data_2yl1_qFit
_cell.length_a                    53.009
_cell.length_b                    53.009
_cell.length_c                    181.114
_cell.angle_alpha                 90.000
_cell.angle_beta                  90.000
_cell.angle_gamma                 120.000
_cell.volume                      440739.378
_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     10.22
_refine.pdbx_refine_id            'X-RAY DIFFRACTION'
_refine.ls_d_res_low              32.24
_refine.ls_d_res_high             1.03
_refine.pdbx_ls_sigma_F           1.33
_refine.ls_percent_reflns_obs     99.92
_refine.ls_number_reflns_obs      75432
_refine.ls_number_reflns_R_work   73432
_refine.ls_number_reflns_R_free   2000
_refine.ls_R_factor_obs           0.1869
_refine.ls_R_factor_R_work        0.1865
_refine.ls_R_factor_R_free        0.2057
_refine.ls_percent_reflns_R_free  2.65
_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             0.1028
_refine.pdbx_overall_phase_error  24.3970
_refine.pdbx_stereochemistry_target_values 'GeoStd + Monomer Library + CDL v1.2'
_refine.B_iso_mean                14.42
_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 1534 0.0131 ? ?
   'X-RAY DIFFRACTION' f_angle_d 2114 1.1766 ? ?
   'X-RAY DIFFRACTION' f_chiral_restr 216 0.0808 ? ?
   'X-RAY DIFFRACTION' f_plane_restr 279 0.0103 ? ?
   'X-RAY DIFFRACTION' f_dihedral_angle_d 572 14.0162 ? ?

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' 2.48 32.24 5725 0.1781 99.86 0.2107 156
   'X-RAY DIFFRACTION' 1.97 2.48 5382 0.1680 99.80 0.1772 147
   'X-RAY DIFFRACTION' 1.72 1.97 5316 0.1760 99.95 0.1683 144
   'X-RAY DIFFRACTION' 1.56 1.72 5263 0.1708 99.98 0.1874 144
   'X-RAY DIFFRACTION' 1.45 1.56 5253 0.1724 99.98 0.2011 143
   'X-RAY DIFFRACTION' 1.37 1.45 5213 0.1818 99.91 0.2104 142
   'X-RAY DIFFRACTION' 1.30 1.37 5194 0.1902 99.98 0.1944 141
   'X-RAY DIFFRACTION' 1.24 1.30 5173 0.1945 99.91 0.2122 141
   'X-RAY DIFFRACTION' 1.19 1.24 5185 0.2126 99.91 0.2651 141
   'X-RAY DIFFRACTION' 1.15 1.19 5140 0.2134 99.96 0.2398 140
   'X-RAY DIFFRACTION' 1.12 1.15 5181 0.2304 99.96 0.2429 141
   'X-RAY DIFFRACTION' 1.08 1.12 5140 0.2458 99.96 0.2541 140
   'X-RAY DIFFRACTION' 1.06 1.08 5124 0.2679 99.98 0.2505 140
   'X-RAY DIFFRACTION' 1.03 1.06 5143 0.3056 99.70 0.3213 140

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 126 C . 'Bond created based on atom type and distance.'
   C00002 covale CYS A 116 SG CYS A 115 SG . HEC A 128 CAB HEC B . CAB . 'Bond created based on atom type and distance.'
   C00003 covale CYS A 116 SG CYS A 115 SG . HEC A 128 CAB HEC B . CAB . 'Bond created based on atom type and distance.'
   C00004 covale CYS A 119 SG CYS A 118 SG . HEC A 128 CAC HEC B . CAC . 'Bond created based on atom type and distance.'
   C00005 covale CYS A 119 SG CYS A 118 SG . HEC A 128 CAC HEC B . CAC . 'Bond created based on atom type and distance.'
   C00006 covale HEC A 128 FE HEC B . FE . CMO A 129 O CMO C . O . '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.
;
 .
   H . . 0.53795 0.34799 0.11320 . 10.08003 29.74760 2.57510 . 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 ? 32.08491 -8.29102 2.76712 1.000 9.78992 N ? A ? 1 N 1
   ATOM 2 CA . PHE A 2 ? 33.12989 -9.20765 3.16788 1.000 10.63566 C ? A ? 1 CA 1
   ATOM 3 C . PHE A 2 ? 34.38396 -8.87635 2.37938 1.000 12.17714 C ? A ? 1 C 1
   ATOM 4 O . PHE A 2 ? 34.35109 -8.83997 1.15361 1.000 12.50546 O ? A ? 1 O 1
   ATOM 5 HA . PHE A 2 ? 33.33018 -9.13155 4.11392 1.000 12.73949 H ? A ? 1 HA 1
   ATOM 6 CB A PHE A 2 ? 32.67403 -10.66633 2.93891 0.498 11.81584 C ? A ? 1 CB 1
   ATOM 7 CG A PHE A 2 ? 31.38815 -11.00592 3.62573 0.498 11.04028 C ? A ? 1 CG 1
   ATOM 8 CD1 A PHE A 2 ? 31.29951 -10.92332 5.00098 0.498 9.00969 C ? A ? 1 CD1 1
   ATOM 9 CD2 A PHE A 2 ? 30.27773 -11.36062 2.89620 0.498 9.86723 C ? A ? 1 CD2 1
   ATOM 10 CE1 A PHE A 2 ? 30.11845 -11.19317 5.66680 0.498 11.25653 C ? A ? 1 CE1 1
   ATOM 11 CE2 A PHE A 2 ? 29.06886 -11.63717 3.54222 0.498 10.66909 C ? A ? 1 CE2 1
   ATOM 12 CZ A PHE A 2 ? 29.00461 -11.56084 4.93376 0.498 9.07431 C ? A ? 1 CZ 1
   ATOM 13 HB2 A PHE A 2 ? 32.54932 -10.80928 1.98764 0.498 14.15571 H ? A ? 1 HB2 1
   ATOM 14 HB3 A PHE A 2 ? 33.35844 -11.26459 3.27738 0.498 14.15571 H ? A ? 1 HB3 1
   ATOM 15 HD1 A PHE A 2 ? 32.05182 -10.68051 5.49085 0.498 10.78833 H ? A ? 1 HD1 1
   ATOM 16 HD2 A PHE A 2 ? 30.33101 -11.41678 1.96943 0.498 11.81738 H ? A ? 1 HD2 1
   ATOM 17 HE1 A PHE A 2 ? 30.07350 -11.12849 6.59346 0.498 13.48454 H ? A ? 1 HE1 1
   ATOM 18 HE2 A PHE A 2 ? 28.31530 -11.86963 3.04926 0.498 12.77960 H ? A ? 1 HE2 1
   ATOM 19 HZ A PHE A 2 ? 28.20802 -11.75838 5.37117 0.498 10.86587 H ? A ? 1 HZ 1
   ATOM 20 CB B PHE A 2 ? 32.63108 -10.64418 2.98893 0.502 11.93198 C ? A ? 1 CB 1
   ATOM 21 CG B PHE A 2 ? 31.43502 -10.94771 3.82756 0.502 8.78734 C ? A ? 1 CG 1
   ATOM 22 CD1 B PHE A 2 ? 31.47489 -10.78192 5.20251 0.502 10.08979 C ? A ? 1 CD1 1
   ATOM 23 CD2 B PHE A 2 ? 30.25333 -11.33735 3.22585 0.502 10.67976 C ? A ? 1 CD2 1
   ATOM 24 CE1 B PHE A 2 ? 30.35564 -11.03104 5.98672 0.502 9.54443 C ? A ? 1 CE1 1
   ATOM 25 CE2 B PHE A 2 ? 29.14093 -11.59310 3.99267 0.502 9.10205 C ? A ? 1 CE2 1
   ATOM 26 CZ B PHE A 2 ? 29.19307 -11.43878 5.37261 0.502 9.67391 C ? A ? 1 CZ 1
   ATOM 27 HB2 B PHE A 2 ? 32.38899 -10.78103 2.05965 0.502 14.29508 H ? A ? 1 HB2 1
   ATOM 28 HB3 B PHE A 2 ? 33.33855 -11.25794 3.24130 0.502 14.29508 H ? A ? 1 HB3 1
   ATOM 29 HD1 B PHE A 2 ? 32.26335 -10.49943 5.60679 0.502 12.08444 H ? A ? 1 HD1 1
   ATOM 30 HD2 B PHE A 2 ? 30.21049 -11.42669 2.30114 0.502 12.79242 H ? A ? 1 HD2 1
   ATOM 31 HE1 B PHE A 2 ? 30.39111 -10.92429 6.90989 0.502 11.43002 H ? A ? 1 HE1 1
   ATOM 32 HE2 B PHE A 2 ? 28.35147 -11.87012 3.58657 0.502 10.89915 H ? A ? 1 HE2 1
   ATOM 33 HZ B PHE A 2 ? 28.43675 -11.61230 5.88523 0.502 11.58539 H ? A ? 1 HZ 1
   ATOM 34 N . ALA A 3 ? 35.45682 -8.56763 3.10713 1.000 11.52091 N ? A ? 2 N 1
   ATOM 35 CA . ALA A 3 ? 36.68191 -8.14571 2.44084 1.000 14.88910 C ? A ? 2 CA 1
   ATOM 36 C . ALA A 3 ? 37.27459 -9.28385 1.62168 1.000 15.51739 C ? A ? 2 C 1
   ATOM 37 O . ALA A 3 ? 37.83695 -9.04993 0.53470 1.000 18.07612 O ? A ? 2 O 1
   ATOM 38 CB . ALA A 3 ? 37.66126 -7.59264 3.46692 1.000 17.11235 C ? A ? 2 CB 1
   ATOM 39 H . ALA A 3 ? 35.49887 -8.59400 3.96570 1.000 13.80179 H ? A ? 2 H 1
   ATOM 40 HA . ALA A 3 ? 36.49054 -7.42464 1.82089 1.000 17.84362 H ? A ? 2 HA 1
   ATOM 41 HB1 . ALA A 3 ? 38.46571 -7.30064 3.01030 1.000 20.51153 H ? A ? 2 HB1 1
   ATOM 42 HB2 . ALA A 3 ? 37.24967 -6.84264 3.92409 1.000 20.51153 H ? A ? 2 HB2 1
   ATOM 43 HB3 . ALA A 3 ? 37.87785 -8.29047 4.10491 1.000 20.51153 H ? A ? 2 HB3 1
   ATOM 44 N . LYS A 4 ? 37.17369 -10.50147 2.12674 1.000 14.68869 N ? A ? 3 N 1
   ATOM 45 CA . LYS A 4 ? 37.69038 -11.69444 1.47495 1.000 14.78434 C ? A ? 3 CA 1
   ATOM 46 C . LYS A 4 ? 36.65817 -12.79865 1.64702 1.000 14.08138 C ? A ? 3 C 1
   ATOM 47 O . LYS A 4 ? 35.85207 -12.73889 2.56600 1.000 13.65303 O ? A ? 3 O 1
   ATOM 48 H . LYS A 4 ? 36.79331 -10.67046 2.87931 1.000 17.60313 H ? A ? 3 H 1
   ATOM 49 HA . LYS A 4 ? 37.84669 -11.51391 0.53480 1.000 17.71791 H ? A ? 3 HA 1
   ATOM 50 CB A LYS A 4 ? 38.99247 -12.17019 2.13320 0.508 17.37619 C ? A ? 3 CB 1
   ATOM 51 CG A LYS A 4 ? 40.03164 -11.10418 2.37072 0.508 21.56778 C ? A ? 3 CG 1
   ATOM 52 CD A LYS A 4 ? 41.39219 -11.72706 2.70998 0.508 29.19666 C ? A ? 3 CD 1
   ATOM 53 CE A LYS A 4 ? 41.28579 -12.78713 3.79919 0.508 30.69899 C ? A ? 3 CE 1
   ATOM 54 NZ A LYS A 4 ? 40.86396 -12.23883 5.12720 0.508 35.72232 N ? A ? 3 NZ 1
   ATOM 55 HB2 A LYS A 4 ? 38.77398 -12.55656 2.99568 0.508 20.82813 H ? A ? 3 HB2 1
   ATOM 56 HB3 A LYS A 4 ? 39.39490 -12.84217 1.56100 0.508 20.82813 H ? A ? 3 HB3 1
   ATOM 57 HG2 A LYS A 4 ? 40.13164 -10.56633 1.56971 0.508 25.85803 H ? A ? 3 HG2 1
   ATOM 58 HG3 A LYS A 4 ? 39.75651 -10.54470 3.11381 0.508 25.85803 H ? A ? 3 HG3 1
   ATOM 59 HD2 A LYS A 4 ? 41.75740 -12.14660 1.91531 0.508 35.01269 H ? A ? 3 HD2 1
   ATOM 60 HD3 A LYS A 4 ? 41.99154 -11.03169 3.02327 0.508 35.01269 H ? A ? 3 HD3 1
   ATOM 61 HE2 A LYS A 4 ? 40.62965 -13.44872 3.52961 0.508 36.81549 H ? A ? 3 HE2 1
   ATOM 62 HE3 A LYS A 4 ? 42.15266 -13.20705 3.91359 0.508 36.81549 H ? A ? 3 HE3 1
   ATOM 63 HZ1 A LYS A 4 ? 40.83592 -12.89194 5.73116 0.508 42.84349 H ? A ? 3 HZ1 1
   ATOM 64 HZ2 A LYS A 4 ? 41.44251 -11.61929 5.39840 0.508 42.84349 H ? A ? 3 HZ2 1
   ATOM 65 HZ3 A LYS A 4 ? 40.05621 -11.87090 5.06194 0.508 42.84349 H ? A ? 3 HZ3 1
   ATOM 66 CB B LYS A 4 ? 39.01095 -12.14341 2.11116 0.492 17.38040 C ? A ? 3 CB 1
   ATOM 67 CG B LYS A 4 ? 40.11217 -11.14807 1.90128 0.492 18.28307 C ? A ? 3 CG 1
   ATOM 68 CD B LYS A 4 ? 41.44254 -11.63000 2.43224 0.492 28.67734 C ? A ? 3 CD 1
   ATOM 69 CE B LYS A 4 ? 42.49552 -10.52629 2.30674 0.492 22.10521 C ? A ? 3 CE 1
   ATOM 70 NZ B LYS A 4 ? 42.59270 -10.00267 0.88550 0.492 29.51245 N ? A ? 3 NZ 1
   ATOM 71 HB2 B LYS A 4 ? 38.88157 -12.25396 3.06611 0.492 20.83318 H ? A ? 3 HB2 1
   ATOM 72 HB3 B LYS A 4 ? 39.28454 -12.98494 1.71382 0.492 20.83318 H ? A ? 3 HB3 1
   ATOM 73 HG2 B LYS A 4 ? 40.21136 -10.98111 0.95091 0.492 21.91638 H ? A ? 3 HG2 1
   ATOM 74 HG3 B LYS A 4 ? 39.88648 -10.32432 2.36105 0.492 21.91638 H ? A ? 3 HG3 1
   ATOM 75 HD2 B LYS A 4 ? 41.35297 -11.86788 3.36835 0.492 34.38951 H ? A ? 3 HD2 1
   ATOM 76 HD3 B LYS A 4 ? 41.73792 -12.39970 1.92114 0.492 34.38951 H ? A ? 3 HD3 1
   ATOM 77 HE2 B LYS A 4 ? 42.25583 -9.78727 2.88751 0.492 26.50296 H ? A ? 3 HE2 1
   ATOM 78 HE3 B LYS A 4 ? 43.36231 -10.88007 2.56055 0.492 26.50296 H ? A ? 3 HE3 1
   ATOM 79 HZ1 B LYS A 4 ? 43.26107 -9.41849 0.82136 0.492 35.39163 H ? A ? 3 HZ1 1
   ATOM 80 HZ2 B LYS A 4 ? 42.74233 -10.67570 0.32270 0.492 35.39163 H ? A ? 3 HZ2 1
   ATOM 81 HZ3 B LYS A 4 ? 41.83316 -9.59877 0.65731 0.492 35.39163 H ? A ? 3 HZ3 1
   ATOM 82 N A PRO A 5 ? 36.71236 -13.84467 0.82240 0.103 16.67677 N ? A ? 4 N 1
   ATOM 83 CA A PRO A 5 ? 35.72328 -14.93249 0.98365 0.103 16.70188 C ? A ? 4 CA 1
   ATOM 84 C A PRO A 5 ? 35.77957 -15.63228 2.33292 0.103 11.27251 C ? A ? 4 C 1
   ATOM 85 O A PRO A 5 ? 34.77678 -16.20172 2.77194 0.103 11.05471 O ? A ? 4 O 1
   ATOM 86 CB A PRO A 5 ? 36.03076 -15.88618 -0.18013 0.103 19.79827 C ? A ? 4 CB 1
   ATOM 87 CG A PRO A 5 ? 37.45288 -15.54596 -0.60579 0.103 19.85243 C ? A ? 4 CG 1
   ATOM 88 CD A PRO A 5 ? 37.58992 -14.05497 -0.34030 0.103 17.74407 C ? A ? 4 CD 1
   ATOM 89 HA A PRO A 5 ? 34.83163 -14.57112 0.86008 0.103 20.01896 H ? A ? 4 HA 1
   ATOM 90 HB2 A PRO A 5 ? 35.96979 -16.80585 0.12216 0.103 23.73463 H ? A ? 4 HB2 1
   ATOM 91 HB3 A PRO A 5 ? 35.40553 -15.73334 -0.90582 0.103 23.73463 H ? A ? 4 HB3 1
   ATOM 92 HG2 A PRO A 5 ? 38.08791 -16.05315 -0.07626 0.103 23.79962 H ? A ? 4 HG2 1
   ATOM 93 HG3 A PRO A 5 ? 37.57349 -15.74386 -1.54770 0.103 23.79962 H ? A ? 4 HG3 1
   ATOM 94 HD2 A PRO A 5 ? 38.50773 -13.82375 -0.12800 0.103 21.26958 H ? A ? 4 HD2 1
   ATOM 95 HD3 A PRO A 5 ? 37.28529 -13.53789 -1.10236 0.103 21.26958 H ? A ? 4 HD3 1
   ATOM 96 N B PRO A 5 ? 36.70083 -13.82630 0.81405 0.897 17.25464 N ? A ? 4 N 1
   ATOM 97 CA B PRO A 5 ? 35.74242 -14.93749 0.97590 0.897 17.17854 C ? A ? 4 CA 1
   ATOM 98 C B PRO A 5 ? 35.75902 -15.55526 2.36449 0.897 10.89904 C ? A ? 4 C 1
   ATOM 99 O B PRO A 5 ? 34.69160 -15.92162 2.88523 0.897 12.02421 O ? A ? 4 O 1
   ATOM 100 CB B PRO A 5 ? 36.14628 -15.94314 -0.11475 0.897 20.52388 C ? A ? 4 CB 1
   ATOM 101 CG B PRO A 5 ? 37.29607 -15.29884 -0.89358 0.897 22.11402 C ? A ? 4 CG 1
   ATOM 102 CD B PRO A 5 ? 37.38427 -13.84411 -0.48309 0.897 23.30608 C ? A ? 4 CD 1
   ATOM 103 HA B PRO A 5 ? 34.84634 -14.62202 0.77986 0.897 20.59095 H ? A ? 4 HA 1
   ATOM 104 HB2 B PRO A 5 ? 36.43545 -16.77147 0.29895 0.897 24.60536 H ? A ? 4 HB2 1
   ATOM 105 HB3 B PRO A 5 ? 35.38951 -16.11018 -0.69811 0.897 24.60536 H ? A ? 4 HB3 1
   ATOM 106 HG2 B PRO A 5 ? 38.12271 -15.75861 -0.67871 0.897 26.51353 H ? A ? 4 HG2 1
   ATOM 107 HG3 B PRO A 5 ? 37.11493 -15.36871 -1.84395 0.897 26.51353 H ? A ? 4 HG3 1
   ATOM 108 HD2 B PRO A 5 ? 38.30883 -13.56540 -0.39145 0.897 27.94400 H ? A ? 4 HD2 1
   ATOM 109 HD3 B PRO A 5 ? 36.92816 -13.27530 -1.12288 0.897 27.94400 H ? A ? 4 HD3 1
   ATOM 110 N . GLU A 6 ? 36.92171 -15.61694 3.00885 1.000 12.39427 N ? A ? 5 N 1
   ATOM 111 CA . GLU A 6 ? 37.00690 -16.15466 4.35972 1.000 10.49821 C ? A ? 5 CA 1
   ATOM 112 C . GLU A 6 ? 36.10588 -15.41516 5.33322 1.000 11.02780 C ? A ? 5 C 1
   ATOM 113 O . GLU A 6 ? 35.64289 -16.01819 6.30991 1.000 10.29290 O ? A ? 5 O 1
   ATOM 114 CB . GLU A 6 ? 38.44820 -16.09107 4.86326 1.000 11.33824 C ? A ? 5 CB 1
   ATOM 115 CG . GLU A 6 ? 39.43429 -17.08890 4.26438 1.000 13.59535 C ? A ? 5 CG 1
   ATOM 116 CD . GLU A 6 ? 39.96645 -16.72241 2.89256 1.000 13.21386 C ? A ? 5 CD 1
   ATOM 117 OE1 . GLU A 6 ? 39.60215 -15.70420 2.30133 1.000 14.98263 O ? A ? 5 OE1 1
   ATOM 118 OE2 . GLU A 6 ? 40.83772 -17.51821 2.40228 1.000 13.89555 O ? A ? 5 OE2 1
   ATOM 119 HA . GLU A 6 ? 36.72419 -17.08196 4.32683 1.000 12.57455 H ? A ? 5 HA 1
   ATOM 120 HB2 . GLU A 6 ? 38.79290 -15.20456 4.67305 1.000 13.58259 H ? A ? 5 HB2 1
   ATOM 121 HB3 . GLU A 6 ? 38.43773 -16.24452 5.82098 1.000 13.58259 H ? A ? 5 HB3 1
   ATOM 122 HG2 . GLU A 6 ? 40.19590 -17.16345 4.86045 1.000 16.29112 H ? A ? 5 HG2 1
   ATOM 123 HG3 . GLU A 6 ? 38.99099 -17.94788 4.18348 1.000 16.29112 H ? A ? 5 HG3 1
   ATOM 124 H A GLU A 6 ? 37.66308 -15.30084 2.70876 0.103 14.84983 H ? A ? 5 H 1
   ATOM 125 H B GLU A 6 ? 37.67435 -15.35428 2.68612 0.897 14.84983 H ? A ? 5 H 1
   ATOM 126 N . ASP A 7 ? 35.90362 -14.11652 5.12882 1.000 9.34294 N ? A ? 6 N 1
   ATOM 127 CA . ASP A 7 ? 35.03039 -13.36663 6.02589 1.000 10.24504 C ? A ? 6 CA 1
   ATOM 128 C . ASP A 7 ? 33.56392 -13.77078 5.84714 1.000 8.73575 C ? A ? 6 C 1
   ATOM 129 O . ASP A 7 ? 32.81340 -13.77358 6.81812 1.000 9.43077 O ? A ? 6 O 1
   ATOM 130 CB . ASP A 7 ? 35.22751 -11.87644 5.78617 1.000 9.76141 C ? A ? 6 CB 1
   ATOM 131 CG . ASP A 7 ? 36.67210 -11.43626 6.00519 1.000 12.03714 C ? A ? 6 CG 1
   ATOM 132 OD1 . ASP A 7 ? 37.20334 -11.74878 7.05938 1.000 14.83174 O ? A ? 6 OD1 1
   ATOM 133 OD2 . ASP A 7 ? 37.26192 -10.79541 5.09911 1.000 16.03041 O ? A ? 6 OD2 1
   ATOM 134 H . ASP A 7 ? 36.25207 -13.65517 4.49216 1.000 11.18823 H ? A ? 6 H 1
   ATOM 135 HA . ASP A 7 ? 35.26728 -13.55324 6.94782 1.000 12.27075 H ? A ? 6 HA 1
   ATOM 136 HB2 . ASP A 7 ? 34.98464 -11.66764 4.87058 1.000 11.69039 H ? A ? 6 HB2 1
   ATOM 137 HB3 . ASP A 7 ? 34.66484 -11.37926 6.40028 1.000 11.69039 H ? A ? 6 HB3 1
   ATOM 138 N . ALA A 8 ? 33.16567 -14.10400 4.62378 1.000 8.69249 N ? A ? 7 N 1
   ATOM 139 CA . ALA A 8 ? 31.81669 -14.60063 4.37181 1.000 9.09058 C ? A ? 7 CA 1
   ATOM 140 C . ALA A 8 ? 31.61974 -15.95339 5.00868 1.000 9.12146 C ? A ? 7 C 1
   ATOM 141 O . ALA A 8 ? 30.56082 -16.21862 5.59517 1.000 8.14328 O ? A ? 7 O 1
   ATOM 142 CB . ALA A 8 ? 31.55531 -14.64785 2.87502 1.000 9.26340 C ? A ? 7 CB 1
   ATOM 143 H . ALA A 8 ? 33.65694 -14.05237 3.91980 1.000 10.40769 H ? A ? 7 H 1
   ATOM 144 HA . ALA A 8 ? 31.16782 -13.99316 4.76022 1.000 10.88540 H ? A ? 7 HA 1
   ATOM 145 HB1 . ALA A 8 ? 30.64858 -14.95677 2.72237 1.000 11.09278 H ? A ? 7 HB1 1
   ATOM 146 HB2 . ALA A 8 ? 31.66793 -13.75766 2.50654 1.000 11.09278 H ? A ? 7 HB2 1
   ATOM 147 HB3 . ALA A 8 ? 32.18654 -15.25855 2.46333 1.000 11.09278 H ? A ? 7 HB3 1
   ATOM 148 N A VAL A 9 ? 32.62275 -16.82842 4.91160 0.064 8.34143 N ? A ? 8 N 1
   ATOM 149 CA A VAL A 9 ? 32.53645 -18.13962 5.54949 0.064 7.94923 C ? A ? 8 CA 1
   ATOM 150 C A VAL A 9 ? 32.40922 -17.98639 7.05950 0.064 8.77604 C ? A ? 8 C 1
   ATOM 151 O A VAL A 9 ? 31.56911 -18.62927 7.70138 0.064 8.63311 O ? A ? 8 O 1
   ATOM 152 CB A VAL A 9 ? 33.75532 -19.00197 5.17197 0.064 8.82522 C ? A ? 8 CB 1
   ATOM 153 CG1 A VAL A 9 ? 33.77391 -20.28929 5.99228 0.064 8.41017 C ? A ? 8 CG1 1
   ATOM 154 CG2 A VAL A 9 ? 33.75697 -19.30781 3.68018 0.064 9.24532 C ? A ? 8 CG2 1
   ATOM 155 H A VAL A 9 ? 33.35671 -16.68784 4.48599 0.064 9.98641 H ? A ? 8 H 1
   ATOM 156 HA A VAL A 9 ? 31.73938 -18.58750 5.22548 0.064 9.51578 H ? A ? 8 HA 1
   ATOM 157 HB A VAL A 9 ? 34.56421 -18.50610 5.37375 0.064 10.56697 H ? A ? 8 HB 1
   ATOM 158 HG11 A VAL A 9 ? 34.38077 -20.92075 5.57528 0.064 10.06891 H ? A ? 8 HG11 1
   ATOM 159 HG12 A VAL A 9 ? 34.07463 -20.08622 6.89185 0.064 10.06891 H ? A ? 8 HG12 1
   ATOM 160 HG13 A VAL A 9 ? 32.87786 -20.65983 6.01880 0.064 10.06891 H ? A ? 8 HG13 1
   ATOM 161 HG21 A VAL A 9 ? 34.57875 -19.77067 3.45361 0.064 11.07108 H ? A ? 8 HG21 1
   ATOM 162 HG22 A VAL A 9 ? 32.99331 -19.86848 3.47191 0.064 11.07108 H ? A ? 8 HG22 1
   ATOM 163 HG23 A VAL A 9 ? 33.69986 -18.47454 3.18691 0.064 11.07108 H ? A ? 8 HG23 1
   ATOM 164 N B VAL A 9 ? 32.60191 -16.83035 4.85471 0.494 8.31993 N ? A ? 8 N 1
   ATOM 165 CA B VAL A 9 ? 32.54549 -18.13492 5.48892 0.494 8.12350 C ? A ? 8 CA 1
   ATOM 166 C B VAL A 9 ? 32.42874 -17.98423 7.00190 0.494 8.62199 C ? A ? 8 C 1
   ATOM 167 O B VAL A 9 ? 31.57412 -18.62012 7.64091 0.494 8.66461 O ? A ? 8 O 1
   ATOM 168 CB B VAL A 9 ? 33.76703 -18.96741 5.06168 0.494 8.55127 C ? A ? 8 CB 1
   ATOM 169 CG1 B VAL A 9 ? 33.67365 -20.35304 5.66779 0.494 8.89535 C ? A ? 8 CG1 1
   ATOM 170 CG2 B VAL A 9 ? 33.86147 -19.05299 3.53554 0.494 9.97114 C ? A ? 8 CG2 1
   ATOM 171 H B VAL A 9 ? 33.31136 -16.69393 4.38816 0.494 9.96061 H ? A ? 8 H 1
   ATOM 172 HA B VAL A 9 ? 31.75072 -18.60691 5.19487 0.494 9.72490 H ? A ? 8 HA 1
   ATOM 173 HB B VAL A 9 ? 34.57511 -18.53708 5.38218 0.494 10.23823 H ? A ? 8 HB 1
   ATOM 174 HG11 B VAL A 9 ? 34.34978 -20.92011 5.26508 0.494 10.65113 H ? A ? 8 HG11 1
   ATOM 175 HG12 B VAL A 9 ? 33.82176 -20.28995 6.62434 0.494 10.65113 H ? A ? 8 HG12 1
   ATOM 176 HG13 B VAL A 9 ? 32.79103 -20.71540 5.49293 0.494 10.65113 H ? A ? 8 HG13 1
   ATOM 177 HG21 B VAL A 9 ? 34.53603 -19.70799 3.29712 0.494 11.94206 H ? A ? 8 HG21 1
   ATOM 178 HG22 B VAL A 9 ? 32.99966 -19.32139 3.18036 0.494 11.94206 H ? A ? 8 HG22 1
   ATOM 179 HG23 B VAL A 9 ? 34.10714 -18.18254 3.18503 0.494 11.94206 H ? A ? 8 HG23 1
   ATOM 180 N C VAL A 9 ? 32.62949 -16.83428 4.92495 0.442 8.22755 N ? A ? 8 N 1
   ATOM 181 CA C VAL A 9 ? 32.55155 -18.14229 5.57880 0.442 7.62133 C ? A ? 8 CA 1
   ATOM 182 C C VAL A 9 ? 32.39147 -17.97434 7.07988 0.442 8.89874 C ? A ? 8 C 1
   ATOM 183 O C VAL A 9 ? 31.54439 -18.62413 7.71443 0.442 8.62573 O ? A ? 8 O 1
   ATOM 184 CB C VAL A 9 ? 33.79449 -18.99577 5.25382 0.442 8.79847 C ? A ? 8 CB 1
   ATOM 185 CG1 C VAL A 9 ? 33.82069 -20.24160 6.16692 0.442 7.16292 C ? A ? 8 CG1 1
   ATOM 186 CG2 C VAL A 9 ? 33.83834 -19.38356 3.78665 0.442 7.55462 C ? A ? 8 CG2 1
   ATOM 187 H C VAL A 9 ? 33.36344 -16.69698 4.49825 0.442 9.84976 H ? A ? 8 H 1
   ATOM 188 HA C VAL A 9 ? 31.77021 -18.60162 5.23323 0.442 9.12230 H ? A ? 8 HA 1
   ATOM 189 HB C VAL A 9 ? 34.59176 -18.47007 5.42379 0.442 10.53487 H ? A ? 8 HB 1
   ATOM 190 HG11 C VAL A 9 ? 34.43619 -20.89268 5.79522 0.442 8.57220 H ? A ? 8 HG11 1
   ATOM 191 HG12 C VAL A 9 ? 34.11383 -19.97756 7.05306 0.442 8.57220 H ? A ? 8 HG12 1
   ATOM 192 HG13 C VAL A 9 ? 32.92811 -20.61860 6.21245 0.442 8.57220 H ? A ? 8 HG13 1
   ATOM 193 HG21 C VAL A 9 ? 34.69017 -19.80717 3.59730 0.442 9.04224 H ? A ? 8 HG21 1
   ATOM 194 HG22 C VAL A 9 ? 33.11348 -20.00094 3.60138 0.442 9.04224 H ? A ? 8 HG22 1
   ATOM 195 HG23 C VAL A 9 ? 33.73875 -18.58459 3.24571 0.442 9.04224 H ? A ? 8 HG23 1
   ATOM 196 N A LYS A 10 ? 33.25639 -17.14205 7.65153 0.064 8.58394 N ? A ? 9 N 1
   ATOM 197 CA A LYS A 10 ? 33.20257 -16.91708 9.09396 0.064 8.58349 C ? A ? 9 CA 1
   ATOM 198 C A LYS A 10 ? 31.84736 -16.36139 9.51125 0.064 8.96990 C ? A ? 9 C 1
   ATOM 199 O A LYS A 10 ? 31.30495 -16.73940 10.55240 0.064 8.38909 O ? A ? 9 O 1
   ATOM 200 CB A LYS A 10 ? 34.33163 -15.96792 9.49800 0.064 11.19992 C ? A ? 9 CB 1
   ATOM 201 CG A LYS A 10 ? 34.43201 -15.63318 10.98469 0.064 12.63652 C ? A ? 9 CG 1
   ATOM 202 CD A LYS A 10 ? 35.78132 -14.98012 11.26999 0.064 18.29262 C ? A ? 9 CD 1
   ATOM 203 CE A LYS A 10 ? 35.81090 -14.29787 12.62348 0.064 14.86308 C ? A ? 9 CE 1
   ATOM 204 NZ A LYS A 10 ? 37.21507 -13.89129 13.00823 0.064 18.80348 N ? A ? 9 NZ 1
   ATOM 205 H A LYS A 10 ? 33.86549 -16.69178 7.24429 0.064 10.27742 H ? A ? 9 H 1
   ATOM 206 HA A LYS A 10 ? 33.33040 -17.75820 9.55988 0.064 10.27688 H ? A ? 9 HA 1
   ATOM 207 HB2 A LYS A 10 ? 35.17413 -16.37287 9.23893 0.064 13.41661 H ? A ? 9 HB2 1
   ATOM 208 HB3 A LYS A 10 ? 34.20652 -15.13061 9.02456 0.064 13.41661 H ? A ? 9 HB3 1
   ATOM 209 HG2 A LYS A 10 ? 33.72644 -15.01476 11.23091 0.064 15.14052 H ? A ? 9 HG2 1
   ATOM 210 HG3 A LYS A 10 ? 34.35973 -16.44526 11.51024 0.064 15.14052 H ? A ? 9 HG3 1
   ATOM 211 HD2 A LYS A 10 ? 36.47324 -15.65984 11.25904 0.064 21.92785 H ? A ? 9 HD2 1
   ATOM 212 HD3 A LYS A 10 ? 35.96208 -14.31173 10.59067 0.064 21.92785 H ? A ? 9 HD3 1
   ATOM 213 HE2 A LYS A 10 ? 35.25983 -13.50018 12.59314 0.064 17.81239 H ? A ? 9 HE2 1
   ATOM 214 HE3 A LYS A 10 ? 35.47433 -14.90814 13.29816 0.064 17.81239 H ? A ? 9 HE3 1
   ATOM 215 HZ1 A LYS A 10 ? 37.21877 -13.55028 13.83030 0.064 22.54088 H ? A ? 9 HZ1 1
   ATOM 216 HZ2 A LYS A 10 ? 37.75368 -14.59949 12.98688 0.064 22.54088 H ? A ? 9 HZ2 1
   ATOM 217 HZ3 A LYS A 10 ? 37.52104 -13.27847 12.43995 0.064 22.54088 H ? A ? 9 HZ3 1
   ATOM 218 N B LYS A 10 ? 33.27447 -17.13842 7.60203 0.494 8.65713 N ? A ? 9 N 1
   ATOM 219 CA B LYS A 10 ? 33.20025 -16.91123 9.04193 0.494 8.30573 C ? A ? 9 CA 1
   ATOM 220 C B LYS A 10 ? 31.80577 -16.44494 9.43276 0.494 8.73792 C ? A ? 9 C 1
   ATOM 221 O B LYS A 10 ? 31.21220 -16.93858 10.39776 0.494 9.40120 O ? A ? 9 O 1
   ATOM 222 CB B LYS A 10 ? 34.23692 -15.87791 9.48424 0.494 12.58256 C ? A ? 9 CB 1
   ATOM 223 CG B LYS A 10 ? 35.65612 -16.39270 9.50676 0.494 11.20737 C ? A ? 9 CG 1
   ATOM 224 CD B LYS A 10 ? 36.63540 -15.26959 9.65326 0.494 15.79074 C ? A ? 9 CD 1
   ATOM 225 CE B LYS A 10 ? 38.04756 -15.79495 9.83087 0.494 20.00909 C ? A ? 9 CE 1
   ATOM 226 NZ B LYS A 10 ? 38.58697 -16.46119 8.58958 0.494 25.06583 N ? A ? 9 NZ 1
   ATOM 227 H B LYS A 10 ? 33.89035 -16.69171 7.20109 0.494 10.36526 H ? A ? 9 H 1
   ATOM 228 HA B LYS A 10 ? 33.40049 -17.74517 9.49507 0.494 9.94358 H ? A ? 9 HA 1
   ATOM 229 HB2 B LYS A 10 ? 34.20646 -15.12664 8.87141 0.494 15.07577 H ? A ? 9 HB2 1
   ATOM 230 HB3 B LYS A 10 ? 34.01695 -15.58303 10.38177 0.494 15.07577 H ? A ? 9 HB3 1
   ATOM 231 HG2 B LYS A 10 ? 35.76836 -16.99695 10.25722 0.494 13.42555 H ? A ? 9 HG2 1
   ATOM 232 HG3 B LYS A 10 ? 35.84425 -16.85688 8.67607 0.494 13.42555 H ? A ? 9 HG3 1
   ATOM 233 HD2 B LYS A 10 ? 36.61243 -14.71553 8.85740 0.494 18.92558 H ? A ? 9 HD2 1
   ATOM 234 HD3 B LYS A 10 ? 36.40510 -14.74024 10.43278 0.494 18.92558 H ? A ? 9 HD3 1
   ATOM 235 HE2 B LYS A 10 ? 38.63426 -15.05482 10.05198 0.494 23.98761 H ? A ? 9 HE2 1
   ATOM 236 HE3 B LYS A 10 ? 38.05343 -16.44851 10.54761 0.494 23.98761 H ? A ? 9 HE3 1
   ATOM 237 HZ1 B LYS A 10 ? 39.41959 -16.74152 8.73193 0.494 30.05570 H ? A ? 9 HZ1 1
   ATOM 238 HZ2 B LYS A 10 ? 38.07972 -17.16009 8.37434 0.494 30.05570 H ? A ? 9 HZ2 1
   ATOM 239 HZ3 B LYS A 10 ? 38.58815 -15.88526 7.91104 0.494 30.05570 H ? A ? 9 HZ3 1
   ATOM 240 N C LYS A 10 ? 33.24138 -17.14089 7.68106 0.442 8.35486 N ? A ? 9 N 1
   ATOM 241 CA C LYS A 10 ? 33.18218 -16.94150 9.12089 0.442 8.65635 C ? A ? 9 CA 1
   ATOM 242 C C LYS A 10 ? 31.82781 -16.37126 9.51848 0.442 9.19713 C ? A ? 9 C 1
   ATOM 243 O C LYS A 10 ? 31.25828 -16.75396 10.54324 0.442 8.13552 O ? A ? 9 O 1
   ATOM 244 CB C LYS A 10 ? 34.32435 -16.04391 9.56638 0.442 9.91588 C ? A ? 9 CB 1
   ATOM 245 CG C LYS A 10 ? 34.38507 -15.73426 11.05386 0.442 12.60682 C ? A ? 9 CG 1
   ATOM 246 CD C LYS A 10 ? 35.65857 -14.97173 11.34395 0.442 17.70975 C ? A ? 9 CD 1
   ATOM 247 CE C LYS A 10 ? 35.59775 -14.18102 12.63827 0.442 13.72213 C ? A ? 9 CE 1
   ATOM 248 NZ C LYS A 10 ? 36.97119 -13.57607 12.97974 0.442 23.42201 N ? A ? 9 NZ 1
   ATOM 249 H C LYS A 10 ? 33.85216 -16.68652 7.28094 0.442 10.00253 H ? A ? 9 H 1
   ATOM 250 HA C LYS A 10 ? 33.29359 -17.78956 9.57836 0.442 10.36432 H ? A ? 9 HA 1
   ATOM 251 HB2 C LYS A 10 ? 35.15986 -16.47570 9.32892 0.442 11.87576 H ? A ? 9 HB2 1
   ATOM 252 HB3 C LYS A 10 ? 34.24430 -15.19710 9.10013 0.442 11.87576 H ? A ? 9 HB3 1
   ATOM 253 HG2 C LYS A 10 ? 33.62507 -15.18855 11.30980 0.442 15.10488 H ? A ? 9 HG2 1
   ATOM 254 HG3 C LYS A 10 ? 34.38791 -16.55927 11.56401 0.442 15.10488 H ? A ? 9 HG3 1
   ATOM 255 HD2 C LYS A 10 ? 36.39371 -15.60075 11.41323 0.442 21.22840 H ? A ? 9 HD2 1
   ATOM 256 HD3 C LYS A 10 ? 35.82356 -14.34698 10.62051 0.442 21.22840 H ? A ? 9 HD3 1
   ATOM 257 HE2 C LYS A 10 ? 34.95806 -13.45780 12.54529 0.442 16.44326 H ? A ? 9 HE2 1
   ATOM 258 HE3 C LYS A 10 ? 35.33180 -14.76801 13.36327 0.442 16.44326 H ? A ? 9 HE3 1
   ATOM 259 HZ1 C LYS A 10 ? 36.92150 -13.11892 13.74174 0.442 28.08312 H ? A ? 9 HZ1 1
   ATOM 260 HZ2 C LYS A 10 ? 37.57502 -14.22360 13.07024 0.442 28.08312 H ? A ? 9 HZ2 1
   ATOM 261 HZ3 C LYS A 10 ? 37.23194 -13.02677 12.32984 0.442 28.08312 H ? A ? 9 HZ3 1
   ATOM 262 N . TYR A 11 ? 31.28110 -15.47373 8.69949 1.000 8.25105 N ? A ? 10 N 1
   ATOM 263 CA . TYR A 11 ? 29.97082 -14.91349 9.00119 1.000 7.95369 C ? A ? 10 CA 1
   ATOM 264 C . TYR A 11 ? 28.89282 -15.97417 8.97120 1.000 7.96130 C ? A ? 10 C 1
   ATOM 265 O . TYR A 11 ? 28.09886 -16.10773 9.92349 1.000 8.10859 O ? A ? 10 O 1
   ATOM 266 CB . TYR A 11 ? 29.66751 -13.77431 8.04060 1.000 7.71769 C ? A ? 10 CB 1
   ATOM 267 CG . TYR A 11 ? 28.31097 -13.15845 8.22112 1.000 8.31035 C ? A ? 10 CG 1
   ATOM 268 CD1 . TYR A 11 ? 27.15740 -13.78685 7.77363 1.000 8.53990 C ? A ? 10 CD1 1
   ATOM 269 CD2 . TYR A 11 ? 28.17034 -11.91289 8.83201 1.000 7.87970 C ? A ? 10 CD2 1
   ATOM 270 CE1 . TYR A 11 ? 25.91991 -13.21855 7.93058 1.000 7.81435 C ? A ? 10 CE1 1
   ATOM 271 CE2 . TYR A 11 ? 26.93376 -11.33465 8.99010 1.000 8.56925 C ? A ? 10 CE2 1
   ATOM 272 CZ . TYR A 11 ? 25.78649 -11.99619 8.53047 1.000 7.54943 C ? A ? 10 CZ 1
   ATOM 273 OH . TYR A 11 ? 24.53547 -11.46273 8.68969 1.000 8.59930 O ? A ? 10 OH 1
   ATOM 274 HA . TYR A 11 ? 29.98106 -14.54765 9.89949 1.000 9.52113 H ? A ? 10 HA 1
   ATOM 275 HB2 . TYR A 11 ? 30.32716 -13.07523 8.17110 1.000 9.23793 H ? A ? 10 HB2 1
   ATOM 276 HB3 . TYR A 11 ? 29.71796 -14.11281 7.13298 1.000 9.23793 H ? A ? 10 HB3 1
   ATOM 277 HD1 . TYR A 11 ? 27.22571 -14.61517 7.35635 1.000 10.22458 H ? A ? 10 HD1 1
   ATOM 278 HD2 . TYR A 11 ? 28.92636 -11.46581 9.13769 1.000 9.43233 H ? A ? 10 HD2 1
   ATOM 279 HE1 . TYR A 11 ? 25.16445 -13.66780 7.62666 1.000 9.35391 H ? A ? 10 HE1 1
   ATOM 280 HE2 . TYR A 11 ? 26.85801 -10.50432 9.40209 1.000 10.25979 H ? A ? 10 HE2 1
   ATOM 281 HH . TYR A 11 ? 24.53295 -10.65866 8.44665 1.000 10.29586 H ? A ? 10 HH 1
   ATOM 282 H A TYR A 11 ? 31.63296 -15.18086 7.97146 0.064 9.87796 H ? A ? 10 H 1
   ATOM 283 H B TYR A 11 ? 31.66582 -15.11892 8.01707 0.494 9.87796 H ? A ? 10 H 1
   ATOM 284 H C TYR A 11 ? 31.64260 -15.17915 7.97690 0.442 9.87796 H ? A ? 10 H 1
   ATOM 285 N A ARG A 12 ? 28.84075 -16.76396 7.91274 0.656 8.05235 N ? A ? 11 N 1
   ATOM 286 CA A ARG A 12 ? 27.72673 -17.69994 7.82882 0.656 7.20217 C ? A ? 11 CA 1
   ATOM 287 C A ARG A 12 ? 27.84510 -18.81357 8.85799 0.656 8.09758 C ? A ? 11 C 1
   ATOM 288 O A ARG A 12 ? 26.82004 -19.27409 9.36682 0.656 8.49318 O ? A ? 11 O 1
   ATOM 289 CB A ARG A 12 ? 27.53533 -18.27210 6.40373 0.656 7.57342 C ? A ? 11 CB 1
   ATOM 290 CG A ARG A 12 ? 28.60535 -19.24342 5.92107 0.656 7.37387 C ? A ? 11 CG 1
   ATOM 291 CD A ARG A 12 ? 28.78508 -19.01681 4.44281 0.656 8.65379 C ? A ? 11 CD 1
   ATOM 292 NE A ARG A 12 ? 29.66697 -19.99958 3.83124 0.656 9.60059 N ? A ? 11 NE 1
   ATOM 293 CZ A ARG A 12 ? 30.26919 -19.84989 2.65828 0.656 8.80129 C ? A ? 11 CZ 1
   ATOM 294 NH1 A ARG A 12 ? 30.11532 -18.74932 1.95535 0.656 8.15011 N ? A ? 11 NH1 1
   ATOM 295 NH2 A ARG A 12 ? 31.04596 -20.83210 2.18482 0.656 9.91340 N ? A ? 11 NH2 1
   ATOM 296 H A ARG A 12 ? 29.40426 -16.78001 7.26328 0.656 9.63952 H ? A ? 11 H 1
   ATOM 297 HA A ARG A 12 ? 26.91781 -17.19898 8.01748 0.656 8.61931 H ? A ? 11 HA 1
   ATOM 298 HB2 A ARG A 12 ? 26.68832 -18.74417 6.37852 0.656 9.06481 H ? A ? 11 HB2 1
   ATOM 299 HB3 A ARG A 12 ? 27.52023 -17.52997 5.77930 0.656 9.06481 H ? A ? 11 HB3 1
   ATOM 300 HG2 A ARG A 12 ? 29.44451 -19.07397 6.37714 0.656 8.82535 H ? A ? 11 HG2 1
   ATOM 301 HG3 A ARG A 12 ? 28.32329 -20.15874 6.07453 0.656 8.82535 H ? A ? 11 HG3 1
   ATOM 302 HD2 A ARG A 12 ? 27.92109 -19.07483 4.00570 0.656 10.36125 H ? A ? 11 HD2 1
   ATOM 303 HD3 A ARG A 12 ? 29.17017 -18.13786 4.30120 0.656 10.36125 H ? A ? 11 HD3 1
   ATOM 304 HE A ARG A 12 ? 29.80817 -20.73077 4.26138 0.656 11.49741 H ? A ? 11 HE 1
   ATOM 305 HH11 A ARG A 12 ? 29.61881 -18.11399 2.25440 0.656 9.75684 H ? A ? 11 HH11 1
   ATOM 306 HH12 A ARG A 12 ? 30.51119 -18.66485 1.19657 0.656 9.75684 H ? A ? 11 HH12 1
   ATOM 307 HH21 A ARG A 12 ? 31.15190 -21.55392 2.64019 0.656 11.87277 H ? A ? 11 HH21 1
   ATOM 308 HH22 A ARG A 12 ? 31.43902 -20.74124 1.42532 0.656 11.87277 H ? A ? 11 HH22 1
   ATOM 309 N C ARG A 12 ? 28.80089 -16.71551 7.86219 0.344 8.37584 N ? A ? 11 N 1
   ATOM 310 CA C ARG A 12 ? 27.68631 -17.64666 7.71728 0.344 7.14880 C ? A ? 11 CA 1
   ATOM 311 C C ARG A 12 ? 27.78513 -18.78784 8.71466 0.344 7.27457 C ? A ? 11 C 1
   ATOM 312 O C ARG A 12 ? 26.75564 -19.30620 9.16755 0.344 7.42612 O ? A ? 11 O 1
   ATOM 313 CB C ARG A 12 ? 27.56321 -18.17043 6.27588 0.344 8.56335 C ? A ? 11 CB 1
   ATOM 314 CG C ARG A 12 ? 28.70309 -19.02215 5.76212 0.344 7.36316 C ? A ? 11 CG 1
   ATOM 315 CD C ARG A 12 ? 28.75498 -18.89426 4.24963 0.344 9.32158 C ? A ? 11 CD 1
   ATOM 316 NE C ARG A 12 ? 29.69753 -19.85199 3.69683 0.344 7.52985 N ? A ? 11 NE 1
   ATOM 317 CZ C ARG A 12 ? 30.21186 -19.79973 2.47542 0.344 8.55214 C ? A ? 11 CZ 1
   ATOM 318 NH1 C ARG A 12 ? 29.89307 -18.83717 1.63468 0.344 11.33832 N ? A ? 11 NH1 1
   ATOM 319 NH2 C ARG A 12 ? 31.10280 -20.71638 2.10624 0.344 9.56218 N ? A ? 11 NH2 1
   ATOM 320 H C ARG A 12 ? 29.35303 -16.69697 7.20310 0.344 10.02771 H ? A ? 11 H 1
   ATOM 321 HA C ARG A 12 ? 26.86431 -17.16319 7.89469 0.344 8.55526 H ? A ? 11 HA 1
   ATOM 322 HB2 C ARG A 12 ? 26.75890 -18.70976 6.22006 0.344 10.25272 H ? A ? 11 HB2 1
   ATOM 323 HB3 C ARG A 12 ? 27.49157 -17.40560 5.68359 0.344 10.25272 H ? A ? 11 HB3 1
   ATOM 324 HG2 C ARG A 12 ? 29.54349 -18.71405 6.13589 0.344 8.81249 H ? A ? 11 HG2 1
   ATOM 325 HG3 C ARG A 12 ? 28.55630 -19.95167 5.99737 0.344 8.81249 H ? A ? 11 HG3 1
   ATOM 326 HD2 C ARG A 12 ? 27.87719 -19.07212 3.87714 0.344 11.16259 H ? A ? 11 HD2 1
   ATOM 327 HD3 C ARG A 12 ? 29.04305 -18.00015 4.00778 0.344 11.16259 H ? A ? 11 HD3 1
   ATOM 328 HE C ARG A 12 ? 29.94117 -20.50431 4.20152 0.344 9.01252 H ? A ? 11 HE 1
   ATOM 329 HH11 C ARG A 12 ? 29.33967 -18.22363 1.87326 0.344 13.58269 H ? A ? 11 HH11 1
   ATOM 330 HH12 C ARG A 12 ? 30.23832 -18.82225 0.84716 0.344 13.58269 H ? A ? 11 HH12 1
   ATOM 331 HH21 C ARG A 12 ? 31.33869 -21.33315 2.65718 0.344 11.45132 H ? A ? 11 HH21 1
   ATOM 332 HH22 C ARG A 12 ? 31.44277 -20.69208 1.31666 0.344 11.45132 H ? A ? 11 HH22 1
   ATOM 333 N A GLN A 13 ? 29.06974 -19.24564 9.19517 0.656 7.72295 N ? A ? 12 N 1
   ATOM 334 CA A GLN A 13 ? 29.23993 -20.22650 10.26065 0.656 8.00200 C ? A ? 12 CA 1
   ATOM 335 C A GLN A 13 ? 28.81145 -19.65270 11.60210 0.656 8.09615 C ? A ? 12 C 1
   ATOM 336 O A GLN A 13 ? 28.20462 -20.36272 12.41715 0.656 8.50159 O ? A ? 12 O 1
   ATOM 337 CB A GLN A 13 ? 30.67508 -20.74318 10.28887 0.656 8.21047 C ? A ? 12 CB 1
   ATOM 338 CG A GLN A 13 ? 31.02267 -21.47795 9.01098 0.656 8.09290 C ? A ? 12 CG 1
   ATOM 339 CD A GLN A 13 ? 32.44658 -21.98049 9.00824 0.656 10.14003 C ? A ? 12 CD 1
   ATOM 340 OE1 A GLN A 13 ? 33.22639 -21.69734 9.93569 0.656 10.55286 O ? A ? 12 OE1 1
   ATOM 341 NE2 A GLN A 13 ? 32.79546 -22.75292 7.96966 0.656 9.66625 N ? A ? 12 NE2 1
   ATOM 342 H A GLN A 13 ? 29.80217 -18.98766 8.82559 0.656 9.24424 H ? A ? 12 H 1
   ATOM 343 HA A GLN A 13 ? 28.67461 -20.99405 10.08128 0.656 9.57909 H ? A ? 12 HA 1
   ATOM 344 HB2 A GLN A 13 ? 31.28389 -19.99441 10.38680 0.656 9.82927 H ? A ? 12 HB2 1
   ATOM 345 HB3 A GLN A 13 ? 30.78087 -21.35630 11.03305 0.656 9.82927 H ? A ? 12 HB3 1
   ATOM 346 HG2 A GLN A 13 ? 30.43280 -22.24172 8.91298 0.656 9.68818 H ? A ? 12 HG2 1
   ATOM 347 HG3 A GLN A 13 ? 30.91361 -20.87581 8.25837 0.656 9.68818 H ? A ? 12 HG3 1
   ATOM 348 HE21 A GLN A 13 ? 32.22047 -22.93432 7.35641 0.656 11.57620 H ? A ? 12 HE21 1
   ATOM 349 HE22 A GLN A 13 ? 33.59428 -23.06706 7.91662 0.656 11.57620 H ? A ? 12 HE22 1
   ATOM 350 N C GLN A 13 ? 29.00625 -19.18686 9.07341 0.344 7.80397 N ? A ? 12 N 1
   ATOM 351 CA C GLN A 13 ? 29.16497 -20.19689 10.10930 0.344 8.43547 C ? A ? 12 CA 1
   ATOM 352 C C GLN A 13 ? 28.75955 -19.66548 11.48036 0.344 7.66446 C ? A ? 12 C 1
   ATOM 353 O C GLN A 13 ? 28.16138 -20.40152 12.27519 0.344 7.87641 O ? A ? 12 O 1
   ATOM 354 CB C GLN A 13 ? 30.59778 -20.70700 10.12396 0.344 8.97979 C ? A ? 12 CB 1
   ATOM 355 CG C GLN A 13 ? 30.95058 -21.53519 8.91591 0.344 7.82979 C ? A ? 12 CG 1
   ATOM 356 CD C GLN A 13 ? 32.40142 -21.97099 8.94729 0.344 9.78696 C ? A ? 12 CD 1
   ATOM 357 OE1 C GLN A 13 ? 33.25908 -21.22820 9.42715 0.344 8.47791 O ? A ? 12 OE1 1
   ATOM 358 NE2 C GLN A 13 ? 32.69102 -23.12234 8.37979 0.344 5.82092 N ? A ? 12 NE2 1
   ATOM 359 H C GLN A 13 ? 29.74162 -18.89302 8.73800 0.344 9.34146 H ? A ? 12 H 1
   ATOM 360 HA C GLN A 13 ? 28.58394 -20.94614 9.90456 0.344 10.09926 H ? A ? 12 HA 1
   ATOM 361 HB2 C GLN A 13 ? 31.20039 -19.94735 10.15034 0.344 10.75244 H ? A ? 12 HB2 1
   ATOM 362 HB3 C GLN A 13 ? 30.72552 -21.25929 10.91108 0.344 10.75244 H ? A ? 12 HB3 1
   ATOM 363 HG2 C GLN A 13 ? 30.39353 -22.32906 8.89704 0.344 9.37245 H ? A ? 12 HG2 1
   ATOM 364 HG3 C GLN A 13 ? 30.80676 -21.00982 8.11329 0.344 9.37245 H ? A ? 12 HG3 1
   ATOM 365 HE21 C GLN A 13 ? 32.06891 -23.58977 8.01361 0.344 6.96180 H ? A ? 12 HE21 1
   ATOM 366 HE22 C GLN A 13 ? 33.50240 -23.40737 8.37507 0.344 6.96180 H ? A ? 12 HE22 1
   ATOM 367 N A SER A 14 ? 29.10570 -18.36653 11.85228 0.656 8.14440 N ? A ? 13 N 1
   ATOM 368 CA A SER A 14 ? 28.63701 -17.74743 13.08530 0.656 8.22475 C ? A ? 13 CA 1
   ATOM 369 C A SER A 14 ? 27.11712 -17.64960 13.11103 0.656 8.49731 C ? A ? 13 C 1
   ATOM 370 O A SER A 14 ? 26.48286 -17.88471 14.14703 0.656 8.97648 O ? A ? 13 O 1
   ATOM 371 CB A SER A 14 ? 29.25727 -16.36760 13.21810 0.656 10.84482 C ? A ? 13 CB 1
   ATOM 372 OG A SER A 14 ? 30.65980 -16.45559 13.32011 0.656 11.59388 O ? A ? 13 OG 1
   ATOM 373 H A SER A 14 ? 29.56170 -17.85183 11.33581 0.656 9.74998 H ? A ? 13 H 1
   ATOM 374 HA A SER A 14 ? 28.91378 -18.28882 13.84108 0.656 9.84641 H ? A ? 13 HA 1
   ATOM 375 HB2 A SER A 14 ? 29.03005 -15.84264 12.43471 0.656 12.99048 H ? A ? 13 HB2 1
   ATOM 376 HB3 A SER A 14 ? 28.90888 -15.94038 14.01622 0.656 12.99048 H ? A ? 13 HB3 1
   ATOM 377 HG A SER A 14 ? 30.96710 -16.90198 12.67832 0.656 13.88936 H ? A ? 13 HG 1
   ATOM 378 N C SER A 14 ? 29.08148 -18.39690 11.78843 0.344 8.25751 N ? A ? 13 N 1
   ATOM 379 CA C SER A 14 ? 28.64963 -17.83979 13.06841 0.344 8.60604 C ? A ? 13 CA 1
   ATOM 380 C C SER A 14 ? 27.13397 -17.63430 13.11210 0.344 8.65836 C ? A ? 13 C 1
   ATOM 381 O C SER A 14 ? 26.51579 -17.80802 14.16866 0.344 8.51668 O ? A ? 13 O 1
   ATOM 382 CB C SER A 14 ? 29.37075 -16.53421 13.37371 0.344 6.62524 C ? A ? 13 CB 1
   ATOM 383 OG C SER A 14 ? 30.64674 -16.72124 14.00517 0.344 6.57827 O ? A ? 13 OG 1
   ATOM 384 H C SER A 14 ? 29.53264 -17.86207 11.28841 0.344 9.88571 H ? A ? 13 H 1
   ATOM 385 HA C SER A 14 ? 28.89243 -18.46941 13.76520 0.344 10.30395 H ? A ? 13 HA 1
   ATOM 386 HB2 C SER A 14 ? 29.50962 -16.05965 12.53919 0.344 7.92699 H ? A ? 13 HB2 1
   ATOM 387 HB3 C SER A 14 ? 28.81129 -16.00752 13.96574 0.344 7.92699 H ? A ? 13 HB3 1
   ATOM 388 HG C SER A 14 ? 31.26048 -16.66755 13.43418 0.344 7.87062 H ? A ? 13 HG 1
   ATOM 389 N . ALA A 15 ? 26.51615 -17.24539 11.99884 1.000 8.04612 N ? A ? 14 N 1
   ATOM 390 CA . ALA A 15 ? 25.05176 -17.16398 11.95300 1.000 8.89743 C ? A ? 14 CA 1
   ATOM 391 C . ALA A 15 ? 24.44903 -18.53381 12.22332 1.000 9.29917 C ? A ? 14 C 1
   ATOM 392 O . ALA A 15 ? 23.46925 -18.67072 12.96376 1.000 8.35072 O ? A ? 14 O 1
   ATOM 393 CB . ALA A 15 ? 24.57101 -16.62253 10.60092 1.000 9.11491 C ? A ? 14 CB 1
   ATOM 394 HA . ALA A 15 ? 24.75130 -16.53991 12.63208 1.000 10.65362 H ? A ? 14 HA 1
   ATOM 395 HB1 . ALA A 15 ? 23.60140 -16.59515 10.59841 1.000 10.91459 H ? A ? 14 HB1 1
   ATOM 396 HB2 . ALA A 15 ? 24.92746 -15.72943 10.47359 1.000 10.91459 H ? A ? 14 HB2 1
   ATOM 397 HB3 . ALA A 15 ? 24.88720 -17.20855 9.89558 1.000 10.91459 H ? A ? 14 HB3 1
   ATOM 398 H A ALA A 15 ? 26.91705 -17.01725 11.27300 0.656 9.63204 H ? A ? 14 H 1
   ATOM 399 H C ALA A 15 ? 26.91276 -17.02647 11.26782 0.344 9.63204 H ? A ? 14 H 1
   ATOM 400 N A ALA A 16 ? 24.97786 -19.55687 11.55351 0.665 7.57545 N ? A ? 15 N 1
   ATOM 401 CA A ALA A 16 ? 24.50068 -20.92033 11.76124 0.665 8.61981 C ? A ? 15 CA 1
   ATOM 402 C A ALA A 16 ? 24.63116 -21.33418 13.21650 0.665 8.90346 C ? A ? 15 C 1
   ATOM 403 O A ALA A 16 ? 23.72027 -21.95730 13.77182 0.665 9.36839 O ? A ? 15 O 1
   ATOM 404 CB A ALA A 16 ? 25.32583 -21.88444 10.90296 0.665 9.22506 C ? A ? 15 CB 1
   ATOM 405 H A ALA A 16 ? 25.61119 -19.48873 10.97571 0.665 9.06724 H ? A ? 15 H 1
   ATOM 406 HA A ALA A 16 ? 23.56719 -20.96356 11.50120 0.665 10.32047 H ? A ? 15 HA 1
   ATOM 407 HB1 A ALA A 16 ? 24.80742 -22.68881 10.74442 0.665 11.04677 H ? A ? 15 HB1 1
   ATOM 408 HB2 A ALA A 16 ? 25.53631 -21.45488 10.05911 0.665 11.04677 H ? A ? 15 HB2 1
   ATOM 409 HB3 A ALA A 16 ? 26.14404 -22.10583 11.37457 0.665 11.04677 H ? A ? 15 HB3 1
   ATOM 410 N B ALA A 16 ? 25.07867 -19.57864 11.68723 0.335 8.93033 N ? A ? 15 N 1
   ATOM 411 CA B ALA A 16 ? 24.59855 -20.93423 11.94739 0.335 8.52318 C ? A ? 15 CA 1
   ATOM 412 C B ALA A 16 ? 24.72596 -21.30777 13.41930 0.335 8.12413 C ? A ? 15 C 1
   ATOM 413 O B ALA A 16 ? 23.84470 -21.99042 13.96381 0.335 7.78593 O ? A ? 15 O 1
   ATOM 414 CB B ALA A 16 ? 25.37650 -21.95575 11.10983 0.335 8.98233 C ? A ? 15 CB 1
   ATOM 415 H B ALA A 16 ? 25.77153 -19.53161 11.17996 0.335 10.69310 H ? A ? 15 H 1
   ATOM 416 HA B ALA A 16 ? 23.66303 -20.96285 11.69264 0.335 10.20452 H ? A ? 15 HA 1
   ATOM 417 HB1 B ALA A 16 ? 24.82769 -22.74587 10.98570 0.335 10.75549 H ? A ? 15 HB1 1
   ATOM 418 HB2 B ALA A 16 ? 25.58909 -21.56211 10.24916 0.335 10.75549 H ? A ? 15 HB2 1
   ATOM 419 HB3 B ALA A 16 ? 26.19351 -22.19055 11.57704 0.335 10.75549 H ? A ? 15 HB3 1
   ATOM 420 N A THR A 17 ? 25.75527 -21.00605 13.85469 0.665 10.09432 N ? A ? 16 N 1
   ATOM 421 CA A THR A 17 ? 25.95944 -21.37021 15.24837 0.665 8.21514 C ? A ? 16 CA 1
   ATOM 422 C A THR A 17 ? 24.86815 -20.76417 16.10501 0.665 7.72996 C ? A ? 16 C 1
   ATOM 423 O A THR A 17 ? 24.33150 -21.40239 17.01760 0.665 9.35244 O ? A ? 16 O 1
   ATOM 424 CB A THR A 17 ? 27.32261 -20.84878 15.68847 0.665 7.88479 C ? A ? 16 CB 1
   ATOM 425 OG1 A THR A 17 ? 28.34677 -21.50987 14.93061 0.665 9.88371 O ? A ? 16 OG1 1
   ATOM 426 CG2 A THR A 17 ? 27.57274 -21.11132 17.17295 0.665 10.35721 C ? A ? 16 CG2 1
   ATOM 427 H A THR A 17 ? 26.41050 -20.57458 13.50241 0.665 12.08988 H ? A ? 16 H 1
   ATOM 428 HA A THR A 17 ? 25.93979 -22.33406 15.35565 0.665 9.83487 H ? A ? 16 HA 1
   ATOM 429 HB A THR A 17 ? 27.35237 -19.89030 15.54243 0.665 9.43844 H ? A ? 16 HB 1
   ATOM 430 HG1 A THR A 17 ? 28.04184 -22.21382 14.58846 0.665 11.83715 H ? A ? 16 HG1 1
   ATOM 431 HG21 A THR A 17 ? 28.49860 -20.92223 17.39190 0.665 12.40535 H ? A ? 16 HG21 1
   ATOM 432 HG22 A THR A 17 ? 26.99961 -20.54349 17.71146 0.665 12.40535 H ? A ? 16 HG22 1
   ATOM 433 HG23 A THR A 17 ? 27.38293 -22.03924 17.38234 0.665 12.40535 H ? A ? 16 HG23 1
   ATOM 434 N B THR A 17 ? 25.83109 -20.91433 14.06858 0.335 6.36424 N ? A ? 16 N 1
   ATOM 435 CA B THR A 17 ? 26.00639 -21.17131 15.49442 0.335 6.38241 C ? A ? 16 CA 1
   ATOM 436 C B THR A 17 ? 24.87391 -20.54260 16.29191 0.335 10.50314 C ? A ? 16 C 1
   ATOM 437 O B THR A 17 ? 24.28737 -21.18249 17.17847 0.335 6.95320 O ? A ? 16 O 1
   ATOM 438 CB B THR A 17 ? 27.36462 -20.61804 15.92677 0.335 10.14722 C ? A ? 16 CB 1
   ATOM 439 OG1 B THR A 17 ? 28.40924 -21.36098 15.28816 0.335 10.68346 O ? A ? 16 OG1 1
   ATOM 440 CG2 B THR A 17 ? 27.56981 -20.67601 17.44274 0.335 8.56647 C ? A ? 16 CG2 1
   ATOM 441 H B THR A 17 ? 26.48943 -20.49843 13.70358 0.335 7.61379 H ? A ? 16 H 1
   ATOM 442 HA B THR A 17 ? 25.99401 -22.12526 15.66972 0.335 7.63559 H ? A ? 16 HA 1
   ATOM 443 HB B THR A 17 ? 27.40317 -19.68403 15.66785 0.335 12.15336 H ? A ? 16 HB 1
   ATOM 444 HG1 B THR A 17 ? 28.37176 -21.25224 14.45607 0.335 12.79685 H ? A ? 16 HG1 1
   ATOM 445 HG21 B THR A 17 ? 28.51347 -20.59739 17.65305 0.335 10.25647 H ? A ? 16 HG21 1
   ATOM 446 HG22 B THR A 17 ? 27.09037 -19.94931 17.87045 0.335 10.25647 H ? A ? 16 HG22 1
   ATOM 447 HG23 B THR A 17 ? 27.23900 -21.51902 17.79031 0.335 10.25647 H ? A ? 16 HG23 1
   ATOM 448 N A LEU A 18 ? 24.55272 -19.49600 15.85709 0.665 8.42023 N ? A ? 17 N 1
   ATOM 449 CA A LEU A 18 ? 23.50333 -18.84631 16.63629 0.665 8.41840 C ? A ? 17 CA 1
   ATOM 450 C A LEU A 18 ? 22.13113 -19.45373 16.35213 0.665 9.35663 C ? A ? 17 C 1
   ATOM 451 O A LEU A 18 ? 21.32111 -19.60358 17.27671 0.665 10.36341 O ? A ? 17 O 1
   ATOM 452 CB A LEU A 18 ? 23.49660 -17.32877 16.40305 0.665 9.50413 C ? A ? 17 CB 1
   ATOM 453 CG A LEU A 18 ? 24.80628 -16.62406 16.77570 0.665 9.10098 C ? A ? 17 CG 1
   ATOM 454 CD1 A LEU A 18 ? 24.86185 -15.21268 16.21303 0.665 12.12920 C ? A ? 17 CD1 1
   ATOM 455 CD2 A LEU A 18 ? 25.05888 -16.54484 18.28208 0.665 13.55952 C ? A ? 17 CD2 1
   ATOM 456 H A LEU A 18 ? 24.92137 -19.00089 15.25829 0.665 10.08098 H ? A ? 17 H 1
   ATOM 457 HA A LEU A 18 ? 23.69979 -18.98675 17.57575 0.665 10.07878 H ? A ? 17 HA 1
   ATOM 458 HB2 A LEU A 18 ? 23.33053 -17.16198 15.46203 0.665 11.38166 H ? A ? 17 HB2 1
   ATOM 459 HB3 A LEU A 18 ? 22.78934 -16.93735 16.93921 0.665 11.38166 H ? A ? 17 HB3 1
   ATOM 460 HG A LEU A 18 ? 25.50625 -17.17006 16.38476 0.665 10.89787 H ? A ? 17 HG 1
   ATOM 461 HD11 A LEU A 18 ? 25.68915 -14.79241 16.49558 0.665 14.53174 H ? A ? 17 HD11 1
   ATOM 462 HD12 A LEU A 18 ? 24.82735 -15.25718 15.24467 0.665 14.53174 H ? A ? 17 HD12 1
   ATOM 463 HD13 A LEU A 18 ? 24.10366 -14.70900 16.54824 0.665 14.53174 H ? A ? 17 HD13 1
   ATOM 464 HD21 A LEU A 18 ? 25.82130 -15.96757 18.44451 0.665 16.24812 H ? A ? 17 HD21 1
   ATOM 465 HD22 A LEU A 18 ? 24.27081 -16.18186 18.71578 0.665 16.24812 H ? A ? 17 HD22 1
   ATOM 466 HD23 A LEU A 18 ? 25.24100 -17.43601 18.61904 0.665 16.24812 H ? A ? 17 HD23 1
   ATOM 467 N B LEU A 18 ? 24.54553 -19.28233 15.98776 0.335 8.23036 N ? A ? 17 N 1
   ATOM 468 CA B LEU A 18 ? 23.49145 -18.62502 16.74907 0.335 10.97692 C ? A ? 17 CA 1
   ATOM 469 C B LEU A 18 ? 22.12194 -19.19765 16.42198 0.335 8.44362 C ? A ? 17 C 1
   ATOM 470 O B LEU A 18 ? 21.28894 -19.37503 17.31052 0.335 7.09646 O ? A ? 17 O 1
   ATOM 471 CB B LEU A 18 ? 23.52199 -17.12828 16.47952 0.335 8.63133 C ? A ? 17 CB 1
   ATOM 472 CG B LEU A 18 ? 24.75634 -16.39334 17.02348 0.335 14.20864 C ? A ? 17 CG 1
   ATOM 473 CD1 B LEU A 18 ? 24.31863 -14.94697 17.22973 0.335 11.60195 C ? A ? 17 CD1 1
   ATOM 474 CD2 B LEU A 18 ? 25.33780 -17.05713 18.26598 0.335 10.44370 C ? A ? 17 CD2 1
   ATOM 475 H B LEU A 18 ? 24.90629 -18.80734 15.36821 0.335 9.85314 H ? A ? 17 H 1
   ATOM 476 HA B LEU A 18 ? 23.65287 -18.77068 17.69439 0.335 13.14900 H ? A ? 17 HA 1
   ATOM 477 HB2 B LEU A 18 ? 23.50028 -16.98978 15.51970 0.335 10.33429 H ? A ? 17 HB2 1
   ATOM 478 HB3 B LEU A 18 ? 22.74004 -16.72743 16.89033 0.335 10.33429 H ? A ? 17 HB3 1
   ATOM 479 HG B LEU A 18 ? 25.50361 -16.42404 16.40580 0.335 17.02707 H ? A ? 17 HG 1
   ATOM 480 HD11 B LEU A 18 ? 25.08547 -14.42137 17.50649 0.335 13.89905 H ? A ? 17 HD11 1
   ATOM 481 HD12 B LEU A 18 ? 23.96500 -14.60195 16.39498 0.335 13.89905 H ? A ? 17 HD12 1
   ATOM 482 HD13 B LEU A 18 ? 23.63352 -14.91914 17.91585 0.335 13.89905 H ? A ? 17 HD13 1
   ATOM 483 HD21 B LEU A 18 ? 26.01048 -16.47346 18.65034 0.335 12.50914 H ? A ? 17 HD21 1
   ATOM 484 HD22 B LEU A 18 ? 24.62511 -17.20733 18.90661 0.335 12.50914 H ? A ? 17 HD22 1
   ATOM 485 HD23 B LEU A 18 ? 25.73929 -17.90324 18.01341 0.335 12.50914 H ? A ? 17 HD23 1
   ATOM 486 N A MET A 19 ? 21.85245 -19.83980 15.10294 0.665 8.57548 N ? A ? 18 N 1
   ATOM 487 CA A MET A 19 ? 20.58773 -20.50098 14.79611 0.665 7.74658 C ? A ? 18 CA 1
   ATOM 488 C A MET A 19 ? 20.49513 -21.82030 15.54386 0.665 8.79467 C ? A ? 18 C 1
   ATOM 489 O A MET A 19 ? 19.45074 -22.17271 16.08508 0.665 8.76905 O ? A ? 18 O 1
   ATOM 490 CB A MET A 19 ? 20.49891 -20.81579 13.29490 0.665 10.05608 C ? A ? 18 CB 1
   ATOM 491 CG A MET A 19 ? 20.19714 -19.61301 12.39002 0.665 8.85460 C ? A ? 18 CG 1
   ATOM 492 SD A MET A 19 ? 19.26176 -20.16812 10.91576 0.665 12.10484 S ? A ? 18 SD 1
   ATOM 493 CE A MET A 19 ? 20.39541 -21.38382 10.31804 0.665 12.72844 C ? A ? 18 CE 1
   ATOM 494 H A MET A 19 ? 22.37243 -19.73121 14.42660 0.665 10.26728 H ? A ? 18 H 1
   ATOM 495 HA A MET A 19 ? 19.86695 -19.90000 15.04144 0.665 9.27260 H ? A ? 18 HA 1
   ATOM 496 HB2 A MET A 19 ? 21.34830 -21.18720 13.00942 0.665 12.04400 H ? A ? 18 HB2 1
   ATOM 497 HB3 A MET A 19 ? 19.79083 -21.46483 13.15979 0.665 12.04400 H ? A ? 18 HB3 1
   ATOM 498 HG2 A MET A 19 ? 19.66201 -18.96482 12.87414 0.665 10.60222 H ? A ? 18 HG2 1
   ATOM 499 HG3 A MET A 19 ? 21.02781 -19.20582 12.09832 0.665 10.60222 H ? A ? 18 HG3 1
   ATOM 500 HE1 A MET A 19 ? 20.25896 -21.50130 9.36489 0.665 15.25083 H ? A ? 18 HE1 1
   ATOM 501 HE2 A MET A 19 ? 21.30130 -21.08136 10.48770 0.665 15.25083 H ? A ? 18 HE2 1
   ATOM 502 HE3 A MET A 19 ? 20.23399 -22.22082 10.78094 0.665 15.25083 H ? A ? 18 HE3 1
   ATOM 503 N B MET A 19 ? 21.84567 -19.43109 15.14992 0.335 7.25944 N ? A ? 18 N 1
   ATOM 504 CA B MET A 19 ? 20.61008 -20.09915 14.77207 0.335 9.03348 C ? A ? 18 CA 1
   ATOM 505 C B MET A 19 ? 20.45772 -21.42449 15.49725 0.335 7.13465 C ? A ? 18 C 1
   ATOM 506 O B MET A 19 ? 19.37591 -21.73125 16.01391 0.335 8.24541 O ? A ? 18 O 1
   ATOM 507 CB B MET A 19 ? 20.59381 -20.39082 13.27156 0.335 9.54775 C ? A ? 18 CB 1
   ATOM 508 CG B MET A 19 ? 20.41866 -19.20126 12.38761 0.335 10.07772 C ? A ? 18 CG 1
   ATOM 509 SD B MET A 19 ? 20.76778 -19.63745 10.67789 0.335 7.70539 S ? A ? 18 SD 1
   ATOM 510 CE B MET A 19 ? 19.51947 -20.86701 10.30615 0.335 8.50894 C ? A ? 18 CE 1
   ATOM 511 H B MET A 19 ? 22.35182 -19.21516 14.48902 0.335 8.68803 H ? A ? 18 H 1
   ATOM 512 HA B MET A 19 ? 19.88308 -19.49703 14.99529 0.335 10.81687 H ? A ? 18 HA 1
   ATOM 513 HB2 B MET A 19 ? 21.43702 -20.80645 13.03249 0.335 11.43401 H ? A ? 18 HB2 1
   ATOM 514 HB3 B MET A 19 ? 19.86041 -20.99819 13.08685 0.335 11.43401 H ? A ? 18 HB3 1
   ATOM 515 HG2 B MET A 19 ? 19.50388 -18.88402 12.44633 0.335 12.06996 H ? A ? 18 HG2 1
   ATOM 516 HG3 B MET A 19 ? 21.03108 -18.50019 12.66026 0.335 12.06996 H ? A ? 18 HG3 1
   ATOM 517 HE1 B MET A 19 ? 19.60899 -21.13762 9.37898 0.335 10.18743 H ? A ? 18 HE1 1
   ATOM 518 HE2 B MET A 19 ? 19.64713 -21.63257 10.88798 0.335 10.18743 H ? A ? 18 HE2 1
   ATOM 519 HE3 B MET A 19 ? 18.64202 -20.48119 10.45488 0.335 10.18743 H ? A ? 18 HE3 1
   ATOM 520 N A ALA A 20 ? 21.56965 -22.59803 15.56093 0.665 9.84208 N ? A ? 19 N 1
   ATOM 521 CA A ALA A 20 ? 21.54107 -23.86431 16.27606 0.665 8.64795 C ? A ? 19 CA 1
   ATOM 522 C A ALA A 20 ? 21.22386 -23.65633 17.74294 0.665 10.02894 C ? A ? 19 C 1
   ATOM 523 O A ALA A 20 ? 20.49506 -24.46373 18.33679 0.665 9.12122 O ? A ? 19 O 1
   ATOM 524 CB A ALA A 20 ? 22.87065 -24.59589 16.11215 0.665 11.04879 C ? A ? 19 CB 1
   ATOM 525 H A ALA A 20 ? 22.31593 -22.41894 15.17287 0.665 11.78719 H ? A ? 19 H 1
   ATOM 526 HA A ALA A 20 ? 20.84643 -24.42235 15.89271 0.665 10.35424 H ? A ? 19 HA 1
   ATOM 527 HB1 A ALA A 20 ? 22.84024 -25.42328 16.61752 0.665 13.23525 H ? A ? 19 HB1 1
   ATOM 528 HB2 A ALA A 20 ? 23.01176 -24.78764 15.17182 0.665 13.23525 H ? A ? 19 HB2 1
   ATOM 529 HB3 A ALA A 20 ? 23.58519 -24.03083 16.44536 0.665 13.23525 H ? A ? 19 HB3 1
   ATOM 530 N B ALA A 20 ? 21.50451 -22.26201 15.45843 0.335 9.32456 N ? A ? 19 N 1
   ATOM 531 CA B ALA A 20 ? 21.43219 -23.57744 16.08207 0.335 9.27432 C ? A ? 19 CA 1
   ATOM 532 C B ALA A 20 ? 21.12226 -23.46163 17.56480 0.335 9.17893 C ? A ? 19 C 1
   ATOM 533 O B ALA A 20 ? 20.36091 -24.27310 18.11060 0.335 9.43578 O ? A ? 19 O 1
   ATOM 534 CB B ALA A 20 ? 22.73454 -24.33301 15.86722 0.335 9.76110 C ? A ? 19 CB 1
   ATOM 535 H B ALA A 20 ? 22.25730 -22.08942 15.08012 0.335 11.16617 H ? A ? 19 H 1
   ATOM 536 HA B ALA A 20 ? 20.72020 -24.08438 15.66139 0.335 11.10588 H ? A ? 19 HA 1
   ATOM 537 HB1 B ALA A 20 ? 22.66849 -25.20304 16.29101 0.335 11.69001 H ? A ? 19 HB1 1
   ATOM 538 HB2 B ALA A 20 ? 22.88443 -24.43952 14.91481 0.335 11.69001 H ? A ? 19 HB2 1
   ATOM 539 HB3 B ALA A 20 ? 23.46196 -23.82714 16.26201 0.335 11.69001 H ? A ? 19 HB3 1
   ATOM 540 N A SER A 21 ? 21.78836 -22.61005 18.35026 0.665 8.80961 N ? A ? 20 N 1
   ATOM 541 CA A SER A 21 ? 21.49351 -22.35793 19.75650 0.665 8.30455 C ? A ? 20 CA 1
   ATOM 542 C A SER A 21 ? 20.05452 -21.92704 19.97869 0.665 8.64104 C ? A ? 20 C 1
   ATOM 543 O A SER A 21 ? 19.37885 -22.42548 20.89575 0.665 9.44916 O ? A ? 20 O 1
   ATOM 544 CB A SER A 21 ? 22.45795 -21.34223 20.32105 0.665 9.40774 C ? A ? 20 CB 1
   ATOM 545 OG A SER A 21 ? 22.12885 -21.09912 21.67059 0.665 9.88801 O ? A ? 20 OG 1
   ATOM 546 H A SER A 21 ? 22.32737 -22.05081 17.98105 0.665 10.54823 H ? A ? 20 H 1
   ATOM 547 HA A SER A 21 ? 21.61701 -23.19014 20.23929 0.665 9.94216 H ? A ? 20 HA 1
   ATOM 548 HB2 A SER A 21 ? 23.36199 -21.68949 20.26623 0.665 11.26599 H ? A ? 20 HB2 1
   ATOM 549 HB3 A SER A 21 ? 22.38881 -20.51604 19.81753 0.665 11.26599 H ? A ? 20 HB3 1
   ATOM 550 HG A SER A 21 ? 22.33477 -21.76404 22.14079 0.665 11.84232 H ? A ? 20 HG 1
   ATOM 551 N B SER A 21 ? 21.67144 -22.43258 18.22348 0.335 8.35239 N ? A ? 20 N 1
   ATOM 552 CA B SER A 21 ? 21.39630 -22.26091 19.64801 0.335 8.45492 C ? A ? 20 CA 1
   ATOM 553 C B SER A 21 ? 19.96871 -21.78176 19.89667 0.335 8.70413 C ? A ? 20 C 1
   ATOM 554 O B SER A 21 ? 19.28430 -22.27424 20.80741 0.335 8.64710 O ? A ? 20 O 1
   ATOM 555 CB B SER A 21 ? 22.41391 -21.31815 20.26724 0.335 9.69332 C ? A ? 20 CB 1
   ATOM 556 OG B SER A 21 ? 22.10740 -21.07117 21.62635 0.335 9.85379 O ? A ? 20 OG 1
   ATOM 557 H B SER A 21 ? 22.18992 -21.84034 17.87703 0.335 9.99956 H ? A ? 20 H 1
   ATOM 558 HA B SER A 21 ? 21.48829 -23.12079 20.08738 0.335 10.12261 H ? A ? 20 HA 1
   ATOM 559 HB2 B SER A 21 ? 23.29420 -21.72154 20.21007 0.335 11.60868 H ? A ? 20 HB2 1
   ATOM 560 HB3 B SER A 21 ? 22.40195 -20.47784 19.78284 0.335 11.60868 H ? A ? 20 HB3 1
   ATOM 561 HG B SER A 21 ? 22.19959 -21.77577 22.07428 0.335 11.80124 H ? A ? 20 HG 1
   ATOM 562 N A HIS A 22 ? 19.55488 -20.99400 19.18506 0.665 8.44300 N ? A ? 21 N 1
   ATOM 563 CA A HIS A 22 ? 18.19505 -20.51714 19.41323 0.665 8.68689 C ? A ? 21 CA 1
   ATOM 564 C A HIS A 22 ? 17.12861 -21.51347 18.99636 0.665 7.54541 C ? A ? 21 C 1
   ATOM 565 O A HIS A 22 ? 16.05904 -21.53208 19.60941 0.665 8.20053 O ? A ? 21 O 1
   ATOM 566 CB A HIS A 22 ? 17.98621 -19.15158 18.78283 0.665 9.47997 C ? A ? 21 CB 1
   ATOM 567 CG A HIS A 22 ? 18.64881 -18.06784 19.56269 0.665 7.71889 C ? A ? 21 CG 1
   ATOM 568 ND1 A HIS A 22 ? 18.05208 -17.48955 20.65388 0.665 7.74104 N ? A ? 21 ND1 1
   ATOM 569 CD2 A HIS A 22 ? 19.90918 -17.57574 19.50764 0.665 7.79948 C ? A ? 21 CD2 1
   ATOM 570 CE1 A HIS A 22 ? 18.90018 -16.61738 21.17976 0.665 7.57238 C ? A ? 21 CE1 1
   ATOM 571 NE2 A HIS A 22 ? 20.02589 -16.63492 20.49039 0.665 7.12938 N ? A ? 21 NE2 1
   ATOM 572 H A HIS A 22 ? 19.96713 -20.62817 18.52490 0.665 10.10830 H ? A ? 21 H 1
   ATOM 573 HA A HIS A 22 ? 18.08135 -20.40022 20.36942 0.665 10.40097 H ? A ? 21 HA 1
   ATOM 574 HB2 A HIS A 22 ? 18.36032 -19.15341 17.88788 0.665 11.35267 H ? A ? 21 HB2 1
   ATOM 575 HB3 A HIS A 22 ? 17.03600 -18.96035 18.74481 0.665 11.35267 H ? A ? 21 HB3 1
   ATOM 576 HD2 A HIS A 22 ? 20.57389 -17.83178 18.90972 0.665 9.33608 H ? A ? 21 HD2 1
   ATOM 577 HE1 A HIS A 22 ? 18.72924 -16.07812 21.91792 0.665 9.06355 H ? A ? 21 HE1 1
   ATOM 578 HE2 A HIS A 22 ? 20.71377 -16.13949 20.63520 0.665 8.53196 H ? A ? 21 HE2 1
   ATOM 579 N B HIS A 22 ? 19.48696 -20.83276 19.10387 0.335 6.16511 N ? A ? 21 N 1
   ATOM 580 CA B HIS A 22 ? 18.13658 -20.33443 19.32087 0.335 8.23667 C ? A ? 21 CA 1
   ATOM 581 C B HIS A 22 ? 17.07039 -21.32742 18.88085 0.335 9.06914 C ? A ? 21 C 1
   ATOM 582 O B HIS A 22 ? 15.91565 -21.20902 19.31263 0.335 7.40938 O ? A ? 21 O 1
   ATOM 583 CB B HIS A 22 ? 17.95402 -19.00221 18.61092 0.335 6.84324 C ? A ? 21 CB 1
   ATOM 584 CG B HIS A 22 ? 18.58048 -17.87645 19.36182 0.335 7.65448 C ? A ? 21 CG 1
   ATOM 585 ND1 B HIS A 22 ? 17.95789 -17.26232 20.42488 0.335 10.72988 N ? A ? 21 ND1 1
   ATOM 586 CD2 B HIS A 22 ? 19.82225 -17.34079 19.29743 0.335 7.18881 C ? A ? 21 CD2 1
   ATOM 587 CE1 B HIS A 22 ? 18.76064 -16.34654 20.93982 0.335 16.07796 C ? A ? 21 CE1 1
   ATOM 588 NE2 B HIS A 22 ? 19.89515 -16.36607 20.26394 0.335 15.31391 N ? A ? 21 NE2 1
   ATOM 589 H B HIS A 22 ? 19.91083 -20.46968 18.44958 0.335 7.37483 H ? A ? 21 H 1
   ATOM 590 HA B HIS A 22 ? 18.00884 -20.18019 20.26997 0.335 9.86071 H ? A ? 21 HA 1
   ATOM 591 HB2 B HIS A 22 ? 18.36725 -19.04922 17.73460 0.335 8.18858 H ? A ? 21 HB2 1
   ATOM 592 HB3 B HIS A 22 ? 17.00619 -18.81652 18.52124 0.335 8.18858 H ? A ? 21 HB3 1
   ATOM 593 HD2 B HIS A 22 ? 20.49940 -17.58640 18.70918 0.335 8.60327 H ? A ? 21 HD2 1
   ATOM 594 HE1 B HIS A 22 ? 18.56095 -15.78571 21.65431 0.335 19.27025 H ? A ? 21 HE1 1
   ATOM 595 HE2 B HIS A 22 ? 20.57009 -15.85227 20.40556 0.335 18.35339 H ? A ? 21 HE2 1
   ATOM 596 N A PHE A 23 ? 17.39765 -22.33138 17.98497 0.665 9.29237 N ? A ? 22 N 1
   ATOM 597 CA A PHE A 23 ? 16.48138 -23.41806 17.65829 0.665 9.15029 C ? A ? 22 CA 1
   ATOM 598 C A PHE A 23 ? 16.59279 -24.50089 18.71599 0.665 9.03836 C ? A ? 22 C 1
   ATOM 599 O A PHE A 23 ? 15.58728 -24.87653 19.34438 0.665 9.21927 O ? A ? 22 O 1
   ATOM 600 CB A PHE A 23 ? 16.84221 -24.00466 16.28645 0.665 9.10177 C ? A ? 22 CB 1
   ATOM 601 CG A PHE A 23 ? 16.00367 -25.18636 15.88429 0.665 9.84192 C ? A ? 22 CG 1
   ATOM 602 CD1 A PHE A 23 ? 14.70988 -24.99289 15.42881 0.665 9.66241 C ? A ? 22 CD1 1
   ATOM 603 CD2 A PHE A 23 ? 16.49124 -26.48670 15.97951 0.665 11.02953 C ? A ? 22 CD2 1
   ATOM 604 CE1 A PHE A 23 ? 13.91434 -26.07912 15.04597 0.665 9.98850 C ? A ? 22 CE1 1
   ATOM 605 CE2 A PHE A 23 ? 15.69831 -27.58821 15.60242 0.665 12.19400 C ? A ? 22 CE2 1
   ATOM 606 CZ A PHE A 23 ? 14.41064 -27.36872 15.13664 0.665 11.25297 C ? A ? 22 CZ 1
   ATOM 607 H A PHE A 23 ? 18.09203 -22.28039 17.48015 0.665 11.12754 H ? A ? 22 H 1
   ATOM 608 HA A PHE A 23 ? 15.57264 -23.08088 17.62103 0.665 10.95705 H ? A ? 22 HA 1
   ATOM 609 HB2 A PHE A 23 ? 16.72339 -23.31637 15.61337 0.665 10.89882 H ? A ? 22 HB2 1
   ATOM 610 HB3 A PHE A 23 ? 17.76805 -24.29336 16.30591 0.665 10.89882 H ? A ? 22 HB3 1
   ATOM 611 HD1 A PHE A 23 ? 14.36552 -24.13057 15.37671 0.665 11.57159 H ? A ? 22 HD1 1
   ATOM 612 HD2 A PHE A 23 ? 17.35352 -26.63040 16.29689 0.665 13.21214 H ? A ? 22 HD2 1
   ATOM 613 HE1 A PHE A 23 ? 13.05155 -25.93457 14.73039 0.665 11.96290 H ? A ? 22 HE1 1
   ATOM 614 HE2 A PHE A 23 ? 16.03459 -28.45301 15.66512 0.665 14.60950 H ? A ? 22 HE2 1
   ATOM 615 HZ A PHE A 23 ? 13.87928 -28.08917 14.88462 0.665 13.48026 H ? A ? 22 HZ 1
   ATOM 616 N B PHE A 23 ? 17.41077 -22.28868 18.02684 0.335 9.00711 N ? A ? 22 N 1
   ATOM 617 CA B PHE A 23 ? 16.46089 -23.33804 17.68282 0.335 8.43123 C ? A ? 22 CA 1
   ATOM 618 C B PHE A 23 ? 16.58782 -24.52107 18.64743 0.335 9.36415 C ? A ? 22 C 1
   ATOM 619 O B PHE A 23 ? 15.59295 -24.96543 19.23682 0.335 9.31212 O ? A ? 22 O 1
   ATOM 620 CB B PHE A 23 ? 16.76167 -23.80379 16.25498 0.335 9.29206 C ? A ? 22 CB 1
   ATOM 621 CG B PHE A 23 ? 15.84987 -24.86994 15.77394 0.335 9.46503 C ? A ? 22 CG 1
   ATOM 622 CD1 B PHE A 23 ? 14.52231 -24.58039 15.53048 0.335 9.24895 C ? A ? 22 CD1 1
   ATOM 623 CD2 B PHE A 23 ? 16.28175 -26.15905 15.57740 0.335 6.96090 C ? A ? 22 CD2 1
   ATOM 624 CE1 B PHE A 23 ? 13.63416 -25.55428 15.09829 0.335 7.44886 C ? A ? 22 CE1 1
   ATOM 625 CE2 B PHE A 23 ? 15.42550 -27.13337 15.14094 0.335 8.26282 C ? A ? 22 CE2 1
   ATOM 626 CZ B PHE A 23 ? 14.10850 -26.82014 14.89002 0.335 8.38372 C ? A ? 22 CZ 1
   ATOM 627 H B PHE A 23 ? 18.17580 -22.35301 17.63928 0.335 10.78523 H ? A ? 22 H 1
   ATOM 628 HA B PHE A 23 ? 15.55222 -23.00134 17.72572 0.335 10.09418 H ? A ? 22 HA 1
   ATOM 629 HB2 B PHE A 23 ? 16.67580 -23.04671 15.65469 0.335 11.12717 H ? A ? 22 HB2 1
   ATOM 630 HB3 B PHE A 23 ? 17.66686 -24.15101 16.22367 0.335 11.12717 H ? A ? 22 HB3 1
   ATOM 631 HD1 B PHE A 23 ? 14.21612 -23.71174 15.65929 0.335 11.07544 H ? A ? 22 HD1 1
   ATOM 632 HD2 B PHE A 23 ? 17.17128 -26.37339 15.74378 0.335 8.32977 H ? A ? 22 HD2 1
   ATOM 633 HE1 B PHE A 23 ? 12.73813 -25.35149 14.95367 0.335 8.91533 H ? A ? 22 HE1 1
   ATOM 634 HE2 B PHE A 23 ? 15.73161 -28.00240 15.01452 0.335 9.89209 H ? A ? 22 HE2 1
   ATOM 635 HZ B PHE A 23 ? 13.53298 -27.47892 14.57429 0.335 10.03716 H ? A ? 22 HZ 1
   ATOM 636 N A GLY A 24 ? 17.80977 -25.00794 18.94736 0.665 8.87986 N ? A ? 23 N 1
   ATOM 637 CA A GLY A 24 ? 17.97704 -26.16179 19.80641 0.665 8.92363 C ? A ? 23 CA 1
   ATOM 638 C A GLY A 24 ? 17.62040 -25.91926 21.24752 0.665 9.37415 C ? A ? 23 C 1
   ATOM 639 O A GLY A 24 ? 17.23446 -26.86130 21.94826 0.665 11.69203 O ? A ? 23 O 1
   ATOM 640 H A GLY A 24 ? 18.54189 -24.69924 18.61825 0.665 10.63253 H ? A ? 23 H 1
   ATOM 641 HA2 A GLY A 24 ? 17.41498 -26.88084 19.47783 0.665 10.68506 H ? A ? 23 HA2 1
   ATOM 642 HA3 A GLY A 24 ? 18.90411 -26.44519 19.77304 0.665 10.68506 H ? A ? 23 HA3 1
   ATOM 643 N B GLY A 24 ? 17.80390 -25.04069 18.83520 0.335 9.30589 N ? A ? 23 N 1
   ATOM 644 CA B GLY A 24 ? 17.96981 -26.23726 19.63834 0.335 10.45896 C ? A ? 23 CA 1
   ATOM 645 C B GLY A 24 ? 17.64081 -26.04910 21.09806 0.335 9.84856 C ? A ? 23 C 1
   ATOM 646 O B GLY A 24 ? 17.29525 -27.01737 21.78126 0.335 8.49208 O ? A ? 23 O 1
   ATOM 647 H B GLY A 24 ? 18.53331 -24.72033 18.51128 0.335 11.14376 H ? A ? 23 H 1
   ATOM 648 HA2 B GLY A 24 ? 17.39102 -26.93287 19.28900 0.335 12.52745 H ? A ? 23 HA2 1
   ATOM 649 HA3 B GLY A 24 ? 18.89167 -26.53243 19.57561 0.335 12.52745 H ? A ? 23 HA3 1
   ATOM 650 N A ARG A 25 ? 17.75832 -24.68754 21.72703 0.665 9.14826 N ? A ? 24 N 1
   ATOM 651 CA A ARG A 25 ? 17.39806 -24.45213 23.11761 0.665 10.74764 C ? A ? 24 CA 1
   ATOM 652 C A ARG A 25 ? 15.91724 -24.67145 23.38317 0.665 10.40306 C ? A ? 24 C 1
   ATOM 653 O A ARG A 25 ? 15.51297 -24.68098 24.55272 0.665 10.40773 O ? A ? 24 O 1
   ATOM 654 CB A ARG A 25 ? 17.76236 -23.03895 23.56528 0.665 10.86579 C ? A ? 24 CB 1
   ATOM 655 CG A ARG A 25 ? 16.94441 -21.94418 22.90100 0.665 10.00900 C ? A ? 24 CG 1
   ATOM 656 CD A ARG A 25 ? 17.40040 -20.56884 23.31789 0.665 10.79271 C ? A ? 24 CD 1
   ATOM 657 NE A ARG A 25 ? 18.80114 -20.32031 23.01360 0.665 9.34776 N ? A ? 24 NE 1
   ATOM 658 CZ A ARG A 25 ? 19.48163 -19.30246 23.51594 0.665 9.33601 C ? A ? 24 CZ 1
   ATOM 659 NH1 A ARG A 25 ? 18.92195 -18.44983 24.35597 0.665 10.31501 N ? A ? 24 NH1 1
   ATOM 660 NH2 A ARG A 25 ? 20.75940 -19.14073 23.18108 0.665 9.76808 N ? A ? 24 NH2 1
   ATOM 661 H A ARG A 25 ? 18.04430 -24.00522 21.28857 0.665 10.95462 H ? A ? 24 H 1
   ATOM 662 HA A ARG A 25 ? 17.91719 -25.07315 23.65216 0.665 12.87387 H ? A ? 24 HA 1
   ATOM 663 HB2 A ARG A 25 ? 17.62194 -22.97120 24.52267 0.665 13.01565 H ? A ? 24 HB2 1
   ATOM 664 HB3 A ARG A 25 ? 18.69542 -22.87791 23.35461 0.665 13.01565 H ? A ? 24 HB3 1
   ATOM 665 HG2 A ARG A 25 ? 17.03740 -22.01532 21.93809 0.665 11.98749 H ? A ? 24 HG2 1
   ATOM 666 HG3 A ARG A 25 ? 16.01293 -22.04381 23.15260 0.665 11.98749 H ? A ? 24 HG3 1
   ATOM 667 HD2 A ARG A 25 ? 16.87025 -19.90504 22.84968 0.665 12.92795 H ? A ? 24 HD2 1
   ATOM 668 HD3 A ARG A 25 ? 17.28088 -20.47345 24.27576 0.665 12.92795 H ? A ? 24 HD3 1
   ATOM 669 HE A ARG A 25 ? 19.20654 -20.86091 22.48163 0.665 11.19402 H ? A ? 24 HE 1
   ATOM 670 HH11 A ARG A 25 ? 18.09957 -18.55044 24.58653 0.665 12.35471 H ? A ? 24 HH11 1
   ATOM 671 HH12 A ARG A 25 ? 19.38005 -17.79426 24.67215 0.665 12.35471 H ? A ? 24 HH12 1
   ATOM 672 HH21 A ARG A 25 ? 21.13625 -19.69519 22.64242 0.665 11.69840 H ? A ? 24 HH21 1
   ATOM 673 HH22 A ARG A 25 ? 21.20829 -18.48176 23.50334 0.665 11.69840 H ? A ? 24 HH22 1
   ATOM 674 N B ARG A 25 ? 17.76293 -24.82491 21.61139 0.335 8.59767 N ? A ? 24 N 1
   ATOM 675 CA B ARG A 25 ? 17.45728 -24.61688 23.02327 0.335 10.06946 C ? A ? 24 CA 1
   ATOM 676 C B ARG A 25 ? 15.98198 -24.84572 23.34335 0.335 7.47631 C ? A ? 24 C 1
   ATOM 677 O B ARG A 25 ? 15.64735 -25.02871 24.51895 0.335 8.84348 O ? A ? 24 O 1
   ATOM 678 CB B ARG A 25 ? 17.88122 -23.21047 23.48139 0.335 9.49315 C ? A ? 24 CB 1
   ATOM 679 CG B ARG A 25 ? 17.00048 -22.09171 22.96730 0.335 9.97026 C ? A ? 24 CG 1
   ATOM 680 CD B ARG A 25 ? 17.42336 -20.73334 23.52362 0.335 9.75668 C ? A ? 24 CD 1
   ATOM 681 NE B ARG A 25 ? 18.79401 -20.39346 23.14556 0.335 9.21061 N ? A ? 24 NE 1
   ATOM 682 CZ B ARG A 25 ? 19.45148 -19.34547 23.62384 0.335 9.67629 C ? A ? 24 CZ 1
   ATOM 683 NH1 B ARG A 25 ? 18.89318 -18.52161 24.49661 0.335 10.67870 N ? A ? 24 NH1 1
   ATOM 684 NH2 B ARG A 25 ? 20.69654 -19.11432 23.21608 0.335 9.62018 N ? A ? 24 NH2 1
   ATOM 685 H B ARG A 25 ? 18.01176 -24.12459 21.17868 0.335 10.29390 H ? A ? 24 H 1
   ATOM 686 HA B ARG A 25 ? 17.97792 -25.25518 23.53554 0.335 12.06005 H ? A ? 24 HA 1
   ATOM 687 HB2 B ARG A 25 ? 17.85703 -23.18078 24.45063 0.335 11.36848 H ? A ? 24 HB2 1
   ATOM 688 HB3 B ARG A 25 ? 18.78311 -23.04170 23.16671 0.335 11.36848 H ? A ? 24 HB3 1
   ATOM 689 HG2 B ARG A 25 ? 17.06127 -22.05552 21.99989 0.335 11.94101 H ? A ? 24 HG2 1
   ATOM 690 HG3 B ARG A 25 ? 16.08331 -22.25736 23.23611 0.335 11.94101 H ? A ? 24 HG3 1
   ATOM 691 HD2 B ARG A 25 ? 16.83316 -20.04714 23.17479 0.335 11.68471 H ? A ? 24 HD2 1
   ATOM 692 HD3 B ARG A 25 ? 17.37185 -20.75432 24.49203 0.335 11.68471 H ? A ? 24 HD3 1
   ATOM 693 HE B ARG A 25 ? 19.19694 -20.90189 22.58098 0.335 11.02944 H ? A ? 24 HE 1
   ATOM 694 HH11 B ARG A 25 ? 18.08802 -18.66061 24.76492 0.335 12.79114 H ? A ? 24 HH11 1
   ATOM 695 HH12 B ARG A 25 ? 19.33562 -17.84737 24.79533 0.335 12.79114 H ? A ? 24 HH12 1
   ATOM 696 HH21 B ARG A 25 ? 21.06778 -19.64209 22.64753 0.335 11.52091 H ? A ? 24 HH21 1
   ATOM 697 HH22 B ARG A 25 ? 21.13016 -18.43714 23.52103 0.335 11.52091 H ? A ? 24 HH22 1
   ATOM 698 N . MET A 26 ? 15.10021 -24.78209 22.34215 1.000 8.86050 N ? A ? 25 N 1
   ATOM 699 CA . MET A 26 ? 13.68877 -25.06193 22.53160 1.000 9.20447 C ? A ? 25 CA 1
   ATOM 700 C . MET A 26 ? 13.36598 -26.54041 22.54508 1.000 9.75722 C ? A ? 25 C 1
   ATOM 701 O . MET A 26 ? 12.22215 -26.85845 22.89408 1.000 10.10814 O ? A ? 25 O 1
   ATOM 702 CB . MET A 26 ? 12.85383 -24.34467 21.47012 1.000 9.69825 C ? A ? 25 CB 1
   ATOM 703 CG . MET A 26 ? 12.93916 -22.82247 21.56522 1.000 10.07302 C ? A ? 25 CG 1
   ATOM 704 SD . MET A 26 ? 11.85995 -21.94820 20.43306 1.000 10.14487 S ? A ? 25 SD 1
   ATOM 705 CE . MET A 26 ? 12.67344 -22.32848 18.88095 1.000 10.60710 C ? A ? 25 CE 1
   ATOM 706 HA . MET A 26 ? 13.42393 -24.69644 23.39018 1.000 11.02206 H ? A ? 25 HA 1
   ATOM 707 HB2 . MET A 26 ? 13.17023 -24.60714 20.59154 1.000 11.61460 H ? A ? 25 HB2 1
   ATOM 708 HB3 . MET A 26 ? 11.92391 -24.59888 21.57746 1.000 11.61460 H ? A ? 25 HB3 1
   ATOM 709 HG2 . MET A 26 ? 12.69799 -22.55442 22.46572 1.000 12.06433 H ? A ? 25 HG2 1
   ATOM 710 HG3 . MET A 26 ? 13.84975 -22.55058 21.37079 1.000 12.06433 H ? A ? 25 HG3 1
   ATOM 711 HE1 . MET A 26 ? 12.19513 -21.89228 18.15855 1.000 12.70522 H ? A ? 25 HE1 1
   ATOM 712 HE2 . MET A 26 ? 13.58714 -22.00468 18.91565 1.000 12.70522 H ? A ? 25 HE2 1
   ATOM 713 HE3 . MET A 26 ? 12.66783 -23.28939 18.74859 1.000 12.70522 H ? A ? 25 HE3 1
   ATOM 714 H A MET A 26 ? 15.34134 -24.69907 21.52083 0.665 10.60929 H ? A ? 25 H 1
   ATOM 715 H B MET A 26 ? 15.30452 -24.57504 21.53284 0.335 10.60929 H ? A ? 25 H 1
   ATOM 716 N . THR A 27 ? 14.31881 -27.42704 22.23914 1.000 9.95571 N ? A ? 26 N 1
   ATOM 717 CA . THR A 27 ? 14.00747 -28.85047 22.23069 1.000 10.98416 C ? A ? 26 CA 1
   ATOM 718 C . THR A 27 ? 13.38346 -29.30244 23.55057 1.000 9.99376 C ? A ? 26 C 1
   ATOM 719 O . THR A 27 ? 12.36301 -30.01826 23.52554 1.000 10.46809 O ? A ? 26 O 1
   ATOM 720 CB . THR A 27 ? 15.26570 -29.65226 21.87231 1.000 10.80130 C ? A ? 26 CB 1
   ATOM 721 OG1 . THR A 27 ? 15.69320 -29.26935 20.56898 1.000 12.16418 O ? A ? 26 OG1 1
   ATOM 722 CG2 . THR A 27 ? 14.99180 -31.15488 21.88842 1.000 15.31288 C ? A ? 26 CG2 1
   ATOM 723 H . THR A 27 ? 15.13165 -27.23056 22.03844 1.000 11.92355 H ? A ? 26 H 1
   ATOM 724 HA . THR A 27 ? 13.36220 -29.02622 21.52810 1.000 13.15769 H ? A ? 26 HA 1
   ATOM 725 HB . THR A 27 ? 15.96063 -29.47309 22.52490 1.000 12.93826 H ? A ? 26 HB 1
   ATOM 726 HG1 . THR A 27 ? 15.91516 -28.45921 20.56588 1.000 14.57372 H ? A ? 26 HG1 1
   ATOM 727 HG21 . THR A 27 ? 15.72214 -31.62983 21.46189 1.000 18.35216 H ? A ? 26 HG21 1
   ATOM 728 HG22 . THR A 27 ? 14.90511 -31.46652 22.80290 1.000 18.35216 H ? A ? 26 HG22 1
   ATOM 729 HG23 . THR A 27 ? 14.16968 -31.34739 21.41098 1.000 18.35216 H ? A ? 26 HG23 1
   ATOM 730 N . PRO A 28 ? 13.92071 -28.94673 24.72263 1.000 10.10774 N ? A ? 27 N 1
   ATOM 731 CA . PRO A 28 ? 13.30875 -29.45094 25.96354 1.000 10.59723 C ? A ? 27 CA 1
   ATOM 732 C . PRO A 28 ? 11.90733 -28.91960 26.16563 1.000 9.84064 C ? A ? 27 C 1
   ATOM 733 O . PRO A 28 ? 11.09235 -29.59406 26.81704 1.000 10.43554 O ? A ? 27 O 1
   ATOM 734 CB . PRO A 28 ? 14.26026 -28.96742 27.06992 1.000 12.46927 C ? A ? 27 CB 1
   ATOM 735 CG . PRO A 28 ? 15.55923 -28.65830 26.36160 1.000 13.03549 C ? A ? 27 CG 1
   ATOM 736 CD . PRO A 28 ? 15.16376 -28.18582 24.98350 1.000 10.24040 C ? A ? 27 CD 1
   ATOM 737 HA . PRO A 28 ? 13.30264 -30.42092 25.96558 1.000 12.69337 H ? A ? 27 HA 1
   ATOM 738 HB2 . PRO A 28 ? 13.89807 -28.17323 27.49298 1.000 14.93982 H ? A ? 27 HB2 1
   ATOM 739 HB3 . PRO A 28 ? 14.38275 -29.66808 27.72944 1.000 14.93982 H ? A ? 27 HB3 1
   ATOM 740 HG2 . PRO A 28 ? 16.03749 -27.96341 26.84045 1.000 15.61928 H ? A ? 27 HG2 1
   ATOM 741 HG3 . PRO A 28 ? 16.10349 -29.45947 26.30859 1.000 15.61928 H ? A ? 27 HG3 1
   ATOM 742 HD2 . PRO A 28 ? 14.99398 -27.23080 24.97903 1.000 12.26518 H ? A ? 27 HD2 1
   ATOM 743 HD3 . PRO A 28 ? 15.84809 -28.40417 24.33164 1.000 12.26518 H ? A ? 27 HD3 1
   ATOM 744 N A VAL A 29 ? 11.61217 -27.72200 25.65586 0.291 9.45096 N ? A ? 28 N 1
   ATOM 745 CA A VAL A 29 ? 10.26852 -27.16795 25.76697 0.291 9.74180 C ? A ? 28 CA 1
   ATOM 746 C A VAL A 29 ? 9.30433 -27.95200 24.88753 0.291 9.06324 C ? A ? 28 C 1
   ATOM 747 O A VAL A 29 ? 8.20546 -28.32909 25.31452 0.291 10.05582 O ? A ? 28 O 1
   ATOM 748 CB A VAL A 29 ? 10.27941 -25.67327 25.39536 0.291 9.77277 C ? A ? 28 CB 1
   ATOM 749 CG1 A VAL A 29 ? 8.87405 -25.09102 25.47608 0.291 11.07098 C ? A ? 28 CG1 1
   ATOM 750 CG2 A VAL A 29 ? 11.22920 -24.90109 26.29201 0.291 11.26205 C ? A ? 28 CG2 1
   ATOM 751 H A VAL A 29 ? 12.17079 -27.21464 25.24340 0.291 11.31785 H ? A ? 28 H 1
   ATOM 752 HA A VAL A 29 ? 9.97141 -27.24865 26.68681 0.291 11.66687 H ? A ? 28 HA 1
   ATOM 753 HB A VAL A 29 ? 10.59237 -25.58473 24.48151 0.291 11.70403 H ? A ? 28 HB 1
   ATOM 754 HG11 A VAL A 29 ? 8.93126 -24.12306 25.44971 0.291 13.26187 H ? A ? 28 HG11 1
   ATOM 755 HG12 A VAL A 29 ? 8.35529 -25.41237 24.72207 0.291 13.26187 H ? A ? 28 HG12 1
   ATOM 756 HG13 A VAL A 29 ? 8.46158 -25.37549 26.30664 0.291 13.26187 H ? A ? 28 HG13 1
   ATOM 757 HG21 A VAL A 29 ? 11.15970 -23.95578 26.08596 0.291 13.49116 H ? A ? 28 HG21 1
   ATOM 758 HG22 A VAL A 29 ? 10.98588 -25.05655 27.21804 0.291 13.49116 H ? A ? 28 HG22 1
   ATOM 759 HG23 A VAL A 29 ? 12.13506 -25.20881 26.13189 0.291 13.49116 H ? A ? 28 HG23 1
   ATOM 760 N B VAL A 29 ? 11.60758 -27.72978 25.63626 0.117 9.45272 N ? A ? 28 N 1
   ATOM 761 CA B VAL A 29 ? 10.26879 -27.16559 25.76337 0.117 9.72112 C ? A ? 28 CA 1
   ATOM 762 C B VAL A 29 ? 9.28777 -27.91806 24.87391 0.117 9.24958 C ? A ? 28 C 1
   ATOM 763 O B VAL A 29 ? 8.16558 -28.23574 25.28299 0.117 9.94150 O ? A ? 28 O 1
   ATOM 764 CB B VAL A 29 ? 10.28798 -25.66180 25.43539 0.117 9.94553 C ? A ? 28 CB 1
   ATOM 765 CG1 B VAL A 29 ? 8.88997 -25.06810 25.58631 0.117 10.67083 C ? A ? 28 CG1 1
   ATOM 766 CG2 B VAL A 29 ? 11.28426 -24.92778 26.31544 0.117 11.07098 C ? A ? 28 CG2 1
   ATOM 767 H B VAL A 29 ? 12.16019 -27.23436 25.20178 0.117 11.31997 H ? A ? 28 H 1
   ATOM 768 HA B VAL A 29 ? 9.97763 -27.26886 26.68286 0.117 11.64204 H ? A ? 28 HA 1
   ATOM 769 HB B VAL A 29 ? 10.56900 -25.54699 24.51411 0.117 11.91134 H ? A ? 28 HB 1
   ATOM 770 HG11 B VAL A 29 ? 8.95098 -24.10107 25.54121 0.117 12.78170 H ? A ? 28 HG11 1
   ATOM 771 HG12 B VAL A 29 ? 8.32758 -25.39791 24.86809 0.117 12.78170 H ? A ? 28 HG12 1
   ATOM 772 HG13 B VAL A 29 ? 8.52359 -25.33681 26.44332 0.117 12.78170 H ? A ? 28 HG13 1
   ATOM 773 HG21 B VAL A 29 ? 11.20173 -23.97415 26.15839 0.117 13.26188 H ? A ? 28 HG21 1
   ATOM 774 HG22 B VAL A 29 ? 11.09194 -25.12781 27.24491 0.117 13.26188 H ? A ? 28 HG22 1
   ATOM 775 HG23 B VAL A 29 ? 12.18071 -25.22344 26.09211 0.117 13.26188 H ? A ? 28 HG23 1
   ATOM 776 N C VAL A 29 ? 11.60204 -27.72417 25.65852 0.592 9.38194 N ? A ? 28 N 1
   ATOM 777 CA C VAL A 29 ? 10.25684 -27.17534 25.78977 0.592 9.67998 C ? A ? 28 CA 1
   ATOM 778 C C VAL A 29 ? 9.29541 -27.94505 24.88877 0.592 9.07579 C ? A ? 28 C 1
   ATOM 779 O C VAL A 29 ? 8.19943 -28.34677 25.30896 0.592 9.77601 O ? A ? 28 O 1
   ATOM 780 CB C VAL A 29 ? 10.27548 -25.66803 25.46466 0.592 10.15724 C ? A ? 28 CB 1
   ATOM 781 CG1 C VAL A 29 ? 8.86507 -25.12792 25.38547 0.592 11.77268 C ? A ? 28 CG1 1
   ATOM 782 CG2 C VAL A 29 ? 11.09457 -24.89489 26.50268 0.592 9.46483 C ? A ? 28 CG2 1
   ATOM 783 H C VAL A 29 ? 12.15287 -27.21561 25.23715 0.591 11.23502 H ? A ? 28 H 1
   ATOM 784 HA C VAL A 29 ? 9.95113 -27.27800 26.70459 0.591 11.59268 H ? A ? 28 HA 1
   ATOM 785 HB C VAL A 29 ? 10.69833 -25.54195 24.60083 0.591 12.16539 H ? A ? 28 HB 1
   ATOM 786 HG11 C VAL A 29 ? 8.88954 -24.16411 25.49211 0.591 14.10391 H ? A ? 28 HG11 1
   ATOM 787 HG12 C VAL A 29 ? 8.48775 -25.35564 24.52137 0.591 14.10391 H ? A ? 28 HG12 1
   ATOM 788 HG13 C VAL A 29 ? 8.33438 -25.52567 26.09333 0.591 14.10391 H ? A ? 28 HG13 1
   ATOM 789 HG21 C VAL A 29 ? 11.07935 -23.95141 26.27797 0.591 11.33450 H ? A ? 28 HG21 1
   ATOM 790 HG22 C VAL A 29 ? 10.70354 -25.03240 27.37966 0.591 11.33450 H ? A ? 28 HG22 1
   ATOM 791 HG23 C VAL A 29 ? 12.00745 -25.22267 26.49247 0.591 11.33450 H ? A ? 28 HG23 1
   ATOM 792 N . VAL A 30 ? 9.68051 -28.18633 23.62938 1.000 10.00161 N ? A ? 29 N 1
   ATOM 793 CA . VAL A 30 ? 8.77524 -28.92986 22.74192 1.000 11.42887 C ? A ? 29 CA 1
   ATOM 794 C . VAL A 30 ? 8.55292 -30.35351 23.24583 1.000 11.42301 C ? A ? 29 C 1
   ATOM 795 O . VAL A 30 ? 7.47546 -30.93289 23.03490 1.000 13.32075 O ? A ? 29 O 1
   ATOM 796 HA . VAL A 30 ? 7.92323 -28.46733 22.77425 1.000 13.69134 H ? A ? 29 HA 1
   ATOM 797 CB A VAL A 30 ? 9.22807 -28.91574 21.26830 0.295 15.98323 C ? A ? 29 CB 1
   ATOM 798 CG1 A VAL A 30 ? 9.69676 -27.53223 20.86280 0.295 13.39138 C ? A ? 29 CG1 1
   ATOM 799 CG2 A VAL A 30 ? 10.31977 -29.94618 21.01861 0.295 21.75645 C ? A ? 29 CG2 1
   ATOM 800 H A VAL A 30 ? 10.42380 -27.93727 23.27570 0.291 11.97863 H ? A ? 29 H 1
   ATOM 801 HB A VAL A 30 ? 8.46677 -29.15148 20.71535 0.295 19.15657 H ? A ? 29 HB 1
   ATOM 802 HG11 A VAL A 30 ? 9.66307 -27.45807 19.89622 0.295 16.04635 H ? A ? 29 HG11 1
   ATOM 803 HG12 A VAL A 30 ? 9.11331 -26.87039 21.26586 0.295 16.04635 H ? A ? 29 HG12 1
   ATOM 804 HG13 A VAL A 30 ? 10.60681 -27.40360 21.17289 0.295 16.04635 H ? A ? 29 HG13 1
   ATOM 805 HG21 A VAL A 30 ? 10.70278 -29.79401 20.14051 0.295 26.08444 H ? A ? 29 HG21 1
   ATOM 806 HG22 A VAL A 30 ? 11.00461 -29.85191 21.69906 0.295 26.08444 H ? A ? 29 HG22 1
   ATOM 807 HG23 A VAL A 30 ? 9.93155 -30.83410 21.06080 0.295 26.08444 H ? A ? 29 HG23 1
   ATOM 808 CB B VAL A 30 ? 9.20094 -28.88580 21.26201 0.705 15.88581 C ? A ? 29 CB 1
   ATOM 809 CG1 B VAL A 30 ? 9.04731 -27.48003 20.70024 0.705 14.25083 C ? A ? 29 CG1 1
   ATOM 810 CG2 B VAL A 30 ? 10.61780 -29.35538 21.10119 0.705 24.11394 C ? A ? 29 CG2 1
   ATOM 811 H B VAL A 30 ? 10.43481 -27.96025 23.28366 0.117 11.97863 H ? A ? 29 H 1
   ATOM 812 HB B VAL A 30 ? 8.62327 -29.48156 20.75974 0.705 19.03967 H ? A ? 29 HB 1
   ATOM 813 HG11 B VAL A 30 ? 9.35187 -27.47293 19.77932 0.705 17.07770 H ? A ? 29 HG11 1
   ATOM 814 HG12 B VAL A 30 ? 8.11267 -27.22385 20.74152 0.705 17.07770 H ? A ? 29 HG12 1
   ATOM 815 HG13 B VAL A 30 ? 9.58175 -26.86805 21.23011 0.705 17.07770 H ? A ? 29 HG13 1
   ATOM 816 HG21 B VAL A 30 ? 10.81526 -29.44545 20.15578 0.705 28.91343 H ? A ? 29 HG21 1
   ATOM 817 HG22 B VAL A 30 ? 11.21387 -28.70412 21.50301 0.705 28.91343 H ? A ? 29 HG22 1
   ATOM 818 HG23 B VAL A 30 ? 10.71840 -30.21289 21.54328 0.705 28.91343 H ? A ? 29 HG23 1
   ATOM 819 H C VAL A 30 ? 10.42685 -27.94193 23.27888 0.591 11.97863 H ? A ? 29 H 1
   ATOM 820 N . LYS A 31 ? 9.53684 -30.93977 23.90968 1.000 10.79814 N ? A ? 30 N 1
   ATOM 821 CA . LYS A 31 ? 9.39537 -32.26689 24.49801 1.000 11.32210 C ? A ? 30 CA 1
   ATOM 822 C . LYS A 31 ? 8.68540 -32.24953 25.84473 1.000 11.41821 C ? A ? 30 C 1
   ATOM 823 O . LYS A 31 ? 8.38600 -33.33069 26.37456 1.000 14.03497 O ? A ? 30 O 1
   ATOM 824 CB . LYS A 31 ? 10.76635 -32.91928 24.65617 1.000 13.75042 C ? A ? 30 CB 1
   ATOM 825 CG . LYS A 31 ? 11.42261 -33.31128 23.36388 1.000 15.48640 C ? A ? 30 CG 1
   ATOM 826 CD . LYS A 31 ? 12.70188 -34.04035 23.61436 1.000 22.12523 C ? A ? 30 CD 1
   ATOM 827 CE . LYS A 31 ? 13.25013 -34.59448 22.32076 1.000 35.89025 C ? A ? 30 CE 1
   ATOM 828 NZ . LYS A 31 ? 14.64629 -35.09817 22.51828 1.000 39.33490 N ? A ? 30 NZ 1
   ATOM 829 H . LYS A 31 ? 10.31041 -30.58626 24.03703 1.000 12.93446 H ? A ? 30 H 1
   ATOM 830 HA . LYS A 31 ? 8.87058 -32.81518 23.89397 1.000 13.56322 H ? A ? 30 HA 1
   ATOM 831 HB2 . LYS A 31 ? 11.35583 -32.29406 25.10617 1.000 16.47721 H ? A ? 30 HB2 1
   ATOM 832 HB3 . LYS A 31 ? 10.66610 -33.72330 25.18945 1.000 16.47721 H ? A ? 30 HB3 1
   ATOM 833 HG2 . LYS A 31 ? 10.82983 -33.89390 22.86381 1.000 18.56038 H ? A ? 30 HG2 1
   ATOM 834 HG3 . LYS A 31 ? 11.61922 -32.51479 22.84635 1.000 18.56038 H ? A ? 30 HG3 1
   ATOM 835 HD2 . LYS A 31 ? 13.35546 -33.43146 23.99250 1.000 26.52697 H ? A ? 30 HD2 1
   ATOM 836 HD3 . LYS A 31 ? 12.54297 -34.77734 24.22468 1.000 26.52697 H ? A ? 30 HD3 1
   ATOM 837 HE2 . LYS A 31 ? 12.69473 -35.33117 22.02124 1.000 43.04500 H ? A ? 30 HE2 1
   ATOM 838 HE3 . LYS A 31 ? 13.26538 -33.89569 21.64818 1.000 43.04500 H ? A ? 30 HE3 1
   ATOM 839 HZ1 . LYS A 31 ? 14.89301 -35.59273 21.82068 1.000 47.17858 H ? A ? 30 HZ1 1
   ATOM 840 HZ2 . LYS A 31 ? 15.20840 -34.41298 22.59982 1.000 47.17858 H ? A ? 30 HZ2 1
   ATOM 841 HZ3 . LYS A 31 ? 14.68895 -35.59599 23.25479 1.000 47.17858 H ? A ? 30 HZ3 1
   ATOM 842 N A GLY A 32 ? 8.45149 -31.09110 26.43796 0.539 11.78256 N ? A ? 31 N 1
   ATOM 843 CA A GLY A 32 ? 7.83886 -31.02110 27.75169 0.539 10.71104 C ? A ? 31 CA 1
   ATOM 844 C A GLY A 32 ? 8.78041 -31.25804 28.90621 0.539 9.25700 C ? A ? 31 C 1
   ATOM 845 O A GLY A 32 ? 8.32334 -31.27226 30.05649 0.539 11.09263 O ? A ? 31 O 1
   ATOM 846 H A GLY A 32 ? 8.64031 -30.32454 26.09689 0.539 14.11577 H ? A ? 31 H 1
   ATOM 847 HA2 A GLY A 32 ? 7.44792 -30.14064 27.86511 0.539 12.82994 H ? A ? 31 HA2 1
   ATOM 848 HA3 A GLY A 32 ? 7.13593 -31.68762 27.80206 0.539 12.82994 H ? A ? 31 HA3 1
   ATOM 849 N B GLY A 32 ? 8.42054 -31.08262 26.41115 0.461 11.75265 N ? A ? 31 N 1
   ATOM 850 CA B GLY A 32 ? 7.76840 -30.98738 27.70022 0.461 10.46724 C ? A ? 31 CA 1
   ATOM 851 C B GLY A 32 ? 8.66721 -31.19203 28.89407 0.461 10.44763 C ? A ? 31 C 1
   ATOM 852 O B GLY A 32 ? 8.17110 -31.18237 30.02411 0.461 9.16864 O ? A ? 31 O 1
   ATOM 853 H B GLY A 32 ? 8.61279 -30.32095 26.06115 0.461 14.07988 H ? A ? 31 H 1
   ATOM 854 HA2 B GLY A 32 ? 7.36947 -30.10682 27.78013 0.461 12.53738 H ? A ? 31 HA2 1
   ATOM 855 HA3 B GLY A 32 ? 7.06745 -31.65659 27.74184 0.461 12.53738 H ? A ? 31 HA3 1
   ATOM 856 N A GLN A 33 ? 10.07640 -31.44312 28.64039 0.539 10.97657 N ? A ? 32 N 1
   ATOM 857 CA A GLN A 33 ? 11.05722 -31.58494 29.71001 0.539 9.79030 C ? A ? 32 CA 1
   ATOM 858 C A GLN A 33 ? 11.30694 -30.27599 30.44845 0.539 10.04062 C ? A ? 32 C 1
   ATOM 859 O A GLN A 33 ? 11.72555 -30.29961 31.60941 0.539 12.10994 O ? A ? 32 O 1
   ATOM 860 CB A GLN A 33 ? 12.37667 -32.11474 29.12903 0.539 10.81487 C ? A ? 32 CB 1
   ATOM 861 CG A GLN A 33 ? 12.25034 -33.46152 28.44719 0.539 13.97083 C ? A ? 32 CG 1
   ATOM 862 CD A GLN A 33 ? 13.43604 -33.79348 27.55217 0.539 21.08901 C ? A ? 32 CD 1
   ATOM 863 OE1 A GLN A 33 ? 14.20953 -32.90282 27.15184 0.539 20.31435 O ? A ? 32 OE1 1
   ATOM 864 NE2 A GLN A 33 ? 13.58930 -35.09548 27.23278 0.539 33.56196 N ? A ? 32 NE2 1
   ATOM 865 H A GLN A 33 ? 10.41012 -31.48978 27.84915 0.539 13.14858 H ? A ? 32 H 1
   ATOM 866 HA A GLN A 33 ? 10.72589 -32.22772 30.35650 0.539 11.72506 H ? A ? 32 HA 1
   ATOM 867 HB2 A GLN A 33 ? 12.70437 -31.48059 28.47224 0.539 12.95455 H ? A ? 32 HB2 1
   ATOM 868 HB3 A GLN A 33 ? 13.01906 -32.20758 29.84988 0.539 12.95455 H ? A ? 32 HB3 1
   ATOM 869 HG2 A GLN A 33 ? 12.18582 -34.15236 29.12503 0.539 16.74169 H ? A ? 32 HG2 1
   ATOM 870 HG3 A GLN A 33 ? 11.45185 -33.46150 27.89644 0.539 16.74169 H ? A ? 32 HG3 1
   ATOM 871 HE21 A GLN A 33 ? 13.03401 -35.67994 27.53222 0.539 40.25105 H ? A ? 32 HE21 1
   ATOM 872 HE22 A GLN A 33 ? 14.24227 -35.34086 26.72977 0.539 40.25105 H ? A ? 32 HE22 1
   ATOM 873 N B GLN A 33 ? 9.96575 -31.38257 28.68346 0.461 9.99649 N ? A ? 32 N 1
   ATOM 874 CA B GLN A 33 ? 10.91819 -31.58232 29.76778 0.461 10.63346 C ? A ? 32 CA 1
   ATOM 875 C B GLN A 33 ? 11.34938 -30.27877 30.42370 0.461 9.57962 C ? A ? 32 C 1
   ATOM 876 O B GLN A 33 ? 11.92876 -30.32013 31.51157 0.461 10.53007 O ? A ? 32 O 1
   ATOM 877 CB B GLN A 33 ? 12.13542 -32.34990 29.24300 0.461 11.41028 C ? A ? 32 CB 1
   ATOM 878 CG B GLN A 33 ? 11.78089 -33.74086 28.75608 0.461 13.55831 C ? A ? 32 CG 1
   ATOM 879 CD B GLN A 33 ? 12.90748 -34.38505 27.99168 0.461 21.89206 C ? A ? 32 CD 1
   ATOM 880 OE1 B GLN A 33 ? 14.06773 -34.02585 28.15292 0.461 28.21770 O ? A ? 32 OE1 1
   ATOM 881 NE2 B GLN A 33 ? 12.56671 -35.36214 27.15339 0.461 24.08680 N ? A ? 32 NE2 1
   ATOM 882 H B GLN A 33 ? 10.32781 -31.40077 27.90360 0.461 11.97249 H ? A ? 32 H 1
   ATOM 883 HA B GLN A 33 ? 10.50843 -32.12344 30.46074 0.461 12.73685 H ? A ? 32 HA 1
   ATOM 884 HB2 B GLN A 33 ? 12.52199 -31.86027 28.50022 0.461 13.66904 H ? A ? 32 HB2 1
   ATOM 885 HB3 B GLN A 33 ? 12.78605 -32.43756 29.95707 0.461 13.66904 H ? A ? 32 HB3 1
   ATOM 886 HG2 B GLN A 33 ? 11.57525 -34.30199 29.52011 0.461 16.24668 H ? A ? 32 HG2 1
   ATOM 887 HG3 B GLN A 33 ? 11.01102 -33.68508 28.16864 0.461 16.24668 H ? A ? 32 HG3 1
   ATOM 888 HE21 B GLN A 33 ? 11.74180 -35.59169 27.07315 0.461 28.88086 H ? A ? 32 HE21 1
   ATOM 889 HE22 B GLN A 33 ? 13.17156 -35.76357 26.69228 0.461 28.88086 H ? A ? 32 HE22 1
   ATOM 890 N A ALA A 34 ? 11.05360 -29.14984 29.80687 0.539 9.86669 N ? A ? 33 N 1
   ATOM 891 CA A ALA A 34 ? 11.16489 -27.83360 30.40246 0.539 9.29194 C ? A ? 33 CA 1
   ATOM 892 C A ALA A 34 ? 9.81951 -27.14760 30.23239 0.539 10.20155 C ? A ? 33 C 1
   ATOM 893 O A ALA A 34 ? 9.08085 -27.46485 29.29484 0.539 9.51455 O ? A ? 33 O 1
   ATOM 894 CB A ALA A 34 ? 12.27035 -27.02308 29.70956 0.539 9.43817 C ? A ? 33 CB 1
   ATOM 895 H A ALA A 34 ? 10.80315 -29.12153 28.98464 0.539 11.81672 H ? A ? 33 H 1
   ATOM 896 HA A ALA A 34 ? 11.38719 -27.87747 31.34562 0.539 11.12702 H ? A ? 33 HA 1
   ATOM 897 HB1 A ALA A 34 ? 12.33095 -26.14989 30.12763 0.539 11.30251 H ? A ? 33 HB1 1
   ATOM 898 HB2 A ALA A 34 ? 13.11319 -27.49395 29.80341 0.539 11.30251 H ? A ? 33 HB2 1
   ATOM 899 HB3 A ALA A 34 ? 12.04880 -26.92544 28.77027 0.539 11.30251 H ? A ? 33 HB3 1
   ATOM 900 N B ALA A 34 ? 11.05125 -29.14164 29.80507 0.461 9.80130 N ? A ? 33 N 1
   ATOM 901 CA B ALA A 34 ? 11.16575 -27.81249 30.36007 0.461 9.47808 C ? A ? 33 CA 1
   ATOM 902 C B ALA A 34 ? 9.81103 -27.14068 30.22905 0.461 10.20731 C ? A ? 33 C 1
   ATOM 903 O B ALA A 34 ? 9.05552 -27.45841 29.30770 0.461 9.93685 O ? A ? 33 O 1
   ATOM 904 CB B ALA A 34 ? 12.20912 -26.99044 29.59218 0.461 10.53453 C ? A ? 33 CB 1
   ATOM 905 H B ALA A 34 ? 10.75712 -29.11878 28.99726 0.461 11.73826 H ? A ? 33 H 1
   ATOM 906 HA B ALA A 34 ? 11.43818 -27.84124 31.29059 0.461 11.35039 H ? A ? 33 HA 1
   ATOM 907 HB1 B ALA A 34 ? 12.26053 -26.10320 29.98086 0.461 12.61814 H ? A ? 33 HB1 1
   ATOM 908 HB2 B ALA A 34 ? 13.07045 -27.43143 29.65942 0.461 12.61814 H ? A ? 33 HB2 1
   ATOM 909 HB3 B ALA A 34 ? 11.94064 -26.92907 28.66210 0.461 12.61814 H ? A ? 33 HB3 1
   ATOM 910 N . PRO A 35 ? 9.47701 -26.20112 31.11463 1.000 10.45349 N ? A ? 34 N 1
   ATOM 911 CA . PRO A 35 ? 8.15032 -25.58016 31.04717 1.000 10.52159 C ? A ? 34 CA 1
   ATOM 912 C . PRO A 35 ? 7.99049 -24.69615 29.82678 1.000 8.76953 C ? A ? 34 C 1
   ATOM 913 O . PRO A 35 ? 8.96378 -24.14291 29.28934 1.000 9.42241 O ? A ? 34 O 1
   ATOM 914 CB . PRO A 35 ? 8.07075 -24.75349 32.33826 1.000 12.91675 C ? A ? 34 CB 1
   ATOM 915 CG . PRO A 35 ? 9.46247 -24.57766 32.80192 1.000 13.55080 C ? A ? 34 CG 1
   ATOM 916 CD . PRO A 35 ? 10.26717 -25.73483 32.27813 1.000 11.62143 C ? A ? 34 CD 1
   ATOM 917 HA . PRO A 35 ? 7.46097 -26.26258 31.04577 1.000 12.60261 H ? A ? 34 HA 1
   ATOM 918 HB2 . PRO A 35 ? 7.66124 -23.89461 32.14975 1.000 15.47680 H ? A ? 34 HB2 1
   ATOM 919 HB3 . PRO A 35 ? 7.54720 -25.23267 32.99946 1.000 15.47680 H ? A ? 34 HB3 1
   ATOM 920 HG2 . PRO A 35 ? 9.81128 -23.74102 32.45659 1.000 16.23766 H ? A ? 34 HG2 1
   ATOM 921 HG3 . PRO A 35 ? 9.47765 -24.56833 33.77175 1.000 16.23766 H ? A ? 34 HG3 1
   ATOM 922 HD2 . PRO A 35 ? 11.15020 -25.44400 32.00143 1.000 13.92242 H ? A ? 34 HD2 1
   ATOM 923 HD3 . PRO A 35 ? 10.34237 -26.43363 32.94665 1.000 13.92242 H ? A ? 34 HD3 1
   ATOM 924 N . TYR A 36 ? 6.74051 -24.49920 29.43760 1.000 10.09619 N ? A ? 35 N 1
   ATOM 925 CA . TYR A 36 ? 6.37770 -23.65668 28.30818 1.000 10.25206 C ? A ? 35 CA 1
   ATOM 926 C . TYR A 36 ? 5.89890 -22.31037 28.84982 1.000 9.69860 C ? A ? 35 C 1
   ATOM 927 O . TYR A 36 ? 4.79485 -22.21730 29.42619 1.000 11.39955 O ? A ? 35 O 1
   ATOM 928 CB . TYR A 36 ? 5.26934 -24.28272 27.46664 1.000 10.90720 C ? A ? 35 CB 1
   ATOM 929 CG . TYR A 36 ? 4.78186 -23.38188 26.34623 1.000 10.13097 C ? A ? 35 CG 1
   ATOM 930 CD1 . TYR A 36 ? 5.67656 -22.72073 25.49687 1.000 10.13083 C ? A ? 35 CD1 1
   ATOM 931 CD2 . TYR A 36 ? 3.44057 -23.13895 26.17133 1.000 11.53604 C ? A ? 35 CD2 1
   ATOM 932 CE1 . TYR A 36 ? 5.23022 -21.91306 24.48062 1.000 11.49206 C ? A ? 35 CE1 1
   ATOM 933 CE2 . TYR A 36 ? 2.97758 -22.31892 25.17376 1.000 10.68487 C ? A ? 35 CE2 1
   ATOM 934 CZ . TYR A 36 ? 3.88588 -21.71755 24.31751 1.000 10.25360 C ? A ? 35 CZ 1
   ATOM 935 OH . TYR A 36 ? 3.39324 -20.87806 23.33845 1.000 12.12411 O ? A ? 35 OH 1
   ATOM 936 H . TYR A 36 ? 6.06052 -24.85528 29.82544 1.000 12.09212 H ? A ? 35 H 1
   ATOM 937 HA . TYR A 36 ? 7.16414 -23.53664 27.75320 1.000 12.27917 H ? A ? 35 HA 1
   ATOM 938 HB2 . TYR A 36 ? 5.60366 -25.10079 27.06677 1.000 13.06534 H ? A ? 35 HB2 1
   ATOM 939 HB3 . TYR A 36 ? 4.51285 -24.47929 28.04108 1.000 13.06534 H ? A ? 35 HB3 1
   ATOM 940 HD1 . TYR A 36 ? 6.59131 -22.83078 25.62349 1.000 12.13370 H ? A ? 35 HD1 1
   ATOM 941 HD2 . TYR A 36 ? 2.82967 -23.54174 26.74531 1.000 13.81995 H ? A ? 35 HD2 1
   ATOM 942 HE1 . TYR A 36 ? 5.83663 -21.50210 23.90767 1.000 13.76717 H ? A ? 35 HE1 1
   ATOM 943 HE2 . TYR A 36 ? 2.06532 -22.16850 25.07345 1.000 12.79854 H ? A ? 35 HE2 1
   ATOM 944 HH . TYR A 36 ? 3.54147 -20.07750 23.54518 1.000 14.52563 H ? A ? 35 HH 1
   ATOM 945 N . ASP A 37 ? 6.65857 -21.25340 28.61712 1.000 10.54789 N ? A ? 36 N 1
   ATOM 946 CA . ASP A 37 ? 6.26309 -19.88418 28.90574 1.000 11.69450 C ? A ? 36 CA 1
   ATOM 947 C . ASP A 37 ? 6.09560 -19.22978 27.54825 1.000 9.50823 C ? A ? 36 C 1
   ATOM 948 O . ASP A 37 ? 7.06551 -19.03278 26.82011 1.000 10.29676 O ? A ? 36 O 1
   ATOM 949 H . ASP A 37 ? 7.44615 -21.30576 28.27569 1.000 12.63417 H ? A ? 36 H 1
   ATOM 950 HA . ASP A 37 ? 5.43421 -19.82528 29.40613 1.000 14.01010 H ? A ? 36 HA 1
   ATOM 951 CB A ASP A 37 ? 7.27635 -19.14501 29.75501 0.359 11.77418 C ? A ? 36 CB 1
   ATOM 952 CG A ASP A 37 ? 6.83588 -17.76154 30.02377 0.359 17.65554 C ? A ? 36 CG 1
   ATOM 953 OD1 A ASP A 37 ? 5.86230 -17.60789 30.80700 0.359 13.03780 O ? A ? 36 OD1 1
   ATOM 954 OD2 A ASP A 37 ? 7.39532 -16.84423 29.44494 0.359 8.67074 O ? A ? 36 OD2 1
   ATOM 955 HB2 A ASP A 37 ? 7.38223 -19.60372 30.60312 0.359 14.10572 H ? A ? 36 HB2 1
   ATOM 956 HB3 A ASP A 37 ? 8.12568 -19.11147 29.28768 0.359 14.10572 H ? A ? 36 HB3 1
   ATOM 957 CB B ASP A 37 ? 7.37356 -19.21141 29.71500 0.641 10.98403 C ? A ? 36 CB 1
   ATOM 958 CG B ASP A 37 ? 7.09959 -17.74329 30.02093 0.641 12.92873 C ? A ? 36 CG 1
   ATOM 959 OD1 B ASP A 37 ? 6.74821 -16.98734 29.09184 0.641 15.80798 O ? A ? 36 OD1 1
   ATOM 960 OD2 B ASP A 37 ? 7.26400 -17.33005 31.18856 0.641 23.16441 O ? A ? 36 OD2 1
   ATOM 961 HB2 B ASP A 37 ? 7.47133 -19.67732 30.56015 0.641 13.15753 H ? A ? 36 HB2 1
   ATOM 962 HB3 B ASP A 37 ? 8.20130 -19.26010 29.21163 0.641 13.15753 H ? A ? 36 HB3 1
   ATOM 963 N . ALA A 38 ? 4.85522 -18.90809 27.20956 1.000 10.01907 N ? A ? 37 N 1
   ATOM 964 CA . ALA A 38 ? 4.55098 -18.42613 25.86656 1.000 10.39980 C ? A ? 37 CA 1
   ATOM 965 C . ALA A 38 ? 5.33743 -17.18062 25.51814 1.000 8.98347 C ? A ? 37 C 1
   ATOM 966 O . ALA A 38 ? 5.81848 -17.03905 24.38876 1.000 10.11724 O ? A ? 37 O 1
   ATOM 967 CB . ALA A 38 ? 3.05654 -18.16405 25.69311 1.000 11.00055 C ? A ? 37 CB 1
   ATOM 968 H . ALA A 38 ? 4.17436 -18.95829 27.73255 1.000 11.99959 H ? A ? 37 H 1
   ATOM 969 HA . ALA A 38 ? 4.80251 -19.12978 25.24809 1.000 12.45646 H ? A ? 37 HA 1
   ATOM 970 HB1 . ALA A 38 ? 2.88956 -17.87983 24.78084 1.000 13.17736 H ? A ? 37 HB1 1
   ATOM 971 HB2 . ALA A 38 ? 2.56885 -18.98158 25.87938 1.000 13.17736 H ? A ? 37 HB2 1
   ATOM 972 HB3 . ALA A 38 ? 2.78410 -17.46816 26.31150 1.000 13.17736 H ? A ? 37 HB3 1
   ATOM 973 N . ALA A 39 ? 5.46216 -16.23783 26.45945 1.000 10.60351 N ? A ? 38 N 1
   ATOM 974 CA . ALA A 39 ? 6.18470 -15.00334 26.16811 1.000 10.59838 C ? A ? 38 CA 1
   ATOM 975 C . ALA A 39 ? 7.65981 -15.26425 25.92810 1.000 10.67222 C ? A ? 38 C 1
   ATOM 976 O . ALA A 39 ? 8.27825 -14.63723 25.04621 1.000 11.55672 O ? A ? 38 O 1
   ATOM 977 CB . ALA A 39 ? 6.01329 -14.00369 27.30165 1.000 11.83210 C ? A ? 38 CB 1
   ATOM 978 H . ALA A 39 ? 5.14359 -16.29007 27.25656 1.000 12.70092 H ? A ? 38 H 1
   ATOM 979 HA . ALA A 39 ? 5.80594 -14.61746 25.36278 1.000 12.69475 H ? A ? 38 HA 1
   ATOM 980 HB1 . ALA A 39 ? 6.53103 -13.20807 27.10206 1.000 14.17522 H ? A ? 38 HB1 1
   ATOM 981 HB2 . ALA A 39 ? 5.07395 -13.77551 27.38215 1.000 14.17522 H ? A ? 38 HB2 1
   ATOM 982 HB3 . ALA A 39 ? 6.32812 -14.40484 28.12679 1.000 14.17522 H ? A ? 38 HB3 1
   ATOM 983 N A GLN A 40 ? 8.24773 -16.18242 26.69111 0.312 11.05366 N ? A ? 39 N 1
   ATOM 984 CA A GLN A 40 ? 9.66653 -16.47671 26.53276 0.312 10.74325 C ? A ? 39 CA 1
   ATOM 985 C A GLN A 40 ? 9.94695 -17.12151 25.18130 0.312 8.02737 C ? A ? 39 C 1
   ATOM 986 O A GLN A 40 ? 10.98818 -16.86611 24.55910 0.312 6.64729 O ? A ? 39 O 1
   ATOM 987 CB A GLN A 40 ? 10.12713 -17.41436 27.65246 0.312 14.00207 C ? A ? 39 CB 1
   ATOM 988 CG A GLN A 40 ? 11.62701 -17.65647 27.64103 0.312 17.28013 C ? A ? 39 CG 1
   ATOM 989 CD A GLN A 40 ? 12.02163 -19.11610 27.73700 0.312 18.09759 C ? A ? 39 CD 1
   ATOM 990 OE1 A GLN A 40 ? 11.36544 -19.98722 27.20086 0.312 21.07504 O ? A ? 39 OE1 1
   ATOM 991 NE2 A GLN A 40 ? 13.10473 -19.38282 28.43501 0.312 15.91764 N ? A ? 39 NE2 1
   ATOM 992 H A GLN A 40 ? 7.85235 -16.64323 27.30015 0.312 13.24109 H ? A ? 39 H 1
   ATOM 993 HA A GLN A 40 ? 10.16514 -15.64669 26.59078 0.312 12.86860 H ? A ? 39 HA 1
   ATOM 994 HB2 A GLN A 40 ? 9.89328 -17.02203 28.50820 0.312 16.77919 H ? A ? 39 HB2 1
   ATOM 995 HB3 A GLN A 40 ? 9.68434 -18.27108 27.54818 0.312 16.77919 H ? A ? 39 HB3 1
   ATOM 996 HG2 A GLN A 40 ? 11.99152 -17.30751 26.81262 0.312 20.71286 H ? A ? 39 HG2 1
   ATOM 997 HG3 A GLN A 40 ? 12.02174 -17.19514 28.39751 0.312 20.71286 H ? A ? 39 HG3 1
   ATOM 998 HE21 A GLN A 40 ? 13.54542 -18.74418 28.80585 0.312 19.07786 H ? A ? 39 HE21 1
   ATOM 999 HE22 A GLN A 40 ? 13.37192 -20.19580 28.52036 0.312 19.07786 H ? A ? 39 HE22 1
   ATOM 1000 N B GLN A 40 ? 8.26483 -16.11220 26.74406 0.688 11.09111 N ? A ? 39 N 1
   ATOM 1001 CA B GLN A 40 ? 9.65895 -16.49524 26.53790 0.688 10.82185 C ? A ? 39 CA 1
   ATOM 1002 C B GLN A 40 ? 9.86557 -17.02513 25.12756 0.688 9.63260 C ? A ? 39 C 1
   ATOM 1003 O B GLN A 40 ? 10.74377 -16.55475 24.38467 0.688 10.88393 O ? A ? 39 O 1
   ATOM 1004 CB B GLN A 40 ? 10.06922 -17.57136 27.56580 0.688 13.83255 C ? A ? 39 CB 1
   ATOM 1005 CG B GLN A 40 ? 11.49677 -18.11119 27.39966 0.688 11.56637 C ? A ? 39 CG 1
   ATOM 1006 CD B GLN A 40 ? 11.82277 -19.21069 28.39175 0.688 12.91647 C ? A ? 39 CD 1
   ATOM 1007 OE1 B GLN A 40 ? 10.95249 -19.99355 28.78586 0.688 14.82869 O ? A ? 39 OE1 1
   ATOM 1008 NE2 B GLN A 40 ? 13.07754 -19.26222 28.82522 0.688 12.95088 N ? A ? 39 NE2 1
   ATOM 1009 H B GLN A 40 ? 7.89469 -16.48283 27.42614 0.688 13.28604 H ? A ? 39 H 1
   ATOM 1010 HA B GLN A 40 ? 10.22013 -15.71478 26.66777 0.688 12.96291 H ? A ? 39 HA 1
   ATOM 1011 HB2 B GLN A 40 ? 10.00401 -17.18842 28.45462 0.688 16.57576 H ? A ? 39 HB2 1
   ATOM 1012 HB3 B GLN A 40 ? 9.46185 -18.32313 27.48307 0.688 16.57576 H ? A ? 39 HB3 1
   ATOM 1013 HG2 B GLN A 40 ? 11.59623 -18.47383 26.50552 0.688 13.85634 H ? A ? 39 HG2 1
   ATOM 1014 HG3 B GLN A 40 ? 12.12724 -17.38671 27.53586 0.688 13.85634 H ? A ? 39 HG3 1
   ATOM 1015 HE21 B GLN A 40 ? 13.65409 -18.69033 28.54214 0.688 15.51776 H ? A ? 39 HE21 1
   ATOM 1016 HE22 B GLN A 40 ? 13.31324 -19.86746 29.38889 0.688 15.51776 H ? A ? 39 HE22 1
   ATOM 1017 N . ILE A 41 ? 9.04742 -18.00108 24.73590 1.000 9.69362 N ? A ? 40 N 1
   ATOM 1018 CA . ILE A 41 ? 9.19621 -18.62531 23.43182 1.000 8.97644 C ? A ? 40 CA 1
   ATOM 1019 C . ILE A 41 ? 8.90808 -17.64301 22.31457 1.000 8.89473 C ? A ? 40 C 1
   ATOM 1020 O . ILE A 41 ? 9.62500 -17.65203 21.30876 1.000 9.55938 O ? A ? 40 O 1
   ATOM 1021 CB . ILE A 41 ? 8.34149 -19.90041 23.34667 1.000 9.07769 C ? A ? 40 CB 1
   ATOM 1022 CG1 . ILE A 41 ? 8.89582 -20.98641 24.29671 1.000 10.50731 C ? A ? 40 CG1 1
   ATOM 1023 CG2 . ILE A 41 ? 8.25218 -20.40120 21.92228 1.000 9.35735 C ? A ? 40 CG2 1
   ATOM 1024 CD1 . ILE A 41 ? 10.24070 -21.48844 23.88948 1.000 11.02058 C ? A ? 40 CD1 1
   ATOM 1025 HA . ILE A 41 ? 10.12229 -18.89403 23.32665 1.000 10.74842 H ? A ? 40 HA 1
   ATOM 1026 HB . ILE A 41 ? 7.44116 -19.68250 23.63446 1.000 10.86992 H ? A ? 40 HB 1
   ATOM 1027 HG12 . ILE A 41 ? 8.97333 -20.61395 25.18900 1.000 12.58547 H ? A ? 40 HG12 1
   ATOM 1028 HG13 . ILE A 41 ? 8.28495 -21.73986 24.30363 1.000 12.58547 H ? A ? 40 HG13 1
   ATOM 1029 HG21 . ILE A 41 ? 7.94468 -21.32114 21.92965 1.000 11.20552 H ? A ? 40 HG21 1
   ATOM 1030 HG22 . ILE A 41 ? 7.62557 -19.84691 21.43135 1.000 11.20552 H ? A ? 40 HG22 1
   ATOM 1031 HG23 . ILE A 41 ? 9.13036 -20.34925 21.51362 1.000 11.20552 H ? A ? 40 HG23 1
   ATOM 1032 HD11 . ILE A 41 ? 10.45785 -22.27312 24.41677 1.000 13.20139 H ? A ? 40 HD11 1
   ATOM 1033 HD12 . ILE A 41 ? 10.21998 -21.71836 22.94735 1.000 13.20139 H ? A ? 40 HD12 1
   ATOM 1034 HD13 . ILE A 41 ? 10.89817 -20.79258 24.04576 1.000 13.20139 H ? A ? 40 HD13 1
   ATOM 1035 H A ILE A 41 ? 8.34771 -18.24916 25.17004 0.312 11.60904 H ? A ? 40 H 1
   ATOM 1036 H B ILE A 41 ? 8.40114 -18.31684 25.20731 0.688 11.60904 H ? A ? 40 H 1
   ATOM 1037 N . LYS A 42 ? 7.92537 -16.76668 22.47681 1.000 9.29881 N ? A ? 41 N 1
   ATOM 1038 CA . LYS A 42 ? 7.65657 -15.76584 21.45476 1.000 9.33524 C ? A ? 41 CA 1
   ATOM 1039 C . LYS A 42 ? 8.88301 -14.90080 21.22320 1.000 8.82811 C ? A ? 41 C 1
   ATOM 1040 O . LYS A 42 ? 9.26397 -14.62728 20.07793 1.000 9.89239 O ? A ? 41 O 1
   ATOM 1041 CB . LYS A 42 ? 6.43715 -14.92243 21.85685 1.000 9.55298 C ? A ? 41 CB 1
   ATOM 1042 CG . LYS A 42 ? 6.09513 -13.82860 20.86221 1.000 12.54212 C ? A ? 41 CG 1
   ATOM 1043 CD . LYS A 42 ? 4.87768 -13.02520 21.30408 1.000 12.69421 C ? A ? 41 CD 1
   ATOM 1044 CE . LYS A 42 ? 4.63611 -11.87408 20.36130 1.000 16.68951 C ? A ? 41 CE 1
   ATOM 1045 NZ . LYS A 42 ? 3.45750 -11.05107 20.74728 1.000 26.94095 N ? A ? 41 NZ 1
   ATOM 1046 H . LYS A 42 ? 7.40551 -16.73012 23.16092 1.000 11.13527 H ? A ? 41 H 1
   ATOM 1047 HA . LYS A 42 ? 7.44031 -16.20486 20.61727 1.000 11.17899 H ? A ? 41 HA 1
   ATOM 1048 HB2 . LYS A 42 ? 5.66584 -15.50576 21.93229 1.000 11.44028 H ? A ? 41 HB2 1
   ATOM 1049 HB3 . LYS A 42 ? 6.61833 -14.49986 22.71097 1.000 11.44028 H ? A ? 41 HB3 1
   ATOM 1050 HG2 . LYS A 42 ? 6.84735 -13.22140 20.78235 1.000 15.02725 H ? A ? 41 HG2 1
   ATOM 1051 HG3 . LYS A 42 ? 5.89887 -14.22877 20.00067 1.000 15.02725 H ? A ? 41 HG3 1
   ATOM 1052 HD2 . LYS A 42 ? 4.09333 -13.59590 21.30279 1.000 15.20975 H ? A ? 41 HD2 1
   ATOM 1053 HD3 . LYS A 42 ? 5.02792 -12.66983 22.19405 1.000 15.20975 H ? A ? 41 HD3 1
   ATOM 1054 HE2 . LYS A 42 ? 5.41635 -11.29778 20.35934 1.000 20.00411 H ? A ? 41 HE2 1
   ATOM 1055 HE3 . LYS A 42 ? 4.47907 -12.22291 19.46992 1.000 20.00411 H ? A ? 41 HE3 1
   ATOM 1056 HZ1 . LYS A 42 ? 3.65933 -10.18597 20.69279 1.000 32.30584 H ? A ? 41 HZ1 1
   ATOM 1057 HZ2 . LYS A 42 ? 2.77466 -11.22319 20.20304 1.000 32.30584 H ? A ? 41 HZ2 1
   ATOM 1058 HZ3 . LYS A 42 ? 3.21542 -11.23910 21.58283 1.000 32.30584 H ? A ? 41 HZ3 1
   ATOM 1059 N . ALA A 43 ? 9.51325 -14.44995 22.30630 1.000 9.32846 N ? A ? 42 N 1
   ATOM 1060 CA . ALA A 43 ? 10.71561 -13.63836 22.17328 1.000 8.93837 C ? A ? 42 CA 1
   ATOM 1061 C . ALA A 43 ? 11.85192 -14.40518 21.53327 1.000 9.81999 C ? A ? 42 C 1
   ATOM 1062 O . ALA A 43 ? 12.58839 -13.86895 20.68833 1.000 10.19105 O ? A ? 42 O 1
   ATOM 1063 CB . ALA A 43 ? 11.13574 -13.09188 23.54019 1.000 12.00153 C ? A ? 42 CB 1
   ATOM 1064 H . ALA A 43 ? 9.26797 -14.59823 23.11713 1.000 11.17085 H ? A ? 42 H 1
   ATOM 1065 HA . ALA A 43 ? 10.51118 -12.88679 21.59513 1.000 10.70275 H ? A ? 42 HA 1
   ATOM 1066 HB1 . ALA A 43 ? 11.94207 -12.56312 23.43465 1.000 14.37854 H ? A ? 42 HB1 1
   ATOM 1067 HB2 . ALA A 43 ? 10.42108 -12.53858 23.89234 1.000 14.37854 H ? A ? 42 HB2 1
   ATOM 1068 HB3 . ALA A 43 ? 11.30409 -13.83577 24.13952 1.000 14.37854 H ? A ? 42 HB3 1
   ATOM 1069 N . ASN A 44 ? 12.04550 -15.65765 21.93495 1.000 9.33324 N ? A ? 43 N 1
   ATOM 1070 CA . ASN A 44 ? 13.11794 -16.43583 21.37047 1.000 9.49993 C ? A ? 43 CA 1
   ATOM 1071 C . ASN A 44 ? 12.92367 -16.67142 19.88626 1.000 8.49305 C ? A ? 43 C 1
   ATOM 1072 O . ASN A 44 ? 13.89785 -16.65586 19.11324 1.000 9.13653 O ? A ? 43 O 1
   ATOM 1073 H . ASN A 44 ? 11.57232 -16.06710 22.52492 1.000 11.17658 H ? A ? 43 H 1
   ATOM 1074 HA . ASN A 44 ? 13.94322 -15.94220 21.49755 1.000 11.37662 H ? A ? 43 HA 1
   ATOM 1075 CB A ASN A 44 ? 13.30673 -17.74382 22.14133 0.247 9.81977 C ? A ? 43 CB 1
   ATOM 1076 CG A ASN A 44 ? 14.48720 -18.53119 21.63355 0.247 9.66817 C ? A ? 43 CG 1
   ATOM 1077 OD1 A ASN A 44 ? 15.62892 -18.27830 22.07158 0.247 6.80414 O ? A ? 43 OD1 1
   ATOM 1078 ND2 A ASN A 44 ? 14.25773 -19.44651 20.70202 0.247 8.33914 N ? A ? 43 ND2 1
   ATOM 1079 HB2 A ASN A 44 ? 13.45624 -17.54332 23.07853 0.247 11.76043 H ? A ? 43 HB2 1
   ATOM 1080 HB3 A ASN A 44 ? 12.51179 -18.29067 22.04176 0.247 11.76043 H ? A ? 43 HB3 1
   ATOM 1081 HD21 A ASN A 44 ? 14.90812 -19.91436 20.38943 0.247 9.98367 H ? A ? 43 HD21 1
   ATOM 1082 HD22 A ASN A 44 ? 13.45851 -19.57232 20.41044 0.247 9.98367 H ? A ? 43 HD22 1
   ATOM 1083 CB B ASN A 44 ? 13.23938 -17.77686 22.07171 0.753 10.08101 C ? A ? 43 CB 1
   ATOM 1084 CG B ASN A 44 ? 14.45149 -18.53417 21.58898 0.753 9.35686 C ? A ? 43 CG 1
   ATOM 1085 OD1 B ASN A 44 ? 15.60068 -18.00505 21.71880 0.753 10.02448 O ? A ? 43 OD1 1
   ATOM 1086 ND2 B ASN A 44 ? 14.24792 -19.71361 20.99676 0.753 9.08160 N ? A ? 43 ND2 1
   ATOM 1087 HB2 B ASN A 44 ? 13.32690 -17.63437 23.02719 0.753 12.07392 H ? A ? 43 HB2 1
   ATOM 1088 HB3 B ASN A 44 ? 12.45051 -18.31011 21.88670 0.753 12.07392 H ? A ? 43 HB3 1
   ATOM 1089 HD21 B ASN A 44 ? 14.91672 -20.17173 20.70966 0.753 10.87463 H ? A ? 43 HD21 1
   ATOM 1090 HD22 B ASN A 44 ? 13.44802 -20.01505 20.90247 0.753 10.87463 H ? A ? 43 HD22 1
   ATOM 1091 N A VAL A 45 ? 11.68998 -16.96407 19.46281 0.438 8.87861 N ? A ? 44 N 1
   ATOM 1092 CA A VAL A 45 ? 11.46461 -17.23382 18.05073 0.438 8.51735 C ? A ? 44 CA 1
   ATOM 1093 C A VAL A 45 ? 11.66882 -15.98746 17.20667 0.438 8.65362 C ? A ? 44 C 1
   ATOM 1094 O A VAL A 45 ? 12.16411 -16.07712 16.08423 0.438 7.00608 O ? A ? 44 O 1
   ATOM 1095 CB A VAL A 45 ? 10.11543 -17.93169 17.82487 0.438 8.04856 C ? A ? 44 CB 1
   ATOM 1096 CG1 A VAL A 45 ? 9.86052 -18.14281 16.34549 0.438 8.49734 C ? A ? 44 CG1 1
   ATOM 1097 CG2 A VAL A 45 ? 10.11870 -19.27791 18.54897 0.438 8.81968 C ? A ? 44 CG2 1
   ATOM 1098 H A VAL A 45 ? 10.99064 -17.01030 19.96120 0.438 10.63103 H ? A ? 44 H 1
   ATOM 1099 HA A VAL A 45 ? 12.13723 -17.86578 17.75220 0.438 10.19752 H ? A ? 44 HA 1
   ATOM 1100 HB A VAL A 45 ? 9.40332 -17.37433 18.17579 0.438 9.63498 H ? A ? 44 HB 1
   ATOM 1101 HG11 A VAL A 45 ? 9.14379 -18.78740 16.23737 0.438 10.17351 H ? A ? 44 HG11 1
   ATOM 1102 HG12 A VAL A 45 ? 9.60751 -17.29649 15.94471 0.438 10.17351 H ? A ? 44 HG12 1
   ATOM 1103 HG13 A VAL A 45 ? 10.67097 -18.47646 15.92986 0.438 10.17351 H ? A ? 44 HG13 1
   ATOM 1104 HG21 A VAL A 45 ? 9.26201 -19.71194 18.41257 0.438 10.56032 H ? A ? 44 HG21 1
   ATOM 1105 HG22 A VAL A 45 ? 10.83014 -19.82926 18.18737 0.438 10.56032 H ? A ? 44 HG22 1
   ATOM 1106 HG23 A VAL A 45 ? 10.26596 -19.12688 19.49576 0.438 10.56032 H ? A ? 44 HG23 1
   ATOM 1107 N C VAL A 45 ? 11.69364 -16.99702 19.48491 0.562 8.89128 N ? A ? 44 N 1
   ATOM 1108 CA C VAL A 45 ? 11.41923 -17.18138 18.07662 0.562 8.28785 C ? A ? 44 CA 1
   ATOM 1109 C C VAL A 45 ? 11.57360 -15.88272 17.31155 0.562 9.41269 C ? A ? 44 C 1
   ATOM 1110 O C VAL A 45 ? 11.90763 -15.89605 16.12960 0.562 10.71182 O ? A ? 44 O 1
   ATOM 1111 CB C VAL A 45 ? 10.05597 -17.85090 17.87611 0.562 8.56328 C ? A ? 44 CB 1
   ATOM 1112 CG1 C VAL A 45 ? 9.70113 -17.86159 16.40569 0.562 9.35912 C ? A ? 44 CG1 1
   ATOM 1113 CG2 C VAL A 45 ? 10.11180 -19.25506 18.45340 0.562 9.27653 C ? A ? 44 CG2 1
   ATOM 1114 H C VAL A 45 ? 11.01795 -17.11321 20.00409 0.562 10.64623 H ? A ? 44 H 1
   ATOM 1115 HA C VAL A 45 ? 12.08048 -17.78912 17.71015 0.562 9.92212 H ? A ? 44 HA 1
   ATOM 1116 HB C VAL A 45 ? 9.35775 -17.35952 18.33648 0.562 10.25264 H ? A ? 44 HB 1
   ATOM 1117 HG11 C VAL A 45 ? 8.91701 -18.41722 16.27407 0.562 11.20764 H ? A ? 44 HG11 1
   ATOM 1118 HG12 C VAL A 45 ? 9.51513 -16.95375 16.11910 0.562 11.20764 H ? A ? 44 HG12 1
   ATOM 1119 HG13 C VAL A 45 ? 10.44902 -18.22050 15.90294 0.562 11.20764 H ? A ? 44 HG13 1
   ATOM 1120 HG21 C VAL A 45 ? 9.25464 -19.68761 18.31527 0.562 11.10854 H ? A ? 44 HG21 1
   ATOM 1121 HG22 C VAL A 45 ? 10.81070 -19.75428 18.00261 0.562 11.10854 H ? A ? 44 HG22 1
   ATOM 1122 HG23 C VAL A 45 ? 10.30488 -19.19893 19.40233 0.562 11.10854 H ? A ? 44 HG23 1
   ATOM 1123 N A GLU A 46 ? 11.32944 -14.80784 17.72999 0.438 7.39570 N ? A ? 45 N 1
   ATOM 1124 CA A GLU A 46 ? 11.61920 -13.55949 17.02226 0.438 9.34182 C ? A ? 45 CA 1
   ATOM 1125 C A GLU A 46 ? 13.11849 -13.40718 16.76519 0.438 11.19726 C ? A ? 45 C 1
   ATOM 1126 O A GLU A 46 ? 13.53472 -13.02068 15.65942 0.438 8.98915 O ? A ? 45 O 1
   ATOM 1127 CB A GLU A 46 ? 11.08760 -12.36840 17.83001 0.438 12.11933 C ? A ? 45 CB 1
   ATOM 1128 CG A GLU A 46 ? 11.22986 -11.00565 17.16758 0.438 19.93168 C ? A ? 45 CG 1
   ATOM 1129 CD A GLU A 46 ? 10.36191 -10.87321 15.94271 0.438 13.92730 C ? A ? 45 CD 1
   ATOM 1130 OE1 A GLU A 46 ? 9.36543 -11.61436 15.84904 0.438 19.65126 O ? A ? 45 OE1 1
   ATOM 1131 OE2 A GLU A 46 ? 10.68612 -10.05206 15.05891 0.438 30.08800 O ? A ? 45 OE2 1
   ATOM 1132 H A GLU A 46 ? 10.93408 -14.70259 18.48644 0.438 8.85154 H ? A ? 45 H 1
   ATOM 1133 HA A GLU A 46 ? 11.16683 -13.56987 16.16427 0.438 11.18689 H ? A ? 45 HA 1
   ATOM 1134 HB2 A GLU A 46 ? 10.14249 -12.51066 17.99563 0.438 14.51989 H ? A ? 45 HB2 1
   ATOM 1135 HB3 A GLU A 46 ? 11.56988 -12.33147 18.67080 0.438 14.51989 H ? A ? 45 HB3 1
   ATOM 1136 HG2 A GLU A 46 ? 10.96915 -10.31656 17.79851 0.438 23.89472 H ? A ? 45 HG2 1
   ATOM 1137 HG3 A GLU A 46 ? 12.15305 -10.87742 16.89895 0.438 23.89472 H ? A ? 45 HG3 1
   ATOM 1138 N C GLU A 46 ? 11.37291 -14.73960 17.95610 0.562 10.32906 N ? A ? 45 N 1
   ATOM 1139 CA C GLU A 46 ? 11.67437 -13.47028 17.29358 0.562 10.07233 C ? A ? 45 CA 1
   ATOM 1140 C C GLU A 46 ? 13.17131 -13.35127 16.99815 0.562 8.43116 C ? A ? 45 C 1
   ATOM 1141 O C GLU A 46 ? 13.56241 -12.88688 15.92162 0.562 12.24627 O ? A ? 45 O 1
   ATOM 1142 CB C GLU A 46 ? 11.17221 -12.28301 18.13476 0.562 8.48334 C ? A ? 45 CB 1
   ATOM 1143 CG C GLU A 46 ? 9.68432 -12.07263 17.97554 0.562 13.40423 C ? A ? 45 CG 1
   ATOM 1144 CD C GLU A 46 ? 9.14003 -11.18886 19.05451 0.562 14.36668 C ? A ? 45 CD 1
   ATOM 1145 OE1 C GLU A 46 ? 9.91746 -10.73924 19.90843 0.562 26.73378 O ? A ? 45 OE1 1
   ATOM 1146 OE2 C GLU A 46 ? 7.90848 -10.93269 19.05125 0.562 16.85793 O ? A ? 45 OE2 1
   ATOM 1147 H C GLU A 46 ? 11.07058 -14.66878 18.75809 0.562 12.37158 H ? A ? 45 H 1
   ATOM 1148 HA C GLU A 46 ? 11.19910 -13.43695 16.44865 0.562 12.06349 H ? A ? 45 HA 1
   ATOM 1149 HB2 C GLU A 46 ? 11.35701 -12.45437 19.07145 0.562 10.15671 H ? A ? 45 HB2 1
   ATOM 1150 HB3 C GLU A 46 ? 11.62629 -11.47472 17.84948 0.562 10.15671 H ? A ? 45 HB3 1
   ATOM 1151 HG2 C GLU A 46 ? 9.50888 -11.65288 17.11884 0.562 16.06178 H ? A ? 45 HG2 1
   ATOM 1152 HG3 C GLU A 46 ? 9.23154 -12.92909 18.02426 0.562 16.06178 H ? A ? 45 HG3 1
   ATOM 1153 N A VAL A 47 ? 13.94630 -13.70028 17.77685 0.438 9.59660 N ? A ? 46 N 1
   ATOM 1154 CA A VAL A 47 ? 15.39350 -13.68125 17.57427 0.438 9.56128 C ? A ? 46 CA 1
   ATOM 1155 C A VAL A 47 ? 15.79021 -14.73402 16.55204 0.438 8.19027 C ? A ? 46 C 1
   ATOM 1156 O A VAL A 47 ? 16.63279 -14.48807 15.68071 0.438 8.98491 O ? A ? 46 O 1
   ATOM 1157 CB A VAL A 47 ? 16.12268 -13.88892 18.91110 0.438 8.48588 C ? A ? 46 CB 1
   ATOM 1158 CG1 A VAL A 47 ? 17.58424 -14.05521 18.68356 0.438 10.87882 C ? A ? 46 CG1 1
   ATOM 1159 CG2 A VAL A 47 ? 15.81766 -12.71838 19.84633 0.438 10.60321 C ? A ? 46 CG2 1
   ATOM 1160 H A VAL A 47 ? 13.69730 -13.90885 18.57315 0.438 11.49263 H ? A ? 46 H 1
   ATOM 1161 HA A VAL A 47 ? 15.64847 -12.81149 17.22872 0.438 11.45024 H ? A ? 46 HA 1
   ATOM 1162 HB A VAL A 47 ? 15.80949 -14.70078 19.33969 0.438 10.15976 H ? A ? 46 HB 1
   ATOM 1163 HG11 A VAL A 47 ? 18.05039 -13.93766 19.52605 0.438 13.03128 H ? A ? 46 HG11 1
   ATOM 1164 HG12 A VAL A 47 ? 17.75035 -14.94503 18.33497 0.438 13.03128 H ? A ? 46 HG12 1
   ATOM 1165 HG13 A VAL A 47 ? 17.88224 -13.38877 18.04485 0.438 13.03128 H ? A ? 46 HG13 1
   ATOM 1166 HG21 A VAL A 47 ? 16.30566 -12.84125 20.67558 0.438 12.70055 H ? A ? 46 HG21 1
   ATOM 1167 HG22 A VAL A 47 ? 16.09403 -11.89253 19.41913 0.438 12.70055 H ? A ? 46 HG22 1
   ATOM 1168 HG23 A VAL A 47 ? 14.86429 -12.69606 20.02376 0.438 12.70055 H ? A ? 46 HG23 1
   ATOM 1169 N C VAL A 47 ? 14.02613 -13.79355 17.91922 0.562 9.39742 N ? A ? 46 N 1
   ATOM 1170 CA C VAL A 47 ? 15.45793 -13.79068 17.63618 0.562 9.01241 C ? A ? 46 CA 1
   ATOM 1171 C C VAL A 47 ? 15.75530 -14.72201 16.46902 0.562 8.90105 C ? A ? 46 C 1
   ATOM 1172 O C VAL A 47 ? 16.44740 -14.34463 15.50398 0.562 9.46724 O ? A ? 46 O 1
   ATOM 1173 CB C VAL A 47 ? 16.24553 -14.20901 18.88596 0.562 9.46027 C ? A ? 46 CB 1
   ATOM 1174 CG1 C VAL A 47 ? 17.71501 -14.39235 18.50561 0.562 8.91064 C ? A ? 46 CG1 1
   ATOM 1175 CG2 C VAL A 47 ? 16.08725 -13.22824 20.00345 0.562 8.28033 C ? A ? 46 CG2 1
   ATOM 1176 H C VAL A 47 ? 13.80809 -14.09262 18.69550 0.562 11.25361 H ? A ? 46 H 1
   ATOM 1177 HA C VAL A 47 ? 15.72708 -12.89147 17.39144 0.562 10.79160 H ? A ? 46 HA 1
   ATOM 1178 HB C VAL A 47 ? 15.89413 -15.04958 19.21890 0.562 11.32902 H ? A ? 46 HB 1
   ATOM 1179 HG11 C VAL A 47 ? 18.24921 -14.42272 19.31468 0.562 10.66947 H ? A ? 46 HG11 1
   ATOM 1180 HG12 C VAL A 47 ? 17.81262 -15.22248 18.01342 0.562 10.66947 H ? A ? 46 HG12 1
   ATOM 1181 HG13 C VAL A 47 ? 17.99375 -13.64544 17.95304 0.562 10.66947 H ? A ? 46 HG13 1
   ATOM 1182 HG21 C VAL A 47 ? 16.58000 -13.54718 20.77571 0.562 9.91310 H ? A ? 46 HG21 1
   ATOM 1183 HG22 C VAL A 47 ? 16.43584 -12.36834 19.72069 0.562 9.91310 H ? A ? 46 HG22 1
   ATOM 1184 HG23 C VAL A 47 ? 15.14563 -13.14778 20.22202 0.562 9.91310 H ? A ? 46 HG23 1
   ATOM 1185 N A LEU A 48 ? 15.17980 -15.92308 16.62086 0.438 8.20162 N ? A ? 47 N 1
   ATOM 1186 CA A LEU A 48 ? 15.52610 -16.97392 15.66695 0.438 9.96601 C ? A ? 47 CA 1
   ATOM 1187 C A LEU A 48 ? 15.15906 -16.56288 14.25028 0.438 9.20941 C ? A ? 47 C 1
   ATOM 1188 O A LEU A 48 ? 15.87037 -16.89033 13.30263 0.438 7.64495 O ? A ? 47 O 1
   ATOM 1189 CB A LEU A 48 ? 14.85915 -18.28819 16.05780 0.438 7.80548 C ? A ? 47 CB 1
   ATOM 1190 CG A LEU A 48 ? 15.12868 -19.48018 15.13967 0.438 7.32823 C ? A ? 47 CG 1
   ATOM 1191 CD1 A LEU A 48 ? 16.57932 -19.83926 15.10637 0.438 9.72756 C ? A ? 47 CD1 1
   ATOM 1192 CD2 A LEU A 48 ? 14.26222 -20.62914 15.67124 0.438 9.25383 C ? A ? 47 CD2 1
   ATOM 1193 H A LEU A 48 ? 14.57793 -16.13865 17.19608 0.438 9.81864 H ? A ? 47 H 1
   ATOM 1194 HA A LEU A 48 ? 16.48421 -17.12313 15.69273 0.438 11.93591 H ? A ? 47 HA 1
   ATOM 1195 HB2 A LEU A 48 ? 15.17020 -18.53270 16.94344 0.438 9.34328 H ? A ? 47 HB2 1
   ATOM 1196 HB3 A LEU A 48 ? 13.89949 -18.14751 16.07033 0.438 9.34328 H ? A ? 47 HB3 1
   ATOM 1197 HG A LEU A 48 ? 14.90331 -19.28068 14.21754 0.438 8.77057 H ? A ? 47 HG 1
   ATOM 1198 HD11 A LEU A 48 ? 16.69136 -20.65347 14.59119 0.438 11.64977 H ? A ? 47 HD11 1
   ATOM 1199 HD12 A LEU A 48 ? 17.07448 -19.11514 14.69241 0.438 11.64977 H ? A ? 47 HD12 1
   ATOM 1200 HD13 A LEU A 48 ? 16.89154 -19.97677 16.01439 0.438 11.64977 H ? A ? 47 HD13 1
   ATOM 1201 HD21 A LEU A 48 ? 14.37199 -21.40075 15.09377 0.438 11.08130 H ? A ? 47 HD21 1
   ATOM 1202 HD22 A LEU A 48 ? 14.54590 -20.84764 16.57274 0.438 11.08130 H ? A ? 47 HD22 1
   ATOM 1203 HD23 A LEU A 48 ? 13.33369 -20.34860 15.67551 0.438 11.08130 H ? A ? 47 HD23 1
   ATOM 1204 N C LEU A 48 ? 15.23118 -15.95770 16.53899 0.562 8.58688 N ? A ? 47 N 1
   ATOM 1205 CA C LEU A 48 ? 15.49227 -16.92289 15.47972 0.562 9.74725 C ? A ? 47 CA 1
   ATOM 1206 C C LEU A 48 ? 15.02135 -16.38736 14.13413 0.562 8.22681 C ? A ? 47 C 1
   ATOM 1207 O C LEU A 48 ? 15.65605 -16.63504 13.10883 0.562 9.76772 O ? A ? 47 O 1
   ATOM 1208 CB C LEU A 48 ? 14.83399 -18.25904 15.81648 0.562 8.56068 C ? A ? 47 CB 1
   ATOM 1209 CG C LEU A 48 ? 15.01908 -19.40427 14.82814 0.562 10.61334 C ? A ? 47 CG 1
   ATOM 1210 CD1 C LEU A 48 ? 16.48627 -19.69823 14.62705 0.562 8.48987 C ? A ? 47 CD1 1
   ATOM 1211 CD2 C LEU A 48 ? 14.30411 -20.67606 15.28722 0.562 8.66025 C ? A ? 47 CD2 1
   ATOM 1212 H C LEU A 48 ? 14.73359 -16.24815 17.17746 0.562 10.28096 H ? A ? 47 H 1
   ATOM 1213 HA C LEU A 48 ? 16.44670 -17.08303 15.41392 0.562 11.67340 H ? A ? 47 HA 1
   ATOM 1214 HB2 C LEU A 48 ? 15.19287 -18.56053 16.66572 0.562 10.24952 H ? A ? 47 HB2 1
   ATOM 1215 HB3 C LEU A 48 ? 13.87910 -18.10758 15.89484 0.562 10.24952 H ? A ? 47 HB3 1
   ATOM 1216 HG C LEU A 48 ? 14.62729 -19.13007 13.98422 0.562 12.71270 H ? A ? 47 HG 1
   ATOM 1217 HD11 C LEU A 48 ? 16.57687 -20.48193 14.06268 0.562 10.16455 H ? A ? 47 HD11 1
   ATOM 1218 HD12 C LEU A 48 ? 16.90607 -18.93410 14.20188 0.562 10.16455 H ? A ? 47 HD12 1
   ATOM 1219 HD13 C LEU A 48 ? 16.89654 -19.86314 15.49041 0.562 10.16455 H ? A ? 47 HD13 1
   ATOM 1220 HD21 C LEU A 48 ? 14.43427 -21.36936 14.62142 0.562 10.36900 H ? A ? 47 HD21 1
   ATOM 1221 HD22 C LEU A 48 ? 14.67726 -20.95899 16.13670 0.562 10.36900 H ? A ? 47 HD22 1
   ATOM 1222 HD23 C LEU A 48 ? 13.35794 -20.48759 15.38791 0.562 10.36900 H ? A ? 47 HD23 1
   ATOM 1223 N A LYS A 49 ? 14.04564 -15.85208 14.09047 0.438 8.67367 N ? A ? 48 N 1
   ATOM 1224 CA A LYS A 49 ? 13.60484 -15.41186 12.76732 0.438 8.47498 C ? A ? 48 CA 1
   ATOM 1225 C A LYS A 49 ? 14.59659 -14.41899 12.15445 0.438 7.94020 C ? A ? 48 C 1
   ATOM 1226 O A LYS A 49 ? 15.00345 -14.57254 11.00477 0.438 8.36783 O ? A ? 48 O 1
   ATOM 1227 CB A LYS A 49 ? 12.20643 -14.78460 12.87044 0.438 7.30238 C ? A ? 48 CB 1
   ATOM 1228 CG A LYS A 49 ? 11.63273 -14.23390 11.56705 0.438 8.44280 C ? A ? 48 CG 1
   ATOM 1229 CD A LYS A 49 ? 10.39877 -13.35412 11.84233 0.438 19.02679 C ? A ? 48 CD 1
   ATOM 1230 CE A LYS A 49 ? 9.80528 -12.68974 10.59368 0.438 25.12557 C ? A ? 48 CE 1
   ATOM 1231 NZ A LYS A 49 ? 10.69124 -11.62816 10.03163 0.438 31.35647 N ? A ? 48 NZ 1
   ATOM 1232 H A LYS A 49 ? 13.52549 -15.61019 14.73120 0.438 10.38511 H ? A ? 48 H 1
   ATOM 1233 HA A LYS A 49 ? 13.55304 -16.18261 12.18066 0.438 10.14668 H ? A ? 48 HA 1
   ATOM 1234 HB2 A LYS A 49 ? 11.59159 -15.46223 13.19243 0.438 8.73956 H ? A ? 48 HB2 1
   ATOM 1235 HB3 A LYS A 49 ? 12.24850 -14.04841 13.50064 0.438 8.73956 H ? A ? 48 HB3 1
   ATOM 1236 HG2 A LYS A 49 ? 12.30308 -13.69320 11.12075 0.438 10.10806 H ? A ? 48 HG2 1
   ATOM 1237 HG3 A LYS A 49 ? 11.36485 -14.96960 10.99443 0.438 10.10806 H ? A ? 48 HG3 1
   ATOM 1238 HD2 A LYS A 49 ? 9.70595 -13.90601 12.23770 0.438 22.80885 H ? A ? 48 HD2 1
   ATOM 1239 HD3 A LYS A 49 ? 10.65185 -12.64807 12.45743 0.438 22.80885 H ? A ? 48 HD3 1
   ATOM 1240 HE2 A LYS A 49 ? 9.67278 -13.36382 9.90887 0.438 30.12739 H ? A ? 48 HE2 1
   ATOM 1241 HE3 A LYS A 49 ? 8.95670 -12.28095 10.82540 0.438 30.12739 H ? A ? 48 HE3 1
   ATOM 1242 HZ1 A LYS A 49 ? 10.43349 -11.42278 9.20490 0.438 37.60447 H ? A ? 48 HZ1 1
   ATOM 1243 HZ2 A LYS A 49 ? 10.64889 -10.89706 10.53739 0.438 37.60447 H ? A ? 48 HZ2 1
   ATOM 1244 HZ3 A LYS A 49 ? 11.53339 -11.91514 10.00871 0.438 37.60447 H ? A ? 48 HZ3 1
   ATOM 1245 N C LYS A 49 ? 13.86119 -15.73481 14.10693 0.562 10.76917 N ? A ? 48 N 1
   ATOM 1246 CA C LYS A 49 ? 13.38119 -15.10959 12.87824 0.562 8.80206 C ? A ? 48 CA 1
   ATOM 1247 C C LYS A 49 ? 14.44764 -14.21541 12.28138 0.562 7.86944 C ? A ? 48 C 1
   ATOM 1248 O C LYS A 49 ? 14.73307 -14.29436 11.08812 0.562 7.84954 O ? A ? 48 O 1
   ATOM 1249 CB C LYS A 49 ? 12.07945 -14.32923 13.13877 0.562 12.39041 C ? A ? 48 CB 1
   ATOM 1250 CG C LYS A 49 ? 11.61201 -13.43928 11.97180 0.562 10.85002 C ? A ? 48 CG 1
   ATOM 1251 CD C LYS A 49 ? 10.33056 -12.69614 12.31410 0.562 17.38077 C ? A ? 48 CD 1
   ATOM 1252 CE C LYS A 49 ? 9.96862 -11.71484 11.20883 0.562 29.80085 C ? A ? 48 CE 1
   ATOM 1253 NZ C LYS A 49 ? 8.92007 -10.74008 11.59765 0.562 22.01494 N ? A ? 48 NZ 1
   ATOM 1254 H C LYS A 49 ? 13.33635 -15.64006 14.78159 0.562 12.89970 H ? A ? 48 H 1
   ATOM 1255 HA C LYS A 49 ? 13.17164 -15.80343 12.23359 0.562 10.53917 H ? A ? 48 HA 1
   ATOM 1256 HB2 C LYS A 49 ? 11.37080 -14.96589 13.32147 0.562 14.84519 H ? A ? 48 HB2 1
   ATOM 1257 HB3 C LYS A 49 ? 12.21480 -13.75374 13.90780 0.562 14.84519 H ? A ? 48 HB3 1
   ATOM 1258 HG2 C LYS A 49 ? 12.29946 -12.78482 11.77181 0.562 12.99673 H ? A ? 48 HG2 1
   ATOM 1259 HG3 C LYS A 49 ? 11.44433 -13.99282 11.19310 0.562 12.99673 H ? A ? 48 HG3 1
   ATOM 1260 HD2 C LYS A 49 ? 9.60380 -13.33086 12.41337 0.562 20.83362 H ? A ? 48 HD2 1
   ATOM 1261 HD3 C LYS A 49 ? 10.45312 -12.20048 13.13884 0.562 20.83362 H ? A ? 48 HD3 1
   ATOM 1262 HE2 C LYS A 49 ? 10.76201 -11.21368 10.96332 0.562 35.73772 H ? A ? 48 HE2 1
   ATOM 1263 HE3 C LYS A 49 ? 9.64066 -12.21263 10.44362 0.562 35.73772 H ? A ? 48 HE3 1
   ATOM 1264 HZ1 C LYS A 49 ? 8.96353 -10.02139 11.07450 0.562 26.39463 H ? A ? 48 HZ1 1
   ATOM 1265 HZ2 C LYS A 49 ? 8.11479 -11.10978 11.51424 0.562 26.39463 H ? A ? 48 HZ2 1
   ATOM 1266 HZ3 C LYS A 49 ? 9.03643 -10.48905 12.44355 0.562 26.39463 H ? A ? 48 HZ3 1
   ATOM 1267 N A THR A 50 ? 14.98182 -13.37419 12.90029 0.438 9.03360 N ? A ? 49 N 1
   ATOM 1268 CA A THR A 50 ? 15.97676 -12.43352 12.39264 0.438 8.71665 C ? A ? 49 CA 1
   ATOM 1269 C A THR A 50 ? 17.22752 -13.18188 11.99269 0.438 8.24350 C ? A ? 49 C 1
   ATOM 1270 O A THR A 50 ? 17.77383 -12.96976 10.91483 0.438 10.03516 O ? A ? 49 O 1
   ATOM 1271 CB A THR A 50 ? 16.27093 -11.38080 13.45964 0.438 8.63885 C ? A ? 49 CB 1
   ATOM 1272 OG1 A THR A 50 ? 15.07884 -10.60641 13.71586 0.438 11.60171 O ? A ? 49 OG1 1
   ATOM 1273 CG2 A THR A 50 ? 17.38516 -10.42761 13.00307 0.438 12.27558 C ? A ? 49 CG2 1
   ATOM 1274 H A THR A 50 ? 14.68588 -13.19451 13.68752 0.438 10.81702 H ? A ? 49 H 1
   ATOM 1275 HA A THR A 50 ? 15.63707 -11.96939 11.61156 0.438 10.43668 H ? A ? 49 HA 1
   ATOM 1276 HB A THR A 50 ? 16.56078 -11.82769 14.27030 0.438 10.34332 H ? A ? 49 HB 1
   ATOM 1277 HG1 A THR A 50 ? 14.45594 -11.11187 13.96510 0.438 13.89876 H ? A ? 49 HG1 1
   ATOM 1278 HG21 A THR A 50 ? 17.39958 -9.63930 13.56810 0.438 14.70740 H ? A ? 49 HG21 1
   ATOM 1279 HG22 A THR A 50 ? 18.24567 -10.87163 13.06016 0.438 14.70740 H ? A ? 49 HG22 1
   ATOM 1280 HG23 A THR A 50 ? 17.23232 -10.15415 12.08505 0.438 14.70740 H ? A ? 49 HG23 1
   ATOM 1281 N C THR A 50 ? 15.07174 -13.38263 13.10931 0.562 7.72805 N ? A ? 49 N 1
   ATOM 1282 CA C THR A 50 ? 16.10084 -12.47973 12.62207 0.562 7.66678 C ? A ? 49 CA 1
   ATOM 1283 C C THR A 50 ? 17.29745 -13.25613 12.12024 0.562 8.36343 C ? A ? 49 C 1
   ATOM 1284 O C THR A 50 ? 17.77801 -13.02335 11.00619 0.562 9.92673 O ? A ? 49 O 1
   ATOM 1285 CB C THR A 50 ? 16.50881 -11.52437 13.74173 0.562 9.12092 C ? A ? 49 CB 1
   ATOM 1286 OG1 C THR A 50 ? 15.38073 -10.72630 14.11034 0.562 12.67170 O ? A ? 49 OG1 1
   ATOM 1287 CG2 C THR A 50 ? 17.65331 -10.64465 13.29709 0.562 9.33461 C ? A ? 49 CG2 1
   ATOM 1288 H C THR A 50 ? 14.91718 -13.32256 13.95317 0.562 9.25036 H ? A ? 49 H 1
   ATOM 1289 HA C THR A 50 ? 15.75011 -11.95518 11.88536 0.562 9.17683 H ? A ? 49 HA 1
   ATOM 1290 HB C THR A 50 ? 16.80962 -12.02547 14.51589 0.562 10.92180 H ? A ? 49 HB 1
   ATOM 1291 HG1 C THR A 50 ? 14.78889 -11.20935 14.45961 0.562 15.18274 H ? A ? 49 HG1 1
   ATOM 1292 HG21 C THR A 50 ? 17.73798 -9.88399 13.89301 0.562 11.17823 H ? A ? 49 HG21 1
   ATOM 1293 HG22 C THR A 50 ? 18.48254 -11.14778 13.30908 0.562 11.17823 H ? A ? 49 HG22 1
   ATOM 1294 HG23 C THR A 50 ? 17.49355 -10.32252 12.39620 0.562 11.17823 H ? A ? 49 HG23 1
   ATOM 1295 N A LEU A 51 ? 17.69522 -14.06995 12.85618 0.438 8.34966 N ? A ? 50 N 1
   ATOM 1296 CA A LEU A 51 ? 18.91788 -14.82386 12.59790 0.438 8.28279 C ? A ? 50 CA 1
   ATOM 1297 C A LEU A 51 ? 18.78745 -15.71399 11.36650 0.438 8.83453 C ? A ? 50 C 1
   ATOM 1298 O A LEU A 51 ? 19.76220 -15.90960 10.62852 0.438 8.66912 O ? A ? 50 O 1
   ATOM 1299 CB A LEU A 51 ? 19.29239 -15.65055 13.84943 0.438 9.86185 C ? A ? 50 CB 1
   ATOM 1300 CG A LEU A 51 ? 19.65917 -14.91469 15.13572 0.438 10.20501 C ? A ? 50 CG 1
   ATOM 1301 CD1 A LEU A 51 ? 19.86156 -15.89480 16.29555 0.438 8.76505 C ? A ? 50 CD1 1
   ATOM 1302 CD2 A LEU A 51 ? 20.90930 -14.05177 14.90600 0.438 12.45225 C ? A ? 50 CD2 1
   ATOM 1303 H A LEU A 51 ? 17.32290 -14.25977 13.60781 0.438 9.99630 H ? A ? 50 H 1
   ATOM 1304 HA A LEU A 51 ? 19.63974 -14.20050 12.42110 0.438 9.91604 H ? A ? 50 HA 1
   ATOM 1305 HB2 A LEU A 51 ? 18.53339 -16.21556 14.06294 0.438 11.81092 H ? A ? 50 HB2 1
   ATOM 1306 HB3 A LEU A 51 ? 20.05888 -16.19811 13.61798 0.438 11.81092 H ? A ? 50 HB3 1
   ATOM 1307 HG A LEU A 51 ? 18.92919 -14.32809 15.38860 0.438 12.22271 H ? A ? 50 HG 1
   ATOM 1308 HD11 A LEU A 51 ? 20.13678 -15.39973 17.08299 0.438 10.49476 H ? A ? 50 HD11 1
   ATOM 1309 HD12 A LEU A 51 ? 19.02563 -16.35504 16.46961 0.438 10.49476 H ? A ? 50 HD12 1
   ATOM 1310 HD13 A LEU A 51 ? 20.54744 -16.53576 16.05133 0.438 10.49476 H ? A ? 50 HD13 1
   ATOM 1311 HD21 A LEU A 51 ? 21.16632 -13.63851 15.74508 0.438 14.91940 H ? A ? 50 HD21 1
   ATOM 1312 HD22 A LEU A 51 ? 21.62793 -14.61693 14.58184 0.438 14.91940 H ? A ? 50 HD22 1
   ATOM 1313 HD23 A LEU A 51 ? 20.70459 -13.36775 14.24942 0.438 14.91940 H ? A ? 50 HD23 1
   ATOM 1314 N C LEU A 51 ? 17.79676 -14.19012 12.93006 0.562 9.06082 N ? A ? 50 N 1
   ATOM 1315 CA C LEU A 51 ? 19.00059 -14.92214 12.56615 0.562 9.12936 C ? A ? 50 CA 1
   ATOM 1316 C C LEU A 51 ? 18.78626 -15.70545 11.29208 0.562 8.94822 C ? A ? 50 C 1
   ATOM 1317 O C LEU A 51 ? 19.69576 -15.83404 10.46161 0.562 9.91647 O ? A ? 50 O 1
   ATOM 1318 CB C LEU A 51 ? 19.40579 -15.89763 13.67599 0.562 8.65004 C ? A ? 50 CB 1
   ATOM 1319 CG C LEU A 51 ? 19.79902 -15.24441 14.97095 0.562 9.14125 C ? A ? 50 CG 1
   ATOM 1320 CD1 C LEU A 51 ? 19.89425 -16.29541 16.07236 0.562 8.81111 C ? A ? 50 CD1 1
   ATOM 1321 CD2 C LEU A 51 ? 21.13145 -14.49568 14.81405 0.562 8.64686 C ? A ? 50 CD2 1
   ATOM 1322 H C LEU A 51 ? 17.45872 -14.41495 13.68821 0.562 10.84968 H ? A ? 50 H 1
   ATOM 1323 HA C LEU A 51 ? 19.71469 -14.27716 12.44385 0.562 10.93193 H ? A ? 50 HA 1
   ATOM 1324 HB2 C LEU A 51 ? 18.65519 -16.48398 13.85956 0.562 10.35675 H ? A ? 50 HB2 1
   ATOM 1325 HB3 C LEU A 51 ? 20.16471 -16.41694 13.36736 0.562 10.35675 H ? A ? 50 HB3 1
   ATOM 1326 HG C LEU A 51 ? 19.12474 -14.59497 15.22489 0.562 10.94621 H ? A ? 50 HG 1
   ATOM 1327 HD11 C LEU A 51 ? 20.21860 -15.87414 16.88367 0.562 10.55003 H ? A ? 50 HD11 1
   ATOM 1328 HD12 C LEU A 51 ? 19.01410 -16.67347 16.22507 0.562 10.55003 H ? A ? 50 HD12 1
   ATOM 1329 HD13 C LEU A 51 ? 20.50918 -16.99140 15.79243 0.562 10.55003 H ? A ? 50 HD13 1
   ATOM 1330 HD21 C LEU A 51 ? 21.43961 -14.21265 15.68917 0.562 10.35294 H ? A ? 50 HD21 1
   ATOM 1331 HD22 C LEU A 51 ? 21.78254 -15.09085 14.41063 0.562 10.35294 H ? A ? 50 HD22 1
   ATOM 1332 HD23 C LEU A 51 ? 20.99383 -13.72184 14.24560 0.562 10.35294 H ? A ? 50 HD23 1
   ATOM 1333 N . SER A 52 ? 17.59525 -16.29026 11.14927 1.000 8.64713 N ? A ? 51 N 1
   ATOM 1334 CA . SER A 52 ? 17.33842 -17.24158 10.07287 1.000 9.25041 C ? A ? 51 CA 1
   ATOM 1335 C . SER A 52 ? 17.37774 -16.61358 8.69832 1.000 9.15389 C ? A ? 51 C 1
   ATOM 1336 O . SER A 52 ? 17.46386 -17.34792 7.70894 1.000 10.11976 O ? A ? 51 O 1
   ATOM 1337 HA . SER A 52 ? 18.01285 -17.93734 10.11718 1.000 11.07719 H ? A ? 51 HA 1
   ATOM 1338 CB A SER A 52 ? 16.05794 -18.02431 10.37077 0.407 9.26961 C ? A ? 51 CB 1
   ATOM 1339 OG A SER A 52 ? 16.29606 -18.94658 11.43182 0.407 9.34991 O ? A ? 51 OG 1
   ATOM 1340 H A SER A 52 ? 16.89863 -16.13860 11.63023 0.438 10.35325 H ? A ? 51 H 1
   ATOM 1341 HB2 A SER A 52 ? 15.35835 -17.40620 10.63424 0.407 11.10024 H ? A ? 51 HB2 1
   ATOM 1342 HB3 A SER A 52 ? 15.78818 -18.51183 9.57676 0.407 11.10024 H ? A ? 51 HB3 1
   ATOM 1343 HG A SER A 52 ? 16.70650 -19.61932 11.14104 0.407 11.19659 H ? A ? 51 HG 1
   ATOM 1344 CB B SER A 52 ? 15.91925 -17.81251 10.25497 0.593 10.27379 C ? A ? 51 CB 1
   ATOM 1345 OG B SER A 52 ? 14.89963 -16.81865 10.03848 0.593 11.73905 O ? A ? 51 OG 1
   ATOM 1346 HB2 B SER A 52 ? 15.79060 -18.53263 9.61796 0.593 12.30524 H ? A ? 51 HB2 1
   ATOM 1347 HB3 B SER A 52 ? 15.83501 -18.15118 11.16001 0.593 12.30524 H ? A ? 51 HB3 1
   ATOM 1348 HG B SER A 52 ? 14.14276 -17.14240 10.20560 0.593 14.06356 H ? A ? 51 HG 1
   ATOM 1349 H C SER A 52 ? 16.91991 -16.15211 11.66350 0.562 10.35325 H ? A ? 51 H 1
   ATOM 1350 N . ALA A 53 ? 17.30507 -15.29575 8.61560 1.000 8.63541 N ? A ? 52 N 1
   ATOM 1351 CA . ALA A 53 ? 17.44462 -14.59198 7.35746 1.000 9.84883 C ? A ? 52 CA 1
   ATOM 1352 C . ALA A 53 ? 18.88183 -14.26919 7.00433 1.000 11.05211 C ? A ? 52 C 1
   ATOM 1353 O . ALA A 53 ? 19.13768 -13.84315 5.87296 1.000 15.13363 O ? A ? 52 O 1
   ATOM 1354 CB . ALA A 53 ? 16.64185 -13.30137 7.39106 1.000 10.72756 C ? A ? 52 CB 1
   ATOM 1355 H . ALA A 53 ? 17.17277 -14.77752 9.28905 1.000 10.33920 H ? A ? 52 H 1
   ATOM 1356 HA . ALA A 53 ? 17.08750 -15.15509 6.65299 1.000 11.79530 H ? A ? 52 HA 1
   ATOM 1357 HB1 . ALA A 53 ? 16.74279 -12.84447 6.54138 1.000 12.84978 H ? A ? 52 HB1 1
   ATOM 1358 HB2 . ALA A 53 ? 15.70783 -13.51430 7.54322 1.000 12.84978 H ? A ? 52 HB2 1
   ATOM 1359 HB3 . ALA A 53 ? 16.97468 -12.74106 8.10952 1.000 12.84978 H ? A ? 52 HB3 1
   ATOM 1360 N . LEU A 54 ? 19.78946 -14.44514 7.92646 1.000 8.13886 N ? A ? 53 N 1
   ATOM 1361 CA . LEU A 54 ? 21.13893 -13.94046 7.72928 1.000 8.52300 C ? A ? 53 CA 1
   ATOM 1362 C . LEU A 54 ? 22.11757 -14.79982 6.92469 1.000 7.42097 C ? A ? 53 C 1
   ATOM 1363 O . LEU A 54 ? 22.95441 -14.21128 6.22686 1.000 8.52576 O ? A ? 53 O 1
   ATOM 1364 CB . LEU A 54 ? 21.78920 -13.59211 9.07024 1.000 9.47671 C ? A ? 53 CB 1
   ATOM 1365 CG . LEU A 54 ? 21.02990 -12.59765 9.93995 1.000 10.48155 C ? A ? 53 CG 1
   ATOM 1366 CD1 . LEU A 54 ? 21.78910 -12.31634 11.22624 1.000 12.39455 C ? A ? 53 CD1 1
   ATOM 1367 CD2 . LEU A 54 ? 20.79293 -11.29302 9.21675 1.000 10.33172 C ? A ? 53 CD2 1
   ATOM 1368 H . LEU A 54 ? 19.65935 -14.84982 8.67406 1.000 9.74333 H ? A ? 53 H 1
   ATOM 1369 HA . LEU A 54 ? 20.99572 -13.16277 7.16751 1.000 10.20430 H ? A ? 53 HA 1
   ATOM 1370 HB2 . LEU A 54 ? 21.88241 -14.41014 9.58310 1.000 11.34875 H ? A ? 53 HB2 1
   ATOM 1371 HB3 . LEU A 54 ? 22.66311 -13.21037 8.89284 1.000 11.34875 H ? A ? 53 HB3 1
   ATOM 1372 HG . LEU A 54 ? 20.17023 -12.99354 10.15243 1.000 12.55456 H ? A ? 53 HG 1
   ATOM 1373 HD11 . LEU A 54 ? 21.28351 -11.68298 11.75929 1.000 14.85016 H ? A ? 53 HD11 1
   ATOM 1374 HD12 . LEU A 54 ? 21.89976 -13.14648 11.71563 1.000 14.85016 H ? A ? 53 HD12 1
   ATOM 1375 HD13 . LEU A 54 ? 22.65727 -11.94419 11.00558 1.000 14.85016 H ? A ? 53 HD13 1
   ATOM 1376 HD21 . LEU A 54 ? 20.36681 -10.66815 9.82408 1.000 12.37477 H ? A ? 53 HD21 1
   ATOM 1377 HD22 . LEU A 54 ? 21.64510 -10.93706 8.92011 1.000 12.37477 H ? A ? 53 HD22 1
   ATOM 1378 HD23 . LEU A 54 ? 20.21822 -11.45551 8.45241 1.000 12.37477 H ? A ? 53 HD23 1
   ATOM 1379 N A PRO A 55 ? 22.13071 -16.12947 7.00539 0.987 7.26704 N ? A ? 54 N 1
   ATOM 1380 CA A PRO A 55 ? 23.21382 -16.84393 6.31333 0.987 8.44711 C ? A ? 54 CA 1
   ATOM 1381 C A PRO A 55 ? 23.23849 -16.59880 4.82396 0.987 8.21190 C ? A ? 54 C 1
   ATOM 1382 O A PRO A 55 ? 24.32566 -16.63510 4.24328 0.987 9.16487 O ? A ? 54 O 1
   ATOM 1383 CB A PRO A 55 ? 22.92681 -18.32004 6.64076 0.987 8.74660 C ? A ? 54 CB 1
   ATOM 1384 CG A PRO A 55 ? 22.17717 -18.29410 7.93167 0.987 8.69237 C ? A ? 54 CG 1
   ATOM 1385 CD A PRO A 55 ? 21.33855 -17.04710 7.84349 0.987 8.26805 C ? A ? 54 CD 1
   ATOM 1386 HA A PRO A 55 ? 24.07024 -16.59235 6.69301 0.987 10.11324 H ? A ? 54 HA 1
   ATOM 1387 HB2 A PRO A 55 ? 22.39023 -18.71568 5.93617 0.987 10.47262 H ? A ? 54 HB2 1
   ATOM 1388 HB3 A PRO A 55 ? 23.76151 -18.80526 6.73428 0.987 10.47262 H ? A ? 54 HB3 1
   ATOM 1389 HG2 A PRO A 55 ? 21.62111 -19.08490 8.01128 0.987 10.40754 H ? A ? 54 HG2 1
   ATOM 1390 HG3 A PRO A 55 ? 22.79632 -18.24749 8.67691 0.987 10.40754 H ? A ? 54 HG3 1
   ATOM 1391 HD2 A PRO A 55 ? 20.48479 -17.23946 7.42517 0.987 9.89836 H ? A ? 54 HD2 1
   ATOM 1392 HD3 A PRO A 55 ? 21.19804 -16.66786 8.72516 0.987 9.89836 H ? A ? 54 HD3 1
   ATOM 1393 N B PRO A 55 ? 22.10957 -16.12661 7.01394 0.013 7.57047 N ? A ? 54 N 1
   ATOM 1394 CA B PRO A 55 ? 23.18012 -16.87994 6.33766 0.013 8.52080 C ? A ? 54 CA 1
   ATOM 1395 C B PRO A 55 ? 23.21900 -16.72577 4.82010 0.013 8.70391 C ? A ? 54 C 1
   ATOM 1396 O B PRO A 55 ? 24.30979 -16.84047 4.23787 0.013 9.68333 O ? A ? 54 O 1
   ATOM 1397 CB B PRO A 55 ? 22.92151 -18.32755 6.76419 0.013 8.95031 C ? A ? 54 CB 1
   ATOM 1398 CG B PRO A 55 ? 22.13426 -18.22685 8.04789 0.013 8.74451 C ? A ? 54 CG 1
   ATOM 1399 CD B PRO A 55 ? 21.28331 -16.98173 7.88899 0.013 8.38290 C ? A ? 54 CD 1
   ATOM 1400 HA B PRO A 55 ? 24.03590 -16.58985 6.69033 0.013 10.20166 H ? A ? 54 HA 1
   ATOM 1401 HB2 B PRO A 55 ? 22.41028 -18.78639 6.07934 0.013 10.71708 H ? A ? 54 HB2 1
   ATOM 1402 HB3 B PRO A 55 ? 23.76507 -18.78368 6.90998 0.013 10.71708 H ? A ? 54 HB3 1
   ATOM 1403 HG2 B PRO A 55 ? 21.57904 -19.01457 8.15802 0.013 10.47011 H ? A ? 54 HG2 1
   ATOM 1404 HG3 B PRO A 55 ? 22.73936 -18.13953 8.80097 0.013 10.47011 H ? A ? 54 HG3 1
   ATOM 1405 HD2 B PRO A 55 ? 20.43564 -17.19268 7.46727 0.013 10.03618 H ? A ? 54 HD2 1
   ATOM 1406 HD3 B PRO A 55 ? 21.13014 -16.55480 8.74641 0.013 10.03618 H ? A ? 54 HD3 1
   ATOM 1407 N . TRP A 56 ? 22.08452 -16.43613 4.17038 1.000 8.62739 N ? A ? 55 N 1
   ATOM 1408 CA . TRP A 56 ? 22.00317 -16.64755 2.71388 1.000 9.99864 C ? A ? 55 CA 1
   ATOM 1409 C . TRP A 56 ? 22.76490 -15.59017 1.94081 1.000 12.54338 C ? A ? 55 C 1
   ATOM 1410 O . TRP A 56 ? 23.45755 -15.93470 0.96589 1.000 12.62260 O ? A ? 55 O 1
   ATOM 1411 HA . TRP A 56 ? 22.44324 -17.48241 2.48971 1.000 11.97507 H ? A ? 55 HA 1
   ATOM 1412 CB A TRP A 56 ? 20.53978 -16.75157 2.29157 0.049 10.16557 C ? A ? 55 CB 1
   ATOM 1413 CG A TRP A 56 ? 19.76953 -17.48025 3.34437 0.049 9.53035 C ? A ? 55 CG 1
   ATOM 1414 CD1 A TRP A 56 ? 18.70733 -17.01237 4.03996 0.049 11.18736 C ? A ? 55 CD1 1
   ATOM 1415 CD2 A TRP A 56 ? 20.05186 -18.79130 3.87136 0.049 9.37069 C ? A ? 55 CD2 1
   ATOM 1416 NE1 A TRP A 56 ? 18.27706 -17.95493 4.93809 0.049 8.28706 N ? A ? 55 NE1 1
   ATOM 1417 CE2 A TRP A 56 ? 19.09338 -19.05223 4.86488 0.049 10.32353 C ? A ? 55 CE2 1
   ATOM 1418 CE3 A TRP A 56 ? 21.01565 -19.77059 3.58988 0.049 9.38140 C ? A ? 55 CE3 1
   ATOM 1419 CZ2 A TRP A 56 ? 19.05955 -20.25299 5.57494 0.049 14.39164 C ? A ? 55 CZ2 1
   ATOM 1420 CZ3 A TRP A 56 ? 20.98204 -20.95883 4.29869 0.049 12.12056 C ? A ? 55 CZ3 1
   ATOM 1421 CH2 A TRP A 56 ? 20.01204 -21.18900 5.27729 0.049 16.45684 C ? A ? 55 CH2 1
   ATOM 1422 H A TRP A 56 ? 21.34128 -16.20685 4.53730 0.987 10.32957 H ? A ? 55 H 1
   ATOM 1423 HB2 A TRP A 56 ? 20.16444 -15.86342 2.18571 0.049 12.17539 H ? A ? 55 HB2 1
   ATOM 1424 HB3 A TRP A 56 ? 20.47264 -17.24172 1.45722 0.049 12.17539 H ? A ? 55 HB3 1
   ATOM 1425 HD1 A TRP A 56 ? 18.32436 -16.17265 3.92540 0.049 13.40153 H ? A ? 55 HD1 1
   ATOM 1426 HE1 A TRP A 56 ? 17.60179 -17.87047 5.46391 0.049 9.92117 H ? A ? 55 HE1 1
   ATOM 1427 HE3 A TRP A 56 ? 21.66445 -19.62437 2.93982 0.049 11.23438 H ? A ? 55 HE3 1
   ATOM 1428 HZ2 A TRP A 56 ? 18.41419 -20.41100 6.22567 0.049 17.24667 H ? A ? 55 HZ2 1
   ATOM 1429 HZ3 A TRP A 56 ? 21.61614 -21.61537 4.12044 0.049 14.52137 H ? A ? 55 HZ3 1
   ATOM 1430 HH2 A TRP A 56 ? 20.01377 -21.99733 5.73719 0.049 19.72490 H ? A ? 55 HH2 1
   ATOM 1431 CB B TRP A 56 ? 20.52736 -16.88775 2.23766 0.951 10.69301 C ? A ? 55 CB 1
   ATOM 1432 CG B TRP A 56 ? 19.79731 -17.64449 3.38462 0.951 9.26049 C ? A ? 55 CG 1
   ATOM 1433 CD1 B TRP A 56 ? 18.81041 -17.15644 4.18561 0.951 9.98177 C ? A ? 55 CD1 1
   ATOM 1434 CD2 B TRP A 56 ? 20.20257 -18.89306 3.96636 0.951 9.18369 C ? A ? 55 CD2 1
   ATOM 1435 NE1 B TRP A 56 ? 18.55008 -18.03254 5.19433 0.951 10.56396 N ? A ? 55 NE1 1
   ATOM 1436 CE2 B TRP A 56 ? 19.42812 -19.09499 5.10965 0.951 9.79703 C ? A ? 55 CE2 1
   ATOM 1437 CE3 B TRP A 56 ? 21.18581 -19.83878 3.63857 0.951 9.61599 C ? A ? 55 CE3 1
   ATOM 1438 CZ2 B TRP A 56 ? 19.60442 -20.20350 5.91737 0.951 10.22313 C ? A ? 55 CZ2 1
   ATOM 1439 CZ3 B TRP A 56 ? 21.37220 -20.92455 4.43561 0.951 9.68711 C ? A ? 55 CZ3 1
   ATOM 1440 CH2 B TRP A 56 ? 20.58783 -21.12036 5.54362 0.951 9.78937 C ? A ? 55 CH2 1
   ATOM 1441 H B TRP A 56 ? 21.36952 -16.12623 4.53418 0.013 10.32957 H ? A ? 55 H 1
   ATOM 1442 HB2 B TRP A 56 ? 20.08333 -16.04107 2.07377 0.951 12.80832 H ? A ? 55 HB2 1
   ATOM 1443 HB3 B TRP A 56 ? 20.51603 -17.42951 1.43313 0.951 12.80832 H ? A ? 55 HB3 1
   ATOM 1444 HD1 B TRP A 56 ? 18.37721 -16.34289 4.06159 0.951 11.95483 H ? A ? 55 HD1 1
   ATOM 1445 HE1 B TRP A 56 ? 17.93646 -17.93924 5.78962 0.951 12.65345 H ? A ? 55 HE1 1
   ATOM 1446 HE3 B TRP A 56 ? 21.70866 -19.72333 2.87818 0.951 11.51589 H ? A ? 55 HE3 1
   ATOM 1447 HZ2 B TRP A 56 ? 19.08784 -20.33292 6.67979 0.951 12.24446 H ? A ? 55 HZ2 1
   ATOM 1448 HZ3 B TRP A 56 ? 22.03763 -21.54003 4.22756 0.951 11.60123 H ? A ? 55 HZ3 1
   ATOM 1449 HH2 B TRP A 56 ? 20.71466 -21.88391 6.05918 0.951 11.72395 H ? A ? 55 HH2 1
   ATOM 1450 N . ALA A 57 ? 22.80259 -14.36739 2.46815 1.000 9.94305 N ? A ? 56 N 1
   ATOM 1451 CA . ALA A 57 ? 23.52011 -13.28091 1.83047 1.000 11.43333 C ? A ? 56 CA 1
   ATOM 1452 C . ALA A 57 ? 25.02270 -13.46222 1.93942 1.000 11.42271 C ? A ? 56 C 1
   ATOM 1453 O . ALA A 57 ? 25.76742 -12.72524 1.27111 1.000 12.97548 O ? A ? 56 O 1
   ATOM 1454 CB . ALA A 57 ? 23.11385 -11.92868 2.44405 1.000 11.72882 C ? A ? 56 CB 1
   ATOM 1455 H . ALA A 57 ? 22.41482 -14.14427 3.20262 1.000 11.90836 H ? A ? 56 H 1
   ATOM 1456 HA . ALA A 57 ? 23.27709 -13.25195 0.89185 1.000 13.69670 H ? A ? 56 HA 1
   ATOM 1457 HB1 . ALA A 57 ? 23.61128 -11.22073 2.00557 1.000 14.05128 H ? A ? 56 HB1 1
   ATOM 1458 HB2 . ALA A 57 ? 22.16222 -11.79509 2.31190 1.000 14.05128 H ? A ? 56 HB2 1
   ATOM 1459 HB3 . ALA A 57 ? 23.31802 -11.93806 3.39227 1.000 14.05128 H ? A ? 56 HB3 1
   ATOM 1460 N . ALA A 58 ? 25.48959 -14.40229 2.76274 1.000 9.53535 N ? A ? 57 N 1
   ATOM 1461 CA . ALA A 58 ? 26.90495 -14.69002 2.92343 1.000 9.51644 C ? A ? 57 CA 1
   ATOM 1462 C . ALA A 58 ? 27.33849 -15.89351 2.10317 1.000 8.99976 C ? A ? 57 C 1
   ATOM 1463 O . ALA A 58 ? 28.45056 -16.39416 2.31133 1.000 10.11104 O ? A ? 57 O 1
   ATOM 1464 CB . ALA A 58 ? 27.23362 -14.90198 4.40445 1.000 9.54843 C ? A ? 57 CB 1
   ATOM 1465 H . ALA A 58 ? 24.98587 -14.89908 3.25168 1.000 11.41912 H ? A ? 57 H 1
   ATOM 1466 HA . ALA A 58 ? 27.41590 -13.92491 2.61613 1.000 11.39643 H ? A ? 57 HA 1
   ATOM 1467 HB1 . ALA A 58 ? 28.14352 -15.22897 4.48235 1.000 11.43481 H ? A ? 57 HB1 1
   ATOM 1468 HB2 . ALA A 58 ? 27.14478 -14.05663 4.87177 1.000 11.43481 H ? A ? 57 HB2 1
   ATOM 1469 HB3 . ALA A 58 ? 26.61586 -15.55143 4.77522 1.000 11.43481 H ? A ? 57 HB3 1
   ATOM 1470 N . PHE A 59 ? 26.51304 -16.33883 1.15534 1.000 9.80692 N ? A ? 58 N 1
   ATOM 1471 CA . PHE A 59 ? 26.93368 -17.23306 0.09127 1.000 10.60141 C ? A ? 58 CA 1
   ATOM 1472 C . PHE A 59 ? 26.94527 -16.51326 -1.25343 1.000 12.69867 C ? A ? 58 C 1
   ATOM 1473 O . PHE A 59 ? 26.53176 -17.07444 -2.26367 1.000 14.46498 O ? A ? 58 O 1
   ATOM 1474 CB . PHE A 59 ? 26.02355 -18.46165 0.00986 1.000 11.56233 C ? A ? 58 CB 1
   ATOM 1475 CG . PHE A 59 ? 25.98957 -19.31582 1.24662 1.000 9.87994 C ? A ? 58 CG 1
   ATOM 1476 CD1 . PHE A 59 ? 25.10105 -19.07162 2.29810 1.000 11.25058 C ? A ? 58 CD1 1
   ATOM 1477 CD2 . PHE A 59 ? 26.79032 -20.45486 1.34878 1.000 10.74602 C ? A ? 58 CD2 1
   ATOM 1478 CE1 . PHE A 59 ? 25.07074 -19.87624 3.40898 1.000 10.28313 C ? A ? 58 CE1 1
   ATOM 1479 CE2 . PHE A 59 ? 26.75503 -21.26376 2.44697 1.000 9.86684 C ? A ? 58 CE2 1
   ATOM 1480 CZ . PHE A 59 ? 25.87100 -20.99748 3.49699 1.000 11.00327 C ? A ? 58 CZ 1
   ATOM 1481 H . PHE A 59 ? 25.68071 -16.12686 1.11172 1.000 11.74500 H ? A ? 58 H 1
   ATOM 1482 HA . PHE A 59 ? 27.83264 -17.53793 0.29085 1.000 12.69840 H ? A ? 58 HA 1
   ATOM 1483 HB2 . PHE A 59 ? 25.11713 -18.16071 -0.15964 1.000 13.85149 H ? A ? 58 HB2 1
   ATOM 1484 HB3 . PHE A 59 ? 26.32934 -19.02152 -0.72085 1.000 13.85149 H ? A ? 58 HB3 1
   ATOM 1485 HD1 . PHE A 59 ? 24.51847 -18.34877 2.24339 1.000 13.47740 H ? A ? 58 HD1 1
   ATOM 1486 HD2 . PHE A 59 ? 27.36395 -20.66828 0.64857 1.000 12.87192 H ? A ? 58 HD2 1
   ATOM 1487 HE1 . PHE A 59 ? 24.50233 -19.66295 4.11347 1.000 12.31646 H ? A ? 58 HE1 1
   ATOM 1488 HE2 . PHE A 59 ? 27.32349 -21.99807 2.49750 1.000 11.81691 H ? A ? 58 HE2 1
   ATOM 1489 HZ . PHE A 59 ? 25.82341 -21.56098 4.23530 1.000 13.18063 H ? A ? 58 HZ 1
   ATOM 1490 N A GLY A 60 ? 27.44091 -15.27687 -1.27726 0.428 13.83430 N ? A ? 59 N 1
   ATOM 1491 CA A GLY A 60 ? 27.43543 -14.46824 -2.47273 0.428 15.98954 C ? A ? 59 CA 1
   ATOM 1492 C A GLY A 60 ? 28.44936 -14.92961 -3.49990 0.428 25.86881 C ? A ? 59 C 1
   ATOM 1493 O A GLY A 60 ? 29.01314 -16.01618 -3.40312 0.428 21.93656 O ? A ? 59 O 1
   ATOM 1494 H A GLY A 60 ? 27.79045 -14.88471 -0.59636 0.428 16.57786 H ? A ? 59 H 1
   ATOM 1495 HA2 A GLY A 60 ? 26.55491 -14.50363 -2.87810 0.428 19.16414 H ? A ? 59 HA2 1
   ATOM 1496 HA3 A GLY A 60 ? 27.63811 -13.54928 -2.23752 0.428 19.16414 H ? A ? 59 HA3 1
   ATOM 1497 N B GLY A 60 ? 27.44756 -15.28107 -1.28211 0.572 13.77388 N ? A ? 59 N 1
   ATOM 1498 CA B GLY A 60 ? 27.44688 -14.49591 -2.49301 0.572 16.02748 C ? A ? 59 CA 1
   ATOM 1499 C B GLY A 60 ? 28.63169 -14.81277 -3.36458 0.572 25.69750 C ? A ? 59 C 1
   ATOM 1500 O B GLY A 60 ? 29.45216 -15.67733 -3.06203 0.572 12.08364 O ? A ? 59 O 1
   ATOM 1501 H B GLY A 60 ? 27.79512 -14.88173 -0.60437 0.572 16.50536 H ? A ? 59 H 1
   ATOM 1502 HA2 B GLY A 60 ? 26.63731 -14.67720 -2.99564 0.572 19.20967 H ? A ? 59 HA2 1
   ATOM 1503 HA3 B GLY A 60 ? 27.47387 -13.55296 -2.26714 0.572 19.20967 H ? A ? 59 HA3 1
   ATOM 1504 N . PRO A 61 ? 28.71267 -14.09496 -4.49364 1.000 38.94898 N ? A ? 60 N 1
   ATOM 1505 CA . PRO A 61 ? 29.72896 -14.41646 -5.50085 1.000 39.00561 C ? A ? 60 CA 1
   ATOM 1506 C . PRO A 61 ? 31.10661 -14.51959 -4.86850 1.000 22.50374 C ? A ? 60 C 1
   ATOM 1507 O . PRO A 61 ? 31.52493 -13.65637 -4.09711 1.000 30.95816 O ? A ? 60 O 1
   ATOM 1508 CB . PRO A 61 ? 29.64428 -13.23324 -6.47197 1.000 56.14599 C ? A ? 60 CB 1
   ATOM 1509 CG . PRO A 61 ? 28.99614 -12.13836 -5.73489 1.000 56.60096 C ? A ? 60 CG 1
   ATOM 1510 CD . PRO A 61 ? 28.09350 -12.78207 -4.73120 1.000 45.05645 C ? A ? 60 CD 1
   ATOM 1511 HA . PRO A 61 ? 29.51245 -15.24103 -5.96358 1.000 46.78343 H ? A ? 60 HA 1
   ATOM 1512 HB2 . PRO A 61 ? 30.53753 -12.97688 -6.74997 1.000 67.35188 H ? A ? 60 HB2 1
   ATOM 1513 HB3 . PRO A 61 ? 29.11564 -13.48516 -7.24526 1.000 67.35188 H ? A ? 60 HB3 1
   ATOM 1514 HG2 . PRO A 61 ? 29.67102 -11.60052 -5.29200 1.000 67.89785 H ? A ? 60 HG2 1
   ATOM 1515 HG3 . PRO A 61 ? 28.48590 -11.58938 -6.35067 1.000 67.89785 H ? A ? 60 HG3 1
   ATOM 1516 HD2 . PRO A 61 ? 28.06487 -12.26280 -3.91240 1.000 54.04444 H ? A ? 60 HD2 1
   ATOM 1517 HD3 . PRO A 61 ? 27.19834 -12.88462 -5.09048 1.000 54.04444 H ? A ? 60 HD3 1
   ATOM 1518 N . GLY A 62 ? 31.82661 -15.58073 -5.19363 1.000 29.84291 N ? A ? 61 N 1
   ATOM 1519 CA . GLY A 62 ? 33.21027 -15.67855 -4.76127 1.000 34.34921 C ? A ? 61 CA 1
   ATOM 1520 C . GLY A 62 ? 33.42813 -16.17055 -3.35294 1.000 37.55521 C ? A ? 61 C 1
   ATOM 1521 O . GLY A 62 ? 34.57878 -16.35861 -2.96437 1.000 27.27235 O ? A ? 61 O 1
   ATOM 1522 H . GLY A 62 ? 31.54136 -16.24701 -5.65656 1.000 35.78819 H ? A ? 61 H 1
   ATOM 1523 HA2 . GLY A 62 ? 33.67504 -16.28658 -5.35724 1.000 41.19575 H ? A ? 61 HA2 1
   ATOM 1524 HA3 . GLY A 62 ? 33.61494 -14.79956 -4.82846 1.000 41.19575 H ? A ? 61 HA3 1
   ATOM 1525 N . THR A 63 ? 32.36938 -16.39122 -2.57674 1.000 21.23075 N ? A ? 62 N 1
   ATOM 1526 CA . THR A 63 ? 32.48702 -16.83288 -1.18909 1.000 17.49252 C ? A ? 62 CA 1
   ATOM 1527 C . THR A 63 ? 32.55217 -18.34553 -1.02659 1.000 13.29883 C ? A ? 62 C 1
   ATOM 1528 O . THR A 63 ? 32.24306 -18.91243 0.04248 1.000 13.59190 O ? A ? 62 O 1
   ATOM 1529 CB . THR A 63 ? 31.34330 -16.26038 -0.37229 1.000 14.38893 C ? A ? 62 CB 1
   ATOM 1530 OG1 . THR A 63 ? 30.10970 -16.88248 -0.79371 1.000 13.43344 O ? A ? 62 OG1 1
   ATOM 1531 CG2 . THR A 63 ? 31.25174 -14.74990 -0.56990 1.000 16.11627 C ? A ? 62 CG2 1
   ATOM 1532 H . THR A 63 ? 31.55590 -16.28990 -2.83673 1.000 25.45360 H ? A ? 62 H 1
   ATOM 1533 HA . THR A 63 ? 33.32140 -16.48298 -0.83940 1.000 20.96772 H ? A ? 62 HA 1
   ATOM 1534 HB . THR A 63 ? 31.48889 -16.43107 0.57141 1.000 17.24342 H ? A ? 62 HB 1
   ATOM 1535 HG1 . THR A 63 ? 29.46872 -16.58701 -0.33825 1.000 16.09683 H ? A ? 62 HG1 1
   ATOM 1536 HG21 . THR A 63 ? 30.60088 -14.37396 0.04325 1.000 19.31622 H ? A ? 62 HG21 1
   ATOM 1537 HG22 . THR A 63 ? 32.11503 -14.34049 -0.40255 1.000 19.31622 H ? A ? 62 HG22 1
   ATOM 1538 HG23 . THR A 63 ? 30.97958 -14.55018 -1.47926 1.000 19.31622 H ? A ? 62 HG23 1
   ATOM 1539 N . GLU A 64 ? 32.99174 -19.05281 -2.03917 1.000 16.27472 N ? A ? 63 N 1
   ATOM 1540 CA . GLU A 64 ? 33.18937 -20.48414 -1.88647 1.000 13.80274 C ? A ? 63 CA 1
   ATOM 1541 C . GLU A 64 ? 34.14026 -20.80635 -0.73364 1.000 12.31149 C ? A ? 63 C 1
   ATOM 1542 O . GLU A 64 ? 35.10728 -20.09407 -0.50087 1.000 12.15782 O ? A ? 63 O 1
   ATOM 1543 CB . GLU A 64 ? 33.83374 -21.01196 -3.16747 1.000 16.25959 C ? A ? 63 CB 1
   ATOM 1544 CG . GLU A 64 ? 32.86958 -21.06797 -4.22366 1.000 23.61539 C ? A ? 63 CG 1
   ATOM 1545 CD . GLU A 64 ? 32.65009 -19.76695 -4.79864 1.000 18.31256 C ? A ? 63 CD 1
   ATOM 1546 OE1 . GLU A 64 ? 33.55825 -18.89655 -4.69206 1.000 30.02634 O ? A ? 63 OE1 1
   ATOM 1547 OE2 . GLU A 64 ? 31.53312 -19.57353 -5.42960 1.000 32.42756 O ? A ? 63 OE2 1
   ATOM 1548 H . GLU A 64 ? 33.18236 -18.73933 -2.81698 1.000 19.50636 H ? A ? 63 H 1
   ATOM 1549 HA . GLU A 64 ? 32.33316 -20.90433 -1.70974 1.000 16.53999 H ? A ? 63 HA 1
   ATOM 1550 HB2 . GLU A 64 ? 34.55434 -20.42076 -3.43601 1.000 19.48821 H ? A ? 63 HB2 1
   ATOM 1551 HB3 . GLU A 64 ? 34.17780 -21.90574 -3.01355 1.000 19.48821 H ? A ? 63 HB3 1
   ATOM 1552 HG2 . GLU A 64 ? 33.19017 -21.66102 -4.92109 1.000 28.31516 H ? A ? 63 HG2 1
   ATOM 1553 HG3 . GLU A 64 ? 32.02615 -21.39405 -3.87266 1.000 28.31516 H ? A ? 63 HG3 1
   ATOM 1554 N . GLY A 65 ? 33.89163 -21.86121 -0.02295 1.000 11.61231 N ? A ? 64 N 1
   ATOM 1555 CA . GLY A 65 ? 34.75534 -22.34877 1.03200 1.000 11.69933 C ? A ? 64 CA 1
   ATOM 1556 C . GLY A 65 ? 34.02053 -22.92922 2.19864 1.000 10.38211 C ? A ? 64 C 1
   ATOM 1557 O . GLY A 65 ? 32.81646 -23.15584 2.14224 1.000 11.44536 O ? A ? 64 O 1
   ATOM 1558 H . GLY A 65 ? 33.19079 -22.34797 -0.13009 1.000 13.91147 H ? A ? 64 H 1
   ATOM 1559 HA2 . GLY A 65 ? 35.33530 -23.03786 0.67187 1.000 14.01590 H ? A ? 64 HA2 1
   ATOM 1560 HA3 . GLY A 65 ? 35.30055 -21.61556 1.35765 1.000 14.01590 H ? A ? 64 HA3 1
   ATOM 1561 N . GLY A 66 ? 34.72606 -23.17347 3.28436 1.000 11.69383 N ? A ? 65 N 1
   ATOM 1562 CA . GLY A 66 ? 34.14417 -23.81026 4.43912 1.000 10.73432 C ? A ? 65 CA 1
   ATOM 1563 C . GLY A 66 ? 33.59408 -25.16108 4.05516 1.000 11.16703 C ? A ? 65 C 1
   ATOM 1564 O . GLY A 66 ? 34.18494 -25.91637 3.24421 1.000 13.55147 O ? A ? 65 O 1
   ATOM 1565 H . GLY A 66 ? 35.55791 -22.97641 3.37814 1.000 14.00929 H ? A ? 65 H 1
   ATOM 1566 HA2 . GLY A 66 ? 34.81753 -23.92690 5.12751 1.000 12.85789 H ? A ? 65 HA2 1
   ATOM 1567 HA3 . GLY A 66 ? 33.42413 -23.26382 4.79103 1.000 12.85789 H ? A ? 65 HA3 1
   ATOM 1568 N A ASP A 67 ? 32.47482 -25.52385 4.67520 0.544 10.40915 N ? A ? 66 N 1
   ATOM 1569 CA A ASP A 67 ? 31.81173 -26.78248 4.35485 0.544 12.86789 C ? A ? 66 CA 1
   ATOM 1570 C A ASP A 67 ? 30.64351 -26.57395 3.39326 0.544 11.74059 C ? A ? 66 C 1
   ATOM 1571 O A ASP A 67 ? 29.73224 -27.40477 3.33079 0.544 12.99675 O ? A ? 66 O 1
   ATOM 1572 CB A ASP A 67 ? 31.38839 -27.49521 5.64313 0.544 11.87936 C ? A ? 66 CB 1
   ATOM 1573 CG A ASP A 67 ? 32.56411 -28.11719 6.42412 0.544 18.83641 C ? A ? 66 CG 1
   ATOM 1574 OD1 A ASP A 67 ? 33.74735 -28.09236 5.95545 0.544 15.64198 O ? A ? 66 OD1 1
   ATOM 1575 OD2 A ASP A 67 ? 32.28695 -28.64701 7.52143 0.544 14.70339 O ? A ? 66 OD2 1
   ATOM 1576 H A ASP A 67 ? 32.08252 -25.05859 5.28285 0.544 12.46768 H ? A ? 66 H 1
   ATOM 1577 HA A ASP A 67 ? 32.43454 -27.37821 3.90975 0.544 15.41817 H ? A ? 66 HA 1
   ATOM 1578 HB2 A ASP A 67 ? 30.95251 -26.85397 6.22599 0.544 14.23193 H ? A ? 66 HB2 1
   ATOM 1579 HB3 A ASP A 67 ? 30.77275 -28.20982 5.41681 0.544 14.23193 H ? A ? 66 HB3 1
   ATOM 1580 N B ASP A 67 ? 32.46712 -25.51939 4.68429 0.456 10.40117 N ? A ? 66 N 1
   ATOM 1581 CA B ASP A 67 ? 31.75694 -26.75849 4.37600 0.456 12.47318 C ? A ? 66 CA 1
   ATOM 1582 C B ASP A 67 ? 30.58844 -26.53570 3.43671 0.456 11.55990 C ? A ? 66 C 1
   ATOM 1583 O B ASP A 67 ? 29.63968 -27.32988 3.41889 0.456 14.42453 O ? A ? 66 O 1
   ATOM 1584 CB B ASP A 67 ? 31.35972 -27.44713 5.67321 0.456 12.29213 C ? A ? 66 CB 1
   ATOM 1585 CG B ASP A 67 ? 32.52702 -28.15163 6.30242 0.456 19.05307 C ? A ? 66 CG 1
   ATOM 1586 OD1 B ASP A 67 ? 33.36509 -28.67230 5.53048 0.456 16.01798 O ? A ? 66 OD1 1
   ATOM 1587 OD2 B ASP A 67 ? 32.64060 -28.19745 7.53546 0.456 20.68099 O ? A ? 66 OD2 1
   ATOM 1588 H B ASP A 67 ? 32.09286 -25.05162 5.30131 0.456 12.45810 H ? A ? 66 H 1
   ATOM 1589 HA B ASP A 67 ? 32.34573 -27.37242 3.90981 0.456 14.94452 H ? A ? 66 HA 1
   ATOM 1590 HB2 B ASP A 67 ? 31.02905 -26.78473 6.29994 0.456 14.72726 H ? A ? 66 HB2 1
   ATOM 1591 HB3 B ASP A 67 ? 30.66973 -28.10374 5.48969 0.456 14.72726 H ? A ? 66 HB3 1
   ATOM 1592 N . ALA A 68 ? 30.64056 -25.47870 2.64698 1.000 11.34449 N ? A ? 67 N 1
   ATOM 1593 CA . ALA A 68 ? 29.60523 -25.20892 1.65462 1.000 12.58938 C ? A ? 67 CA 1
   ATOM 1594 C . ALA A 68 ? 29.91286 -25.97213 0.36499 1.000 11.93927 C ? A ? 67 C 1
   ATOM 1595 O . ALA A 68 ? 31.03902 -25.87490 -0.15064 1.000 14.25203 O ? A ? 67 O 1
   ATOM 1596 CB . ALA A 68 ? 29.60346 -23.71694 1.34831 1.000 11.51317 C ? A ? 67 CB 1
   ATOM 1597 HA . ALA A 68 ? 28.74277 -25.49379 1.99508 1.000 15.08396 H ? A ? 67 HA 1
   ATOM 1598 HB1 . ALA A 68 ? 28.96207 -23.54023 0.64241 1.000 13.79250 H ? A ? 67 HB1 1
   ATOM 1599 HB2 . ALA A 68 ? 29.35553 -23.23027 2.14993 1.000 13.79250 H ? A ? 67 HB2 1
   ATOM 1600 HB3 . ALA A 68 ? 30.49166 -23.45226 1.06207 1.000 13.79250 H ? A ? 67 HB3 1
   ATOM 1601 H A ALA A 68 ? 31.23836 -24.86236 2.69548 0.544 13.59008 H ? A ? 67 H 1
   ATOM 1602 H B ALA A 68 ? 31.27027 -24.89318 2.66260 0.456 13.59008 H ? A ? 67 H 1
   ATOM 1603 N . ARG A 69 ? 28.96308 -26.76655 -0.14217 1.000 11.42963 N ? A ? 68 N 1
   ATOM 1604 CA . ARG A 69 ? 29.19757 -27.46056 -1.41039 1.000 10.72722 C ? A ? 68 CA 1
   ATOM 1605 C . ARG A 69 ? 29.07129 -26.51310 -2.60007 1.000 12.90628 C ? A ? 68 C 1
   ATOM 1606 O . ARG A 69 ? 28.27656 -25.58268 -2.56995 1.000 12.78268 O ? A ? 68 O 1
   ATOM 1607 H . ARG A 69 ? 28.19682 -26.91555 0.21871 1.000 13.69226 H ? A ? 68 H 1
   ATOM 1608 HA . ARG A 69 ? 30.10088 -27.81376 -1.42397 1.000 12.84937 H ? A ? 68 HA 1
   ATOM 1609 CB A ARG A 69 ? 28.20264 -28.61540 -1.55143 0.432 14.44258 C ? A ? 68 CB 1
   ATOM 1610 CG A ARG A 69 ? 28.39161 -29.73073 -0.52082 0.432 14.39242 C ? A ? 68 CG 1
   ATOM 1611 CD A ARG A 69 ? 27.39750 -30.88779 -0.66100 0.432 17.07675 C ? A ? 68 CD 1
   ATOM 1612 NE A ARG A 69 ? 27.48289 -31.57421 -1.94499 0.432 26.41396 N ? A ? 68 NE 1
   ATOM 1613 CZ A ARG A 69 ? 26.76613 -32.64061 -2.28531 0.432 28.04901 C ? A ? 68 CZ 1
   ATOM 1614 NH1 A ARG A 69 ? 25.89638 -33.19140 -1.45203 0.432 28.20368 N ? A ? 68 NH1 1
   ATOM 1615 NH2 A ARG A 69 ? 26.93726 -33.17810 -3.48981 0.432 22.30470 N ? A ? 68 NH2 1
   ATOM 1616 HB2 A ARG A 69 ? 27.30397 -28.26582 -1.44622 0.432 17.30779 H ? A ? 68 HB2 1
   ATOM 1617 HB3 A ARG A 69 ? 28.30495 -29.00772 -2.43263 0.432 17.30779 H ? A ? 68 HB3 1
   ATOM 1618 HG2 A ARG A 69 ? 29.28439 -30.09710 -0.61886 0.432 17.24760 H ? A ? 68 HG2 1
   ATOM 1619 HG3 A ARG A 69 ? 28.28252 -29.35577 0.36710 0.432 17.24760 H ? A ? 68 HG3 1
   ATOM 1620 HD2 A ARG A 69 ? 27.57391 -31.53897 0.03595 0.432 20.46881 H ? A ? 68 HD2 1
   ATOM 1621 HD3 A ARG A 69 ? 26.49660 -30.54000 -0.56975 0.432 20.46881 H ? A ? 68 HD3 1
   ATOM 1622 HE A ARG A 69 ? 28.03819 -31.26615 -2.52494 0.432 31.67345 H ? A ? 68 HE 1
   ATOM 1623 HH11 A ARG A 69 ? 25.78345 -32.85919 -0.66686 0.432 33.82112 H ? A ? 68 HH11 1
   ATOM 1624 HH12 A ARG A 69 ? 25.44457 -33.88124 -1.69612 0.432 33.82112 H ? A ? 68 HH12 1
   ATOM 1625 HH21 A ARG A 69 ? 27.50572 -32.83555 -4.03672 0.432 26.74234 H ? A ? 68 HH21 1
   ATOM 1626 HH22 A ARG A 69 ? 26.47945 -33.86819 -3.72172 0.432 26.74234 H ? A ? 68 HH22 1
   ATOM 1627 CB B ARG A 69 ? 28.20348 -28.61296 -1.55805 0.278 14.60597 C ? A ? 68 CB 1
   ATOM 1628 CG B ARG A 69 ? 28.40558 -29.77302 -0.57736 0.278 14.70279 C ? A ? 68 CG 1
   ATOM 1629 CD B ARG A 69 ? 27.52591 -30.98819 -0.92749 0.278 17.14858 C ? A ? 68 CD 1
   ATOM 1630 NE B ARG A 69 ? 27.98768 -32.22752 -0.31277 0.278 17.72624 N ? A ? 68 NE 1
   ATOM 1631 CZ B ARG A 69 ? 27.27688 -32.96001 0.53640 0.278 20.23937 C ? A ? 68 CZ 1
   ATOM 1632 NH1 B ARG A 69 ? 26.04227 -32.62780 0.87488 0.278 20.54337 N ? A ? 68 NH1 1
   ATOM 1633 NH2 B ARG A 69 ? 27.82258 -34.04936 1.07056 0.278 20.69454 N ? A ? 68 NH2 1
   ATOM 1634 HB2 B ARG A 69 ? 27.30855 -28.26614 -1.41766 0.278 17.50387 H ? A ? 68 HB2 1
   ATOM 1635 HB3 B ARG A 69 ? 28.28263 -28.97347 -2.45509 0.278 17.50387 H ? A ? 68 HB3 1
   ATOM 1636 HG2 B ARG A 69 ? 29.33356 -30.05426 -0.60285 0.278 17.62005 H ? A ? 68 HG2 1
   ATOM 1637 HG3 B ARG A 69 ? 28.17252 -29.47883 0.31709 0.278 17.62005 H ? A ? 68 HG3 1
   ATOM 1638 HD2 B ARG A 69 ? 26.62162 -30.82139 -0.61873 0.278 20.55499 H ? A ? 68 HD2 1
   ATOM 1639 HD3 B ARG A 69 ? 27.53030 -31.11308 -1.88940 0.278 20.55499 H ? A ? 68 HD3 1
   ATOM 1640 HE B ARG A 69 ? 28.77672 -32.50359 -0.51475 0.278 21.24818 H ? A ? 68 HE 1
   ATOM 1641 HH11 B ARG A 69 ? 25.68059 -31.92172 0.54285 0.278 24.62874 H ? A ? 68 HH11 1
   ATOM 1642 HH12 B ARG A 69 ? 25.60114 -33.11786 1.42701 0.278 24.62874 H ? A ? 68 HH12 1
   ATOM 1643 HH21 B ARG A 69 ? 28.62730 -34.27228 0.86478 0.278 24.81014 H ? A ? 68 HH21 1
   ATOM 1644 HH22 B ARG A 69 ? 27.37064 -34.53065 1.62166 0.278 24.81014 H ? A ? 68 HH22 1
   ATOM 1645 CB C ARG A 69 ? 28.21967 -28.62664 -1.54236 0.290 14.65110 C ? A ? 68 CB 1
   ATOM 1646 CG C ARG A 69 ? 28.52419 -29.77939 -0.58762 0.290 15.06009 C ? A ? 68 CG 1
   ATOM 1647 CD C ARG A 69 ? 27.51754 -30.92219 -0.67248 0.290 17.07916 C ? A ? 68 CD 1
   ATOM 1648 NE C ARG A 69 ? 28.02437 -32.15071 -0.07443 0.290 18.35336 N ? A ? 68 NE 1
   ATOM 1649 CZ C ARG A 69 ? 27.33399 -33.27773 0.03899 0.290 20.99264 C ? A ? 68 CZ 1
   ATOM 1650 NH1 C ARG A 69 ? 26.07345 -33.35512 -0.34490 0.290 15.72182 N ? A ? 68 NH1 1
   ATOM 1651 NH2 C ARG A 69 ? 27.93173 -34.35942 0.53361 0.290 24.15741 N ? A ? 68 NH2 1
   ATOM 1652 HB2 C ARG A 69 ? 27.32388 -28.30832 -1.34965 0.290 17.55803 H ? A ? 68 HB2 1
   ATOM 1653 HB3 C ARG A 69 ? 28.26180 -28.97054 -2.44837 0.290 17.55803 H ? A ? 68 HB3 1
   ATOM 1654 HG2 C ARG A 69 ? 29.39960 -30.13933 -0.79977 0.290 18.04880 H ? A ? 68 HG2 1
   ATOM 1655 HG3 C ARG A 69 ? 28.51517 -29.44360 0.32235 0.290 18.04880 H ? A ? 68 HG3 1
   ATOM 1656 HD2 C ARG A 69 ? 26.70827 -30.66886 -0.20153 0.290 20.47169 H ? A ? 68 HD2 1
   ATOM 1657 HD3 C ARG A 69 ? 27.31688 -31.10077 -1.60454 0.290 20.47169 H ? A ? 68 HD3 1
   ATOM 1658 HE C ARG A 69 ? 28.82981 -32.14458 0.22695 0.290 22.00073 H ? A ? 68 HE 1
   ATOM 1659 HH11 C ARG A 69 ? 25.68201 -32.66521 -0.67717 0.290 18.84288 H ? A ? 68 HH11 1
   ATOM 1660 HH12 C ARG A 69 ? 25.64361 -34.09545 -0.26276 0.290 18.84288 H ? A ? 68 HH12 1
   ATOM 1661 HH21 C ARG A 69 ? 28.75623 -34.32245 0.77532 0.290 28.96559 H ? A ? 68 HH21 1
   ATOM 1662 HH22 C ARG A 69 ? 27.49339 -35.09522 0.61145 0.290 28.96559 H ? A ? 68 HH22 1
   ATOM 1663 N . PRO A 70 ? 29.85157 -26.74687 -3.67599 1.000 12.74761 N ? A ? 69 N 1
   ATOM 1664 CA . PRO A 70 ? 29.80873 -25.84014 -4.82806 1.000 13.31297 C ? A ? 69 CA 1
   ATOM 1665 C . PRO A 70 ? 28.45572 -25.74647 -5.50391 1.000 10.81340 C ? A ? 69 C 1
   ATOM 1666 O . PRO A 70 ? 28.19803 -24.75504 -6.18364 1.000 13.87951 O ? A ? 69 O 1
   ATOM 1667 CB . PRO A 70 ? 30.85778 -26.43698 -5.77333 1.000 13.77155 C ? A ? 69 CB 1
   ATOM 1668 CG . PRO A 70 ? 31.14000 -27.79170 -5.27251 1.000 17.88946 C ? A ? 69 CG 1
   ATOM 1669 CD . PRO A 70 ? 30.87975 -27.79693 -3.80202 1.000 18.40417 C ? A ? 69 CD 1
   ATOM 1670 HA . PRO A 70 ? 30.07960 -24.95135 -4.54951 1.000 15.95227 H ? A ? 69 HA 1
   ATOM 1671 HB2 . PRO A 70 ? 30.50063 -26.47238 -6.67449 1.000 16.50256 H ? A ? 69 HB2 1
   ATOM 1672 HB3 . PRO A 70 ? 31.65947 -25.89120 -5.75539 1.000 16.50256 H ? A ? 69 HB3 1
   ATOM 1673 HG2 . PRO A 70 ? 30.55732 -28.42530 -5.71965 1.000 21.44405 H ? A ? 69 HG2 1
   ATOM 1674 HG3 . PRO A 70 ? 32.06785 -28.01124 -5.45083 1.000 21.44405 H ? A ? 69 HG3 1
   ATOM 1675 HD2 . PRO A 70 ? 30.54104 -28.65714 -3.50838 1.000 22.06170 H ? A ? 69 HD2 1
   ATOM 1676 HD3 . PRO A 70 ? 31.67925 -27.56730 -3.30305 1.000 22.06170 H ? A ? 69 HD3 1
   ATOM 1677 N A GLU A 71 ? 27.66692 -26.83052 -5.42458 0.491 15.06320 N ? A ? 70 N 1
   ATOM 1678 CA A GLU A 71 ? 26.35265 -26.84043 -6.03998 0.491 15.80585 C ? A ? 70 CA 1
   ATOM 1679 C A GLU A 71 ? 25.41685 -25.84581 -5.39382 0.491 16.38244 C ? A ? 70 C 1
   ATOM 1680 O A GLU A 71 ? 24.35376 -25.54856 -5.94590 0.491 13.50292 O ? A ? 70 O 1
   ATOM 1681 CB A GLU A 71 ? 25.74384 -28.21757 -5.86996 0.491 16.62380 C ? A ? 70 CB 1
   ATOM 1682 CG A GLU A 71 ? 26.38408 -29.28997 -6.67132 0.491 18.95204 C ? A ? 70 CG 1
   ATOM 1683 CD A GLU A 71 ? 27.62900 -29.84731 -6.00477 0.491 21.16539 C ? A ? 70 CD 1
   ATOM 1684 OE1 A GLU A 71 ? 27.85226 -29.60852 -4.80061 0.491 22.06006 O ? A ? 70 OE1 1
   ATOM 1685 OE2 A GLU A 71 ? 28.39355 -30.56917 -6.69824 0.491 22.45257 O ? A ? 70 OE2 1
   ATOM 1686 H A GLU A 71 ? 27.87656 -27.56088 -5.02180 0.491 18.05254 H ? A ? 70 H 1
   ATOM 1687 HA A GLU A 71 ? 26.44540 -26.62615 -6.98146 0.491 18.94372 H ? A ? 70 HA 1
   ATOM 1688 HB2 A GLU A 71 ? 25.81402 -28.47101 -4.93629 0.491 19.92527 H ? A ? 70 HB2 1
   ATOM 1689 HB3 A GLU A 71 ? 24.81116 -28.17543 -6.13308 0.491 19.92527 H ? A ? 70 HB3 1
   ATOM 1690 HG2 A GLU A 71 ? 25.75366 -30.01780 -6.78847 0.491 22.71915 H ? A ? 70 HG2 1
   ATOM 1691 HG3 A GLU A 71 ? 26.64017 -28.93059 -7.53513 0.491 22.71915 H ? A ? 70 HG3 1
   ATOM 1692 N B GLU A 71 ? 27.57912 -26.74144 -5.32234 0.509 14.50955 N ? A ? 70 N 1
   ATOM 1693 CA B GLU A 71 ? 26.25059 -26.72222 -5.93239 0.509 13.50238 C ? A ? 70 CA 1
   ATOM 1694 C B GLU A 71 ? 25.41159 -25.52165 -5.48738 0.509 10.36686 C ? A ? 70 C 1
   ATOM 1695 O B GLU A 71 ? 24.48160 -25.10418 -6.20426 0.509 11.20283 O ? A ? 70 O 1
   ATOM 1696 CB B GLU A 71 ? 25.55004 -28.02561 -5.52907 0.509 18.73082 C ? A ? 70 CB 1
   ATOM 1697 CG B GLU A 71 ? 26.05994 -29.34989 -6.18973 0.509 22.14123 C ? A ? 70 CG 1
   ATOM 1698 CD B GLU A 71 ? 27.15558 -30.11041 -5.40467 0.509 21.90998 C ? A ? 70 CD 1
   ATOM 1699 OE1 B GLU A 71 ? 27.95529 -29.46890 -4.68662 0.509 21.73723 O ? A ? 70 OE1 1
   ATOM 1700 OE2 B GLU A 71 ? 27.20239 -31.36387 -5.47909 0.509 28.78279 O ? A ? 70 OE2 1
   ATOM 1701 H B GLU A 71 ? 27.73156 -27.44206 -4.84749 0.509 17.38817 H ? A ? 70 H 1
   ATOM 1702 HA B GLU A 71 ? 26.33308 -26.65906 -6.89681 0.509 16.17955 H ? A ? 70 HA 1
   ATOM 1703 HB2 B GLU A 71 ? 25.65054 -28.13341 -4.57033 0.509 22.45369 H ? A ? 70 HB2 1
   ATOM 1704 HB3 B GLU A 71 ? 24.61090 -27.94177 -5.75686 0.509 22.45369 H ? A ? 70 HB3 1
   ATOM 1705 HG2 B GLU A 71 ? 25.30577 -29.95200 -6.28765 0.509 26.54617 H ? A ? 70 HG2 1
   ATOM 1706 HG3 B GLU A 71 ? 26.42759 -29.13421 -7.06106 0.509 26.54617 H ? A ? 70 HG3 1
   ATOM 1707 N A ILE A 72 ? 25.78434 -25.33247 -4.22529 0.491 14.25902 N ? A ? 71 N 1
   ATOM 1708 CA A ILE A 72 ? 25.11044 -24.14190 -3.72836 0.491 10.87982 C ? A ? 71 CA 1
   ATOM 1709 C A ILE A 72 ? 25.06284 -23.08362 -4.82622 0.491 12.69475 C ? A ? 71 C 1
   ATOM 1710 O A ILE A 72 ? 24.02731 -22.45604 -5.06698 0.491 14.09683 O ? A ? 71 O 1
   ATOM 1711 CB A ILE A 72 ? 25.79654 -23.62401 -2.44516 0.491 9.78927 C ? A ? 71 CB 1
   ATOM 1712 CG1 A ILE A 72 ? 25.56594 -24.61996 -1.29165 0.491 10.74094 C ? A ? 71 CG1 1
   ATOM 1713 CG2 A ILE A 72 ? 25.30410 -22.22107 -2.06993 0.491 8.56892 C ? A ? 71 CG2 1
   ATOM 1714 CD1 A ILE A 72 ? 26.18377 -24.22405 0.04412 0.491 10.29741 C ? A ? 71 CD1 1
   ATOM 1715 H A ILE A 72 ? 26.40269 -25.64539 -3.71605 0.491 17.08752 H ? A ? 71 H 1
   ATOM 1716 HA A ILE A 72 ? 24.19843 -24.36946 -3.48888 0.491 13.03248 H ? A ? 71 HA 1
   ATOM 1717 HB A ILE A 72 ? 26.74889 -23.55663 -2.61661 0.491 11.72382 H ? A ? 71 HB 1
   ATOM 1718 HG12 A ILE A 72 ? 24.61027 -24.71123 -1.15279 0.491 12.86582 H ? A ? 71 HG12 1
   ATOM 1719 HG13 A ILE A 72 ? 25.94753 -25.47503 -1.54493 0.491 12.86582 H ? A ? 71 HG13 1
   ATOM 1720 HG21 A ILE A 72 ? 25.60954 -22.00825 -1.17421 0.491 10.25941 H ? A ? 71 HG21 1
   ATOM 1721 HG22 A ILE A 72 ? 25.66384 -21.58027 -2.70307 0.491 10.25941 H ? A ? 71 HG22 1
   ATOM 1722 HG23 A ILE A 72 ? 24.33467 -22.20794 -2.10069 0.491 10.25941 H ? A ? 71 HG23 1
   ATOM 1723 HD11 A ILE A 72 ? 26.32907 -25.02334 0.57414 0.491 12.33360 H ? A ? 71 HD11 1
   ATOM 1724 HD12 A ILE A 72 ? 27.02908 -23.77713 -0.11901 0.491 12.33360 H ? A ? 71 HD12 1
   ATOM 1725 HD13 A ILE A 72 ? 25.57722 -23.62556 0.50760 0.491 12.33360 H ? A ? 71 HD13 1
   ATOM 1726 N B ILE A 72 ? 25.71773 -24.94563 -4.32060 0.509 9.08884 N ? A ? 71 N 1
   ATOM 1727 CA B ILE A 72 ? 25.02954 -23.73336 -3.88831 0.509 10.39147 C ? A ? 71 CA 1
   ATOM 1728 C B ILE A 72 ? 25.05328 -22.65188 -4.96293 0.509 9.70678 C ? A ? 71 C 1
   ATOM 1729 O B ILE A 72 ? 24.06805 -21.91420 -5.15329 0.509 9.35975 O ? A ? 71 O 1
   ATOM 1730 CB B ILE A 72 ? 25.67392 -23.23582 -2.58194 0.509 9.60441 C ? A ? 71 CB 1
   ATOM 1731 CG1 B ILE A 72 ? 25.42592 -24.23102 -1.45871 0.509 8.46563 C ? A ? 71 CG1 1
   ATOM 1732 CG2 B ILE A 72 ? 25.22778 -21.81267 -2.26477 0.509 11.03360 C ? A ? 71 CG2 1
   ATOM 1733 CD1 B ILE A 72 ? 26.08903 -23.87682 -0.15959 0.509 9.35686 C ? A ? 71 CD1 1
   ATOM 1734 H B ILE A 72 ? 26.31212 -25.23482 -3.77045 0.509 10.88331 H ? A ? 71 H 1
   ATOM 1735 HA B ILE A 72 ? 24.09688 -23.94909 -3.73175 0.509 12.44646 H ? A ? 71 HA 1
   ATOM 1736 HB B ILE A 72 ? 26.63651 -23.18924 -2.69221 0.509 11.50199 H ? A ? 71 HB 1
   ATOM 1737 HG12 B ILE A 72 ? 24.47102 -24.28267 -1.29621 0.509 10.13546 H ? A ? 71 HG12 1
   ATOM 1738 HG13 B ILE A 72 ? 25.76308 -25.09807 -1.73340 0.509 10.13546 H ? A ? 71 HG13 1
   ATOM 1739 HG21 B ILE A 72 ? 25.46519 -21.60427 -1.34765 0.509 13.21702 H ? A ? 71 HG21 1
   ATOM 1740 HG22 B ILE A 72 ? 25.67423 -21.19958 -2.86950 0.509 13.21702 H ? A ? 71 HG22 1
   ATOM 1741 HG23 B ILE A 72 ? 24.26670 -21.74990 -2.38009 0.509 13.21702 H ? A ? 71 HG23 1
   ATOM 1742 HD11 B ILE A 72 ? 26.14661 -24.67213 0.39272 0.509 11.20493 H ? A ? 71 HD11 1
   ATOM 1743 HD12 B ILE A 72 ? 26.97853 -23.53552 -0.34181 0.509 11.20493 H ? A ? 71 HD12 1
   ATOM 1744 HD13 B ILE A 72 ? 25.56049 -23.19922 0.29031 0.509 11.20493 H ? A ? 71 HD13 1
   ATOM 1745 N A TRP A 73 ? 26.18241 -22.90048 -5.54335 0.491 12.21820 N ? A ? 72 N 1
   ATOM 1746 CA A TRP A 73 ? 26.33061 -21.80779 -6.50585 0.491 11.28243 C ? A ? 72 CA 1
   ATOM 1747 C A TRP A 73 ? 25.91929 -22.16143 -7.91663 0.491 16.19149 C ? A ? 72 C 1
   ATOM 1748 O A TRP A 73 ? 25.29849 -21.35934 -8.60373 0.491 24.02241 O ? A ? 72 O 1
   ATOM 1749 CB A TRP A 73 ? 27.78977 -21.33591 -6.52186 0.491 13.66371 C ? A ? 72 CB 1
   ATOM 1750 CG A TRP A 73 ? 28.07793 -20.65294 -5.26266 0.491 13.50084 C ? A ? 72 CG 1
   ATOM 1751 CD1 A TRP A 73 ? 27.82357 -19.34844 -4.96397 0.491 23.05670 C ? A ? 72 CD1 1
   ATOM 1752 CD2 A TRP A 73 ? 28.63060 -21.22532 -4.07934 0.491 11.87216 C ? A ? 72 CD2 1
   ATOM 1753 NE1 A TRP A 73 ? 28.16930 -19.07449 -3.66722 0.491 17.63665 N ? A ? 72 NE1 1
   ATOM 1754 CE2 A TRP A 73 ? 28.70409 -20.19898 -3.11388 0.491 11.10866 C ? A ? 72 CE2 1
   ATOM 1755 CE3 A TRP A 73 ? 29.10932 -22.48610 -3.75114 0.491 14.92325 C ? A ? 72 CE3 1
   ATOM 1756 CZ2 A TRP A 73 ? 29.19630 -20.39680 -1.82989 0.491 11.66442 C ? A ? 72 CZ2 1
   ATOM 1757 CZ3 A TRP A 73 ? 29.60698 -22.69764 -2.47040 0.491 11.47619 C ? A ? 72 CZ3 1
   ATOM 1758 CH2 A TRP A 73 ? 29.64448 -21.65342 -1.51422 0.491 9.66216 C ? A ? 72 CH2 1
   ATOM 1759 H A TRP A 73 ? 26.87712 -23.40427 -5.48700 0.491 14.63854 H ? A ? 72 H 1
   ATOM 1760 HA A TRP A 73 ? 25.75305 -21.08499 -6.21452 0.491 13.51562 H ? A ? 72 HA 1
   ATOM 1761 HB2 A TRP A 73 ? 28.38300 -22.09807 -6.61178 0.491 16.37316 H ? A ? 72 HB2 1
   ATOM 1762 HB3 A TRP A 73 ? 27.92967 -20.71813 -7.25649 0.491 16.37316 H ? A ? 72 HB3 1
   ATOM 1763 HD1 A TRP A 73 ? 27.46484 -18.72952 -5.55824 0.491 27.64475 H ? A ? 72 HD1 1
   ATOM 1764 HE1 A TRP A 73 ? 28.06613 -18.31926 -3.26898 0.491 21.14068 H ? A ? 72 HE1 1
   ATOM 1765 HE3 A TRP A 73 ? 29.09742 -23.17540 -4.37534 0.491 17.88460 H ? A ? 72 HE3 1
   ATOM 1766 HZ2 A TRP A 73 ? 29.22080 -19.70454 -1.20934 0.491 13.97401 H ? A ? 72 HZ2 1
   ATOM 1767 HZ3 A TRP A 73 ? 29.92137 -23.54117 -2.23695 0.491 13.74813 H ? A ? 72 HZ3 1
   ATOM 1768 HH2 A TRP A 73 ? 29.97702 -21.82217 -0.66225 0.491 11.57129 H ? A ? 72 HH2 1
   ATOM 1769 N B TRP A 73 ? 26.20193 -22.51388 -5.63639 0.509 10.99931 N ? A ? 72 N 1
   ATOM 1770 CA B TRP A 73 ? 26.42123 -21.52751 -6.67979 0.509 14.43217 C ? A ? 72 CA 1
   ATOM 1771 C B TRP A 73 ? 26.04780 -22.05178 -8.06246 0.509 15.71876 C ? A ? 72 C 1
   ATOM 1772 O B TRP A 73 ? 25.51569 -21.29474 -8.87676 0.509 17.11175 O ? A ? 72 O 1
   ATOM 1773 CB B TRP A 73 ? 27.88914 -21.08616 -6.65077 0.509 11.05643 C ? A ? 72 CB 1
   ATOM 1774 CG B TRP A 73 ? 28.25963 -20.27420 -5.43722 0.509 12.42994 C ? A ? 72 CG 1
   ATOM 1775 CD1 B TRP A 73 ? 28.20056 -18.91542 -5.31213 0.509 11.52896 C ? A ? 72 CD1 1
   ATOM 1776 CD2 B TRP A 73 ? 28.68846 -20.76817 -4.15706 0.509 9.48867 C ? A ? 72 CD2 1
   ATOM 1777 NE1 B TRP A 73 ? 28.57894 -18.53650 -4.05083 0.509 10.97655 N ? A ? 72 NE1 1
   ATOM 1778 CE2 B TRP A 73 ? 28.89013 -19.64773 -3.32067 0.509 10.26229 C ? A ? 72 CE2 1
   ATOM 1779 CE3 B TRP A 73 ? 28.95053 -22.03794 -3.64549 0.509 9.32942 C ? A ? 72 CE3 1
   ATOM 1780 CZ2 B TRP A 73 ? 29.32222 -19.75748 -2.00702 0.509 8.57799 C ? A ? 72 CZ2 1
   ATOM 1781 CZ3 B TRP A 73 ? 29.38462 -22.14255 -2.33713 0.509 8.36820 C ? A ? 72 CZ3 1
   ATOM 1782 CH2 B TRP A 73 ? 29.55048 -21.03040 -1.53257 0.509 6.47912 C ? A ? 72 CH2 1
   ATOM 1783 H B TRP A 73 ? 26.89436 -23.00418 -5.49587 0.509 13.17587 H ? A ? 72 H 1
   ATOM 1784 HA B TRP A 73 ? 25.86731 -20.74898 -6.51260 0.509 17.29531 H ? A ? 72 HA 1
   ATOM 1785 HB2 B TRP A 73 ? 28.45189 -21.87618 -6.66039 0.509 13.24441 H ? A ? 72 HB2 1
   ATOM 1786 HB3 B TRP A 73 ? 28.06637 -20.54304 -7.43467 0.509 13.24441 H ? A ? 72 HB3 1
   ATOM 1787 HD1 B TRP A 73 ? 27.94055 -18.33065 -5.98691 0.509 13.81145 H ? A ? 72 HD1 1
   ATOM 1788 HE1 B TRP A 73 ? 28.61480 -17.72647 -3.76421 0.509 13.14856 H ? A ? 72 HE1 1
   ATOM 1789 HE3 B TRP A 73 ? 28.83617 -22.79632 -4.17149 0.509 11.17200 H ? A ? 72 HE3 1
   ATOM 1790 HZ2 B TRP A 73 ? 29.45159 -19.00763 -1.47232 0.509 10.27029 H ? A ? 72 HZ2 1
   ATOM 1791 HZ3 B TRP A 73 ? 29.57026 -22.98448 -1.98842 0.509 10.01854 H ? A ? 72 HZ3 1
   ATOM 1792 HH2 B TRP A 73 ? 29.82247 -21.14438 -0.65057 0.509 7.75164 H ? A ? 72 HH2 1
   ATOM 1793 N . SER A 74 ? 26.31090 -23.32056 -8.37251 1.000 14.00834 N ? A ? 73 N 1
   ATOM 1794 CA . SER A 74 ? 25.95941 -23.78499 -9.71152 1.000 22.02495 C ? A ? 73 CA 1
   ATOM 1795 C . SER A 74 ? 24.47569 -24.11729 -9.85362 1.000 21.87493 C ? A ? 73 C 1
   ATOM 1796 O . SER A 74 ? 23.96942 -24.13868 -10.97918 1.000 26.45425 O ? A ? 73 O 1
   ATOM 1797 CB . SER A 74 ? 26.83160 -24.99517 -10.09898 1.000 20.69694 C ? A ? 73 CB 1
   ATOM 1798 OG . SER A 74 ? 26.63597 -26.06440 -9.25678 1.000 18.13079 O ? A ? 73 OG 1
   ATOM 1799 HA . SER A 74 ? 26.15006 -23.07874 -10.34851 1.000 26.40664 H ? A ? 73 HA 1
   ATOM 1800 HB2 . SER A 74 ? 26.60429 -25.26552 -11.00238 1.000 24.81303 H ? A ? 73 HB2 1
   ATOM 1801 HB3 . SER A 74 ? 27.76435 -24.73241 -10.05609 1.000 24.81303 H ? A ? 73 HB3 1
   ATOM 1802 HG . SER A 74 ? 27.06554 -26.73087 -9.53406 1.000 21.73365 H ? A ? 73 HG 1
   ATOM 1803 H A SER A 74 ? 26.79127 -23.87857 -7.92815 0.491 16.78671 H ? A ? 73 H 1
   ATOM 1804 H B SER A 74 ? 26.67335 -23.90153 -7.85222 0.509 16.78671 H ? A ? 73 H 1
   ATOM 1805 N . ASP A 75 ? 23.76461 -24.35399 -8.74804 1.000 16.21655 N ? A ? 74 N 1
   ATOM 1806 CA . ASP A 75 ? 22.32411 -24.56927 -8.75329 1.000 17.26946 C ? A ? 74 CA 1
   ATOM 1807 C . ASP A 75 ? 21.67265 -23.47649 -7.91973 1.000 15.65439 C ? A ? 74 C 1
   ATOM 1808 O . ASP A 75 ? 21.00954 -23.75846 -6.91839 1.000 15.98880 O ? A ? 74 O 1
   ATOM 1809 CB . ASP A 75 ? 21.98913 -25.94625 -8.16542 1.000 18.98413 C ? A ? 74 CB 1
   ATOM 1810 CG . ASP A 75 ? 22.58773 -27.08334 -8.98431 1.000 21.73904 C ? A ? 74 CG 1
   ATOM 1811 OD1 . ASP A 75 ? 22.76729 -26.91270 -10.21036 1.000 26.27510 O ? A ? 74 OD1 1
   ATOM 1812 OD2 . ASP A 75 ? 22.90755 -28.14308 -8.41356 1.000 19.09507 O ? A ? 74 OD2 1
   ATOM 1813 H . ASP A 75 ? 24.10741 -24.39531 -7.96040 1.000 19.43655 H ? A ? 74 H 1
   ATOM 1814 HA . ASP A 75 ? 21.97955 -24.54395 -9.65967 1.000 20.70005 H ? A ? 74 HA 1
   ATOM 1815 HB2 . ASP A 75 ? 22.34468 -26.00273 -7.26470 1.000 22.75765 H ? A ? 74 HB2 1
   ATOM 1816 HB3 . ASP A 75 ? 21.02592 -26.05970 -8.14959 1.000 22.75765 H ? A ? 74 HB3 1
   ATOM 1817 N . ALA A 76 ? 21.85793 -22.22419 -8.31753 1.000 16.89163 N ? A ? 75 N 1
   ATOM 1818 CA . ALA A 76 ? 21.47712 -21.09166 -7.48004 1.000 14.97771 C ? A ? 75 CA 1
   ATOM 1819 C . ALA A 76 ? 19.97893 -21.09624 -7.21849 1.000 18.98598 C ? A ? 75 C 1
   ATOM 1820 O . ALA A 76 ? 19.55359 -20.85311 -6.08939 1.000 15.75551 O ? A ? 75 O 1
   ATOM 1821 CB . ALA A 76 ? 21.92540 -19.75073 -8.11314 1.000 17.09843 C ? A ? 75 CB 1
   ATOM 1822 H . ALA A 76 ? 22.20402 -21.99904 -9.07194 1.000 20.24666 H ? A ? 75 H 1
   ATOM 1823 HA . ALA A 76 ? 21.93905 -21.16758 -6.63048 1.000 17.94995 H ? A ? 75 HA 1
   ATOM 1824 HB1 . ALA A 76 ? 21.63298 -19.02029 -7.54584 1.000 20.49482 H ? A ? 75 HB1 1
   ATOM 1825 HB2 . ALA A 76 ? 22.89248 -19.74460 -8.18813 1.000 20.49482 H ? A ? 75 HB2 1
   ATOM 1826 HB3 . ALA A 76 ? 21.52490 -19.66725 -8.99265 1.000 20.49482 H ? A ? 75 HB3 1
   ATOM 1827 N . ALA A 77 ? 19.16397 -21.37558 -8.24406 1.000 16.82502 N ? A ? 76 N 1
   ATOM 1828 CA . ALA A 77 ? 17.71370 -21.39444 -8.03459 1.000 22.83280 C ? A ? 76 CA 1
   ATOM 1829 C . ALA A 77 ? 17.29343 -22.45225 -7.02644 1.000 16.60844 C ? A ? 76 C 1
   ATOM 1830 O . ALA A 77 ? 16.41206 -22.20645 -6.19018 1.000 15.07801 O ? A ? 76 O 1
   ATOM 1831 CB . ALA A 77 ? 16.97253 -21.57703 -9.36179 1.000 16.26771 C ? A ? 76 CB 1
   ATOM 1832 H . ALA A 77 ? 19.41850 -21.55220 -9.04632 1.000 20.16672 H ? A ? 76 H 1
   ATOM 1833 HA . ALA A 77 ? 17.45650 -20.53168 -7.67348 1.000 27.37606 H ? A ? 76 HA 1
   ATOM 1834 HB1 . ALA A 77 ? 16.01773 -21.58958 -9.19117 1.000 19.49795 H ? A ? 76 HB1 1
   ATOM 1835 HB2 . ALA A 77 ? 17.19356 -20.83894 -9.95107 1.000 19.49795 H ? A ? 76 HB2 1
   ATOM 1836 HB3 . ALA A 77 ? 17.24765 -22.41555 -9.76438 1.000 19.49795 H ? A ? 76 HB3 1
   ATOM 1837 N . SER A 78 ? 17.88941 -23.63361 -7.10114 1.000 16.04621 N ? A ? 77 N 1
   ATOM 1838 CA . SER A 78 ? 17.56293 -24.71146 -6.17625 1.000 14.95603 C ? A ? 77 CA 1
   ATOM 1839 C . SER A 78 ? 17.95509 -24.38153 -4.74379 1.000 12.10592 C ? A ? 77 C 1
   ATOM 1840 O . SER A 78 ? 17.19966 -24.65128 -3.79106 1.000 14.29440 O ? A ? 77 O 1
   ATOM 1841 CB . SER A 78 ? 18.21990 -26.00370 -6.59661 1.000 16.43883 C ? A ? 77 CB 1
   ATOM 1842 OG . SER A 78 ? 17.64316 -26.48077 -7.80586 1.000 27.60094 O ? A ? 77 OG 1
   ATOM 1843 H . SER A 78 ? 18.49019 -23.84040 -7.68071 1.000 19.23215 H ? A ? 77 H 1
   ATOM 1844 HA . SER A 78 ? 16.60088 -24.83108 -6.20877 1.000 17.92394 H ? A ? 77 HA 1
   ATOM 1845 HB2 . SER A 78 ? 19.16711 -25.84796 -6.73607 1.000 19.70330 H ? A ? 77 HB2 1
   ATOM 1846 HB3 . SER A 78 ? 18.09169 -26.66661 -5.90018 1.000 19.70330 H ? A ? 77 HB3 1
   ATOM 1847 HG . SER A 78 ? 17.92634 -27.25353 -7.97394 1.000 33.09783 H ? A ? 77 HG 1
   ATOM 1848 N A PHE A 79 ? 19.15727 -23.85344 -4.54337 0.536 12.76709 N ? A ? 78 N 1
   ATOM 1849 CA A PHE A 79 ? 19.53999 -23.45942 -3.18998 0.536 13.24588 C ? A ? 78 CA 1
   ATOM 1850 C A PHE A 79 ? 18.63966 -22.33648 -2.66931 0.536 11.98837 C ? A ? 78 C 1
   ATOM 1851 O A PHE A 79 ? 18.25370 -22.33835 -1.49423 0.536 11.75729 O ? A ? 78 O 1
   ATOM 1852 CB A PHE A 79 ? 21.02551 -23.10656 -3.13266 0.536 10.53654 C ? A ? 78 CB 1
   ATOM 1853 CG A PHE A 79 ? 21.52769 -22.85088 -1.74488 0.536 10.35953 C ? A ? 78 CG 1
   ATOM 1854 CD1 A PHE A 79 ? 21.86901 -23.88361 -0.91185 0.536 10.25402 C ? A ? 78 CD1 1
   ATOM 1855 CD2 A PHE A 79 ? 21.66495 -21.55965 -1.28950 0.536 11.48898 C ? A ? 78 CD2 1
   ATOM 1856 CE1 A PHE A 79 ? 22.33343 -23.63100 0.37847 0.536 10.20652 C ? A ? 78 CE1 1
   ATOM 1857 CE2 A PHE A 79 ? 22.12181 -21.30480 -0.01520 0.536 11.70830 C ? A ? 78 CE2 1
   ATOM 1858 CZ A PHE A 79 ? 22.46511 -22.32715 0.82329 0.536 9.89847 C ? A ? 78 CZ 1
   ATOM 1859 H A PHE A 79 ? 19.75062 -23.71651 -5.15065 0.536 15.29721 H ? A ? 78 H 1
   ATOM 1860 HA A PHE A 79 ? 19.42276 -24.21174 -2.58900 0.536 15.87176 H ? A ? 78 HA 1
   ATOM 1861 HB2 A PHE A 79 ? 21.53635 -23.84381 -3.50199 0.536 12.62055 H ? A ? 78 HB2 1
   ATOM 1862 HB3 A PHE A 79 ? 21.17641 -22.30359 -3.65551 0.536 12.62055 H ? A ? 78 HB3 1
   ATOM 1863 HD1 A PHE A 79 ? 21.79025 -24.76112 -1.20965 0.536 12.28152 H ? A ? 78 HD1 1
   ATOM 1864 HD2 A PHE A 79 ? 21.44645 -20.84986 -1.84928 0.536 13.76348 H ? A ? 78 HD2 1
   ATOM 1865 HE1 A PHE A 79 ? 22.55464 -24.33857 0.94000 0.536 12.22452 H ? A ? 78 HE1 1
   ATOM 1866 HE2 A PHE A 79 ? 22.19751 -20.42549 0.27803 0.536 14.02666 H ? A ? 78 HE2 1
   ATOM 1867 HZ A PHE A 79 ? 22.78225 -22.14980 1.67937 0.536 11.85487 H ? A ? 78 HZ 1
   ATOM 1868 N B PHE A 79 ? 19.14333 -23.79055 -4.57851 0.464 12.97407 N ? A ? 78 N 1
   ATOM 1869 CA B PHE A 79 ? 19.57331 -23.33666 -3.26474 0.464 11.40051 C ? A ? 78 CA 1
   ATOM 1870 C B PHE A 79 ? 18.61168 -22.30673 -2.70504 0.464 11.58577 C ? A ? 78 C 1
   ATOM 1871 O B PHE A 79 ? 18.21524 -22.38256 -1.53455 0.464 12.01660 O ? A ? 78 O 1
   ATOM 1872 CB B PHE A 79 ? 20.97267 -22.74168 -3.31127 0.464 8.74188 C ? A ? 78 CB 1
   ATOM 1873 CG B PHE A 79 ? 21.49832 -22.41438 -1.92889 0.464 8.75655 C ? A ? 78 CG 1
   ATOM 1874 CD1 B PHE A 79 ? 21.84018 -23.44223 -1.06680 0.464 7.59712 C ? A ? 78 CD1 1
   ATOM 1875 CD2 B PHE A 79 ? 21.61747 -21.11934 -1.50077 0.464 8.54904 C ? A ? 78 CD2 1
   ATOM 1876 CE1 B PHE A 79 ? 22.31257 -23.15412 0.20224 0.464 10.07815 C ? A ? 78 CE1 1
   ATOM 1877 CE2 B PHE A 79 ? 22.08661 -20.82566 -0.23491 0.464 8.72285 C ? A ? 78 CE2 1
   ATOM 1878 CZ B PHE A 79 ? 22.42620 -21.84997 0.62273 0.464 10.96281 C ? A ? 78 CZ 1
   ATOM 1879 H B PHE A 79 ? 19.71037 -23.64418 -5.20831 0.464 15.54558 H ? A ? 78 H 1
   ATOM 1880 HA B PHE A 79 ? 19.59578 -24.11276 -2.68330 0.464 13.65732 H ? A ? 78 HA 1
   ATOM 1881 HB2 B PHE A 79 ? 21.57656 -23.38008 -3.72196 0.464 10.46696 H ? A ? 78 HB2 1
   ATOM 1882 HB3 B PHE A 79 ? 20.95315 -21.92231 -3.83006 0.464 10.46696 H ? A ? 78 HB3 1
   ATOM 1883 HD1 B PHE A 79 ? 21.75244 -24.32676 -1.34031 0.464 9.09324 H ? A ? 78 HD1 1
   ATOM 1884 HD2 B PHE A 79 ? 21.37848 -20.42541 -2.07194 0.464 10.23555 H ? A ? 78 HD2 1
   ATOM 1885 HE1 B PHE A 79 ? 22.55448 -23.84679 0.77372 0.464 12.07049 H ? A ? 78 HE1 1
   ATOM 1886 HE2 B PHE A 79 ? 22.17293 -19.94062 0.03741 0.464 10.44412 H ? A ? 78 HE2 1
   ATOM 1887 HZ B PHE A 79 ? 22.73041 -21.66004 1.48080 0.464 13.13207 H ? A ? 78 HZ 1
   ATOM 1888 N A LYS A 80 ? 18.27225 -21.39022 -3.53252 0.536 12.50160 N ? A ? 79 N 1
   ATOM 1889 CA A LYS A 80 ? 17.37355 -20.30839 -3.12140 0.536 13.50126 C ? A ? 79 CA 1
   ATOM 1890 C A LYS A 80 ? 16.02898 -20.85691 -2.68016 0.536 11.46211 C ? A ? 79 C 1
   ATOM 1891 O A LYS A 80 ? 15.47289 -20.41746 -1.67032 0.536 12.39761 O ? A ? 79 O 1
   ATOM 1892 CB A LYS A 80 ? 17.18758 -19.30750 -4.26255 0.536 15.34361 C ? A ? 79 CB 1
   ATOM 1893 CG A LYS A 80 ? 16.38919 -18.07096 -3.90327 0.536 15.07421 C ? A ? 79 CG 1
   ATOM 1894 CD A LYS A 80 ? 16.36630 -17.08135 -5.05993 0.536 21.90984 C ? A ? 79 CD 1
   ATOM 1895 CE A LYS A 80 ? 15.64561 -15.78068 -4.70115 0.536 32.41266 C ? A ? 79 CE 1
   ATOM 1896 NZ A LYS A 80 ? 15.61978 -14.84697 -5.85708 0.536 35.90283 N ? A ? 79 NZ 1
   ATOM 1897 H A LYS A 80 ? 18.52496 -21.34968 -4.35355 0.536 14.97863 H ? A ? 79 H 1
   ATOM 1898 HA A LYS A 80 ? 17.77572 -19.83877 -2.37399 0.536 16.17822 H ? A ? 79 HA 1
   ATOM 1899 HB2 A LYS A 80 ? 18.06305 -19.01297 -4.55869 0.536 18.38903 H ? A ? 79 HB2 1
   ATOM 1900 HB3 A LYS A 80 ? 16.72394 -19.75253 -4.98911 0.536 18.38903 H ? A ? 79 HB3 1
   ATOM 1901 HG2 A LYS A 80 ? 15.47566 -18.32439 -3.69798 0.536 18.06575 H ? A ? 79 HG2 1
   ATOM 1902 HG3 A LYS A 80 ? 16.79349 -17.63685 -3.13582 0.536 18.06575 H ? A ? 79 HG3 1
   ATOM 1903 HD2 A LYS A 80 ? 17.27789 -16.86164 -5.30820 0.536 26.26851 H ? A ? 79 HD2 1
   ATOM 1904 HD3 A LYS A 80 ? 15.90508 -17.48313 -5.81276 0.536 26.26851 H ? A ? 79 HD3 1
   ATOM 1905 HE2 A LYS A 80 ? 14.73087 -15.97843 -4.44610 0.536 38.87190 H ? A ? 79 HE2 1
   ATOM 1906 HE3 A LYS A 80 ? 16.10841 -15.34729 -3.96706 0.536 38.87190 H ? A ? 79 HE3 1
   ATOM 1907 HZ1 A LYS A 80 ? 16.21996 -14.20038 -5.73955 0.536 43.06010 H ? A ? 79 HZ1 1
   ATOM 1908 HZ2 A LYS A 80 ? 15.81124 -15.28590 -6.60727 0.536 43.06010 H ? A ? 79 HZ2 1
   ATOM 1909 HZ3 A LYS A 80 ? 14.81228 -14.48089 -5.93469 0.536 43.06010 H ? A ? 79 HZ3 1
   ATOM 1910 N B LYS A 80 ? 18.24924 -21.32321 -3.52409 0.464 13.05906 N ? A ? 79 N 1
   ATOM 1911 CA B LYS A 80 ? 17.34881 -20.27447 -3.06081 0.464 12.87738 C ? A ? 79 CA 1
   ATOM 1912 C B LYS A 80 ? 15.99519 -20.84357 -2.66914 0.464 11.42966 C ? A ? 79 C 1
   ATOM 1913 O B LYS A 80 ? 15.39765 -20.40750 -1.67990 0.464 11.91712 O ? A ? 79 O 1
   ATOM 1914 CB B LYS A 80 ? 17.18218 -19.19282 -4.12503 0.464 14.30464 C ? A ? 79 CB 1
   ATOM 1915 CG B LYS A 80 ? 16.34654 -18.01346 -3.64340 0.464 14.84055 C ? A ? 79 CG 1
   ATOM 1916 CD B LYS A 80 ? 16.20965 -16.91764 -4.69296 0.464 19.41726 C ? A ? 79 CD 1
   ATOM 1917 CE B LYS A 80 ? 15.33580 -15.77876 -4.17974 0.464 29.12672 C ? A ? 79 CE 1
   ATOM 1918 NZ B LYS A 80 ? 15.17252 -14.69649 -5.17981 0.464 33.43409 N ? A ? 79 NZ 1
   ATOM 1919 H B LYS A 80 ? 18.50662 -21.24109 -4.34055 0.464 15.64757 H ? A ? 79 H 1
   ATOM 1920 HA B LYS A 80 ? 17.74494 -19.85936 -2.27872 0.464 15.42956 H ? A ? 79 HA 1
   ATOM 1921 HB2 B LYS A 80 ? 18.05782 -18.85820 -4.37440 0.464 17.14227 H ? A ? 79 HB2 1
   ATOM 1922 HB3 B LYS A 80 ? 16.74112 -19.57700 -4.89882 0.464 17.14227 H ? A ? 79 HB3 1
   ATOM 1923 HG2 B LYS A 80 ? 15.45611 -18.32703 -3.42043 0.464 17.78536 H ? A ? 79 HG2 1
   ATOM 1924 HG3 B LYS A 80 ? 16.76782 -17.62645 -2.86005 0.464 17.78536 H ? A ? 79 HG3 1
   ATOM 1925 HD2 B LYS A 80 ? 17.08651 -16.56089 -4.90451 0.464 23.27741 H ? A ? 79 HD2 1
   ATOM 1926 HD3 B LYS A 80 ? 15.79905 -17.28413 -5.49171 0.464 23.27741 H ? A ? 79 HD3 1
   ATOM 1927 HE2 B LYS A 80 ? 14.45577 -16.12564 -3.96498 0.464 34.92876 H ? A ? 79 HE2 1
   ATOM 1928 HE3 B LYS A 80 ? 15.74452 -15.39721 -3.38711 0.464 34.92876 H ? A ? 79 HE3 1
   ATOM 1929 HZ1 B LYS A 80 ? 14.62204 -14.07189 -4.86525 0.464 40.09761 H ? A ? 79 HZ1 1
   ATOM 1930 HZ2 B LYS A 80 ? 15.96119 -14.32391 -5.35665 0.464 40.09761 H ? A ? 79 HZ2 1
   ATOM 1931 HZ3 B LYS A 80 ? 14.83374 -15.02706 -5.93350 0.464 40.09761 H ? A ? 79 HZ3 1
   ATOM 1932 N . GLN A 81 ? 15.49202 -21.81966 -3.42286 1.000 11.66937 N ? A ? 80 N 1
   ATOM 1933 CA . GLN A 81 ? 14.24505 -22.44189 -3.02727 1.000 9.59866 C ? A ? 80 CA 1
   ATOM 1934 C . GLN A 81 ? 14.38304 -23.01854 -1.62864 1.000 12.61122 C ? A ? 80 C 1
   ATOM 1935 O . GLN A 81 ? 13.44292 -22.92124 -0.82900 1.000 11.53373 O ? A ? 80 O 1
   ATOM 1936 HA . GLN A 81 ? 13.52601 -21.79094 -3.01548 1.000 11.49509 H ? A ? 80 HA 1
   ATOM 1937 CB A GLN A 81 ? 13.86461 -23.50624 -4.04146 0.636 14.19229 C ? A ? 80 CB 1
   ATOM 1938 CG A GLN A 81 ? 13.44417 -22.87239 -5.32963 0.636 21.30387 C ? A ? 80 CG 1
   ATOM 1939 CD A GLN A 81 ? 12.05687 -22.26722 -5.24832 0.636 25.92784 C ? A ? 80 CD 1
   ATOM 1940 OE1 A GLN A 81 ? 11.19304 -22.78534 -4.53719 0.636 32.24471 O ? A ? 80 OE1 1
   ATOM 1941 NE2 A GLN A 81 ? 11.83134 -21.18241 -5.97145 0.636 24.57931 N ? A ? 80 NE2 1
   ATOM 1942 H A GLN A 81 ? 15.82935 -22.12520 -4.15256 0.536 13.97995 H ? A ? 80 H 1
   ATOM 1943 HB2 A GLN A 81 ? 14.62815 -24.07955 -4.21241 0.636 17.00745 H ? A ? 80 HB2 1
   ATOM 1944 HB3 A GLN A 81 ? 13.12515 -24.03203 -3.69847 0.636 17.00745 H ? A ? 80 HB3 1
   ATOM 1945 HG2 A GLN A 81 ? 14.06900 -22.16537 -5.55459 0.636 25.54134 H ? A ? 80 HG2 1
   ATOM 1946 HG3 A GLN A 81 ? 13.43923 -23.54544 -6.02811 0.636 25.54134 H ? A ? 80 HG3 1
   ATOM 1947 HE21 A GLN A 81 ? 12.45843 -20.85241 -6.45874 0.636 29.47188 H ? A ? 80 HE21 1
   ATOM 1948 HE22 A GLN A 81 ? 11.05765 -20.80729 -5.95419 0.636 29.47188 H ? A ? 80 HE22 1
   ATOM 1949 CB B GLN A 81 ? 13.87086 -23.55067 -4.01022 0.364 14.46882 C ? A ? 80 CB 1
   ATOM 1950 CG B GLN A 81 ? 12.74150 -24.41938 -3.49918 0.364 18.77638 C ? A ? 80 CG 1
   ATOM 1951 CD B GLN A 81 ? 11.37015 -23.98265 -4.01602 0.364 26.32041 C ? A ? 80 CD 1
   ATOM 1952 OE1 B GLN A 81 ? 11.20070 -22.85282 -4.49314 0.364 31.33178 O ? A ? 80 OE1 1
   ATOM 1953 NE2 B GLN A 81 ? 10.38543 -24.88105 -3.92149 0.364 28.00690 N ? A ? 80 NE2 1
   ATOM 1954 H B GLN A 81 ? 15.84578 -22.12660 -4.14414 0.464 13.97995 H ? A ? 80 H 1
   ATOM 1955 HB2 B GLN A 81 ? 13.58828 -23.15001 -4.84719 0.364 17.33929 H ? A ? 80 HB2 1
   ATOM 1956 HB3 B GLN A 81 ? 14.64416 -24.11728 -4.15805 0.364 17.33929 H ? A ? 80 HB3 1
   ATOM 1957 HG2 B GLN A 81 ? 12.89207 -25.33341 -3.78692 0.364 22.50835 H ? A ? 80 HG2 1
   ATOM 1958 HG3 B GLN A 81 ? 12.72364 -24.37524 -2.53035 0.364 22.50835 H ? A ? 80 HG3 1
   ATOM 1959 HE21 B GLN A 81 ? 10.54170 -25.65640 -3.58383 0.364 33.58498 H ? A ? 80 HE21 1
   ATOM 1960 HE22 B GLN A 81 ? 9.59544 -24.68388 -4.19832 0.364 33.58498 H ? A ? 80 HE22 1
   ATOM 1961 N . LYS A 82 ? 15.51172 -23.69514 -1.33044 1.000 12.05654 N ? A ? 81 N 1
   ATOM 1962 CA . LYS A 82 ? 15.63752 -24.34048 -0.02654 1.000 11.12933 C ? A ? 81 CA 1
   ATOM 1963 C . LYS A 82 ? 15.71006 -23.31355 1.09552 1.000 10.96573 C ? A ? 81 C 1
   ATOM 1964 O . LYS A 82 ? 15.10553 -23.49559 2.13842 1.000 11.40525 O ? A ? 81 O 1
   ATOM 1965 H . LYS A 82 ? 16.18931 -23.78712 -1.85199 1.000 14.44455 H ? A ? 81 H 1
   ATOM 1966 HA . LYS A 82 ? 14.84936 -24.88404 0.12918 1.000 13.33189 H ? A ? 81 HA 1
   ATOM 1967 CB A LYS A 82 ? 16.82651 -25.27918 -0.00652 0.707 14.96113 C ? A ? 81 CB 1
   ATOM 1968 CG A LYS A 82 ? 16.45423 -26.69321 -0.39834 0.707 20.82876 C ? A ? 81 CG 1
   ATOM 1969 CD A LYS A 82 ? 17.56073 -27.67294 -0.04910 0.707 13.19610 C ? A ? 81 CD 1
   ATOM 1970 CE A LYS A 82 ? 17.13201 -29.13775 -0.15501 0.707 15.92525 C ? A ? 81 CE 1
   ATOM 1971 NZ A LYS A 82 ? 16.62947 -29.59284 -1.48778 0.707 15.29641 N ? A ? 81 NZ 1
   ATOM 1972 HB2 A LYS A 82 ? 17.49388 -24.95841 -0.63313 0.707 17.93006 H ? A ? 81 HB2 1
   ATOM 1973 HB3 A LYS A 82 ? 17.19685 -25.30217 0.88970 0.707 17.93006 H ? A ? 81 HB3 1
   ATOM 1974 HG2 A LYS A 82 ? 15.65078 -26.95784 0.07637 0.707 24.97121 H ? A ? 81 HG2 1
   ATOM 1975 HG3 A LYS A 82 ? 16.30218 -26.73258 -1.35554 0.707 24.97121 H ? A ? 81 HG3 1
   ATOM 1976 HD2 A LYS A 82 ? 18.30412 -27.53670 -0.65715 0.707 15.81202 H ? A ? 81 HD2 1
   ATOM 1977 HD3 A LYS A 82 ? 17.84543 -27.51245 0.86418 0.707 15.81202 H ? A ? 81 HD3 1
   ATOM 1978 HE2 A LYS A 82 ? 17.89708 -29.69245 0.06378 0.707 19.08700 H ? A ? 81 HE2 1
   ATOM 1979 HE3 A LYS A 82 ? 16.41826 -29.29000 0.48397 0.707 19.08700 H ? A ? 81 HE3 1
   ATOM 1980 HZ1 A LYS A 82 ? 16.05651 -30.26585 -1.38345 0.707 18.33239 H ? A ? 81 HZ1 1
   ATOM 1981 HZ2 A LYS A 82 ? 16.21550 -28.92268 -1.90205 0.707 18.33239 H ? A ? 81 HZ2 1
   ATOM 1982 HZ3 A LYS A 82 ? 17.30948 -29.86792 -1.99178 0.707 18.33239 H ? A ? 81 HZ3 1
   ATOM 1983 CB B LYS A 82 ? 16.87008 -25.24148 -0.00702 0.293 14.91138 C ? A ? 81 CB 1
   ATOM 1984 CG B LYS A 82 ? 16.71900 -26.50356 -0.83775 0.293 8.58216 C ? A ? 81 CG 1
   ATOM 1985 CD B LYS A 82 ? 17.40600 -27.68745 -0.17463 0.293 12.82046 C ? A ? 81 CD 1
   ATOM 1986 CE B LYS A 82 ? 17.16916 -28.97175 -0.95091 0.293 13.03281 C ? A ? 81 CE 1
   ATOM 1987 NZ B LYS A 82 ? 17.81326 -30.15622 -0.30829 0.293 27.89042 N ? A ? 81 NZ 1
   ATOM 1988 HB2 B LYS A 82 ? 17.62522 -24.74434 -0.35846 0.293 17.87036 H ? A ? 81 HB2 1
   ATOM 1989 HB3 B LYS A 82 ? 17.04617 -25.50902 0.90858 0.293 17.87036 H ? A ? 81 HB3 1
   ATOM 1990 HG2 B LYS A 82 ? 15.77708 -26.71301 -0.93685 0.293 10.27530 H ? A ? 81 HG2 1
   ATOM 1991 HG3 B LYS A 82 ? 17.12164 -26.36547 -1.70936 0.293 10.27530 H ? A ? 81 HG3 1
   ATOM 1992 HD2 B LYS A 82 ? 18.36160 -27.52521 -0.13713 0.293 15.36125 H ? A ? 81 HD2 1
   ATOM 1993 HD3 B LYS A 82 ? 17.05370 -27.80312 0.72170 0.293 15.36125 H ? A ? 81 HD3 1
   ATOM 1994 HE2 B LYS A 82 ? 16.21521 -29.13959 -1.00286 0.293 15.61607 H ? A ? 81 HE2 1
   ATOM 1995 HE3 B LYS A 82 ? 17.53821 -28.87587 -1.84282 0.293 15.61607 H ? A ? 81 HE3 1
   ATOM 1996 HZ1 B LYS A 82 ? 17.76796 -30.85955 -0.85179 0.293 33.44521 H ? A ? 81 HZ1 1
   ATOM 1997 HZ2 B LYS A 82 ? 18.66814 -29.98056 -0.13387 0.293 33.44521 H ? A ? 81 HZ2 1
   ATOM 1998 HZ3 B LYS A 82 ? 17.39748 -30.35276 0.45368 0.293 33.44521 H ? A ? 81 HZ3 1
   ATOM 1999 N . GLN A 83 ? 16.43941 -22.22855 0.92704 1.000 9.78270 N ? A ? 82 N 1
   ATOM 2000 CA . GLN A 83 ? 16.49432 -21.24032 1.99933 1.000 8.67373 C ? A ? 82 CA 1
   ATOM 2001 C . GLN A 83 ? 15.16856 -20.52193 2.14826 1.000 10.13753 C ? A ? 82 C 1
   ATOM 2002 O . GLN A 83 ? 14.78112 -20.18481 3.26506 1.000 10.65913 O ? A ? 82 O 1
   ATOM 2003 CB . GLN A 83 ? 17.67474 -20.25829 1.86679 1.000 10.28163 C ? A ? 82 CB 1
   ATOM 2004 CG . GLN A 83 ? 17.74315 -19.44122 0.59599 1.000 11.96596 C ? A ? 82 CG 1
   ATOM 2005 CD . GLN A 83 ? 17.17553 -18.06019 0.72708 1.000 11.80778 C ? A ? 82 CD 1
   ATOM 2006 OE1 . GLN A 83 ? 16.31662 -17.80536 1.58782 1.000 12.79214 O ? A ? 82 OE1 1
   ATOM 2007 NE2 . GLN A 83 ? 17.59120 -17.16737 -0.16178 1.000 15.75766 N ? A ? 82 NE2 1
   ATOM 2008 H . GLN A 83 ? 16.90022 -22.04000 0.22582 1.000 11.71594 H ? A ? 82 H 1
   ATOM 2009 HA . GLN A 83 ? 16.67393 -21.72188 2.82197 1.000 10.38517 H ? A ? 82 HA 1
   ATOM 2010 HB2 . GLN A 83 ? 17.62677 -19.63045 2.60464 1.000 12.31466 H ? A ? 82 HB2 1
   ATOM 2011 HB3 . GLN A 83 ? 18.49742 -20.76952 1.91914 1.000 12.31466 H ? A ? 82 HB3 1
   ATOM 2012 HG2 . GLN A 83 ? 18.67239 -19.35387 0.33183 1.000 14.33585 H ? A ? 82 HG2 1
   ATOM 2013 HG3 . GLN A 83 ? 17.24311 -19.90065 -0.09667 1.000 14.33585 H ? A ? 82 HG3 1
   ATOM 2014 HE21 . GLN A 83 ? 18.15576 -17.39579 -0.76899 1.000 18.88590 H ? A ? 82 HE21 1
   ATOM 2015 HE22 . GLN A 83 ? 17.29610 -16.36018 -0.13079 1.000 18.88590 H ? A ? 82 HE22 1
   ATOM 2016 N . GLN A 84 ? 14.45472 -20.28705 1.04162 1.000 9.67253 N ? A ? 83 N 1
   ATOM 2017 CA . GLN A 84 ? 13.16745 -19.60571 1.11397 1.000 9.83246 C ? A ? 83 CA 1
   ATOM 2018 C . GLN A 84 ? 12.14005 -20.49870 1.77040 1.000 10.44144 C ? A ? 83 C 1
   ATOM 2019 O . GLN A 84 ? 11.30400 -20.01749 2.54677 1.000 10.57605 O ? A ? 83 O 1
   ATOM 2020 CB . GLN A 84 ? 12.74092 -19.18815 -0.28561 1.000 10.87707 C ? A ? 83 CB 1
   ATOM 2021 CG . GLN A 84 ? 13.50254 -17.99910 -0.80960 1.000 12.36451 C ? A ? 83 CG 1
   ATOM 2022 CD . GLN A 84 ? 13.11816 -16.68813 -0.10184 1.000 30.29450 C ? A ? 83 CD 1
   ATOM 2023 OE1 . GLN A 84 ? 12.03618 -16.13549 -0.33163 1.000 19.20287 O ? A ? 83 OE1 1
   ATOM 2024 NE2 . GLN A 84 ? 14.00573 -16.18301 0.74264 1.000 13.39513 N ? A ? 83 NE2 1
   ATOM 2025 H . GLN A 84 ? 14.69387 -20.51106 0.24650 1.000 11.58373 H ? A ? 83 H 1
   ATOM 2026 HA . GLN A 84 ? 13.24032 -18.79903 1.64770 1.000 11.77565 H ? A ? 83 HA 1
   ATOM 2027 HB2 . GLN A 84 ? 12.89019 -19.92934 -0.89328 1.000 13.02918 H ? A ? 83 HB2 1
   ATOM 2028 HB3 . GLN A 84 ? 11.79922 -18.95606 -0.27043 1.000 13.02918 H ? A ? 83 HB3 1
   ATOM 2029 HG2 . GLN A 84 ? 14.45158 -18.14648 -0.67354 1.000 14.81412 H ? A ? 83 HG2 1
   ATOM 2030 HG3 . GLN A 84 ? 13.31518 -17.89546 -1.75567 1.000 14.81412 H ? A ? 83 HG3 1
   ATOM 2031 HE21 . GLN A 84 ? 14.75393 -16.58666 0.87246 1.000 16.05085 H ? A ? 83 HE21 1
   ATOM 2032 HE22 . GLN A 84 ? 13.83353 -15.45155 1.16087 1.000 16.05085 H ? A ? 83 HE22 1
   ATOM 2033 N . ALA A 85 ? 12.16879 -21.79282 1.46727 1.000 10.21534 N ? A ? 84 N 1
   ATOM 2034 CA . ALA A 85 ? 11.24321 -22.72103 2.11194 1.000 11.01820 C ? A ? 84 CA 1
   ATOM 2035 C . ALA A 85 ? 11.55846 -22.82929 3.59407 1.000 10.99332 C ? A ? 84 C 1
   ATOM 2036 O . ALA A 85 ? 10.64602 -22.95245 4.43097 1.000 11.66767 O ? A ? 84 O 1
   ATOM 2037 CB . ALA A 85 ? 11.33663 -24.10851 1.45134 1.000 12.63388 C ? A ? 84 CB 1
   ATOM 2038 H . ALA A 85 ? 12.70517 -22.15514 0.90104 1.000 12.23511 H ? A ? 84 H 1
   ATOM 2039 HA . ALA A 85 ? 10.33579 -22.39675 2.00095 1.000 13.19854 H ? A ? 84 HA 1
   ATOM 2040 HB1 . ALA A 85 ? 10.73632 -24.71741 1.90935 1.000 15.13736 H ? A ? 84 HB1 1
   ATOM 2041 HB2 . ALA A 85 ? 11.08180 -24.03196 0.51855 1.000 15.13736 H ? A ? 84 HB2 1
   ATOM 2042 HB3 . ALA A 85 ? 12.24926 -24.42998 1.51961 1.000 15.13736 H ? A ? 84 HB3 1
   ATOM 2043 N . PHE A 86 ? 12.85753 -22.85958 3.93465 1.000 9.88286 N ? A ? 85 N 1
   ATOM 2044 CA . PHE A 86 ? 13.25486 -22.85670 5.33246 1.000 9.70144 C ? A ? 85 CA 1
   ATOM 2045 C . PHE A 86 ? 12.67983 -21.63913 6.02229 1.000 9.08780 C ? A ? 85 C 1
   ATOM 2046 O . PHE A 86 ? 12.10340 -21.73403 7.10626 1.000 8.53169 O ? A ? 85 O 1
   ATOM 2047 CB . PHE A 86 ? 14.78765 -22.93250 5.45695 1.000 8.90910 C ? A ? 85 CB 1
   ATOM 2048 CG . PHE A 86 ? 15.29422 -22.48214 6.78971 1.000 8.35294 C ? A ? 85 CG 1
   ATOM 2049 CD1 . PHE A 86 ? 16.02460 -21.32539 6.88741 1.000 8.29337 C ? A ? 85 CD1 1
   ATOM 2050 CD2 . PHE A 86 ? 15.07979 -23.21024 7.92852 1.000 9.53422 C ? A ? 85 CD2 1
   ATOM 2051 CE1 . PHE A 86 ? 16.44938 -20.87503 8.11803 1.000 8.90994 C ? A ? 85 CE1 1
   ATOM 2052 CE2 . PHE A 86 ? 15.48414 -22.78114 9.15467 1.000 9.95406 C ? A ? 85 CE2 1
   ATOM 2053 CZ . PHE A 86 ? 16.20981 -21.59206 9.23540 1.000 9.76194 C ? A ? 85 CZ 1
   ATOM 2054 H . PHE A 86 ? 13.51186 -22.88168 3.37701 1.000 11.83613 H ? A ? 85 H 1
   ATOM 2055 HA . PHE A 86 ? 12.91034 -23.64599 5.77881 1.000 11.61843 H ? A ? 85 HA 1
   ATOM 2056 HB2 . PHE A 86 ? 15.06810 -23.85185 5.32639 1.000 10.66762 H ? A ? 85 HB2 1
   ATOM 2057 HB3 . PHE A 86 ? 15.18611 -22.36463 4.77898 1.000 10.66762 H ? A ? 85 HB3 1
   ATOM 2058 HD1 . PHE A 86 ? 16.23384 -20.84334 6.12011 1.000 9.92875 H ? A ? 85 HD1 1
   ATOM 2059 HD2 . PHE A 86 ? 14.64181 -24.02794 7.86184 1.000 11.41777 H ? A ? 85 HD2 1
   ATOM 2060 HE1 . PHE A 86 ? 16.90653 -20.06746 8.17927 1.000 10.66863 H ? A ? 85 HE1 1
   ATOM 2061 HE2 . PHE A 86 ? 15.28179 -23.26853 9.92044 1.000 11.92158 H ? A ? 85 HE2 1
   ATOM 2062 HZ . PHE A 86 ? 16.52747 -21.29461 10.05730 1.000 11.69103 H ? A ? 85 HZ 1
   ATOM 2063 N . GLN A 87 ? 12.86164 -20.46991 5.40971 1.000 9.45696 N ? A ? 86 N 1
   ATOM 2064 CA . GLN A 87 ? 12.35179 -19.25483 6.02471 1.000 9.55959 C ? A ? 86 CA 1
   ATOM 2065 C . GLN A 87 ? 10.83251 -19.25742 6.12449 1.000 9.08976 C ? A ? 86 C 1
   ATOM 2066 O . GLN A 87 ? 10.30110 -18.69877 7.07637 1.000 9.31225 O ? A ? 86 O 1
   ATOM 2067 CB . GLN A 87 ? 12.86170 -17.98651 5.34055 1.000 10.21844 C ? A ? 86 CB 1
   ATOM 2068 CG . GLN A 87 ? 14.37217 -17.83612 5.49262 1.000 10.43252 C ? A ? 86 CG 1
   ATOM 2069 CD . GLN A 87 ? 14.85089 -16.46639 5.14826 1.000 11.91506 C ? A ? 86 CD 1
   ATOM 2070 OE1 . GLN A 87 ? 14.58041 -15.49266 5.91282 1.000 11.68549 O ? A ? 86 OE1 1
   ATOM 2071 NE2 . GLN A 87 ? 15.44042 -16.33355 4.00193 1.000 12.67521 N ? A ? 86 NE2 1
   ATOM 2072 H . GLN A 87 ? 13.26575 -20.35907 4.65870 1.000 11.32505 H ? A ? 86 H 1
   ATOM 2073 HA . GLN A 87 ? 12.70995 -19.22412 6.92564 1.000 11.44820 H ? A ? 86 HA 1
   ATOM 2074 HB2 . GLN A 87 ? 12.65250 -18.02688 4.39424 1.000 12.23883 H ? A ? 86 HB2 1
   ATOM 2075 HB3 . GLN A 87 ? 12.43579 -17.21286 5.74177 1.000 12.23883 H ? A ? 86 HB3 1
   ATOM 2076 HG2 . GLN A 87 ? 14.61709 -18.01715 6.41357 1.000 12.49573 H ? A ? 86 HG2 1
   ATOM 2077 HG3 . GLN A 87 ? 14.81396 -18.46601 4.90189 1.000 12.49573 H ? A ? 86 HG3 1
   ATOM 2078 HE21 . GLN A 87 ? 15.53726 -17.01524 3.48664 1.000 15.18695 H ? A ? 86 HE21 1
   ATOM 2079 HE22 . GLN A 87 ? 15.73481 -15.56369 3.75645 1.000 15.18695 H ? A ? 86 HE22 1
   ATOM 2080 N . ASP A 88 ? 10.12904 -19.91310 5.19063 1.000 9.04943 N ? A ? 87 N 1
   ATOM 2081 CA . ASP A 88 ? 8.69361 -20.09674 5.32065 1.000 8.75019 C ? A ? 87 CA 1
   ATOM 2082 C . ASP A 88 ? 8.34705 -20.97058 6.51002 1.000 9.39996 C ? A ? 87 C 1
   ATOM 2083 O . ASP A 88 ? 7.35592 -20.70598 7.20117 1.000 10.14399 O ? A ? 87 O 1
   ATOM 2084 CB . ASP A 88 ? 8.13022 -20.76953 4.07069 1.000 12.59442 C ? A ? 87 CB 1
   ATOM 2085 CG . ASP A 88 ? 8.18049 -19.96367 2.83100 1.000 16.42243 C ? A ? 87 CG 1
   ATOM 2086 OD1 . ASP A 88 ? 8.25163 -18.75418 2.87099 1.000 18.45677 O ? A ? 87 OD1 1
   ATOM 2087 OD2 . ASP A 88 ? 8.14194 -20.58977 1.69330 1.000 15.83425 O ? A ? 87 OD2 1
   ATOM 2088 H . ASP A 88 ? 10.46474 -20.25726 4.47756 1.000 10.83602 H ? A ? 87 H 1
   ATOM 2089 HA . ASP A 88 ? 8.29785 -19.21814 5.43175 1.000 10.47692 H ? A ? 87 HA 1
   ATOM 2090 HB2 . ASP A 88 ? 8.63618 -21.58075 3.90688 1.000 15.09000 H ? A ? 87 HB2 1
   ATOM 2091 HB3 . ASP A 88 ? 7.19919 -20.98666 4.23480 1.000 15.09000 H ? A ? 87 HB3 1
   ATOM 2092 N . ASN A 89 ? 9.09310 -22.04696 6.74122 1.000 9.33637 N ? A ? 88 N 1
   ATOM 2093 CA . ASN A 89 ? 8.87538 -22.82500 7.94400 1.000 8.40683 C ? A ? 88 CA 1
   ATOM 2094 C . ASN A 89 ? 9.11261 -21.99269 9.19169 1.000 8.45438 C ? A ? 88 C 1
   ATOM 2095 O . ASN A 89 ? 8.42725 -22.16960 10.20034 1.000 9.56689 O ? A ? 88 O 1
   ATOM 2096 CB . ASN A 89 ? 9.70187 -24.08970 7.88345 1.000 10.28209 C ? A ? 88 CB 1
   ATOM 2097 CG . ASN A 89 ? 8.97261 -25.13447 7.11138 1.000 15.03831 C ? A ? 88 CG 1
   ATOM 2098 OD1 . ASN A 89 ? 7.77412 -25.32871 7.35104 1.000 18.36223 O ? A ? 88 OD1 1
   ATOM 2099 ND2 . ASN A 89 ? 9.62268 -25.74199 6.16584 1.000 22.32381 N ? A ? 88 ND2 1
   ATOM 2100 H . ASN A 89 ? 9.71722 -22.33841 6.22631 1.000 11.18034 H ? A ? 88 H 1
   ATOM 2101 HA . ASN A 89 ? 7.95024 -23.11137 7.99884 1.000 10.06490 H ? A ? 88 HA 1
   ATOM 2102 HB2 . ASN A 89 ? 10.54626 -23.90787 7.44205 1.000 12.31521 H ? A ? 88 HB2 1
   ATOM 2103 HB3 . ASN A 89 ? 9.86128 -24.41964 8.78157 1.000 12.31521 H ? A ? 88 HB3 1
   ATOM 2104 HD21 . ASN A 89 ? 10.44213 -25.53558 6.00615 1.000 26.76527 H ? A ? 88 HD21 1
   ATOM 2105 HD22 . ASN A 89 ? 9.23383 -26.35082 5.69923 1.000 26.76527 H ? A ? 88 HD22 1
   ATOM 2106 N A ILE A 90 ? 10.07161 -21.06830 9.15574 0.694 8.77785 N ? A ? 89 N 1
   ATOM 2107 CA A ILE A 90 ? 10.29209 -20.19338 10.30266 0.694 9.30864 C ? A ? 89 CA 1
   ATOM 2108 C A ILE A 90 ? 9.09242 -19.27743 10.51760 0.694 9.74382 C ? A ? 89 C 1
   ATOM 2109 O A ILE A 90 ? 8.71347 -19.02675 11.66313 0.694 11.01186 O ? A ? 89 O 1
   ATOM 2110 CB A ILE A 90 ? 11.62949 -19.43355 10.17180 0.694 8.18571 C ? A ? 89 CB 1
   ATOM 2111 CG1 A ILE A 90 ? 12.84753 -20.35998 10.32249 0.694 9.25759 C ? A ? 89 CG1 1
   ATOM 2112 CG2 A ILE A 90 ? 11.68475 -18.28442 11.17944 0.694 11.48098 C ? A ? 89 CG2 1
   ATOM 2113 CD1 A ILE A 90 ? 13.12864 -20.86857 11.73023 0.694 10.96439 C ? A ? 89 CD1 1
   ATOM 2114 H A ILE A 90 ? 10.59900 -20.92998 8.49066 0.694 10.51013 H ? A ? 89 H 1
   ATOM 2115 HA A ILE A 90 ? 10.37099 -20.74248 11.09837 0.694 11.14707 H ? A ? 89 HA 1
   ATOM 2116 HB A ILE A 90 ? 11.66786 -19.06964 9.27347 0.694 9.79956 H ? A ? 89 HB 1
   ATOM 2117 HG12 A ILE A 90 ? 12.70868 -21.13747 9.75935 0.694 11.08581 H ? A ? 89 HG12 1
   ATOM 2118 HG13 A ILE A 90 ? 13.63526 -19.87517 10.03037 0.694 11.08581 H ? A ? 89 HG13 1
   ATOM 2119 HG21 A ILE A 90 ? 12.59908 -17.96776 11.24748 0.694 13.75388 H ? A ? 89 HG21 1
   ATOM 2120 HG22 A ILE A 90 ? 11.10829 -17.56723 10.87246 0.694 13.75388 H ? A ? 89 HG22 1
   ATOM 2121 HG23 A ILE A 90 ? 11.38111 -18.60640 12.04259 0.694 13.75388 H ? A ? 89 HG23 1
   ATOM 2122 HD11 A ILE A 90 ? 13.76717 -21.59711 11.68116 0.694 13.13397 H ? A ? 89 HD11 1
   ATOM 2123 HD12 A ILE A 90 ? 13.49419 -20.14350 12.26083 0.694 13.13397 H ? A ? 89 HD12 1
   ATOM 2124 HD13 A ILE A 90 ? 12.29942 -21.18148 12.12441 0.694 13.13397 H ? A ? 89 HD13 1
   ATOM 2125 N C ILE A 90 ? 10.08367 -21.07450 9.13085 0.306 9.00979 N ? A ? 89 N 1
   ATOM 2126 CA C ILE A 90 ? 10.31334 -20.13142 10.22039 0.306 8.96463 C ? A ? 89 CA 1
   ATOM 2127 C C ILE A 90 ? 9.09551 -19.23692 10.41661 0.306 9.62968 C ? A ? 89 C 1
   ATOM 2128 O C ILE A 90 ? 8.75133 -18.88546 11.54408 0.306 9.37006 O ? A ? 89 O 1
   ATOM 2129 CB C ILE A 90 ? 11.58677 -19.30006 9.95859 0.306 9.63786 C ? A ? 89 CB 1
   ATOM 2130 CG1 C ILE A 90 ? 12.84210 -20.16461 10.00369 0.306 7.14442 C ? A ? 89 CG1 1
   ATOM 2131 CG2 C ILE A 90 ? 11.66935 -18.14689 10.95478 0.306 12.50195 C ? A ? 89 CG2 1
   ATOM 2132 CD1 C ILE A 90 ? 13.13532 -20.77971 11.36253 0.306 11.90792 C ? A ? 89 CD1 1
   ATOM 2133 H C ILE A 90 ? 10.62250 -20.97907 8.46740 0.306 10.78845 H ? A ? 89 H 1
   ATOM 2134 HA C ILE A 90 ? 10.45002 -20.63800 11.03622 0.306 10.73426 H ? A ? 89 HA 1
   ATOM 2135 HB C ILE A 90 ? 11.52978 -18.93418 9.06205 0.306 11.54213 H ? A ? 89 HB 1
   ATOM 2136 HG12 C ILE A 90 ? 12.73988 -20.89117 9.36921 0.306 8.55001 H ? A ? 89 HG12 1
   ATOM 2137 HG13 C ILE A 90 ? 13.60404 -19.61604 9.75995 0.306 8.55001 H ? A ? 89 HG13 1
   ATOM 2138 HG21 C ILE A 90 ? 12.56654 -17.77855 10.93781 0.306 14.97904 H ? A ? 89 HG21 1
   ATOM 2139 HG22 C ILE A 90 ? 11.02707 -17.46514 10.70263 0.306 14.97904 H ? A ? 89 HG22 1
   ATOM 2140 HG23 C ILE A 90 ? 11.46573 -18.48110 11.84233 0.306 14.97904 H ? A ? 89 HG23 1
   ATOM 2141 HD11 C ILE A 90 ? 13.98251 -21.25019 11.32003 0.306 14.26621 H ? A ? 89 HD11 1
   ATOM 2142 HD12 C ILE A 90 ? 13.18221 -20.07319 12.02551 0.306 14.26621 H ? A ? 89 HD12 1
   ATOM 2143 HD13 C ILE A 90 ? 12.42398 -21.39909 11.58894 0.306 14.26621 H ? A ? 89 HD13 1
   ATOM 2144 N A VAL A 91 ? 8.46802 -18.78447 9.43516 0.694 10.80568 N ? A ? 90 N 1
   ATOM 2145 CA A VAL A 91 ? 7.25121 -17.99296 9.58667 0.694 10.28147 C ? A ? 90 CA 1
   ATOM 2146 C A VAL A 91 ? 6.19100 -18.80548 10.30954 0.694 10.35576 C ? A ? 90 C 1
   ATOM 2147 O A VAL A 91 ? 5.48528 -18.27419 11.18338 0.694 11.56673 O ? A ? 90 O 1
   ATOM 2148 CB A VAL A 91 ? 6.77739 -17.48015 8.21246 0.694 11.72854 C ? A ? 90 CB 1
   ATOM 2149 CG1 A VAL A 91 ? 5.34507 -16.91825 8.32220 0.694 12.38232 C ? A ? 90 CG1 1
   ATOM 2150 CG2 A VAL A 91 ? 7.73870 -16.45088 7.65933 0.694 12.31512 C ? A ? 90 CG2 1
   ATOM 2151 H A VAL A 91 ? 8.72743 -18.89484 8.62268 0.694 12.94351 H ? A ? 90 H 1
   ATOM 2152 HA A VAL A 91 ? 7.43970 -17.21325 10.13203 0.694 12.31446 H ? A ? 90 HA 1
   ATOM 2153 HB A VAL A 91 ? 6.76048 -18.21908 7.58429 0.694 14.05095 H ? A ? 90 HB 1
   ATOM 2154 HG11 A VAL A 91 ? 5.15163 -16.39006 7.53195 0.694 14.83549 H ? A ? 90 HG11 1
   ATOM 2155 HG12 A VAL A 91 ? 4.72007 -17.65720 8.38730 0.694 14.83549 H ? A ? 90 HG12 1
   ATOM 2156 HG13 A VAL A 91 ? 5.28376 -16.36237 9.11476 0.694 14.83549 H ? A ? 90 HG13 1
   ATOM 2157 HG21 A VAL A 91 ? 7.41191 -16.14361 6.79927 0.694 14.75485 H ? A ? 90 HG21 1
   ATOM 2158 HG22 A VAL A 91 ? 7.79366 -15.70561 8.27776 0.694 14.75485 H ? A ? 90 HG22 1
   ATOM 2159 HG23 A VAL A 91 ? 8.61244 -16.85895 7.55462 0.694 14.75485 H ? A ? 90 HG23 1
   ATOM 2160 N C VAL A 91 ? 8.43824 -18.82971 9.32905 0.306 10.29203 N ? A ? 90 N 1
   ATOM 2161 CA C VAL A 91 ? 7.24357 -18.00102 9.47095 0.306 10.24895 C ? A ? 90 CA 1
   ATOM 2162 C C VAL A 91 ? 6.14689 -18.77405 10.19573 0.306 11.51602 C ? A ? 90 C 1
   ATOM 2163 O C VAL A 91 ? 5.41012 -18.21205 11.01436 0.306 10.44587 O ? A ? 90 O 1
   ATOM 2164 CB C VAL A 91 ? 6.79191 -17.46746 8.09711 0.306 11.73858 C ? A ? 90 CB 1
   ATOM 2165 CG1 C VAL A 91 ? 5.53708 -16.59641 8.24316 0.306 9.20639 C ? A ? 90 CG1 1
   ATOM 2166 CG2 C VAL A 91 ? 7.88592 -16.66792 7.41603 0.306 11.48750 C ? A ? 90 CG2 1
   ATOM 2167 H C VAL A 91 ? 8.65826 -19.01511 8.51860 0.306 12.32713 H ? A ? 90 H 1
   ATOM 2168 HA C VAL A 91 ? 7.45864 -17.22872 10.01702 0.306 12.27545 H ? A ? 90 HA 1
   ATOM 2169 HB C VAL A 91 ? 6.58789 -18.23407 7.53892 0.306 14.06300 H ? A ? 90 HB 1
   ATOM 2170 HG11 C VAL A 91 ? 5.35211 -16.16427 7.39467 0.306 11.02437 H ? A ? 90 HG11 1
   ATOM 2171 HG12 C VAL A 91 ? 4.78945 -17.15973 8.49739 0.306 11.02437 H ? A ? 90 HG12 1
   ATOM 2172 HG13 C VAL A 91 ? 5.69492 -15.92744 8.92760 0.306 11.02437 H ? A ? 90 HG13 1
   ATOM 2173 HG21 C VAL A 91 ? 7.47902 -16.02093 6.81876 0.306 13.76169 H ? A ? 90 HG21 1
   ATOM 2174 HG22 C VAL A 91 ? 8.41002 -16.21030 8.09191 0.306 13.76169 H ? A ? 90 HG22 1
   ATOM 2175 HG23 C VAL A 91 ? 8.45214 -17.27306 6.91196 0.306 13.76169 H ? A ? 90 HG23 1
   ATOM 2176 N A LYS A 92 ? 6.02688 -20.08883 9.93953 0.694 11.47355 N ? A ? 91 N 1
   ATOM 2177 CA A LYS A 92 ? 5.04012 -20.93061 10.60601 0.694 10.44879 C ? A ? 91 CA 1
   ATOM 2178 C A LYS A 92 ? 5.36088 -21.10532 12.08391 0.694 9.27981 C ? A ? 91 C 1
   ATOM 2179 O A LYS A 92 ? 4.45275 -21.10672 12.92603 0.694 10.40839 O ? A ? 91 O 1
   ATOM 2180 CB A LYS A 92 ? 4.92254 -22.24698 9.87547 0.694 11.92896 C ? A ? 91 CB 1
   ATOM 2181 CG A LYS A 92 ? 3.82785 -23.12736 10.39903 0.694 12.60667 C ? A ? 91 CG 1
   ATOM 2182 CD A LYS A 92 ? 3.26166 -24.07089 9.36879 0.694 20.51546 C ? A ? 91 CD 1
   ATOM 2183 CE A LYS A 92 ? 4.31746 -24.75605 8.54164 0.694 18.41881 C ? A ? 91 CE 1
   ATOM 2184 NZ A LYS A 92 ? 5.22986 -25.62394 9.33026 0.694 23.61178 N ? A ? 91 NZ 1
   ATOM 2185 H A LYS A 92 ? 6.46989 -20.48201 9.31603 0.694 13.74496 H ? A ? 91 H 1
   ATOM 2186 HA A LYS A 92 ? 4.16863 -20.50638 10.56789 0.694 12.51525 H ? A ? 91 HA 1
   ATOM 2187 HB2 A LYS A 92 ? 4.73909 -22.06974 8.93961 0.694 14.29146 H ? A ? 91 HB2 1
   ATOM 2188 HB3 A LYS A 92 ? 5.75945 -22.72933 9.96393 0.694 14.29146 H ? A ? 91 HB3 1
   ATOM 2189 HG2 A LYS A 92 ? 4.17874 -23.66240 11.12808 0.694 15.10470 H ? A ? 91 HG2 1
   ATOM 2190 HG3 A LYS A 92 ? 3.10217 -22.56798 10.71742 0.694 15.10470 H ? A ? 91 HG3 1
   ATOM 2191 HD2 A LYS A 92 ? 2.74683 -24.75748 9.82094 0.694 24.59525 H ? A ? 91 HD2 1
   ATOM 2192 HD3 A LYS A 92 ? 2.68997 -23.57085 8.76544 0.694 24.59525 H ? A ? 91 HD3 1
   ATOM 2193 HE2 A LYS A 92 ? 3.88122 -25.31284 7.87788 0.694 22.07927 H ? A ? 91 HE2 1
   ATOM 2194 HE3 A LYS A 92 ? 4.85833 -24.08015 8.10401 0.694 22.07927 H ? A ? 91 HE3 1
   ATOM 2195 HZ1 A LYS A 92 ? 6.00069 -25.72779 8.89767 0.694 28.31083 H ? A ? 91 HZ1 1
   ATOM 2196 HZ2 A LYS A 92 ? 5.39140 -25.25435 10.12362 0.694 28.31083 H ? A ? 91 HZ2 1
   ATOM 2197 HZ3 A LYS A 92 ? 4.85826 -26.42310 9.45420 0.694 28.31083 H ? A ? 91 HZ3 1
   ATOM 2198 N C LYS A 92 ? 6.01479 -20.06751 9.91265 0.306 11.48296 N ? A ? 91 N 1
   ATOM 2199 CA C LYS A 92 ? 5.04205 -20.87061 10.63741 0.306 11.03042 C ? A ? 91 CA 1
   ATOM 2200 C C LYS A 92 ? 5.37477 -20.96516 12.11033 0.306 10.04063 C ? A ? 91 C 1
   ATOM 2201 O C LYS A 92 ? 4.47886 -20.88537 12.96110 0.306 8.49550 O ? A ? 91 O 1
   ATOM 2202 CB C LYS A 92 ? 5.02707 -22.27373 10.07049 0.306 11.16455 C ? A ? 91 CB 1
   ATOM 2203 CG C LYS A 92 ? 4.08060 -22.46890 8.94257 0.306 14.57771 C ? A ? 91 CG 1
   ATOM 2204 CD C LYS A 92 ? 4.45956 -23.68629 8.21415 0.306 18.92760 C ? A ? 91 CD 1
   ATOM 2205 CE C LYS A 92 ? 4.08648 -24.93652 8.92638 0.306 21.79213 C ? A ? 91 CE 1
   ATOM 2206 NZ C LYS A 92 ? 5.07583 -25.96102 8.52015 0.306 26.79770 N ? A ? 91 NZ 1
   ATOM 2207 H C LYS A 92 ? 6.46711 -20.49357 9.31812 0.306 13.75625 H ? A ? 91 H 1
   ATOM 2208 HA C LYS A 92 ? 4.17272 -20.45289 10.53410 0.306 13.21320 H ? A ? 91 HA 1
   ATOM 2209 HB2 C LYS A 92 ? 5.91661 -22.48642 9.74739 0.306 13.37416 H ? A ? 91 HB2 1
   ATOM 2210 HB3 C LYS A 92 ? 4.77420 -22.88975 10.77581 0.306 13.37416 H ? A ? 91 HB3 1
   ATOM 2211 HG2 C LYS A 92 ? 3.17741 -22.57105 9.28125 0.306 17.46996 H ? A ? 91 HG2 1
   ATOM 2212 HG3 C LYS A 92 ? 4.12450 -21.71175 8.33784 0.306 17.46996 H ? A ? 91 HG3 1
   ATOM 2213 HD2 C LYS A 92 ? 4.01261 -23.68976 7.35326 0.306 22.68982 H ? A ? 91 HD2 1
   ATOM 2214 HD3 C LYS A 92 ? 5.42139 -23.69123 8.08862 0.306 22.68982 H ? A ? 91 HD3 1
   ATOM 2215 HE2 C LYS A 92 ? 4.12761 -24.80624 9.88671 0.306 26.12725 H ? A ? 91 HE2 1
   ATOM 2216 HE3 C LYS A 92 ? 3.19626 -25.22248 8.66821 0.306 26.12725 H ? A ? 91 HE3 1
   ATOM 2217 HZ1 C LYS A 92 ? 4.91188 -26.72695 8.94273 0.306 32.13394 H ? A ? 91 HZ1 1
   ATOM 2218 HZ2 C LYS A 92 ? 5.02771 -26.09944 7.64229 0.306 32.13394 H ? A ? 91 HZ2 1
   ATOM 2219 HZ3 C LYS A 92 ? 5.89791 -25.68838 8.72493 0.306 32.13394 H ? A ? 91 HZ3 1
   ATOM 2220 N . LEU A 93 ? 6.64557 -21.20844 12.42358 1.000 10.43187 N ? A ? 92 N 1
   ATOM 2221 CA . LEU A 93 ? 7.04251 -21.28114 13.82354 1.000 9.73395 C ? A ? 92 CA 1
   ATOM 2222 C . LEU A 93 ? 6.74784 -19.97492 14.54894 1.000 9.35200 C ? A ? 92 C 1
   ATOM 2223 O . LEU A 93 ? 6.26403 -19.99318 15.68164 1.000 10.48013 O ? A ? 92 O 1
   ATOM 2224 CB . LEU A 93 ? 8.50647 -21.65881 13.91648 1.000 10.05504 C ? A ? 92 CB 1
   ATOM 2225 CG . LEU A 93 ? 9.12739 -21.88916 15.30834 1.000 9.66136 C ? A ? 92 CG 1
   ATOM 2226 CD1 . LEU A 93 ? 8.59177 -23.15482 15.95124 1.000 12.59135 C ? A ? 92 CD1 1
   ATOM 2227 CD2 . LEU A 93 ? 10.62120 -21.93493 15.19143 1.000 10.70559 C ? A ? 92 CD2 1
   ATOM 2228 HA . LEU A 93 ? 6.53318 -21.97494 14.27091 1.000 11.65744 H ? A ? 92 HA 1
   ATOM 2229 HB2 . LEU A 93 ? 8.62619 -22.48462 13.42191 1.000 12.04275 H ? A ? 92 HB2 1
   ATOM 2230 HB3 . LEU A 93 ? 9.01791 -20.94657 13.50170 1.000 12.04275 H ? A ? 92 HB3 1
   ATOM 2231 HG . LEU A 93 ? 8.88366 -21.15374 15.89200 1.000 11.57034 H ? A ? 92 HG 1
   ATOM 2232 HD11 . LEU A 93 ? 9.01555 -23.27365 16.81565 1.000 15.08632 H ? A ? 92 HD11 1
   ATOM 2233 HD12 . LEU A 93 ? 7.63182 -23.07078 16.06223 1.000 15.08632 H ? A ? 92 HD12 1
   ATOM 2234 HD13 . LEU A 93 ? 8.79351 -23.91032 15.37729 1.000 15.08632 H ? A ? 92 HD13 1
   ATOM 2235 HD21 . LEU A 93 ? 11.00245 -22.08228 16.07111 1.000 12.82341 H ? A ? 92 HD21 1
   ATOM 2236 HD22 . LEU A 93 ? 10.86941 -22.66061 14.59756 1.000 12.82341 H ? A ? 92 HD22 1
   ATOM 2237 HD23 . LEU A 93 ? 10.93583 -21.09081 14.83173 1.000 12.82341 H ? A ? 92 HD23 1
   ATOM 2238 H A LEU A 93 ? 7.30000 -21.23794 11.86640 0.694 12.49494 H ? A ? 92 H 1
   ATOM 2239 H C LEU A 93 ? 7.28129 -21.33197 11.85772 0.306 12.49494 H ? A ? 92 H 1
   ATOM 2240 N . SER A 94 ? 6.98131 -18.85093 13.87935 1.000 10.38049 N ? A ? 93 N 1
   ATOM 2241 CA . SER A 94 ? 6.67106 -17.55059 14.46393 1.000 9.79527 C ? A ? 93 CA 1
   ATOM 2242 C . SER A 94 ? 5.17829 -17.40240 14.68900 1.000 9.71731 C ? A ? 93 C 1
   ATOM 2243 O . SER A 94 ? 4.75145 -16.90788 15.73161 1.000 11.03630 O ? A ? 93 O 1
   ATOM 2244 CB . SER A 94 ? 7.12817 -16.42837 13.53505 1.000 10.52111 C ? A ? 93 CB 1
   ATOM 2245 OG . SER A 94 ? 8.52135 -16.35974 13.44937 1.000 12.55680 O ? A ? 93 OG 1
   ATOM 2246 H . SER A 94 ? 7.31715 -18.81234 13.08858 1.000 12.43329 H ? A ? 93 H 1
   ATOM 2247 HA . SER A 94 ? 7.14216 -17.48006 15.30891 1.000 11.73103 H ? A ? 93 HA 1
   ATOM 2248 HB2 . SER A 94 ? 6.76894 -16.59133 12.64888 1.000 12.60204 H ? A ? 93 HB2 1
   ATOM 2249 HB3 . SER A 94 ? 6.79493 -15.58447 13.87809 1.000 12.60204 H ? A ? 93 HB3 1
   ATOM 2250 HG . SER A 94 ? 8.83040 -17.09880 13.19665 1.000 15.04487 H ? A ? 93 HG 1
   ATOM 2251 N . ALA A 95 ? 4.34686 -17.88454 13.75371 1.000 9.75240 N ? A ? 94 N 1
   ATOM 2252 CA . ALA A 95 ? 2.89884 -17.82916 13.94643 1.000 10.31926 C ? A ? 94 CA 1
   ATOM 2253 C . ALA A 95 ? 2.48306 -18.64791 15.14849 1.000 10.01072 C ? A ? 94 C 1
   ATOM 2254 O . ALA A 95 ? 1.63479 -18.19870 15.94638 1.000 10.79409 O ? A ? 94 O 1
   ATOM 2255 CB . ALA A 95 ? 2.18941 -18.28044 12.66334 1.000 11.45500 C ? A ? 94 CB 1
   ATOM 2256 H . ALA A 95 ? 4.59501 -18.24224 13.01204 1.000 11.67958 H ? A ? 94 H 1
   ATOM 2257 HA . ALA A 95 ? 2.62295 -16.91500 14.11702 1.000 12.35982 H ? A ? 94 HA 1
   ATOM 2258 HB1 . ALA A 95 ? 1.23085 -18.19743 12.78657 1.000 13.72270 H ? A ? 94 HB1 1
   ATOM 2259 HB2 . ALA A 95 ? 2.47835 -17.71761 11.92806 1.000 13.72270 H ? A ? 94 HB2 1
   ATOM 2260 HB3 . ALA A 95 ? 2.42088 -19.20499 12.48297 1.000 13.72270 H ? A ? 94 HB3 1
   ATOM 2261 N . ALA A 96 ? 3.04421 -19.84766 15.29268 1.000 10.22922 N ? A ? 95 N 1
   ATOM 2262 CA . ALA A 96 ? 2.70900 -20.68245 16.43079 1.000 10.41813 C ? A ? 95 CA 1
   ATOM 2263 C . ALA A 96 ? 3.13226 -20.02209 17.73627 1.000 9.85400 C ? A ? 95 C 1
   ATOM 2264 O . ALA A 96 ? 2.38384 -20.02143 18.72342 1.000 11.79702 O ? A ? 95 O 1
   ATOM 2265 CB . ALA A 96 ? 3.39933 -22.04377 16.29656 1.000 12.27301 C ? A ? 95 CB 1
   ATOM 2266 H . ALA A 96 ? 3.61459 -20.19348 14.74985 1.000 12.25177 H ? A ? 95 H 1
   ATOM 2267 HA . ALA A 96 ? 1.74864 -20.81796 16.44673 1.000 12.47845 H ? A ? 95 HA 1
   ATOM 2268 HB1 . ALA A 96 ? 3.18546 -22.58425 17.07312 1.000 14.70431 H ? A ? 95 HB1 1
   ATOM 2269 HB2 . ALA A 96 ? 3.08119 -22.48116 15.49135 1.000 14.70431 H ? A ? 95 HB2 1
   ATOM 2270 HB3 . ALA A 96 ? 4.35819 -21.90762 16.24223 1.000 14.70431 H ? A ? 95 HB3 1
   ATOM 2271 N A ALA A 97 ? 4.33491 -19.46298 17.76011 0.892 9.01915 N ? A ? 96 N 1
   ATOM 2272 CA A ALA A 97 ? 4.82536 -18.83281 18.97752 0.892 9.46340 C ? A ? 96 CA 1
   ATOM 2273 C A ALA A 97 ? 4.00294 -17.60613 19.32143 0.892 11.55319 C ? A ? 96 C 1
   ATOM 2274 O A ALA A 97 ? 3.67951 -17.36880 20.49615 0.892 12.33360 O ? A ? 96 O 1
   ATOM 2275 CB A ALA A 97 ? 6.29423 -18.46345 18.79647 0.892 10.52640 C ? A ? 96 CB 1
   ATOM 2276 H A ALA A 97 ? 4.87963 -19.43474 17.09522 0.892 10.79969 H ? A ? 96 H 1
   ATOM 2277 HA A ALA A 97 ? 4.75496 -19.45605 19.71746 0.892 11.33278 H ? A ? 96 HA 1
   ATOM 2278 HB1 A ALA A 97 ? 6.61866 -18.04985 19.61169 0.892 12.60838 H ? A ? 96 HB1 1
   ATOM 2279 HB2 A ALA A 97 ? 6.80164 -19.26873 18.60951 0.892 12.60838 H ? A ? 96 HB2 1
   ATOM 2280 HB3 A ALA A 97 ? 6.37470 -17.84235 18.05575 0.892 12.60838 H ? A ? 96 HB3 1
   ATOM 2281 N B ALA A 97 ? 4.34226 -19.46298 17.76883 0.108 9.24248 N ? A ? 96 N 1
   ATOM 2282 CA B ALA A 97 ? 4.82873 -18.83599 18.99266 0.108 9.65379 C ? A ? 96 CA 1
   ATOM 2283 C B ALA A 97 ? 4.02880 -17.58560 19.32719 0.108 11.64656 C ? A ? 96 C 1
   ATOM 2284 O B ALA A 97 ? 3.75944 -17.31204 20.50394 0.108 12.36825 O ? A ? 96 O 1
   ATOM 2285 CB B ALA A 97 ? 6.31383 -18.50276 18.85415 0.108 10.56387 C ? A ? 96 CB 1
   ATOM 2286 H B ALA A 97 ? 4.89076 -19.43427 17.10708 0.108 11.06768 H ? A ? 96 H 1
   ATOM 2287 HA B ALA A 97 ? 4.72785 -19.46191 19.72679 0.108 11.56125 H ? A ? 96 HA 1
   ATOM 2288 HB1 B ALA A 97 ? 6.62364 -18.09309 19.67701 0.108 12.65334 H ? A ? 96 HB1 1
   ATOM 2289 HB2 B ALA A 97 ? 6.80676 -19.32109 18.68605 0.108 12.65334 H ? A ? 96 HB2 1
   ATOM 2290 HB3 B ALA A 97 ? 6.43170 -17.88753 18.11354 0.108 12.65334 H ? A ? 96 HB3 1
   ATOM 2291 N . ASP A 98 ? 3.65128 -16.80732 18.30628 1.000 11.40216 N ? A ? 97 N 1
   ATOM 2292 CA . ASP A 98 ? 2.86455 -15.60407 18.53190 1.000 12.24411 C ? A ? 97 CA 1
   ATOM 2293 C . ASP A 98 ? 1.47623 -15.94237 19.04150 1.000 16.54529 C ? A ? 97 C 1
   ATOM 2294 O . ASP A 98 ? 0.88815 -15.15338 19.78911 1.000 17.17522 O ? A ? 97 O 1
   ATOM 2295 CB . ASP A 98 ? 2.79637 -14.77075 17.24470 1.000 15.13199 C ? A ? 97 CB 1
   ATOM 2296 CG . ASP A 98 ? 4.09687 -14.10763 16.87742 1.000 16.37197 C ? A ? 97 CG 1
   ATOM 2297 OD1 . ASP A 98 ? 5.05490 -14.10956 17.67037 1.000 15.50491 O ? A ? 97 OD1 1
   ATOM 2298 OD2 . ASP A 98 ? 4.17604 -13.52399 15.74286 1.000 17.72566 O ? A ? 97 OD2 1
   ATOM 2299 HA . ASP A 98 ? 3.29913 -15.05761 19.20527 1.000 14.66964 H ? A ? 97 HA 1
   ATOM 2300 HB2 . ASP A 98 ? 2.54383 -15.35189 16.51026 1.000 18.13509 H ? A ? 97 HB2 1
   ATOM 2301 HB3 . ASP A 98 ? 2.13187 -14.07353 17.35967 1.000 18.13509 H ? A ? 97 HB3 1
   ATOM 2302 H A ASP A 98 ? 3.85744 -16.94386 17.48260 0.892 13.65929 H ? A ? 97 H 1
   ATOM 2303 H B ASP A 98 ? 3.83909 -16.95725 17.48054 0.108 13.65929 H ? A ? 97 H 1
   ATOM 2304 N . ALA A 99 ? 0.94699 -17.09934 18.66039 1.000 13.70005 N ? A ? 98 N 1
   ATOM 2305 CA . ALA A 99 ? -0.36052 -17.56192 19.10712 1.000 16.03798 C ? A ? 98 CA 1
   ATOM 2306 C . ALA A 99 ? -0.32071 -18.21087 20.48151 1.000 13.96354 C ? A ? 98 C 1
   ATOM 2307 O . ALA A 99 ? -1.39654 -18.44634 21.08128 1.000 16.37432 O ? A ? 98 O 1
   ATOM 2308 CB . ALA A 99 ? -0.93184 -18.56175 18.10409 1.000 19.15477 C ? A ? 98 CB 1
   ATOM 2309 H . ALA A 99 ? 1.33667 -17.65080 18.12781 1.000 16.41676 H ? A ? 98 H 1
   ATOM 2310 HA . ALA A 99 ? -0.95696 -16.79819 19.15038 1.000 19.22228 H ? A ? 98 HA 1
   ATOM 2311 HB1 . ALA A 99 ? -1.80131 -18.85902 18.41484 1.000 22.96242 H ? A ? 98 HB1 1
   ATOM 2312 HB2 . ALA A 99 ? -1.01961 -18.12802 17.24092 1.000 22.96242 H ? A ? 98 HB2 1
   ATOM 2313 HB3 . ALA A 99 ? -0.32905 -19.31849 18.03426 1.000 22.96242 H ? A ? 98 HB3 1
   ATOM 2314 N A GLY A 100 ? 0.87117 -18.47895 21.00666 0.169 12.98587 N ? A ? 99 N 1
   ATOM 2315 CA A GLY A 100 ? 0.98223 -19.14690 22.28917 0.169 12.46853 C ? A ? 99 CA 1
   ATOM 2316 C A GLY A 100 ? 0.40104 -20.53959 22.29164 0.169 13.13862 C ? A ? 99 C 1
   ATOM 2317 O A GLY A 100 ? -0.23318 -20.94476 23.27175 0.169 17.90927 O ? A ? 99 O 1
   ATOM 2318 H A GLY A 100 ? 1.62390 -18.28390 20.63931 0.169 15.55975 H ? A ? 99 H 1
   ATOM 2319 HA2 A GLY A 100 ? 1.91891 -19.21027 22.53313 0.169 14.93893 H ? A ? 99 HA2 1
   ATOM 2320 HA3 A GLY A 100 ? 0.51586 -18.62400 22.95997 0.169 14.93893 H ? A ? 99 HA3 1
   ATOM 2321 N B GLY A 100 ? 0.87205 -18.52462 20.99528 0.831 12.68233 N ? A ? 99 N 1
   ATOM 2322 CA B GLY A 100 ? 0.99378 -19.15322 22.29306 0.831 12.18246 C ? A ? 99 CA 1
   ATOM 2323 C B GLY A 100 ? 0.50823 -20.58213 22.33208 0.831 12.46026 C ? A ? 99 C 1
   ATOM 2324 O B GLY A 100 ? 0.05748 -21.06324 23.38024 0.831 16.25030 O ? A ? 99 O 1
   ATOM 2325 H B GLY A 100 ? 1.62405 -18.37980 20.60398 0.831 15.19550 H ? A ? 99 H 1
   ATOM 2326 HA2 B GLY A 100 ? 1.92664 -19.14687 22.55881 0.831 14.59565 H ? A ? 99 HA2 1
   ATOM 2327 HA3 B GLY A 100 ? 0.47818 -18.64432 22.93810 0.831 14.59565 H ? A ? 99 HA3 1
   ATOM 2328 N . ASP A 101 ? 0.61727 -21.29208 21.22209 1.000 13.84541 N ? A ? 100 N 1
   ATOM 2329 CA . ASP A 101 ? 0.01580 -22.61102 21.04065 1.000 15.87330 C ? A ? 100 CA 1
   ATOM 2330 C . ASP A 101 ? 1.12980 -23.65178 20.98163 1.000 13.77659 C ? A ? 100 C 1
   ATOM 2331 O . ASP A 101 ? 1.81049 -23.76974 19.96689 1.000 13.90303 O ? A ? 100 O 1
   ATOM 2332 CB . ASP A 101 ? -0.81085 -22.62404 19.74492 1.000 21.03010 C ? A ? 100 CB 1
   ATOM 2333 CG . ASP A 101 ? -1.56153 -23.91832 19.52599 1.000 34.04257 C ? A ? 100 CG 1
   ATOM 2334 OD1 . ASP A 101 ? -1.11744 -24.98559 19.97514 1.000 22.52742 O ? A ? 100 OD1 1
   ATOM 2335 OD2 . ASP A 101 ? -2.62267 -23.86352 18.89649 1.000 45.32242 O ? A ? 100 OD2 1
   ATOM 2336 HA . ASP A 101 ? -0.55045 -22.81908 21.80023 1.000 19.02465 H ? A ? 100 HA 1
   ATOM 2337 HB2 . ASP A 101 ? -1.46127 -21.90530 19.78038 1.000 25.21282 H ? A ? 100 HB2 1
   ATOM 2338 HB3 . ASP A 101 ? -0.21448 -22.49488 18.99088 1.000 25.21282 H ? A ? 100 HB3 1
   ATOM 2339 H A ASP A 101 ? 1.12285 -21.05547 20.56786 0.169 16.59119 H ? A ? 100 H 1
   ATOM 2340 H B ASP A 101 ? 1.05137 -21.02370 20.52989 0.831 16.59119 H ? A ? 100 H 1
   ATOM 2341 N . LEU A 102 ? 1.30598 -24.40638 22.05619 1.000 15.92908 N ? A ? 101 N 1
   ATOM 2342 CA . LEU A 102 ? 2.39743 -25.38038 22.11912 1.000 16.47995 C ? A ? 101 CA 1
   ATOM 2343 C . LEU A 102 ? 2.24048 -26.50647 21.11345 1.000 13.61405 C ? A ? 101 C 1
   ATOM 2344 O . LEU A 102 ? 3.22891 -27.01253 20.58140 1.000 14.82465 O ? A ? 101 O 1
   ATOM 2345 CB . LEU A 102 ? 2.57077 -25.91920 23.54139 1.000 20.66347 C ? A ? 101 CB 1
   ATOM 2346 CG . LEU A 102 ? 3.70152 -26.90361 23.82717 1.000 27.94463 C ? A ? 101 CG 1
   ATOM 2347 CD1 . LEU A 102 ? 5.05875 -26.33111 23.47712 1.000 23.40800 C ? A ? 101 CD1 1
   ATOM 2348 CD2 . LEU A 102 ? 3.66663 -27.30219 25.31594 1.000 28.85604 C ? A ? 101 CD2 1
   ATOM 2349 H . LEU A 102 ? 0.81400 -24.37885 22.76103 1.000 19.09159 H ? A ? 101 H 1
   ATOM 2350 HA . LEU A 102 ? 3.21521 -24.91358 21.88625 1.000 19.75264 H ? A ? 101 HA 1
   ATOM 2351 HB2 . LEU A 102 ? 2.71607 -25.15796 24.12473 1.000 24.77286 H ? A ? 101 HB2 1
   ATOM 2352 HB3 . LEU A 102 ? 1.74688 -26.37027 23.78357 1.000 24.77286 H ? A ? 101 HB3 1
   ATOM 2353 HG . LEU A 102 ? 3.57391 -27.68869 23.27195 1.000 33.51026 H ? A ? 101 HG 1
   ATOM 2354 HD11 . LEU A 102 ? 5.74343 -26.97869 23.70677 1.000 28.06630 H ? A ? 101 HD11 1
   ATOM 2355 HD12 . LEU A 102 ? 5.08658 -26.14357 22.52583 1.000 28.06630 H ? A ? 101 HD12 1
   ATOM 2356 HD13 . LEU A 102 ? 5.19550 -25.51282 23.97972 1.000 28.06630 H ? A ? 101 HD13 1
   ATOM 2357 HD21 . LEU A 102 ? 4.37277 -27.94472 25.48748 1.000 34.60395 H ? A ? 101 HD21 1
   ATOM 2358 HD22 . LEU A 102 ? 3.80180 -26.50946 25.85835 1.000 34.60395 H ? A ? 101 HD22 1
   ATOM 2359 HD23 . LEU A 102 ? 2.80387 -27.69735 25.51693 1.000 34.60395 H ? A ? 101 HD23 1
   ATOM 2360 N . ASP A 103 ? 1.01748 -26.93359 20.85814 1.000 14.66223 N ? A ? 102 N 1
   ATOM 2361 CA . ASP A 103 ? 0.84428 -27.97367 19.84813 1.000 13.43007 C ? A ? 102 CA 1
   ATOM 2362 C . ASP A 103 ? 1.27562 -27.48799 18.47411 1.000 12.02186 C ? A ? 102 C 1
   ATOM 2363 O . ASP A 103 ? 1.98200 -28.20265 17.73887 1.000 13.18734 O ? A ? 102 O 1
   ATOM 2364 CB . ASP A 103 ? -0.61570 -28.42767 19.74761 1.000 16.73152 C ? A ? 102 CB 1
   ATOM 2365 CG . ASP A 103 ? -1.03541 -29.33876 20.87115 1.000 36.06607 C ? A ? 102 CG 1
   ATOM 2366 OD1 . ASP A 103 ? -2.18111 -29.20089 21.33304 1.000 56.16219 O ? A ? 102 OD1 1
   ATOM 2367 OD2 . ASP A 103 ? -0.24717 -30.20176 21.29957 1.000 47.72460 O ? A ? 102 OD2 1
   ATOM 2368 H . ASP A 103 ? 0.29761 -26.65352 21.23622 1.000 17.57137 H ? A ? 102 H 1
   ATOM 2369 HA . ASP A 103 ? 1.38890 -28.72622 20.12733 1.000 16.09279 H ? A ? 102 HA 1
   ATOM 2370 HB2 . ASP A 103 ? -1.18968 -27.64599 19.76818 1.000 20.05453 H ? A ? 102 HB2 1
   ATOM 2371 HB3 . ASP A 103 ? -0.73853 -28.90760 18.91366 1.000 20.05453 H ? A ? 102 HB3 1
   ATOM 2372 N . LYS A 104 ? 0.87102 -26.27898 18.10866 1.000 13.21934 N ? A ? 103 N 1
   ATOM 2373 CA . LYS A 104 ? 1.30992 -25.71917 16.83894 1.000 12.89310 C ? A ? 103 CA 1
   ATOM 2374 C . LYS A 104 ? 2.81126 -25.50023 16.84294 1.000 11.21913 C ? A ? 103 C 1
   ATOM 2375 O . LYS A 104 ? 3.48326 -25.69923 15.81064 1.000 12.05136 O ? A ? 103 O 1
   ATOM 2376 CB . LYS A 104 ? 0.58121 -24.41061 16.54629 1.000 15.56291 C ? A ? 103 CB 1
   ATOM 2377 CG . LYS A 104 ? -0.83942 -24.60040 16.01483 1.000 23.21685 C ? A ? 103 CG 1
   ATOM 2378 CD . LYS A 104 ? -1.58721 -23.27524 15.91881 1.000 38.20169 C ? A ? 103 CD 1
   ATOM 2379 CE . LYS A 104 ? -2.58633 -23.24978 14.77204 1.000 50.52166 C ? A ? 103 CE 1
   ATOM 2380 NZ . LYS A 104 ? -1.92810 -23.16833 13.44157 1.000 36.63989 N ? A ? 103 NZ 1
   ATOM 2381 H . LYS A 104 ? 0.35175 -25.77064 18.56860 1.000 15.83991 H ? A ? 103 H 1
   ATOM 2382 HA . LYS A 104 ? 1.08689 -26.34185 16.12942 1.000 15.44842 H ? A ? 103 HA 1
   ATOM 2383 HB2 . LYS A 104 ? 0.52397 -23.89577 17.36639 1.000 18.65219 H ? A ? 103 HB2 1
   ATOM 2384 HB3 . LYS A 104 ? 1.08322 -23.91698 15.87904 1.000 18.65219 H ? A ? 103 HB3 1
   ATOM 2385 HG2 . LYS A 104 ? -0.80034 -24.99232 15.12839 1.000 27.83692 H ? A ? 103 HG2 1
   ATOM 2386 HG3 . LYS A 104 ? -1.33058 -25.18387 16.61418 1.000 27.83692 H ? A ? 103 HG3 1
   ATOM 2387 HD2 . LYS A 104 ? -2.07385 -23.12517 16.74438 1.000 45.81872 H ? A ? 103 HD2 1
   ATOM 2388 HD3 . LYS A 104 ? -0.94783 -22.55993 15.77588 1.000 45.81872 H ? A ? 103 HD3 1
   ATOM 2389 HE2 . LYS A 104 ? -3.11637 -24.06181 14.79559 1.000 60.60269 H ? A ? 103 HE2 1
   ATOM 2390 HE3 . LYS A 104 ? -3.16170 -22.47506 14.87031 1.000 60.60269 H ? A ? 103 HE3 1
   ATOM 2391 HZ1 . LYS A 104 ? -2.54298 -23.14961 12.79839 1.000 43.94457 H ? A ? 103 HZ1 1
   ATOM 2392 HZ2 . LYS A 104 ? -1.43451 -22.42948 13.39087 1.000 43.94457 H ? A ? 103 HZ2 1
   ATOM 2393 HZ3 . LYS A 104 ? -1.40249 -23.87586 13.31816 1.000 43.94457 H ? A ? 103 HZ3 1
   ATOM 2394 N . LEU A 105 ? 3.35977 -25.08904 17.99566 1.000 11.31043 N ? A ? 104 N 1
   ATOM 2395 CA . LEU A 105 ? 4.79454 -24.89164 18.09593 1.000 10.32745 C ? A ? 104 CA 1
   ATOM 2396 C . LEU A 105 ? 5.54302 -26.18355 17.83328 1.000 9.36882 C ? A ? 104 C 1
   ATOM 2397 O . LEU A 105 ? 6.52566 -26.20063 17.09231 1.000 10.40380 O ? A ? 104 O 1
   ATOM 2398 CB . LEU A 105 ? 5.14750 -24.35875 19.47381 1.000 11.92097 C ? A ? 104 CB 1
   ATOM 2399 CG . LEU A 105 ? 6.57986 -23.86332 19.59173 1.000 12.89902 C ? A ? 104 CG 1
   ATOM 2400 CD1 . LEU A 105 ? 6.67969 -22.42457 19.10536 1.000 13.37687 C ? A ? 104 CD1 1
   ATOM 2401 CD2 . LEU A 105 ? 7.06674 -23.97183 21.00139 1.000 14.19776 C ? A ? 104 CD2 1
   ATOM 2402 H . LEU A 105 ? 2.92299 -24.92246 18.71751 1.000 13.54922 H ? A ? 104 H 1
   ATOM 2403 HA . LEU A 105 ? 5.06469 -24.23868 17.43142 1.000 12.36963 H ? A ? 104 HA 1
   ATOM 2404 HB2 . LEU A 105 ? 4.55883 -23.61592 19.68011 1.000 14.28186 H ? A ? 104 HB2 1
   ATOM 2405 HB3 . LEU A 105 ? 5.02506 -25.06923 20.12274 1.000 14.28186 H ? A ? 104 HB3 1
   ATOM 2406 HG . LEU A 105 ? 7.15101 -24.41705 19.03669 1.000 15.45552 H ? A ? 104 HG 1
   ATOM 2407 HD11 . LEU A 105 ? 7.59352 -22.11756 19.21285 1.000 16.02895 H ? A ? 104 HD11 1
   ATOM 2408 HD12 . LEU A 105 ? 6.42680 -22.38929 18.16956 1.000 16.02895 H ? A ? 104 HD12 1
   ATOM 2409 HD13 . LEU A 105 ? 6.08088 -21.87128 19.63090 1.000 16.02895 H ? A ? 104 HD13 1
   ATOM 2410 HD21 . LEU A 105 ? 7.97770 -23.64177 21.04715 1.000 17.01401 H ? A ? 104 HD21 1
   ATOM 2411 HD22 . LEU A 105 ? 6.49314 -23.44041 21.57540 1.000 17.01401 H ? A ? 104 HD22 1
   ATOM 2412 HD23 . LEU A 105 ? 7.03783 -24.90206 21.27476 1.000 17.01401 H ? A ? 104 HD23 1
   ATOM 2413 N . ARG A 106 ? 5.11926 -27.28309 18.45386 1.000 10.45468 N ? A ? 105 N 1
   ATOM 2414 CA . ARG A 106 ? 5.83619 -28.53881 18.28317 1.000 11.82345 C ? A ? 105 CA 1
   ATOM 2415 C . ARG A 106 ? 5.84149 -28.97230 16.83141 1.000 10.80521 C ? A ? 105 C 1
   ATOM 2416 O . ARG A 106 ? 6.84702 -29.44262 16.30833 1.000 10.58614 O ? A ? 105 O 1
   ATOM 2417 CB . ARG A 106 ? 5.13824 -29.67734 19.02907 1.000 15.71321 C ? A ? 105 CB 1
   ATOM 2418 CG . ARG A 106 ? 4.87462 -29.58890 20.49864 1.000 32.80304 C ? A ? 105 CG 1
   ATOM 2419 CD . ARG A 106 ? 4.52841 -31.03091 21.00143 1.000 28.90768 C ? A ? 105 CD 1
   ATOM 2420 NE . ARG A 106 ? 3.35910 -31.66014 20.37406 1.000 33.46482 N ? A ? 105 NE 1
   ATOM 2421 CZ . ARG A 106 ? 3.11906 -32.97069 20.36452 1.000 33.97232 C ? A ? 105 CZ 1
   ATOM 2422 NH1 . ARG A 106 ? 4.00186 -33.84201 20.82431 1.000 18.29977 N ? A ? 105 NH1 1
   ATOM 2423 NH2 . ARG A 106 ? 1.95145 -33.41952 19.90114 1.000 21.55570 N ? A ? 105 NH2 1
   ATOM 2424 H . ARG A 106 ? 4.43216 -27.32639 18.96925 1.000 12.52232 H ? A ? 105 H 1
   ATOM 2425 HA . ARG A 106 ? 6.73151 -28.39095 18.62587 1.000 14.16484 H ? A ? 105 HA 1
   ATOM 2426 HB2 . ARG A 106 ? 4.27116 -29.79959 18.61181 1.000 18.83255 H ? A ? 105 HB2 1
   ATOM 2427 HB3 . ARG A 106 ? 5.68100 -30.47167 18.90516 1.000 18.83255 H ? A ? 105 HB3 1
   ATOM 2428 HG2 . ARG A 106 ? 5.66291 -29.26690 20.96320 1.000 39.34035 H ? A ? 105 HG2 1
   ATOM 2429 HG3 . ARG A 106 ? 4.12394 -28.99927 20.67102 1.000 39.34035 H ? A ? 105 HG3 1
   ATOM 2430 HD2 . ARG A 106 ? 5.29078 -31.60528 20.82884 1.000 34.66591 H ? A ? 105 HD2 1
   ATOM 2431 HD3 . ARG A 106 ? 4.35449 -30.98792 21.95474 1.000 34.66591 H ? A ? 105 HD3 1
   ATOM 2432 HE . ARG A 106 ? 2.78917 -31.14654 19.98547 1.000 40.13449 H ? A ? 105 HE 1
   ATOM 2433 HH11 . ARG A 106 ? 4.75320 -33.56713 21.13978 1.000 21.93642 H ? A ? 105 HH11 1
   ATOM 2434 HH12 . ARG A 106 ? 3.82443 -34.68335 20.80775 1.000 21.93642 H ? A ? 105 HH12 1
   ATOM 2435 HH21 . ARG A 106 ? 1.36156 -32.86449 19.61203 1.000 25.84354 H ? A ? 105 HH21 1
   ATOM 2436 HH22 . ARG A 106 ? 1.78858 -34.26390 19.89152 1.000 25.84354 H ? A ? 105 HH22 1
   ATOM 2437 N . ALA A 107 ? 4.70283 -28.86179 16.17512 1.000 10.42274 N ? A ? 106 N 1
   ATOM 2438 CA . ALA A 107 ? 4.58504 -29.27332 14.78226 1.000 11.79086 C ? A ? 106 CA 1
   ATOM 2439 C . ALA A 107 ? 5.49276 -28.41581 13.91336 1.000 9.88848 C ? A ? 106 C 1
   ATOM 2440 O . ALA A 107 ? 6.22716 -28.91128 13.05437 1.000 10.86635 O ? A ? 106 O 1
   ATOM 2441 CB . ALA A 107 ? 3.11290 -29.14475 14.33654 1.000 12.77678 C ? A ? 106 CB 1
   ATOM 2442 H . ALA A 107 ? 3.97498 -28.55008 16.51077 1.000 12.48398 H ? A ? 106 H 1
   ATOM 2443 HA . ALA A 107 ? 4.84896 -30.20136 14.68229 1.000 14.12574 H ? A ? 106 HA 1
   ATOM 2444 HB1 . ALA A 107 ? 3.04061 -29.40800 13.40575 1.000 15.30884 H ? A ? 106 HB1 1
   ATOM 2445 HB2 . ALA A 107 ? 2.56426 -29.72441 14.88781 1.000 15.30884 H ? A ? 106 HB2 1
   ATOM 2446 HB3 . ALA A 107 ? 2.83022 -28.22292 14.44249 1.000 15.30884 H ? A ? 106 HB3 1
   ATOM 2447 N . ALA A 108 ? 5.44552 -27.10974 14.13301 1.000 9.55298 N ? A ? 107 N 1
   ATOM 2448 CA . ALA A 108 ? 6.27174 -26.18990 13.36210 1.000 10.39746 C ? A ? 107 CA 1
   ATOM 2449 C . ALA A 108 ? 7.73160 -26.41457 13.61032 1.000 9.97589 C ? A ? 107 C 1
   ATOM 2450 O . ALA A 108 ? 8.54627 -26.24800 12.67982 1.000 10.91975 O ? A ? 107 O 1
   ATOM 2451 CB . ALA A 108 ? 5.87007 -24.76237 13.67701 1.000 12.67705 C ? A ? 107 CB 1
   ATOM 2452 H . ALA A 108 ? 4.94573 -26.72926 14.72041 1.000 11.44027 H ? A ? 107 H 1
   ATOM 2453 HA . ALA A 108 ? 6.11965 -26.34256 12.41634 1.000 12.45365 H ? A ? 107 HA 1
   ATOM 2454 HB1 . ALA A 108 ? 6.42037 -24.15715 13.15568 1.000 15.18916 H ? A ? 107 HB1 1
   ATOM 2455 HB2 . ALA A 108 ? 4.93542 -24.63956 13.44846 1.000 15.18916 H ? A ? 107 HB2 1
   ATOM 2456 HB3 . ALA A 108 ? 6.00343 -24.59831 14.62369 1.000 15.18916 H ? A ? 107 HB3 1
   ATOM 2457 N . PHE A 109 ? 8.08805 -26.70923 14.85585 1.000 9.64346 N ? A ? 108 N 1
   ATOM 2458 CA . PHE A 109 ? 9.48250 -26.94121 15.22457 1.000 9.73420 C ? A ? 108 CA 1
   ATOM 2459 C . PHE A 109 ? 10.00676 -28.12755 14.44667 1.000 9.47472 C ? A ? 108 C 1
   ATOM 2460 O . PHE A 109 ? 11.13749 -28.10249 13.91825 1.000 10.61341 O ? A ? 108 O 1
   ATOM 2461 H . PHE A 109 ? 7.53888 -26.78204 15.51366 1.000 11.54886 H ? A ? 108 H 1
   ATOM 2462 HA . PHE A 109 ? 10.04593 -26.17933 15.01723 1.000 11.65774 H ? A ? 108 HA 1
   ATOM 2463 CB A PHE A 109 ? 9.56057 -27.21261 16.74559 0.456 10.27526 C ? A ? 108 CB 1
   ATOM 2464 CG A PHE A 109 ? 10.95634 -27.51710 17.27898 0.456 8.49578 C ? A ? 108 CG 1
   ATOM 2465 CD1 A PHE A 109 ? 11.76592 -26.49007 17.74953 0.456 9.54520 C ? A ? 108 CD1 1
   ATOM 2466 CD2 A PHE A 109 ? 11.43814 -28.81052 17.34463 0.456 9.51489 C ? A ? 108 CD2 1
   ATOM 2467 CE1 A PHE A 109 ? 13.04213 -26.75582 18.24456 0.456 8.46524 C ? A ? 108 CE1 1
   ATOM 2468 CE2 A PHE A 109 ? 12.72009 -29.06816 17.85368 0.456 10.68981 C ? A ? 108 CE2 1
   ATOM 2469 CZ A PHE A 109 ? 13.51064 -28.05006 18.29093 0.456 13.83352 C ? A ? 108 CZ 1
   ATOM 2470 HB2 A PHE A 109 ? 9.23592 -26.42768 17.21398 0.456 12.30701 H ? A ? 108 HB2 1
   ATOM 2471 HB3 A PHE A 109 ? 8.99898 -27.97670 16.94975 0.456 12.30701 H ? A ? 108 HB3 1
   ATOM 2472 HD1 A PHE A 109 ? 11.45254 -25.61460 17.73404 0.456 11.43094 H ? A ? 108 HD1 1
   ATOM 2473 HD2 A PHE A 109 ? 10.90869 -29.51569 17.04915 0.456 11.39457 H ? A ? 108 HD2 1
   ATOM 2474 HE1 A PHE A 109 ? 13.57821 -26.05740 18.54412 0.456 10.13499 H ? A ? 108 HE1 1
   ATOM 2475 HE2 A PHE A 109 ? 13.03269 -29.94318 17.89271 0.456 12.80448 H ? A ? 108 HE2 1
   ATOM 2476 HZ A PHE A 109 ? 14.36251 -28.22744 18.61920 0.456 16.57693 H ? A ? 108 HZ 1
   ATOM 2477 CB B PHE A 109 ? 9.54782 -27.15725 16.73207 0.544 9.93148 C ? A ? 108 CB 1
   ATOM 2478 CG B PHE A 109 ? 10.92661 -27.26368 17.29408 0.544 11.26601 C ? A ? 108 CG 1
   ATOM 2479 CD1 B PHE A 109 ? 11.63283 -26.13371 17.67004 0.544 11.99400 C ? A ? 108 CD1 1
   ATOM 2480 CD2 B PHE A 109 ? 11.47494 -28.50269 17.54705 0.544 10.70276 C ? A ? 108 CD2 1
   ATOM 2481 CE1 B PHE A 109 ? 12.90459 -26.24928 18.24912 0.544 11.14538 C ? A ? 108 CE1 1
   ATOM 2482 CE2 B PHE A 109 ? 12.72368 -28.62416 18.13063 0.544 10.61524 C ? A ? 108 CE2 1
   ATOM 2483 CZ B PHE A 109 ? 13.43307 -27.50752 18.45938 0.544 9.05849 C ? A ? 108 CZ 1
   ATOM 2484 HB2 B PHE A 109 ? 9.11266 -26.40842 17.16886 0.544 11.89448 H ? A ? 108 HB2 1
   ATOM 2485 HB3 B PHE A 109 ? 9.08260 -27.98140 16.94474 0.544 11.89448 H ? A ? 108 HB3 1
   ATOM 2486 HD1 B PHE A 109 ? 11.26089 -25.29169 17.53748 0.544 14.36950 H ? A ? 108 HD1 1
   ATOM 2487 HD2 B PHE A 109 ? 10.99827 -29.26889 17.32202 0.544 12.82001 H ? A ? 108 HD2 1
   ATOM 2488 HE1 B PHE A 109 ? 13.38506 -25.48971 18.48807 0.544 13.35116 H ? A ? 108 HE1 1
   ATOM 2489 HE2 B PHE A 109 ? 13.07879 -29.46715 18.29847 0.544 12.71499 H ? A ? 108 HE2 1
   ATOM 2490 HZ B PHE A 109 ? 14.28198 -27.59406 18.82919 0.544 10.84689 H ? A ? 108 HZ 1
   ATOM 2491 N B GLY A 110 ? 9.23193 -29.21258 14.42014 0.661 10.28626 N ? A ? 109 N 1
   ATOM 2492 CA B GLY A 110 ? 9.64123 -30.40078 13.68948 0.661 11.34022 C ? A ? 109 CA 1
   ATOM 2493 C B GLY A 110 ? 9.86971 -30.14384 12.21179 0.661 10.76397 C ? A ? 109 C 1
   ATOM 2494 O B GLY A 110 ? 10.82498 -30.66497 11.61218 0.661 12.08446 O ? A ? 109 O 1
   ATOM 2495 H B GLY A 110 ? 8.47109 -29.28290 14.81481 0.661 12.32021 H ? A ? 109 H 1
   ATOM 2496 HA2 B GLY A 110 ? 10.46758 -30.73844 14.06899 0.661 13.58496 H ? A ? 109 HA2 1
   ATOM 2497 HA3 B GLY A 110 ? 8.95364 -31.07953 13.77559 0.661 13.58496 H ? A ? 109 HA3 1
   ATOM 2498 N D GLY A 110 ? 9.20457 -29.18636 14.35588 0.339 10.57059 N ? A ? 109 N 1
   ATOM 2499 CA D GLY A 110 ? 9.57657 -30.30890 13.51423 0.339 10.03420 C ? A ? 109 CA 1
   ATOM 2500 C D GLY A 110 ? 9.77365 -29.91327 12.06114 0.339 7.73724 C ? A ? 109 C 1
   ATOM 2501 O D GLY A 110 ? 10.72418 -30.34807 11.40744 0.339 7.51222 O ? A ? 109 O 1
   ATOM 2502 H D GLY A 110 ? 8.45349 -29.27502 14.76528 0.339 12.66141 H ? A ? 109 H 1
   ATOM 2503 HA2 D GLY A 110 ? 10.40591 -30.69190 13.84042 0.339 12.01774 H ? A ? 109 HA2 1
   ATOM 2504 HA3 D GLY A 110 ? 8.88018 -30.98295 13.55425 0.339 12.01774 H ? A ? 109 HA3 1
   ATOM 2505 N B ASP A 111 ? 8.98920 -29.34507 11.59876 0.661 10.13705 N ? A ? 110 N 1
   ATOM 2506 CA B ASP A 111 ? 9.14575 -29.00014 10.19074 0.661 8.63015 C ? A ? 110 CA 1
   ATOM 2507 C B ASP A 111 ? 10.39117 -28.15278 9.95427 0.661 9.81353 C ? A ? 110 C 1
   ATOM 2508 O B ASP A 111 ? 11.14711 -28.38974 8.99713 0.661 9.16882 O ? A ? 110 O 1
   ATOM 2509 CB B ASP A 111 ? 7.88196 -28.31380 9.67140 0.661 9.43248 C ? A ? 110 CB 1
   ATOM 2510 CG B ASP A 111 ? 6.65450 -29.21781 9.74261 0.661 14.04965 C ? A ? 110 CG 1
   ATOM 2511 OD1 B ASP A 111 ? 6.82629 -30.43746 9.74994 0.661 14.47157 O ? A ? 110 OD1 1
   ATOM 2512 OD2 B ASP A 111 ? 5.51836 -28.65556 9.77282 0.661 17.32458 O ? A ? 110 OD2 1
   ATOM 2513 H B ASP A 111 ? 8.29991 -28.99466 11.97518 0.661 12.14116 H ? A ? 110 H 1
   ATOM 2514 HA B ASP A 111 ? 9.25874 -29.81587 9.67818 0.661 10.33288 H ? A ? 110 HA 1
   ATOM 2515 HB2 B ASP A 111 ? 7.70631 -27.52503 10.20794 0.661 11.29567 H ? A ? 110 HB2 1
   ATOM 2516 HB3 B ASP A 111 ? 8.01641 -28.06136 8.74452 0.661 11.29567 H ? A ? 110 HB3 1
   ATOM 2517 N D ASP A 111 ? 8.86962 -29.09244 11.52472 0.339 7.66395 N ? A ? 110 N 1
   ATOM 2518 CA D ASP A 111 ? 8.98758 -28.69720 10.12464 0.339 8.74863 C ? A ? 110 CA 1
   ATOM 2519 C D ASP A 111 ? 10.24802 -27.87898 9.89342 0.339 7.67898 C ? A ? 110 C 1
   ATOM 2520 O D ASP A 111 ? 10.88771 -27.98846 8.83666 0.339 7.71306 O ? A ? 110 O 1
   ATOM 2521 CB D ASP A 111 ? 7.75587 -27.91659 9.68380 0.339 13.05395 C ? A ? 110 CB 1
   ATOM 2522 CG D ASP A 111 ? 6.57930 -28.80140 9.41066 0.339 11.45386 C ? A ? 110 CG 1
   ATOM 2523 OD1 D ASP A 111 ? 6.75219 -30.02203 9.34807 0.339 10.17504 O ? A ? 110 OD1 1
   ATOM 2524 OD2 D ASP A 111 ? 5.46936 -28.26739 9.22818 0.339 8.22566 O ? A ? 110 OD2 1
   ATOM 2525 H D ASP A 111 ? 8.19487 -28.75871 11.94058 0.339 9.17344 H ? A ? 110 H 1
   ATOM 2526 HA D ASP A 111 ? 9.03825 -29.49847 9.58030 0.339 10.47506 H ? A ? 110 HA 1
   ATOM 2527 HB2 D ASP A 111 ? 7.50746 -27.29467 10.38553 0.339 15.64144 H ? A ? 110 HB2 1
   ATOM 2528 HB3 D ASP A 111 ? 7.96294 -27.43227 8.86927 0.339 15.64144 H ? A ? 110 HB3 1
   ATOM 2529 N B VAL A 112 ? 10.63388 -27.17431 10.82258 0.661 8.80286 N ? A ? 111 N 1
   ATOM 2530 CA B VAL A 112 ? 11.84992 -26.37440 10.68854 0.661 8.83992 C ? A ? 111 CA 1
   ATOM 2531 C B VAL A 112 ? 13.06713 -27.27511 10.75075 0.661 9.27471 C ? A ? 111 C 1
   ATOM 2532 O B VAL A 112 ? 13.96056 -27.20775 9.90007 0.661 9.52437 O ? A ? 111 O 1
   ATOM 2533 CB B VAL A 112 ? 11.94296 -25.27401 11.75850 0.661 8.78140 C ? A ? 111 CB 1
   ATOM 2534 CG1 B VAL A 112 ? 13.32192 -24.61616 11.73353 0.661 9.45451 C ? A ? 111 CG1 1
   ATOM 2535 CG2 B VAL A 112 ? 10.88919 -24.20539 11.54816 0.661 11.52230 C ? A ? 111 CG2 1
   ATOM 2536 H B VAL A 112 ? 10.12504 -26.95780 11.48122 0.661 10.54013 H ? A ? 111 H 1
   ATOM 2537 HA B VAL A 112 ? 11.81093 -25.93542 9.82443 0.661 10.58461 H ? A ? 111 HA 1
   ATOM 2538 HB B VAL A 112 ? 11.79561 -25.69248 12.62110 0.661 10.51437 H ? A ? 111 HB 1
   ATOM 2539 HG11 B VAL A 112 ? 13.28376 -23.78379 12.23011 0.661 11.32211 H ? A ? 111 HG11 1
   ATOM 2540 HG12 B VAL A 112 ? 13.96541 -25.21597 12.14225 0.661 11.32211 H ? A ? 111 HG12 1
   ATOM 2541 HG13 B VAL A 112 ? 13.57156 -24.44087 10.81274 0.661 11.32211 H ? A ? 111 HG13 1
   ATOM 2542 HG21 B VAL A 112 ? 10.87514 -23.61929 12.32093 0.661 13.80346 H ? A ? 111 HG21 1
   ATOM 2543 HG22 B VAL A 112 ? 11.10920 -23.69737 10.75166 0.661 13.80346 H ? A ? 111 HG22 1
   ATOM 2544 HG23 B VAL A 112 ? 10.02446 -24.63146 11.44038 0.661 13.80346 H ? A ? 111 HG23 1
   ATOM 2545 N D VAL A 112 ? 10.61894 -27.05118 10.87208 0.339 9.96825 N ? A ? 111 N 1
   ATOM 2546 CA D VAL A 112 ? 11.86282 -26.29074 10.75538 0.339 8.80314 C ? A ? 111 CA 1
   ATOM 2547 C D VAL A 112 ? 13.07122 -27.22991 10.77511 0.339 9.21585 C ? A ? 111 C 1
   ATOM 2548 O D VAL A 112 ? 13.94697 -27.16868 9.90094 0.339 9.67369 O ? A ? 111 O 1
   ATOM 2549 CB D VAL A 112 ? 11.95250 -25.23067 11.86561 0.339 9.09030 C ? A ? 111 CB 1
   ATOM 2550 CG1 D VAL A 112 ? 13.35906 -24.71322 12.00006 0.339 7.38142 C ? A ? 111 CG1 1
   ATOM 2551 CG2 D VAL A 112 ? 10.98788 -24.07248 11.60013 0.339 7.26749 C ? A ? 111 CG2 1
   ATOM 2552 H D VAL A 112 ? 10.17807 -26.91484 11.59778 0.339 11.93860 H ? A ? 111 H 1
   ATOM 2553 HA D VAL A 112 ? 11.85952 -25.83038 9.90159 0.339 10.54047 H ? A ? 111 HA 1
   ATOM 2554 HB D VAL A 112 ? 11.69888 -25.65019 12.70262 0.339 10.88506 H ? A ? 111 HB 1
   ATOM 2555 HG11 D VAL A 112 ? 13.34098 -23.87039 12.47986 0.339 8.83440 H ? A ? 111 HG11 1
   ATOM 2556 HG12 D VAL A 112 ? 13.88856 -25.36155 12.49017 0.339 8.83440 H ? A ? 111 HG12 1
   ATOM 2557 HG13 D VAL A 112 ? 13.73323 -24.58194 11.11482 0.339 8.83440 H ? A ? 111 HG13 1
   ATOM 2558 HG21 D VAL A 112 ? 11.04435 -23.44005 12.33344 0.339 8.69769 H ? A ? 111 HG21 1
   ATOM 2559 HG22 D VAL A 112 ? 11.23667 -23.63844 10.76910 0.339 8.69769 H ? A ? 111 HG22 1
   ATOM 2560 HG23 D VAL A 112 ? 10.08549 -24.42200 11.53352 0.339 8.69769 H ? A ? 111 HG23 1
   ATOM 2561 N . GLY A 113 ? 13.12343 -28.13167 11.75733 1.000 9.36349 N ? A ? 112 N 1
   ATOM 2562 CA . GLY A 113 ? 14.25810 -29.03709 11.86867 1.000 9.76604 C ? A ? 112 CA 1
   ATOM 2563 C . GLY A 113 ? 14.47867 -29.89106 10.63805 1.000 9.50773 C ? A ? 112 C 1
   ATOM 2564 O . GLY A 113 ? 15.62493 -30.08180 10.20665 1.000 10.58570 O ? A ? 112 O 1
   ATOM 2565 HA2 . GLY A 113 ? 15.06285 -28.51757 12.02155 1.000 11.69595 H ? A ? 112 HA2 1
   ATOM 2566 HA3 . GLY A 113 ? 14.11649 -29.62953 12.62356 1.000 11.69595 H ? A ? 112 HA3 1
   ATOM 2567 H B GLY A 113 ? 12.53247 -28.20974 12.37722 0.661 11.21289 H ? A ? 112 H 1
   ATOM 2568 H D GLY A 113 ? 12.52168 -28.23642 12.36275 0.339 11.21289 H ? A ? 112 H 1
   ATOM 2569 N . ALA A 114 ? 13.38670 -30.39024 10.03552 1.000 10.27864 N ? A ? 113 N 1
   ATOM 2570 CA . ALA A 114 ? 13.52065 -31.17362 8.81447 1.000 10.19237 C ? A ? 113 CA 1
   ATOM 2571 C . ALA A 114 ? 14.07731 -30.31712 7.67746 1.000 10.32142 C ? A ? 113 C 1
   ATOM 2572 O . ALA A 114 ? 14.84883 -30.82547 6.84396 1.000 10.87861 O ? A ? 113 O 1
   ATOM 2573 CB . ALA A 114 ? 12.18293 -31.77891 8.42095 1.000 10.95638 C ? A ? 113 CB 1
   ATOM 2574 H . ALA A 114 ? 12.57893 -30.28815 10.31246 1.000 12.31107 H ? A ? 113 H 1
   ATOM 2575 HA . ALA A 114 ? 14.13346 -31.90816 8.97512 1.000 12.20754 H ? A ? 113 HA 1
   ATOM 2576 HB1 . ALA A 114 ? 12.29918 -32.30414 7.61378 1.000 13.12436 H ? A ? 113 HB1 1
   ATOM 2577 HB2 . ALA A 114 ? 11.86854 -32.34615 9.14227 1.000 13.12436 H ? A ? 113 HB2 1
   ATOM 2578 HB3 . ALA A 114 ? 11.54735 -31.06371 8.26154 1.000 13.12436 H ? A ? 113 HB3 1
   ATOM 2579 N A SER A 115 ? 13.76985 -29.01966 7.66267 0.578 9.53305 N ? A ? 114 N 1
   ATOM 2580 CA A SER A 115 ? 14.21002 -28.13628 6.59327 0.578 9.48068 C ? A ? 114 CA 1
   ATOM 2581 C A SER A 115 ? 15.67293 -27.79412 6.75941 0.578 10.86582 C ? A ? 114 C 1
   ATOM 2582 O A SER A 115 ? 16.38965 -27.64566 5.74542 0.578 9.80320 O ? A ? 114 O 1
   ATOM 2583 CB A SER A 115 ? 13.32879 -26.89543 6.61306 0.578 11.05737 C ? A ? 114 CB 1
   ATOM 2584 OG A SER A 115 ? 13.47657 -26.12931 5.44138 0.578 11.63118 O ? A ? 114 OG 1
   ATOM 2585 H A SER A 115 ? 13.30283 -28.62466 8.26721 0.578 11.41636 H ? A ? 114 H 1
   ATOM 2586 HA A SER A 115 ? 14.11517 -28.56126 5.72649 0.578 11.35352 H ? A ? 114 HA 1
   ATOM 2587 HB2 A SER A 115 ? 12.40229 -27.17224 6.68974 0.578 13.24554 H ? A ? 114 HB2 1
   ATOM 2588 HB3 A SER A 115 ? 13.57615 -26.34952 7.37575 0.578 13.24554 H ? A ? 114 HB3 1
   ATOM 2589 HG A SER A 115 ? 14.26143 -25.83483 5.38776 0.578 13.93412 H ? A ? 114 HG 1
   ATOM 2590 N B SER A 115 ? 13.70647 -29.03395 7.62138 0.422 10.18446 N ? A ? 114 N 1
   ATOM 2591 CA B SER A 115 ? 14.27551 -28.16774 6.59575 0.422 9.71639 C ? A ? 114 CA 1
   ATOM 2592 C B SER A 115 ? 15.78560 -27.99345 6.79872 0.422 8.71386 C ? A ? 114 C 1
   ATOM 2593 O B SER A 115 ? 16.56994 -28.08410 5.84102 0.422 9.55899 O ? A ? 114 O 1
   ATOM 2594 CB B SER A 115 ? 13.57517 -26.80984 6.56701 0.422 11.03230 C ? A ? 114 CB 1
   ATOM 2595 OG B SER A 115 ? 12.23565 -26.91185 6.14817 0.422 14.46217 O ? A ? 114 OG 1
   ATOM 2596 H B SER A 115 ? 13.14429 -28.65498 8.15047 0.422 12.19805 H ? A ? 114 H 1
   ATOM 2597 HA B SER A 115 ? 14.12595 -28.58319 5.73207 0.422 11.63637 H ? A ? 114 HA 1
   ATOM 2598 HB2 B SER A 115 ? 13.59319 -26.43231 7.46035 0.422 13.21546 H ? A ? 114 HB2 1
   ATOM 2599 HB3 B SER A 115 ? 14.04941 -26.22895 5.95173 0.422 13.21546 H ? A ? 114 HB3 1
   ATOM 2600 HG B SER A 115 ? 11.80859 -27.41212 6.67061 0.422 17.33130 H ? A ? 114 HG 1
   ATOM 2601 N A CYS A 116 ? 16.12284 -27.69164 8.01955 0.578 8.38836 N ? A ? 115 N 1
   ATOM 2602 CA A CYS A 116 ? 17.54749 -27.55091 8.25550 0.578 10.41365 C ? A ? 115 CA 1
   ATOM 2603 C A CYS A 116 ? 18.29160 -28.74769 7.65211 0.578 9.01990 C ? A ? 115 C 1
   ATOM 2604 O A CYS A 116 ? 19.23847 -28.61285 6.84950 0.578 11.10122 O ? A ? 115 O 1
   ATOM 2605 CB A CYS A 116 ? 17.83232 -27.57605 9.75514 0.578 13.21971 C ? A ? 115 CB 1
   ATOM 2606 SG A CYS A 116 ? 17.06564 -26.39520 10.95430 0.578 8.11413 S ? A ? 115 SG 1
   ATOM 2607 H A CYS A 116 ? 15.63184 -27.70159 8.72554 0.578 10.04273 H ? A ? 115 H 1
   ATOM 2608 HA A CYS A 116 ? 17.83927 -26.71091 7.86800 0.578 12.47308 H ? A ? 115 HA 1
   ATOM 2609 HB2 A CYS A 116 ? 17.57654 -28.45792 10.06783 0.578 15.84035 H ? A ? 115 HB2 1
   ATOM 2610 HB3 A CYS A 116 ? 18.78944 -27.45358 9.85430 0.578 15.84035 H ? A ? 115 HB3 1
   ATOM 2611 N B CYS A 116 ? 16.22624 -27.74681 8.03749 0.422 8.10017 N ? A ? 115 N 1
   ATOM 2612 CA B CYS A 116 ? 17.66697 -27.58700 8.27852 0.422 11.11784 C ? A ? 115 CA 1
   ATOM 2613 C B CYS A 116 ? 18.39725 -28.82797 7.80294 0.422 9.02787 C ? A ? 115 C 1
   ATOM 2614 O B CYS A 116 ? 19.41339 -28.74915 7.10849 0.422 10.33298 O ? A ? 115 O 1
   ATOM 2615 CB B CYS A 116 ? 17.98683 -27.35849 9.75805 0.422 6.80585 C ? A ? 115 CB 1
   ATOM 2616 SG B CYS A 116 ? 16.90878 -26.15466 10.49066 0.422 11.51017 S ? A ? 115 SG 1
   ATOM 2617 H B CYS A 116 ? 15.72893 -27.66947 8.73484 0.422 9.69690 H ? A ? 115 H 1
   ATOM 2618 HA B CYS A 116 ? 17.96312 -26.79877 7.79696 0.422 13.31811 H ? A ? 115 HA 1
   ATOM 2619 HB2 B CYS A 116 ? 17.88158 -28.19388 10.23966 0.422 8.14372 H ? A ? 115 HB2 1
   ATOM 2620 HB3 B CYS A 116 ? 18.89931 -27.04015 9.84145 0.422 8.14372 H ? A ? 115 HB3 1
   ATOM 2621 N A LYS A 117 ? 17.86485 -29.95486 8.06937 0.578 10.71686 N ? A ? 116 N 1
   ATOM 2622 CA A LYS A 117 ? 18.55839 -31.18709 7.69482 0.578 11.54381 C ? A ? 116 CA 1
   ATOM 2623 C A LYS A 117 ? 18.48672 -31.41674 6.19050 0.578 12.97883 C ? A ? 116 C 1
   ATOM 2624 O A LYS A 117 ? 19.45293 -31.89556 5.58514 0.578 12.60279 O ? A ? 116 O 1
   ATOM 2625 CB A LYS A 117 ? 17.92964 -32.38177 8.42275 0.578 14.09825 C ? A ? 116 CB 1
   ATOM 2626 CG A LYS A 117 ? 18.67896 -33.70846 8.24657 0.578 14.23804 C ? A ? 116 CG 1
   ATOM 2627 CD A LYS A 117 ? 18.04009 -34.86181 9.03421 0.578 20.34190 C ? A ? 116 CD 1
   ATOM 2628 CE A LYS A 117 ? 18.80939 -36.17281 8.82550 0.578 25.21166 C ? A ? 116 CE 1
   ATOM 2629 NZ A LYS A 117 ? 18.92356 -36.52282 7.37507 0.578 28.39102 N ? A ? 116 NZ 1
   ATOM 2630 H A LYS A 117 ? 17.17662 -30.08143 8.56929 0.578 12.83693 H ? A ? 116 H 1
   ATOM 2631 HA A LYS A 117 ? 19.48875 -31.11279 7.95904 0.578 13.82927 H ? A ? 116 HA 1
   ATOM 2632 HB2 A LYS A 117 ? 17.90396 -32.18497 9.37223 0.578 16.89460 H ? A ? 116 HB2 1
   ATOM 2633 HB3 A LYS A 117 ? 17.02893 -32.50835 8.08570 0.578 16.89460 H ? A ? 116 HB3 1
   ATOM 2634 HG2 A LYS A 117 ? 18.67732 -33.95039 7.30723 0.578 17.06235 H ? A ? 116 HG2 1
   ATOM 2635 HG3 A LYS A 117 ? 19.59065 -33.60088 8.55986 0.578 17.06235 H ? A ? 116 HG3 1
   ATOM 2636 HD2 A LYS A 117 ? 18.04920 -34.64939 9.98062 0.578 24.38698 H ? A ? 116 HD2 1
   ATOM 2637 HD3 A LYS A 117 ? 17.12751 -34.99148 8.73207 0.578 24.38698 H ? A ? 116 HD3 1
   ATOM 2638 HE2 A LYS A 117 ? 19.70457 -36.07999 9.18735 0.578 30.23069 H ? A ? 116 HE2 1
   ATOM 2639 HE3 A LYS A 117 ? 18.34236 -36.89353 9.27644 0.578 30.23069 H ? A ? 116 HE3 1
   ATOM 2640 HZ1 A LYS A 117 ? 19.33326 -37.30748 7.28262 0.578 34.04593 H ? A ? 116 HZ1 1
   ATOM 2641 HZ2 A LYS A 117 ? 18.11362 -36.57508 7.00988 0.578 34.04593 H ? A ? 116 HZ2 1
   ATOM 2642 HZ3 A LYS A 117 ? 19.39347 -35.89949 6.94759 0.578 34.04593 H ? A ? 116 HZ3 1
   ATOM 2643 N B LYS A 117 ? 17.84016 -30.00016 8.10245 0.422 11.14387 N ? A ? 116 N 1
   ATOM 2644 CA B LYS A 117 ? 18.49295 -31.24807 7.71876 0.422 11.30909 C ? A ? 116 CA 1
   ATOM 2645 C B LYS A 117 ? 18.47132 -31.42695 6.20855 0.422 13.08035 C ? A ? 116 C 1
   ATOM 2646 O B LYS A 117 ? 19.45799 -31.88029 5.62016 0.422 12.79975 O ? A ? 116 O 1
   ATOM 2647 CB B LYS A 117 ? 17.79463 -32.42679 8.40332 0.422 13.15270 C ? A ? 116 CB 1
   ATOM 2648 CG B LYS A 117 ? 18.22787 -33.77852 7.90058 0.422 16.41733 C ? A ? 116 CG 1
   ATOM 2649 CD B LYS A 117 ? 17.34804 -34.85687 8.52008 0.422 24.17132 C ? A ? 116 CD 1
   ATOM 2650 CE B LYS A 117 ? 17.51193 -36.21127 7.85349 0.422 21.79806 C ? A ? 116 CE 1
   ATOM 2651 NZ B LYS A 117 ? 16.39544 -37.12009 8.24283 0.422 30.15976 N ? A ? 116 NZ 1
   ATOM 2652 H B LYS A 117 ? 17.09550 -30.09919 8.52111 0.422 13.34934 H ? A ? 116 H 1
   ATOM 2653 HA B LYS A 117 ? 19.41756 -31.22858 8.01137 0.422 13.54760 H ? A ? 116 HA 1
   ATOM 2654 HB2 B LYS A 117 ? 17.98621 -32.39116 9.35354 0.422 15.75994 H ? A ? 116 HB2 1
   ATOM 2655 HB3 B LYS A 117 ? 16.83921 -32.34997 8.25439 0.422 15.75994 H ? A ? 116 HB3 1
   ATOM 2656 HG2 B LYS A 117 ? 18.13621 -33.81548 6.93562 0.422 19.67750 H ? A ? 116 HG2 1
   ATOM 2657 HG3 B LYS A 117 ? 19.14989 -33.94328 8.15280 0.422 19.67750 H ? A ? 116 HG3 1
   ATOM 2658 HD2 B LYS A 117 ? 17.58108 -34.95487 9.45656 0.422 28.98229 H ? A ? 116 HD2 1
   ATOM 2659 HD3 B LYS A 117 ? 16.41848 -34.59296 8.43538 0.422 28.98229 H ? A ? 116 HD3 1
   ATOM 2660 HE2 B LYS A 117 ? 17.50142 -36.10297 6.88962 0.422 26.13437 H ? A ? 116 HE2 1
   ATOM 2661 HE3 B LYS A 117 ? 18.34968 -36.61235 8.13316 0.422 26.13437 H ? A ? 116 HE3 1
   ATOM 2662 HZ1 B LYS A 117 ? 16.48389 -37.90442 7.83162 0.422 36.16841 H ? A ? 116 HZ1 1
   ATOM 2663 HZ2 B LYS A 117 ? 16.40373 -37.25278 9.12284 0.422 36.16841 H ? A ? 116 HZ2 1
   ATOM 2664 HZ3 B LYS A 117 ? 15.61503 -36.75955 8.01243 0.422 36.16841 H ? A ? 116 HZ3 1
   ATOM 2665 N . ALA A 118 ? 17.35392 -31.08917 5.56279 1.000 11.98788 N ? A ? 117 N 1
   ATOM 2666 CA . ALA A 118 ? 17.24037 -31.27371 4.11349 1.000 13.64314 C ? A ? 117 CA 1
   ATOM 2667 C . ALA A 118 ? 18.28294 -30.45390 3.37532 1.000 11.70966 C ? A ? 117 C 1
   ATOM 2668 O . ALA A 118 ? 18.90036 -30.93667 2.41366 1.000 13.06727 O ? A ? 117 O 1
   ATOM 2669 CB . ALA A 118 ? 15.83272 -30.93664 3.62899 1.000 18.24495 C ? A ? 117 CB 1
   ATOM 2670 HA . ALA A 118 ? 17.39358 -32.20964 3.90985 1.000 16.34847 H ? A ? 117 HA 1
   ATOM 2671 HB1 . ALA A 118 ? 15.81419 -30.97678 2.66000 1.000 21.87064 H ? A ? 117 HB1 1
   ATOM 2672 HB2 . ALA A 118 ? 15.20879 -31.58077 3.99872 1.000 21.87064 H ? A ? 117 HB2 1
   ATOM 2673 HB3 . ALA A 118 ? 15.60148 -30.04317 3.92753 1.000 21.87064 H ? A ? 117 HB3 1
   ATOM 2674 H A ALA A 118 ? 16.65323 -30.76612 5.94263 0.578 14.36215 H ? A ? 117 H 1
   ATOM 2675 H B ALA A 118 ? 16.65409 -30.75487 5.93438 0.422 14.36215 H ? A ? 117 H 1
   ATOM 2676 N A CYS A 119 ? 18.50222 -29.19122 3.79398 0.150 10.26714 N ? A ? 118 N 1
   ATOM 2677 CA A CYS A 119 ? 19.52525 -28.39446 3.10692 0.150 9.55101 C ? A ? 118 CA 1
   ATOM 2678 C A CYS A 119 ? 20.93667 -28.89508 3.42379 0.150 9.99017 C ? A ? 118 C 1
   ATOM 2679 O A CYS A 119 ? 21.78858 -28.93268 2.52711 0.150 11.81882 O ? A ? 118 O 1
   ATOM 2680 CB A CYS A 119 ? 19.41869 -26.87662 3.36460 0.150 9.37358 C ? A ? 118 CB 1
   ATOM 2681 SG A CYS A 119 ? 20.51851 -25.81379 2.27773 0.150 3.82464 S ? A ? 118 SG 1
   ATOM 2682 H A CYS A 119 ? 18.09169 -28.79793 4.43926 0.150 12.29727 H ? A ? 118 H 1
   ATOM 2683 HA A CYS A 119 ? 19.35167 -28.49971 2.15840 0.150 11.43791 H ? A ? 118 HA 1
   ATOM 2684 HB2 A CYS A 119 ? 18.50157 -26.60186 3.20871 0.150 11.22500 H ? A ? 118 HB2 1
   ATOM 2685 HB3 A CYS A 119 ? 19.66480 -26.70321 4.28670 0.150 11.22500 H ? A ? 118 HB3 1
   ATOM 2686 N B CYS A 119 ? 18.51178 -29.23717 3.81631 0.850 9.84961 N ? A ? 118 N 1
   ATOM 2687 CA B CYS A 119 ? 19.51411 -28.41742 3.16724 0.850 9.32476 C ? A ? 118 CA 1
   ATOM 2688 C B CYS A 119 ? 20.90311 -28.95851 3.42829 0.850 9.58293 C ? A ? 118 C 1
   ATOM 2689 O B CYS A 119 ? 21.71899 -29.06338 2.50180 0.850 9.98638 O ? A ? 118 O 1
   ATOM 2690 CB B CYS A 119 ? 19.39714 -26.98083 3.62676 0.850 9.70911 C ? A ? 118 CB 1
   ATOM 2691 SG B CYS A 119 ? 20.58284 -26.05202 2.68412 0.850 9.70877 S ? A ? 118 SG 1
   ATOM 2692 H B CYS A 119 ? 18.10878 -28.86521 4.47875 0.850 11.79623 H ? A ? 118 H 1
   ATOM 2693 HA B CYS A 119 ? 19.35924 -28.43137 2.20978 0.850 11.16641 H ? A ? 118 HA 1
   ATOM 2694 HB2 B CYS A 119 ? 18.50503 -26.64104 3.45479 0.850 11.62763 H ? A ? 118 HB2 1
   ATOM 2695 HB3 B CYS A 119 ? 19.60304 -26.90898 4.57193 0.850 11.62763 H ? A ? 118 HB3 1
   ATOM 2696 N . HIS A 120 ? 21.21435 -29.29905 4.66895 1.000 9.77158 N ? A ? 119 N 1
   ATOM 2697 CA . HIS A 120 ? 22.54962 -29.79837 4.98120 1.000 9.53399 C ? A ? 119 CA 1
   ATOM 2698 C . HIS A 120 ? 22.82867 -31.05524 4.17876 1.000 8.77255 C ? A ? 119 C 1
   ATOM 2699 O . HIS A 120 ? 23.95712 -31.25510 3.69085 1.000 10.98717 O ? A ? 119 O 1
   ATOM 2700 CB . HIS A 120 ? 22.68474 -30.09397 6.46901 1.000 9.86086 C ? A ? 119 CB 1
   ATOM 2701 CG . HIS A 120 ? 22.61787 -28.87120 7.32863 1.000 9.30253 C ? A ? 119 CG 1
   ATOM 2702 ND1 . HIS A 120 ? 22.24345 -28.89334 8.64734 1.000 9.88809 N ? A ? 119 ND1 1
   ATOM 2703 CD2 . HIS A 120 ? 22.89252 -27.58187 7.03783 1.000 7.91546 C ? A ? 119 CD2 1
   ATOM 2704 CE1 . HIS A 120 ? 22.27090 -27.66255 9.13126 1.000 8.66040 C ? A ? 119 CE1 1
   ATOM 2705 NE2 . HIS A 120 ? 22.69570 -26.85109 8.17993 1.000 8.46140 N ? A ? 119 NE2 1
   ATOM 2706 HA . HIS A 120 ? 23.20161 -29.11529 4.75936 1.000 11.41749 H ? A ? 119 HA 1
   ATOM 2707 HB2 . HIS A 120 ? 21.96427 -30.68549 6.73718 1.000 11.80973 H ? A ? 119 HB2 1
   ATOM 2708 HB3 . HIS A 120 ? 23.54106 -30.52150 6.62656 1.000 11.80973 H ? A ? 119 HB3 1
   ATOM 2709 HD1 . HIS A 120 ? 22.02495 -29.59722 9.09053 1.000 11.84241 H ? A ? 119 HD1 1
   ATOM 2710 HD2 . HIS A 120 ? 23.16547 -27.25025 6.21295 1.000 9.47525 H ? A ? 119 HD2 1
   ATOM 2711 HE1 . HIS A 120 ? 22.03182 -27.41151 9.99423 1.000 10.36918 H ? A ? 119 HE1 1
   ATOM 2712 H A HIS A 120 ? 20.66234 -29.29315 5.32839 0.150 11.70260 H ? A ? 119 H 1
   ATOM 2713 H B HIS A 120 ? 20.68105 -29.25275 5.34204 0.850 11.70260 H ? A ? 119 H 1
   ATOM 2714 N A ASP A 121 ? 21.83907 -31.94504 4.06605 0.697 10.78232 N ? A ? 120 N 1
   ATOM 2715 CA A ASP A 121 ? 22.05896 -33.17130 3.30546 0.697 11.01235 C ? A ? 120 CA 1
   ATOM 2716 C A ASP A 121 ? 22.48775 -32.86044 1.87531 0.697 11.22098 C ? A ? 120 C 1
   ATOM 2717 O A ASP A 121 ? 23.34165 -33.57186 1.30637 0.697 14.03715 O ? A ? 120 O 1
   ATOM 2718 CB A ASP A 121 ? 20.77517 -34.00134 3.31321 0.697 12.97963 C ? A ? 120 CB 1
   ATOM 2719 CG A ASP A 121 ? 20.48628 -34.67587 4.63617 0.697 15.00777 C ? A ? 120 CG 1
   ATOM 2720 OD1 A ASP A 121 ? 21.34093 -34.65396 5.54970 0.697 15.75441 O ? A ? 120 OD1 1
   ATOM 2721 OD2 A ASP A 121 ? 19.35659 -35.27736 4.73709 0.697 16.51261 O ? A ? 120 OD2 1
   ATOM 2722 H A ASP A 121 ? 21.05537 -31.86337 4.41063 0.697 12.91549 H ? A ? 120 H 1
   ATOM 2723 HA A ASP A 121 ? 22.76522 -33.69038 3.72098 0.697 13.19153 H ? A ? 120 HA 1
   ATOM 2724 HB2 A ASP A 121 ? 20.02667 -33.41885 3.10986 0.697 15.55225 H ? A ? 120 HB2 1
   ATOM 2725 HB3 A ASP A 121 ? 20.84873 -34.69470 2.63887 0.697 15.55225 H ? A ? 120 HB3 1
   ATOM 2726 N B ASP A 121 ? 21.82256 -31.93742 4.04196 0.303 10.94102 N ? A ? 120 N 1
   ATOM 2727 CA B ASP A 121 ? 22.04714 -33.19192 3.32446 0.303 11.23589 C ? A ? 120 CA 1
   ATOM 2728 C B ASP A 121 ? 22.35401 -32.95558 1.84543 0.303 13.95028 C ? A ? 120 C 1
   ATOM 2729 O B ASP A 121 ? 23.04492 -33.77880 1.23046 0.303 16.25474 O ? A ? 120 O 1
   ATOM 2730 CB B ASP A 121 ? 20.86440 -34.14521 3.53268 0.303 13.43942 C ? A ? 120 CB 1
   ATOM 2731 CG B ASP A 121 ? 20.79863 -34.74035 4.96740 0.303 6.63634 C ? A ? 120 CG 1
   ATOM 2732 OD1 B ASP A 121 ? 21.82723 -34.80317 5.68032 0.303 21.50604 O ? A ? 120 OD1 1
   ATOM 2733 OD2 B ASP A 121 ? 19.68428 -35.16010 5.36800 0.303 18.33361 O ? A ? 120 OD2 1
   ATOM 2734 H B ASP A 121 ? 21.02587 -31.83177 4.34811 0.303 13.10593 H ? A ? 120 H 1
   ATOM 2735 HA B ASP A 121 ? 22.82427 -33.63709 3.69700 0.303 13.45976 H ? A ? 120 HA 1
   ATOM 2736 HB2 B ASP A 121 ? 20.03913 -33.66103 3.37331 0.303 16.10401 H ? A ? 120 HB2 1
   ATOM 2737 HB3 B ASP A 121 ? 20.94213 -34.88304 2.90779 0.303 16.10401 H ? A ? 120 HB3 1
   ATOM 2738 N . ALA A 122 ? 21.89045 -31.84689 1.26209 1.000 12.08991 N ? A ? 121 N 1
   ATOM 2739 CA . ALA A 122 ? 22.15623 -31.54943 -0.13457 1.000 11.79055 C ? A ? 121 CA 1
   ATOM 2740 C . ALA A 122 ? 23.39548 -30.67679 -0.31522 1.000 11.50920 C ? A ? 121 C 1
   ATOM 2741 O . ALA A 122 ? 24.11718 -30.81434 -1.30643 1.000 14.63286 O ? A ? 121 O 1
   ATOM 2742 CB . ALA A 122 ? 20.97119 -30.87552 -0.78919 1.000 13.32917 C ? A ? 121 CB 1
   ATOM 2743 HA . ALA A 122 ? 22.30306 -32.39335 -0.58969 1.000 14.12536 H ? A ? 121 HA 1
   ATOM 2744 HB1 . ALA A 122 ? 21.19039 -30.67922 -1.71348 1.000 15.97170 H ? A ? 121 HB1 1
   ATOM 2745 HB2 . ALA A 122 ? 20.20727 -31.47201 -0.74990 1.000 15.97170 H ? A ? 121 HB2 1
   ATOM 2746 HB3 . ALA A 122 ? 20.77350 -30.05316 -0.31427 1.000 15.97170 H ? A ? 121 HB3 1
   ATOM 2747 H A ALA A 122 ? 21.32583 -31.31538 1.63398 0.697 14.48459 H ? A ? 121 H 1
   ATOM 2748 H B ALA A 122 ? 21.41676 -31.25086 1.66206 0.303 14.48459 H ? A ? 121 H 1
   ATOM 2749 N . TYR A 123 ? 23.65183 -29.75283 0.61038 1.000 11.31943 N ? A ? 122 N 1
   ATOM 2750 CA . TYR A 123 ? 24.53954 -28.62388 0.35006 1.000 11.15399 C ? A ? 122 CA 1
   ATOM 2751 C . TYR A 123 ? 25.65636 -28.42562 1.35680 1.000 10.34786 C ? A ? 122 C 1
   ATOM 2752 O . TYR A 123 ? 26.44278 -27.48574 1.17372 1.000 11.13463 O ? A ? 122 O 1
   ATOM 2753 H . TYR A 123 ? 23.32001 -29.75892 1.40377 1.000 13.56002 H ? A ? 122 H 1
   ATOM 2754 HA . TYR A 123 ? 24.98754 -28.78586 -0.49490 1.000 13.36149 H ? A ? 122 HA 1
   ATOM 2755 CB A TYR A 123 ? 23.71001 -27.33695 0.22174 0.746 11.10527 C ? A ? 122 CB 1
   ATOM 2756 CG A TYR A 123 ? 22.82733 -27.34436 -0.99804 0.746 12.55579 C ? A ? 122 CG 1
   ATOM 2757 CD1 A TYR A 123 ? 21.44005 -27.31232 -0.88641 0.746 14.19113 C ? A ? 122 CD1 1
   ATOM 2758 CD2 A TYR A 123 ? 23.38614 -27.36575 -2.26774 0.746 15.36079 C ? A ? 122 CD2 1
   ATOM 2759 CE1 A TYR A 123 ? 20.63432 -27.29853 -2.02814 0.746 17.97630 C ? A ? 122 CE1 1
   ATOM 2760 CE2 A TYR A 123 ? 22.59670 -27.36354 -3.40550 0.746 14.45898 C ? A ? 122 CE2 1
   ATOM 2761 CZ A TYR A 123 ? 21.22120 -27.32580 -3.27368 0.746 14.98157 C ? A ? 122 CZ 1
   ATOM 2762 OH A TYR A 123 ? 20.42026 -27.30145 -4.40686 0.746 19.46831 O ? A ? 122 OH 1
   ATOM 2763 HB2 A TYR A 123 ? 23.14371 -27.24512 1.00390 0.746 13.30302 H ? A ? 122 HB2 1
   ATOM 2764 HB3 A TYR A 123 ? 24.31020 -26.57779 0.15573 0.746 13.30302 H ? A ? 122 HB3 1
   ATOM 2765 HD1 A TYR A 123 ? 21.04582 -27.29997 -0.04419 0.746 17.00606 H ? A ? 122 HD1 1
   ATOM 2766 HD2 A TYR A 123 ? 24.31173 -27.38194 -2.35677 0.746 18.40964 H ? A ? 122 HD2 1
   ATOM 2767 HE1 A TYR A 123 ? 19.70824 -27.27113 -1.94738 0.746 21.54826 H ? A ? 122 HE1 1
   ATOM 2768 HE2 A TYR A 123 ? 22.98766 -27.38719 -4.24901 0.746 17.32748 H ? A ? 122 HE2 1
   ATOM 2769 HH A TYR A 123 ? 19.62031 -27.16427 -4.19037 0.746 23.33867 H ? A ? 122 HH 1
   ATOM 2770 CB B TYR A 123 ? 23.72458 -27.31803 0.22963 0.254 11.18325 C ? A ? 122 CB 1
   ATOM 2771 CG B TYR A 123 ? 22.82761 -27.21862 -0.99711 0.254 11.55722 C ? A ? 122 CG 1
   ATOM 2772 CD1 B TYR A 123 ? 23.37195 -27.18364 -2.27353 0.254 15.28598 C ? A ? 122 CD1 1
   ATOM 2773 CD2 B TYR A 123 ? 21.44599 -27.13990 -0.87307 0.254 13.59959 C ? A ? 122 CD2 1
   ATOM 2774 CE1 B TYR A 123 ? 22.56454 -27.07794 -3.40531 0.254 14.81549 C ? A ? 122 CE1 1
   ATOM 2775 CE2 B TYR A 123 ? 20.62540 -27.04314 -1.99712 0.254 11.89229 C ? A ? 122 CE2 1
   ATOM 2776 CZ B TYR A 123 ? 21.19056 -27.00923 -3.25521 0.254 11.78396 C ? A ? 122 CZ 1
   ATOM 2777 OH B TYR A 123 ? 20.38026 -26.91261 -4.37244 0.254 12.32997 O ? A ? 122 OH 1
   ATOM 2778 HB2 B TYR A 123 ? 23.15522 -27.24012 1.01108 0.254 13.39660 H ? A ? 122 HB2 1
   ATOM 2779 HB3 B TYR A 123 ? 24.34475 -26.57298 0.19538 0.254 13.39660 H ? A ? 122 HB3 1
   ATOM 2780 HD1 B TYR A 123 ? 24.29504 -27.23175 -2.37600 0.254 18.31987 H ? A ? 122 HD1 1
   ATOM 2781 HD2 B TYR A 123 ? 21.06169 -27.15192 -0.02628 0.254 16.29620 H ? A ? 122 HD2 1
   ATOM 2782 HE1 B TYR A 123 ? 22.94581 -27.05384 -4.25322 0.254 17.75528 H ? A ? 122 HE1 1
   ATOM 2783 HE2 B TYR A 123 ? 19.70154 -27.00168 -1.89881 0.254 14.24745 H ? A ? 122 HE2 1
   ATOM 2784 HH B TYR A 123 ? 19.57329 -26.97817 -4.14862 0.254 14.77267 H ? A ? 122 HH 1
   ATOM 2785 N . ARG A 124 ? 25.77223 -29.23838 2.38780 1.000 10.74783 N ? A ? 123 N 1
   ATOM 2786 CA . ARG A 124 ? 26.84030 -29.09140 3.36230 1.000 11.65824 C ? A ? 123 CA 1
   ATOM 2787 C . ARG A 124 ? 27.75648 -30.31420 3.27235 1.000 12.19000 C ? A ? 123 C 1
   ATOM 2788 O . ARG A 124 ? 27.29320 -31.46683 3.26919 1.000 12.68653 O ? A ? 123 O 1
   ATOM 2789 CB . ARG A 124 ? 26.30115 -28.91643 4.79055 1.000 11.26331 C ? A ? 123 CB 1
   ATOM 2790 CG . ARG A 124 ? 27.40168 -28.61743 5.79035 1.000 11.77024 C ? A ? 123 CG 1
   ATOM 2791 CD . ARG A 124 ? 26.79942 -28.30684 7.15550 1.000 11.46804 C ? A ? 123 CD 1
   ATOM 2792 NE . ARG A 124 ? 26.25988 -29.51126 7.77454 1.000 11.68415 N ? A ? 123 NE 1
   ATOM 2793 CZ . ARG A 124 ? 25.67072 -29.52968 8.95448 1.000 11.75155 C ? A ? 123 CZ 1
   ATOM 2794 NH1 . ARG A 124 ? 25.47796 -28.42544 9.64538 1.000 11.97717 N ? A ? 123 NH1 1
   ATOM 2795 NH2 . ARG A 124 ? 25.28405 -30.69772 9.46445 1.000 14.40709 N ? A ? 123 NH2 1
   ATOM 2796 H . ARG A 124 ? 25.23792 -29.89274 2.54879 1.000 12.87410 H ? A ? 123 H 1
   ATOM 2797 HA . ARG A 124 ? 27.35674 -28.29619 3.15776 1.000 13.96659 H ? A ? 123 HA 1
   ATOM 2798 HB2 . ARG A 124 ? 25.67221 -28.17809 4.80390 1.000 13.49267 H ? A ? 123 HB2 1
   ATOM 2799 HB3 . ARG A 124 ? 25.85812 -29.73462 5.06476 1.000 13.49267 H ? A ? 123 HB3 1
   ATOM 2800 HG2 . ARG A 124 ? 27.98368 -29.38872 5.87575 1.000 14.10099 H ? A ? 123 HG2 1
   ATOM 2801 HG3 . ARG A 124 ? 27.91218 -27.84785 5.49364 1.000 14.10099 H ? A ? 123 HG3 1
   ATOM 2802 HD2 . ARG A 124 ? 27.48617 -27.94403 7.73656 1.000 13.73834 H ? A ? 123 HD2 1
   ATOM 2803 HD3 . ARG A 124 ? 26.07915 -27.66536 7.05242 1.000 13.73834 H ? A ? 123 HD3 1
   ATOM 2804 HE . ARG A 124 ? 26.32981 -30.25319 7.34531 1.000 13.99768 H ? A ? 123 HE 1
   ATOM 2805 HH11 . ARG A 124 ? 25.73843 -27.66932 9.32909 1.000 14.34930 H ? A ? 123 HH11 1
   ATOM 2806 HH12 . ARG A 124 ? 25.09159 -28.46036 10.41291 1.000 14.34930 H ? A ? 123 HH12 1
   ATOM 2807 HH21 . ARG A 124 ? 25.41975 -31.42465 9.02541 1.000 17.26521 H ? A ? 123 HH21 1
   ATOM 2808 HH22 . ARG A 124 ? 24.89867 -30.72501 10.23279 1.000 17.26521 H ? A ? 123 HH22 1
   ATOM 2809 N . LYS A 125 ? 29.06266 -30.07173 3.18521 1.000 12.02578 N ? A ? 124 N 1
   ATOM 2810 CA . LYS A 125 ? 30.01595 -31.16287 3.08472 1.000 13.87500 C ? A ? 124 CA 1
   ATOM 2811 C . LYS A 125 ? 29.99929 -31.97366 4.37689 1.000 14.44876 C ? A ? 124 C 1
   ATOM 2812 O . LYS A 125 ? 29.75018 -31.45974 5.47404 1.000 16.76601 O ? A ? 124 O 1
   ATOM 2813 CB . LYS A 125 ? 31.42208 -30.61303 2.86607 1.000 14.80072 C ? A ? 124 CB 1
   ATOM 2814 CG . LYS A 125 ? 31.58703 -29.76166 1.62972 1.000 12.71453 C ? A ? 124 CG 1
   ATOM 2815 CD . LYS A 125 ? 33.05733 -29.52213 1.35449 1.000 14.51698 C ? A ? 124 CD 1
   ATOM 2816 CE . LYS A 125 ? 33.22479 -28.86488 0.00317 1.000 18.24092 C ? A ? 124 CE 1
   ATOM 2817 NZ . LYS A 125 ? 34.63750 -28.69134 -0.34421 1.000 13.56732 N ? A ? 124 NZ 1
   ATOM 2818 H . LYS A 125 ? 29.41657 -29.28793 3.18248 1.000 14.40764 H ? A ? 124 H 1
   ATOM 2819 HA . LYS A 125 ? 29.78610 -31.73575 2.33647 1.000 16.62671 H ? A ? 124 HA 1
   ATOM 2820 HB2 . LYS A 125 ? 31.66028 -30.06555 3.63055 1.000 17.73757 H ? A ? 124 HB2 1
   ATOM 2821 HB3 . LYS A 125 ? 32.03572 -31.36029 2.78906 1.000 17.73757 H ? A ? 124 HB3 1
   ATOM 2822 HG2 . LYS A 125 ? 31.19800 -30.21598 0.86608 1.000 15.23414 H ? A ? 124 HG2 1
   ATOM 2823 HG3 . LYS A 125 ? 31.15228 -28.90483 1.76286 1.000 15.23414 H ? A ? 124 HG3 1
   ATOM 2824 HD2 . LYS A 125 ? 33.42693 -28.93690 2.03404 1.000 17.39708 H ? A ? 124 HD2 1
   ATOM 2825 HD3 . LYS A 125 ? 33.53220 -30.36793 1.35106 1.000 17.39708 H ? A ? 124 HD3 1
   ATOM 2826 HE2 . LYS A 125 ? 32.81049 -29.41952 -0.67626 1.000 21.86581 H ? A ? 124 HE2 1
   ATOM 2827 HE3 . LYS A 125 ? 32.80571 -27.99021 0.01833 1.000 21.86581 H ? A ? 124 HE3 1
   ATOM 2828 HZ1 . LYS A 125 ? 34.70943 -28.27345 -1.12671 1.000 16.25749 H ? A ? 124 HZ1 1
   ATOM 2829 HZ2 . LYS A 125 ? 35.04734 -28.20755 0.28035 1.000 16.25749 H ? A ? 124 HZ2 1
   ATOM 2830 HZ3 . LYS A 125 ? 35.03625 -29.48485 -0.40281 1.000 16.25749 H ? A ? 124 HZ3 1
   ATOM 2831 N . LYS A 126 ? 30.26531 -33.27401 4.24229 1.000 22.25198 N ? A ? 125 N 1
   ATOM 2832 CA . LYS A 126 ? 30.23776 -34.15940 5.42220 1.000 38.62863 C ? A ? 125 CA 1
   ATOM 2833 C . LYS A 126 ? 31.42532 -33.86977 6.31612 1.000 34.32618 C ? A ? 125 C 1
   ATOM 2834 O . LYS A 126 ? 32.35522 -33.14868 5.95641 1.000 43.13358 O ? A ? 125 O 1
   ATOM 2835 H . LYS A 126 ? 30.46003 -33.66299 3.50042 1.000 26.67907 H ? A ? 125 H 1
   ATOM 2836 HA . LYS A 126 ? 29.40982 -34.00618 5.90380 1.000 46.33106 H ? A ? 125 HA 1
   ATOM 2837 CB A LYS A 126 ? 30.23800 -35.63892 5.03583 0.215 38.57360 C ? A ? 125 CB 1
   ATOM 2838 CG A LYS A 126 ? 28.85774 -36.22687 4.83784 0.215 37.50672 C ? A ? 125 CG 1
   ATOM 2839 CD A LYS A 126 ? 28.18020 -35.60736 3.62987 0.215 30.77109 C ? A ? 125 CD 1
   ATOM 2840 CE A LYS A 126 ? 26.86409 -36.29434 3.31910 0.215 30.54840 C ? A ? 125 CE 1
   ATOM 2841 NZ A LYS A 126 ? 26.26472 -35.78988 2.05174 0.215 29.60907 N ? A ? 125 NZ 1
   ATOM 2842 HB2 A LYS A 126 ? 30.72434 -35.74208 4.20293 0.215 46.26502 H ? A ? 125 HB2 1
   ATOM 2843 HB3 A LYS A 126 ? 30.67486 -36.14343 5.73977 0.215 46.26502 H ? A ? 125 HB3 1
   ATOM 2844 HG2 A LYS A 126 ? 28.93006 -37.18342 4.69405 0.215 44.98477 H ? A ? 125 HG2 1
   ATOM 2845 HG3 A LYS A 126 ? 28.31397 -36.04931 5.62123 0.215 44.98477 H ? A ? 125 HG3 1
   ATOM 2846 HD2 A LYS A 126 ? 28.00102 -34.67064 3.80695 0.215 36.90201 H ? A ? 125 HD2 1
   ATOM 2847 HD3 A LYS A 126 ? 28.75953 -35.69394 2.85671 0.215 36.90201 H ? A ? 125 HD3 1
   ATOM 2848 HE2 A LYS A 126 ? 27.01477 -37.24801 3.22579 0.215 36.63477 H ? A ? 125 HE2 1
   ATOM 2849 HE3 A LYS A 126 ? 26.23712 -36.12649 4.03996 0.215 36.63477 H ? A ? 125 HE3 1
   ATOM 2850 HZ1 A LYS A 126 ? 25.52695 -36.24925 1.85995 0.215 35.50759 H ? A ? 125 HZ1 1
   ATOM 2851 HZ2 A LYS A 126 ? 26.05530 -34.92895 2.13561 0.215 35.50759 H ? A ? 125 HZ2 1
   ATOM 2852 HZ3 A LYS A 126 ? 26.84455 -35.88227 1.38289 0.215 35.50759 H ? A ? 125 HZ3 1
   ATOM 2853 CB B LYS A 126 ? 30.23395 -35.63804 5.02438 0.388 38.84843 C ? A ? 125 CB 1
   ATOM 2854 CG B LYS A 126 ? 28.89807 -36.14881 4.52543 0.388 39.49056 C ? A ? 125 CG 1
   ATOM 2855 CD B LYS A 126 ? 28.02187 -36.67087 5.66066 0.388 38.22611 C ? A ? 125 CD 1
   ATOM 2856 CE B LYS A 126 ? 28.59323 -37.93809 6.28421 0.388 38.88196 C ? A ? 125 CE 1
   ATOM 2857 NZ B LYS A 126 ? 27.70723 -38.50231 7.35230 0.388 34.26767 N ? A ? 125 NZ 1
   ATOM 2858 HB2 B LYS A 126 ? 30.88177 -35.76892 4.31437 0.388 46.59481 H ? A ? 125 HB2 1
   ATOM 2859 HB3 B LYS A 126 ? 30.47951 -36.16737 5.79924 0.388 46.59481 H ? A ? 125 HB3 1
   ATOM 2860 HG2 B LYS A 126 ? 28.42408 -35.42556 4.08594 0.388 47.36538 H ? A ? 125 HG2 1
   ATOM 2861 HG3 B LYS A 126 ? 29.04769 -36.87543 3.90050 0.388 47.36538 H ? A ? 125 HG3 1
   ATOM 2862 HD2 B LYS A 126 ? 27.95900 -35.99432 6.35293 0.388 45.84804 H ? A ? 125 HD2 1
   ATOM 2863 HD3 B LYS A 126 ? 27.13882 -36.87486 5.31496 0.388 45.84804 H ? A ? 125 HD3 1
   ATOM 2864 HE2 B LYS A 126 ? 28.69846 -38.61154 5.59407 0.388 46.63505 H ? A ? 125 HE2 1
   ATOM 2865 HE3 B LYS A 126 ? 29.45359 -37.73500 6.68350 0.388 46.63505 H ? A ? 125 HE3 1
   ATOM 2866 HZ1 B LYS A 126 ? 28.08037 -39.22944 7.70466 0.388 41.09791 H ? A ? 125 HZ1 1
   ATOM 2867 HZ2 B LYS A 126 ? 27.58466 -37.89984 7.99581 0.388 41.09791 H ? A ? 125 HZ2 1
   ATOM 2868 HZ3 B LYS A 126 ? 26.91657 -38.72160 7.00753 0.388 41.09791 H ? A ? 125 HZ3 1
   ATOM 2869 CB C LYS A 126 ? 30.29606 -35.62677 5.01212 0.397 38.86555 C ? A ? 125 CB 1
   ATOM 2870 CG C LYS A 126 ? 31.66566 -36.04371 4.49946 0.397 39.47477 C ? A ? 125 CG 1
   ATOM 2871 CD C LYS A 126 ? 31.82502 -37.55293 4.39743 0.397 40.73193 C ? A ? 125 CD 1
   ATOM 2872 CE C LYS A 126 ? 30.79844 -38.12195 3.44801 0.397 31.26932 C ? A ? 125 CE 1
   ATOM 2873 NZ C LYS A 126 ? 30.88792 -39.59410 3.24057 0.397 33.06279 N ? A ? 125 NZ 1
   ATOM 2874 HB2 C LYS A 126 ? 30.08349 -36.17773 5.78165 0.397 46.61536 H ? A ? 125 HB2 1
   ATOM 2875 HB3 C LYS A 126 ? 29.65101 -35.78211 4.30453 0.397 46.61536 H ? A ? 125 HB3 1
   ATOM 2876 HG2 C LYS A 126 ? 31.79967 -35.66848 3.61507 0.397 47.34642 H ? A ? 125 HG2 1
   ATOM 2877 HG3 C LYS A 126 ? 32.34499 -35.71177 5.10710 0.397 47.34642 H ? A ? 125 HG3 1
   ATOM 2878 HD2 C LYS A 126 ? 32.70987 -37.76569 4.06174 0.397 48.85502 H ? A ? 125 HD2 1
   ATOM 2879 HD3 C LYS A 126 ? 31.69618 -37.95448 5.27096 0.397 48.85502 H ? A ? 125 HD3 1
   ATOM 2880 HE2 C LYS A 126 ? 29.91450 -37.93067 3.79866 0.397 37.49988 H ? A ? 125 HE2 1
   ATOM 2881 HE3 C LYS A 126 ? 30.91073 -37.69874 2.58246 0.397 37.49988 H ? A ? 125 HE3 1
   ATOM 2882 HZ1 C LYS A 126 ? 30.25662 -39.86040 2.67256 0.397 39.65205 H ? A ? 125 HZ1 1
   ATOM 2883 HZ2 C LYS A 126 ? 31.68511 -39.80657 2.90673 0.397 39.65205 H ? A ? 125 HZ2 1
   ATOM 2884 HZ3 C LYS A 126 ? 30.77691 -40.01797 4.01524 0.397 39.65205 H ? A ? 125 HZ3 1
   HETATM 2885 N . PCA A 1 ? 29.70416 -7.25372 2.01515 1.000 10.30971 N ? A ? 126 N 1
   HETATM 2886 CA . PCA A 1 ? 30.24519 -6.67849 3.24986 1.000 9.93406 C ? A ? 126 CA 1
   HETATM 2887 C . PCA A 1 ? 31.53417 -7.35710 3.68137 1.000 10.26664 C ? A ? 126 C 1
   HETATM 2888 O . PCA A 1 ? 32.00815 -7.15721 4.76767 1.000 12.75341 O ? A ? 126 O 1
   HETATM 2889 CB . PCA A 1 ? 29.20322 -6.87167 4.34994 1.000 11.74544 C ? A ? 126 CB 1
   HETATM 2890 CG . PCA A 1 ? 28.36502 -8.00425 3.76963 1.000 10.08594 C ? A ? 126 CG 1
   HETATM 2891 CD . PCA A 1 ? 28.65720 -8.04852 2.28905 1.000 10.09433 C ? A ? 126 CD 1
   HETATM 2892 OE . PCA A 1 ? 28.02731 -8.72759 1.48498 1.000 11.16816 O ? A ? 126 OE 1
   HETATM 2893 H2 . PCA A 1 ? 28.94593 -6.84965 1.82690 1.000 12.34835 H ? A ? 126 H2 1
   HETATM 2894 HA . PCA A 1 ? 30.44299 -5.73916 3.11048 1.000 11.89757 H ? A ? 126 HA 1
   HETATM 2895 HB2 . PCA A 1 ? 29.61993 -7.10947 5.19297 1.000 14.07122 H ? A ? 126 HB2 1
   HETATM 2896 HB3 . PCA A 1 ? 28.68851 -6.06233 4.49463 1.000 14.07122 H ? A ? 126 HB3 1
   HETATM 2897 HG2 . PCA A 1 ? 28.58229 -8.86905 4.15149 1.000 12.07983 H ? A ? 126 HG2 1
   HETATM 2898 HG3 . PCA A 1 ? 27.41210 -7.86938 3.89067 1.000 12.07983 H ? A ? 126 HG3 1
   HETATM 2899 NB . HEC A 128 ? 21.46026 -24.81049 9.72506 1.000 8.06744 N ? B ? . NB 1
   HETATM 2900 ND . HEC A 128 ? 24.36735 -24.81023 6.96160 1.000 8.02749 N ? B ? . ND 1
   HETATM 2901 C1A . HEC A 128 ? 25.65431 -25.13482 9.61091 1.000 8.71480 C ? B ? . C1A 1
   HETATM 2902 C1B . HEC A 128 ? 21.59577 -25.05770 11.06648 1.000 8.86820 C ? B ? . C1B 1
   HETATM 2903 C1C . HEC A 128 ? 20.19524 -24.48663 7.07325 1.000 6.96046 C ? B ? . C1C 1
   HETATM 2904 C1D . HEC A 128 ? 24.23766 -24.72772 5.58745 1.000 7.80592 C ? B ? . C1D 1
   HETATM 2905 C2A . HEC A 128 ? 26.28333 -25.34585 10.90108 1.000 8.14653 C ? B ? . C2A 1
   HETATM 2906 C2B . HEC A 128 ? 20.30932 -25.05094 11.70516 1.000 8.61533 C ? B ? . C2B 1
   HETATM 2907 C2C . HEC A 128 ? 19.53365 -24.36394 5.76776 1.000 7.91424 C ? B ? . C2C 1
   HETATM 2908 C2D . HEC A 128 ? 25.46587 -24.75640 4.88813 1.000 8.42632 C ? B ? . C2D 1
   HETATM 2909 C3A . HEC A 128 ? 25.28196 -25.45980 11.81557 1.000 8.56390 C ? B ? . C3A 1
   HETATM 2910 C3B . HEC A 128 ? 19.37217 -24.81554 10.76102 1.000 8.74998 C ? B ? . C3B 1
   HETATM 2911 C3C . HEC A 128 ? 20.50168 -24.43089 4.83280 1.000 8.21700 C ? B ? . C3C 1
   HETATM 2912 C3D . HEC A 128 ? 26.45271 -24.78540 5.95601 1.000 8.65517 C ? B ? . C3D 1
   HETATM 2913 C4A . HEC A 128 ? 24.04594 -25.27601 11.10660 1.000 8.18883 C ? B ? . C4A 1
   HETATM 2914 C4B . HEC A 128 ? 20.08418 -24.66671 9.50218 1.000 7.89715 C ? B ? . C4B 1
   HETATM 2915 C4C . HEC A 128 ? 21.76738 -24.55624 5.53304 1.000 8.02833 C ? B ? . C4C 1
   HETATM 2916 C4D . HEC A 128 ? 25.74886 -24.86093 7.20363 1.000 7.76506 C ? B ? . C4D 1
   HETATM 2917 CAA . HEC A 128 ? 27.77365 -25.45881 11.17218 1.000 9.72292 C ? B ? . CAA 1
   HETATM 2918 CAB . HEC A 128 ? 17.86377 -24.76257 10.88833 1.000 10.08427 C ? B ? . CAB 1
   HETATM 2919 CAC . HEC A 128 ? 20.41973 -24.37088 3.29485 1.000 9.65148 C ? B ? . CAC 1
   HETATM 2920 CAD . HEC A 128 ? 27.94195 -24.77406 5.75488 1.000 9.02885 C ? B ? . CAD 1
   HETATM 2921 CBA . HEC A 128 ? 28.38510 -24.07938 11.41403 1.000 9.60854 C ? B ? . CBA 1
   HETATM 2922 CBB . HEC A 128 ? 17.34235 -23.92641 12.05402 1.000 9.83863 C ? B ? . CBB 1
   HETATM 2923 CBC . HEC A 128 ? 19.20467 -23.56832 2.74681 1.000 9.32611 C ? B ? . CBC 1
   HETATM 2924 CBD . HEC A 128 ? 28.51128 -23.32933 5.91302 1.000 8.07389 C ? B ? . CBD 1
   HETATM 2925 CGA . HEC A 128 ? 29.82503 -24.19195 11.78908 1.000 10.89577 C ? B ? . CGA 1
   HETATM 2926 CGD . HEC A 128 ? 29.97787 -23.24973 5.64715 1.000 8.90729 C ? B ? . CGD 1
   HETATM 2927 CHA . HEC A 128 ? 26.30882 -24.97231 8.42708 1.000 8.19414 C ? B ? . CHA 1
   HETATM 2928 CHB . HEC A 128 ? 22.79492 -25.25031 11.72208 1.000 8.41294 C ? B ? . CHB 1
   HETATM 2929 CHC . HEC A 128 ? 19.54386 -24.48160 8.28422 1.000 7.98392 C ? B ? . CHC 1
   HETATM 2930 CHD . HEC A 128 ? 23.01796 -24.65629 4.93666 1.000 8.17361 C ? B ? . CHD 1
   HETATM 2931 CMA . HEC A 128 ? 25.40036 -25.65201 13.31820 1.000 10.71465 C ? B ? . CMA 1
   HETATM 2932 CMB . HEC A 128 ? 20.09676 -25.27681 13.21401 1.000 11.13693 C ? B ? . CMB 1
   HETATM 2933 CMC . HEC A 128 ? 18.03435 -24.25974 5.59335 1.000 9.26649 C ? B ? . CMC 1
   HETATM 2934 CMD . HEC A 128 ? 25.68553 -24.68165 3.36949 1.000 9.98609 C ? B ? . CMD 1
   HETATM 2935 NA . HEC A 128 ? 24.26737 -25.07477 9.77201 1.000 7.38826 N ? B ? . NA 1
   HETATM 2936 NC . HEC A 128 ? 21.56301 -24.61738 6.87730 1.000 8.01915 N ? B ? . NC 1
   HETATM 2937 O1A . HEC A 128 ? 30.70051 -24.23345 10.90413 1.000 11.25518 O ? B ? . O1A 1
   HETATM 2938 O1D . HEC A 128 ? 30.42434 -22.46313 4.80614 1.000 9.61060 O ? B ? . O1D 1
   HETATM 2939 O2A . HEC A 128 ? 30.11806 -24.31689 13.02584 1.000 16.38308 O ? B ? . O2A 1
   HETATM 2940 O2D . HEC A 128 ? 30.72910 -24.02749 6.31412 1.000 8.32739 O ? B ? . O2D 1
   HETATM 2941 FE . HEC A 128 ? 22.90481 -24.79296 8.35443 1.000 7.68541 Fe ? B ? . FE 1
   HETATM 2942 C . CMO A 129 ? 23.08841 -21.88564 8.12710 1.000 9.59923 C ? C ? . C 1
   HETATM 2943 O . CMO A 129 ? 22.99639 -22.87775 8.52538 1.000 11.02502 O ? C ? . O 1
   HETATM 2944 O A HOH A 2001 ? 27.05093 -10.46009 -2.01993 0.871 18.53039 O ? D ? . O 1
   HETATM 2946 O . HOH A 2002 ? 26.00117 -10.15104 2.47493 0.772 11.97970 O ? D ? . O 1
   HETATM 2947 O . HOH A 2003 ? 28.65938 -10.69981 -0.20468 0.436 12.74273 O ? D ? . O 1
   HETATM 2948 O . HOH A 2004 ? 31.46005 -7.51388 7.26595 0.999 15.09277 O ? D ? . O 1
   HETATM 2949 O . HOH A 2005 ? 34.72931 -5.62872 5.42924 0.893 16.74053 O ? D ? . O 1
   HETATM 2950 O . HOH A 2007 ? 33.51046 -9.24537 7.96104 0.992 15.50065 O ? D ? . O 1
   HETATM 2951 O . HOH A 2008 ? 40.36208 -12.50793 -1.81112 0.862 20.59689 O ? D ? . O 1
   HETATM 2952 O . HOH A 2009 ? 36.77613 -4.47572 1.37692 0.777 21.29241 O ? D ? . O 1
   HETATM 2953 O . HOH A 2010 ? 36.37029 -7.67384 13.99427 0.914 20.78702 O ? D ? . O 1
   HETATM 2954 O . HOH A 2013 ? 35.21287 -8.27791 6.00576 0.877 14.67413 O ? D ? . O 1
   HETATM 2955 O . HOH A 2015 ? 38.60214 -6.28327 0.21520 0.907 27.13352 O ? D ? . O 1
   HETATM 2956 O A HOH A 2016 ? 40.52999 -18.12655 -1.56056 0.514 11.09504 O ? D ? . O 1
   HETATM 2957 O B HOH A 2016 ? 40.34727 -16.77365 -2.15818 0.486 19.54057 O ? D ? . O 1
   HETATM 2958 O . HOH A 2019 ? 34.49992 -12.24798 10.82577 0.675 18.08969 O ? D ? . O 1
   HETATM 2961 O A HOH A 2022 ? 21.65197 -9.62560 5.05921 0.598 16.15708 O ? D ? . O 1
   HETATM 2962 O B HOH A 2022 ? 20.91546 -10.04425 5.70957 0.402 17.46181 O ? D ? . O 1
   HETATM 2965 O . HOH A 2026 ? 40.81568 -15.01200 -0.30173 0.778 20.50818 O ? D ? . O 1
   HETATM 2966 O . HOH A 2027 ? 39.44543 -19.08160 0.70513 0.771 13.75467 O ? D ? . O 1
   HETATM 2967 O . HOH A 2030 ? 32.72019 -11.80102 8.78560 0.894 16.39749 O ? D ? . O 1
   HETATM 2968 O . HOH A 2031 ? 39.32740 -13.30603 7.36547 0.998 29.74434 O ? D ? . O 1
   HETATM 2969 O . HOH A 2033 ? 39.63211 -9.80988 5.76139 0.996 23.83947 O ? D ? . O 1
   HETATM 2970 O . HOH A 2034 ? 37.70902 -7.71514 7.14224 0.916 28.49236 O ? D ? . O 1
   HETATM 2971 O . HOH A 2035 ? 23.73721 -25.24765 19.78531 0.945 19.24022 O ? D ? . O 1
   HETATM 2972 O . HOH A 2036 ? 26.47761 -25.39072 16.63756 0.969 21.57507 O ? D ? . O 1
   HETATM 2973 O . HOH A 2037 ? 18.81206 -29.06588 17.41335 0.548 28.20506 O ? D ? . O 1
   HETATM 2974 O . HOH A 2038 ? 22.24565 -27.73880 14.82137 0.907 23.30738 O ? D ? . O 1
   HETATM 2976 O . HOH A 2042 ? 32.69892 -18.01977 12.65379 0.788 19.60299 O ? D ? . O 1
   HETATM 2978 O . HOH A 2044 ? 13.58836 -23.22323 28.30540 0.863 10.57330 O ? D ? . O 1
   HETATM 2979 O . HOH A 2045 ? 15.01243 -25.52500 28.19646 0.941 12.97873 O ? D ? . O 1
   HETATM 2980 O . HOH A 2046 ? 12.09457 -32.49775 19.15358 0.811 26.07028 O ? D ? . O 1
   HETATM 2981 O . HOH A 2047 ? 15.57520 -31.17361 15.92056 0.842 28.61788 O ? D ? . O 1
   HETATM 2982 O . HOH A 2048 ? 23.36076 -11.51234 6.23915 0.979 9.43939 O ? D ? . O 1
   HETATM 2983 O . HOH A 2049 ? 15.76852 -27.31157 30.18600 0.469 10.75687 O ? D ? . O 1
   HETATM 2984 O . HOH A 2051 ? 0.64533 -22.53071 31.22442 1.000 35.59402 O ? D ? . O 1
   HETATM 2985 O . HOH A 2052 ? 0.48242 -20.96226 28.11156 0.957 31.06292 O ? D ? . O 1
   HETATM 2986 O . HOH A 2053 ? 30.86025 -20.43186 14.52259 1.000 29.75781 O ? D ? . O 1
   HETATM 2987 O . HOH A 2054 ? 33.36711 -20.67544 12.36704 0.801 23.46789 O ? D ? . O 1
   HETATM 2988 O . HOH A 2055 ? 35.51912 -19.97814 9.32364 0.708 19.82376 O ? D ? . O 1
   HETATM 2989 O . HOH A 2056 ? 35.39418 -24.19230 7.91216 0.996 20.16713 O ? D ? . O 1
   HETATM 2990 O . HOH A 2057 ? 1.85114 -14.57092 26.86540 0.992 29.57421 O ? D ? . O 1
   HETATM 2992 O . HOH A 2061 ? 5.05419 -13.17201 33.96684 0.799 28.33177 O ? D ? . O 1
   HETATM 2993 O . HOH A 2062 ? 4.80398 -11.75939 24.79679 0.968 17.39359 O ? D ? . O 1
   HETATM 2994 O A HOH A 2063 ? 13.73263 -9.56117 19.00881 0.682 23.09138 O ? D ? . O 1
   HETATM 2995 O B HOH A 2063 ? 15.01287 -9.82794 19.54138 0.318 13.08947 O ? D ? . O 1
   HETATM 2996 O . HOH A 2064 ? 14.68696 -11.51242 23.20810 0.938 22.72750 O ? D ? . O 1
   HETATM 2997 O . HOH A 2066 ? 25.31868 -23.56829 18.37651 1.000 15.41060 O ? D ? . O 1
   HETATM 2998 O . HOH A 2067 ? 28.44194 -24.25979 15.08010 0.939 15.54370 O ? D ? . O 1
   HETATM 2999 O A HOH A 2068 ? 11.03009 -16.22213 8.44784 0.610 12.80466 O ? D ? . O 1
   HETATM 3000 O B HOH A 2068 ? 10.64427 -14.58348 8.83456 0.390 15.40370 O ? D ? . O 1
   HETATM 3001 O A HOH A 2069 ? 12.90346 -12.86537 8.61366 0.523 14.76750 O ? D ? . O 1
   HETATM 3002 O B HOH A 2069 ? 14.35341 -10.70900 9.28506 0.477 19.31487 O ? D ? . O 1
   HETATM 3003 O . HOH A 2070 ? 6.74954 -14.06756 10.44067 0.762 21.35933 O ? D ? . O 1
   HETATM 3004 O A HOH A 2071 ? 18.47487 -9.41261 7.26507 0.566 13.56430 O ? D ? . O 1
   HETATM 3005 O B HOH A 2071 ? 17.34463 -9.64482 7.27364 0.434 17.71909 O ? D ? . O 1
   HETATM 3006 O A HOH A 2073 ? 19.61752 -13.32269 1.13221 0.578 15.60966 O ? D ? . O 1
   HETATM 3007 O B HOH A 2073 ? 20.93196 -14.04804 -0.46509 0.422 17.05269 O ? D ? . O 1
   HETATM 3008 O A HOH A 2075 ? 22.60164 -15.47975 -3.57699 0.535 20.76595 O ? D ? . O 1
   HETATM 3011 O . HOH A 2078 ? 20.17815 -26.92517 16.87096 0.863 20.54030 O ? D ? . O 1
   HETATM 3012 O . HOH A 2081 ? 38.86021 -13.22629 -3.91996 0.877 26.57420 O ? D ? . O 1
   HETATM 3014 O . HOH A 2085 ? 18.35413 -29.68254 20.25604 0.787 17.40402 O ? D ? . O 1
   HETATM 3015 O . HOH A 2087 ? 18.49377 -28.69095 23.90570 0.894 24.76126 O ? D ? . O 1
   HETATM 3017 O . HOH A 2089 ? 31.46921 -31.25262 -1.99671 0.990 32.80732 O ? D ? . O 1
   HETATM 3020 O . HOH A 2092 ? 14.07954 -22.55646 25.58893 0.997 15.27742 O ? D ? . O 1
   HETATM 3022 O . HOH A 2094 ? 15.99611 -18.17545 25.00176 1.000 13.61173 O ? D ? . O 1
   HETATM 3023 O . HOH A 2095 ? 21.51010 -17.03699 25.04743 0.933 12.06709 O ? D ? . O 1
   HETATM 3024 O . HOH A 2099 ? 26.30652 -30.10796 -10.70173 0.801 18.46408 O ? D ? . O 1
   HETATM 3026 O . HOH A 2101 ? 19.15322 -18.66455 -10.72812 0.950 32.02750 O ? D ? . O 1
   HETATM 3027 O . HOH A 2102 ? 15.40892 -18.37236 -8.36285 1.000 32.28184 O ? D ? . O 1
   HETATM 3028 O . HOH A 2103 ? 13.15796 -22.48187 -8.84986 1.000 30.11328 O ? D ? . O 1
   HETATM 3029 O . HOH A 2104 ? 15.33415 -31.26681 18.63151 0.747 24.41867 O ? D ? . O 1
   HETATM 3030 O . HOH A 2105 ? 19.96687 -11.65396 -3.16681 0.942 30.72312 O ? D ? . O 1
   HETATM 3031 O . HOH A 2108 ? 6.86881 -27.45029 27.58250 0.909 11.91255 O ? D ? . O 1
   HETATM 3032 O A HOH A 2109 ? 6.63333 -33.15495 21.75110 0.698 16.71030 O ? D ? . O 1
   HETATM 3033 O B HOH A 2109 ? 6.24196 -33.41740 23.59491 0.302 16.91215 O ? D ? . O 1
   HETATM 3035 O . HOH A 2113 ? 5.31225 -32.63566 29.56154 1.000 29.32942 O ? D ? . O 1
   HETATM 3036 O . HOH A 2114 ? 12.62650 -32.53410 32.87322 0.877 16.01955 O ? D ? . O 1
   HETATM 3038 O . HOH A 2116 ? 14.17407 -29.97884 34.03810 0.998 22.43582 O ? D ? . O 1
   HETATM 3040 O . HOH A 2118 ? 15.95986 -31.58787 29.02665 0.948 31.81417 O ? D ? . O 1
   HETATM 3041 O . HOH A 2119 ? 0.37269 -14.67257 13.16089 0.860 23.25630 O ? D ? . O 1
   HETATM 3042 O . HOH A 2120 ? 9.24927 -21.85273 27.52276 0.947 10.64856 O ? D ? . O 1
   HETATM 3043 O . HOH A 2121 ? 11.42569 -23.25411 30.00307 0.844 11.08358 O ? D ? . O 1
   HETATM 3044 O . HOH A 2122 ? 4.63261 -25.23237 31.35372 0.981 16.63358 O ? D ? . O 1
   HETATM 3045 O . HOH A 2123 ? 2.59909 -23.74166 30.05621 0.993 22.77738 O ? D ? . O 1
   HETATM 3047 O . HOH A 2126 ? 4.81226 -21.72071 32.07620 0.997 23.50958 O ? D ? . O 1
   HETATM 3049 O . HOH A 2128 ? 3.88747 -16.08654 28.97225 1.000 18.91413 O ? D ? . O 1
   HETATM 3050 O . HOH A 2131 ? 8.23143 -14.59744 30.42951 0.541 14.53747 O ? D ? . O 1
   HETATM 3051 O . HOH A 2132 ? -4.49122 -25.56056 24.05336 1.000 30.57043 O ? D ? . O 1
   HETATM 3053 O . HOH A 2134 ? 7.38453 -33.24540 14.74108 0.835 22.33938 O ? D ? . O 1
   HETATM 3054 O . HOH A 2135 ? 10.99815 -32.08961 16.65604 0.834 16.46936 O ? D ? . O 1
   HETATM 3055 O . HOH A 2137 ? 3.19917 -14.08159 24.57140 0.910 17.25751 O ? D ? . O 1
   HETATM 3056 O . HOH A 2138 ? 7.54187 -12.10991 24.36068 0.932 14.43294 O ? D ? . O 1
   HETATM 3057 O . HOH A 2139 ? 13.15796 -15.52006 25.55191 0.995 14.66625 O ? D ? . O 1
   HETATM 3058 O A HOH A 2140 ? 14.76991 -16.98371 27.03996 0.765 16.86123 O ? D ? . O 1
   HETATM 3059 O B HOH A 2140 ? 14.84714 -17.29410 27.63905 0.235 7.90102 O ? D ? . O 1
   HETATM 3060 O . HOH A 2142 ? 13.90990 -20.07893 24.45063 1.000 16.77902 O ? D ? . O 1
   HETATM 3062 O . HOH A 2144 ? 14.17654 -34.90353 8.83004 0.816 23.01614 O ? D ? . O 1
   HETATM 3063 O . HOH A 2146 ? 21.18602 -28.70358 12.25500 0.880 40.21868 O ? D ? . O 1
   HETATM 3064 O . HOH A 2147 ? 7.68693 -15.22892 17.67334 0.777 10.39801 O ? D ? . O 1
   HETATM 3065 O . HOH A 2148 ? 1.33769 -12.75867 20.86386 0.997 26.11927 O ? D ? . O 1
   HETATM 3067 O . HOH A 2150 ? 3.97353 -9.80298 23.09664 1.000 27.42218 O ? D ? . O 1
   HETATM 3068 O . HOH A 2152 ? 13.08195 -11.15239 21.02964 1.000 15.66624 O ? D ? . O 1
   HETATM 3072 O . HOH A 2157 ? 8.86431 -14.35844 15.29311 0.859 11.70348 O ? D ? . O 1
   HETATM 3073 O . HOH A 2159 ? 14.77413 -9.71162 16.63840 0.924 23.84271 O ? D ? . O 1
   HETATM 3074 O . HOH A 2161 ? 6.31121 -11.75171 17.33799 0.912 29.20387 O ? D ? . O 1
   HETATM 3075 O . HOH A 2162 ? 8.33195 -10.71789 22.20117 1.000 25.72010 O ? D ? . O 1
   HETATM 3076 O . HOH A 2165 ? 13.66750 -15.72915 8.43455 0.841 19.56398 O ? D ? . O 1
   HETATM 3078 O . HOH A 2167 ? 17.29032 -10.51208 9.60954 0.953 12.65766 O ? D ? . O 1
   HETATM 3079 O . HOH A 2168 ? 12.94425 -10.10631 11.68018 1.000 40.36237 O ? D ? . O 1
   HETATM 3080 O A HOH A 2169 ? 16.85318 -13.85894 3.68468 0.595 20.46364 O ? D ? . O 1
   HETATM 3081 O B HOH A 2169 ? 15.84375 -13.44593 3.08098 0.405 16.49575 O ? D ? . O 1
   HETATM 3082 O . HOH A 2170 ? 20.87923 -13.29590 3.90379 0.742 18.71946 O ? D ? . O 1
   HETATM 3083 O . HOH A 2171 ? 22.20133 -17.79528 -0.76412 0.888 14.47797 O ? D ? . O 1
   HETATM 3084 O . HOH A 2174 ? 25.04566 -12.02047 -1.50623 0.996 21.38653 O ? D ? . O 1
   HETATM 3085 O . HOH A 2175 ? 28.48654 -13.26127 0.45955 0.972 15.78815 O ? D ? . O 1
   HETATM 3086 O . HOH A 2176 ? 23.95415 -17.76197 -2.83734 0.896 17.35342 O ? D ? . O 1
   HETATM 3087 O . HOH A 2177 ? 26.35997 -16.09607 -5.09266 0.650 18.85882 O ? D ? . O 1
   HETATM 3090 O . HOH A 2182 ? 36.11413 -18.52778 -2.51544 0.834 16.57219 O ? D ? . O 1
   HETATM 3091 O . HOH A 2185 ? 36.92951 -19.44024 1.68225 0.761 11.90872 O ? D ? . O 1
   HETATM 3094 O . HOH A 2189 ? 37.23499 -26.21857 3.30890 0.955 18.37477 O ? D ? . O 1
   HETATM 3095 O . HOH A 2190 ? 35.93381 -26.43007 6.59689 0.899 22.58427 O ? D ? . O 1
   HETATM 3096 O . HOH A 2194 ? 30.17628 -27.83431 9.06196 0.909 20.25235 O ? D ? . O 1
   HETATM 3097 O . HOH A 2195 ? 29.62471 -31.46398 -3.93492 0.984 35.35237 O ? D ? . O 1
   HETATM 3101 O . HOH A 2202 ? 28.71960 -29.92321 -9.47363 0.991 21.84146 O ? D ? . O 1
   HETATM 3102 O . HOH A 2203 ? 23.45736 -19.37604 -4.90088 0.908 14.85424 O ? D ? . O 1
   HETATM 3103 O . HOH A 2204 ? 25.84893 -18.73032 -8.77939 0.551 19.37431 O ? D ? . O 1
   HETATM 3105 O . HOH A 2207 ? 25.27487 -27.40620 -11.09726 0.799 19.42906 O ? D ? . O 1
   HETATM 3106 O A HOH A 2209 ? 19.16395 -24.57901 -9.65092 0.578 20.30998 O ? D ? . O 1
   HETATM 3108 O . HOH A 2210 ? 21.24832 -28.57213 -6.45298 0.977 26.10682 O ? D ? . O 1
   HETATM 3110 O . HOH A 2212 ? 20.76859 -18.95283 -4.51094 0.862 15.46607 O ? D ? . O 1
   HETATM 3111 O . HOH A 2213 ? 18.12041 -17.89770 -8.20287 0.990 25.56199 O ? D ? . O 1
   HETATM 3112 O . HOH A 2215 ? 14.53955 -20.18323 -6.75031 0.927 22.66415 O ? D ? . O 1
   HETATM 3113 O . HOH A 2217 ? 15.54790 -26.81872 -4.34989 0.944 15.86961 O ? D ? . O 1
   HETATM 3114 O . HOH A 2218 ? 14.31888 -26.49882 -6.67165 0.914 23.51498 O ? D ? . O 1
   HETATM 3115 O . HOH A 2219 ? 18.33908 -29.26794 -3.98103 1.000 36.21591 O ? D ? . O 1
   HETATM 3117 O . HOH A 2221 ? 18.14111 -13.95455 -6.76215 0.998 28.88001 O ? D ? . O 1
   HETATM 3118 O . HOH A 2223 ? 10.96906 -21.86293 -1.80667 0.818 10.61286 O ? D ? . O 1
   HETATM 3119 O . HOH A 2224 ? 10.87714 -23.85645 -8.02039 0.775 19.25202 O ? D ? . O 1
   HETATM 3120 O . HOH A 2225 ? 13.18484 -18.80190 -4.64728 0.751 23.61900 O ? D ? . O 1
   HETATM 3123 O A HOH A 2229 ? 18.37235 -33.23627 1.12001 0.512 13.11750 O ? D ? . O 1
   HETATM 3124 O B HOH A 2229 ? 17.92743 -32.74094 0.51907 0.488 17.12166 O ? D ? . O 1
   HETATM 3126 O . HOH A 2231 ? 19.84319 -17.95621 -2.03066 0.927 14.90118 O ? D ? . O 1
   HETATM 3128 O . HOH A 2233 ? 9.30651 -20.26446 -0.50789 0.881 17.53630 O ? D ? . O 1
   HETATM 3129 O . HOH A 2234 ? 10.74398 -17.13373 2.39388 0.718 14.94940 O ? D ? . O 1
   HETATM 3130 O . HOH A 2235 ? 10.03700 -17.22652 -1.93020 0.670 14.49869 O ? D ? . O 1
   HETATM 3131 O . HOH A 2236 ? 13.48080 -13.56275 1.98588 0.999 27.14245 O ? D ? . O 1
   HETATM 3132 O . HOH A 2238 ? 13.03287 -13.07905 5.79688 1.000 36.96041 O ? D ? . O 1
   HETATM 3133 O A HOH A 2241 ? 7.44935 -16.16753 3.71025 0.433 26.36664 O ? D ? . O 1
   HETATM 3134 O B HOH A 2241 ? 7.20318 -15.28809 3.68373 0.567 31.35954 O ? D ? . O 1
   HETATM 3135 O . HOH A 2242 ? 5.89797 -22.09226 1.50087 0.875 15.37236 O ? D ? . O 1
   HETATM 3136 O . HOH A 2245 ? 7.33433 -24.57143 10.63481 0.558 10.29492 O ? D ? . O 1
   HETATM 3137 O . HOH A 2246 ? 9.66189 -29.28515 6.57541 1.000 18.32155 O ? D ? . O 1
   HETATM 3138 O . HOH A 2247 ? 8.99675 -15.52814 10.76364 0.701 14.93539 O ? D ? . O 1
   HETATM 3139 O . HOH A 2248 ? 4.29998 -15.68000 11.21037 0.909 15.61199 O ? D ? . O 1
   HETATM 3140 O . HOH A 2249 ? 1.97842 -22.35646 12.96239 0.906 16.85232 O ? D ? . O 1
   HETATM 3141 O . HOH A 2250 ? 3.44102 -26.69652 11.32473 0.720 19.20496 O ? D ? . O 1
   HETATM 3142 O . HOH A 2251 ? -0.23920 -16.35951 15.17504 0.995 18.15678 O ? D ? . O 1
   HETATM 3143 O . HOH A 2253 ? 2.54836 -15.94887 22.70783 1.000 17.30376 O ? D ? . O 1
   HETATM 3145 O . HOH A 2255 ? 3.11975 -14.31959 13.33398 0.861 19.01855 O ? D ? . O 1
   HETATM 3147 O . HOH A 2258 ? -0.15854 -15.98230 23.46721 1.000 28.64607 O ? D ? . O 1
   HETATM 3148 O A HOH A 2259 ? -0.68140 -23.95520 24.25873 0.689 20.58171 O ? D ? . O 1
   HETATM 3149 O B HOH A 2259 ? -0.05510 -24.52041 24.97679 0.311 12.72816 O ? D ? . O 1
   HETATM 3150 O . HOH A 2260 ? -0.50361 -19.68611 25.62992 0.898 25.97937 O ? D ? . O 1
   HETATM 3152 O . HOH A 2265 ? -3.07801 -30.38768 23.48875 0.751 20.83668 O ? D ? . O 1
   HETATM 3153 O . HOH A 2267 ? 1.57339 -30.93505 17.31204 0.784 13.53835 O ? D ? . O 1
   HETATM 3155 O . HOH A 2270 ? 2.36244 -25.22020 13.47367 0.992 19.44877 O ? D ? . O 1
   HETATM 3156 O . HOH A 2274 ? 8.31393 -31.67772 16.90577 0.949 23.34154 O ? D ? . O 1
   HETATM 3157 O . HOH A 2275 ? 3.64835 -32.53036 16.45408 0.845 15.16632 O ? D ? . O 1
   HETATM 3158 O . HOH A 2278 ? 6.10502 -31.71542 12.78225 0.913 18.01568 O ? D ? . O 1
   HETATM 3159 O . HOH A 2279 ? 13.11967 -30.81412 14.79656 0.923 20.30787 O ? D ? . O 1
   HETATM 3160 O . HOH A 2281 ? 12.55153 -32.63365 12.64103 1.000 25.63453 O ? D ? . O 1
   HETATM 3161 O . HOH A 2282 ? 8.41023 -31.47767 7.69536 0.995 20.12450 O ? D ? . O 1
   HETATM 3162 O . HOH A 2283 ? 7.80333 -32.74331 11.13282 1.000 37.05871 O ? D ? . O 1
   HETATM 3164 O . HOH A 2285 ? 14.54609 -33.63706 11.27021 0.786 28.88515 O ? D ? . O 1
   HETATM 3165 O . HOH A 2286 ? 14.92612 -33.63542 6.64020 0.842 16.00055 O ? D ? . O 1
   HETATM 3166 O . HOH A 2287 ? 11.96144 -29.99930 4.79238 0.860 20.88009 O ? D ? . O 1
   HETATM 3167 O . HOH A 2288 ? 12.07211 -27.70756 3.50451 0.652 16.67821 O ? D ? . O 1
   HETATM 3168 O . HOH A 2289 ? 18.37054 -28.44535 13.14358 0.888 29.02620 O ? D ? . O 1
   HETATM 3169 O . HOH A 2291 ? 25.71989 -33.31671 4.86224 0.705 21.51837 O ? D ? . O 1
   HETATM 3170 O . HOH A 2293 ? 21.57221 -31.38881 9.86328 0.996 19.62960 O ? D ? . O 1
   HETATM 3171 O . HOH A 2294 ? 20.19140 -34.75654 -0.31712 0.990 28.13652 O ? D ? . O 1
   HETATM 3172 O . HOH A 2295 ? 22.01592 -33.54099 8.11823 0.998 27.72217 O ? D ? . O 1
   HETATM 3173 O . HOH A 2296 ? 16.88398 -34.74756 4.85584 0.831 19.88734 O ? D ? . O 1
   HETATM 3174 O . HOH A 2297 ? 27.35466 -31.96452 6.72714 0.694 15.13573 O ? D ? . O 1
   HETATM 3176 O . HOH A 2302 ? 29.85949 -25.26019 8.55343 0.998 11.45336 O ? D ? . O 1
   HETATM 3177 O . HOH A 2303 ? 33.17611 -25.24512 11.28289 0.738 21.83221 O ? D ? . O 1
   HETATM 3178 O . HOH A 2304 ? 32.18744 -22.74197 13.72371 0.663 26.72556 O ? D ? . O 1
   HETATM 5444 O . HOH S 2305 ? 42.35179 -19.59918 -3.12876 0.877 15.99808 O ? E ? . O 1
   HETATM 5445 O . HOH S 2306 ? 2.64150 -19.29055 29.11300 0.908 21.78571 O ? E ? . O 1
   HETATM 5448 O . HOH S 2309 ? 4.71152 -24.36274 33.62589 0.662 22.52720 O ? E ? . O 1
   HETATM 5449 O . HOH S 2310 ? 7.33460 -19.41973 -1.13443 0.294 10.30253 O ? E ? . O 1
   HETATM 5453 O . HOH S 2314 ? 5.63638 -16.99806 33.18349 0.646 20.37450 O ? E ? . O 1
   HETATM 5454 O . HOH S 2315 ? 16.26213 -34.39825 2.06994 0.735 20.39572 O ? E ? . O 1
   HETATM 5460 O . HOH S 2321 ? 6.64881 -12.62018 14.59739 0.986 33.52520 O ? E ? . O 1
   HETATM 5462 O . HOH S 2323 ? 6.43677 -11.94990 12.23838 0.541 23.75962 O ? E ? . O 1
   HETATM 5464 O . HOH S 2325 ? 35.00866 -31.54143 -0.76958 1.000 32.11505 O ? E ? . O 1
   HETATM 5465 O . HOH S 2326 ? 10.93349 -9.72318 22.09385 0.820 28.08322 O ? E ? . O 1
   HETATM 5467 O . HOH S 2328 ? 10.36142 -14.45543 6.44558 1.000 28.00532 O ? E ? . O 1
   HETATM 5468 O . HOH S 2329 ? 14.76122 -24.43450 -8.35209 0.949 30.70884 O ? E ? . O 1
   HETATM 5470 O . HOH S 2331 ? 41.06585 -8.16317 4.35047 0.862 27.07849 O ? E ? . O 1
   HETATM 5472 O . HOH S 2333 ? 19.90320 -15.49619 -2.71631 1.000 47.86041 O ? E ? . O 1
   HETATM 5474 O . HOH S 2335 ? 28.30923 -18.11791 -8.69519 0.994 36.01548 O ? E ? . O 1
   HETATM 5479 O . HOH S 2340 ? -3.86321 -28.75517 19.27654 0.766 30.74454 O ? E ? . O 1
   HETATM 5485 O . HOH S 2346 ? 4.13671 -10.67062 27.24056 0.601 22.58200 O ? E ? . O 1
   HETATM 5486 O . HOH S 2347 ? 10.41266 -33.49895 11.90391 0.995 39.14524 O ? E ? . O 1
   HETATM 5490 O . HOH S 2351 ? 6.29273 -12.79972 30.94929 0.753 26.99154 O ? E ? . O 1
   HETATM 5494 O . HOH S 2355 ? 5.97208 -13.65241 5.43296 0.995 34.83471 O ? E ? . O 1
   HETATM 5497 O . HOH S 2358 ? 30.16723 -32.29814 -6.97675 0.528 27.90937 O ? E ? . O 1
   HETATM 5498 O . HOH S 2359 ? 6.38437 -12.81307 8.24099 0.945 32.65033 O ? E ? . O 1
   HETATM 5501 O . HOH S 2362 ? 40.20643 -5.35592 -1.92188 1.000 37.72419 O ? E ? . O 1
   HETATM 5514 O . HOH S 2375 ? 31.07406 -31.01364 7.66351 0.998 35.74380 O ? E ? . O 1
   HETATM 5517 O . HOH S 2378 ? 30.05169 -12.19486 -2.87769 0.301 22.45859 O ? E ? . O 1
   HETATM 5519 O . HOH S 2380 ? 36.79915 -3.94721 6.03680 0.819 39.01409 O ? E ? . O 1
   HETATM 5520 O . HOH S 2381 ? 10.15200 -34.20273 19.97961 0.954 37.91874 O ? E ? . O 1
   HETATM 5521 O . HOH S 2382 ? 21.80614 -25.85697 -12.26185 0.998 41.31378 O ? E ? . O 1
   HETATM 5523 O . HOH S 2384 ? 2.77406 -11.22736 15.71998 0.916 38.72511 O ? E ? . O 1
   HETATM 5525 O . HOH S 2386 ? 1.22606 -21.98577 33.60471 1.000 41.78810 O ? E ? . O 1
   HETATM 5527 O . HOH S 2388 ? 2.72784 -13.79788 35.19580 1.000 43.81400 O ? E ? . O 1
   HETATM 5529 O . HOH S 2390 ? 6.49713 -14.79747 32.23796 0.431 21.76184 O ? E ? . O 1
   HETATM 5579 O . HOH S 2399 ? 4.97048 -18.89333 22.41594 1.000 10.77774 O ? F ? . O 1
   HETATM 5580 O . HOH S 2400 ? 31.74503 -33.40380 0.11780 1.000 21.34140 O ? F ? . O 1
   HETATM 5582 O . HOH S 2402 ? 32.45299 -4.95493 7.15457 1.000 23.62474 O ? F ? . O 1
   HETATM 5587 O . HOH S 2407 ? 20.45281 -28.19927 21.14322 0.755 23.46756 O ? F ? . O 1
   HETATM 5590 O . HOH S 2410 ? 24.44535 -14.74962 -1.01359 0.240 9.71869 O ? F ? . O 1
   HETATM 5591 O . HOH S 2411 ? 11.76118 -16.25462 -5.39482 1.000 37.49193 O ? F ? . O 1
   HETATM 5593 O . HOH S 2413 ? 0.99999 -25.26457 28.38822 0.914 38.49012 O ? F ? . O 1
   HETATM 5594 O . HOH S 2414 ? 25.24048 -26.92946 -13.68794 0.646 23.99126 O ? F ? . O 1
   HETATM 5595 O . HOH S 2415 ? 15.67327 -32.18458 25.26190 0.996 39.96449 O ? F ? . O 1
   HETATM 5596 O . HOH S 2416 ? 8.46090 -35.72663 25.03352 0.964 33.56158 O ? F ? . O 1
   HETATM 5598 O . HOH S 2418 ? -1.75753 -14.55486 21.43512 1.000 39.47672 O ? F ? . O 1
   HETATM 5599 O . HOH S 2419 ? 17.99606 -13.72835 -3.22247 1.000 45.19705 O ? F ? . O 1
   HETATM 5604 O . HOH S 2424 ? 30.69842 -34.64287 1.74570 1.000 43.29916 O ? F ? . O 1
   HETATM 5609 O . HOH S 2429 ? 11.87798 -14.31556 3.53971 1.000 43.96158 O ? F ? . O 1
   HETATM 5641 O . HOH S 2461 ? 19.64520 -31.09557 11.09862 0.759 34.98940 O ? F ? . O 1
   HETATM 5645 O . HOH S 2465 ? 41.23667 -6.43357 2.41859 1.000 47.81544 O ? F ? . O 1
   HETATM 5647 O . HOH S 2467 ? 21.41278 -26.01369 20.98787 0.748 30.47885 O ? F ? . O 1
   HETATM 5648 O . HOH S 2468 ? 9.32243 -33.37146 9.57609 0.374 23.61544 O ? F ? . O 1
   HETATM 5649 O . HOH S 2469 ? 4.63871 -9.81978 16.70565 0.625 37.74309 O ? F ? . O 1
   HETATM 5650 O . HOH S 2470 ? 18.00937 -30.29535 14.91762 0.561 28.27025 O ? F ? . O 1
   HETATM 5663 O . HOH S 2483 ? 1.99184 -7.70796 23.72190 1.000 45.14291 O ? F ? . O 1
   HETATM 5680 O . HOH S 2484 ? 17.33128 -24.94954 26.77816 0.993 12.74600 O ? G ? . O 1
   HETATM 5681 O . HOH S 2485 ? 14.73831 -29.73537 30.76060 0.928 15.81598 O ? G ? . O 1
   HETATM 5682 O . HOH S 2486 ? 24.08347 -29.03224 12.11671 0.960 21.28923 O ? G ? . O 1
   HETATM 5683 O . HOH S 2487 ? 29.12470 -27.27298 -8.93191 0.645 15.96868 O ? G ? . O 1
   HETATM 5685 O . HOH S 2489 ? 28.20591 -16.03042 -7.21312 0.571 17.61823 O ? G ? . O 1
   HETATM 5689 O . HOH S 2493 ? 31.89250 -21.62357 -6.23184 0.517 19.83751 O ? G ? . O 1
   HETATM 5690 O . HOH S 2494 ? 4.01909 -13.74147 30.33700 0.607 20.55784 O ? G ? . O 1
   HETATM 5693 O . HOH S 2497 ? 40.24238 -20.08759 -3.17067 0.327 15.85569 O ? G ? . O 1
   HETATM 5695 O . HOH S 2499 ? 17.49155 -30.72727 12.05449 0.741 29.22372 O ? G ? . O 1
   HETATM 5697 O . HOH S 2501 ? -1.76527 -15.13633 17.02920 0.700 27.89731 O ? G ? . O 1
   HETATM 5698 O . HOH S 2502 ? 10.13487 -15.55397 4.41442 0.613 30.65388 O ? G ? . O 1
   HETATM 5699 O . HOH S 2503 ? 35.43927 -29.32139 4.42712 0.543 25.45963 O ? G ? . O 1
   HETATM 5700 O . HOH S 2504 ? 16.61051 -34.01891 23.89061 0.584 31.42165 O ? G ? . O 1
   HETATM 5702 O . HOH S 2506 ? 0.71493 -31.15605 19.55569 0.423 27.19758 O ? G ? . O 1
   HETATM 5704 O . HOH S 2508 ? 14.79464 -18.52187 -10.91521 0.796 26.67072 O ? G ? . O 1
   HETATM 5709 O . HOH S 2513 ? 36.12296 -11.70965 9.31194 0.479 29.24327 O ? G ? . O 1
   HETATM 5712 O . HOH S 2516 ? 33.95322 -10.02530 -1.22289 0.440 18.57790 O ? G ? . O 1
   HETATM 5713 O . HOH S 2517 ? 17.75855 -31.06344 24.43954 0.479 19.08078 O ? G ? . O 1
   HETATM 5714 O . HOH S 2518 ? 0.78099 -24.32269 12.03371 0.593 28.80954 O ? G ? . O 1
   HETATM 5721 O . HOH S 2525 ? 6.20002 -32.91918 17.43109 0.264 19.03639 O ? G ? . O 1
   HETATM 5727 O . HOH S 2531 ? 9.30844 -14.69380 -3.10476 0.514 27.13018 O ? G ? . O 1
   HETATM 5736 O . HOH S 2540 ? 23.93932 -28.79893 -14.46173 0.343 22.71858 O ? G ? . O 1
   HETATM 5739 O . HOH S 2543 ? 18.36044 -30.11220 27.88061 0.527 27.17572 O ? G ? . O 1
   HETATM 5752 O . HOH S 2556 ? 11.70990 -34.88495 10.51579 0.328 24.75550 O ? G ? . O 1
   HETATM 5754 O . HOH S 2558 ? -4.11011 -31.00346 18.99337 0.259 23.44655 O ? G ? . O 1
   HETATM 5777 O . HOH S 2559 ? 14.79042 -14.44427 23.52077 0.649 19.50842 O ? H ? . O 1
   HETATM 5779 O . HOH S 2561 ? 34.80280 -16.89705 13.63124 0.703 25.47982 O ? H ? . O 1
   HETATM 5784 O . HOH S 2566 ? 17.08669 -14.19532 0.44061 0.730 23.42665 O ? H ? . O 1
   HETATM 5794 O . HOH S 2576 ? 1.81974 -14.14046 31.89249 0.599 27.72224 O ? H ? . O 1
   HETATM 5797 O . HOH S 2579 ? 4.01436 -8.78868 18.79759 0.882 38.96286 O ? H ? . O 1
   HETATM 5799 O . HOH S 2581 ? 18.97334 -32.16877 20.95417 0.525 28.42648 O ? H ? . O 1
   HETATM 5800 O . HOH S 2582 ? 18.94063 -29.11696 -7.94766 0.645 28.52648 O ? H ? . O 1
   HETATM 5802 O . HOH S 2584 ? 18.26732 -11.00631 5.31506 0.489 28.51312 O ? H ? . O 1
   HETATM 5803 O . HOH S 2585 ? 27.93377 -17.57609 -10.91399 0.291 15.48128 O ? H ? . O 1
   HETATM 5810 O . HOH S 2592 ? 3.91274 -15.39737 33.74245 0.527 28.62448 O ? H ? . O 1
   HETATM 5811 O . HOH S 2593 ? 40.23733 -5.13447 5.13357 0.478 24.09634 O ? H ? . O 1
   HETATM 5829 O . HOH S 2611 ? 21.57834 -35.77100 10.09427 0.538 37.11542 O ? H ? . O 1
   HETATM 5830 O . HOH S 2612 ? 39.28305 -11.67257 -5.60283 0.382 27.96783 O ? H ? . O 1
   HETATM 5838 O . HOH S 2620 ? 21.98245 -27.13669 18.98530 0.315 18.05764 O ? H ? . O 1
   HETATM 5857 O . HOH S 2621 ? 36.64954 -18.27571 7.12189 0.666 16.59882 O ? I ? . O 1
   HETATM 5864 O . HOH S 2628 ? 23.13506 -25.75995 -14.78861 0.574 29.16876 O ? I ? . O 1
   HETATM 5870 O . HOH S 2634 ? 39.04847 -9.99023 -1.71653 0.510 28.86641 O ? I ? . O 1
   HETATM 5874 O . HOH S 2638 ? 18.86143 -13.03330 3.46315 0.266 15.00906 O ? I ? . O 1
   HETATM 5884 O . HOH S 2648 ? 23.72664 -33.42082 6.32237 0.446 38.88076 O ? I ? . O 1
   HETATM 5886 O . HOH S 2650 ? 14.48585 -15.91683 -8.01272 0.448 25.45254 O ? I ? . O 1
   HETATM 5891 O . HOH S 2655 ? 37.66397 -27.66465 7.99363 0.614 33.32126 O ? I ? . O 1
   HETATM 5892 O . HOH S 2656 ? 15.65207 -37.26165 4.97684 0.269 19.46789 O ? I ? . O 1
   HETATM 5900 O . HOH S 2664 ? 10.90930 -25.82307 -6.68712 0.498 36.86349 O ? I ? . O 1
   HETATM 5903 O . HOH S 2667 ? 22.62004 -30.30389 -5.67544 0.342 22.27025 O ? I ? . O 1
   HETATM 5907 O . HOH S 2671 ? 12.30233 -16.07938 -7.62883 0.500 32.64506 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 .

