data_7u0s_qFit
_cell.length_a                    89.810
_cell.length_b                    91.470
_cell.length_c                    35.530
_cell.angle_alpha                 90.000
_cell.angle_beta                  90.000
_cell.angle_gamma                 90.000
_cell.volume                      291876.118
_space_group.crystal_system       orthorhombic
_space_group.IT_number            18
_space_group.name_H-M_alt         'P 21 21 2'
_space_group.name_Hall            ' P 2 2ab'
_symmetry.space_group_name_H-M    'P 21 21 2'
_symmetry.space_group_name_Hall   ' P 2 2ab'
_symmetry.Int_Tables_number       18
_reflns.B_iso_Wilson_estimate     19.98
_refine.pdbx_refine_id            'X-RAY DIFFRACTION'
_refine.ls_d_res_low              40.75
_refine.ls_d_res_high             1.70
_refine.pdbx_ls_sigma_F           1.35
_refine.ls_percent_reflns_obs     99.43
_refine.ls_number_reflns_obs      32870
_refine.ls_number_reflns_R_work   30874
_refine.ls_number_reflns_R_free   1996
_refine.ls_R_factor_obs           0.1651
_refine.ls_R_factor_R_work        0.1627
_refine.ls_R_factor_R_free        0.2031
_refine.ls_percent_reflns_R_free  6.07
_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             0.1615
_refine.pdbx_overall_phase_error  19.4958
_refine.pdbx_stereochemistry_target_values 'GeoStd + Monomer Library + CDL v1.2'
_refine.B_iso_mean                23.03
_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+1/2,-y+1/2,-z
   3 -x+1/2,y+1/2,-z
   4 -x,-y,z

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 2874 0.0184 ? ?
   'X-RAY DIFFRACTION' f_angle_d 3892 1.6212 ? ?
   'X-RAY DIFFRACTION' f_chiral_restr 414 0.1174 ? ?
   'X-RAY DIFFRACTION' f_plane_restr 504 0.0142 ? ?
   'X-RAY DIFFRACTION' f_dihedral_angle_d 1256 16.5845 ? ?

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' 4.10 40.75 2365 0.1638 98.71 0.1928 154
   'X-RAY DIFFRACTION' 3.25 4.10 2265 0.1554 99.92 0.1893 146
   'X-RAY DIFFRACTION' 2.84 3.25 2248 0.1724 99.75 0.2016 143
   'X-RAY DIFFRACTION' 2.58 2.84 2220 0.1667 99.71 0.2132 146
   'X-RAY DIFFRACTION' 2.40 2.58 2206 0.1562 99.75 0.1951 145
   'X-RAY DIFFRACTION' 2.25 2.40 2191 0.1515 99.70 0.1930 141
   'X-RAY DIFFRACTION' 2.14 2.25 2204 0.1518 99.74 0.2022 139
   'X-RAY DIFFRACTION' 2.05 2.14 2186 0.1474 99.40 0.2135 142
   'X-RAY DIFFRACTION' 1.97 2.05 2168 0.1451 99.31 0.2146 146
   'X-RAY DIFFRACTION' 1.90 1.97 2171 0.1524 99.31 0.1855 142
   'X-RAY DIFFRACTION' 1.84 1.90 2188 0.1736 99.44 0.2146 139
   'X-RAY DIFFRACTION' 1.79 1.84 2146 0.1897 99.13 0.2430 139
   'X-RAY DIFFRACTION' 1.74 1.79 2186 0.2041 99.02 0.2803 136
   'X-RAY DIFFRACTION' 1.70 1.74 2130 0.2132 99.21 0.2750 138

loop_
  _struct_asym.id
   A
   B
   C
   D
   E
   F
   G
   H
   I
   J
   K
   L
   M
   N
   O
   P
   Q
   R
   S

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 ASP B 44 CG ASP B 17 CG . LYS B 139 NZ LYS B 112 NZ . '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.
;
 .
   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
   1PE
   ACT
   ALA
   ARG
   ASN
   ASP
   GLN
   GLU
   GLY
   HIS
   HOH
   ILE
   KXX
   LEU
   LYS
   MET
   P6G
   PG4
   PHE
   PRO
   SER
   SO4
   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 15 ? -0.21332 10.89445 29.62432 1.000 60.55445 N ? A ? 1 N 1
   ATOM 2 CA . PHE A 15 ? 1.11672 11.44839 29.36267 1.000 66.56554 C ? A ? 1 CA 1
   ATOM 3 C . PHE A 15 ? 1.32106 11.93260 27.89656 1.000 63.95431 C ? A ? 1 C 1
   ATOM 4 O . PHE A 15 ? 1.16348 11.16314 26.95161 1.000 45.68485 O ? A ? 1 O 1
   ATOM 5 CB . PHE A 15 ? 2.15926 10.40157 29.73270 1.000 78.70968 C ? A ? 1 CB 1
   ATOM 6 CG . PHE A 15 ? 3.43289 10.52910 28.97518 1.000 91.12193 C ? A ? 1 CG 1
   ATOM 7 CD1 . PHE A 15 ? 4.35256 11.50167 29.32225 1.000 92.64086 C ? A ? 1 CD1 1
   ATOM 8 CD2 . PHE A 15 ? 3.71463 9.67462 27.91407 1.000 77.22702 C ? A ? 1 CD2 1
   ATOM 9 CE1 . PHE A 15 ? 5.52615 11.63198 28.63937 1.000 85.12163 C ? A ? 1 CE1 1
   ATOM 10 CE2 . PHE A 15 ? 4.89215 9.79172 27.21914 1.000 70.03950 C ? A ? 1 CE2 1
   ATOM 11 CZ . PHE A 15 ? 5.80388 10.77579 27.58231 1.000 90.93583 C ? A ? 1 CZ 1
   ATOM 12 N . GLU A 16 ? 1.65556 13.21165 27.70678 1.000 42.63024 N ? A ? 2 N 1
   ATOM 13 CA . GLU A 16 ? 1.82051 13.78625 26.36991 1.000 35.63969 C ? A ? 2 CA 1
   ATOM 14 C . GLU A 16 ? 3.03145 14.70704 26.37192 1.000 38.46689 C ? A ? 2 C 1
   ATOM 15 O . GLU A 16 ? 3.27574 15.37298 27.38785 1.000 33.73730 O ? A ? 2 O 1
   ATOM 16 CB . GLU A 16 ? 0.58233 14.61208 25.94312 1.000 25.45047 C ? A ? 2 CB 1
   ATOM 17 CG . GLU A 16 ? 0.68953 15.15810 24.49296 1.000 21.50647 C ? A ? 2 CG 1
   ATOM 18 CD . GLU A 16 ? 1.49399 16.48373 24.46006 1.000 42.59294 C ? A ? 2 CD 1
   ATOM 19 OE1 . GLU A 16 ? 1.87946 16.97684 25.54208 1.000 25.35077 O ? A ? 2 OE1 1
   ATOM 20 OE2 . GLU A 16 ? 1.76515 17.02132 23.37163 1.000 38.22819 O ? A ? 2 OE2 1
   ATOM 21 N . ALA A 17 ? 3.72159 14.83630 25.21917 1.000 26.21923 N ? A ? 3 N 1
   ATOM 22 CA . ALA A 17 ? 4.83637 15.77910 25.17020 1.000 20.47605 C ? A ? 3 CA 1
   ATOM 23 C . ALA A 17 ? 5.44161 15.84614 23.74360 1.000 19.17149 C ? A ? 3 C 1
   ATOM 24 O . ALA A 17 ? 5.31531 14.91529 22.94123 1.000 19.41715 O ? A ? 3 O 1
   ATOM 25 CB . ALA A 17 ? 5.88027 15.34714 26.22637 1.000 23.19451 C ? A ? 3 CB 1
   ATOM 26 N A GLN A 18 ? 6.12158 16.95820 23.47220 0.522 15.73225 N ? A ? 4 N 1
   ATOM 27 CA A GLN A 18 ? 6.83907 17.15701 22.21999 0.522 16.76327 C ? A ? 4 CA 1
   ATOM 28 C A GLN A 18 ? 8.26176 17.51730 22.61261 0.522 17.33744 C ? A ? 4 C 1
   ATOM 29 O A GLN A 18 ? 8.48374 18.47265 23.38253 0.522 16.85946 O ? A ? 4 O 1
   ATOM 30 CB A GLN A 18 ? 6.20918 18.26562 21.35261 0.522 18.93343 C ? A ? 4 CB 1
   ATOM 31 CG A GLN A 18 ? 4.78018 17.94746 20.82651 0.522 21.30180 C ? A ? 4 CG 1
   ATOM 32 CD A GLN A 18 ? 4.71978 16.62000 20.08450 0.522 18.20729 C ? A ? 4 CD 1
   ATOM 33 OE1 A GLN A 18 ? 5.73479 16.15490 19.55485 0.522 21.13255 O ? A ? 4 OE1 1
   ATOM 34 NE2 A GLN A 18 ? 3.52518 16.02482 20.00750 0.522 22.69432 N ? A ? 4 NE2 1
   ATOM 35 N B GLN A 18 ? 6.09296 16.95937 23.41362 0.478 15.81206 N ? A ? 4 N 1
   ATOM 36 CA B GLN A 18 ? 6.78910 17.05248 22.12222 0.478 16.57982 C ? A ? 4 CA 1
   ATOM 37 C B GLN A 18 ? 8.17006 17.60157 22.45380 0.478 16.78136 C ? A ? 4 C 1
   ATOM 38 O B GLN A 18 ? 8.28438 18.73572 22.93962 0.478 16.54523 O ? A ? 4 O 1
   ATOM 39 CB B GLN A 18 ? 6.06893 17.96351 21.10138 0.478 20.49259 C ? A ? 4 CB 1
   ATOM 40 CG B GLN A 18 ? 4.61243 17.55174 20.70698 0.478 22.25071 C ? A ? 4 CG 1
   ATOM 41 CD B GLN A 18 ? 4.52041 16.64976 19.43262 0.478 26.66677 C ? A ? 4 CD 1
   ATOM 42 OE1 B GLN A 18 ? 5.51942 16.48493 18.68568 0.478 20.33753 O ? A ? 4 OE1 1
   ATOM 43 NE2 B GLN A 18 ? 3.29496 16.08952 19.16583 0.478 18.93679 N ? A ? 4 NE2 1
   ATOM 44 N A LYS A 19 ? 9.22282 16.71550 22.14256 0.522 12.90185 N ? A ? 5 N 1
   ATOM 45 CA A LYS A 19 ? 10.63297 17.03747 22.34395 0.522 14.99133 C ? A ? 5 CA 1
   ATOM 46 C A LYS A 19 ? 11.03752 17.85844 21.11194 0.522 15.49721 C ? A ? 5 C 1
   ATOM 47 O A LYS A 19 ? 11.44117 17.33716 20.06270 0.522 15.42567 O ? A ? 5 O 1
   ATOM 48 CB A LYS A 19 ? 11.45257 15.75703 22.54228 0.522 14.93806 C ? A ? 5 CB 1
   ATOM 49 CG A LYS A 19 ? 10.91308 14.83417 23.69500 0.522 23.63446 C ? A ? 5 CG 1
   ATOM 50 CD A LYS A 19 ? 11.04529 15.45218 25.06955 0.522 27.80940 C ? A ? 5 CD 1
   ATOM 51 CE A LYS A 19 ? 11.28188 14.36194 26.11141 0.522 41.57139 C ? A ? 5 CE 1
   ATOM 52 NZ A LYS A 19 ? 12.66195 14.40670 26.68714 0.522 45.04715 N ? A ? 5 NZ 1
   ATOM 53 N B LYS A 19 ? 9.22733 16.79402 22.25271 0.478 12.99185 N ? A ? 5 N 1
   ATOM 54 CA B LYS A 19 ? 10.58649 17.26832 22.55421 0.478 13.86637 C ? A ? 5 CA 1
   ATOM 55 C B LYS A 19 ? 11.07108 18.01511 21.30288 0.478 15.97434 C ? A ? 5 C 1
   ATOM 56 O B LYS A 19 ? 11.67237 17.45101 20.38100 0.478 16.09155 O ? A ? 5 O 1
   ATOM 57 CB B LYS A 19 ? 11.48736 16.10069 22.97459 0.478 15.36782 C ? A ? 5 CB 1
   ATOM 58 CG B LYS A 19 ? 10.88184 15.26618 24.13235 0.478 21.98291 C ? A ? 5 CG 1
   ATOM 59 CD B LYS A 19 ? 11.80433 15.34616 25.33659 0.478 29.81768 C ? A ? 5 CD 1
   ATOM 60 CE B LYS A 19 ? 11.51477 14.20804 26.30507 0.478 41.52344 C ? A ? 5 CE 1
   ATOM 61 NZ B LYS A 19 ? 12.67082 13.95294 27.22082 0.478 45.27015 N ? A ? 5 NZ 1
   ATOM 62 N A ILE A 20 ? 10.90513 19.17393 21.23036 0.522 13.29202 N ? A ? 6 N 1
   ATOM 63 CA A ILE A 20 ? 11.12101 19.96295 20.02367 0.522 15.56757 C ? A ? 6 CA 1
   ATOM 64 C A ILE A 20 ? 12.62277 20.20929 19.79093 0.522 15.09088 C ? A ? 6 C 1
   ATOM 65 O A ILE A 20 ? 13.07277 20.24471 18.63316 0.522 18.30081 O ? A ? 6 O 1
   ATOM 66 CB A ILE A 20 ? 10.29366 21.25107 20.15207 0.522 16.85607 C ? A ? 6 CB 1
   ATOM 67 CG1 A ILE A 20 ? 8.77097 20.92345 19.97696 0.522 12.60310 C ? A ? 6 CG1 1
   ATOM 68 CG2 A ILE A 20 ? 10.85713 22.39145 19.24411 0.522 17.80061 C ? A ? 6 CG2 1
   ATOM 69 CD1 A ILE A 20 ? 7.85000 21.99107 20.47522 0.522 23.40314 C ? A ? 6 CD1 1
   ATOM 70 N B ILE A 20 ? 10.81698 19.32168 21.29169 0.478 13.34887 N ? A ? 6 N 1
   ATOM 71 CA B ILE A 20 ? 10.98548 20.11424 20.06769 0.478 15.49772 C ? A ? 6 CA 1
   ATOM 72 C B ILE A 20 ? 12.44682 20.15387 19.63114 0.478 14.66646 C ? A ? 6 C 1
   ATOM 73 O B ILE A 20 ? 12.76339 20.12929 18.42922 0.478 17.22841 O ? A ? 6 O 1
   ATOM 74 CB B ILE A 20 ? 10.47314 21.53655 20.31844 0.478 17.26276 C ? A ? 6 CB 1
   ATOM 75 CG1 B ILE A 20 ? 9.14868 21.48207 21.11491 0.478 13.86763 C ? A ? 6 CG1 1
   ATOM 76 CG2 B ILE A 20 ? 10.39409 22.32552 18.96672 0.478 18.79994 C ? A ? 6 CG2 1
   ATOM 77 CD1 B ILE A 20 ? 7.97007 22.11020 20.41447 0.478 23.14779 C ? A ? 6 CD1 1
   ATOM 78 N A GLU A 21 ? 13.41107 20.37988 20.86618 0.522 15.61895 N ? A ? 7 N 1
   ATOM 79 CA A GLU A 21 ? 14.86838 20.27105 20.77931 0.522 16.00393 C ? A ? 7 CA 1
   ATOM 80 C A GLU A 21 ? 15.36361 19.32969 21.84314 0.522 18.67365 C ? A ? 7 C 1
   ATOM 81 O A GLU A 21 ? 14.96125 19.43571 23.00036 0.522 17.61865 O ? A ? 7 O 1
   ATOM 82 CB A GLU A 21 ? 15.60229 21.63557 20.96516 0.522 15.89206 C ? A ? 7 CB 1
   ATOM 83 CG A GLU A 21 ? 15.12128 22.80970 20.05862 0.522 18.32141 C ? A ? 7 CG 1
   ATOM 84 CD A GLU A 21 ? 15.22592 22.56394 18.53290 0.522 21.70695 C ? A ? 7 CD 1
   ATOM 85 OE1 A GLU A 21 ? 16.11931 21.82346 18.08565 0.522 22.26880 O ? A ? 7 OE1 1
   ATOM 86 OE2 A GLU A 21 ? 14.42502 23.16575 17.78305 0.522 20.20878 O ? A ? 7 OE2 1
   ATOM 87 N B GLU A 21 ? 13.33201 20.37109 20.59562 0.478 16.41328 N ? A ? 7 N 1
   ATOM 88 CA B GLU A 21 ? 14.77731 20.32436 20.43846 0.478 17.88677 C ? A ? 7 CA 1
   ATOM 89 C B GLU A 21 ? 15.29605 19.44824 21.54340 0.478 16.30233 C ? A ? 7 C 1
   ATOM 90 O B GLU A 21 ? 14.80501 19.54187 22.66752 0.478 17.63586 O ? A ? 7 O 1
   ATOM 91 CB B GLU A 21 ? 15.41165 21.73711 20.59027 0.478 18.40562 C ? A ? 7 CB 1
   ATOM 92 CG B GLU A 21 ? 14.81056 22.75706 19.64315 0.478 19.34152 C ? A ? 7 CG 1
   ATOM 93 CD B GLU A 21 ? 15.51099 22.74867 18.29153 0.478 20.74102 C ? A ? 7 CD 1
   ATOM 94 OE1 B GLU A 21 ? 16.54715 22.06911 18.17694 0.478 22.36461 O ? A ? 7 OE1 1
   ATOM 95 OE2 B GLU A 21 ? 15.04486 23.45313 17.38235 0.478 22.11348 O ? A ? 7 OE2 1
   ATOM 96 N A TRP A 22 ? 16.28577 18.42932 21.48054 0.522 16.44822 N ? A ? 8 N 1
   ATOM 97 CA A TRP A 22 ? 16.85548 17.54373 22.47806 0.522 14.05693 C ? A ? 8 CA 1
   ATOM 98 C A TRP A 22 ? 18.31721 17.35383 22.12777 0.522 18.77065 C ? A ? 8 C 1
   ATOM 99 O A TRP A 22 ? 18.62500 16.95943 21.00379 0.522 18.06849 O ? A ? 8 O 1
   ATOM 100 CB A TRP A 22 ? 16.13454 16.19886 22.48618 0.522 15.83388 C ? A ? 8 CB 1
   ATOM 101 CG A TRP A 22 ? 16.61812 15.34662 23.56524 0.522 15.91952 C ? A ? 8 CG 1
   ATOM 102 CD1 A TRP A 22 ? 16.26705 15.42973 24.89528 0.522 22.76623 C ? A ? 8 CD1 1
   ATOM 103 CD2 A TRP A 22 ? 17.59641 14.28702 23.47050 0.522 16.02593 C ? A ? 8 CD2 1
   ATOM 104 NE1 A TRP A 22 ? 16.93184 14.46527 25.60389 0.522 20.90714 N ? A ? 8 NE1 1
   ATOM 105 CE2 A TRP A 22 ? 17.78184 13.78103 24.77150 0.522 22.30596 C ? A ? 8 CE2 1
   ATOM 106 CE3 A TRP A 22 ? 18.33236 13.73147 22.41761 0.522 16.25036 C ? A ? 8 CE3 1
   ATOM 107 CZ2 A TRP A 22 ? 18.64469 12.73199 25.04488 0.522 22.13566 C ? A ? 8 CZ2 1
   ATOM 108 CZ3 A TRP A 22 ? 19.19014 12.68387 22.68959 0.522 17.52179 C ? A ? 8 CZ3 1
   ATOM 109 CH2 A TRP A 22 ? 19.33787 12.19313 23.99906 0.522 21.75138 C ? A ? 8 CH2 1
   ATOM 110 N B TRP A 22 ? 16.29625 18.59346 21.24841 0.478 16.95130 N ? A ? 8 N 1
   ATOM 111 CA B TRP A 22 ? 16.89449 17.76662 22.28325 0.478 13.71967 C ? A ? 8 CA 1
   ATOM 112 C B TRP A 22 ? 18.38326 17.61752 21.99635 0.478 18.57621 C ? A ? 8 C 1
   ATOM 113 O B TRP A 22 ? 18.81954 17.57932 20.84220 0.478 16.40752 O ? A ? 8 O 1
   ATOM 114 CB B TRP A 22 ? 16.20230 16.39132 22.34696 0.478 15.86063 C ? A ? 8 CB 1
   ATOM 115 CG B TRP A 22 ? 16.85253 15.34397 23.22040 0.478 16.33056 C ? A ? 8 CG 1
   ATOM 116 CD1 B TRP A 22 ? 16.60563 15.09396 24.54990 0.478 23.38683 C ? A ? 8 CD1 1
   ATOM 117 CD2 B TRP A 22 ? 17.84760 14.37724 22.81246 0.478 16.29106 C ? A ? 8 CD2 1
   ATOM 118 NE1 B TRP A 22 ? 17.39807 14.05049 24.98546 0.478 24.72081 N ? A ? 8 NE1 1
   ATOM 119 CE2 B TRP A 22 ? 18.15453 13.59028 23.93705 0.478 17.71597 C ? A ? 8 CE2 1
   ATOM 120 CE3 B TRP A 22 ? 18.51052 14.11485 21.60725 0.478 14.69089 C ? A ? 8 CE3 1
   ATOM 121 CZ2 B TRP A 22 ? 19.09370 12.54540 23.88899 0.478 22.31644 C ? A ? 8 CZ2 1
   ATOM 122 CZ3 B TRP A 22 ? 19.45539 13.05893 21.56694 0.478 17.76262 C ? A ? 8 CZ3 1
   ATOM 123 CH2 B TRP A 22 ? 19.73275 12.31014 22.69699 0.478 19.23660 C ? A ? 8 CH2 1
   ATOM 124 N A HIS A 23 ? 19.20182 17.65213 23.05669 0.522 16.49135 N ? A ? 9 N 1
   ATOM 125 CA A HIS A 23 ? 20.61975 17.37763 22.86489 0.522 21.34478 C ? A ? 9 CA 1
   ATOM 126 C A HIS A 23 ? 21.10906 16.47901 23.97705 0.522 21.08983 C ? A ? 9 C 1
   ATOM 127 O A HIS A 23 ? 20.59516 16.51454 25.10128 0.522 18.85520 O ? A ? 9 O 1
   ATOM 128 CB A HIS A 23 ? 21.49580 18.66153 22.86748 0.522 21.57951 C ? A ? 9 CB 1
   ATOM 129 CG A HIS A 23 ? 22.98161 18.38072 22.80404 0.522 20.29606 C ? A ? 9 CG 1
   ATOM 130 ND1 A HIS A 23 ? 23.63250 18.04024 21.63142 0.522 19.44260 N ? A ? 9 ND1 1
   ATOM 131 CD2 A HIS A 23 ? 23.93434 18.39467 23.76707 0.522 17.52944 C ? A ? 9 CD2 1
   ATOM 132 CE1 A HIS A 23 ? 24.91922 17.85762 21.87698 0.522 18.41309 C ? A ? 9 CE1 1
   ATOM 133 NE2 A HIS A 23 ? 25.12834 18.07546 23.16480 0.522 26.79565 N ? A ? 9 NE2 1
   ATOM 134 N B HIS A 23 ? 19.16573 17.52873 23.04885 0.478 16.47580 N ? A ? 9 N 1
   ATOM 135 CA B HIS A 23 ? 20.59929 17.50437 22.81297 0.478 21.56516 C ? A ? 9 CA 1
   ATOM 136 C B HIS A 23 ? 21.27242 16.70943 23.90873 0.478 20.88335 C ? A ? 9 C 1
   ATOM 137 O B HIS A 23 ? 21.06536 16.99098 25.09110 0.478 18.99903 O ? A ? 9 O 1
   ATOM 138 CB B HIS A 23 ? 21.18188 18.93089 22.77235 0.478 18.74429 C ? A ? 9 CB 1
   ATOM 139 CG B HIS A 23 ? 22.67757 18.94799 22.64110 0.478 20.66931 C ? A ? 9 CG 1
   ATOM 140 ND1 B HIS A 23 ? 23.31421 18.83737 21.42207 0.478 21.36568 N ? A ? 9 ND1 1
   ATOM 141 CD2 B HIS A 23 ? 23.65813 18.99242 23.57716 0.478 21.63799 C ? A ? 9 CD2 1
   ATOM 142 CE1 B HIS A 23 ? 24.62416 18.83236 21.61145 0.478 21.18285 C ? A ? 9 CE1 1
   ATOM 143 NE2 B HIS A 23 ? 24.85884 18.94294 22.91052 0.478 24.27258 N ? A ? 9 NE2 1
   ATOM 144 N A GLU A 24 ? 22.12856 15.67601 23.65449 0.522 19.75240 N ? A ? 10 N 1
   ATOM 145 CA A GLU A 24 ? 22.85120 14.93054 24.66769 0.522 18.70747 C ? A ? 10 CA 1
   ATOM 146 C A GLU A 24 ? 24.30926 14.84779 24.25991 0.522 25.45555 C ? A ? 10 C 1
   ATOM 147 O A GLU A 24 ? 24.61242 14.42944 23.12905 0.522 19.19990 O ? A ? 10 O 1
   ATOM 148 CB A GLU A 24 ? 22.29680 13.51463 24.81116 0.522 19.40122 C ? A ? 10 CB 1
   ATOM 149 CG A GLU A 24 ? 22.80268 12.82772 26.05081 0.522 28.11422 C ? A ? 10 CG 1
   ATOM 150 CD A GLU A 24 ? 22.50820 11.34446 26.02899 0.522 37.64224 C ? A ? 10 CD 1
   ATOM 151 OE1 A GLU A 24 ? 22.72819 10.69881 24.96380 0.522 35.53295 O ? A ? 10 OE1 1
   ATOM 152 OE2 A GLU A 24 ? 22.05138 10.82954 27.06753 0.522 52.14905 O ? A ? 10 OE2 1
   ATOM 153 N B GLU A 24 ? 22.09477 15.72802 23.51762 0.478 19.67950 N ? A ? 10 N 1
   ATOM 154 CA B GLU A 24 ? 22.91179 15.00216 24.47318 0.478 18.73589 C ? A ? 10 CA 1
   ATOM 155 C B GLU A 24 ? 24.38556 15.20471 24.14997 0.478 25.41803 C ? A ? 10 C 1
   ATOM 156 O B GLU A 24 ? 24.78726 15.31796 22.99295 0.478 19.70837 O ? A ? 10 O 1
   ATOM 157 CB B GLU A 24 ? 22.59532 13.48007 24.46082 0.478 18.45576 C ? A ? 10 CB 1
   ATOM 158 CG B GLU A 24 ? 23.39654 12.68689 25.49448 0.478 26.30431 C ? A ? 10 CG 1
   ATOM 159 CD B GLU A 24 ? 22.67204 11.43166 25.95942 0.478 37.66074 C ? A ? 10 CD 1
   ATOM 160 OE1 B GLU A 24 ? 21.84808 10.87941 25.17870 0.478 31.27530 O ? A ? 10 OE1 1
   ATOM 161 OE2 B GLU A 24 ? 22.93542 10.99739 27.10216 0.478 51.59726 O ? A ? 10 OE2 1
   ATOM 162 N . GLY A 25 ? 25.18903 15.24915 25.18998 1.000 29.52491 N ? A ? 11 N 1
   ATOM 163 CA . GLY A 25 ? 26.63196 15.16944 25.03521 1.000 34.96920 C ? A ? 11 CA 1
   ATOM 164 C . GLY A 25 ? 27.22332 15.15083 26.43561 1.000 33.69957 C ? A ? 11 C 1
   ATOM 165 O . GLY A 25 ? 27.99584 16.03764 26.75841 1.000 49.20418 O ? A ? 11 O 1
   ATOM 166 N . SER A 29 ? 30.13397 21.22009 21.12197 1.000 84.18367 N ? A ? 12 N 1
   ATOM 167 CA . SER A 29 ? 30.91078 20.01768 21.41845 1.000 88.00875 C ? A ? 12 CA 1
   ATOM 168 C . SER A 29 ? 30.29787 18.73048 20.79058 1.000 86.10450 C ? A ? 12 C 1
   ATOM 169 O . SER A 29 ? 29.38257 18.79318 19.94596 1.000 51.45723 O ? A ? 12 O 1
   ATOM 170 CB . SER A 29 ? 31.07575 19.87039 22.94811 1.000 68.41651 C ? A ? 12 CB 1
   ATOM 171 OG . SER A 29 ? 29.83173 19.83609 23.63358 1.000 57.73076 O ? A ? 12 OG 1
   ATOM 172 N . SER A 30 ? 30.83974 17.57682 21.19080 1.000 38.97686 N ? A ? 13 N 1
   ATOM 173 CA . SER A 30 ? 30.37807 16.29527 20.71546 1.000 36.11259 C ? A ? 13 CA 1
   ATOM 174 C . SER A 30 ? 28.97224 15.93220 21.19716 1.000 39.13029 C ? A ? 13 C 1
   ATOM 175 O . SER A 30 ? 28.53279 16.30946 22.28756 1.000 40.44806 O ? A ? 13 O 1
   ATOM 176 CB . SER A 30 ? 31.28679 15.20261 21.19579 1.000 28.97524 C ? A ? 13 CB 1
   ATOM 177 OG . SER A 30 ? 30.86316 14.61337 22.42064 1.000 51.24214 O ? A ? 13 OG 1
   ATOM 178 N . GLY A 31 ? 28.32956 15.07098 20.43692 1.000 24.44120 N ? A ? 14 N 1
   ATOM 179 CA . GLY A 31 ? 27.05761 14.59763 20.92514 1.000 27.45591 C ? A ? 14 CA 1
   ATOM 180 C . GLY A 31 ? 26.06450 14.33514 19.80168 1.000 19.01963 C ? A ? 14 C 1
   ATOM 181 O . GLY A 31 ? 26.42819 14.04196 18.65946 1.000 23.64713 O ? A ? 14 O 1
   ATOM 182 N A VAL A 32 ? 24.79559 14.37753 20.18958 0.445 16.75333 N ? A ? 15 N 1
   ATOM 183 CA A VAL A 32 ? 23.68557 14.19724 19.26208 0.445 17.64059 C ? A ? 15 CA 1
   ATOM 184 C A VAL A 32 ? 22.65779 15.26994 19.55575 0.445 17.28496 C ? A ? 15 C 1
   ATOM 185 O A VAL A 32 ? 22.33869 15.52966 20.72284 0.445 19.75662 O ? A ? 15 O 1
   ATOM 186 CB A VAL A 32 ? 23.04682 12.77774 19.34066 0.445 19.02948 C ? A ? 15 CB 1
   ATOM 187 CG1 A VAL A 32 ? 22.62834 12.35645 20.80790 0.445 19.64432 C ? A ? 15 CG1 1
   ATOM 188 CG2 A VAL A 32 ? 21.84846 12.63390 18.41004 0.445 16.12450 C ? A ? 15 CG2 1
   ATOM 189 N B VAL A 32 ? 24.79568 14.44923 20.16615 0.555 16.80701 N ? A ? 15 N 1
   ATOM 190 CA B VAL A 32 ? 23.72044 14.26814 19.20078 0.555 17.60647 C ? A ? 15 CA 1
   ATOM 191 C B VAL A 32 ? 22.67085 15.32880 19.45208 0.555 16.98783 C ? A ? 15 C 1
   ATOM 192 O B VAL A 32 ? 22.30783 15.59412 20.60502 0.555 20.18291 O ? A ? 15 O 1
   ATOM 193 CB B VAL A 32 ? 23.09581 12.84598 19.25647 0.555 18.88824 C ? A ? 15 CB 1
   ATOM 194 CG1 B VAL A 32 ? 22.79860 12.34609 20.75277 0.555 20.03628 C ? A ? 15 CG1 1
   ATOM 195 CG2 B VAL A 32 ? 21.83101 12.73778 18.39773 0.555 16.14639 C ? A ? 15 CG2 1
   ATOM 196 N A THR A 33 ? 22.14242 15.87584 18.50434 0.445 15.52749 N ? A ? 16 N 1
   ATOM 197 CA A THR A 33 ? 21.02747 16.80569 18.63532 0.445 15.90639 C ? A ? 16 CA 1
   ATOM 198 C A THR A 33 ? 19.88572 16.39267 17.71293 0.445 16.20340 C ? A ? 16 C 1
   ATOM 199 O A THR A 33 ? 20.07708 16.19566 16.50115 0.445 15.16146 O ? A ? 16 O 1
   ATOM 200 CB A THR A 33 ? 21.47170 18.24394 18.33579 0.445 22.27620 C ? A ? 16 CB 1
   ATOM 201 OG1 A THR A 33 ? 22.61234 18.55010 19.14936 0.445 15.05317 O ? A ? 16 OG1 1
   ATOM 202 CG2 A THR A 33 ? 20.33618 19.21374 18.66941 0.445 19.04735 C ? A ? 16 CG2 1
   ATOM 203 N B THR A 33 ? 22.21035 15.93764 18.38551 0.555 15.47016 N ? A ? 16 N 1
   ATOM 204 CA B THR A 33 ? 21.06152 16.83634 18.44128 0.555 15.91335 C ? A ? 16 CA 1
   ATOM 205 C B THR A 33 ? 19.89670 16.17798 17.72769 0.555 16.33412 C ? A ? 16 C 1
   ATOM 206 O B THR A 33 ? 20.07287 15.61689 16.64422 0.555 17.00736 O ? A ? 16 O 1
   ATOM 207 CB B THR A 33 ? 21.38658 18.17947 17.77454 0.555 16.77137 C ? A ? 16 CB 1
   ATOM 208 OG1 B THR A 33 ? 22.49488 18.75195 18.48051 0.555 22.48903 O ? A ? 16 OG1 1
   ATOM 209 CG2 B THR A 33 ? 20.19685 19.14159 17.86897 0.555 16.70982 C ? A ? 16 CG2 1
   ATOM 210 N . LYS A 34 ? 18.67889 16.32508 18.28453 1.000 16.68369 N ? A ? 17 N 1
   ATOM 211 CA . LYS A 34 ? 17.44786 15.99303 17.56268 1.000 13.29192 C ? A ? 17 CA 1
   ATOM 212 C . LYS A 34 ? 16.61643 17.26739 17.49482 1.000 19.78887 C ? A ? 17 C 1
   ATOM 213 O . LYS A 34 ? 16.31291 17.85974 18.54242 1.000 20.19253 O ? A ? 17 O 1
   ATOM 214 CB . LYS A 34 ? 16.64161 14.93682 18.31371 1.000 17.48900 C ? A ? 17 CB 1
   ATOM 215 CG . LYS A 34 ? 15.48654 14.46881 17.44302 1.000 18.50243 C ? A ? 17 CG 1
   ATOM 216 CD . LYS A 34 ? 14.01892 14.36174 18.04562 1.000 19.97925 C ? A ? 17 CD 1
   ATOM 217 CE . LYS A 34 ? 13.59682 15.11583 19.22148 1.000 28.96476 C ? A ? 17 CE 1
   ATOM 218 NZ . LYS A 34 ? 12.10773 14.83638 19.26060 1.000 16.55506 N ? A ? 17 NZ 1
   ATOM 219 N A GLU A 35 ? 16.22434 17.67009 16.29584 0.469 16.41352 N ? A ? 18 N 1
   ATOM 220 CA A GLU A 35 ? 15.33407 18.81149 16.11949 0.469 16.99756 C ? A ? 18 CA 1
   ATOM 221 C A GLU A 35 ? 14.02093 18.35475 15.50156 0.469 17.34854 C ? A ? 18 C 1
   ATOM 222 O A GLU A 35 ? 14.01908 17.62359 14.51232 0.469 15.22477 O ? A ? 18 O 1
   ATOM 223 CB A GLU A 35 ? 15.97894 19.88338 15.23502 0.469 19.31320 C ? A ? 18 CB 1
   ATOM 224 CG A GLU A 35 ? 15.05529 21.04214 15.00515 0.469 15.14834 C ? A ? 18 CG 1
   ATOM 225 CD A GLU A 35 ? 15.78657 22.25798 14.52484 0.469 24.07497 C ? A ? 18 CD 1
   ATOM 226 OE1 A GLU A 35 ? 16.36108 22.17610 13.40914 0.469 33.79232 O ? A ? 18 OE1 1
   ATOM 227 OE2 A GLU A 35 ? 15.76672 23.28703 15.24815 0.469 18.82865 O ? A ? 18 OE2 1
   ATOM 228 N B GLU A 35 ? 16.26975 17.69365 16.27630 0.531 16.33008 N ? A ? 18 N 1
   ATOM 229 CA B GLU A 35 ? 15.38388 18.83739 16.01915 0.531 17.08007 C ? A ? 18 CA 1
   ATOM 230 C B GLU A 35 ? 14.07730 18.34013 15.41567 0.531 17.30306 C ? A ? 18 C 1
   ATOM 231 O B GLU A 35 ? 14.04338 17.92379 14.26070 0.531 15.50220 O ? A ? 18 O 1
   ATOM 232 CB B GLU A 35 ? 16.03943 19.84953 15.06908 0.531 19.16099 C ? A ? 18 CB 1
   ATOM 233 CG B GLU A 35 ? 17.31568 20.38810 15.61863 0.531 23.80971 C ? A ? 18 CG 1
   ATOM 234 CD B GLU A 35 ? 17.76105 21.71108 15.02865 0.531 38.87912 C ? A ? 18 CD 1
   ATOM 235 OE1 B GLU A 35 ? 17.21097 22.18274 14.01612 0.531 27.68464 O ? A ? 18 OE1 1
   ATOM 236 OE2 B GLU A 35 ? 18.70326 22.29491 15.59757 0.531 59.90844 O ? A ? 18 OE2 1
   ATOM 237 N A LEU A 36 ? 12.89781 18.75323 16.10300 0.469 13.43454 N ? A ? 19 N 1
   ATOM 238 CA A LEU A 36 ? 11.61160 18.37318 15.54858 0.469 14.87353 C ? A ? 19 CA 1
   ATOM 239 C A LEU A 36 ? 11.32442 19.16975 14.28199 0.469 16.45367 C ? A ? 19 C 1
   ATOM 240 O A LEU A 36 ? 11.55430 20.38621 14.23630 0.469 17.35659 O ? A ? 19 O 1
   ATOM 241 CB A LEU A 36 ? 10.51464 18.59547 16.59175 0.469 16.05766 C ? A ? 19 CB 1
   ATOM 242 CG A LEU A 36 ? 9.16931 18.02979 16.10833 0.469 18.58887 C ? A ? 19 CG 1
   ATOM 243 CD1 A LEU A 36 ? 8.32804 17.46778 17.25516 0.469 18.07125 C ? A ? 19 CD1 1
   ATOM 244 CD2 A LEU A 36 ? 8.42438 19.15359 15.45347 0.469 14.42094 C ? A ? 19 CD2 1
   ATOM 245 N B LEU A 36 ? 12.99102 18.39904 16.18707 0.531 13.59097 N ? A ? 19 N 1
   ATOM 246 CA B LEU A 36 ? 11.69685 17.99669 15.66795 0.531 15.77171 C ? A ? 19 CA 1
   ATOM 247 C B LEU A 36 ? 11.30318 18.89774 14.50680 0.531 15.73469 C ? A ? 19 C 1
   ATOM 248 O B LEU A 36 ? 11.33470 20.12511 14.62762 0.531 20.21696 O ? A ? 19 O 1
   ATOM 249 CB B LEU A 36 ? 10.67636 18.06097 16.81047 0.531 15.12839 C ? A ? 19 CB 1
   ATOM 250 CG B LEU A 36 ? 9.22080 17.60975 16.62006 0.531 14.95655 C ? A ? 19 CG 1
   ATOM 251 CD1 B LEU A 36 ? 8.60338 17.31535 18.01017 0.531 16.54662 C ? A ? 19 CD1 1
   ATOM 252 CD2 B LEU A 36 ? 8.36727 18.65129 15.82677 0.531 16.41850 C ? A ? 19 CD2 1
   ATOM 253 N A LYS A 37 ? 10.84738 18.47242 13.24230 0.469 15.99792 N ? A ? 20 N 1
   ATOM 254 CA A LYS A 37 ? 10.45385 19.06462 11.95759 0.469 18.75563 C ? A ? 20 CA 1
   ATOM 255 C A LYS A 37 ? 8.96089 18.96015 11.68671 0.469 20.66973 C ? A ? 20 C 1
   ATOM 256 O A LYS A 37 ? 8.37643 19.85698 11.04619 0.469 20.30787 O ? A ? 20 O 1
   ATOM 257 CB A LYS A 37 ? 11.20588 18.38016 10.81385 0.469 21.64645 C ? A ? 20 CB 1
   ATOM 258 CG A LYS A 37 ? 12.70955 18.68171 10.85914 0.469 27.10616 C ? A ? 20 CG 1
   ATOM 259 CD A LYS A 37 ? 12.95913 20.21806 10.90954 0.469 30.29898 C ? A ? 20 CD 1
   ATOM 260 CE A LYS A 37 ? 14.36998 20.56433 11.36307 0.469 36.29421 C ? A ? 20 CE 1
   ATOM 261 NZ A LYS A 37 ? 14.66728 22.02755 11.20106 0.469 43.06891 N ? A ? 20 NZ 1
   ATOM 262 N B LYS A 37 ? 10.96459 18.29601 13.36222 0.531 15.36427 N ? A ? 20 N 1
   ATOM 263 CA B LYS A 37 ? 10.48743 19.07031 12.20964 0.531 19.19983 C ? A ? 20 CA 1
   ATOM 264 C B LYS A 37 ? 8.96478 19.09128 12.14097 0.531 21.60741 C ? A ? 20 C 1
   ATOM 265 O B LYS A 37 ? 8.34499 20.16054 12.08968 0.531 17.44285 O ? A ? 20 O 1
   ATOM 266 CB B LYS A 37 ? 11.06649 18.50339 10.91374 0.531 21.36177 C ? A ? 20 CB 1
   ATOM 267 CG B LYS A 37 ? 12.58419 18.75033 10.81685 0.531 26.90383 C ? A ? 20 CG 1
   ATOM 268 CD B LYS A 37 ? 12.90170 20.26478 11.05191 0.531 30.15074 C ? A ? 20 CD 1
   ATOM 269 CE B LYS A 37 ? 14.39396 20.55300 11.12233 0.531 36.60574 C ? A ? 20 CE 1
   ATOM 270 NZ B LYS A 37 ? 14.69879 22.02226 11.17294 0.531 43.13079 N ? A ? 20 NZ 1
   ATOM 271 N A SER A 38 ? 8.33220 17.89253 12.18480 0.469 17.57089 N ? A ? 21 N 1
   ATOM 272 CA A SER A 38 ? 6.88856 17.71659 12.11960 0.469 20.30026 C ? A ? 21 CA 1
   ATOM 273 C A SER A 38 ? 6.47367 16.86600 13.31328 0.469 20.15003 C ? A ? 21 C 1
   ATOM 274 O A SER A 38 ? 7.23460 15.98472 13.74503 0.469 16.35845 O ? A ? 21 O 1
   ATOM 275 CB A SER A 38 ? 6.45780 17.06665 10.79413 0.469 24.62902 C ? A ? 21 CB 1
   ATOM 276 OG A SER A 38 ? 5.09606 17.34456 10.49120 0.469 26.86281 O ? A ? 21 OG 1
   ATOM 277 N B SER A 38 ? 8.34552 17.91705 12.11352 0.531 17.56610 N ? A ? 21 N 1
   ATOM 278 CA B SER A 38 ? 6.89291 17.88834 12.19144 0.531 20.55445 C ? A ? 21 CA 1
   ATOM 279 C B SER A 38 ? 6.48027 16.88199 13.25893 0.531 20.18014 C ? A ? 21 C 1
   ATOM 280 O B SER A 38 ? 7.05253 15.78157 13.34903 0.531 17.83350 O ? A ? 21 O 1
   ATOM 281 CB B SER A 38 ? 6.26882 17.56177 10.81132 0.531 27.00695 C ? A ? 21 CB 1
   ATOM 282 OG B SER A 38 ? 6.73576 16.34046 10.28603 0.531 27.48229 O ? A ? 21 OG 1
   ATOM 283 N A PRO A 39 ? 5.29100 17.08838 13.85690 0.469 17.30409 N ? A ? 22 N 1
   ATOM 284 CA A PRO A 39 ? 4.93739 16.44819 15.12147 0.469 18.58125 C ? A ? 22 CA 1
   ATOM 285 C A PRO A 39 ? 4.34857 15.07090 14.90134 0.469 20.73587 C ? A ? 22 C 1
   ATOM 286 O A PRO A 39 ? 3.59201 14.85232 13.95163 0.469 18.78387 O ? A ? 22 O 1
   ATOM 287 CB A PRO A 39 ? 3.88298 17.39643 15.71745 0.469 21.98100 C ? A ? 22 CB 1
   ATOM 288 CG A PRO A 39 ? 3.19423 17.91784 14.50139 0.469 20.01101 C ? A ? 22 CG 1
   ATOM 289 CD A PRO A 39 ? 4.28013 18.08475 13.43213 0.469 17.17290 C ? A ? 22 CD 1
   ATOM 290 N B PRO A 39 ? 5.50986 17.24093 14.08983 0.531 17.92291 N ? A ? 22 N 1
   ATOM 291 CA B PRO A 39 ? 5.23421 16.47479 15.30411 0.531 18.64788 C ? A ? 22 CA 1
   ATOM 292 C B PRO A 39 ? 4.71030 15.07772 15.01497 0.531 20.93615 C ? A ? 22 C 1
   ATOM 293 O B PRO A 39 ? 4.07306 14.81457 13.99060 0.531 21.37421 O ? A ? 22 O 1
   ATOM 294 CB B PRO A 39 ? 4.14314 17.30779 16.01344 0.531 23.55140 C ? A ? 22 CB 1
   ATOM 295 CG B PRO A 39 ? 3.51056 18.06026 14.88985 0.531 21.84596 C ? A ? 22 CG 1
   ATOM 296 CD B PRO A 39 ? 4.64716 18.44390 13.99664 0.531 18.87919 C ? A ? 22 CD 1
   ATOM 297 N A GLY A 40 ? 4.70618 14.14799 15.79627 0.469 16.53554 N ? A ? 23 N 1
   ATOM 298 CA A GLY A 40 ? 4.01158 12.87421 15.94636 0.469 14.36529 C ? A ? 23 CA 1
   ATOM 299 C A GLY A 40 ? 2.84061 13.03389 16.89900 0.469 20.29292 C ? A ? 23 C 1
   ATOM 300 O A GLY A 40 ? 2.26276 14.11846 16.97997 0.469 18.11394 O ? A ? 23 O 1
   ATOM 301 N B GLY A 40 ? 4.96092 14.18460 15.96528 0.531 15.32631 N ? A ? 23 N 1
   ATOM 302 CA B GLY A 40 ? 4.28001 12.91017 16.00731 0.531 14.10119 C ? A ? 23 CA 1
   ATOM 303 C B GLY A 40 ? 3.06291 13.00903 16.91028 0.531 20.48250 C ? A ? 23 C 1
   ATOM 304 O B GLY A 40 ? 2.72773 14.07192 17.43676 0.531 17.85071 O ? A ? 23 O 1
   ATOM 305 N A ASN A 41 ? 2.50459 11.96003 17.66903 0.469 15.27657 N ? A ? 24 N 1
   ATOM 306 CA A ASN A 41 ? 1.32999 12.00251 18.54771 0.469 16.62995 C ? A ? 24 CA 1
   ATOM 307 C A ASN A 41 ? 1.64230 12.40551 19.99869 0.469 17.65379 C ? A ? 24 C 1
   ATOM 308 O A ASN A 41 ? 0.71244 12.55708 20.80350 0.469 15.92376 O ? A ? 24 O 1
   ATOM 309 CB A ASN A 41 ? 0.54884 10.65303 18.50954 0.469 16.33288 C ? A ? 24 CB 1
   ATOM 310 CG A ASN A 41 ? 1.25905 9.45265 19.22958 0.469 19.42864 C ? A ? 24 CG 1
   ATOM 311 OD1 A ASN A 41 ? 2.19839 9.60524 20.00312 0.469 13.82921 O ? A ? 24 OD1 1
   ATOM 312 ND2 A ASN A 41 ? 0.73615 8.21863 18.96703 0.469 15.66278 N ? A ? 24 ND2 1
   ATOM 313 N B ASN A 41 ? 2.41565 11.86552 17.13610 0.531 17.07096 N ? A ? 24 N 1
   ATOM 314 CA B ASN A 41 ? 1.18047 11.97511 17.88267 0.531 15.42582 C ? A ? 24 CA 1
   ATOM 315 C B ASN A 41 ? 1.41621 12.43101 19.30668 0.531 17.40372 C ? A ? 24 C 1
   ATOM 316 O B ASN A 41 ? 0.45679 12.80349 19.97615 0.531 17.50090 O ? A ? 24 O 1
   ATOM 317 CB B ASN A 41 ? 0.38490 10.65100 17.82403 0.531 16.09661 C ? A ? 24 CB 1
   ATOM 318 CG B ASN A 41 ? 1.07360 9.46898 18.52071 0.531 19.62442 C ? A ? 24 CG 1
   ATOM 319 OD1 B ASN A 41 ? 2.02343 9.61512 19.29940 0.531 20.13114 O ? A ? 24 OD1 1
   ATOM 320 ND2 B ASN A 41 ? 0.49665 8.28177 18.31805 0.531 16.23205 N ? A ? 24 ND2 1
   ATOM 321 N A GLY A 42 ? 2.91345 12.58597 20.34861 0.469 17.74158 N ? A ? 25 N 1
   ATOM 322 CA A GLY A 42 ? 3.29372 13.03778 21.67852 0.469 18.01241 C ? A ? 25 CA 1
   ATOM 323 C A GLY A 42 ? 2.99163 12.10046 22.82724 0.469 17.19849 C ? A ? 25 C 1
   ATOM 324 O A GLY A 42 ? 3.08415 12.51106 23.98906 0.469 20.91857 O ? A ? 25 O 1
   ATOM 325 N B GLY A 42 ? 2.67714 12.51057 19.73755 0.531 18.11372 N ? A ? 25 N 1
   ATOM 326 CA B GLY A 42 ? 2.97680 13.03798 21.02737 0.531 17.94056 C ? A ? 25 CA 1
   ATOM 327 C B GLY A 42 ? 2.71468 12.13281 22.20195 0.531 19.22789 C ? A ? 25 C 1
   ATOM 328 O B GLY A 42 ? 2.94250 12.57338 23.33405 0.531 17.66870 O ? A ? 25 O 1
   ATOM 329 N A VAL A 43 ? 2.71773 10.82388 22.53591 0.469 20.12697 N ? A ? 26 N 1
   ATOM 330 CA A VAL A 43 ? 2.09932 9.89776 23.47638 0.469 17.83772 C ? A ? 26 CA 1
   ATOM 331 C A VAL A 43 ? 2.87512 8.57351 23.52152 0.469 14.99791 C ? A ? 26 C 1
   ATOM 332 O A VAL A 43 ? 3.11050 8.00403 24.59299 0.469 22.33112 O ? A ? 26 O 1
   ATOM 333 CB A VAL A 43 ? 0.62183 9.69572 23.02983 0.469 18.48216 C ? A ? 26 CB 1
   ATOM 334 CG1 A VAL A 43 ? -0.02032 8.46072 23.63120 0.469 17.55178 C ? A ? 26 CG1 1
   ATOM 335 CG2 A VAL A 43 ? -0.24993 10.98441 23.30997 0.469 14.67625 C ? A ? 26 CG2 1
   ATOM 336 N B VAL A 43 ? 2.28560 10.86893 22.00259 0.531 13.41123 N ? A ? 26 N 1
   ATOM 337 CA B VAL A 43 ? 2.12699 10.06081 23.21846 0.531 18.93775 C ? A ? 26 CA 1
   ATOM 338 C B VAL A 43 ? 2.90742 8.76057 23.10038 0.531 16.28288 C ? A ? 26 C 1
   ATOM 339 O B VAL A 43 ? 3.38261 8.22396 24.09705 0.531 18.59769 O ? A ? 26 O 1
   ATOM 340 CB B VAL A 43 ? 0.63679 9.77788 23.51494 0.531 20.47724 C ? A ? 26 CB 1
   ATOM 341 CG1 B VAL A 43 ? -0.03590 9.38624 22.23594 0.531 18.23518 C ? A ? 26 CG1 1
   ATOM 342 CG2 B VAL A 43 ? 0.47510 8.67521 24.58622 0.531 27.35476 C ? A ? 26 CG2 1
   ATOM 343 N A ASP A 44 ? 3.25749 8.07637 22.34792 0.469 17.02718 N ? A ? 27 N 1
   ATOM 344 CA A ASP A 44 ? 3.95961 6.79767 22.19943 0.469 15.83111 C ? A ? 27 CA 1
   ATOM 345 C A ASP A 44 ? 5.44281 7.07960 21.94881 0.469 17.52455 C ? A ? 27 C 1
   ATOM 346 O A ASP A 44 ? 5.80583 7.55206 20.87117 0.469 14.12217 O ? A ? 27 O 1
   ATOM 347 CB A ASP A 44 ? 3.39330 5.99950 21.01603 0.469 13.93039 C ? A ? 27 CB 1
   ATOM 348 CG A ASP A 44 ? 1.84169 5.75395 21.10724 0.469 18.27682 C ? A ? 27 CG 1
   ATOM 349 OD1 A ASP A 44 ? 1.31877 5.50354 22.21046 0.469 22.03573 O ? A ? 27 OD1 1
   ATOM 350 OD2 A ASP A 44 ? 1.16470 5.76617 20.04852 0.469 19.50474 O ? A ? 27 OD2 1
   ATOM 351 N B ASP A 44 ? 3.02763 8.23964 21.88641 0.531 15.76773 N ? A ? 27 N 1
   ATOM 352 CA B ASP A 44 ? 3.73059 6.96684 21.69421 0.531 16.97720 C ? A ? 27 CA 1
   ATOM 353 C B ASP A 44 ? 5.18600 7.22724 21.36793 0.531 18.71635 C ? A ? 27 C 1
   ATOM 354 O B ASP A 44 ? 5.48636 7.67146 20.26445 0.531 16.74165 O ? A ? 27 O 1
   ATOM 355 CB B ASP A 44 ? 3.07436 6.15929 20.58842 0.531 14.49368 C ? A ? 27 CB 1
   ATOM 356 CG B ASP A 44 ? 1.72330 5.60428 21.03651 0.531 18.33697 C ? A ? 27 CG 1
   ATOM 357 OD1 B ASP A 44 ? 1.69661 4.93901 22.10375 0.531 17.51272 O ? A ? 27 OD1 1
   ATOM 358 OD2 B ASP A 44 ? 0.73807 5.87966 20.33831 0.531 18.72189 O ? A ? 27 OD2 1
   ATOM 359 N A PHE A 45 ? 6.31089 6.74516 22.89398 0.469 14.77450 N ? A ? 28 N 1
   ATOM 360 CA A PHE A 45 ? 7.73970 6.93072 22.59828 0.469 17.51869 C ? A ? 28 CA 1
   ATOM 361 C A PHE A 45 ? 8.45860 5.59081 22.61459 0.469 17.18463 C ? A ? 28 C 1
   ATOM 362 O A PHE A 45 ? 8.20566 4.77232 23.52443 0.469 15.64819 O ? A ? 28 O 1
   ATOM 363 CB A PHE A 45 ? 8.43442 7.85736 23.61148 0.469 13.63341 C ? A ? 28 CB 1
   ATOM 364 CG A PHE A 45 ? 7.96520 9.27557 23.54184 0.469 20.98517 C ? A ? 28 CG 1
   ATOM 365 CD1 A PHE A 45 ? 6.69195 9.63464 24.01046 0.469 18.00287 C ? A ? 28 CD1 1
   ATOM 366 CD2 A PHE A 45 ? 8.80197 10.26319 23.02538 0.469 18.12832 C ? A ? 28 CD2 1
   ATOM 367 CE1 A PHE A 45 ? 6.26347 10.96140 23.94008 0.469 21.61388 C ? A ? 28 CE1 1
   ATOM 368 CE2 A PHE A 45 ? 8.38315 11.56913 22.96654 0.469 20.84919 C ? A ? 28 CE2 1
   ATOM 369 CZ A PHE A 45 ? 7.09932 11.91238 23.39380 0.469 21.14339 C ? A ? 28 CZ 1
   ATOM 370 N B PHE A 45 ? 6.08236 6.86527 22.30027 0.531 15.54634 N ? A ? 28 N 1
   ATOM 371 CA B PHE A 45 ? 7.53351 6.98123 22.16456 0.531 14.08458 C ? A ? 28 CA 1
   ATOM 372 C B PHE A 45 ? 8.18750 5.60566 22.25399 0.531 14.48762 C ? A ? 28 C 1
   ATOM 373 O B PHE A 45 ? 7.77127 4.78162 23.09841 0.531 16.90818 O ? A ? 28 O 1
   ATOM 374 CB B PHE A 45 ? 8.11383 7.84656 23.30396 0.531 15.48389 C ? A ? 28 CB 1
   ATOM 375 CG B PHE A 45 ? 7.74770 9.30215 23.20323 0.531 18.53223 C ? A ? 28 CG 1
   ATOM 376 CD1 B PHE A 45 ? 6.53308 9.77239 23.70414 0.531 19.35959 C ? A ? 28 CD1 1
   ATOM 377 CD2 B PHE A 45 ? 8.66291 10.20690 22.68450 0.531 18.00676 C ? A ? 28 CD2 1
   ATOM 378 CE1 B PHE A 45 ? 6.21728 11.14327 23.61255 0.531 21.49008 C ? A ? 28 CE1 1
   ATOM 379 CE2 B PHE A 45 ? 8.36319 11.55401 22.61250 0.531 21.97929 C ? A ? 28 CE2 1
   ATOM 380 CZ B PHE A 45 ? 7.12492 12.00896 23.03565 0.531 19.48502 C ? A ? 28 CZ 1
   ATOM 381 N A PRO A 46 ? 9.36034 5.34079 21.65194 0.469 16.34915 N ? A ? 29 N 1
   ATOM 382 CA A PRO A 46 ? 10.17581 4.11715 21.69192 0.469 20.45040 C ? A ? 29 CA 1
   ATOM 383 C A PRO A 46 ? 10.92817 3.98038 23.00592 0.469 19.54842 C ? A ? 29 C 1
   ATOM 384 O A PRO A 46 ? 11.67484 4.87955 23.39301 0.469 17.30690 O ? A ? 29 O 1
   ATOM 385 CB A PRO A 46 ? 11.17658 4.31853 20.54613 0.469 18.92321 C ? A ? 29 CB 1
   ATOM 386 CG A PRO A 46 ? 10.55393 5.25907 19.61010 0.469 17.27943 C ? A ? 29 CG 1
   ATOM 387 CD A PRO A 46 ? 9.71946 6.19209 20.49632 0.469 15.34264 C ? A ? 29 CD 1
   ATOM 388 N B PRO A 46 ? 9.24175 5.34117 21.48479 0.531 16.20325 N ? A ? 29 N 1
   ATOM 389 CA B PRO A 46 ? 9.95111 4.06509 21.64101 0.531 19.25534 C ? A ? 29 CA 1
   ATOM 390 C B PRO A 46 ? 10.68826 3.96125 22.97246 0.531 20.04206 C ? A ? 29 C 1
   ATOM 391 O B PRO A 46 ? 11.19036 4.95659 23.50779 0.531 18.12108 O ? A ? 29 O 1
   ATOM 392 CB B PRO A 46 ? 10.97531 4.06786 20.49327 0.531 20.12077 C ? A ? 29 CB 1
   ATOM 393 CG B PRO A 46 ? 10.65246 5.21478 19.59765 0.531 17.10404 C ? A ? 29 CG 1
   ATOM 394 CD B PRO A 46 ? 9.86275 6.21225 20.46329 0.531 15.19038 C ? A ? 29 CD 1
   ATOM 395 N A LYS A 47 ? 10.74901 2.84858 23.68341 0.469 20.31352 N ? A ? 30 N 1
   ATOM 396 CA A LYS A 47 ? 11.54628 2.55092 24.86662 0.469 21.64264 C ? A ? 30 CA 1
   ATOM 397 C A LYS A 47 ? 12.58662 1.49899 24.52758 0.469 20.70550 C ? A ? 30 C 1
   ATOM 398 O A LYS A 47 ? 12.48791 0.81430 23.51894 0.469 20.25572 O ? A ? 30 O 1
   ATOM 399 CB A LYS A 47 ? 10.68164 2.05014 26.03404 0.469 26.65992 C ? A ? 30 CB 1
   ATOM 400 CG A LYS A 47 ? 10.27150 0.59044 25.94694 0.469 29.73834 C ? A ? 30 CG 1
   ATOM 401 CD A LYS A 47 ? 9.24540 0.19967 27.08181 0.469 41.63915 C ? A ? 30 CD 1
   ATOM 402 CE A LYS A 47 ? 8.86408 -1.29601 27.03622 0.469 36.93101 C ? A ? 30 CE 1
   ATOM 403 NZ A LYS A 47 ? 8.27452 -1.70769 25.71377 0.469 36.22331 N ? A ? 30 NZ 1
   ATOM 404 N B LYS A 47 ? 10.80377 2.72775 23.46439 0.531 19.38452 N ? A ? 30 N 1
   ATOM 405 CA B LYS A 47 ? 11.58133 2.38486 24.65108 0.531 20.77429 C ? A ? 30 CA 1
   ATOM 406 C B LYS A 47 ? 12.59454 1.30630 24.30161 0.531 19.25535 C ? A ? 30 C 1
   ATOM 407 O B LYS A 47 ? 12.54711 0.71315 23.23471 0.531 21.53590 O ? A ? 30 O 1
   ATOM 408 CB B LYS A 47 ? 10.66993 1.88061 25.78573 0.531 25.18857 C ? A ? 30 CB 1
   ATOM 409 CG B LYS A 47 ? 9.75370 0.75247 25.32601 0.531 32.64850 C ? A ? 30 CG 1
   ATOM 410 CD B LYS A 47 ? 8.39031 0.70407 26.07653 0.531 44.72899 C ? A ? 30 CD 1
   ATOM 411 CE B LYS A 47 ? 7.71209 -0.69225 25.98119 0.531 40.15075 C ? A ? 30 CE 1
   ATOM 412 NZ B LYS A 47 ? 7.03304 -1.08667 24.67397 0.531 30.65012 N ? A ? 30 NZ 1
   ATOM 413 N A LYS A 48 ? 13.59286 1.37299 25.39804 0.469 19.37242 N ? A ? 31 N 1
   ATOM 414 CA A LYS A 48 ? 14.63908 0.37863 25.16881 0.469 23.50799 C ? A ? 31 CA 1
   ATOM 415 C A LYS A 48 ? 14.03327 -0.99217 24.89491 0.469 18.46707 C ? A ? 31 C 1
   ATOM 416 O A LYS A 48 ? 13.07104 -1.40705 25.55026 0.469 23.51067 O ? A ? 31 O 1
   ATOM 417 CB A LYS A 48 ? 15.57767 0.32094 26.38261 0.469 25.66714 C ? A ? 31 CB 1
   ATOM 418 CG A LYS A 48 ? 16.57560 -0.80224 26.32159 0.469 30.28743 C ? A ? 31 CG 1
   ATOM 419 CD A LYS A 48 ? 17.27347 -1.01269 27.67858 0.469 35.78584 C ? A ? 31 CD 1
   ATOM 420 CE A LYS A 48 ? 18.43404 -2.00257 27.53333 0.469 51.47558 C ? A ? 31 CE 1
   ATOM 421 NZ A LYS A 48 ? 19.48192 -1.49240 26.61076 0.469 32.16128 N ? A ? 31 NZ 1
   ATOM 422 N B LYS A 48 ? 13.52352 1.03572 25.22629 0.531 21.72452 N ? A ? 31 N 1
   ATOM 423 CA B LYS A 48 ? 14.58787 0.07812 24.91520 0.531 20.78377 C ? A ? 31 CA 1
   ATOM 424 C B LYS A 48 ? 13.99624 -1.28615 24.58060 0.531 20.99011 C ? A ? 31 C 1
   ATOM 425 O B LYS A 48 ? 13.11820 -1.79700 25.28987 0.531 23.23785 O ? A ? 31 O 1
   ATOM 426 CB B LYS A 48 ? 15.58769 -0.04828 26.08052 0.531 25.01935 C ? A ? 31 CB 1
   ATOM 427 CG B LYS A 48 ? 16.63993 -1.12496 25.83160 0.531 25.55323 C ? A ? 31 CG 1
   ATOM 428 CD B LYS A 48 ? 17.72454 -1.14180 26.90952 0.531 41.11745 C ? A ? 31 CD 1
   ATOM 429 CE B LYS A 48 ? 18.60546 -2.39621 26.78534 0.531 46.47716 C ? A ? 31 CE 1
   ATOM 430 NZ B LYS A 48 ? 17.82378 -3.67035 26.78724 0.531 50.45848 N ? A ? 31 NZ 1
   ATOM 431 N A GLY A 49 ? 14.54770 -1.66235 23.84889 0.469 19.84194 N ? A ? 32 N 1
   ATOM 432 CA A GLY A 49 ? 14.03811 -2.96051 23.46145 0.469 21.74176 C ? A ? 32 CA 1
   ATOM 433 C A GLY A 49 ? 12.85362 -2.94552 22.51468 0.469 20.05995 C ? A ? 32 C 1
   ATOM 434 O A GLY A 49 ? 12.48731 -4.00293 21.99196 0.469 18.97755 O ? A ? 32 O 1
   ATOM 435 N B GLY A 49 ? 14.45050 -1.86038 23.46267 0.531 18.39863 N ? A ? 32 N 1
   ATOM 436 CA B GLY A 49 ? 13.93656 -3.13406 23.00305 0.531 20.28786 C ? A ? 32 CA 1
   ATOM 437 C B GLY A 49 ? 12.81250 -3.06559 21.98301 0.531 21.71946 C ? A ? 32 C 1
   ATOM 438 O B GLY A 49 ? 12.56906 -4.07542 21.29362 0.531 20.48290 O ? A ? 32 O 1
   ATOM 439 N A ASP A 50 ? 12.23062 -1.78350 22.27185 0.469 19.52523 N ? A ? 33 N 1
   ATOM 440 CA A ASP A 50 ? 11.17263 -1.71916 21.27558 0.469 16.93802 C ? A ? 33 CA 1
   ATOM 441 C A ASP A 50 ? 11.74770 -1.86788 19.88112 0.469 18.52674 C ? A ? 33 C 1
   ATOM 442 O A ASP A 50 ? 12.90617 -1.52509 19.62456 0.469 17.44026 O ? A ? 33 O 1
   ATOM 443 CB A ASP A 50 ? 10.39685 -0.39635 21.37473 0.469 17.04185 C ? A ? 33 CB 1
   ATOM 444 CG A ASP A 50 ? 9.47833 -0.33803 22.59066 0.469 23.79702 C ? A ? 33 CG 1
   ATOM 445 OD1 A ASP A 50 ? 9.18871 -1.42063 23.16290 0.469 20.06557 O ? A ? 33 OD1 1
   ATOM 446 OD2 A ASP A 50 ? 9.06074 0.79401 22.97626 0.469 21.61166 O ? A ? 33 OD2 1
   ATOM 447 N B ASP A 50 ? 12.11317 -1.91415 21.86144 0.531 18.58893 N ? A ? 33 N 1
   ATOM 448 CA B ASP A 50 ? 11.06455 -1.79644 20.85277 0.531 14.78245 C ? A ? 33 CA 1
   ATOM 449 C B ASP A 50 ? 11.65688 -1.92555 19.46451 0.531 19.34153 C ? A ? 33 C 1
   ATOM 450 O B ASP A 50 ? 12.77295 -1.47836 19.21027 0.531 18.45398 O ? A ? 33 O 1
   ATOM 451 CB B ASP A 50 ? 10.33489 -0.43676 20.93032 0.531 16.54312 C ? A ? 33 CB 1
   ATOM 452 CG B ASP A 50 ? 9.33762 -0.33301 22.08161 0.531 19.84589 C ? A ? 33 CG 1
   ATOM 453 OD1 B ASP A 50 ? 8.99002 -1.35839 22.72561 0.531 20.86245 O ? A ? 33 OD1 1
   ATOM 454 OD2 B ASP A 50 ? 8.92020 0.82383 22.37073 0.531 18.87501 O ? A ? 33 OD2 1
   ATOM 455 N A PHE A 51 ? 10.91918 -2.40452 18.98057 0.469 17.35740 N ? A ? 34 N 1
   ATOM 456 CA A PHE A 51 ? 11.19398 -2.35284 17.55602 0.469 19.11273 C ? A ? 34 CA 1
   ATOM 457 C A PHE A 51 ? 10.73039 -1.01176 17.02294 0.469 13.81721 C ? A ? 34 C 1
   ATOM 458 O A PHE A 51 ? 9.69930 -0.47492 17.46012 0.469 18.59931 O ? A ? 34 O 1
   ATOM 459 CB A PHE A 51 ? 10.50395 -3.50820 16.83003 0.469 22.30608 C ? A ? 34 CB 1
   ATOM 460 CG A PHE A 51 ? 11.06570 -4.82574 17.18259 0.469 26.04502 C ? A ? 34 CG 1
   ATOM 461 CD1 A PHE A 51 ? 12.28512 -5.22871 16.64900 0.469 27.51844 C ? A ? 34 CD1 1
   ATOM 462 CD2 A PHE A 51 ? 10.41373 -5.65202 18.07493 0.469 22.27304 C ? A ? 34 CD2 1
   ATOM 463 CE1 A PHE A 51 ? 12.83029 -6.45734 16.98452 0.469 31.19575 C ? A ? 34 CE1 1
   ATOM 464 CE2 A PHE A 51 ? 10.95277 -6.89616 18.40512 0.469 38.39549 C ? A ? 34 CE2 1
   ATOM 465 CZ A PHE A 51 ? 12.16179 -7.28563 17.86637 0.469 30.75485 C ? A ? 34 CZ 1
   ATOM 466 N B PHE A 51 ? 10.87257 -2.49529 18.54219 0.531 15.48663 N ? A ? 34 N 1
   ATOM 467 CA B PHE A 51 ? 11.28051 -2.55887 17.14606 0.531 19.04206 C ? A ? 34 CA 1
   ATOM 468 C B PHE A 51 ? 10.67274 -1.34484 16.50080 0.531 14.35932 C ? A ? 34 C 1
   ATOM 469 O B PHE A 51 ? 9.44057 -1.19353 16.45503 0.531 17.18708 O ? A ? 34 O 1
   ATOM 470 CB B PHE A 51 ? 10.88384 -3.87399 16.48261 0.531 20.22396 C ? A ? 34 CB 1
   ATOM 471 CG B PHE A 51 ? 11.77560 -4.98353 16.90859 0.531 28.01305 C ? A ? 34 CG 1
   ATOM 472 CD1 B PHE A 51 ? 12.80066 -5.43037 16.08022 0.531 29.71253 C ? A ? 34 CD1 1
   ATOM 473 CD2 B PHE A 51 ? 11.69655 -5.46313 18.21606 0.531 24.54556 C ? A ? 34 CD2 1
   ATOM 474 CE1 B PHE A 51 ? 13.66764 -6.44807 16.51392 0.531 29.71584 C ? A ? 34 CE1 1
   ATOM 475 CE2 B PHE A 51 ? 12.54951 -6.48437 18.65867 0.531 26.99597 C ? A ? 34 CE2 1
   ATOM 476 CZ B PHE A 51 ? 13.54333 -6.96693 17.80373 0.531 31.61490 C ? A ? 34 CZ 1
   ATOM 477 N A VAL A 52 ? 11.53053 -0.41265 16.14211 0.469 15.86104 N ? A ? 35 N 1
   ATOM 478 CA A VAL A 52 ? 11.04973 0.79509 15.47802 0.469 16.20885 C ? A ? 35 CA 1
   ATOM 479 C A VAL A 52 ? 11.11766 0.62999 13.96756 0.469 18.09530 C ? A ? 35 C 1
   ATOM 480 O A VAL A 52 ? 12.01193 -0.03709 13.42579 0.469 19.50387 O ? A ? 35 O 1
   ATOM 481 CB A VAL A 52 ? 11.87041 2.03297 15.90753 0.469 15.06438 C ? A ? 35 CB 1
   ATOM 482 CG1 A VAL A 52 ? 11.49001 2.46804 17.33814 0.469 14.67134 C ? A ? 35 CG1 1
   ATOM 483 CG2 A VAL A 52 ? 13.38030 1.71942 15.80027 0.469 17.72093 C ? A ? 35 CG2 1
   ATOM 484 N B VAL A 52 ? 11.54757 -0.43515 16.03259 0.531 16.02044 N ? A ? 35 N 1
   ATOM 485 CA B VAL A 52 ? 11.05958 0.75994 15.35784 0.531 16.13814 C ? A ? 35 CA 1
   ATOM 486 C B VAL A 52 ? 11.13750 0.56924 13.85674 0.531 18.53017 C ? A ? 35 C 1
   ATOM 487 O B VAL A 52 ? 11.97643 -0.18570 13.33248 0.531 19.47770 O ? A ? 35 O 1
   ATOM 488 CB B VAL A 52 ? 11.88467 1.98764 15.79310 0.531 15.00666 C ? A ? 35 CB 1
   ATOM 489 CG1 B VAL A 52 ? 11.82763 2.07887 17.33370 0.531 14.97559 C ? A ? 35 CG1 1
   ATOM 490 CG2 B VAL A 52 ? 13.36717 1.90004 15.21208 0.531 13.78404 C ? A ? 35 CG2 1
   ATOM 491 N A THR A 53 ? 10.16816 1.26552 13.27846 0.469 14.76176 N ? A ? 36 N 1
   ATOM 492 CA A THR A 53 ? 10.14920 1.35165 11.81756 0.469 13.56721 C ? A ? 36 CA 1
   ATOM 493 C A THR A 53 ? 10.35092 2.81651 11.42913 0.469 15.77719 C ? A ? 36 C 1
   ATOM 494 O A THR A 53 ? 9.66816 3.69545 11.96774 0.469 15.80163 O ? A ? 36 O 1
   ATOM 495 CB A THR A 53 ? 8.82425 0.85141 11.24282 0.469 16.19235 C ? A ? 36 CB 1
   ATOM 496 OG1 A THR A 53 ? 8.63106 -0.50675 11.67641 0.469 19.94325 O ? A ? 36 OG1 1
   ATOM 497 CG2 A THR A 53 ? 8.85996 0.89996 9.67621 0.469 18.25662 C ? A ? 36 CG2 1
   ATOM 498 N B THR A 53 ? 10.25875 1.26606 13.13966 0.531 15.00167 N ? A ? 36 N 1
   ATOM 499 CA B THR A 53 ? 10.30090 1.31485 11.67750 0.531 13.34337 C ? A ? 36 CA 1
   ATOM 500 C B THR A 53 ? 10.47858 2.78426 11.27716 0.531 15.82001 C ? A ? 36 C 1
   ATOM 501 O B THR A 53 ? 9.67819 3.63398 11.68666 0.531 16.13071 O ? A ? 36 O 1
   ATOM 502 CB B THR A 53 ? 9.01689 0.74596 11.07519 0.531 17.39652 C ? A ? 36 CB 1
   ATOM 503 OG1 B THR A 53 ? 8.82407 -0.59068 11.58224 0.531 20.54538 O ? A ? 36 OG1 1
   ATOM 504 CG2 B THR A 53 ? 9.13757 0.71312 9.51299 0.531 17.36441 C ? A ? 36 CG2 1
   ATOM 505 N A ILE A 54 ? 11.26134 3.06137 10.48833 0.469 15.18789 N ? A ? 37 N 1
   ATOM 506 CA A ILE A 54 ? 11.83367 4.38888 10.22024 0.469 16.01113 C ? A ? 37 CA 1
   ATOM 507 C A ILE A 54 ? 12.08366 4.54596 8.73194 0.469 19.41824 C ? A ? 37 C 1
   ATOM 508 O A ILE A 54 ? 12.46503 3.58647 8.06225 0.469 16.90848 O ? A ? 37 O 1
   ATOM 509 CB A ILE A 54 ? 13.15787 4.59943 10.99223 0.469 16.22647 C ? A ? 37 CB 1
   ATOM 510 CG1 A ILE A 54 ? 12.86398 4.92947 12.43987 0.469 15.37916 C ? A ? 37 CG1 1
   ATOM 511 CG2 A ILE A 54 ? 14.00937 5.70992 10.37131 0.469 13.76252 C ? A ? 37 CG2 1
   ATOM 512 CD1 A ILE A 54 ? 14.07757 4.68813 13.37859 0.469 12.58932 C ? A ? 37 CD1 1
   ATOM 513 N B ILE A 54 ? 11.54647 3.08993 10.53700 0.531 15.54150 N ? A ? 37 N 1
   ATOM 514 CA B ILE A 54 ? 11.95500 4.47674 10.26369 0.531 15.81017 C ? A ? 37 CA 1
   ATOM 515 C B ILE A 54 ? 12.34460 4.64451 8.81133 0.531 18.97034 C ? A ? 37 C 1
   ATOM 516 O B ILE A 54 ? 13.11744 3.84920 8.28808 0.531 15.78995 O ? A ? 37 O 1
   ATOM 517 CB B ILE A 54 ? 13.13969 4.90635 11.15081 0.531 15.25911 C ? A ? 37 CB 1
   ATOM 518 CG1 B ILE A 54 ? 12.65833 5.03764 12.57531 0.531 15.72258 C ? A ? 37 CG1 1
   ATOM 519 CG2 B ILE A 54 ? 13.77562 6.21175 10.65461 0.531 14.61690 C ? A ? 37 CG2 1
   ATOM 520 CD1 B ILE A 54 ? 13.80530 5.28450 13.59595 0.531 14.92912 C ? A ? 37 CD1 1
   ATOM 521 N A HIS A 55 ? 11.84193 5.75284 8.20830 0.469 17.06601 N ? A ? 38 N 1
   ATOM 522 CA A HIS A 55 ? 12.40405 6.17102 6.92012 0.469 17.06927 C ? A ? 38 CA 1
   ATOM 523 C A HIS A 55 ? 13.44363 7.24894 7.20083 0.469 18.05323 C ? A ? 38 C 1
   ATOM 524 O A HIS A 55 ? 13.21168 8.15677 8.02380 0.469 18.04104 O ? A ? 38 O 1
   ATOM 525 CB A HIS A 55 ? 11.32629 6.70876 5.95700 0.469 18.77450 C ? A ? 38 CB 1
   ATOM 526 CG A HIS A 55 ? 10.98125 5.76344 4.84363 0.469 21.99246 C ? A ? 38 CG 1
   ATOM 527 ND1 A HIS A 55 ? 11.93537 5.01769 4.18118 0.469 21.63657 N ? A ? 38 ND1 1
   ATOM 528 CD2 A HIS A 55 ? 9.79458 5.46315 4.26229 0.469 23.77527 C ? A ? 38 CD2 1
   ATOM 529 CE1 A HIS A 55 ? 11.35126 4.28888 3.24434 0.469 27.30044 C ? A ? 38 CE1 1
   ATOM 530 NE2 A HIS A 55 ? 10.05218 4.55171 3.26323 0.469 28.17783 N ? A ? 38 NE2 1
   ATOM 531 N B HIS A 55 ? 11.84972 5.70651 8.16852 0.531 17.18354 N ? A ? 38 N 1
   ATOM 532 CA B HIS A 55 ? 12.39085 6.10745 6.86636 0.531 17.00934 C ? A ? 38 CA 1
   ATOM 533 C B HIS A 55 ? 13.45372 7.16984 7.10882 0.531 17.85121 C ? A ? 38 C 1
   ATOM 534 O B HIS A 55 ? 13.26579 8.08603 7.93780 0.531 18.27864 O ? A ? 38 O 1
   ATOM 535 CB B HIS A 55 ? 11.29757 6.64581 5.92914 0.531 18.77629 C ? A ? 38 CB 1
   ATOM 536 CG B HIS A 55 ? 10.89138 5.66822 4.86934 0.531 21.80887 C ? A ? 38 CG 1
   ATOM 537 ND1 B HIS A 55 ? 11.79422 4.80977 4.27679 0.531 21.50090 N ? A ? 38 ND1 1
   ATOM 538 CD2 B HIS A 55 ? 9.69337 5.42378 4.28603 0.531 23.68607 C ? A ? 38 CD2 1
   ATOM 539 CE1 B HIS A 55 ? 11.17187 4.07921 3.36569 0.531 27.62783 C ? A ? 38 CE1 1
   ATOM 540 NE2 B HIS A 55 ? 9.89489 4.43578 3.34975 0.531 28.46143 N ? A ? 38 NE2 1
   ATOM 541 N A TYR A 56 ? 14.60972 7.12667 6.58309 0.469 14.83869 N ? A ? 39 N 1
   ATOM 542 CA A TYR A 56 ? 15.62430 8.16089 6.77009 0.469 15.18730 C ? A ? 39 CA 1
   ATOM 543 C A TYR A 56 ? 16.27790 8.52680 5.44947 0.469 16.37287 C ? A ? 39 C 1
   ATOM 544 O A TYR A 56 ? 16.15074 7.81975 4.44021 0.469 17.82230 O ? A ? 39 O 1
   ATOM 545 CB A TYR A 56 ? 16.73660 7.72276 7.73490 0.469 14.99409 C ? A ? 39 CB 1
   ATOM 546 CG A TYR A 56 ? 17.61205 6.57623 7.20976 0.469 15.94670 C ? A ? 39 CG 1
   ATOM 547 CD1 A TYR A 56 ? 17.20731 5.24781 7.35224 0.469 19.00140 C ? A ? 39 CD1 1
   ATOM 548 CD2 A TYR A 56 ? 18.83886 6.83798 6.56763 0.469 12.69345 C ? A ? 39 CD2 1
   ATOM 549 CE1 A TYR A 56 ? 17.96534 4.20378 6.86207 0.469 19.42783 C ? A ? 39 CE1 1
   ATOM 550 CE2 A TYR A 56 ? 19.61712 5.80340 6.08539 0.469 14.71686 C ? A ? 39 CE2 1
   ATOM 551 CZ A TYR A 56 ? 19.17533 4.47517 6.24829 0.469 19.23441 C ? A ? 39 CZ 1
   ATOM 552 OH A TYR A 56 ? 19.94124 3.42004 5.78171 0.469 20.94982 O ? A ? 39 OH 1
   ATOM 553 N B TYR A 56 ? 14.59545 7.02593 6.45422 0.531 14.80813 N ? A ? 39 N 1
   ATOM 554 CA B TYR A 56 ? 15.65163 8.00132 6.71629 0.531 15.31004 C ? A ? 39 CA 1
   ATOM 555 C B TYR A 56 ? 16.41279 8.38838 5.45535 0.531 16.40566 C ? A ? 39 C 1
   ATOM 556 O B TYR A 56 ? 16.50507 7.61577 4.48696 0.531 16.66147 O ? A ? 39 O 1
   ATOM 557 CB B TYR A 56 ? 16.65050 7.46118 7.73271 0.531 14.96229 C ? A ? 39 CB 1
   ATOM 558 CG B TYR A 56 ? 17.50174 6.31278 7.22292 0.531 16.16078 C ? A ? 39 CG 1
   ATOM 559 CD1 B TYR A 56 ? 18.71727 6.56298 6.58331 0.531 13.39411 C ? A ? 39 CD1 1
   ATOM 560 CD2 B TYR A 56 ? 17.08329 4.98490 7.37695 0.531 18.59427 C ? A ? 39 CD2 1
   ATOM 561 CE1 B TYR A 56 ? 19.48306 5.54063 6.11775 0.531 14.70986 C ? A ? 39 CE1 1
   ATOM 562 CE2 B TYR A 56 ? 17.83553 3.93046 6.88217 0.531 17.97475 C ? A ? 39 CE2 1
   ATOM 563 CZ B TYR A 56 ? 19.04792 4.21902 6.27381 0.531 19.44013 C ? A ? 39 CZ 1
   ATOM 564 OH B TYR A 56 ? 19.85403 3.21294 5.79785 0.531 20.47428 O ? A ? 39 OH 1
   ATOM 565 N A THR A 57 ? 17.01722 9.63863 5.49634 0.469 17.66546 N ? A ? 40 N 1
   ATOM 566 CA A THR A 57 ? 18.03264 9.96354 4.50079 0.469 17.05689 C ? A ? 40 CA 1
   ATOM 567 C A THR A 57 ? 19.19865 10.59122 5.25452 0.469 19.52485 C ? A ? 40 C 1
   ATOM 568 O A THR A 57 ? 18.98662 11.49516 6.06724 0.469 17.02531 O ? A ? 40 O 1
   ATOM 569 CB A THR A 57 ? 17.48227 10.92120 3.42650 0.469 19.86507 C ? A ? 40 CB 1
   ATOM 570 OG1 A THR A 57 ? 16.56345 10.22365 2.56814 0.469 17.68376 O ? A ? 40 OG1 1
   ATOM 571 CG2 A THR A 57 ? 18.62857 11.45399 2.58086 0.469 19.44311 C ? A ? 40 CG2 1
   ATOM 572 N B THR A 57 ? 17.02726 9.57569 5.53087 0.531 17.67426 N ? A ? 40 N 1
   ATOM 573 CA B THR A 57 ? 18.03746 10.03300 4.58136 0.531 17.15881 C ? A ? 40 CA 1
   ATOM 574 C B THR A 57 ? 19.27971 10.41123 5.37712 0.531 19.29931 C ? A ? 40 C 1
   ATOM 575 O B THR A 57 ? 19.18431 11.15953 6.34601 0.531 19.15126 O ? A ? 40 O 1
   ATOM 576 CB B THR A 57 ? 17.49622 11.22435 3.77029 0.531 17.62863 C ? A ? 40 CB 1
   ATOM 577 OG1 B THR A 57 ? 16.40497 10.76223 2.97005 0.531 19.67224 O ? A ? 40 OG1 1
   ATOM 578 CG2 B THR A 57 ? 18.58290 11.77464 2.80836 0.531 20.85329 C ? A ? 40 CG2 1
   ATOM 579 N A GLY A 58 ? 20.41984 10.12619 4.99152 0.469 15.28673 N ? A ? 41 N 1
   ATOM 580 CA A GLY A 58 ? 21.60382 10.55855 5.71981 0.469 14.78548 C ? A ? 41 CA 1
   ATOM 581 C A GLY A 58 ? 22.56192 11.34979 4.84003 0.469 16.27522 C ? A ? 41 C 1
   ATOM 582 O A GLY A 58 ? 22.88367 10.92995 3.71500 0.469 18.31406 O ? A ? 41 O 1
   ATOM 583 N B GLY A 58 ? 20.44021 9.86895 5.00981 0.531 15.23443 N ? A ? 41 N 1
   ATOM 584 CA B GLY A 58 ? 21.69214 10.22718 5.65855 0.531 13.47940 C ? A ? 41 CA 1
   ATOM 585 C B GLY A 58 ? 22.48002 11.17686 4.77200 0.531 17.34004 C ? A ? 41 C 1
   ATOM 586 O B GLY A 58 ? 22.66056 10.90607 3.57848 0.531 18.45155 O ? A ? 41 O 1
   ATOM 587 N A ARG A 59 ? 23.02714 12.48303 5.36316 0.469 16.94614 N ? A ? 42 N 1
   ATOM 588 CA A ARG A 59 ? 23.93261 13.36204 4.62342 0.469 16.48359 C ? A ? 42 CA 1
   ATOM 589 C A ARG A 59 ? 25.13259 13.76268 5.47465 0.469 19.56834 C ? A ? 42 C 1
   ATOM 590 O A ARG A 59 ? 25.08820 13.72237 6.70341 0.469 18.36801 O ? A ? 42 O 1
   ATOM 591 CB A ARG A 59 ? 23.18364 14.62370 4.19352 0.469 17.64337 C ? A ? 42 CB 1
   ATOM 592 CG A ARG A 59 ? 21.98154 14.32056 3.32925 0.469 19.82203 C ? A ? 42 CG 1
   ATOM 593 CD A ARG A 59 ? 21.25812 15.63664 2.93753 0.469 26.22869 C ? A ? 42 CD 1
   ATOM 594 NE A ARG A 59 ? 20.05933 15.35376 2.14739 0.469 23.56295 N ? A ? 42 NE 1
   ATOM 595 CZ A ARG A 59 ? 20.05074 15.14974 0.83846 0.469 29.33690 C ? A ? 42 CZ 1
   ATOM 596 NH1 A ARG A 59 ? 21.15843 15.25893 0.11678 0.469 27.31962 N ? A ? 42 NH1 1
   ATOM 597 NH2 A ARG A 59 ? 18.89766 14.82707 0.23824 0.469 29.75424 N ? A ? 42 NH2 1
   ATOM 598 N B ARG A 59 ? 22.94219 12.28394 5.35343 0.531 16.62337 N ? A ? 42 N 1
   ATOM 599 CA B ARG A 59 ? 23.79309 13.23622 4.63276 0.531 16.73785 C ? A ? 42 CA 1
   ATOM 600 C B ARG A 59 ? 25.04309 13.58170 5.42861 0.531 19.40325 C ? A ? 42 C 1
   ATOM 601 O B ARG A 59 ? 25.02488 13.64839 6.65665 0.531 18.42089 O ? A ? 42 O 1
   ATOM 602 CB B ARG A 59 ? 23.03688 14.54006 4.35511 0.531 16.90410 C ? A ? 42 CB 1
   ATOM 603 CG B ARG A 59 ? 21.86174 14.35364 3.45165 0.531 20.06802 C ? A ? 42 CG 1
   ATOM 604 CD B ARG A 59 ? 21.13137 15.70540 3.19845 0.531 25.94193 C ? A ? 42 CD 1
   ATOM 605 NE B ARG A 59 ? 19.98710 15.47079 2.31356 0.531 24.16275 N ? A ? 42 NE 1
   ATOM 606 CZ B ARG A 59 ? 20.08245 15.28526 1.00519 0.531 28.82326 C ? A ? 42 CZ 1
   ATOM 607 NH1 B ARG A 59 ? 21.23918 15.43702 0.37064 0.531 27.03048 N ? A ? 42 NH1 1
   ATOM 608 NH2 B ARG A 59 ? 18.98435 14.94281 0.31486 0.531 30.01834 N ? A ? 42 NH2 1
   ATOM 609 N A LEU A 60 ? 26.21771 14.18796 4.80522 0.469 16.55428 N ? A ? 43 N 1
   ATOM 610 CA A LEU A 60 ? 27.34796 14.78370 5.48664 0.469 14.09004 C ? A ? 43 CA 1
   ATOM 611 C A LEU A 60 ? 27.15353 16.29960 5.63118 0.469 17.41830 C ? A ? 43 C 1
   ATOM 612 O A LEU A 60 ? 26.15383 16.89392 5.19775 0.469 22.28749 O ? A ? 43 O 1
   ATOM 613 CB A LEU A 60 ? 28.66203 14.44668 4.74430 0.469 18.37935 C ? A ? 43 CB 1
   ATOM 614 CG A LEU A 60 ? 29.06052 12.97689 4.52993 0.469 17.32635 C ? A ? 43 CG 1
   ATOM 615 CD1 A LEU A 60 ? 30.35217 12.89707 3.71051 0.469 18.34165 C ? A ? 43 CD1 1
   ATOM 616 CD2 A LEU A 60 ? 29.21380 12.21609 5.86028 0.469 17.54968 C ? A ? 43 CD2 1
   ATOM 617 N B LEU A 60 ? 26.13546 13.84475 4.70810 0.531 18.49805 N ? A ? 43 N 1
   ATOM 618 CA B LEU A 60 ? 27.26993 14.52807 5.28273 0.531 14.01011 C ? A ? 43 CA 1
   ATOM 619 C B LEU A 60 ? 26.98221 16.02989 5.39750 0.531 18.36730 C ? A ? 43 C 1
   ATOM 620 O B LEU A 60 ? 26.01406 16.55479 4.81111 0.531 23.13602 O ? A ? 43 O 1
   ATOM 621 CB B LEU A 60 ? 28.51405 14.23939 4.40832 0.531 16.94027 C ? A ? 43 CB 1
   ATOM 622 CG B LEU A 60 ? 28.59299 12.74663 4.09137 0.531 16.65826 C ? A ? 43 CG 1
   ATOM 623 CD1 B LEU A 60 ? 29.73156 12.42542 3.08686 0.531 16.31194 C ? A ? 43 CD1 1
   ATOM 624 CD2 B LEU A 60 ? 28.79303 11.96544 5.36530 0.531 17.21209 C ? A ? 43 CD2 1
   ATOM 625 N A THR A 61 ? 28.13259 16.95674 6.23100 0.469 20.93719 N ? A ? 44 N 1
   ATOM 626 CA A THR A 61 ? 27.90876 18.36315 6.56421 0.469 23.35880 C ? A ? 44 CA 1
   ATOM 627 C A THR A 61 ? 27.84334 19.23048 5.31548 0.469 29.02419 C ? A ? 44 C 1
   ATOM 628 O A THR A 61 ? 27.20215 20.28672 5.34038 0.469 28.66687 O ? A ? 44 O 1
   ATOM 629 CB A THR A 61 ? 29.00623 18.86159 7.49083 0.469 29.82574 C ? A ? 44 CB 1
   ATOM 630 OG1 A THR A 61 ? 30.26880 18.46179 6.94526 0.469 25.96246 O ? A ? 44 OG1 1
   ATOM 631 CG2 A THR A 61 ? 28.81707 18.25858 8.90403 0.469 20.34363 C ? A ? 44 CG2 1
   ATOM 632 N B THR A 61 ? 27.84638 16.74196 6.13437 0.531 19.33338 N ? A ? 44 N 1
   ATOM 633 CA B THR A 61 ? 27.59944 18.16505 6.42559 0.531 23.76330 C ? A ? 44 CA 1
   ATOM 634 C B THR A 61 ? 27.96924 19.06624 5.25102 0.531 29.17596 C ? A ? 44 C 1
   ATOM 635 O B THR A 61 ? 27.78752 20.28551 5.36045 0.531 28.49298 O ? A ? 44 O 1
   ATOM 636 CB B THR A 61 ? 28.34384 18.68230 7.69706 0.531 29.82292 C ? A ? 44 CB 1
   ATOM 637 OG1 B THR A 61 ? 29.78197 18.60059 7.57675 0.531 24.47530 O ? A ? 44 OG1 1
   ATOM 638 CG2 B THR A 61 ? 27.91526 17.97027 8.98880 0.531 21.81804 C ? A ? 44 CG2 1
   ATOM 639 N A ASP A 62 ? 28.48990 18.80662 4.22230 0.469 29.23796 N ? A ? 45 N 1
   ATOM 640 CA A ASP A 62 ? 28.40758 19.57190 2.98085 0.469 30.82930 C ? A ? 45 CA 1
   ATOM 641 C A ASP A 62 ? 27.07280 19.38704 2.29076 0.469 32.03765 C ? A ? 45 C 1
   ATOM 642 O A ASP A 62 ? 26.77350 20.10959 1.34090 0.469 32.09593 O ? A ? 45 O 1
   ATOM 643 CB A ASP A 62 ? 29.54573 19.20134 2.01251 0.469 34.07763 C ? A ? 45 CB 1
   ATOM 644 CG A ASP A 62 ? 29.59677 17.70692 1.67251 0.469 39.03975 C ? A ? 45 CG 1
   ATOM 645 OD1 A ASP A 62 ? 28.61280 16.97997 1.95800 0.469 33.89996 O ? A ? 45 OD1 1
   ATOM 646 OD2 A ASP A 62 ? 30.63752 17.25366 1.12096 0.469 40.29028 O ? A ? 45 OD2 1
   ATOM 647 N B ASP A 62 ? 28.49356 18.51109 4.14815 0.531 27.73181 N ? A ? 45 N 1
   ATOM 648 CA B ASP A 62 ? 28.53467 19.25699 2.89063 0.531 32.08309 C ? A ? 45 CA 1
   ATOM 649 C B ASP A 62 ? 27.25709 19.06066 2.10922 0.531 33.18216 C ? A ? 45 C 1
   ATOM 650 O B ASP A 62 ? 27.18561 19.42843 0.93199 0.531 32.22475 O ? A ? 45 O 1
   ATOM 651 CB B ASP A 62 ? 29.74988 18.85621 2.03635 0.531 35.38047 C ? A ? 45 CB 1
   ATOM 652 CG B ASP A 62 ? 29.61939 17.46453 1.39456 0.531 39.89042 C ? A ? 45 CG 1
   ATOM 653 OD1 B ASP A 62 ? 28.84828 16.60691 1.88808 0.531 32.77299 O ? A ? 45 OD1 1
   ATOM 654 OD2 B ASP A 62 ? 30.32975 17.20891 0.39679 0.531 40.55686 O ? A ? 45 OD2 1
   ATOM 655 N . GLY A 63 ? 26.25824 18.43619 2.73428 1.000 28.30706 N ? A ? 46 N 1
   ATOM 656 CA . GLY A 63 ? 24.98574 18.22724 2.12167 1.000 21.26568 C ? A ? 46 CA 1
   ATOM 657 C . GLY A 63 ? 24.88498 16.96965 1.29317 1.000 23.68756 C ? A ? 46 C 1
   ATOM 658 O . GLY A 63 ? 23.78397 16.60653 0.91259 1.000 31.37355 O ? A ? 46 O 1
   ATOM 659 N A SER A 64 ? 25.99248 16.31355 0.98416 0.443 26.65884 N ? A ? 47 N 1
   ATOM 660 CA A SER A 64 ? 25.92359 15.17051 0.09237 0.443 25.67070 C ? A ? 47 CA 1
   ATOM 661 C A SER A 64 ? 25.23988 14.00151 0.78921 0.443 25.18170 C ? A ? 47 C 1
   ATOM 662 O A SER A 64 ? 25.58927 13.64585 1.92374 0.443 23.65605 O ? A ? 47 O 1
   ATOM 663 CB A SER A 64 ? 27.31623 14.77386 -0.37882 0.443 30.49766 C ? A ? 47 CB 1
   ATOM 664 OG A SER A 64 ? 28.17316 14.56186 0.72162 0.443 33.97557 O ? A ? 47 OG 1
   ATOM 665 N B SER A 64 ? 25.99277 16.30123 0.99362 0.557 26.60639 N ? A ? 47 N 1
   ATOM 666 CA B SER A 64 ? 25.92309 15.15183 0.10562 0.557 25.65371 C ? A ? 47 CA 1
   ATOM 667 C B SER A 64 ? 25.25039 13.97094 0.80023 0.557 25.23027 C ? A ? 47 C 1
   ATOM 668 O B SER A 64 ? 25.34472 13.80428 2.01900 0.557 23.87692 O ? A ? 47 O 1
   ATOM 669 CB B SER A 64 ? 27.31131 14.74915 -0.36781 0.557 30.48072 C ? A ? 47 CB 1
   ATOM 670 OG B SER A 64 ? 28.06015 14.20891 0.70073 0.557 33.53545 O ? A ? 47 OG 1
   ATOM 671 N A LYS A 65 ? 24.24970 13.43514 0.11863 0.443 21.32620 N ? A ? 48 N 1
   ATOM 672 CA A LYS A 65 ? 23.65107 12.19088 0.58649 0.443 22.47260 C ? A ? 48 CA 1
   ATOM 673 C A LYS A 65 ? 24.73347 11.12399 0.67549 0.443 21.83524 C ? A ? 48 C 1
   ATOM 674 O A LYS A 65 ? 25.58754 11.02220 -0.20274 0.443 24.15337 O ? A ? 48 O 1
   ATOM 675 CB A LYS A 65 ? 22.54632 11.76149 -0.39085 0.443 24.60762 C ? A ? 48 CB 1
   ATOM 676 CG A LYS A 65 ? 21.82437 10.43605 -0.09176 0.443 20.93467 C ? A ? 48 CG 1
   ATOM 677 CD A LYS A 65 ? 20.63043 10.22015 -1.05713 0.443 26.32731 C ? A ? 48 CD 1
   ATOM 678 CE A LYS A 65 ? 19.67235 11.41869 -0.98996 0.443 25.44838 C ? A ? 48 CE 1
   ATOM 679 NZ A LYS A 65 ? 18.68897 11.48082 -2.12919 0.443 23.82407 N ? A ? 48 NZ 1
   ATOM 680 N B LYS A 65 ? 24.63164 13.12204 0.00477 0.557 19.78650 N ? A ? 48 N 1
   ATOM 681 CA B LYS A 65 ? 23.74432 12.07375 0.51181 0.557 22.84606 C ? A ? 48 CA 1
   ATOM 682 C B LYS A 65 ? 24.46821 10.73073 0.44527 0.557 25.43988 C ? A ? 48 C 1
   ATOM 683 O B LYS A 65 ? 24.94352 10.32825 -0.62235 0.557 21.81969 O ? A ? 48 O 1
   ATOM 684 CB B LYS A 65 ? 22.44551 12.04561 -0.29933 0.557 24.36246 C ? A ? 48 CB 1
   ATOM 685 CG B LYS A 65 ? 21.48863 10.92163 0.07484 0.557 20.63087 C ? A ? 48 CG 1
   ATOM 686 CD B LYS A 65 ? 20.22823 10.84141 -0.82786 0.557 26.55990 C ? A ? 48 CD 1
   ATOM 687 CE B LYS A 65 ? 20.60035 10.76558 -2.29539 0.557 36.08032 C ? A ? 48 CE 1
   ATOM 688 NZ B LYS A 65 ? 19.38026 10.66013 -3.13000 0.557 36.32023 N ? A ? 48 NZ 1
   ATOM 689 N A PHE A 66 ? 24.68793 10.29886 1.72786 0.443 19.25700 N ? A ? 49 N 1
   ATOM 690 CA A PHE A 66 ? 25.42967 9.04781 1.68308 0.443 17.47008 C ? A ? 49 CA 1
   ATOM 691 C A PHE A 66 ? 24.55595 7.80554 1.71985 0.443 18.80704 C ? A ? 49 C 1
   ATOM 692 O A PHE A 66 ? 25.04079 6.73524 1.35271 0.443 16.75534 O ? A ? 49 O 1
   ATOM 693 CB A PHE A 66 ? 26.45983 8.95666 2.81789 0.443 18.65599 C ? A ? 49 CB 1
   ATOM 694 CG A PHE A 66 ? 25.89087 9.10803 4.21838 0.443 18.01812 C ? A ? 49 CG 1
   ATOM 695 CD1 A PHE A 66 ? 25.25037 8.03571 4.87939 0.443 19.11094 C ? A ? 49 CD1 1
   ATOM 696 CD2 A PHE A 66 ? 26.06532 10.28665 4.90647 0.443 18.02811 C ? A ? 49 CD2 1
   ATOM 697 CE1 A PHE A 66 ? 24.76733 8.18670 6.19300 0.443 15.93988 C ? A ? 49 CE1 1
   ATOM 698 CE2 A PHE A 66 ? 25.60368 10.43936 6.20632 0.443 14.85470 C ? A ? 49 CE2 1
   ATOM 699 CZ A PHE A 66 ? 24.93845 9.38740 6.85889 0.443 17.43067 C ? A ? 49 CZ 1
   ATOM 700 N B PHE A 66 ? 24.55849 10.02486 1.58180 0.557 19.32657 N ? A ? 49 N 1
   ATOM 701 CA B PHE A 66 ? 25.25218 8.74464 1.54318 0.557 18.06658 C ? A ? 49 CA 1
   ATOM 702 C B PHE A 66 ? 24.31886 7.54050 1.58168 0.557 19.23104 C ? A ? 49 C 1
   ATOM 703 O B PHE A 66 ? 24.75588 6.43346 1.23179 0.557 20.35355 O ? A ? 49 O 1
   ATOM 704 CB B PHE A 66 ? 26.28045 8.63683 2.68673 0.557 19.41682 C ? A ? 49 CB 1
   ATOM 705 CG B PHE A 66 ? 25.69602 8.76319 4.08451 0.557 20.26426 C ? A ? 49 CG 1
   ATOM 706 CD1 B PHE A 66 ? 25.12218 7.64590 4.75542 0.557 16.11613 C ? A ? 49 CD1 1
   ATOM 707 CD2 B PHE A 66 ? 25.78787 9.96309 4.75778 0.557 17.40653 C ? A ? 49 CD2 1
   ATOM 708 CE1 B PHE A 66 ? 24.63406 7.78063 6.05892 0.557 17.36833 C ? A ? 49 CE1 1
   ATOM 709 CE2 B PHE A 66 ? 25.31327 10.09420 6.05550 0.557 17.46801 C ? A ? 49 CE2 1
   ATOM 710 CZ B PHE A 66 ? 24.71323 8.99615 6.70824 0.557 16.09824 C ? A ? 49 CZ 1
   ATOM 711 N A ASP A 67 ? 23.29800 7.91482 2.15674 0.443 16.70209 N ? A ? 50 N 1
   ATOM 712 CA A ASP A 67 ? 22.36814 6.79717 2.06976 0.443 17.37829 C ? A ? 50 CA 1
   ATOM 713 C A ASP A 67 ? 20.96213 7.35155 2.24106 0.443 20.17461 C ? A ? 50 C 1
   ATOM 714 O A ASP A 67 ? 20.76995 8.46304 2.76627 0.443 18.76011 O ? A ? 50 O 1
   ATOM 715 CB A ASP A 67 ? 22.70467 5.72938 3.11933 0.443 19.21250 C ? A ? 50 CB 1
   ATOM 716 CG A ASP A 67 ? 21.91270 4.43520 2.94137 0.443 25.79560 C ? A ? 50 CG 1
   ATOM 717 OD1 A ASP A 67 ? 21.41267 4.17738 1.82559 0.443 26.32999 O ? A ? 50 OD1 1
   ATOM 718 OD2 A ASP A 67 ? 21.82313 3.66052 3.92018 0.443 24.50225 O ? A ? 50 OD2 1
   ATOM 719 N B ASP A 67 ? 23.06178 7.71330 2.01774 0.557 16.87483 N ? A ? 50 N 1
   ATOM 720 CA B ASP A 67 ? 22.10622 6.60815 2.01343 0.557 16.83860 C ? A ? 50 CA 1
   ATOM 721 C B ASP A 67 ? 20.70268 7.17814 2.17047 0.557 20.50683 C ? A ? 50 C 1
   ATOM 722 O B ASP A 67 ? 20.51092 8.29157 2.70019 0.557 20.36929 O ? A ? 50 O 1
   ATOM 723 CB B ASP A 67 ? 22.42058 5.60929 3.13792 0.557 20.00375 C ? A ? 50 CB 1
   ATOM 724 CG B ASP A 67 ? 21.65990 4.27834 3.00794 0.557 25.24842 C ? A ? 50 CG 1
   ATOM 725 OD1 B ASP A 67 ? 21.12426 3.97623 1.92700 0.557 25.58085 O ? A ? 50 OD1 1
   ATOM 726 OD2 B ASP A 67 ? 21.63981 3.51390 3.99465 0.557 25.30208 O ? A ? 50 OD2 1
   ATOM 727 N A SER A 68 ? 19.97753 6.57041 1.78565 0.443 19.70422 N ? A ? 51 N 1
   ATOM 728 CA A SER A 68 ? 18.57666 6.94232 1.99536 0.443 19.85858 C ? A ? 51 CA 1
   ATOM 729 C A SER A 68 ? 17.69883 5.71541 1.88836 0.443 20.91828 C ? A ? 51 C 1
   ATOM 730 O A SER A 68 ? 17.73134 5.03139 0.85559 0.443 21.50208 O ? A ? 51 O 1
   ATOM 731 CB A SER A 68 ? 18.13077 7.95509 0.94695 0.443 20.92855 C ? A ? 51 CB 1
   ATOM 732 OG A SER A 68 ? 16.72002 7.82603 0.79043 0.443 26.35356 O ? A ? 51 OG 1
   ATOM 733 N B SER A 68 ? 19.71679 6.38260 1.74871 0.557 18.83539 N ? A ? 51 N 1
   ATOM 734 CA B SER A 68 ? 18.32200 6.74491 2.01279 0.557 17.77314 C ? A ? 51 CA 1
   ATOM 735 C B SER A 68 ? 17.48283 5.49669 1.92211 0.557 22.46069 C ? A ? 51 C 1
   ATOM 736 O B SER A 68 ? 17.50384 4.81877 0.88546 0.557 21.75993 O ? A ? 51 O 1
   ATOM 737 CB B SER A 68 ? 17.81928 7.78231 0.98996 0.557 21.87203 C ? A ? 51 CB 1
   ATOM 738 OG B SER A 68 ? 16.46786 8.16080 1.28924 0.557 17.40606 O ? A ? 51 OG 1
   ATOM 739 N A SER A 69 ? 16.88881 5.45078 2.91501 0.443 17.30214 N ? A ? 52 N 1
   ATOM 740 CA A SER A 69 ? 15.85946 4.42621 2.78033 0.443 20.89979 C ? A ? 52 CA 1
   ATOM 741 C A SER A 69 ? 14.67750 4.91862 1.94741 0.443 19.80802 C ? A ? 52 C 1
   ATOM 742 O A SER A 69 ? 13.90290 4.10627 1.42955 0.443 20.70646 O ? A ? 52 O 1
   ATOM 743 CB A SER A 69 ? 15.33272 3.99106 4.14896 0.443 18.06528 C ? A ? 52 CB 1
   ATOM 744 OG A SER A 69 ? 14.61684 5.05777 4.76535 0.443 19.71457 O ? A ? 52 OG 1
   ATOM 745 N B SER A 69 ? 16.73375 5.18331 2.97869 0.557 17.02574 N ? A ? 52 N 1
   ATOM 746 CA B SER A 69 ? 15.80398 4.07208 2.83488 0.557 20.64494 C ? A ? 52 CA 1
   ATOM 747 C B SER A 69 ? 14.65829 4.44760 1.88994 0.557 20.36941 C ? A ? 52 C 1
   ATOM 748 O B SER A 69 ? 14.01553 3.57123 1.30769 0.557 21.75660 O ? A ? 52 O 1
   ATOM 749 CB B SER A 69 ? 15.22610 3.64890 4.18909 0.557 18.27086 C ? A ? 52 CB 1
   ATOM 750 OG B SER A 69 ? 14.43968 4.67413 4.79095 0.557 20.37509 O ? A ? 52 OG 1
   ATOM 751 N A VAL A 70 ? 14.50147 6.23491 1.86515 0.443 23.23300 N ? A ? 53 N 1
   ATOM 752 CA A VAL A 70 ? 13.38908 6.79597 1.10667 0.443 22.53232 C ? A ? 53 CA 1
   ATOM 753 C A VAL A 70 ? 13.55217 6.46320 -0.37049 0.443 21.89413 C ? A ? 53 C 1
   ATOM 754 O A VAL A 70 ? 12.60832 5.99720 -1.02343 0.443 25.73359 O ? A ? 53 O 1
   ATOM 755 CB A VAL A 70 ? 13.29777 8.31712 1.32884 0.443 18.13613 C ? A ? 53 CB 1
   ATOM 756 CG1 A VAL A 70 ? 12.26177 8.89976 0.40037 0.443 21.94029 C ? A ? 53 CG1 1
   ATOM 757 CG2 A VAL A 70 ? 12.92229 8.65873 2.78739 0.443 19.46583 C ? A ? 53 CG2 1
   ATOM 758 N B VAL A 70 ? 14.35952 5.74059 1.79154 0.557 19.17878 N ? A ? 53 N 1
   ATOM 759 CA B VAL A 70 ? 13.27818 6.21587 0.93692 0.557 23.68523 C ? A ? 53 CA 1
   ATOM 760 C B VAL A 70 ? 13.62293 5.92732 -0.52288 0.557 22.86399 C ? A ? 53 C 1
   ATOM 761 O B VAL A 70 ? 12.74979 5.53896 -1.30512 0.557 29.48140 O ? A ? 53 O 1
   ATOM 762 CB B VAL A 70 ? 13.01757 7.72478 1.18997 0.557 21.27496 C ? A ? 53 CB 1
   ATOM 763 CG1 B VAL A 70 ? 11.87561 8.25959 0.33146 0.557 25.32940 C ? A ? 53 CG1 1
   ATOM 764 CG2 B VAL A 70 ? 12.68062 7.97523 2.64580 0.557 23.19039 C ? A ? 53 CG2 1
   ATOM 765 N A ASP A 71 ? 14.78309 6.65082 -0.89388 0.443 25.36120 N ? A ? 54 N 1
   ATOM 766 CA A ASP A 71 ? 15.02397 6.53490 -2.33300 0.443 28.72025 C ? A ? 54 CA 1
   ATOM 767 C A ASP A 71 ? 14.83796 5.09697 -2.81042 0.443 28.47216 C ? A ? 54 C 1
   ATOM 768 O A ASP A 71 ? 14.33963 4.85890 -3.92355 0.443 21.32506 O ? A ? 54 O 1
   ATOM 769 CB A ASP A 71 ? 16.43194 7.03869 -2.66509 0.443 25.08554 C ? A ? 54 CB 1
   ATOM 770 CG A ASP A 71 ? 16.59415 8.56355 -2.48489 0.443 23.77143 C ? A ? 54 CG 1
   ATOM 771 OD1 A ASP A 71 ? 15.59713 9.28354 -2.22927 0.443 30.97909 O ? A ? 54 OD1 1
   ATOM 772 OD2 A ASP A 71 ? 17.73607 9.02913 -2.60364 0.443 30.93498 O ? A ? 54 OD2 1
   ATOM 773 N B ASP A 71 ? 14.91605 6.06985 -0.89333 0.557 25.59192 N ? A ? 54 N 1
   ATOM 774 CA B ASP A 71 ? 15.33537 5.94074 -2.29852 0.557 27.12854 C ? A ? 54 CA 1
   ATOM 775 C B ASP A 71 ? 15.26800 4.51247 -2.78829 0.557 31.58777 C ? A ? 54 C 1
   ATOM 776 O B ASP A 71 ? 15.29840 4.27714 -4.01489 0.557 23.38624 O ? A ? 54 O 1
   ATOM 777 CB B ASP A 71 ? 16.75457 6.46873 -2.50909 0.557 22.98320 C ? A ? 54 CB 1
   ATOM 778 CG B ASP A 71 ? 16.80424 7.97972 -2.55079 0.557 26.02405 C ? A ? 54 CG 1
   ATOM 779 OD1 B ASP A 71 ? 15.73018 8.62814 -2.65404 0.557 34.75222 O ? A ? 54 OD1 1
   ATOM 780 OD2 B ASP A 71 ? 17.92256 8.50449 -2.46288 0.557 30.53008 O ? A ? 54 OD2 1
   ATOM 781 N A ARG A 72 ? 15.21661 4.12170 -1.98440 0.443 27.41968 N ? A ? 55 N 1
   ATOM 782 CA A ARG A 72 ? 15.24043 2.71911 -2.38032 0.443 30.98534 C ? A ? 55 CA 1
   ATOM 783 C A ARG A 72 ? 14.05141 1.93293 -1.83266 0.443 29.01116 C ? A ? 55 C 1
   ATOM 784 O A ARG A 72 ? 14.13253 0.70556 -1.69845 0.443 32.20400 O ? A ? 55 O 1
   ATOM 785 CB A ARG A 72 ? 16.54704 2.07207 -1.93482 0.443 28.49646 C ? A ? 55 CB 1
   ATOM 786 CG A ARG A 72 ? 16.77109 2.14652 -0.46880 0.443 25.42260 C ? A ? 55 CG 1
   ATOM 787 CD A ARG A 72 ? 17.53901 0.94474 0.03530 0.443 24.21036 C ? A ? 55 CD 1
   ATOM 788 NE A ARG A 72 ? 17.86570 1.16437 1.44383 0.443 29.43087 N ? A ? 55 NE 1
   ATOM 789 CZ A ARG A 72 ? 18.97293 1.77315 1.84442 0.443 25.29468 C ? A ? 55 CZ 1
   ATOM 790 NH1 A ARG A 72 ? 19.95475 2.03112 0.99874 0.443 24.28242 N ? A ? 55 NH1 1
   ATOM 791 NH2 A ARG A 72 ? 19.07794 2.16898 3.10952 0.443 22.51962 N ? A ? 55 NH2 1
   ATOM 792 N B ARG A 72 ? 15.21526 3.56098 -1.86295 0.557 29.16331 N ? A ? 55 N 1
   ATOM 793 CA B ARG A 72 ? 14.81667 2.20318 -2.17033 0.557 33.59095 C ? A ? 55 CA 1
   ATOM 794 C B ARG A 72 ? 13.38838 1.89862 -1.75052 0.557 24.47523 C ? A ? 55 C 1
   ATOM 795 O B ARG A 72 ? 12.95052 0.77814 -1.93437 0.557 28.54753 O ? A ? 55 O 1
   ATOM 796 CB B ARG A 72 ? 15.76566 1.19540 -1.52282 0.557 25.39834 C ? A ? 55 CB 1
   ATOM 797 CG B ARG A 72 ? 16.28629 1.55311 -0.13234 0.557 27.96360 C ? A ? 55 CG 1
   ATOM 798 CD B ARG A 72 ? 17.11543 0.37966 0.46498 0.557 29.88818 C ? A ? 55 CD 1
   ATOM 799 NE B ARG A 72 ? 17.47586 0.63031 1.86236 0.557 23.23255 N ? A ? 55 NE 1
   ATOM 800 CZ B ARG A 72 ? 18.42234 1.48219 2.24178 0.557 25.50215 C ? A ? 55 CZ 1
   ATOM 801 NH1 B ARG A 72 ? 19.28720 1.98247 1.36449 0.557 23.56266 N ? A ? 55 NH1 1
   ATOM 802 NH2 B ARG A 72 ? 18.47291 1.87886 3.51914 0.557 22.14432 N ? A ? 55 NH2 1
   ATOM 803 N A ASN A 73 ? 12.96389 2.62896 -1.52008 0.443 27.64939 N ? A ? 56 N 1
   ATOM 804 CA A ASN A 73 ? 11.70727 2.08756 -1.00740 0.443 32.07150 C ? A ? 56 CA 1
   ATOM 805 C A ASN A 73 ? 11.89776 0.86796 -0.12793 0.443 29.31282 C ? A ? 56 C 1
   ATOM 806 O A ASN A 73 ? 11.52577 -0.24436 -0.49726 0.443 32.19423 O ? A ? 56 O 1
   ATOM 807 CB A ASN A 73 ? 10.74477 1.76594 -2.15296 0.443 34.66456 C ? A ? 56 CB 1
   ATOM 808 CG A ASN A 73 ? 9.35701 2.26717 -1.87047 0.443 41.86525 C ? A ? 56 CG 1
   ATOM 809 OD1 A ASN A 73 ? 8.74976 1.91321 -0.85243 0.443 42.13057 O ? A ? 56 OD1 1
   ATOM 810 ND2 A ASN A 73 ? 8.85794 3.13925 -2.73422 0.443 45.76809 N ? A ? 56 ND2 1
   ATOM 811 N B ASN A 73 ? 12.64849 2.86905 -1.21770 0.557 30.10426 N ? A ? 56 N 1
   ATOM 812 CA B ASN A 73 ? 11.24857 2.63733 -0.82341 0.557 27.95298 C ? A ? 56 CA 1
   ATOM 813 C B ASN A 73 ? 11.16657 1.41649 0.09178 0.557 25.65380 C ? A ? 56 C 1
   ATOM 814 O B ASN A 73 ? 10.33977 0.52457 -0.10059 0.557 25.84497 O ? A ? 56 O 1
   ATOM 815 CB B ASN A 73 ? 10.36857 2.47052 -2.07496 0.557 36.83928 C ? A ? 56 CB 1
   ATOM 816 CG B ASN A 73 ? 8.89083 2.49051 -1.76002 0.557 44.39364 C ? A ? 56 CG 1
   ATOM 817 OD1 B ASN A 73 ? 8.45387 3.19005 -0.85001 0.557 36.37901 O ? A ? 56 OD1 1
   ATOM 818 ND2 B ASN A 73 ? 8.10517 1.71641 -2.51950 0.557 35.35338 N ? A ? 56 ND2 1
   ATOM 819 N A GLU A 74 ? 12.46904 1.06752 1.05523 0.443 28.77218 N ? A ? 57 N 1
   ATOM 820 CA A GLU A 74 ? 12.51653 -0.00369 2.03812 0.443 26.92914 C ? A ? 57 CA 1
   ATOM 821 C A GLU A 74 ? 12.58639 0.64370 3.41170 0.443 27.76547 C ? A ? 57 C 1
   ATOM 822 O A GLU A 74 ? 13.67755 1.07077 3.80534 0.443 24.87803 O ? A ? 57 O 1
   ATOM 823 CB A GLU A 74 ? 13.72774 -0.89517 1.80310 0.443 33.39764 C ? A ? 57 CB 1
   ATOM 824 CG A GLU A 74 ? 13.78056 -2.12377 2.69202 0.443 37.59006 C ? A ? 57 CG 1
   ATOM 825 CD A GLU A 74 ? 15.04687 -2.96329 2.48806 0.443 55.37476 C ? A ? 57 CD 1
   ATOM 826 OE1 A GLU A 74 ? 15.82476 -2.67077 1.54679 0.443 56.47827 O ? A ? 57 OE1 1
   ATOM 827 OE2 A GLU A 74 ? 15.26869 -3.91170 3.28050 0.443 48.92937 O ? A ? 57 OE2 1
   ATOM 828 N B GLU A 74 ? 12.08652 1.35439 1.07413 0.557 29.15058 N ? A ? 57 N 1
   ATOM 829 CA B GLU A 74 ? 12.29178 0.18034 1.93736 0.557 27.43808 C ? A ? 57 CA 1
   ATOM 830 C B GLU A 74 ? 12.53313 0.67142 3.35210 0.557 27.77369 C ? A ? 57 C 1
   ATOM 831 O B GLU A 74 ? 13.67436 0.94343 3.74462 0.557 24.81730 O ? A ? 57 O 1
   ATOM 832 CB B GLU A 74 ? 13.47115 -0.68848 1.49738 0.557 32.69339 C ? A ? 57 CB 1
   ATOM 833 CG B GLU A 74 ? 13.74894 -1.85479 2.49561 0.557 37.04546 C ? A ? 57 CG 1
   ATOM 834 CD B GLU A 74 ? 14.96793 -2.74804 2.15739 0.557 55.49946 C ? A ? 57 CD 1
   ATOM 835 OE1 B GLU A 74 ? 15.54572 -2.61216 1.05070 0.557 58.27607 O ? A ? 57 OE1 1
   ATOM 836 OE2 B GLU A 74 ? 15.34867 -3.59429 3.01666 0.557 50.87857 O ? A ? 57 OE2 1
   ATOM 837 N . PRO A 75 ? 11.47710 0.80430 4.14274 1.000 25.64055 N ? A ? 58 N 1
   ATOM 838 CA . PRO A 75 ? 11.60320 1.30623 5.51048 1.000 25.13811 C ? A ? 58 CA 1
   ATOM 839 C . PRO A 75 ? 12.60303 0.45647 6.29489 1.000 26.38678 C ? A ? 58 C 1
   ATOM 840 O . PRO A 75 ? 12.75228 -0.76245 6.08963 1.000 25.19880 O ? A ? 58 O 1
   ATOM 841 CB . PRO A 75 ? 10.18229 1.19630 6.07295 1.000 32.64692 C ? A ? 58 CB 1
   ATOM 842 CG . PRO A 75 ? 9.27735 1.34646 4.80455 1.000 30.99264 C ? A ? 58 CG 1
   ATOM 843 CD . PRO A 75 ? 10.06049 0.54255 3.77019 1.000 31.60303 C ? A ? 58 CD 1
   ATOM 844 N . PHE A 76 ? 13.35599 1.13166 7.15004 1.000 18.29655 N ? A ? 59 N 1
   ATOM 845 CA . PHE A 76 ? 14.34397 0.46267 7.93461 1.000 19.60000 C ? A ? 59 CA 1
   ATOM 846 C . PHE A 76 ? 13.73742 0.03108 9.25711 1.000 16.96366 C ? A ? 59 C 1
   ATOM 847 O . PHE A 76 ? 13.00490 0.78505 9.90357 1.000 19.23917 O ? A ? 59 O 1
   ATOM 848 CB . PHE A 76 ? 15.49138 1.44580 8.15127 1.000 20.83368 C ? A ? 59 CB 1
   ATOM 849 CG . PHE A 76 ? 16.47168 1.00292 9.17495 1.000 18.33356 C ? A ? 59 CG 1
   ATOM 850 CD1 . PHE A 76 ? 17.29592 -0.10641 8.94274 1.000 20.55346 C ? A ? 59 CD1 1
   ATOM 851 CD2 . PHE A 76 ? 16.61461 1.67918 10.37974 1.000 20.57710 C ? A ? 59 CD2 1
   ATOM 852 CE1 . PHE A 76 ? 18.21623 -0.56237 9.96685 1.000 21.53871 C ? A ? 59 CE1 1
   ATOM 853 CE2 . PHE A 76 ? 17.55612 1.27558 11.31986 1.000 19.30192 C ? A ? 59 CE2 1
   ATOM 854 CZ . PHE A 76 ? 18.34024 0.14905 11.12658 1.000 19.35082 C ? A ? 59 CZ 1
   ATOM 855 N A GLN A 77 ? 14.09957 -1.15703 9.69428 0.439 16.25547 N ? A ? 60 N 1
   ATOM 856 CA A GLN A 77 ? 13.65852 -1.60969 11.00370 0.439 17.43063 C ? A ? 60 CA 1
   ATOM 857 C A GLN A 77 ? 14.85177 -2.05056 11.83446 0.439 21.95054 C ? A ? 60 C 1
   ATOM 858 O A GLN A 77 ? 15.86032 -2.54194 11.29358 0.439 17.12214 O ? A ? 60 O 1
   ATOM 859 CB A GLN A 77 ? 12.63380 -2.75644 10.86817 0.439 19.68715 C ? A ? 60 CB 1
   ATOM 860 CG A GLN A 77 ? 11.43969 -2.38233 9.99147 0.439 24.47456 C ? A ? 60 CG 1
   ATOM 861 CD A GLN A 77 ? 10.49437 -3.54443 9.84914 0.439 28.68971 C ? A ? 60 CD 1
   ATOM 862 OE1 A GLN A 77 ? 9.46171 -3.61882 10.52705 0.439 33.64400 O ? A ? 60 OE1 1
   ATOM 863 NE2 A GLN A 77 ? 10.86198 -4.48147 9.00858 0.439 17.07047 N ? A ? 60 NE2 1
   ATOM 864 N B GLN A 77 ? 14.06195 -1.17544 9.70572 0.561 16.26686 N ? A ? 60 N 1
   ATOM 865 CA B GLN A 77 ? 13.53893 -1.61243 11.00622 0.561 17.45341 C ? A ? 60 CA 1
   ATOM 866 C B GLN A 77 ? 14.63823 -2.12888 11.92261 0.561 22.03923 C ? A ? 60 C 1
   ATOM 867 O B GLN A 77 ? 15.47773 -2.93469 11.48964 0.561 21.10596 O ? A ? 60 O 1
   ATOM 868 CB B GLN A 77 ? 12.46987 -2.73544 10.84682 0.561 19.82292 C ? A ? 60 CB 1
   ATOM 869 CG B GLN A 77 ? 11.23637 -2.33188 10.01302 0.561 23.91836 C ? A ? 60 CG 1
   ATOM 870 CD B GLN A 77 ? 10.10595 -3.35003 10.17241 0.561 34.04875 C ? A ? 60 CD 1
   ATOM 871 OE1 B GLN A 77 ? 8.91602 -2.99755 10.27202 0.561 27.84987 O ? A ? 60 OE1 1
   ATOM 872 NE2 B GLN A 77 ? 10.48364 -4.62420 10.22881 0.561 32.51729 N ? A ? 60 NE2 1
   ATOM 873 N A THR A 78 ? 14.72358 -1.84060 13.15395 0.439 17.66547 N ? A ? 61 N 1
   ATOM 874 CA A THR A 78 ? 15.70761 -2.27231 14.14167 0.439 16.75577 C ? A ? 61 CA 1
   ATOM 875 C A THR A 78 ? 15.03793 -2.36412 15.49724 0.439 19.11671 C ? A ? 61 C 1
   ATOM 876 O A THR A 78 ? 13.87407 -2.02277 15.65757 0.439 20.85574 O ? A ? 61 O 1
   ATOM 877 CB A THR A 78 ? 16.90953 -1.31232 14.22598 0.439 18.01284 C ? A ? 61 CB 1
   ATOM 878 OG1 A THR A 78 ? 17.94862 -1.94706 14.98013 0.439 19.64556 O ? A ? 61 OG1 1
   ATOM 879 CG2 A THR A 78 ? 16.50758 -0.00961 14.93777 0.439 18.45870 C ? A ? 61 CG2 1
   ATOM 880 N B THR A 78 ? 14.60046 -1.71524 13.20174 0.561 17.95880 N ? A ? 61 N 1
   ATOM 881 CA B THR A 78 ? 15.61401 -2.18165 14.13982 0.561 16.73642 C ? A ? 61 CA 1
   ATOM 882 C B THR A 78 ? 15.09884 -2.16481 15.56527 0.561 18.49125 C ? A ? 61 C 1
   ATOM 883 O B THR A 78 ? 14.26184 -1.34802 15.94438 0.561 16.54002 O ? A ? 61 O 1
   ATOM 884 CB B THR A 78 ? 16.93012 -1.34864 14.04494 0.561 17.50775 C ? A ? 61 CB 1
   ATOM 885 OG1 B THR A 78 ? 17.93960 -2.00844 14.81699 0.561 19.70336 O ? A ? 61 OG1 1
   ATOM 886 CG2 B THR A 78 ? 16.76505 0.09456 14.57934 0.561 18.20361 C ? A ? 61 CG2 1
   ATOM 887 N A GLN A 79 ? 15.79251 -2.85144 16.47761 0.439 18.71757 N ? A ? 62 N 1
   ATOM 888 CA A GLN A 79 ? 15.40394 -2.82658 17.88019 0.439 20.53546 C ? A ? 62 CA 1
   ATOM 889 C A GLN A 79 ? 16.22960 -1.74668 18.59961 0.439 17.57155 C ? A ? 62 C 1
   ATOM 890 O A GLN A 79 ? 17.45239 -1.87334 18.76362 0.439 14.69810 O ? A ? 62 O 1
   ATOM 891 CB A GLN A 79 ? 15.60731 -4.20419 18.49564 0.439 19.50246 C ? A ? 62 CB 1
   ATOM 892 CG A GLN A 79 ? 15.10651 -4.29451 19.92135 0.439 25.24139 C ? A ? 62 CG 1
   ATOM 893 CD A GLN A 79 ? 15.25137 -5.68872 20.46633 0.439 26.44134 C ? A ? 62 CD 1
   ATOM 894 OE1 A GLN A 79 ? 16.12280 -6.43495 20.02626 0.439 27.01293 O ? A ? 62 OE1 1
   ATOM 895 NE2 A GLN A 79 ? 14.38315 -6.06440 21.41067 0.439 27.15335 N ? A ? 62 NE2 1
   ATOM 896 N B GLN A 79 ? 15.61360 -3.09045 16.36613 0.561 18.69533 N ? A ? 62 N 1
   ATOM 897 CA B GLN A 79 ? 15.51799 -2.90742 17.79573 0.561 20.53383 C ? A ? 62 CA 1
   ATOM 898 C B GLN A 79 ? 16.29904 -1.65480 18.20163 0.561 17.87048 C ? A ? 62 C 1
   ATOM 899 O B GLN A 79 ? 17.43035 -1.42507 17.74508 0.561 15.60084 O ? A ? 62 O 1
   ATOM 900 CB B GLN A 79 ? 16.06579 -4.12736 18.52284 0.561 19.22501 C ? A ? 62 CB 1
   ATOM 901 CG B GLN A 79 ? 15.74072 -4.06711 19.98877 0.561 23.05914 C ? A ? 62 CG 1
   ATOM 902 CD B GLN A 79 ? 16.19178 -5.30005 20.72881 0.561 27.55301 C ? A ? 62 CD 1
   ATOM 903 OE1 B GLN A 79 ? 17.34293 -5.67413 20.64796 0.561 27.75696 O ? A ? 62 OE1 1
   ATOM 904 NE2 B GLN A 79 ? 15.29281 -5.90995 21.48524 0.561 28.33404 N ? A ? 62 NE2 1
   ATOM 905 N A ILE A 80 ? 15.57151 -0.70541 19.04059 0.439 16.19066 N ? A ? 63 N 1
   ATOM 906 CA A ILE A 80 ? 16.29127 0.50075 19.47392 0.439 15.66135 C ? A ? 63 CA 1
   ATOM 907 C A ILE A 80 ? 16.73752 0.37083 20.93106 0.439 18.76691 C ? A ? 63 C 1
   ATOM 908 O A ILE A 80 ? 16.10684 -0.32553 21.72984 0.439 20.20215 O ? A ? 63 O 1
   ATOM 909 CB A ILE A 80 ? 15.36170 1.71585 19.23972 0.439 17.40042 C ? A ? 63 CB 1
   ATOM 910 CG1 A ILE A 80 ? 16.15726 3.04909 19.25313 0.439 16.22902 C ? A ? 63 CG1 1
   ATOM 911 CG2 A ILE A 80 ? 14.19601 1.67312 20.25091 0.439 17.15787 C ? A ? 63 CG2 1
   ATOM 912 CD1 A ILE A 80 ? 17.18092 3.18857 18.06478 0.439 12.39800 C ? A ? 63 CD1 1
   ATOM 913 N B ILE A 80 ? 15.69969 -0.85580 19.08439 0.561 16.62710 N ? A ? 63 N 1
   ATOM 914 CA B ILE A 80 ? 16.30077 0.42266 19.50806 0.561 15.62531 C ? A ? 63 CA 1
   ATOM 915 C B ILE A 80 ? 16.79116 0.29594 20.95029 0.561 18.77299 C ? A ? 63 C 1
   ATOM 916 O B ILE A 80 ? 16.25015 -0.48174 21.74101 0.561 20.75958 O ? A ? 63 O 1
   ATOM 917 CB B ILE A 80 ? 15.24434 1.55644 19.31974 0.561 17.26387 C ? A ? 63 CB 1
   ATOM 918 CG1 B ILE A 80 ? 15.89847 2.94656 19.10493 0.561 17.57641 C ? A ? 63 CG1 1
   ATOM 919 CG2 B ILE A 80 ? 14.23697 1.56952 20.49997 0.561 17.00040 C ? A ? 63 CG2 1
   ATOM 920 CD1 B ILE A 80 ? 16.65308 3.07296 17.78759 0.561 12.26590 C ? A ? 63 CD1 1
   ATOM 921 N . GLY A 81 ? 17.82835 1.06325 21.30509 1.000 18.74231 N ? A ? 64 N 1
   ATOM 922 CA . GLY A 81 ? 18.27380 1.08801 22.71297 1.000 19.83698 C ? A ? 64 CA 1
   ATOM 923 C . GLY A 81 ? 19.10528 -0.11714 23.09850 1.000 20.74015 C ? A ? 64 C 1
   ATOM 924 O . GLY A 81 ? 19.34054 -0.31258 24.29315 1.000 28.21144 O ? A ? 64 O 1
   ATOM 925 N A THR A 82 ? 19.54350 -0.94157 22.12017 0.476 20.06766 N ? A ? 65 N 1
   ATOM 926 CA A THR A 82 ? 20.32972 -2.15755 22.38643 0.476 22.00060 C ? A ? 65 CA 1
   ATOM 927 C A THR A 82 ? 21.74390 -2.12899 21.81274 0.476 22.88546 C ? A ? 65 C 1
   ATOM 928 O A THR A 82 ? 22.48366 -3.13332 21.92831 0.476 22.84563 O ? A ? 65 O 1
   ATOM 929 CB A THR A 82 ? 19.60735 -3.40054 21.84985 0.476 20.70458 C ? A ? 65 CB 1
   ATOM 930 OG1 A THR A 82 ? 19.73039 -3.47865 20.42375 0.476 20.87824 O ? A ? 65 OG1 1
   ATOM 931 CG2 A THR A 82 ? 18.12116 -3.38930 22.24665 0.476 26.09194 C ? A ? 65 CG2 1
   ATOM 932 N B THR A 82 ? 19.53147 -0.95060 22.13948 0.524 20.09322 N ? A ? 65 N 1
   ATOM 933 CA B THR A 82 ? 20.24833 -2.17608 22.49674 0.524 22.24198 C ? A ? 65 CA 1
   ATOM 934 C B THR A 82 ? 21.54405 -2.35762 21.71232 0.524 22.66860 C ? A ? 65 C 1
   ATOM 935 O B THR A 82 ? 22.07282 -3.49322 21.62067 0.524 20.15673 O ? A ? 65 O 1
   ATOM 936 CB B THR A 82 ? 19.35394 -3.38597 22.30315 0.524 22.79567 C ? A ? 65 CB 1
   ATOM 937 OG1 B THR A 82 ? 18.92233 -3.41852 20.94170 0.524 18.98806 O ? A ? 65 OG1 1
   ATOM 938 CG2 B THR A 82 ? 18.13263 -3.34475 23.24638 0.524 23.49439 C ? A ? 65 CG2 1
   ATOM 939 N A GLY A 83 ? 22.15837 -1.02556 21.20550 0.476 21.21588 N ? A ? 66 N 1
   ATOM 940 CA A GLY A 83 ? 23.49009 -0.95460 20.64613 0.476 21.88938 C ? A ? 66 CA 1
   ATOM 941 C A GLY A 83 ? 23.63288 -1.58357 19.28267 0.476 19.07187 C ? A ? 66 C 1
   ATOM 942 O A GLY A 83 ? 24.75097 -1.80166 18.84429 0.476 19.19209 O ? A ? 66 O 1
   ATOM 943 N B GLY A 83 ? 22.08931 -1.27724 21.15825 0.524 20.83904 N ? A ? 66 N 1
   ATOM 944 CA B GLY A 83 ? 23.40385 -1.33643 20.56684 0.524 21.94940 C ? A ? 66 CA 1
   ATOM 945 C B GLY A 83 ? 23.42421 -1.84512 19.15605 0.524 17.58911 C ? A ? 66 C 1
   ATOM 946 O B GLY A 83 ? 24.48989 -2.22112 18.67879 0.524 22.57178 O ? A ? 66 O 1
   ATOM 947 N A ARG A 84 ? 22.53503 -1.84352 18.57309 0.476 17.06497 N ? A ? 67 N 1
   ATOM 948 CA A ARG A 84 ? 22.66934 -2.36195 17.22530 0.476 15.74364 C ? A ? 67 CA 1
   ATOM 949 C A ARG A 84 ? 22.94720 -1.26209 16.20763 0.476 19.48061 C ? A ? 67 C 1
   ATOM 950 O A ARG A 84 ? 23.44175 -1.54853 15.10452 0.476 19.79990 O ? A ? 67 O 1
   ATOM 951 CB A ARG A 84 ? 21.40797 -3.13647 16.82579 0.476 16.15691 C ? A ? 67 CB 1
   ATOM 952 CG A ARG A 84 ? 21.27544 -4.62214 17.32871 0.476 27.01247 C ? A ? 67 CG 1
   ATOM 953 CD A ARG A 84 ? 20.01660 -5.26221 16.65367 0.476 31.25803 C ? A ? 67 CD 1
   ATOM 954 NE A ARG A 84 ? 19.73730 -6.64389 17.02972 0.476 33.16222 N ? A ? 67 NE 1
   ATOM 955 CZ A ARG A 84 ? 20.38199 -7.70296 16.55112 0.476 42.83984 C ? A ? 67 CZ 1
   ATOM 956 NH1 A ARG A 84 ? 21.38156 -7.57889 15.69133 0.476 52.30824 N ? A ? 67 NH1 1
   ATOM 957 NH2 A ARG A 84 ? 20.00333 -8.91881 16.93264 0.476 58.63873 N ? A ? 67 NH2 1
   ATOM 958 N B ARG A 84 ? 22.28259 -1.81974 18.45973 0.524 16.69620 N ? A ? 67 N 1
   ATOM 959 CA B ARG A 84 ? 22.18609 -2.34880 17.11746 0.524 14.48804 C ? A ? 67 CA 1
   ATOM 960 C B ARG A 84 ? 22.35596 -1.28107 16.05073 0.524 20.16779 C ? A ? 67 C 1
   ATOM 961 O B ARG A 84 ? 22.55529 -1.61301 14.86552 0.524 17.57872 O ? A ? 67 O 1
   ATOM 962 CB B ARG A 84 ? 20.85854 -3.07859 16.95008 0.524 17.61165 C ? A ? 67 CB 1
   ATOM 963 CG B ARG A 84 ? 20.77711 -4.35127 17.86513 0.524 23.37642 C ? A ? 67 CG 1
   ATOM 964 CD B ARG A 84 ? 19.54603 -5.18110 17.49592 0.524 21.96045 C ? A ? 67 CD 1
   ATOM 965 NE B ARG A 84 ? 19.23065 -6.23133 18.46402 0.524 31.79343 N ? A ? 67 NE 1
   ATOM 966 CZ B ARG A 84 ? 19.68490 -7.47362 18.41297 0.524 50.17521 C ? A ? 67 CZ 1
   ATOM 967 NH1 B ARG A 84 ? 20.68141 -7.81422 17.60712 0.524 49.07476 N ? A ? 67 NH1 1
   ATOM 968 NH2 B ARG A 84 ? 19.10616 -8.40329 19.16731 0.524 36.75563 N ? A ? 67 NH2 1
   ATOM 969 N A VAL A 85 ? 22.63326 -0.01780 16.54291 0.476 15.71393 N ? A ? 68 N 1
   ATOM 970 CA A VAL A 85 ? 22.80788 1.09219 15.61926 0.476 14.55323 C ? A ? 68 CA 1
   ATOM 971 C A VAL A 85 ? 23.75567 2.07578 16.27211 0.476 15.38334 C ? A ? 68 C 1
   ATOM 972 O A VAL A 85 ? 24.08556 1.94841 17.45267 0.476 17.02500 O ? A ? 68 O 1
   ATOM 973 CB A VAL A 85 ? 21.45346 1.76710 15.24568 0.476 16.27368 C ? A ? 68 CB 1
   ATOM 974 CG1 A VAL A 85 ? 20.51144 0.76017 14.48780 0.476 17.48665 C ? A ? 68 CG1 1
   ATOM 975 CG2 A VAL A 85 ? 20.73749 2.34974 16.50757 0.476 12.87774 C ? A ? 68 CG2 1
   ATOM 976 N B VAL A 85 ? 22.31475 -0.02018 16.45072 0.524 16.50964 N ? A ? 68 N 1
   ATOM 977 CA B VAL A 85 ? 22.57128 1.09697 15.55687 0.524 15.66916 C ? A ? 68 CA 1
   ATOM 978 C B VAL A 85 ? 23.48007 2.04686 16.30757 0.524 15.40200 C ? A ? 68 C 1
   ATOM 979 O B VAL A 85 ? 23.67628 1.92299 17.52219 0.524 16.02431 O ? A ? 68 O 1
   ATOM 980 CB B VAL A 85 ? 21.26248 1.81273 15.09681 0.524 16.20209 C ? A ? 68 CB 1
   ATOM 981 CG1 B VAL A 85 ? 20.45786 0.95395 14.07197 0.524 15.25462 C ? A ? 68 CG1 1
   ATOM 982 CG2 B VAL A 85 ? 20.33858 2.09254 16.30636 0.524 12.71909 C ? A ? 68 CG2 1
   ATOM 983 N A ILE A 86 ? 24.20137 3.06522 15.48331 0.476 13.36187 N ? A ? 69 N 1
   ATOM 984 CA A ILE A 86 ? 25.04571 4.12556 16.01856 0.476 14.10386 C ? A ? 69 CA 1
   ATOM 985 C A ILE A 86 ? 24.34206 4.80908 17.20348 0.476 13.74419 C ? A ? 69 C 1
   ATOM 986 O A ILE A 86 ? 23.09986 4.83838 17.30695 0.476 14.44911 O ? A ? 69 O 1
   ATOM 987 CB A ILE A 86 ? 25.41324 5.15478 14.93865 0.476 14.61735 C ? A ? 69 CB 1
   ATOM 988 CG1 A ILE A 86 ? 24.16465 5.59682 14.15827 0.476 14.70894 C ? A ? 69 CG1 1
   ATOM 989 CG2 A ILE A 86 ? 26.53105 4.60868 14.02397 0.476 12.64138 C ? A ? 69 CG2 1
   ATOM 990 CD1 A ILE A 86 ? 24.55178 6.68762 13.05725 0.476 14.25484 C ? A ? 69 CD1 1
   ATOM 991 N B ILE A 86 ? 24.01452 3.02399 15.56893 0.524 13.59112 N ? A ? 69 N 1
   ATOM 992 CA B ILE A 86 ? 24.97803 3.93255 16.15819 0.524 14.54003 C ? A ? 69 CA 1
   ATOM 993 C B ILE A 86 ? 24.36347 4.65785 17.35758 0.524 13.90018 C ? A ? 69 C 1
   ATOM 994 O B ILE A 86 ? 23.13516 4.85230 17.46449 0.524 14.58823 O ? A ? 69 O 1
   ATOM 995 CB B ILE A 86 ? 25.51277 4.94194 15.13361 0.524 14.75412 C ? A ? 69 CB 1
   ATOM 996 CG1 B ILE A 86 ? 24.36457 5.84980 14.61705 0.524 12.55562 C ? A ? 69 CG1 1
   ATOM 997 CG2 B ILE A 86 ? 26.33150 4.15192 14.05801 0.524 11.88230 C ? A ? 69 CG2 1
   ATOM 998 CD1 B ILE A 86 ? 24.85023 6.95985 13.60763 0.524 13.33821 C ? A ? 69 CD1 1
   ATOM 999 N A LYS A 87 ? 25.16283 5.34003 18.11934 0.476 14.58671 N ? A ? 70 N 1
   ATOM 1000 CA A LYS A 87 ? 24.63403 5.83759 19.38869 0.476 14.82704 C ? A ? 70 CA 1
   ATOM 1001 C A LYS A 87 ? 23.69383 7.01567 19.16987 0.476 15.63787 C ? A ? 70 C 1
   ATOM 1002 O A LYS A 87 ? 22.70249 7.16449 19.89144 0.476 14.92581 O ? A ? 70 O 1
   ATOM 1003 CB A LYS A 87 ? 25.78151 6.25957 20.32917 0.476 20.14843 C ? A ? 70 CB 1
   ATOM 1004 CG A LYS A 87 ? 25.29591 6.49907 21.80236 0.476 17.01296 C ? A ? 70 CG 1
   ATOM 1005 CD A LYS A 87 ? 26.48239 6.67657 22.77553 0.476 33.93392 C ? A ? 70 CD 1
   ATOM 1006 CE A LYS A 87 ? 26.82300 5.36568 23.47748 0.476 47.87401 C ? A ? 70 CE 1
   ATOM 1007 NZ A LYS A 87 ? 27.88656 5.49523 24.51850 0.476 50.93178 N ? A ? 70 NZ 1
   ATOM 1008 N B LYS A 87 ? 25.26203 5.06499 18.26032 0.524 14.71622 N ? A ? 70 N 1
   ATOM 1009 CA B LYS A 87 ? 24.86942 5.61137 19.54919 0.524 14.99630 C ? A ? 70 CA 1
   ATOM 1010 C B LYS A 87 ? 23.89488 6.77511 19.39949 0.524 15.18612 C ? A ? 70 C 1
   ATOM 1011 O B LYS A 87 ? 22.95026 6.90160 20.18311 0.524 15.02940 O ? A ? 70 O 1
   ATOM 1012 CB B LYS A 87 ? 26.13692 6.07035 20.29456 0.524 19.11706 C ? A ? 70 CB 1
   ATOM 1013 CG B LYS A 87 ? 25.84147 6.85342 21.58293 0.524 24.92394 C ? A ? 70 CG 1
   ATOM 1014 CD B LYS A 87 ? 27.06180 6.84692 22.54351 0.524 27.22468 C ? A ? 70 CD 1
   ATOM 1015 CE B LYS A 87 ? 27.22595 5.49806 23.25844 0.524 49.36923 C ? A ? 70 CE 1
   ATOM 1016 NZ B LYS A 87 ? 28.39535 5.42657 24.20676 0.524 48.87370 N ? A ? 70 NZ 1
   ATOM 1017 N A GLY A 88 ? 23.98561 7.87617 18.17826 0.476 12.53593 N ? A ? 71 N 1
   ATOM 1018 CA A GLY A 88 ? 23.07433 8.98292 17.92060 0.476 14.33171 C ? A ? 71 CA 1
   ATOM 1019 C A GLY A 88 ? 21.64299 8.53505 17.69266 0.476 15.03853 C ? A ? 71 C 1
   ATOM 1020 O A GLY A 88 ? 20.69498 9.26583 18.00120 0.476 13.27876 O ? A ? 71 O 1
   ATOM 1021 N B GLY A 88 ? 24.13784 7.67793 18.43480 0.524 13.17828 N ? A ? 71 N 1
   ATOM 1022 CA B GLY A 88 ? 23.22380 8.79940 18.26394 0.524 15.18085 C ? A ? 71 CA 1
   ATOM 1023 C B GLY A 88 ? 21.80533 8.39413 17.89347 0.524 14.86646 C ? A ? 71 C 1
   ATOM 1024 O B GLY A 88 ? 20.84263 9.07477 18.26151 0.524 13.91098 O ? A ? 71 O 1
   ATOM 1025 N A TRP A 89 ? 21.45983 7.33169 17.15394 0.476 15.16476 N ? A ? 72 N 1
   ATOM 1026 CA A TRP A 89 ? 20.10335 6.81356 16.96600 0.476 14.65993 C ? A ? 72 CA 1
   ATOM 1027 C A TRP A 89 ? 19.57039 6.22186 18.26153 0.476 14.47711 C ? A ? 72 C 1
   ATOM 1028 O A TRP A 89 ? 18.39595 6.40249 18.60972 0.476 14.07231 O ? A ? 72 O 1
   ATOM 1029 CB A TRP A 89 ? 20.08083 5.72983 15.88492 0.476 12.97400 C ? A ? 72 CB 1
   ATOM 1030 CG A TRP A 89 ? 19.97213 6.25044 14.46324 0.476 13.29773 C ? A ? 72 CG 1
   ATOM 1031 CD1 A TRP A 89 ? 20.78487 7.16790 13.84241 0.476 14.18408 C ? A ? 72 CD1 1
   ATOM 1032 CD2 A TRP A 89 ? 18.99910 5.84873 13.48736 0.476 12.55407 C ? A ? 72 CD2 1
   ATOM 1033 NE1 A TRP A 89 ? 20.36610 7.35905 12.53917 0.476 14.79799 N ? A ? 72 NE1 1
   ATOM 1034 CE2 A TRP A 89 ? 19.27940 6.55714 12.30324 0.476 14.69699 C ? A ? 72 CE2 1
   ATOM 1035 CE3 A TRP A 89 ? 17.92551 4.94634 13.49945 0.476 15.27244 C ? A ? 72 CE3 1
   ATOM 1036 CZ2 A TRP A 89 ? 18.54719 6.38247 11.14035 0.476 14.09116 C ? A ? 72 CZ2 1
   ATOM 1037 CZ3 A TRP A 89 ? 17.19080 4.75993 12.30270 0.476 11.45739 C ? A ? 72 CZ3 1
   ATOM 1038 CH2 A TRP A 89 ? 17.49513 5.50259 11.16191 0.476 16.50768 C ? A ? 72 CH2 1
   ATOM 1039 N B TRP A 89 ? 21.64708 7.30204 17.15196 0.524 14.98546 N ? A ? 72 N 1
   ATOM 1040 CA B TRP A 89 ? 20.28609 6.84922 16.83795 0.524 15.05762 C ? A ? 72 CA 1
   ATOM 1041 C B TRP A 89 ? 19.65232 6.20215 18.06148 0.524 15.28146 C ? A ? 72 C 1
   ATOM 1042 O B TRP A 89 ? 18.44095 6.34782 18.30733 0.524 14.45733 O ? A ? 72 O 1
   ATOM 1043 CB B TRP A 89 ? 20.30637 5.84210 15.68002 0.524 13.47484 C ? A ? 72 CB 1
   ATOM 1044 CG B TRP A 89 ? 20.20776 6.44530 14.28140 0.524 13.81898 C ? A ? 72 CG 1
   ATOM 1045 CD1 B TRP A 89 ? 21.07272 7.33588 13.69431 0.524 12.95618 C ? A ? 72 CD1 1
   ATOM 1046 CD2 B TRP A 89 ? 19.19323 6.16519 13.30818 0.524 11.79262 C ? A ? 72 CD2 1
   ATOM 1047 NE1 B TRP A 89 ? 20.63777 7.62793 12.38717 0.524 13.63619 N ? A ? 72 NE1 1
   ATOM 1048 CE2 B TRP A 89 ? 19.49350 6.91478 12.14789 0.524 15.07110 C ? A ? 72 CE2 1
   ATOM 1049 CE3 B TRP A 89 ? 18.06712 5.33826 13.30304 0.524 13.59339 C ? A ? 72 CE3 1
   ATOM 1050 CZ2 B TRP A 89 ? 18.71980 6.84375 10.98771 0.524 15.10810 C ? A ? 72 CZ2 1
   ATOM 1051 CZ3 B TRP A 89 ? 17.30424 5.24985 12.14317 0.524 14.72339 C ? A ? 72 CZ3 1
   ATOM 1052 CH2 B TRP A 89 ? 17.61306 6.02438 11.01316 0.524 15.44398 C ? A ? 72 CH2 1
   ATOM 1053 N A ASP A 90 ? 20.36030 5.36625 18.90113 0.476 14.97997 N ? A ? 73 N 1
   ATOM 1054 CA A ASP A 90 ? 19.86673 4.77971 20.15006 0.476 12.87777 C ? A ? 73 CA 1
   ATOM 1055 C A ASP A 90 ? 19.49762 5.86943 21.16960 0.476 16.56344 C ? A ? 73 C 1
   ATOM 1056 O A ASP A 90 ? 18.53133 5.71647 21.93487 0.476 17.10477 O ? A ? 73 O 1
   ATOM 1057 CB A ASP A 90 ? 20.91503 3.83057 20.72823 0.476 15.73898 C ? A ? 73 CB 1
   ATOM 1058 CG A ASP A 90 ? 20.64921 2.37228 20.38371 0.476 16.91182 C ? A ? 73 CG 1
   ATOM 1059 OD1 A ASP A 90 ? 19.66607 2.06805 19.66312 0.476 18.11495 O ? A ? 73 OD1 1
   ATOM 1060 OD2 A ASP A 90 ? 21.42326 1.52834 20.89614 0.476 18.06092 O ? A ? 73 OD2 1
   ATOM 1061 N B ASP A 90 ? 20.42134 5.34678 18.74297 0.524 14.01296 N ? A ? 73 N 1
   ATOM 1062 CA B ASP A 90 ? 19.90572 4.68462 19.94645 0.524 12.77325 C ? A ? 73 CA 1
   ATOM 1063 C B ASP A 90 ? 19.46880 5.69652 21.01659 0.524 16.13647 C ? A ? 73 C 1
   ATOM 1064 O B ASP A 90 ? 18.58075 5.39375 21.83155 0.524 18.66335 O ? A ? 73 O 1
   ATOM 1065 CB B ASP A 90 ? 20.99145 3.78211 20.52877 0.524 14.83304 C ? A ? 73 CB 1
   ATOM 1066 CG B ASP A 90 ? 20.84743 2.33650 20.12286 0.524 14.69937 C ? A ? 73 CG 1
   ATOM 1067 OD1 B ASP A 90 ? 19.77157 1.94495 19.62323 0.524 18.15543 O ? A ? 73 OD1 1
   ATOM 1068 OD2 B ASP A 90 ? 21.82557 1.58770 20.40096 0.524 17.06699 O ? A ? 73 OD2 1
   ATOM 1069 N A GLU A 91 ? 20.24215 6.98270 21.19984 0.476 15.79994 N ? A ? 74 N 1
   ATOM 1070 CA A GLU A 91 ? 19.88953 8.07794 22.10763 0.476 15.69456 C ? A ? 74 CA 1
   ATOM 1071 C A GLU A 91 ? 18.75317 8.93998 21.56214 0.476 16.03489 C ? A ? 74 C 1
   ATOM 1072 O A GLU A 91 ? 17.85215 9.35035 22.31568 0.476 16.44699 O ? A ? 74 O 1
   ATOM 1073 CB A GLU A 91 ? 21.11520 8.96664 22.37248 0.476 15.72983 C ? A ? 74 CB 1
   ATOM 1074 CG A GLU A 91 ? 22.22700 8.27136 23.17599 0.476 18.73654 C ? A ? 74 CG 1
   ATOM 1075 CD A GLU A 91 ? 21.70367 7.62477 24.42986 0.476 32.72760 C ? A ? 74 CD 1
   ATOM 1076 OE1 A GLU A 91 ? 21.05726 8.34250 25.23741 0.476 29.01231 O ? A ? 74 OE1 1
   ATOM 1077 OE2 A GLU A 91 ? 21.91412 6.39786 24.58165 0.476 23.76726 O ? A ? 74 OE2 1
   ATOM 1078 N B GLU A 91 ? 20.08643 6.88584 21.07175 0.524 16.14890 N ? A ? 74 N 1
   ATOM 1079 CA B GLU A 91 ? 19.70079 7.87820 22.08311 0.524 15.11812 C ? A ? 74 CA 1
   ATOM 1080 C B GLU A 91 ? 18.69685 8.89289 21.55174 0.524 16.14634 C ? A ? 74 C 1
   ATOM 1081 O B GLU A 91 ? 17.81853 9.35579 22.30728 0.524 16.40903 O ? A ? 74 O 1
   ATOM 1082 CB B GLU A 91 ? 20.93421 8.62990 22.61657 0.524 16.55522 C ? A ? 74 CB 1
   ATOM 1083 CG B GLU A 91 ? 21.94319 7.74994 23.30373 0.524 17.61026 C ? A ? 74 CG 1
   ATOM 1084 CD B GLU A 91 ? 21.50299 7.45408 24.71216 0.524 31.90269 C ? A ? 74 CD 1
   ATOM 1085 OE1 B GLU A 91 ? 21.73476 8.34173 25.55917 0.524 32.73963 O ? A ? 74 OE1 1
   ATOM 1086 OE2 B GLU A 91 ? 20.87589 6.38858 24.94843 0.524 27.12202 O ? A ? 74 OE2 1
   ATOM 1087 N . GLY A 92 ? 18.73958 9.19318 20.24349 1.000 13.54396 N ? A ? 75 N 1
   ATOM 1088 CA . GLY A 92 ? 17.85922 10.20247 19.70271 1.000 14.94461 C ? A ? 75 CA 1
   ATOM 1089 C . GLY A 92 ? 16.46123 9.67648 19.36861 1.000 16.98577 C ? A ? 75 C 1
   ATOM 1090 O . GLY A 92 ? 15.45826 10.37912 19.52029 1.000 14.82531 O ? A ? 75 O 1
   ATOM 1091 N . VAL A 93 ? 16.38320 8.44360 18.83366 1.000 13.69427 N ? A ? 76 N 1
   ATOM 1092 CA . VAL A 93 ? 15.08543 7.91769 18.38444 1.000 13.05285 C ? A ? 76 CA 1
   ATOM 1093 C . VAL A 93 ? 14.09190 7.81326 19.54924 1.000 14.67749 C ? A ? 76 C 1
   ATOM 1094 O . VAL A 93 ? 12.90427 8.11028 19.34066 1.000 16.60784 O ? A ? 76 O 1
   ATOM 1095 CB . VAL A 93 ? 15.28628 6.59805 17.62399 1.000 12.33242 C ? A ? 76 CB 1
   ATOM 1096 CG1 . VAL A 93 ? 13.90239 5.93336 17.36268 1.000 16.24794 C ? A ? 76 CG1 1
   ATOM 1097 CG2 . VAL A 93 ? 15.90534 6.96832 16.21886 1.000 14.83423 C ? A ? 76 CG2 1
   ATOM 1098 N . PRO A 94 ? 14.48077 7.41956 20.78475 1.000 15.82387 N ? A ? 77 N 1
   ATOM 1099 CA . PRO A 94 ? 13.50722 7.37227 21.86988 1.000 18.83580 C ? A ? 77 CA 1
   ATOM 1100 C . PRO A 94 ? 12.97085 8.73855 22.24938 1.000 17.82010 C ? A ? 77 C 1
   ATOM 1101 O . PRO A 94 ? 11.99225 8.80471 22.99981 1.000 18.29053 O ? A ? 77 O 1
   ATOM 1102 CB . PRO A 94 ? 14.30428 6.73172 23.03110 1.000 16.83161 C ? A ? 77 CB 1
   ATOM 1103 CG . PRO A 94 ? 15.27763 5.79335 22.31855 1.000 17.55040 C ? A ? 77 CG 1
   ATOM 1104 CD . PRO A 94 ? 15.74167 6.75204 21.19393 1.000 13.41667 C ? A ? 77 CD 1
   ATOM 1105 N A GLN A 95 ? 13.60639 9.82921 21.82749 0.404 14.57698 N ? A ? 78 N 1
   ATOM 1106 CA A GLN A 95 ? 13.02439 11.13622 22.11511 0.404 14.24815 C ? A ? 78 CA 1
   ATOM 1107 C A GLN A 95 ? 12.01089 11.54437 21.04658 0.404 14.23912 C ? A ? 78 C 1
   ATOM 1108 O A GLN A 95 ? 11.44765 12.64978 21.10968 0.404 16.75004 O ? A ? 78 O 1
   ATOM 1109 CB A GLN A 95 ? 14.14911 12.18250 22.26198 0.404 17.40281 C ? A ? 78 CB 1
   ATOM 1110 CG A GLN A 95 ? 15.23039 11.74986 23.26940 0.404 18.66146 C ? A ? 78 CG 1
   ATOM 1111 CD A GLN A 95 ? 14.68977 11.67339 24.71003 0.404 22.41558 C ? A ? 78 CD 1
   ATOM 1112 OE1 A GLN A 95 ? 13.58782 12.11984 24.98172 0.404 21.73159 O ? A ? 78 OE1 1
   ATOM 1113 NE2 A GLN A 95 ? 15.46852 11.09451 25.62114 0.404 24.74488 N ? A ? 78 NE2 1
   ATOM 1114 N B GLN A 95 ? 13.52523 9.81710 21.68493 0.596 14.54277 N ? A ? 78 N 1
   ATOM 1115 CA B GLN A 95 ? 12.98667 11.15898 21.90181 0.596 14.52986 C ? A ? 78 CA 1
   ATOM 1116 C B GLN A 95 ? 11.92310 11.56963 20.86942 0.596 14.69135 C ? A ? 78 C 1
   ATOM 1117 O B GLN A 95 ? 11.46763 12.73299 20.88298 0.596 16.49615 O ? A ? 78 O 1
   ATOM 1118 CB B GLN A 95 ? 14.16484 12.16957 21.89747 0.596 16.78219 C ? A ? 78 CB 1
   ATOM 1119 CG B GLN A 95 ? 15.20855 11.84411 22.98143 0.596 17.58923 C ? A ? 78 CG 1
   ATOM 1120 CD B GLN A 95 ? 14.63375 11.96172 24.42792 0.596 21.95048 C ? A ? 78 CD 1
   ATOM 1121 OE1 B GLN A 95 ? 13.78537 12.81511 24.69608 0.596 22.09361 O ? A ? 78 OE1 1
   ATOM 1122 NE2 B GLN A 95 ? 15.09177 11.09580 25.33320 0.596 27.09099 N ? A ? 78 NE2 1
   ATOM 1123 N A MET A 96 ? 11.79599 10.69323 20.04156 0.404 15.46485 N ? A ? 79 N 1
   ATOM 1124 CA A MET A 96 ? 10.70363 10.86420 19.11699 0.404 13.28991 C ? A ? 79 CA 1
   ATOM 1125 C A MET A 96 ? 9.45500 10.16383 19.66203 0.404 14.19621 C ? A ? 79 C 1
   ATOM 1126 O A MET A 96 ? 9.55915 9.12588 20.32823 0.404 14.91529 O ? A ? 79 O 1
   ATOM 1127 CB A MET A 96 ? 11.07023 10.28342 17.74124 0.404 15.72795 C ? A ? 79 CB 1
   ATOM 1128 CG A MET A 96 ? 12.32284 10.92035 17.16443 0.404 14.52338 C ? A ? 79 CG 1
   ATOM 1129 SD A MET A 96 ? 12.82072 10.20380 15.55836 0.404 15.02633 S ? A ? 79 SD 1
   ATOM 1130 CE A MET A 96 ? 11.50301 10.74558 14.41776 0.404 13.98823 C ? A ? 79 CE 1
   ATOM 1131 N B MET A 96 ? 11.57305 10.68984 19.91684 0.596 14.79029 N ? A ? 79 N 1
   ATOM 1132 CA B MET A 96 ? 10.60233 10.99326 18.88843 0.596 14.11361 C ? A ? 79 CA 1
   ATOM 1133 C B MET A 96 ? 9.27820 10.27219 19.13480 0.596 13.71835 C ? A ? 79 C 1
   ATOM 1134 O B MET A 96 ? 9.27657 9.12775 19.61978 0.596 13.12167 O ? A ? 79 O 1
   ATOM 1135 CB B MET A 96 ? 11.12782 10.56018 17.51108 0.596 16.58680 C ? A ? 79 CB 1
   ATOM 1136 CG B MET A 96 ? 12.46394 11.19785 17.23982 0.596 13.92014 C ? A ? 79 CG 1
   ATOM 1137 SD B MET A 96 ? 13.09644 10.58913 15.63916 0.596 15.92363 S ? A ? 79 SD 1
   ATOM 1138 CE B MET A 96 ? 11.79403 11.09198 14.45220 0.596 15.91149 C ? A ? 79 CE 1
   ATOM 1139 N A SER A 97 ? 8.28717 10.73517 19.36344 0.404 16.05833 N ? A ? 80 N 1
   ATOM 1140 CA A SER A 97 ? 7.00700 10.03845 19.48506 0.404 14.22194 C ? A ? 80 CA 1
   ATOM 1141 C A SER A 97 ? 6.57535 9.52317 18.10885 0.404 13.63513 C ? A ? 80 C 1
   ATOM 1142 O A SER A 97 ? 7.07798 9.97603 17.07416 0.404 14.05230 O ? A ? 80 O 1
   ATOM 1143 CB A SER A 97 ? 5.93566 10.96695 20.09721 0.404 14.76156 C ? A ? 80 CB 1
   ATOM 1144 OG A SER A 97 ? 5.37720 11.85638 19.13342 0.404 18.18430 O ? A ? 80 OG 1
   ATOM 1145 N B SER A 97 ? 8.17005 10.89005 18.72048 0.596 14.11867 N ? A ? 80 N 1
   ATOM 1146 CA B SER A 97 ? 6.91790 10.17318 18.90843 0.596 12.96809 C ? A ? 80 CA 1
   ATOM 1147 C B SER A 97 ? 6.40415 9.70195 17.55556 0.596 14.36014 C ? A ? 80 C 1
   ATOM 1148 O B SER A 97 ? 6.87905 10.13457 16.50275 0.596 15.58660 O ? A ? 80 O 1
   ATOM 1149 CB B SER A 97 ? 5.85689 11.02150 19.65089 0.596 15.99197 C ? A ? 80 CB 1
   ATOM 1150 OG B SER A 97 ? 5.31414 12.02360 18.80221 0.596 17.33020 O ? A ? 80 OG 1
   ATOM 1151 N A LEU A 98 ? 5.63542 8.55742 18.09593 0.404 12.56213 N ? A ? 81 N 1
   ATOM 1152 CA A LEU A 98 ? 5.22588 7.93995 16.82259 0.404 13.74752 C ? A ? 81 CA 1
   ATOM 1153 C A LEU A 98 ? 4.64224 8.96927 15.85295 0.404 14.26934 C ? A ? 81 C 1
   ATOM 1154 O A LEU A 98 ? 3.78120 9.78529 16.22358 0.404 14.43828 O ? A ? 81 O 1
   ATOM 1155 CB A LEU A 98 ? 4.17614 6.82086 17.05731 0.404 13.57352 C ? A ? 81 CB 1
   ATOM 1156 CG A LEU A 98 ? 3.57114 6.29708 15.71926 0.404 16.11916 C ? A ? 81 CG 1
   ATOM 1157 CD1 A LEU A 98 ? 4.61648 5.48990 14.88728 0.404 15.88216 C ? A ? 81 CD1 1
   ATOM 1158 CD2 A LEU A 98 ? 2.26584 5.46497 15.92994 0.404 19.26695 C ? A ? 81 CD2 1
   ATOM 1159 N B LEU A 98 ? 5.46825 8.74949 17.60795 0.596 14.66752 N ? A ? 81 N 1
   ATOM 1160 CA B LEU A 98 ? 5.00725 8.04768 16.41525 0.596 13.02567 C ? A ? 81 CA 1
   ATOM 1161 C B LEU A 98 ? 4.57221 9.03109 15.34350 0.596 15.72793 C ? A ? 81 C 1
   ATOM 1162 O B LEU A 98 ? 3.73542 9.90758 15.59560 0.596 16.82699 O ? A ? 81 O 1
   ATOM 1163 CB B LEU A 98 ? 3.81631 7.13022 16.82284 0.596 13.46735 C ? A ? 81 CB 1
   ATOM 1164 CG B LEU A 98 ? 3.35358 6.01128 15.88668 0.596 17.90260 C ? A ? 81 CG 1
   ATOM 1165 CD1 B LEU A 98 ? 4.41155 4.96237 15.64673 0.596 14.96547 C ? A ? 81 CD1 1
   ATOM 1166 CD2 B LEU A 98 ? 2.15822 5.40583 16.65468 0.596 15.70902 C ? A ? 81 CD2 1
   ATOM 1167 N A GLY A 99 ? 5.10464 8.91847 14.59474 0.404 16.92634 N ? A ? 82 N 1
   ATOM 1168 CA A GLY A 99 ? 4.71072 9.87068 13.57516 0.404 15.80643 C ? A ? 82 CA 1
   ATOM 1169 C A GLY A 99 ? 5.59474 11.09462 13.43298 0.404 16.83939 C ? A ? 82 C 1
   ATOM 1170 O A GLY A 99 ? 5.37638 11.88738 12.50650 0.404 15.59463 O ? A ? 82 O 1
   ATOM 1171 N B GLY A 99 ? 5.17995 8.92050 14.15572 0.596 15.77211 N ? A ? 82 N 1
   ATOM 1172 CA B GLY A 99 ? 4.86342 9.77916 13.04390 0.596 14.71878 C ? A ? 82 CA 1
   ATOM 1173 C B GLY A 99 ? 5.71079 11.03014 12.94588 0.596 16.65385 C ? A ? 82 C 1
   ATOM 1174 O B GLY A 99 ? 5.62112 11.74219 11.93162 0.596 17.93186 O ? A ? 82 O 1
   ATOM 1175 N A GLU A 100 ? 6.59305 11.26466 14.29763 0.404 16.27958 N ? A ? 83 N 1
   ATOM 1176 CA A GLU A 100 ? 7.40764 12.47759 14.29559 0.404 13.64473 C ? A ? 83 CA 1
   ATOM 1177 C A GLU A 100 ? 8.39788 12.49800 13.12648 0.404 16.96850 C ? A ? 83 C 1
   ATOM 1178 O A GLU A 100 ? 8.98586 11.47238 12.76262 0.404 16.15732 O ? A ? 83 O 1
   ATOM 1179 CB A GLU A 100 ? 8.15286 12.59844 15.63126 0.404 13.77667 C ? A ? 83 CB 1
   ATOM 1180 CG A GLU A 100 ? 8.89041 13.93368 15.73333 0.404 15.19484 C ? A ? 83 CG 1
   ATOM 1181 CD A GLU A 100 ? 9.68233 14.06958 17.01980 0.404 16.13165 C ? A ? 83 CD 1
   ATOM 1182 OE1 A GLU A 100 ? 9.22744 13.60471 18.08729 0.404 14.51217 O ? A ? 83 OE1 1
   ATOM 1183 OE2 A GLU A 100 ? 10.76912 14.66824 16.96715 0.404 17.31692 O ? A ? 83 OE2 1
   ATOM 1184 N B GLU A 100 ? 6.52585 11.31729 13.96403 0.596 16.81837 N ? A ? 83 N 1
   ATOM 1185 CA B GLU A 100 ? 7.39571 12.49290 13.94442 0.596 13.95861 C ? A ? 83 CA 1
   ATOM 1186 C B GLU A 100 ? 8.40362 12.41410 12.79336 0.596 16.67982 C ? A ? 83 C 1
   ATOM 1187 O B GLU A 100 ? 8.91420 11.33673 12.44757 0.596 15.85005 O ? A ? 83 O 1
   ATOM 1188 CB B GLU A 100 ? 8.13517 12.60586 15.27876 0.596 14.62674 C ? A ? 83 CB 1
   ATOM 1189 CG B GLU A 100 ? 9.05030 13.85639 15.33441 0.596 14.26921 C ? A ? 83 CG 1
   ATOM 1190 CD B GLU A 100 ? 9.69242 13.97594 16.70266 0.596 15.50103 C ? A ? 83 CD 1
   ATOM 1191 OE1 B GLU A 100 ? 8.97969 13.73241 17.68188 0.596 15.95146 O ? A ? 83 OE1 1
   ATOM 1192 OE2 B GLU A 100 ? 10.85713 14.37063 16.83297 0.596 17.69140 O ? A ? 83 OE2 1
   ATOM 1193 N A LYS A 101 ? 8.56684 13.67821 12.51777 0.404 15.48266 N ? A ? 84 N 1
   ATOM 1194 CA A LYS A 101 ? 9.63423 13.91466 11.55395 0.404 16.08216 C ? A ? 84 CA 1
   ATOM 1195 C A LYS A 101 ? 10.67429 14.76748 12.24666 0.404 16.76578 C ? A ? 84 C 1
   ATOM 1196 O A LYS A 101 ? 10.31640 15.68846 12.98822 0.404 15.28937 O ? A ? 84 O 1
   ATOM 1197 CB A LYS A 101 ? 9.11242 14.61822 10.29966 0.404 15.29134 C ? A ? 84 CB 1
   ATOM 1198 CG A LYS A 101 ? 7.99243 13.86699 9.61255 0.404 21.63161 C ? A ? 84 CG 1
   ATOM 1199 CD A LYS A 101 ? 7.53540 14.71776 8.42190 0.404 22.45183 C ? A ? 84 CD 1
   ATOM 1200 CE A LYS A 101 ? 6.65060 13.98398 7.44344 0.404 39.66421 C ? A ? 84 CE 1
   ATOM 1201 NZ A LYS A 101 ? 6.03790 14.98228 6.51067 0.404 33.50673 N ? A ? 84 NZ 1
   ATOM 1202 N B LYS A 101 ? 8.70187 13.57784 12.20307 0.596 14.95906 N ? A ? 84 N 1
   ATOM 1203 CA B LYS A 101 ? 9.87844 13.73382 11.35097 0.596 15.09249 C ? A ? 84 CA 1
   ATOM 1204 C B LYS A 101 ? 10.82336 14.67697 12.05075 0.596 16.24479 C ? A ? 84 C 1
   ATOM 1205 O B LYS A 101 ? 10.37578 15.68487 12.61169 0.596 16.35324 O ? A ? 84 O 1
   ATOM 1206 CB B LYS A 101 ? 9.50345 14.31772 9.99881 0.596 17.95140 C ? A ? 84 CB 1
   ATOM 1207 CG B LYS A 101 ? 8.55250 13.41203 9.21909 0.596 19.43761 C ? A ? 84 CG 1
   ATOM 1208 CD B LYS A 101 ? 8.10204 14.20966 7.98711 0.596 24.84280 C ? A ? 84 CD 1
   ATOM 1209 CE B LYS A 101 ? 7.28496 13.40545 7.02294 0.596 37.29060 C ? A ? 84 CE 1
   ATOM 1210 NZ B LYS A 101 ? 6.80101 14.36855 5.97004 0.596 43.39576 N ? A ? 84 NZ 1
   ATOM 1211 N A ALA A 102 ? 11.94376 14.38871 12.10150 0.404 15.28627 N ? A ? 85 N 1
   ATOM 1212 CA A ALA A 102 ? 13.00761 15.07378 12.82825 0.404 14.78835 C ? A ? 85 CA 1
   ATOM 1213 C A ALA A 102 ? 14.29532 14.94452 12.03885 0.404 16.11105 C ? A ? 85 C 1
   ATOM 1214 O A ALA A 102 ? 14.36837 14.20849 11.05117 0.404 16.75242 O ? A ? 85 O 1
   ATOM 1215 CB A ALA A 102 ? 13.17980 14.48337 14.24667 0.404 13.72073 C ? A ? 85 CB 1
   ATOM 1216 N B ALA A 102 ? 12.09173 14.27610 12.15418 0.596 14.44993 N ? A ? 85 N 1
   ATOM 1217 CA B ALA A 102 ? 13.05072 15.10326 12.88881 0.596 14.82590 C ? A ? 85 CA 1
   ATOM 1218 C B ALA A 102 ? 14.37560 15.06740 12.16789 0.596 16.45342 C ? A ? 85 C 1
   ATOM 1219 O B ALA A 102 ? 14.56792 14.26878 11.23793 0.596 16.60575 O ? A ? 85 O 1
   ATOM 1220 CB B ALA A 102 ? 13.24289 14.58126 14.33169 0.596 13.48383 C ? A ? 85 CB 1
   ATOM 1221 N A VAL A 103 ? 15.31837 15.67780 12.48307 0.404 14.19183 N ? A ? 86 N 1
   ATOM 1222 CA A VAL A 103 ? 16.65981 15.60462 11.89888 0.404 14.19967 C ? A ? 86 CA 1
   ATOM 1223 C A VAL A 103 ? 17.61737 15.39387 13.05799 0.404 15.84067 C ? A ? 86 C 1
   ATOM 1224 O A VAL A 103 ? 17.51204 16.07950 14.07824 0.404 17.02476 O ? A ? 86 O 1
   ATOM 1225 CB A VAL A 103 ? 17.02371 16.87617 11.10364 0.404 18.51174 C ? A ? 86 CB 1
   ATOM 1226 CG1 A VAL A 103 ? 18.52557 16.90976 10.74251 0.404 15.76691 C ? A ? 86 CG1 1
   ATOM 1227 CG2 A VAL A 103 ? 16.16573 16.97316 9.86241 0.404 18.20056 C ? A ? 86 CG2 1
   ATOM 1228 N B VAL A 103 ? 15.30027 15.93654 12.60359 0.596 13.36366 N ? A ? 86 N 1
   ATOM 1229 CA B VAL A 103 ? 16.66723 15.94471 12.06910 0.596 16.02031 C ? A ? 86 CA 1
   ATOM 1230 C B VAL A 103 ? 17.58912 15.56908 13.21228 0.596 15.57664 C ? A ? 86 C 1
   ATOM 1231 O B VAL A 103 ? 17.60707 16.24588 14.24588 0.596 17.43607 O ? A ? 86 O 1
   ATOM 1232 CB B VAL A 103 ? 17.06790 17.30869 11.48042 0.596 16.42838 C ? A ? 86 CB 1
   ATOM 1233 CG1 B VAL A 103 ? 18.58530 17.25868 11.05116 0.596 15.23525 C ? A ? 86 CG1 1
   ATOM 1234 CG2 B VAL A 103 ? 16.17465 17.62081 10.27788 0.596 19.17223 C ? A ? 86 CG2 1
   ATOM 1235 N A LEU A 104 ? 18.51646 14.42540 12.92306 0.404 15.13453 N ? A ? 87 N 1
   ATOM 1236 CA A LEU A 104 ? 19.45771 14.08741 13.97729 0.404 16.42346 C ? A ? 87 CA 1
   ATOM 1237 C A LEU A 104 ? 20.84969 14.47689 13.52394 0.404 15.77430 C ? A ? 87 C 1
   ATOM 1238 O A LEU A 104 ? 21.35603 13.92948 12.53204 0.404 17.49564 O ? A ? 87 O 1
   ATOM 1239 CB A LEU A 104 ? 19.45446 12.58365 14.28098 0.404 15.71517 C ? A ? 87 CB 1
   ATOM 1240 CG A LEU A 104 ? 18.07949 12.02450 14.52667 0.404 12.95780 C ? A ? 87 CG 1
   ATOM 1241 CD1 A LEU A 104 ? 18.01829 10.54023 14.23076 0.404 17.75917 C ? A ? 87 CD1 1
   ATOM 1242 CD2 A LEU A 104 ? 17.71714 12.25539 16.05025 0.404 10.09248 C ? A ? 87 CD2 1
   ATOM 1243 N B LEU A 104 ? 18.36036 14.50420 13.01761 0.596 15.62679 N ? A ? 87 N 1
   ATOM 1244 CA B LEU A 104 ? 19.37744 14.09861 13.95929 0.596 16.31083 C ? A ? 87 CA 1
   ATOM 1245 C B LEU A 104 ? 20.72014 14.53509 13.39036 0.596 16.05715 C ? A ? 87 C 1
   ATOM 1246 O B LEU A 104 ? 21.05173 14.21165 12.23417 0.596 17.25627 O ? A ? 87 O 1
   ATOM 1247 CB B LEU A 104 ? 19.39101 12.56212 14.14657 0.596 15.71499 C ? A ? 87 CB 1
   ATOM 1248 CG B LEU A 104 ? 18.51591 11.78770 15.12592 0.596 19.11141 C ? A ? 87 CG 1
   ATOM 1249 CD1 B LEU A 104 ? 18.70867 10.27917 14.93814 0.596 13.56859 C ? A ? 87 CD1 1
   ATOM 1250 CD2 B LEU A 104 ? 18.83596 12.20726 16.55626 0.596 15.67800 C ? A ? 87 CD2 1
   ATOM 1251 N A THR A 105 ? 21.46371 15.39452 14.25631 0.404 13.92036 N ? A ? 88 N 1
   ATOM 1252 CA A THR A 105 ? 22.86295 15.73026 14.06005 0.404 14.41652 C ? A ? 88 CA 1
   ATOM 1253 C A THR A 105 ? 23.70233 14.89014 15.00809 0.404 15.23137 C ? A ? 88 C 1
   ATOM 1254 O A THR A 105 ? 23.47231 14.90803 16.21727 0.404 16.49940 O ? A ? 88 O 1
   ATOM 1255 CB A THR A 105 ? 23.09810 17.21121 14.34279 0.404 15.36564 C ? A ? 88 CB 1
   ATOM 1256 OG1 A THR A 105 ? 22.21274 17.99627 13.52950 0.404 18.23848 O ? A ? 88 OG1 1
   ATOM 1257 CG2 A THR A 105 ? 24.55161 17.55112 14.01627 0.404 16.19694 C ? A ? 88 CG2 1
   ATOM 1258 N B THR A 105 ? 21.49329 15.25508 14.19089 0.596 14.03044 N ? A ? 88 N 1
   ATOM 1259 CA B THR A 105 ? 22.82504 15.68858 13.79100 0.596 14.33037 C ? A ? 88 CA 1
   ATOM 1260 C B THR A 105 ? 23.79907 15.05559 14.77380 0.596 15.72681 C ? A ? 88 C 1
   ATOM 1261 O B THR A 105 ? 23.74406 15.32556 15.98053 0.596 15.97516 O ? A ? 88 O 1
   ATOM 1262 CB B THR A 105 ? 22.93145 17.22439 13.79352 0.596 16.07127 C ? A ? 88 CB 1
   ATOM 1263 OG1 B THR A 105 ? 21.99544 17.76733 12.84930 0.596 16.45738 O ? A ? 88 OG1 1
   ATOM 1264 CG2 B THR A 105 ? 24.33415 17.67768 13.33881 0.596 17.62695 C ? A ? 88 CG2 1
   ATOM 1265 N A ILE A 106 ? 24.71463 14.20120 14.47955 0.404 14.69343 N ? A ? 89 N 1
   ATOM 1266 CA A ILE A 106 ? 25.42377 13.17039 15.25460 0.404 13.27940 C ? A ? 89 CA 1
   ATOM 1267 C A ILE A 106 ? 26.92350 13.39971 15.09847 0.404 16.68357 C ? A ? 89 C 1
   ATOM 1268 O A ILE A 106 ? 27.47323 13.09486 14.04095 0.404 13.42639 O ? A ? 89 O 1
   ATOM 1269 CB A ILE A 106 ? 25.05037 11.75228 14.76653 0.404 13.84234 C ? A ? 89 CB 1
   ATOM 1270 CG1 A ILE A 106 ? 23.53034 11.48888 14.92156 0.404 14.13179 C ? A ? 89 CG1 1
   ATOM 1271 CG2 A ILE A 106 ? 25.82473 10.66610 15.55662 0.404 16.29817 C ? A ? 89 CG2 1
   ATOM 1272 CD1 A ILE A 106 ? 23.07511 10.12264 14.34142 0.404 15.43928 C ? A ? 89 CD1 1
   ATOM 1273 N B ILE A 106 ? 24.69218 14.20862 14.27118 0.596 13.99595 N ? A ? 89 N 1
   ATOM 1274 CA B ILE A 106 ? 25.43035 13.26241 15.12216 0.596 13.33570 C ? A ? 89 CA 1
   ATOM 1275 C B ILE A 106 ? 26.91053 13.51076 14.88255 0.596 16.15000 C ? A ? 89 C 1
   ATOM 1276 O B ILE A 106 ? 27.35809 13.41990 13.73971 0.596 16.50891 O ? A ? 89 O 1
   ATOM 1277 CB B ILE A 106 ? 25.05755 11.80183 14.77682 0.596 13.82882 C ? A ? 89 CB 1
   ATOM 1278 CG1 B ILE A 106 ? 23.58196 11.51689 15.20505 0.596 14.06242 C ? A ? 89 CG1 1
   ATOM 1279 CG2 B ILE A 106 ? 25.97295 10.79258 15.54651 0.596 16.94712 C ? A ? 89 CG2 1
   ATOM 1280 CD1 B ILE A 106 ? 22.88392 10.32032 14.45968 0.596 15.50359 C ? A ? 89 CD1 1
   ATOM 1281 N A THR A 107 ? 27.60559 13.85879 16.15640 0.404 14.83138 N ? A ? 90 N 1
   ATOM 1282 CA A THR A 107 ? 29.07496 14.00520 16.00758 0.404 18.30011 C ? A ? 90 CA 1
   ATOM 1283 C A THR A 107 ? 29.71287 12.62295 15.81682 0.404 15.92997 C ? A ? 90 C 1
   ATOM 1284 O A THR A 107 ? 29.08731 11.59859 16.09405 0.404 15.59482 O ? A ? 90 O 1
   ATOM 1285 CB A THR A 107 ? 29.70342 14.74939 17.19838 0.404 16.37765 C ? A ? 90 CB 1
   ATOM 1286 OG1 A THR A 107 ? 29.75666 13.91432 18.37086 0.404 18.56458 O ? A ? 90 OG1 1
   ATOM 1287 CG2 A THR A 107 ? 28.92410 16.04193 17.49051 0.404 19.88370 C ? A ? 90 CG2 1
   ATOM 1288 N B THR A 107 ? 27.66234 13.80834 15.94749 0.596 15.62320 N ? A ? 90 N 1
   ATOM 1289 CA B THR A 107 ? 29.13062 13.99445 15.79056 0.596 18.17974 C ? A ? 90 CA 1
   ATOM 1290 C B THR A 107 ? 29.84027 12.63351 15.81744 0.596 15.73427 C ? A ? 90 C 1
   ATOM 1291 O B THR A 107 ? 29.23257 11.60074 16.11821 0.596 15.71879 O ? A ? 90 O 1
   ATOM 1292 CB B THR A 107 ? 29.65256 14.96914 16.85715 0.596 17.41671 C ? A ? 90 CB 1
   ATOM 1293 OG1 B THR A 107 ? 29.70775 14.35183 18.15268 0.596 20.68958 O ? A ? 90 OG1 1
   ATOM 1294 CG2 B THR A 107 ? 28.72771 16.24441 16.87759 0.596 16.71305 C ? A ? 90 CG2 1
   ATOM 1295 N A PRO A 108 ? 30.94120 12.55964 15.30079 0.404 17.13940 N ? A ? 91 N 1
   ATOM 1296 CA A PRO A 108 ? 31.57118 11.23835 15.12946 0.404 16.61555 C ? A ? 91 CA 1
   ATOM 1297 C A PRO A 108 ? 31.66083 10.44278 16.41043 0.404 14.73262 C ? A ? 91 C 1
   ATOM 1298 O A PRO A 108 ? 31.60079 9.20425 16.37254 0.404 16.92592 O ? A ? 91 O 1
   ATOM 1299 CB A PRO A 108 ? 32.96643 11.59408 14.56582 0.404 16.36164 C ? A ? 91 CB 1
   ATOM 1300 CG A PRO A 108 ? 32.74869 12.82162 13.81729 0.404 16.09741 C ? A ? 91 CG 1
   ATOM 1301 CD A PRO A 108 ? 31.69122 13.61296 14.59301 0.404 15.34874 C ? A ? 91 CD 1
   ATOM 1302 N B PRO A 108 ? 31.13952 12.59178 15.49853 0.596 16.68679 N ? A ? 91 N 1
   ATOM 1303 CA B PRO A 108 ? 31.78760 11.28189 15.27730 0.596 16.50655 C ? A ? 91 CA 1
   ATOM 1304 C B PRO A 108 ? 31.69374 10.33737 16.44590 0.596 14.88746 C ? A ? 91 C 1
   ATOM 1305 O B PRO A 108 ? 31.48353 9.12657 16.27195 0.596 17.42153 O ? A ? 91 O 1
   ATOM 1306 CB B PRO A 108 ? 33.27113 11.67957 14.96391 0.596 13.67544 C ? A ? 91 CB 1
   ATOM 1307 CG B PRO A 108 ? 33.11569 12.99049 14.27537 0.596 13.14332 C ? A ? 91 CG 1
   ATOM 1308 CD B PRO A 108 ? 31.93496 13.69625 14.93639 0.596 15.46837 C ? A ? 91 CD 1
   ATOM 1309 N A ASP A 109 ? 31.76868 11.10555 17.56757 0.404 14.86242 N ? A ? 92 N 1
   ATOM 1310 CA A ASP A 109 ? 31.73053 10.37720 18.83819 0.404 18.64318 C ? A ? 92 CA 1
   ATOM 1311 C A ASP A 109 ? 30.49032 9.47892 18.95926 0.404 18.39514 C ? A ? 92 C 1
   ATOM 1312 O A ASP A 109 ? 30.55078 8.40783 19.57280 0.404 17.41747 O ? A ? 92 O 1
   ATOM 1313 CB A ASP A 109 ? 31.74868 11.37433 20.00321 0.404 17.81176 C ? A ? 92 CB 1
   ATOM 1314 CG A ASP A 109 ? 32.37811 10.78332 21.26295 0.404 31.34874 C ? A ? 92 CG 1
   ATOM 1315 OD1 A ASP A 109 ? 33.02724 9.71914 21.17833 0.404 29.07387 O ? A ? 92 OD1 1
   ATOM 1316 OD2 A ASP A 109 ? 32.22461 11.39477 22.33849 0.404 33.01447 O ? A ? 92 OD2 1
   ATOM 1317 N B ASP A 109 ? 31.82933 10.86016 17.66111 0.596 15.73500 N ? A ? 92 N 1
   ATOM 1318 CA B ASP A 109 ? 31.81773 10.01826 18.85686 0.596 16.41776 C ? A ? 92 CA 1
   ATOM 1319 C B ASP A 109 ? 30.48021 9.27935 19.06778 0.596 18.04674 C ? A ? 92 C 1
   ATOM 1320 O B ASP A 109 ? 30.44160 8.29901 19.82456 0.596 18.26093 O ? A ? 92 O 1
   ATOM 1321 CB B ASP A 109 ? 32.07868 10.92920 20.04799 0.596 20.62791 C ? A ? 92 CB 1
   ATOM 1322 CG B ASP A 109 ? 32.42242 10.16961 21.31297 0.596 27.22790 C ? A ? 92 CG 1
   ATOM 1323 OD1 B ASP A 109 ? 33.35999 9.34310 21.27436 0.596 32.17085 O ? A ? 92 OD1 1
   ATOM 1324 OD2 B ASP A 109 ? 31.75198 10.41998 22.34571 0.596 35.38138 O ? A ? 92 OD2 1
   ATOM 1325 N A TYR A 110 ? 29.35718 9.91462 18.42155 0.404 14.93836 N ? A ? 93 N 1
   ATOM 1326 CA A TYR A 110 ? 28.12872 9.13312 18.50393 0.404 14.38210 C ? A ? 93 CA 1
   ATOM 1327 C A TYR A 110 ? 27.76160 8.51298 17.15933 0.404 16.85625 C ? A ? 93 C 1
   ATOM 1328 O A TYR A 110 ? 26.67433 7.92276 17.01442 0.404 14.77076 O ? A ? 93 O 1
   ATOM 1329 CB A TYR A 110 ? 26.99740 10.01352 18.97217 0.404 15.80969 C ? A ? 93 CB 1
   ATOM 1330 CG A TYR A 110 ? 27.02318 10.43469 20.41311 0.404 20.50433 C ? A ? 93 CG 1
   ATOM 1331 CD1 A TYR A 110 ? 27.86325 11.44847 20.84343 0.404 27.94722 C ? A ? 93 CD1 1
   ATOM 1332 CD2 A TYR A 110 ? 26.17193 9.84573 21.32499 0.404 19.99995 C ? A ? 93 CD2 1
   ATOM 1333 CE1 A TYR A 110 ? 27.88144 11.85276 22.17794 0.404 23.08385 C ? A ? 93 CE1 1
   ATOM 1334 CE2 A TYR A 110 ? 26.18051 10.23675 22.67801 0.404 20.63988 C ? A ? 93 CE2 1
   ATOM 1335 CZ A TYR A 110 ? 27.04174 11.24829 23.08545 0.404 29.15735 C ? A ? 93 CZ 1
   ATOM 1336 OH A TYR A 110 ? 27.07444 11.66381 24.40428 0.404 29.66822 O ? A ? 93 OH 1
   ATOM 1337 N B TYR A 110 ? 29.39291 9.79611 18.49626 0.596 15.09297 N ? A ? 93 N 1
   ATOM 1338 CA B TYR A 110 ? 28.06894 9.18868 18.58785 0.596 14.00156 C ? A ? 93 CA 1
   ATOM 1339 C B TYR A 110 ? 27.71987 8.48474 17.27549 0.596 16.94277 C ? A ? 93 C 1
   ATOM 1340 O B TYR A 110 ? 26.59555 7.98898 17.08040 0.596 14.91908 O ? A ? 93 O 1
   ATOM 1341 CB B TYR A 110 ? 27.06928 10.27571 18.91131 0.596 16.91525 C ? A ? 93 CB 1
   ATOM 1342 CG B TYR A 110 ? 26.93054 10.56246 20.38928 0.596 20.71549 C ? A ? 93 CG 1
   ATOM 1343 CD1 B TYR A 110 ? 28.02045 10.86497 21.16793 0.596 26.78061 C ? A ? 93 CD1 1
   ATOM 1344 CD2 B TYR A 110 ? 25.71170 10.45988 21.00204 0.596 17.71452 C ? A ? 93 CD2 1
   ATOM 1345 CE1 B TYR A 110 ? 27.87806 11.12313 22.55548 0.596 33.19941 C ? A ? 93 CE1 1
   ATOM 1346 CE2 B TYR A 110 ? 25.55010 10.74061 22.38584 0.596 20.43671 C ? A ? 93 CE2 1
   ATOM 1347 CZ B TYR A 110 ? 26.63412 11.04447 23.15158 0.596 28.62121 C ? A ? 93 CZ 1
   ATOM 1348 OH B TYR A 110 ? 26.44505 11.27690 24.52129 0.596 25.80054 O ? A ? 93 OH 1
   ATOM 1349 N A GLY A 111 ? 28.64412 8.63259 16.17203 0.404 16.14196 N ? A ? 94 N 1
   ATOM 1350 CA A GLY A 111 ? 28.45943 7.94582 14.91433 0.404 14.49308 C ? A ? 94 CA 1
   ATOM 1351 C A GLY A 111 ? 29.48623 6.83359 14.72996 0.404 15.77850 C ? A ? 94 C 1
   ATOM 1352 O A GLY A 111 ? 29.43046 5.81143 15.41333 0.404 16.88820 O ? A ? 94 O 1
   ATOM 1353 N B GLY A 111 ? 28.70825 8.36586 16.39810 0.596 15.22205 N ? A ? 94 N 1
   ATOM 1354 CA B GLY A 111 ? 28.47201 7.93269 15.04130 0.596 14.37157 C ? A ? 94 CA 1
   ATOM 1355 C B GLY A 111 ? 29.56571 6.93541 14.69104 0.596 16.08221 C ? A ? 94 C 1
   ATOM 1356 O B GLY A 111 ? 29.73129 5.94657 15.39826 0.596 17.00371 O ? A ? 94 O 1
   ATOM 1357 N A TYR A 112 ? 30.42801 7.01729 13.79860 0.404 15.04641 N ? A ? 95 N 1
   ATOM 1358 CA A TYR A 112 ? 31.38489 5.96965 13.44950 0.404 12.55328 C ? A ? 95 CA 1
   ATOM 1359 C A TYR A 112 ? 32.81702 6.35979 13.79709 0.404 15.72708 C ? A ? 95 C 1
   ATOM 1360 O A TYR A 112 ? 33.76303 5.67658 13.37986 0.404 13.85817 O ? A ? 95 O 1
   ATOM 1361 CB A TYR A 112 ? 31.28574 5.62060 11.96353 0.404 14.30791 C ? A ? 95 CB 1
   ATOM 1362 CG A TYR A 112 ? 29.99593 4.91012 11.62548 0.404 14.23477 C ? A ? 95 CG 1
   ATOM 1363 CD1 A TYR A 112 ? 29.80209 3.57332 11.96810 0.404 14.56188 C ? A ? 95 CD1 1
   ATOM 1364 CD2 A TYR A 112 ? 28.98349 5.58102 10.96553 0.404 13.40688 C ? A ? 95 CD2 1
   ATOM 1365 CE1 A TYR A 112 ? 28.61680 2.91659 11.63458 0.404 15.75482 C ? A ? 95 CE1 1
   ATOM 1366 CE2 A TYR A 112 ? 27.78935 4.94929 10.63404 0.404 15.20263 C ? A ? 95 CE2 1
   ATOM 1367 CZ A TYR A 112 ? 27.62105 3.62566 10.97359 0.404 15.98119 C ? A ? 95 CZ 1
   ATOM 1368 OH A TYR A 112 ? 26.43476 3.04757 10.63701 0.404 14.92506 O ? A ? 95 OH 1
   ATOM 1369 N B TYR A 112 ? 30.32182 7.17396 13.61269 0.596 14.45517 N ? A ? 95 N 1
   ATOM 1370 CA B TYR A 112 ? 31.31635 6.18824 13.19239 0.596 13.17759 C ? A ? 95 CA 1
   ATOM 1371 C B TYR A 112 ? 32.74413 6.62217 13.51631 0.596 13.55214 C ? A ? 95 C 1
   ATOM 1372 O B TYR A 112 ? 33.69343 5.96838 13.06537 0.596 14.55439 O ? A ? 95 O 1
   ATOM 1373 CB B TYR A 112 ? 31.18501 5.88927 11.68771 0.596 12.45741 C ? A ? 95 CB 1
   ATOM 1374 CG B TYR A 112 ? 29.83858 5.24243 11.33679 0.596 13.21816 C ? A ? 95 CG 1
   ATOM 1375 CD1 B TYR A 112 ? 29.60648 3.91061 11.64625 0.596 16.08088 C ? A ? 95 CD1 1
   ATOM 1376 CD2 B TYR A 112 ? 28.80776 5.97834 10.72908 0.596 15.55421 C ? A ? 95 CD2 1
   ATOM 1377 CE1 B TYR A 112 ? 28.37443 3.28465 11.33555 0.596 16.29294 C ? A ? 95 CE1 1
   ATOM 1378 CE2 B TYR A 112 ? 27.52403 5.34516 10.39356 0.596 11.70823 C ? A ? 95 CE2 1
   ATOM 1379 CZ B TYR A 112 ? 27.34852 4.02070 10.72144 0.596 16.65781 C ? A ? 95 CZ 1
   ATOM 1380 OH B TYR A 112 ? 26.14326 3.42402 10.45330 0.596 15.42908 O ? A ? 95 OH 1
   ATOM 1381 N A GLY A 113 ? 32.99693 7.42234 14.56810 0.404 14.56748 N ? A ? 96 N 1
   ATOM 1382 CA A GLY A 113 ? 34.31765 7.67523 15.12132 0.404 14.58328 C ? A ? 96 CA 1
   ATOM 1383 C A GLY A 113 ? 35.34894 8.10046 14.08581 0.404 15.76339 C ? A ? 96 C 1
   ATOM 1384 O A GLY A 113 ? 35.06039 8.79818 13.09702 0.404 16.22807 O ? A ? 96 O 1
   ATOM 1385 N B GLY A 113 ? 32.90892 7.67040 14.31852 0.596 14.22700 N ? A ? 96 N 1
   ATOM 1386 CA B GLY A 113 ? 34.20016 7.98883 14.94738 0.596 14.74972 C ? A ? 96 CA 1
   ATOM 1387 C B GLY A 113 ? 35.34458 8.15696 13.97086 0.596 15.97885 C ? A ? 96 C 1
   ATOM 1388 O B GLY A 113 ? 35.19503 8.69366 12.86102 0.596 15.96341 O ? A ? 96 O 1
   ATOM 1389 N A ALA A 114 ? 36.58693 7.67060 14.34304 0.404 17.07321 N ? A ? 97 N 1
   ATOM 1390 CA A ALA A 114 ? 37.73802 8.11698 13.55533 0.404 15.15013 C ? A ? 97 CA 1
   ATOM 1391 C A ALA A 114 ? 37.74974 7.52400 12.15749 0.404 17.00856 C ? A ? 97 C 1
   ATOM 1392 O A ALA A 114 ? 38.23181 8.17858 11.22594 0.404 16.76197 O ? A ? 97 O 1
   ATOM 1393 CB A ALA A 114 ? 39.04365 7.73438 14.27844 0.404 15.59192 C ? A ? 97 CB 1
   ATOM 1394 N B ALA A 114 ? 36.52858 7.73638 14.42758 0.596 16.84893 N ? A ? 97 N 1
   ATOM 1395 CA B ALA A 114 ? 37.74856 7.98085 13.65141 0.596 15.89609 C ? A ? 97 CA 1
   ATOM 1396 C B ALA A 114 ? 37.74159 7.21182 12.34735 0.596 17.09891 C ? A ? 97 C 1
   ATOM 1397 O B ALA A 114 ? 38.19775 7.73419 11.32439 0.596 17.98496 O ? A ? 97 O 1
   ATOM 1398 CB B ALA A 114 ? 39.00514 7.58994 14.46711 0.596 15.18250 C ? A ? 97 CB 1
   ATOM 1399 N A ARG A 115 ? 37.26579 6.28675 12.00254 0.404 14.98758 N ? A ? 98 N 1
   ATOM 1400 CA A ARG A 115 ? 37.36574 5.54557 10.74453 0.404 13.78303 C ? A ? 98 CA 1
   ATOM 1401 C A ARG A 115 ? 36.23049 5.88781 9.77600 0.404 14.20025 C ? A ? 98 C 1
   ATOM 1402 O A ARG A 115 ? 36.43211 5.92687 8.54743 0.404 14.44883 O ? A ? 98 O 1
   ATOM 1403 CB A ARG A 115 ? 37.36370 4.04329 11.04621 0.404 16.71306 C ? A ? 98 CB 1
   ATOM 1404 CG A ARG A 115 ? 37.30120 3.13208 9.80929 0.404 15.62541 C ? A ? 98 CG 1
   ATOM 1405 CD A ARG A 115 ? 37.11180 1.65391 10.19493 0.404 15.81880 C ? A ? 98 CD 1
   ATOM 1406 NE A ARG A 115 ? 38.06599 1.18125 11.20273 0.404 19.60844 N ? A ? 98 NE 1
   ATOM 1407 CZ A ARG A 115 ? 39.31977 0.82589 10.93464 0.404 17.79885 C ? A ? 98 CZ 1
   ATOM 1408 NH1 A ARG A 115 ? 39.82643 0.93243 9.71245 0.404 16.37920 N ? A ? 98 NH1 1
   ATOM 1409 NH2 A ARG A 115 ? 40.08940 0.36155 11.91520 0.404 18.45495 N ? A ? 98 NH2 1
   ATOM 1410 N B ARG A 115 ? 37.28371 5.96095 12.36770 0.596 13.91992 N ? A ? 98 N 1
   ATOM 1411 CA B ARG A 115 ? 37.41468 5.18475 11.13432 0.596 14.15090 C ? A ? 98 CA 1
   ATOM 1412 C B ARG A 115 ? 36.36594 5.56869 10.10628 0.596 14.18951 C ? A ? 98 C 1
   ATOM 1413 O B ARG A 115 ? 36.61347 5.45023 8.90045 0.596 16.92835 O ? A ? 98 O 1
   ATOM 1414 CB B ARG A 115 ? 37.28185 3.69918 11.44803 0.596 14.83019 C ? A ? 98 CB 1
   ATOM 1415 CG B ARG A 115 ? 37.32174 2.79220 10.14845 0.596 15.65793 C ? A ? 98 CG 1
   ATOM 1416 CD B ARG A 115 ? 37.36636 1.34389 10.59366 0.596 20.47775 C ? A ? 98 CD 1
   ATOM 1417 NE B ARG A 115 ? 38.54219 1.11384 11.43528 0.596 14.03487 N ? A ? 98 NE 1
   ATOM 1418 CZ B ARG A 115 ? 39.76210 0.88777 10.95631 0.596 18.35775 C ? A ? 98 CZ 1
   ATOM 1419 NH1 B ARG A 115 ? 40.00881 0.86439 9.65022 0.596 16.35964 N ? A ? 98 NH1 1
   ATOM 1420 NH2 B ARG A 115 ? 40.76900 0.74626 11.80095 0.596 18.71577 N ? A ? 98 NH2 1
   ATOM 1421 N A GLY A 116 ? 35.03001 6.14751 10.28835 0.404 13.17666 N ? A ? 99 N 1
   ATOM 1422 CA A GLY A 116 ? 33.88984 6.29641 9.39529 0.404 14.32813 C ? A ? 99 CA 1
   ATOM 1423 C A GLY A 116 ? 33.34597 4.92919 8.99654 0.404 16.23668 C ? A ? 99 C 1
   ATOM 1424 O A GLY A 116 ? 33.57617 3.93255 9.67371 0.404 14.83372 O ? A ? 99 O 1
   ATOM 1425 N B GLY A 116 ? 35.17330 5.95806 10.53516 0.596 13.21716 N ? A ? 99 N 1
   ATOM 1426 CA B GLY A 116 ? 34.12671 6.10199 9.52976 0.596 15.17770 C ? A ? 99 CA 1
   ATOM 1427 C B GLY A 116 ? 33.53570 4.72465 9.21885 0.596 15.89361 C ? A ? 99 C 1
   ATOM 1428 O B GLY A 116 ? 33.65884 3.78096 10.00020 0.596 16.41053 O ? A ? 99 O 1
   ATOM 1429 N A PHE A 117 ? 32.59659 4.89177 7.89156 0.404 13.70959 N ? A ? 100 N 1
   ATOM 1430 CA A PHE A 117 ? 32.09051 3.62933 7.34629 0.404 17.43835 C ? A ? 100 CA 1
   ATOM 1431 C A PHE A 117 ? 32.78997 3.34262 6.02557 0.404 14.57608 C ? A ? 100 C 1
   ATOM 1432 O A PHE A 117 ? 32.64918 4.13478 5.08759 0.404 15.20405 O ? A ? 100 O 1
   ATOM 1433 CB A PHE A 117 ? 30.57611 3.66844 7.14375 0.404 17.22792 C ? A ? 100 CB 1
   ATOM 1434 CG A PHE A 117 ? 30.02295 2.31924 6.72369 0.404 17.69152 C ? A ? 100 CG 1
   ATOM 1435 CD1 A PHE A 117 ? 30.08132 1.92459 5.39995 0.404 15.51836 C ? A ? 100 CD1 1
   ATOM 1436 CD2 A PHE A 117 ? 29.53899 1.42995 7.67382 0.404 17.59878 C ? A ? 100 CD2 1
   ATOM 1437 CE1 A PHE A 117 ? 29.62545 0.63424 5.01410 0.404 20.12093 C ? A ? 100 CE1 1
   ATOM 1438 CE2 A PHE A 117 ? 29.08036 0.16962 7.29981 0.404 17.25668 C ? A ? 100 CE2 1
   ATOM 1439 CZ A PHE A 117 ? 29.12079 -0.22007 5.96718 0.404 19.92405 C ? A ? 100 CZ 1
   ATOM 1440 N B PHE A 117 ? 32.82330 4.63531 8.10091 0.596 15.49015 N ? A ? 100 N 1
   ATOM 1441 CA B PHE A 117 ? 32.20227 3.37731 7.68518 0.596 15.28187 C ? A ? 100 CA 1
   ATOM 1442 C B PHE A 117 ? 32.71175 3.16437 6.26290 0.596 14.77055 C ? A ? 100 C 1
   ATOM 1443 O B PHE A 117 ? 32.38381 3.96578 5.36301 0.596 15.65345 O ? A ? 100 O 1
   ATOM 1444 CB B PHE A 117 ? 30.66895 3.40322 7.75990 0.596 15.04792 C ? A ? 100 CB 1
   ATOM 1445 CG B PHE A 117 ? 30.11761 2.02337 7.57256 0.596 17.32313 C ? A ? 100 CG 1
   ATOM 1446 CD1 B PHE A 117 ? 30.06121 1.45920 6.31212 0.596 17.03167 C ? A ? 100 CD1 1
   ATOM 1447 CD2 B PHE A 117 ? 29.81208 1.26608 8.64317 0.596 15.13433 C ? A ? 100 CD2 1
   ATOM 1448 CE1 B PHE A 117 ? 29.63282 0.12653 6.13642 0.596 16.70976 C ? A ? 100 CE1 1
   ATOM 1449 CE2 B PHE A 117 ? 29.39919 -0.06209 8.52283 0.596 24.21152 C ? A ? 100 CE2 1
   ATOM 1450 CZ B PHE A 117 ? 29.28915 -0.63111 7.25954 0.596 14.36243 C ? A ? 100 CZ 1
   ATOM 1451 N A PRO A 118 ? 33.53452 2.22317 5.88581 0.404 16.60605 N ? A ? 101 N 1
   ATOM 1452 CA A PRO A 118 ? 34.25313 1.96334 4.63511 0.404 18.15504 C ? A ? 101 CA 1
   ATOM 1453 C A PRO A 118 ? 33.41999 2.20024 3.36492 0.404 18.25619 C ? A ? 101 C 1
   ATOM 1454 O A PRO A 118 ? 32.33344 1.63739 3.17552 0.404 17.96903 O ? A ? 101 O 1
   ATOM 1455 CB A PRO A 118 ? 34.66940 0.48732 4.79837 0.404 16.50561 C ? A ? 101 CB 1
   ATOM 1456 CG A PRO A 118 ? 34.92530 0.36990 6.27470 0.404 19.66712 C ? A ? 101 CG 1
   ATOM 1457 CD A PRO A 118 ? 33.81995 1.19940 6.91467 0.404 16.15159 C ? A ? 101 CD 1
   ATOM 1458 N B PRO A 118 ? 33.56518 2.15367 6.03081 0.596 16.85084 N ? A ? 101 N 1
   ATOM 1459 CA B PRO A 118 ? 34.26410 2.05279 4.75265 0.596 17.78889 C ? A ? 101 CA 1
   ATOM 1460 C B PRO A 118 ? 33.27864 1.98285 3.58687 0.596 18.67843 C ? A ? 101 C 1
   ATOM 1461 O B PRO A 118 ? 32.26196 1.27838 3.64904 0.596 22.05533 O ? A ? 101 O 1
   ATOM 1462 CB B PRO A 118 ? 35.06191 0.74395 4.89239 0.596 16.94936 C ? A ? 101 CB 1
   ATOM 1463 CG B PRO A 118 ? 35.32806 0.61833 6.38729 0.596 19.59668 C ? A ? 101 CG 1
   ATOM 1464 CD B PRO A 118 ? 34.05634 1.18459 7.03476 0.596 16.69926 C ? A ? 101 CD 1
   ATOM 1465 N A GLY A 119 ? 33.90345 3.11274 2.52180 0.404 17.77824 N ? A ? 102 N 1
   ATOM 1466 CA A GLY A 119 ? 33.30262 3.41939 1.23767 0.404 24.07309 C ? A ? 102 CA 1
   ATOM 1467 C A GLY A 119 ? 32.14640 4.39467 1.26694 0.404 24.13299 C ? A ? 102 C 1
   ATOM 1468 O A GLY A 119 ? 31.65937 4.77724 0.19343 0.404 25.30648 O ? A ? 102 O 1
   ATOM 1469 N B GLY A 119 ? 33.58755 2.74102 2.52941 0.596 17.32206 N ? A ? 102 N 1
   ATOM 1470 CA B GLY A 119 ? 32.76714 2.80901 1.33819 0.596 22.96950 C ? A ? 102 CA 1
   ATOM 1471 C B GLY A 119 ? 31.63057 3.80231 1.40855 0.596 23.22146 C ? A ? 102 C 1
   ATOM 1472 O B GLY A 119 ? 31.02580 4.09519 0.35826 0.596 22.37111 O ? A ? 102 O 1
   ATOM 1473 N A VAL A 120 ? 31.67957 4.80540 2.44746 0.404 16.15522 N ? A ? 103 N 1
   ATOM 1474 CA A VAL A 120 ? 30.43240 5.56179 2.53210 0.404 16.98543 C ? A ? 103 CA 1
   ATOM 1475 C A VAL A 120 ? 30.63731 6.80227 3.37965 0.404 19.21319 C ? A ? 103 C 1
   ATOM 1476 O A VAL A 120 ? 30.30575 7.91637 2.97100 0.404 16.70785 O ? A ? 103 O 1
   ATOM 1477 CB A VAL A 120 ? 29.29399 4.71794 3.13427 0.404 20.21483 C ? A ? 103 CB 1
   ATOM 1478 CG1 A VAL A 120 ? 27.97764 5.56437 3.17614 0.404 17.92954 C ? A ? 103 CG1 1
   ATOM 1479 CG2 A VAL A 120 ? 29.11052 3.39105 2.38756 0.404 21.78837 C ? A ? 103 CG2 1
   ATOM 1480 N B VAL A 120 ? 31.33397 4.35508 2.59335 0.596 17.80162 N ? A ? 103 N 1
   ATOM 1481 CA B VAL A 120 ? 30.09335 5.12466 2.77475 0.596 16.00979 C ? A ? 103 CA 1
   ATOM 1482 C B VAL A 120 ? 30.32919 6.45310 3.49740 0.596 20.61859 C ? A ? 103 C 1
   ATOM 1483 O B VAL A 120 ? 29.80296 7.48531 3.07764 0.596 19.46700 O ? A ? 103 O 1
   ATOM 1484 CB B VAL A 120 ? 29.01881 4.29131 3.50580 0.596 17.97982 C ? A ? 103 CB 1
   ATOM 1485 CG1 B VAL A 120 ? 27.62256 5.08236 3.50498 0.596 17.85194 C ? A ? 103 CG1 1
   ATOM 1486 CG2 B VAL A 120 ? 28.84933 2.87701 2.85946 0.596 20.03862 C ? A ? 103 CG2 1
   ATOM 1487 N A ILE A 121 ? 31.16535 6.59813 4.57770 0.404 17.58539 N ? A ? 104 N 1
   ATOM 1488 CA A ILE A 121 ? 31.28930 7.64064 5.58645 0.404 17.48335 C ? A ? 104 CA 1
   ATOM 1489 C A ILE A 121 ? 32.77444 7.82889 5.87255 0.404 16.74367 C ? A ? 104 C 1
   ATOM 1490 O A ILE A 121 ? 33.43128 6.89993 6.35849 0.404 17.24383 O ? A ? 104 O 1
   ATOM 1491 CB A ILE A 121 ? 30.52621 7.28705 6.87609 0.404 16.81075 C ? A ? 104 CB 1
   ATOM 1492 CG1 A ILE A 121 ? 29.03343 7.07033 6.57786 0.404 17.23759 C ? A ? 104 CG1 1
   ATOM 1493 CG2 A ILE A 121 ? 30.71343 8.41424 7.90383 0.404 17.31984 C ? A ? 104 CG2 1
   ATOM 1494 CD1 A ILE A 121 ? 28.12043 6.94179 7.81339 0.404 18.62112 C ? A ? 104 CD1 1
   ATOM 1495 N B ILE A 121 ? 31.13316 6.45258 4.56273 0.596 17.15807 N ? A ? 104 N 1
   ATOM 1496 CA B ILE A 121 ? 31.26084 7.65178 5.41656 0.596 17.53668 C ? A ? 104 CA 1
   ATOM 1497 C B ILE A 121 ? 32.72183 7.88218 5.82362 0.596 16.80291 C ? A ? 104 C 1
   ATOM 1498 O B ILE A 121 ? 33.36326 6.95685 6.36108 0.596 17.21156 O ? A ? 104 O 1
   ATOM 1499 CB B ILE A 121 ? 30.36255 7.52094 6.66859 0.596 17.53067 C ? A ? 104 CB 1
   ATOM 1500 CG1 B ILE A 121 ? 28.85936 7.74063 6.33318 0.596 16.96463 C ? A ? 104 CG1 1
   ATOM 1501 CG2 B ILE A 121 ? 30.81743 8.53292 7.75021 0.596 16.83812 C ? A ? 104 CG2 1
   ATOM 1502 CD1 B ILE A 121 ? 27.94986 7.17520 7.42736 0.596 21.84879 C ? A ? 104 CD1 1
   ATOM 1503 N A PRO A 122 ? 33.35583 8.98881 5.55646 0.404 19.05609 N ? A ? 105 N 1
   ATOM 1504 CA A PRO A 122 ? 34.76383 9.23503 5.90535 0.404 16.84707 C ? A ? 105 CA 1
   ATOM 1505 C A PRO A 122 ? 34.98257 9.19536 7.40626 0.404 17.80495 C ? A ? 105 C 1
   ATOM 1506 O A PRO A 122 ? 34.05386 9.30966 8.20805 0.404 15.85914 O ? A ? 105 O 1
   ATOM 1507 CB A PRO A 122 ? 35.03539 10.64926 5.36874 0.404 20.12420 C ? A ? 105 CB 1
   ATOM 1508 CG A PRO A 122 ? 33.98260 10.85534 4.26798 0.404 19.83447 C ? A ? 105 CG 1
   ATOM 1509 CD A PRO A 122 ? 32.75988 10.07528 4.75235 0.404 16.82631 C ? A ? 105 CD 1
   ATOM 1510 N B PRO A 122 ? 33.29101 9.08555 5.59048 0.596 19.34612 N ? A ? 105 N 1
   ATOM 1511 CA B PRO A 122 ? 34.70413 9.35350 5.97155 0.596 16.68635 C ? A ? 105 CA 1
   ATOM 1512 C B PRO A 122 ? 34.93506 9.31241 7.47251 0.596 17.82542 C ? A ? 105 C 1
   ATOM 1513 O B PRO A 122 ? 34.04222 9.61428 8.26051 0.596 17.08194 O ? A ? 105 O 1
   ATOM 1514 CB B PRO A 122 ? 34.96283 10.78783 5.47026 0.596 19.95727 C ? A ? 105 CB 1
   ATOM 1515 CG B PRO A 122 ? 33.84851 11.07449 4.42090 0.596 19.82138 C ? A ? 105 CG 1
   ATOM 1516 CD B PRO A 122 ? 32.65182 10.21083 4.87344 0.596 16.89685 C ? A ? 105 CD 1
   ATOM 1517 N A GLY A 123 ? 36.24196 9.04858 7.78646 0.404 16.64582 N ? A ? 106 N 1
   ATOM 1518 CA A GLY A 123 ? 36.59820 9.26233 9.17349 0.404 15.20998 C ? A ? 106 CA 1
   ATOM 1519 C A GLY A 123 ? 36.23419 10.66309 9.64262 0.404 16.22760 C ? A ? 106 C 1
   ATOM 1520 O A GLY A 123 ? 36.25651 11.63016 8.87655 0.404 16.88611 O ? A ? 106 O 1
   ATOM 1521 N B GLY A 123 ? 36.16793 9.00500 7.86509 0.596 16.59083 N ? A ? 106 N 1
   ATOM 1522 CA B GLY A 123 ? 36.54390 9.22480 9.25729 0.596 15.25550 C ? A ? 106 CA 1
   ATOM 1523 C B GLY A 123 ? 36.20526 10.63016 9.79530 0.596 16.17774 C ? A ? 106 C 1
   ATOM 1524 O B GLY A 123 ? 36.20769 11.60609 9.03869 0.596 17.09708 O ? A ? 106 O 1
   ATOM 1525 N A ASN A 124 ? 35.88996 10.76674 10.92672 0.404 16.01467 N ? A ? 107 N 1
   ATOM 1526 CA A ASN A 124 ? 35.58932 12.04427 11.56023 0.404 14.42250 C ? A ? 107 CA 1
   ATOM 1527 C A ASN A 124 ? 34.52684 12.82675 10.77761 0.404 16.01940 C ? A ? 107 C 1
   ATOM 1528 O A ASN A 124 ? 34.74007 13.96793 10.37160 0.404 18.75817 O ? A ? 107 O 1
   ATOM 1529 CB A ASN A 124 ? 36.87843 12.86059 11.72072 0.404 16.06870 C ? A ? 107 CB 1
   ATOM 1530 CG A ASN A 124 ? 36.71539 14.03698 12.67708 0.404 20.79591 C ? A ? 107 CG 1
   ATOM 1531 OD1 A ASN A 124 ? 36.15389 13.89223 13.77470 0.404 18.62338 O ? A ? 107 OD1 1
   ATOM 1532 ND2 A ASN A 124 ? 37.20506 15.19807 12.26867 0.404 19.57879 N ? A ? 107 ND2 1
   ATOM 1533 N B ASN A 124 ? 35.91712 10.74168 11.10680 0.596 15.47175 N ? A ? 107 N 1
   ATOM 1534 CA B ASN A 124 ? 35.69399 12.04024 11.75210 0.596 14.84129 C ? A ? 107 CA 1
   ATOM 1535 C B ASN A 124 ? 34.53913 12.82891 11.10569 0.596 16.33725 C ? A ? 107 C 1
   ATOM 1536 O B ASN A 124 ? 34.57493 14.07350 11.06168 0.596 15.66461 O ? A ? 107 O 1
   ATOM 1537 CB B ASN A 124 ? 37.00856 12.84541 11.75623 0.596 16.12235 C ? A ? 107 CB 1
   ATOM 1538 CG B ASN A 124 ? 36.92260 14.15993 12.54855 0.596 19.83974 C ? A ? 107 CG 1
   ATOM 1539 OD1 B ASN A 124 ? 36.36026 14.21633 13.65854 0.596 21.26756 O ? A ? 107 OD1 1
   ATOM 1540 ND2 B ASN A 124 ? 37.49373 15.20425 11.98782 0.596 20.61774 N ? A ? 107 ND2 1
   ATOM 1541 N A SER A 125 ? 33.35265 12.20836 10.57974 0.404 13.47434 N ? A ? 108 N 1
   ATOM 1542 CA A SER A 125 ? 32.25798 12.87028 9.86790 0.404 15.73698 C ? A ? 108 CA 1
   ATOM 1543 C A SER A 125 ? 31.07709 13.04504 10.80560 0.404 14.45743 C ? A ? 108 C 1
   ATOM 1544 O A SER A 125 ? 30.44194 12.05623 11.17495 0.404 15.78461 O ? A ? 108 O 1
   ATOM 1545 CB A SER A 125 ? 31.77987 12.07609 8.64971 0.404 17.44991 C ? A ? 108 CB 1
   ATOM 1546 OG A SER A 125 ? 32.88066 11.80518 7.80007 0.404 19.50279 O ? A ? 108 OG 1
   ATOM 1547 N B SER A 125 ? 33.45903 12.11386 10.68869 0.596 13.30833 N ? A ? 108 N 1
   ATOM 1548 CA B SER A 125 ? 32.31951 12.73847 10.00855 0.596 16.10354 C ? A ? 108 CA 1
   ATOM 1549 C B SER A 125 ? 31.19935 13.06724 10.99293 0.596 15.09284 C ? A ? 108 C 1
   ATOM 1550 O B SER A 125 ? 30.80157 12.21199 11.79455 0.596 14.20278 O ? A ? 108 O 1
   ATOM 1551 CB B SER A 125 ? 31.67247 11.85739 8.91505 0.596 16.37100 C ? A ? 108 CB 1
   ATOM 1552 OG B SER A 125 ? 32.50827 11.75715 7.75538 0.596 20.60205 O ? A ? 108 OG 1
   ATOM 1553 N A THR A 126 ? 30.77192 14.29178 11.15683 0.404 16.68493 N ? A ? 109 N 1
   ATOM 1554 CA A THR A 126 ? 29.46686 14.56177 11.76816 0.404 16.39050 C ? A ? 109 CA 1
   ATOM 1555 C A THR A 126 ? 28.37347 14.20078 10.76300 0.404 15.20606 C ? A ? 109 C 1
   ATOM 1556 O A THR A 126 ? 28.48423 14.50496 9.57674 0.404 17.93543 O ? A ? 109 O 1
   ATOM 1557 CB A THR A 126 ? 29.41150 16.04410 12.16595 0.404 17.01096 C ? A ? 109 CB 1
   ATOM 1558 OG1 A THR A 126 ? 30.25114 16.24220 13.31708 0.404 16.18078 O ? A ? 109 OG1 1
   ATOM 1559 CG2 A THR A 126 ? 27.98613 16.51593 12.44535 0.404 17.10891 C ? A ? 109 CG2 1
   ATOM 1560 N B THR A 126 ? 30.66143 14.28021 10.88313 0.596 17.05781 N ? A ? 109 N 1
   ATOM 1561 CA B THR A 126 ? 29.32511 14.50705 11.45306 0.596 16.23007 C ? A ? 109 CA 1
   ATOM 1562 C B THR A 126 ? 28.26352 13.99136 10.48316 0.596 15.48640 C ? A ? 109 C 1
   ATOM 1563 O B THR A 126 ? 28.37805 14.13089 9.26612 0.596 16.69789 O ? A ? 109 O 1
   ATOM 1564 CB B THR A 126 ? 29.13862 16.00061 11.75008 0.596 15.21144 C ? A ? 109 CB 1
   ATOM 1565 OG1 B THR A 126 ? 30.00273 16.36663 12.84144 0.596 19.43310 O ? A ? 109 OG1 1
   ATOM 1566 CG2 B THR A 126 ? 27.64291 16.34576 12.05502 0.596 15.93689 C ? A ? 109 CG2 1
   ATOM 1567 N A LEU A 127 ? 27.29890 13.54801 11.22799 0.404 15.49309 N ? A ? 110 N 1
   ATOM 1568 CA A LEU A 127 ? 26.28608 13.00126 10.33418 0.404 14.08427 C ? A ? 110 CA 1
   ATOM 1569 C A LEU A 127 ? 24.96085 13.74550 10.48987 0.404 16.40834 C ? A ? 110 C 1
   ATOM 1570 O A LEU A 127 ? 24.65158 14.27035 11.56061 0.404 15.86302 O ? A ? 110 O 1
   ATOM 1571 CB A LEU A 127 ? 26.04860 11.50778 10.61092 0.404 15.01782 C ? A ? 110 CB 1
   ATOM 1572 CG A LEU A 127 ? 27.29351 10.65056 10.83878 0.404 16.56749 C ? A ? 110 CG 1
   ATOM 1573 CD1 A LEU A 127 ? 26.90692 9.26208 11.46031 0.404 15.42721 C ? A ? 110 CD1 1
   ATOM 1574 CD2 A LEU A 127 ? 28.08185 10.43821 9.50184 0.404 19.11592 C ? A ? 110 CD2 1
   ATOM 1575 N B LEU A 127 ? 27.18860 13.40306 11.01550 0.596 14.31579 N ? A ? 110 N 1
   ATOM 1576 CA B LEU A 127 ? 26.13975 12.83979 10.18244 0.596 14.01087 C ? A ? 110 CA 1
   ATOM 1577 C B LEU A 127 ? 24.85297 13.58290 10.48484 0.596 16.15793 C ? A ? 110 C 1
   ATOM 1578 O B LEU A 127 ? 24.56155 13.85827 11.64551 0.596 16.43945 O ? A ? 110 O 1
   ATOM 1579 CB B LEU A 127 ? 25.90727 11.34130 10.46975 0.596 14.46666 C ? A ? 110 CB 1
   ATOM 1580 CG B LEU A 127 ? 27.18776 10.50841 10.55026 0.596 18.63507 C ? A ? 110 CG 1
   ATOM 1581 CD1 B LEU A 127 ? 26.87662 9.01002 11.02394 0.596 16.95810 C ? A ? 110 CD1 1
   ATOM 1582 CD2 B LEU A 127 ? 27.99116 10.57113 9.16909 0.596 18.54194 C ? A ? 110 CD2 1
   ATOM 1583 N A ILE A 128 ? 24.19192 13.76961 9.41038 0.404 14.29545 N ? A ? 111 N 1
   ATOM 1584 CA A ILE A 128 ? 22.87367 14.42562 9.36927 0.404 15.34758 C ? A ? 111 CA 1
   ATOM 1585 C A ILE A 128 ? 21.86495 13.39921 8.90835 0.404 17.67724 C ? A ? 111 C 1
   ATOM 1586 O A ILE A 128 ? 21.96066 12.88827 7.78094 0.404 16.72761 O ? A ? 111 O 1
   ATOM 1587 CB A ILE A 128 ? 22.84998 15.64764 8.43244 0.404 16.52187 C ? A ? 111 CB 1
   ATOM 1588 CG1 A ILE A 128 ? 23.86202 16.71462 8.88907 0.404 19.23238 C ? A ? 111 CG1 1
   ATOM 1589 CG2 A ILE A 128 ? 21.34992 16.20625 8.28182 0.404 13.48738 C ? A ? 111 CG2 1
   ATOM 1590 CD1 A ILE A 128 ? 25.36102 16.42981 8.62134 0.404 19.87444 C ? A ? 111 CD1 1
   ATOM 1591 N B ILE A 128 ? 24.12252 13.90043 9.44638 0.596 14.52059 N ? A ? 111 N 1
   ATOM 1592 CA B ILE A 128 ? 22.81212 14.58020 9.55682 0.596 15.43514 C ? A ? 111 CA 1
   ATOM 1593 C B ILE A 128 ? 21.76976 13.67604 8.92787 0.596 17.40984 C ? A ? 111 C 1
   ATOM 1594 O B ILE A 128 ? 21.74743 13.50324 7.70281 0.596 19.58015 O ? A ? 111 O 1
   ATOM 1595 CB B ILE A 128 ? 22.83743 15.95844 8.87671 0.596 14.99210 C ? A ? 111 CB 1
   ATOM 1596 CG1 B ILE A 128 ? 24.03088 16.81140 9.36528 0.596 18.76850 C ? A ? 111 CG1 1
   ATOM 1597 CG2 B ILE A 128 ? 21.45077 16.67774 9.03632 0.596 15.50969 C ? A ? 111 CG2 1
   ATOM 1598 CD1 B ILE A 128 ? 24.14635 18.12032 8.59622 0.596 23.18753 C ? A ? 111 CD1 1
   ATOM 1599 N . PHE A 129 ? 20.88963 13.07803 9.75980 1.000 14.75588 N ? A ? 112 N 1
   ATOM 1600 CA . PHE A 129 ? 19.85792 12.16018 9.30598 1.000 14.28147 C ? A ? 112 CA 1
   ATOM 1601 C . PHE A 129 ? 18.51620 12.83856 9.39700 1.000 15.24723 C ? A ? 112 C 1
   ATOM 1602 O . PHE A 129 ? 18.12876 13.32697 10.46266 1.000 18.91539 O ? A ? 112 O 1
   ATOM 1603 CB . PHE A 129 ? 19.75591 10.88974 10.16398 1.000 17.66374 C ? A ? 112 CB 1
   ATOM 1604 CG . PHE A 129 ? 20.91320 9.93030 9.99415 1.000 15.02399 C ? A ? 112 CG 1
   ATOM 1605 CD1 . PHE A 129 ? 22.05993 10.06323 10.78904 1.000 13.10452 C ? A ? 112 CD1 1
   ATOM 1606 CD2 . PHE A 129 ? 20.79950 8.84196 9.09587 1.000 17.77363 C ? A ? 112 CD2 1
   ATOM 1607 CE1 . PHE A 129 ? 23.15449 9.11870 10.64702 1.000 14.18542 C ? A ? 112 CE1 1
   ATOM 1608 CE2 . PHE A 129 ? 21.84071 7.89782 8.99006 1.000 17.15459 C ? A ? 112 CE2 1
   ATOM 1609 CZ . PHE A 129 ? 23.00032 8.03358 9.77395 1.000 15.32103 C ? A ? 112 CZ 1
   ATOM 1610 N . GLU A 130 ? 17.80319 12.85391 8.28686 1.000 14.92845 N ? A ? 113 N 1
   ATOM 1611 CA . GLU A 130 ? 16.36439 13.16949 8.31078 1.000 14.57969 C ? A ? 113 CA 1
   ATOM 1612 C . GLU A 130 ? 15.66787 11.86897 8.65755 1.000 19.00518 C ? A ? 113 C 1
   ATOM 1613 O . GLU A 130 ? 15.90255 10.86615 7.97509 1.000 19.39700 O ? A ? 113 O 1
   ATOM 1614 CB . GLU A 130 ? 15.91998 13.59674 6.89907 1.000 20.41270 C ? A ? 113 CB 1
   ATOM 1615 CG . GLU A 130 ? 16.74388 14.76584 6.36637 1.000 27.56811 C ? A ? 113 CG 1
   ATOM 1616 CD . GLU A 130 ? 16.77007 14.85766 4.80680 1.000 34.14878 C ? A ? 113 CD 1
   ATOM 1617 OE1 . GLU A 130 ? 15.73704 14.64786 4.14596 1.000 44.12376 O ? A ? 113 OE1 1
   ATOM 1618 OE2 . GLU A 130 ? 17.85428 15.08111 4.25038 1.000 37.24226 O ? A ? 113 OE2 1
   ATOM 1619 N . VAL A 131 ? 14.88546 11.83058 9.73355 1.000 15.40621 N ? A ? 114 N 1
   ATOM 1620 CA . VAL A 131 ? 14.26662 10.57514 10.13648 1.000 15.27633 C ? A ? 114 CA 1
   ATOM 1621 C . VAL A 131 ? 12.76448 10.78761 10.30847 1.000 19.73696 C ? A ? 114 C 1
   ATOM 1622 O . VAL A 131 ? 12.32480 11.81482 10.84032 1.000 17.86330 O ? A ? 114 O 1
   ATOM 1623 CB . VAL A 131 ? 14.84580 10.04275 11.45484 1.000 20.81342 C ? A ? 114 CB 1
   ATOM 1624 CG1 . VAL A 131 ? 16.31745 9.60942 11.23435 1.000 20.18257 C ? A ? 114 CG1 1
   ATOM 1625 CG2 . VAL A 131 ? 14.83468 11.10020 12.45920 1.000 19.17011 C ? A ? 114 CG2 1
   ATOM 1626 N . GLU A 132 ? 11.98801 9.74228 9.97029 1.000 15.49318 N ? A ? 115 N 1
   ATOM 1627 CA . GLU A 132 ? 10.53818 9.73896 10.18333 1.000 15.04731 C ? A ? 115 CA 1
   ATOM 1628 C . GLU A 132 ? 10.18774 8.46038 10.91594 1.000 16.73811 C ? A ? 115 C 1
   ATOM 1629 O . GLU A 132 ? 10.51557 7.37290 10.43334 1.000 16.52367 O ? A ? 115 O 1
   ATOM 1630 CB . GLU A 132 ? 9.79831 9.76143 8.81064 1.000 14.57733 C ? A ? 115 CB 1
   ATOM 1631 CG . GLU A 132 ? 8.30813 9.73839 9.03188 1.000 27.39747 C ? A ? 115 CG 1
   ATOM 1632 CD . GLU A 132 ? 7.53126 9.95680 7.72194 1.000 40.82472 C ? A ? 115 CD 1
   ATOM 1633 OE1 . GLU A 132 ? 8.14997 9.83699 6.66082 1.000 41.87696 O ? A ? 115 OE1 1
   ATOM 1634 OE2 . GLU A 132 ? 6.31083 10.22479 7.77272 1.000 36.13410 O ? A ? 115 OE2 1
   ATOM 1635 N . LEU A 133 ? 9.61949 8.57197 12.09438 1.000 14.48004 N ? A ? 116 N 1
   ATOM 1636 CA . LEU A 133 ? 9.30906 7.38715 12.90364 1.000 15.82104 C ? A ? 116 CA 1
   ATOM 1637 C . LEU A 133 ? 7.94006 6.84864 12.46647 1.000 18.20217 C ? A ? 116 C 1
   ATOM 1638 O . LEU A 133 ? 6.89170 7.41480 12.80672 1.000 19.35684 O ? A ? 116 O 1
   ATOM 1639 CB . LEU A 133 ? 9.29487 7.78317 14.35083 1.000 15.10910 C ? A ? 116 CB 1
   ATOM 1640 CG . LEU A 133 ? 9.01983 6.53141 15.20253 1.000 16.09171 C ? A ? 116 CG 1
   ATOM 1641 CD1 . LEU A 133 ? 10.04929 5.38082 15.10894 1.000 17.34014 C ? A ? 116 CD1 1
   ATOM 1642 CD2 . LEU A 133 ? 8.97049 7.02529 16.69557 1.000 14.88029 C ? A ? 116 CD2 1
   ATOM 1643 N . LEU A 134 ? 7.95397 5.79457 11.65473 1.000 16.11305 N ? A ? 117 N 1
   ATOM 1644 CA . LEU A 134 ? 6.69088 5.28838 11.08665 1.000 15.09324 C ? A ? 117 CA 1
   ATOM 1645 C . LEU A 134 ? 6.05613 4.21164 11.95871 1.000 20.91357 C ? A ? 117 C 1
   ATOM 1646 O . LEU A 134 ? 4.83483 3.92029 11.84608 1.000 19.61835 O ? A ? 117 O 1
   ATOM 1647 CB . LEU A 134 ? 6.97997 4.72046 9.69583 1.000 19.28632 C ? A ? 117 CB 1
   ATOM 1648 CG . LEU A 134 ? 7.51419 5.72227 8.67917 1.000 28.58673 C ? A ? 117 CG 1
   ATOM 1649 CD1 . LEU A 134 ? 8.06098 4.92787 7.52476 1.000 28.84605 C ? A ? 117 CD1 1
   ATOM 1650 CD2 . LEU A 134 ? 6.41755 6.72514 8.29967 1.000 34.45622 C ? A ? 117 CD2 1
   ATOM 1651 N . GLY A 135 ? 6.82578 3.58194 12.80794 1.000 17.22309 N ? A ? 118 N 1
   ATOM 1652 CA . GLY A 135 ? 6.26473 2.46967 13.56297 1.000 19.27419 C ? A ? 118 CA 1
   ATOM 1653 C . GLY A 135 ? 7.04246 2.25929 14.82461 1.000 17.79981 C ? A ? 118 C 1
   ATOM 1654 O . GLY A 135 ? 8.27298 2.47125 14.87211 1.000 16.63318 O ? A ? 118 O 1
   ATOM 1655 N . ILE A 136 ? 6.31925 1.84509 15.87766 1.000 15.90182 N ? A ? 119 N 1
   ATOM 1656 CA . ILE A 136 ? 6.87229 1.36970 17.14761 1.000 15.53816 C ? A ? 119 CA 1
   ATOM 1657 C . ILE A 136 ? 6.16938 0.05188 17.46208 1.000 20.67351 C ? A ? 119 C 1
   ATOM 1658 O . ILE A 136 ? 4.96613 0.05791 17.80956 1.000 19.12673 O ? A ? 119 O 1
   ATOM 1659 CB . ILE A 136 ? 6.61408 2.36078 18.31220 1.000 17.95016 C ? A ? 119 CB 1
   ATOM 1660 CG1 . ILE A 136 ? 7.23672 3.75474 17.99716 1.000 15.73092 C ? A ? 119 CG1 1
   ATOM 1661 CG2 . ILE A 136 ? 7.13780 1.79915 19.63597 1.000 19.93619 C ? A ? 119 CG2 1
   ATOM 1662 CD1 . ILE A 136 ? 6.78138 4.86655 19.06791 1.000 17.61873 C ? A ? 119 CD1 1
   ATOM 1663 N . ASN A 137 ? 6.92247 -1.04819 17.45120 1.000 18.69348 N ? A ? 120 N 1
   ATOM 1664 CA . ASN A 137 ? 6.29238 -2.38877 17.52258 1.000 16.95526 C ? A ? 120 CA 1
   ATOM 1665 C . ASN A 137 ? 5.18260 -2.43482 16.47775 1.000 19.60866 C ? A ? 120 C 1
   ATOM 1666 O . ASN A 137 ? 5.43578 -2.10401 15.30913 1.000 19.70051 O ? A ? 120 O 1
   ATOM 1667 CB . ASN A 137 ? 5.88210 -2.63373 18.97066 1.000 19.36280 C ? A ? 120 CB 1
   ATOM 1668 CG . ASN A 137 ? 7.09993 -2.63748 19.93164 1.000 20.40382 C ? A ? 120 CG 1
   ATOM 1669 OD1 . ASN A 137 ? 8.19267 -3.10827 19.54327 1.000 20.11181 O ? A ? 120 OD1 1
   ATOM 1670 ND2 . ASN A 137 ? 6.92038 -2.15043 21.14253 1.000 21.13918 N ? A ? 120 ND2 1
   ATOM 1671 N A ASN A 138 ? 3.94319 -2.73312 16.90521 0.520 18.69364 N ? A ? 121 N 1
   ATOM 1672 CA A ASN A 138 ? 2.82049 -2.82777 15.98828 0.520 19.71058 C ? A ? 121 CA 1
   ATOM 1673 C A ASN A 138 ? 2.12846 -1.50549 15.71036 0.520 20.87549 C ? A ? 121 C 1
   ATOM 1674 O A ASN A 138 ? 1.25462 -1.45807 14.82848 0.520 22.88387 O ? A ? 121 O 1
   ATOM 1675 CB A ASN A 138 ? 1.78154 -3.80645 16.54162 0.520 15.84306 C ? A ? 121 CB 1
   ATOM 1676 CG A ASN A 138 ? 2.28713 -5.19253 16.49399 0.520 18.24571 C ? A ? 121 CG 1
   ATOM 1677 OD1 A ASN A 138 ? 2.38992 -5.84713 17.51886 0.520 26.20740 O ? A ? 121 OD1 1
   ATOM 1678 ND2 A ASN A 138 ? 2.68955 -5.63871 15.28943 0.520 27.19672 N ? A ? 121 ND2 1
   ATOM 1679 N B ASN A 138 ? 3.93982 -2.78346 16.83109 0.480 18.67336 N ? A ? 121 N 1
   ATOM 1680 CA B ASN A 138 ? 2.91095 -2.81726 15.80761 0.480 19.60105 C ? A ? 121 CA 1
   ATOM 1681 C B ASN A 138 ? 2.11601 -1.50619 15.70191 0.480 20.87622 C ? A ? 121 C 1
   ATOM 1682 O B ASN A 138 ? 1.14446 -1.45782 14.93692 0.480 22.64482 O ? A ? 121 O 1
   ATOM 1683 CB B ASN A 138 ? 1.93828 -3.99099 16.03519 0.480 20.27778 C ? A ? 121 CB 1
   ATOM 1684 CG B ASN A 138 ? 1.31571 -3.97227 17.40680 0.480 24.66276 C ? A ? 121 CG 1
   ATOM 1685 OD1 B ASN A 138 ? 1.22978 -2.93611 18.05036 0.480 21.25181 O ? A ? 121 OD1 1
   ATOM 1686 ND2 B ASN A 138 ? 0.81658 -5.13764 17.85038 0.480 21.36733 N ? A ? 121 ND2 1
   ATOM 1687 N . LYS A 139 ? 2.52316 -0.43773 16.40138 1.000 18.10757 N ? A ? 122 N 1
   ATOM 1688 CA . LYS A 139 ? 1.86181 0.83161 16.22354 1.000 20.19109 C ? A ? 122 CA 1
   ATOM 1689 C . LYS A 139 ? 2.39715 1.49478 14.97844 1.000 21.18620 C ? A ? 122 C 1
   ATOM 1690 O . LYS A 139 ? 3.61536 1.45898 14.72120 1.000 22.50274 O ? A ? 122 O 1
   ATOM 1691 CB . LYS A 139 ? 2.07608 1.73399 17.42916 1.000 17.68639 C ? A ? 122 CB 1
   ATOM 1692 CG . LYS A 139 ? 1.49727 1.18951 18.69161 1.000 24.63710 C ? A ? 122 CG 1
   ATOM 1693 CD . LYS A 139 ? 1.75351 2.13147 19.85408 1.000 26.40612 C ? A ? 122 CD 1
   ATOM 1694 CE . LYS A 139 ? 1.47639 1.47535 21.17923 1.000 35.79063 C ? A ? 122 CE 1
   ATOM 1695 NZ . LYS A 139 ? 1.87154 2.31955 22.33504 1.000 38.14593 N ? A ? 122 NZ 1
   ATOM 1696 N . ARG A 140 ? 1.48143 2.03366 14.16695 1.000 16.97511 N ? A ? 123 N 1
   ATOM 1697 CA . ARG A 140 ? 1.81440 2.60486 12.87429 1.000 18.92319 C ? A ? 123 CA 1
   ATOM 1698 C . ARG A 140 ? 1.32194 4.02911 12.80514 1.000 26.89530 C ? A ? 123 C 1
   ATOM 1699 O . ARG A 140 ? 0.17129 4.31321 13.17791 1.000 26.36906 O ? A ? 123 O 1
   ATOM 1700 CB . ARG A 140 ? 1.20100 1.79199 11.73173 1.000 21.28618 C ? A ? 123 CB 1
   ATOM 1701 CG . ARG A 140 ? 1.92233 0.49844 11.51200 1.000 31.28367 C ? A ? 123 CG 1
   ATOM 1702 CD . ARG A 140 ? 3.33136 0.83903 11.04284 1.000 54.76130 C ? A ? 123 CD 1
   ATOM 1703 NE . ARG A 140 ? 4.13662 -0.34760 10.80039 1.000 47.68586 N ? A ? 123 NE 1
   ATOM 1704 CZ . ARG A 140 ? 4.65860 -1.09680 11.75792 1.000 55.78105 C ? A ? 123 CZ 1
   ATOM 1705 NH1 . ARG A 140 ? 4.44860 -0.82123 13.05295 1.000 33.63356 N ? A ? 123 NH1 1
   ATOM 1706 NH2 . ARG A 140 ? 5.39891 -2.15175 11.41938 1.000 72.73889 N ? A ? 123 NH2 1
   ATOM 1707 N . ALA A 141 ? 2.20354 4.91375 12.35117 1.000 21.54371 N ? A ? 124 N 1
   ATOM 1708 CA . ALA A 141 ? 1.79973 6.24981 12.00645 1.000 24.76354 C ? A ? 124 CA 1
   ATOM 1709 C . ALA A 141 ? 0.82804 6.21212 10.80733 1.000 27.86726 C ? A ? 124 C 1
   ATOM 1710 O . ALA A 141 ? 0.10408 7.23150 10.68162 1.000 37.69033 O ? A ? 124 O 1
   ATOM 1711 CB . ALA A 141 ? 3.02675 7.14945 11.66237 1.000 20.86861 C ? A ? 124 CB 1
   ATOM 1712 N . GLY B 28 ? 19.67794 -30.05082 5.69141 1.000 47.99114 N ? B ? 1 N 1
   ATOM 1713 CA . GLY B 28 ? 21.07584 -30.43556 5.55644 1.000 42.74988 C ? B ? 1 CA 1
   ATOM 1714 C . GLY B 28 ? 21.92554 -29.78875 6.64849 1.000 44.80295 C ? B ? 1 C 1
   ATOM 1715 O . GLY B 28 ? 21.41197 -29.39937 7.70520 1.000 34.34348 O ? B ? 1 O 1
   ATOM 1716 N . SER B 29 ? 23.21648 -29.66230 6.41400 1.000 32.07105 N ? B ? 2 N 1
   ATOM 1717 CA . SER B 29 ? 24.08345 -29.27531 7.50404 1.000 29.37180 C ? B ? 2 CA 1
   ATOM 1718 C . SER B 29 ? 24.61992 -27.86700 7.28426 1.000 37.85481 C ? B ? 2 C 1
   ATOM 1719 O . SER B 29 ? 24.63103 -27.35064 6.17825 1.000 32.19341 O ? B ? 2 O 1
   ATOM 1720 CB . SER B 29 ? 25.22036 -30.30013 7.71888 1.000 35.08144 C ? B ? 2 CB 1
   ATOM 1721 OG . SER B 29 ? 26.19692 -30.26773 6.67901 1.000 46.49543 O ? B ? 2 OG 1
   ATOM 1722 N . SER B 30 ? 25.06987 -27.25203 8.37121 1.000 26.62052 N ? B ? 3 N 1
   ATOM 1723 CA . SER B 30 ? 25.65680 -25.90231 8.32170 1.000 24.72201 C ? B ? 3 CA 1
   ATOM 1724 C . SER B 30 ? 26.66016 -25.84163 9.44059 1.000 22.57397 C ? B ? 3 C 1
   ATOM 1725 O . SER B 30 ? 26.78366 -26.78989 10.21623 1.000 19.81145 O ? B ? 3 O 1
   ATOM 1726 CB . SER B 30 ? 24.63488 -24.81625 8.50467 1.000 21.36519 C ? B ? 3 CB 1
   ATOM 1727 OG . SER B 30 ? 23.93819 -24.92279 9.74386 1.000 21.15965 O ? B ? 3 OG 1
   ATOM 1728 N A GLY B 31 ? 27.46503 -24.76624 9.45892 0.840 17.91799 N ? B ? 4 N 1
   ATOM 1729 CA A GLY B 31 ? 28.38335 -24.70761 10.57876 0.840 16.43753 C ? B ? 4 CA 1
   ATOM 1730 C A GLY B 31 ? 29.59515 -23.85847 10.23873 0.840 18.17785 C ? B ? 4 C 1
   ATOM 1731 O A GLY B 31 ? 29.55040 -23.00934 9.33554 0.840 16.73984 O ? B ? 4 O 1
   ATOM 1732 N B GLY B 31 ? 27.41820 -24.74390 9.51217 0.160 18.27686 N ? B ? 4 N 1
   ATOM 1733 CA B GLY B 31 ? 28.33995 -24.62085 10.61898 0.160 16.69811 C ? B ? 4 CA 1
   ATOM 1734 C B GLY B 31 ? 29.61156 -23.91114 10.20720 0.160 17.93808 C ? B ? 4 C 1
   ATOM 1735 O B GLY B 31 ? 29.68248 -23.27500 9.15823 0.160 17.72041 O ? B ? 4 O 1
   ATOM 1736 N . VAL B 32 ? 30.61233 -24.02099 11.07253 1.000 15.43018 N ? B ? 5 N 1
   ATOM 1737 CA . VAL B 32 ? 31.85839 -23.28674 10.96601 1.000 15.48509 C ? B ? 5 CA 1
   ATOM 1738 C . VAL B 32 ? 32.97519 -24.28735 11.03163 1.000 20.00824 C ? B ? 5 C 1
   ATOM 1739 O . VAL B 32 ? 33.06164 -25.04274 12.00204 1.000 15.60867 O ? B ? 5 O 1
   ATOM 1740 CB . VAL B 32 ? 31.96920 -22.33075 12.15082 1.000 13.49612 C ? B ? 5 CB 1
   ATOM 1741 CG1 . VAL B 32 ? 33.37264 -21.57001 12.18133 1.000 16.54694 C ? B ? 5 CG1 1
   ATOM 1742 CG2 . VAL B 32 ? 30.81864 -21.27969 12.07490 1.000 16.43624 C ? B ? 5 CG2 1
   ATOM 1743 N A THR B 33 ? 33.85268 -24.30999 10.02915 0.350 15.86042 N ? B ? 6 N 1
   ATOM 1744 CA A THR B 33 ? 34.98717 -25.24356 10.05488 0.350 15.93393 C ? B ? 6 CA 1
   ATOM 1745 C A THR B 33 ? 36.28831 -24.47660 9.92068 0.350 16.26256 C ? B ? 6 C 1
   ATOM 1746 O A THR B 33 ? 36.34837 -23.48802 9.18147 0.350 17.31180 O ? B ? 6 O 1
   ATOM 1747 CB A THR B 33 ? 34.87262 -26.28065 8.92645 0.350 18.36778 C ? B ? 6 CB 1
   ATOM 1748 OG1 A THR B 33 ? 33.78159 -27.14850 9.23265 0.350 20.54779 O ? B ? 6 OG1 1
   ATOM 1749 CG2 A THR B 33 ? 36.14583 -27.12328 8.76876 0.350 20.31905 C ? B ? 6 CG2 1
   ATOM 1750 N B THR B 33 ? 33.85565 -24.29044 10.03128 0.650 15.81834 N ? B ? 6 N 1
   ATOM 1751 CA B THR B 33 ? 34.98228 -25.24051 10.00311 0.650 16.07384 C ? B ? 6 CA 1
   ATOM 1752 C B THR B 33 ? 36.28258 -24.46701 9.91351 0.650 16.20814 C ? B ? 6 C 1
   ATOM 1753 O B THR B 33 ? 36.31825 -23.43669 9.22429 0.650 17.19713 O ? B ? 6 O 1
   ATOM 1754 CB B THR B 33 ? 34.83716 -26.15739 8.77886 0.650 16.99414 C ? B ? 6 CB 1
   ATOM 1755 OG1 B THR B 33 ? 33.54368 -26.78426 8.84215 0.650 19.90484 O ? B ? 6 OG1 1
   ATOM 1756 CG2 B THR B 33 ? 35.92043 -27.23121 8.72919 0.650 19.91440 C ? B ? 6 CG2 1
   ATOM 1757 N . LYS B 34 ? 37.29266 -24.88117 10.70295 1.000 15.69681 N ? B ? 7 N 1
   ATOM 1758 CA . LYS B 34 ? 38.64387 -24.30467 10.62515 1.000 15.35421 C ? B ? 7 CA 1
   ATOM 1759 C . LYS B 34 ? 39.60753 -25.38859 10.12268 1.000 20.30487 C ? B ? 7 C 1
   ATOM 1760 O . LYS B 34 ? 39.70468 -26.46763 10.74947 1.000 17.92860 O ? B ? 7 O 1
   ATOM 1761 CB . LYS B 34 ? 39.12643 -23.81563 11.96521 1.000 18.42133 C ? B ? 7 CB 1
   ATOM 1762 CG . LYS B 34 ? 40.53555 -23.24313 11.85574 1.000 19.72485 C ? B ? 7 CG 1
   ATOM 1763 CD . LYS B 34 ? 40.86192 -22.40556 13.16653 1.000 22.41407 C ? B ? 7 CD 1
   ATOM 1764 CE . LYS B 34 ? 41.14675 -23.32756 14.38411 1.000 20.45176 C ? B ? 7 CE 1
   ATOM 1765 NZ . LYS B 34 ? 42.40155 -24.08961 14.22926 1.000 23.58891 N ? B ? 7 NZ 1
   ATOM 1766 N . GLU B 35 ? 40.35704 -25.08983 9.06012 1.000 17.94939 N ? B ? 8 N 1
   ATOM 1767 CA . GLU B 35 ? 41.40624 -25.98621 8.57173 1.000 16.24001 C ? B ? 8 CA 1
   ATOM 1768 C . GLU B 35 ? 42.74850 -25.31895 8.74446 1.000 20.45795 C ? B ? 8 C 1
   ATOM 1769 O . GLU B 35 ? 42.94733 -24.18160 8.33846 1.000 21.13738 O ? B ? 8 O 1
   ATOM 1770 CB . GLU B 35 ? 41.18853 -26.33122 7.08196 1.000 18.21544 C ? B ? 8 CB 1
   ATOM 1771 CG . GLU B 35 ? 39.85688 -27.10361 6.82636 1.000 22.13063 C ? B ? 8 CG 1
   ATOM 1772 CD . GLU B 35 ? 39.55283 -27.15690 5.36184 1.000 41.85590 C ? B ? 8 CD 1
   ATOM 1773 OE1 . GLU B 35 ? 39.01328 -26.15466 4.83680 1.000 37.54937 O ? B ? 8 OE1 1
   ATOM 1774 OE2 . GLU B 35 ? 39.91071 -28.17429 4.72230 1.000 35.45862 O ? B ? 8 OE2 1
   ATOM 1775 N . LEU B 36 ? 43.65661 -26.02071 9.36856 1.000 15.96808 N ? B ? 9 N 1
   ATOM 1776 CA . LEU B 36 ? 44.94801 -25.45657 9.69855 1.000 19.34724 C ? B ? 9 CA 1
   ATOM 1777 C . LEU B 36 ? 45.80553 -25.38510 8.41171 1.000 26.04771 C ? B ? 9 C 1
   ATOM 1778 O . LEU B 36 ? 45.80428 -26.32448 7.62198 1.000 25.56534 O ? B ? 9 O 1
   ATOM 1779 CB . LEU B 36 ? 45.57390 -26.34323 10.79974 1.000 25.27115 C ? B ? 9 CB 1
   ATOM 1780 CG . LEU B 36 ? 46.91506 -25.90414 11.31995 1.000 36.64680 C ? B ? 9 CG 1
   ATOM 1781 CD1 . LEU B 36 ? 46.71235 -24.61405 12.02910 1.000 29.07263 C ? B ? 9 CD1 1
   ATOM 1782 CD2 . LEU B 36 ? 47.37885 -26.96717 12.29221 1.000 43.37669 C ? B ? 9 CD2 1
   ATOM 1783 N . LYS B 37 ? 46.47012 -24.23838 8.17136 1.000 20.08519 N ? B ? 10 N 1
   ATOM 1784 CA . LYS B 37 ? 47.45732 -24.05553 7.07505 1.000 24.14084 C ? B ? 10 CA 1
   ATOM 1785 C . LYS B 37 ? 48.90007 -24.01000 7.56486 1.000 29.59018 C ? B ? 10 C 1
   ATOM 1786 O . LYS B 37 ? 49.80242 -24.58209 6.93356 1.000 27.14287 O ? B ? 10 O 1
   ATOM 1787 CB . LYS B 37 ? 47.14026 -22.76162 6.32196 1.000 22.01833 C ? B ? 10 CB 1
   ATOM 1788 CG . LYS B 37 ? 45.77380 -22.81687 5.58550 1.000 32.46950 C ? B ? 10 CG 1
   ATOM 1789 CD . LYS B 37 ? 45.69172 -24.08080 4.68504 1.000 45.67887 C ? B ? 10 CD 1
   ATOM 1790 CE . LYS B 37 ? 45.78487 -23.73456 3.17098 1.000 58.08333 C ? B ? 10 CE 1
   ATOM 1791 NZ . LYS B 37 ? 46.19572 -24.89777 2.27994 1.000 47.67953 N ? B ? 10 NZ 1
   ATOM 1792 N . SER B 38 ? 49.14507 -23.39858 8.70731 1.000 22.76485 N ? B ? 11 N 1
   ATOM 1793 CA . SER B 38 ? 50.45361 -23.28671 9.31410 1.000 27.30077 C ? B ? 11 CA 1
   ATOM 1794 C . SER B 38 ? 50.22291 -23.17331 10.82104 1.000 24.58518 C ? B ? 11 C 1
   ATOM 1795 O . SER B 38 ? 49.42730 -22.31681 11.26343 1.000 21.42113 O ? B ? 11 O 1
   ATOM 1796 CB . SER B 38 ? 51.23606 -22.05923 8.79919 1.000 27.88942 C ? B ? 11 CB 1
   ATOM 1797 OG . SER B 38 ? 52.57145 -22.17439 9.21389 1.000 39.44536 O ? B ? 11 OG 1
   ATOM 1798 N . PRO B 39 ? 50.89348 -23.98417 11.64360 1.000 28.45773 N ? B ? 12 N 1
   ATOM 1799 CA . PRO B 39 ? 50.60179 -23.99006 13.07145 1.000 24.77595 C ? B ? 12 CA 1
   ATOM 1800 C . PRO B 39 ? 51.08395 -22.71203 13.72195 1.000 29.57418 C ? B ? 12 C 1
   ATOM 1801 O . PRO B 39 ? 52.04509 -22.11094 13.25248 1.000 26.40958 O ? B ? 12 O 1
   ATOM 1802 CB . PRO B 39 ? 51.40197 -25.19040 13.60199 1.000 28.17341 C ? B ? 12 CB 1
   ATOM 1803 CG . PRO B 39 ? 52.35241 -25.45185 12.61350 1.000 33.41823 C ? B ? 12 CG 1
   ATOM 1804 CD . PRO B 39 ? 51.75612 -25.12900 11.28655 1.000 36.64427 C ? B ? 12 CD 1
   ATOM 1805 N . GLY B 40 ? 50.36448 -22.28119 14.77086 1.000 22.67956 N ? B ? 13 N 1
   ATOM 1806 CA . GLY B 40 ? 50.81821 -21.24255 15.68120 1.000 25.22740 C ? B ? 13 CA 1
   ATOM 1807 C . GLY B 40 ? 51.70856 -21.84192 16.75667 1.000 23.98348 C ? B ? 13 C 1
   ATOM 1808 O . GLY B 40 ? 52.20636 -22.96558 16.61848 1.000 27.45206 O ? B ? 13 O 1
   ATOM 1809 N . ASN B 41 ? 51.91357 -21.09151 17.86046 1.000 22.97215 N ? B ? 14 N 1
   ATOM 1810 CA . ASN B 41 ? 52.78944 -21.64161 18.88903 1.000 32.59538 C ? B ? 14 CA 1
   ATOM 1811 C . ASN B 41 ? 52.12347 -22.71121 19.73260 1.000 29.62902 C ? B ? 14 C 1
   ATOM 1812 O . ASN B 41 ? 52.80467 -23.34643 20.54169 1.000 30.95787 O ? B ? 14 O 1
   ATOM 1813 CB . ASN B 41 ? 53.37604 -20.53628 19.80510 1.000 27.46300 C ? B ? 14 CB 1
   ATOM 1814 CG . ASN B 41 ? 52.34949 -19.81284 20.67864 1.000 29.01256 C ? B ? 14 CG 1
   ATOM 1815 OD1 . ASN B 41 ? 51.19761 -20.27253 20.94653 1.000 27.53513 O ? B ? 14 OD1 1
   ATOM 1816 ND2 . ASN B 41 ? 52.76286 -18.60713 21.11689 1.000 27.54467 N ? B ? 14 ND2 1
   ATOM 1817 N . GLY B 42 ? 50.84033 -22.95399 19.57292 1.000 24.85573 N ? B ? 15 N 1
   ATOM 1818 CA . GLY B 42 ? 50.19608 -24.06702 20.24823 1.000 26.95252 C ? B ? 15 CA 1
   ATOM 1819 C . GLY B 42 ? 49.91335 -23.83702 21.71530 1.000 29.28836 C ? B ? 15 C 1
   ATOM 1820 O . GLY B 42 ? 49.34780 -24.72944 22.37355 1.000 34.15730 O ? B ? 15 O 1
   ATOM 1821 N . VAL B 43 ? 50.23666 -22.65495 22.23703 1.000 26.25144 N ? B ? 16 N 1
   ATOM 1822 CA . VAL B 43 ? 50.16337 -22.34679 23.66204 1.000 29.62972 C ? B ? 16 CA 1
   ATOM 1823 C . VAL B 43 ? 49.18590 -21.21494 23.96431 1.000 28.44028 C ? B ? 16 C 1
   ATOM 1824 O . VAL B 43 ? 48.35188 -21.31508 24.88050 1.000 28.09736 O ? B ? 16 O 1
   ATOM 1825 CB . VAL B 43 ? 51.55541 -22.00826 24.22809 1.000 29.79074 C ? B ? 16 CB 1
   ATOM 1826 CG1 . VAL B 43 ? 51.38591 -21.50635 25.62780 1.000 38.03308 C ? B ? 16 CG1 1
   ATOM 1827 CG2 . VAL B 43 ? 52.39500 -23.25728 24.16955 1.000 36.43695 C ? B ? 16 CG2 1
   ATOM 1828 N . ASP B 44 ? 49.26134 -20.13785 23.20350 1.000 25.56107 N ? B ? 17 N 1
   ATOM 1829 CA . ASP B 44 ? 48.48838 -18.93395 23.50153 1.000 22.63635 C ? B ? 17 CA 1
   ATOM 1830 C . ASP B 44 ? 47.26008 -18.91058 22.60531 1.000 26.27265 C ? B ? 17 C 1
   ATOM 1831 O . ASP B 44 ? 47.41438 -18.86338 21.37784 1.000 24.19908 O ? B ? 17 O 1
   ATOM 1832 CB . ASP B 44 ? 49.33683 -17.68744 23.22965 1.000 23.85082 C ? B ? 17 CB 1
   ATOM 1833 CG . ASP B 44 ? 50.54384 -17.61893 24.11726 1.000 33.48963 C ? B ? 17 CG 1
   ATOM 1834 OD1 . ASP B 44 ? 50.37037 -17.64234 25.35275 1.000 31.40934 O ? B ? 17 OD1 1
   ATOM 1835 OD2 . ASP B 44 ? 51.65216 -17.58214 23.56528 1.000 31.04060 O ? B ? 17 OD2 1
   ATOM 1836 N . PHE B 45 ? 46.07686 -18.91416 23.20843 1.000 21.50197 N ? B ? 18 N 1
   ATOM 1837 CA . PHE B 45 ? 44.81933 -18.89155 22.46913 1.000 24.83767 C ? B ? 18 CA 1
   ATOM 1838 C . PHE B 45 ? 44.00462 -17.70691 22.94825 1.000 27.63862 C ? B ? 18 C 1
   ATOM 1839 O . PHE B 45 ? 44.05224 -17.39780 24.13792 1.000 25.73614 O ? B ? 18 O 1
   ATOM 1840 CB . PHE B 45 ? 43.99042 -20.16950 22.70150 1.000 26.18804 C ? B ? 18 CB 1
   ATOM 1841 CG . PHE B 45 ? 44.67351 -21.39646 22.20246 1.000 22.12735 C ? B ? 18 CG 1
   ATOM 1842 CD1 . PHE B 45 ? 45.70483 -21.98809 22.98593 1.000 26.07510 C ? B ? 18 CD1 1
   ATOM 1843 CD2 . PHE B 45 ? 44.29749 -21.97416 20.99063 1.000 22.10284 C ? B ? 18 CD2 1
   ATOM 1844 CE1 . PHE B 45 ? 46.36304 -23.10634 22.55656 1.000 23.96899 C ? B ? 18 CE1 1
   ATOM 1845 CE2 . PHE B 45 ? 44.96541 -23.16026 20.52652 1.000 28.36060 C ? B ? 18 CE2 1
   ATOM 1846 CZ . PHE B 45 ? 46.00041 -23.70431 21.30984 1.000 25.53348 C ? B ? 18 CZ 1
   ATOM 1847 N . PRO B 46 ? 43.26741 -17.01873 22.07146 1.000 21.41388 N ? B ? 19 N 1
   ATOM 1848 CA . PRO B 46 ? 42.43175 -15.91296 22.52977 1.000 26.37717 C ? B ? 19 CA 1
   ATOM 1849 C . PRO B 46 ? 41.27126 -16.41919 23.37767 1.000 30.52591 C ? B ? 19 C 1
   ATOM 1850 O . PRO B 46 ? 40.56506 -17.36679 23.01407 1.000 24.04805 O ? B ? 19 O 1
   ATOM 1851 CB . PRO B 46 ? 41.88648 -15.28963 21.21569 1.000 21.46838 C ? B ? 19 CB 1
   ATOM 1852 CG . PRO B 46 ? 42.71156 -15.87384 20.11274 1.000 22.82630 C ? B ? 19 CG 1
   ATOM 1853 CD . PRO B 46 ? 43.20827 -17.21645 20.62367 1.000 21.06422 C ? B ? 19 CD 1
   ATOM 1854 N . LYS B 47 ? 41.03443 -15.74845 24.49381 1.000 23.24893 N ? B ? 20 N 1
   ATOM 1855 CA . LYS B 47 ? 39.79996 -15.97815 25.23418 1.000 26.53387 C ? B ? 20 CA 1
   ATOM 1856 C . LYS B 47 ? 38.73637 -14.95978 24.86183 1.000 25.46186 C ? B ? 20 C 1
   ATOM 1857 O . LYS B 47 ? 39.03094 -13.84605 24.41695 1.000 23.65651 O ? B ? 20 O 1
   ATOM 1858 CB . LYS B 47 ? 40.08959 -15.89487 26.73467 1.000 35.14839 C ? B ? 20 CB 1
   ATOM 1859 CG . LYS B 47 ? 40.98779 -17.00119 27.18307 1.000 41.61913 C ? B ? 20 CG 1
   ATOM 1860 CD . LYS B 47 ? 40.43904 -18.33087 26.79307 1.000 53.39208 C ? B ? 20 CD 1
   ATOM 1861 CE . LYS B 47 ? 41.55148 -19.38527 26.87828 1.000 61.93408 C ? B ? 20 CE 1
   ATOM 1862 NZ . LYS B 47 ? 41.33415 -20.58029 26.02489 1.000 46.50972 N ? B ? 20 NZ 1
   ATOM 1863 N . LYS B 48 ? 37.48416 -15.29460 25.11898 1.000 23.58508 N ? B ? 21 N 1
   ATOM 1864 CA . LYS B 48 ? 36.46411 -14.28386 24.89210 1.000 20.81706 C ? B ? 21 CA 1
   ATOM 1865 C . LYS B 48 ? 36.78066 -13.02666 25.67632 1.000 27.71681 C ? B ? 21 C 1
   ATOM 1866 O . LYS B 48 ? 37.19033 -13.10956 26.84293 1.000 23.73838 O ? B ? 21 O 1
   ATOM 1867 CB . LYS B 48 ? 35.07533 -14.79742 25.26924 1.000 25.09132 C ? B ? 21 CB 1
   ATOM 1868 CG . LYS B 48 ? 34.82779 -16.14496 24.55002 1.000 32.80228 C ? B ? 21 CG 1
   ATOM 1869 CD . LYS B 48 ? 33.47949 -16.78224 24.94971 1.000 42.72594 C ? B ? 21 CD 1
   ATOM 1870 CE . LYS B 48 ? 32.27830 -15.84060 24.75557 1.000 56.84546 C ? B ? 21 CE 1
   ATOM 1871 NZ . LYS B 48 ? 30.95069 -16.55319 24.90113 1.000 51.70532 N ? B ? 21 NZ 1
   ATOM 1872 N . GLY B 49 ? 36.66195 -11.87858 25.00751 1.000 22.54231 N ? B ? 22 N 1
   ATOM 1873 CA . GLY B 49 ? 37.03313 -10.56072 25.54710 1.000 21.70503 C ? B ? 22 CA 1
   ATOM 1874 C . GLY B 49 ? 38.46942 -10.10301 25.27306 1.000 21.59322 C ? B ? 22 C 1
   ATOM 1875 O . GLY B 49 ? 38.75899 -8.89264 25.42312 1.000 24.50283 O ? B ? 22 O 1
   ATOM 1876 N . ASP B 50 ? 39.36076 -11.00860 24.82169 1.000 19.05065 N ? B ? 23 N 1
   ATOM 1877 CA . ASP B 50 ? 40.68762 -10.61765 24.39914 1.000 20.06167 C ? B ? 23 CA 1
   ATOM 1878 C . ASP B 50 ? 40.60704 -9.77654 23.13684 1.000 20.93848 C ? B ? 23 C 1
   ATOM 1879 O . ASP B 50 ? 39.68794 -9.91419 22.33357 1.000 21.21366 O ? B ? 23 O 1
   ATOM 1880 CB . ASP B 50 ? 41.56774 -11.82316 24.10815 1.000 20.33481 C ? B ? 23 CB 1
   ATOM 1881 CG . ASP B 50 ? 42.17856 -12.40807 25.36666 1.000 35.96724 C ? B ? 23 CG 1
   ATOM 1882 OD1 . ASP B 50 ? 42.28249 -11.66834 26.38331 1.000 24.65625 O ? B ? 23 OD1 1
   ATOM 1883 OD2 . ASP B 50 ? 42.54027 -13.59428 25.34666 1.000 31.31608 O ? B ? 23 OD2 1
   ATOM 1884 N . PHE B 51 ? 41.57008 -8.88834 22.98597 1.000 20.44984 N ? B ? 24 N 1
   ATOM 1885 CA . PHE B 51 ? 41.79328 -8.23272 21.72281 1.000 19.52390 C ? B ? 24 CA 1
   ATOM 1886 C . PHE B 51 ? 42.66392 -9.14593 20.85904 1.000 23.25044 C ? B ? 24 C 1
   ATOM 1887 O . PHE B 51 ? 43.52029 -9.88551 21.37084 1.000 25.02125 O ? B ? 24 O 1
   ATOM 1888 CB . PHE B 51 ? 42.42277 -6.86135 21.93825 1.000 20.87291 C ? B ? 24 CB 1
   ATOM 1889 CG . PHE B 51 ? 41.44535 -5.88113 22.50697 1.000 25.11116 C ? B ? 24 CG 1
   ATOM 1890 CD1 . PHE B 51 ? 41.23592 -5.82169 23.87585 1.000 41.82796 C ? B ? 24 CD1 1
   ATOM 1891 CD2 . PHE B 51 ? 40.70335 -5.06992 21.67592 1.000 34.81036 C ? B ? 24 CD2 1
   ATOM 1892 CE1 . PHE B 51 ? 40.30419 -4.93673 24.39797 1.000 49.80348 C ? B ? 24 CE1 1
   ATOM 1893 CE2 . PHE B 51 ? 39.77627 -4.18293 22.19652 1.000 45.26823 C ? B ? 24 CE2 1
   ATOM 1894 CZ . PHE B 51 ? 39.57298 -4.12692 23.55439 1.000 40.72838 C ? B ? 24 CZ 1
   ATOM 1895 N . VAL B 52 ? 42.37567 -9.17169 19.54799 1.000 17.53838 N ? B ? 25 N 1
   ATOM 1896 CA . VAL B 52 ? 43.18852 -9.94664 18.59303 1.000 15.81145 C ? B ? 25 CA 1
   ATOM 1897 C . VAL B 52 ? 43.57885 -9.01716 17.45627 1.000 19.89512 C ? B ? 25 C 1
   ATOM 1898 O . VAL B 52 ? 42.84337 -8.09140 17.09133 1.000 19.62681 O ? B ? 25 O 1
   ATOM 1899 CB . VAL B 52 ? 42.40500 -11.19425 18.02796 1.000 16.13500 C ? B ? 25 CB 1
   ATOM 1900 CG1 . VAL B 52 ? 42.12211 -12.19740 19.21441 1.000 17.81626 C ? B ? 25 CG1 1
   ATOM 1901 CG2 . VAL B 52 ? 41.08557 -10.80010 17.30943 1.000 14.73334 C ? B ? 25 CG2 1
   ATOM 1902 N . THR B 53 ? 44.69202 -9.35635 16.79663 1.000 16.57059 N ? B ? 26 N 1
   ATOM 1903 CA . THR B 53 ? 45.17509 -8.64674 15.62673 1.000 14.34745 C ? B ? 26 CA 1
   ATOM 1904 C . THR B 53 ? 45.34929 -9.73431 14.56727 1.000 13.53882 C ? B ? 26 C 1
   ATOM 1905 O . THR B 53 ? 46.04645 -10.73815 14.81504 1.000 16.20120 O ? B ? 26 O 1
   ATOM 1906 CB . THR B 53 ? 46.55844 -7.99468 15.95194 1.000 18.23159 C ? B ? 26 CB 1
   ATOM 1907 OG1 . THR B 53 ? 46.40719 -7.11311 17.09377 1.000 18.64735 O ? B ? 26 OG1 1
   ATOM 1908 CG2 . THR B 53 ? 47.03350 -7.22081 14.77621 1.000 16.99336 C ? B ? 26 CG2 1
   ATOM 1909 N . ILE B 54 ? 44.72011 -9.52573 13.39888 1.000 15.78976 N ? B ? 27 N 1
   ATOM 1910 CA . ILE B 54 ? 44.54309 -10.62294 12.44054 1.000 14.79728 C ? B ? 27 CA 1
   ATOM 1911 C . ILE B 54 ? 44.79241 -10.06381 11.04677 1.000 14.78324 C ? B ? 27 C 1
   ATOM 1912 O . ILE B 54 ? 44.36466 -8.95581 10.73907 1.000 16.95582 O ? B ? 27 O 1
   ATOM 1913 CB . ILE B 54 ? 43.09458 -11.15266 12.57517 1.000 16.10331 C ? B ? 27 CB 1
   ATOM 1914 CG1 . ILE B 54 ? 43.03690 -12.07563 13.80957 1.000 15.89903 C ? B ? 27 CG1 1
   ATOM 1915 CG2 . ILE B 54 ? 42.71070 -11.92637 11.32477 1.000 18.18929 C ? B ? 27 CG2 1
   ATOM 1916 CD1 . ILE B 54 ? 41.57061 -12.59554 14.16103 1.000 17.31940 C ? B ? 27 CD1 1
   ATOM 1917 N . HIS B 55 ? 45.35994 -10.88507 10.15807 1.000 12.62353 N ? B ? 28 N 1
   ATOM 1918 CA . HIS B 55 ? 45.28683 -10.57415 8.74397 1.000 15.34408 C ? B ? 28 CA 1
   ATOM 1919 C . HIS B 55 ? 44.34260 -11.57086 8.11091 1.000 15.54266 C ? B ? 28 C 1
   ATOM 1920 O . HIS B 55 ? 44.37170 -12.75405 8.46035 1.000 17.23140 O ? B ? 28 O 1
   ATOM 1921 CB . HIS B 55 ? 46.66875 -10.69827 8.05474 1.000 15.65033 C ? B ? 28 CB 1
   ATOM 1922 CG . HIS B 55 ? 47.35228 -9.38049 7.81183 1.000 16.09616 C ? B ? 28 CG 1
   ATOM 1923 ND1 . HIS B 55 ? 46.68506 -8.25409 7.39249 1.000 16.72636 N ? B ? 28 ND1 1
   ATOM 1924 CD2 . HIS B 55 ? 48.64500 -9.01134 7.97887 1.000 21.30103 C ? B ? 28 CD2 1
   ATOM 1925 CE1 . HIS B 55 ? 47.53794 -7.25230 7.24051 1.000 20.39232 C ? B ? 28 CE1 1
   ATOM 1926 NE2 . HIS B 55 ? 48.73973 -7.68728 7.59061 1.000 21.12996 N ? B ? 28 NE2 1
   ATOM 1927 N . TYR B 56 ? 43.53320 -11.08330 7.16939 1.000 13.76303 N ? B ? 29 N 1
   ATOM 1928 CA . TYR B 56 ? 42.54347 -11.99973 6.58681 1.000 13.53046 C ? B ? 29 CA 1
   ATOM 1929 C . TYR B 56 ? 42.36574 -11.68483 5.10410 1.000 16.15292 C ? B ? 29 C 1
   ATOM 1930 O . TYR B 56 ? 42.64727 -10.55483 4.64520 1.000 17.06919 O ? B ? 29 O 1
   ATOM 1931 CB . TYR B 56 ? 41.15961 -11.88809 7.30345 1.000 14.26696 C ? B ? 29 CB 1
   ATOM 1932 CG . TYR B 56 ? 40.45656 -10.55705 7.04659 1.000 16.74712 C ? B ? 29 CG 1
   ATOM 1933 CD1 . TYR B 56 ? 40.71746 -9.43499 7.90399 1.000 14.68238 C ? B ? 29 CD1 1
   ATOM 1934 CD2 . TYR B 56 ? 39.57097 -10.40542 5.95246 1.000 15.98094 C ? B ? 29 CD2 1
   ATOM 1935 CE1 . TYR B 56 ? 40.09590 -8.24578 7.69423 1.000 14.78887 C ? B ? 29 CE1 1
   ATOM 1936 CE2 . TYR B 56 ? 38.94889 -9.22514 5.71139 1.000 15.25110 C ? B ? 29 CE2 1
   ATOM 1937 CZ . TYR B 56 ? 39.22488 -8.11518 6.59900 1.000 17.25204 C ? B ? 29 CZ 1
   ATOM 1938 OH . TYR B 56 ? 38.65217 -6.88866 6.42181 1.000 19.36044 O ? B ? 29 OH 1
   ATOM 1939 N . THR B 57 ? 41.87049 -12.70710 4.36275 1.000 14.94801 N ? B ? 30 N 1
   ATOM 1940 CA . THR B 57 ? 41.29316 -12.47884 3.04044 1.000 14.43147 C ? B ? 30 CA 1
   ATOM 1941 C . THR B 57 ? 39.98467 -13.23627 3.01157 1.000 16.19089 C ? B ? 30 C 1
   ATOM 1942 O . THR B 57 ? 39.94972 -14.38239 3.46112 1.000 20.55802 O ? B ? 30 O 1
   ATOM 1943 CB . THR B 57 ? 42.22214 -13.04647 1.92765 1.000 20.58060 C ? B ? 30 CB 1
   ATOM 1944 OG1 . THR B 57 ? 43.46178 -12.33286 1.94637 1.000 21.84990 O ? B ? 30 OG1 1
   ATOM 1945 CG2 . THR B 57 ? 41.55942 -12.89330 0.51337 1.000 23.00271 C ? B ? 30 CG2 1
   ATOM 1946 N . GLY B 58 ? 38.91869 -12.59958 2.58096 1.000 13.01570 N ? B ? 31 N 1
   ATOM 1947 CA . GLY B 58 ? 37.62067 -13.27024 2.49882 1.000 13.18360 C ? B ? 31 CA 1
   ATOM 1948 C . GLY B 58 ? 37.23011 -13.48732 1.05349 1.000 18.09712 C ? B ? 31 C 1
   ATOM 1949 O . GLY B 58 ? 37.30941 -12.56634 0.26639 1.000 16.54699 O ? B ? 31 O 1
   ATOM 1950 N . ARG B 59 ? 36.68703 -14.67701 0.78620 1.000 15.36613 N ? B ? 32 N 1
   ATOM 1951 CA . ARG B 59 ? 36.25016 -15.06388 -0.53818 1.000 16.60516 C ? B ? 32 CA 1
   ATOM 1952 C . ARG B 59 ? 34.88428 -15.73738 -0.45918 1.000 21.18574 C ? B ? 32 C 1
   ATOM 1953 O . ARG B 59 ? 34.50652 -16.28669 0.59298 1.000 19.55220 O ? B ? 32 O 1
   ATOM 1954 CB . ARG B 59 ? 37.20819 -16.09274 -1.10021 1.000 18.45321 C ? B ? 32 CB 1
   ATOM 1955 CG . ARG B 59 ? 38.58969 -15.45416 -1.41073 1.000 24.49845 C ? B ? 32 CG 1
   ATOM 1956 CD . ARG B 59 ? 39.45838 -16.47828 -2.11904 1.000 27.84112 C ? B ? 32 CD 1
   ATOM 1957 NE . ARG B 59 ? 40.73038 -15.86235 -2.55648 1.000 30.91256 N ? B ? 32 NE 1
   ATOM 1958 CZ . ARG B 59 ? 41.79935 -15.79712 -1.77420 1.000 52.31433 C ? B ? 32 CZ 1
   ATOM 1959 NH1 . ARG B 59 ? 41.79152 -16.30525 -0.55113 1.000 53.66511 N ? B ? 32 NH1 1
   ATOM 1960 NH2 . ARG B 59 ? 42.90054 -15.20432 -2.22545 1.000 48.05777 N ? B ? 32 NH2 1
   ATOM 1961 N . LEU B 60 ? 34.15229 -15.66511 -1.57182 1.000 19.10284 N ? B ? 33 N 1
   ATOM 1962 CA . LEU B 60 ? 32.90897 -16.41500 -1.75579 1.000 17.85040 C ? B ? 33 CA 1
   ATOM 1963 C . LEU B 60 ? 33.23837 -17.79031 -2.31680 1.000 16.94176 C ? B ? 33 C 1
   ATOM 1964 O . LEU B 60 ? 34.38311 -18.10100 -2.63134 1.000 23.39915 O ? B ? 33 O 1
   ATOM 1965 CB . LEU B 60 ? 31.97649 -15.62512 -2.68266 1.000 18.41508 C ? B ? 33 CB 1
   ATOM 1966 CG . LEU B 60 ? 31.57159 -14.17752 -2.23309 1.000 18.62685 C ? B ? 33 CG 1
   ATOM 1967 CD1 . LEU B 60 ? 30.60511 -13.53629 -3.21989 1.000 23.14006 C ? B ? 33 CD1 1
   ATOM 1968 CD2 . LEU B 60 ? 30.88454 -14.26671 -0.82019 1.000 23.26862 C ? B ? 33 CD2 1
   ATOM 1969 N . THR B 61 ? 32.23352 -18.67119 -2.34271 1.000 20.35223 N ? B ? 34 N 1
   ATOM 1970 CA . THR B 61 ? 32.50489 -20.04222 -2.71219 1.000 22.54461 C ? B ? 34 CA 1
   ATOM 1971 C . THR B 61 ? 32.82259 -20.11437 -4.20636 1.000 26.69554 C ? B ? 34 C 1
   ATOM 1972 O . THR B 61 ? 33.30823 -21.14423 -4.65386 1.000 32.12110 O ? B ? 34 O 1
   ATOM 1973 CB . THR B 61 ? 31.29093 -20.98454 -2.37022 1.000 17.57957 C ? B ? 34 CB 1
   ATOM 1974 OG1 . THR B 61 ? 30.11747 -20.47392 -2.94413 1.000 23.27764 O ? B ? 34 OG1 1
   ATOM 1975 CG2 . THR B 61 ? 31.09599 -21.04727 -0.84688 1.000 25.23416 C ? B ? 34 CG2 1
   ATOM 1976 N . ASP B 62 ? 32.48582 -19.06330 -4.97339 1.000 24.06643 N ? B ? 35 N 1
   ATOM 1977 CA . ASP B 62 ? 32.89010 -19.03765 -6.39990 1.000 32.21624 C ? B ? 35 CA 1
   ATOM 1978 C . ASP B 62 ? 34.32041 -18.58133 -6.58316 1.000 35.49294 C ? B ? 35 C 1
   ATOM 1979 O . ASP B 62 ? 34.76563 -18.36197 -7.71810 1.000 30.69976 O ? B ? 35 O 1
   ATOM 1980 CB . ASP B 62 ? 31.92327 -18.15517 -7.20006 1.000 29.54609 C ? B ? 35 CB 1
   ATOM 1981 CG . ASP B 62 ? 32.01129 -16.64786 -6.83463 1.000 31.27292 C ? B ? 35 CG 1
   ATOM 1982 OD1 . ASP B 62 ? 31.24385 -15.85269 -7.40394 1.000 56.25276 O ? B ? 35 OD1 1
   ATOM 1983 OD2 . ASP B 62 ? 32.87806 -16.25778 -5.99522 1.000 25.87040 O ? B ? 35 OD2 1
   ATOM 1984 N . GLY B 63 ? 35.05432 -18.40889 -5.48929 1.000 25.34528 N ? B ? 36 N 1
   ATOM 1985 CA . GLY B 63 ? 36.43081 -18.01424 -5.51266 1.000 28.67498 C ? B ? 36 CA 1
   ATOM 1986 C . GLY B 63 ? 36.68551 -16.51872 -5.49939 1.000 20.48492 C ? B ? 36 C 1
   ATOM 1987 O . GLY B 63 ? 37.85351 -16.12179 -5.41805 1.000 25.18010 O ? B ? 36 O 1
   ATOM 1988 N . SER B 64 ? 35.68022 -15.69598 -5.64424 1.000 24.19200 N ? B ? 37 N 1
   ATOM 1989 CA . SER B 64 ? 35.96883 -14.27533 -5.78458 1.000 28.54220 C ? B ? 37 CA 1
   ATOM 1990 C . SER B 64 ? 36.32066 -13.69191 -4.42653 1.000 28.72081 C ? B ? 37 C 1
   ATOM 1991 O . SER B 64 ? 35.72487 -14.07253 -3.40956 1.000 23.95957 O ? B ? 37 O 1
   ATOM 1992 CB . SER B 64 ? 34.79321 -13.50744 -6.33289 1.000 28.56846 C ? B ? 37 CB 1
   ATOM 1993 OG . SER B 64 ? 33.62079 -13.65978 -5.59702 1.000 26.81405 O ? B ? 37 OG 1
   ATOM 1994 N . LYS B 65 ? 37.26311 -12.75539 -4.41423 1.000 18.65371 N ? B ? 38 N 1
   ATOM 1995 CA . LYS B 65 ? 37.66622 -12.07926 -3.16270 1.000 19.34243 C ? B ? 38 CA 1
   ATOM 1996 C . LYS B 65 ? 36.72947 -10.92163 -2.91721 1.000 28.51724 C ? B ? 38 C 1
   ATOM 1997 O . LYS B 65 ? 36.46874 -10.12478 -3.82205 1.000 26.12133 O ? B ? 38 O 1
   ATOM 1998 CB . LYS B 65 ? 39.10338 -11.56235 -3.30751 1.000 22.05304 C ? B ? 38 CB 1
   ATOM 1999 CG . LYS B 65 ? 39.62875 -10.67956 -2.23320 1.000 27.41614 C ? B ? 38 CG 1
   ATOM 2000 CD . LYS B 65 ? 41.21111 -10.73732 -2.30407 1.000 30.45695 C ? B ? 38 CD 1
   ATOM 2001 CE . LYS B 65 ? 41.69029 -10.09391 -3.56495 1.000 44.41716 C ? B ? 38 CE 1
   ATOM 2002 NZ . LYS B 65 ? 43.19205 -10.23063 -3.51930 1.000 53.27773 N ? B ? 38 NZ 1
   ATOM 2003 N . PHE B 66 ? 36.20078 -10.80963 -1.70125 1.000 21.06271 N ? B ? 39 N 1
   ATOM 2004 CA . PHE B 66 ? 35.43926 -9.62533 -1.40349 1.000 19.86052 C ? B ? 39 CA 1
   ATOM 2005 C . PHE B 66 ? 36.16938 -8.63745 -0.50309 1.000 18.84567 C ? B ? 39 C 1
   ATOM 2006 O . PHE B 66 ? 35.75604 -7.47228 -0.46021 1.000 20.50346 O ? B ? 39 O 1
   ATOM 2007 CB . PHE B 66 ? 34.06745 -9.98650 -0.79789 1.000 20.51633 C ? B ? 39 CB 1
   ATOM 2008 CG . PHE B 66 ? 34.13593 -10.83745 0.46977 1.000 18.91133 C ? B ? 39 CG 1
   ATOM 2009 CD1 . PHE B 66 ? 34.34402 -10.24005 1.72496 1.000 18.22670 C ? B ? 39 CD1 1
   ATOM 2010 CD2 . PHE B 66 ? 33.94007 -12.23446 0.38765 1.000 20.32535 C ? B ? 39 CD2 1
   ATOM 2011 CE1 . PHE B 66 ? 34.36622 -11.06621 2.85446 1.000 15.95925 C ? B ? 39 CE1 1
   ATOM 2012 CE2 . PHE B 66 ? 33.94416 -13.05105 1.50699 1.000 17.28018 C ? B ? 39 CE2 1
   ATOM 2013 CZ . PHE B 66 ? 34.18696 -12.42023 2.79732 1.000 17.41254 C ? B ? 39 CZ 1
   ATOM 2014 N A ASP B 67 ? 37.24070 -9.04846 0.17157 0.167 16.82295 N ? B ? 40 N 1
   ATOM 2015 CA A ASP B 67 ? 37.99559 -8.12980 1.02177 0.167 16.43470 C ? B ? 40 CA 1
   ATOM 2016 C A ASP B 67 ? 39.29111 -8.80316 1.43402 0.167 16.74632 C ? B ? 40 C 1
   ATOM 2017 O A ASP B 67 ? 39.40194 -10.03448 1.42406 0.167 18.68964 O ? B ? 40 O 1
   ATOM 2018 CB A ASP B 67 ? 37.19301 -7.71647 2.26041 0.167 18.34939 C ? B ? 40 CB 1
   ATOM 2019 CG A ASP B 67 ? 37.62051 -6.37208 2.80570 0.167 21.89370 C ? B ? 40 CG 1
   ATOM 2020 OD1 A ASP B 67 ? 38.05099 -5.52267 2.00551 0.167 15.59236 O ? B ? 40 OD1 1
   ATOM 2021 OD2 A ASP B 67 ? 37.54259 -6.17510 4.03256 0.167 21.20880 O ? B ? 40 OD2 1
   ATOM 2022 N B ASP B 67 ? 37.26709 -9.04968 0.13093 0.833 16.64986 N ? B ? 40 N 1
   ATOM 2023 CA B ASP B 67 ? 38.01410 -8.13405 1.01948 0.833 16.18840 C ? B ? 40 CA 1
   ATOM 2024 C B ASP B 67 ? 39.28334 -8.80995 1.45796 0.833 16.55054 C ? B ? 40 C 1
   ATOM 2025 O B ASP B 67 ? 39.40391 -10.05518 1.45321 0.833 18.92595 O ? B ? 40 O 1
   ATOM 2026 CB B ASP B 67 ? 37.16551 -7.71719 2.24083 0.833 18.18182 C ? B ? 40 CB 1
   ATOM 2027 CG B ASP B 67 ? 37.81153 -6.60083 3.09231 0.833 23.89919 C ? B ? 40 CG 1
   ATOM 2028 OD1 B ASP B 67 ? 38.71176 -5.89988 2.62413 0.833 22.46240 O ? B ? 40 OD1 1
   ATOM 2029 OD2 B ASP B 67 ? 37.38711 -6.43748 4.24415 0.833 22.38246 O ? B ? 40 OD2 1
   ATOM 2030 N . SER B 68 ? 40.27850 -7.98192 1.79235 1.000 16.68850 N ? B ? 41 N 1
   ATOM 2031 CA . SER B 68 ? 41.53695 -8.51779 2.29410 1.000 15.80616 C ? B ? 41 CA 1
   ATOM 2032 C . SER B 68 ? 42.25752 -7.42482 3.08153 1.000 17.95950 C ? B ? 41 C 1
   ATOM 2033 O . SER B 68 ? 42.51880 -6.34687 2.52887 1.000 20.78712 O ? B ? 41 O 1
   ATOM 2034 CB . SER B 68 ? 42.42649 -9.02247 1.13548 1.000 18.17748 C ? B ? 41 CB 1
   ATOM 2035 OG . SER B 68 ? 43.68331 -9.38820 1.65298 1.000 22.76716 O ? B ? 41 OG 1
   ATOM 2036 N . SER B 69 ? 42.56660 -7.68521 4.35594 1.000 13.88505 N ? B ? 42 N 1
   ATOM 2037 CA . SER B 69 ? 43.45452 -6.75522 5.06582 1.000 14.40757 C ? B ? 42 CA 1
   ATOM 2038 C . SER B 69 ? 44.83686 -6.81302 4.49628 1.000 19.95639 C ? B ? 42 C 1
   ATOM 2039 O . SER B 69 ? 45.60306 -5.86591 4.64732 1.000 18.64025 O ? B ? 42 O 1
   ATOM 2040 CB . SER B 69 ? 43.49032 -7.09241 6.56103 1.000 14.90195 C ? B ? 42 CB 1
   ATOM 2041 OG . SER B 69 ? 43.98601 -8.41175 6.80464 1.000 16.94765 O ? B ? 42 OG 1
   ATOM 2042 N . VAL B 70 ? 45.20966 -7.99245 3.99875 1.000 18.39027 N ? B ? 43 N 1
   ATOM 2043 CA . VAL B 70 ? 46.57838 -8.18744 3.51062 1.000 17.25770 C ? B ? 43 CA 1
   ATOM 2044 C . VAL B 70 ? 46.82665 -7.24458 2.36350 1.000 22.54105 C ? B ? 43 C 1
   ATOM 2045 O . VAL B 70 ? 47.89282 -6.61205 2.25984 1.000 24.11026 O ? B ? 43 O 1
   ATOM 2046 CB . VAL B 70 ? 46.77275 -9.64832 3.08115 1.000 21.44739 C ? B ? 43 CB 1
   ATOM 2047 CG1 . VAL B 70 ? 48.16638 -9.83238 2.43304 1.000 25.90382 C ? B ? 43 CG1 1
   ATOM 2048 CG2 . VAL B 70 ? 46.62859 -10.58389 4.35977 1.000 19.02462 C ? B ? 43 CG2 1
   ATOM 2049 N . ASP B 71 ? 45.83361 -7.10894 1.50186 1.000 24.16411 N ? B ? 44 N 1
   ATOM 2050 CA . ASP B 71 ? 45.99073 -6.25139 0.32874 1.000 25.78168 C ? B ? 44 CA 1
   ATOM 2051 C . ASP B 71 ? 46.14525 -4.77375 0.71024 1.000 30.01472 C ? B ? 44 C 1
   ATOM 2052 O . ASP B 71 ? 46.82339 -4.03136 0.00015 1.000 30.67327 O ? B ? 44 O 1
   ATOM 2053 CB . ASP B 71 ? 44.81451 -6.42098 -0.64137 1.000 24.28613 C ? B ? 44 CB 1
   ATOM 2054 CG . ASP B 71 ? 44.81520 -7.78313 -1.32169 1.000 27.62063 C ? B ? 44 CG 1
   ATOM 2055 OD1 . ASP B 71 ? 45.86640 -8.47242 -1.28995 1.000 38.83702 O ? B ? 44 OD1 1
   ATOM 2056 OD2 . ASP B 71 ? 43.77740 -8.14269 -1.89031 1.000 33.46246 O ? B ? 44 OD2 1
   ATOM 2057 N . ARG B 72 ? 45.55950 -4.32871 1.82376 1.000 22.73322 N ? B ? 45 N 1
   ATOM 2058 CA . ARG B 72 ? 45.77333 -2.96890 2.32795 1.000 24.08731 C ? B ? 45 CA 1
   ATOM 2059 C . ARG B 72 ? 46.99613 -2.87508 3.20045 1.000 19.19012 C ? B ? 45 C 1
   ATOM 2060 O . ARG B 72 ? 47.33874 -1.76186 3.66187 1.000 22.80433 O ? B ? 45 O 1
   ATOM 2061 CB . ARG B 72 ? 44.60063 -2.44918 3.19058 1.000 30.80520 C ? B ? 45 CB 1
   ATOM 2062 CG . ARG B 72 ? 43.24606 -2.64915 2.69555 1.000 35.17708 C ? B ? 45 CG 1
   ATOM 2063 CD . ARG B 72 ? 42.23770 -1.98923 3.71332 1.000 23.82646 C ? B ? 45 CD 1
   ATOM 2064 NE . ARG B 72 ? 41.81352 -2.88553 4.81377 1.000 19.20539 N ? B ? 45 NE 1
   ATOM 2065 CZ . ARG B 72 ? 40.86266 -3.81968 4.59950 1.000 15.89917 C ? B ? 45 CZ 1
   ATOM 2066 NH1 . ARG B 72 ? 40.23752 -3.89881 3.41696 1.000 20.47169 N ? B ? 45 NH1 1
   ATOM 2067 NH2 . ARG B 72 ? 40.55681 -4.67287 5.57531 1.000 20.73065 N ? B ? 45 NH2 1
   ATOM 2068 N . ASN B 73 ? 47.60160 -4.03031 3.53547 1.000 20.13887 N ? B ? 46 N 1
   ATOM 2069 CA . ASN B 73 ? 48.70581 -4.12673 4.50992 1.000 21.11980 C ? B ? 46 CA 1
   ATOM 2070 C . ASN B 73 ? 48.37361 -3.48083 5.85056 1.000 20.79617 C ? B ? 46 C 1
   ATOM 2071 O . ASN B 73 ? 49.21490 -2.82977 6.49046 1.000 20.30205 O ? B ? 46 O 1
   ATOM 2072 CB . ASN B 73 ? 50.00718 -3.54979 3.97584 1.000 21.07364 C ? B ? 46 CB 1
   ATOM 2073 CG . ASN B 73 ? 51.13469 -4.13618 4.65651 1.000 24.68451 C ? B ? 46 CG 1
   ATOM 2074 OD1 . ASN B 73 ? 51.06534 -5.31358 5.08018 1.000 25.32045 O ? B ? 46 OD1 1
   ATOM 2075 ND2 . ASN B 73 ? 52.20062 -3.36345 4.83500 1.000 21.91684 N ? B ? 46 ND2 1
   ATOM 2076 N . GLU B 74 ? 47.14587 -3.70712 6.32856 1.000 16.58916 N ? B ? 47 N 1
   ATOM 2077 CA . GLU B 74 ? 46.71687 -3.13536 7.59638 1.000 18.06764 C ? B ? 47 CA 1
   ATOM 2078 C . GLU B 74 ? 46.13710 -4.24233 8.44579 1.000 14.78221 C ? B ? 47 C 1
   ATOM 2079 O . GLU B 74 ? 45.01561 -4.71154 8.10161 1.000 18.12702 O ? B ? 47 O 1
   ATOM 2080 CB . GLU B 74 ? 45.65768 -2.07249 7.34896 1.000 18.79596 C ? B ? 47 CB 1
   ATOM 2081 CG . GLU B 74 ? 46.22328 -0.87329 6.52216 1.000 29.28005 C ? B ? 47 CG 1
   ATOM 2082 CD . GLU B 74 ? 47.09351 0.00103 7.43021 1.000 47.58512 C ? B ? 47 CD 1
   ATOM 2083 OE1 . GLU B 74 ? 47.22221 -0.27895 8.65989 1.000 44.60830 O ? B ? 47 OE1 1
   ATOM 2084 OE2 . GLU B 74 ? 47.60708 0.97718 6.88133 1.000 41.08491 O ? B ? 47 OE2 1
   ATOM 2085 N . PRO B 75 ? 46.79460 -4.63301 9.53814 1.000 18.20956 N ? B ? 48 N 1
   ATOM 2086 CA . PRO B 75 ? 46.23806 -5.67267 10.42161 1.000 15.88711 C ? B ? 48 CA 1
   ATOM 2087 C . PRO B 75 ? 44.88685 -5.22222 10.95276 1.000 17.89323 C ? B ? 48 C 1
   ATOM 2088 O . PRO B 75 ? 44.64479 -4.03750 11.25921 1.000 20.15035 O ? B ? 48 O 1
   ATOM 2089 CB . PRO B 75 ? 47.25676 -5.77347 11.54184 1.000 18.64579 C ? B ? 48 CB 1
   ATOM 2090 CG . PRO B 75 ? 48.57640 -5.41995 10.86309 1.000 19.01549 C ? B ? 48 CG 1
   ATOM 2091 CD . PRO B 75 ? 48.18954 -4.27726 9.91127 1.000 18.12299 C ? B ? 48 CD 1
   ATOM 2092 N . PHE B 76 ? 43.97486 -6.17431 11.04879 1.000 16.43540 N ? B ? 49 N 1
   ATOM 2093 CA . PHE B 76 ? 42.66027 -5.88217 11.57125 1.000 15.78818 C ? B ? 49 CA 1
   ATOM 2094 C . PHE B 76 ? 42.65142 -6.18985 13.07130 1.000 17.37883 C ? B ? 49 C 1
   ATOM 2095 O . PHE B 76 ? 43.10797 -7.24817 13.50064 1.000 17.56978 O ? B ? 49 O 1
   ATOM 2096 CB . PHE B 76 ? 41.65909 -6.79153 10.83435 1.000 15.88259 C ? B ? 49 CB 1
   ATOM 2097 CG . PHE B 76 ? 40.29533 -6.85580 11.50830 1.000 16.37448 C ? B ? 49 CG 1
   ATOM 2098 CD1 . PHE B 76 ? 39.46600 -5.69706 11.62632 1.000 17.77362 C ? B ? 49 CD1 1
   ATOM 2099 CD2 . PHE B 76 ? 39.84073 -8.04428 11.96989 1.000 16.67974 C ? B ? 49 CD2 1
   ATOM 2100 CE1 . PHE B 76 ? 38.17599 -5.79137 12.21299 1.000 17.43245 C ? B ? 49 CE1 1
   ATOM 2101 CE2 . PHE B 76 ? 38.54440 -8.16230 12.62752 1.000 16.14958 C ? B ? 49 CE2 1
   ATOM 2102 CZ . PHE B 76 ? 37.71566 -6.99903 12.72008 1.000 15.26181 C ? B ? 49 CZ 1
   ATOM 2103 N . GLN B 77 ? 42.03356 -5.30734 13.87992 1.000 16.25823 N ? B ? 50 N 1
   ATOM 2104 CA . GLN B 77 ? 42.00840 -5.58611 15.32001 1.000 14.43345 C ? B ? 50 CA 1
   ATOM 2105 C . GLN B 77 ? 40.56443 -5.54613 15.80386 1.000 15.79729 C ? B ? 50 C 1
   ATOM 2106 O . GLN B 77 ? 39.77860 -4.67560 15.37024 1.000 17.49705 O ? B ? 50 O 1
   ATOM 2107 CB . GLN B 77 ? 42.81998 -4.49106 16.02546 1.000 17.17774 C ? B ? 50 CB 1
   ATOM 2108 CG . GLN B 77 ? 44.27121 -4.60474 15.71574 1.000 23.73638 C ? B ? 50 CG 1
   ATOM 2109 CD . GLN B 77 ? 45.03548 -3.60306 16.52913 1.000 35.92152 C ? B ? 50 CD 1
   ATOM 2110 OE1 . GLN B 77 ? 44.79812 -2.40580 16.40012 1.000 35.34465 O ? B ? 50 OE1 1
   ATOM 2111 NE2 . GLN B 77 ? 45.94952 -4.07298 17.37096 1.000 40.58733 N ? B ? 50 NE2 1
   ATOM 2112 N . THR B 78 ? 40.22647 -6.45260 16.72653 1.000 16.66488 N ? B ? 51 N 1
   ATOM 2113 CA . THR B 78 ? 38.86597 -6.41273 17.26556 1.000 15.77142 C ? B ? 51 CA 1
   ATOM 2114 C . THR B 78 ? 38.93330 -7.05326 18.63273 1.000 19.67466 C ? B ? 51 C 1
   ATOM 2115 O . THR B 78 ? 39.92690 -7.66042 18.97632 1.000 19.27606 O ? B ? 51 O 1
   ATOM 2116 CB . THR B 78 ? 37.83807 -7.17392 16.37568 1.000 18.49269 C ? B ? 51 CB 1
   ATOM 2117 OG1 . THR B 78 ? 36.49125 -6.91350 16.85806 1.000 20.18873 O ? B ? 51 OG1 1
   ATOM 2118 CG2 . THR B 78 ? 38.09272 -8.73257 16.37812 1.000 18.96482 C ? B ? 51 CG2 1
   ATOM 2119 N . GLN B 79 ? 37.91043 -6.83312 19.44921 1.000 18.03414 N ? B ? 52 N 1
   ATOM 2120 CA . GLN B 79 ? 37.77729 -7.64115 20.65562 1.000 14.22729 C ? B ? 52 CA 1
   ATOM 2121 C . GLN B 79 ? 36.96166 -8.89127 20.30080 1.000 20.94804 C ? B ? 52 C 1
   ATOM 2122 O . GLN B 79 ? 35.88531 -8.75851 19.72221 1.000 26.90137 O ? B ? 52 O 1
   ATOM 2123 CB . GLN B 79 ? 37.02951 -6.83164 21.73375 1.000 19.81101 C ? B ? 52 CB 1
   ATOM 2124 CG . GLN B 79 ? 36.93367 -7.68343 22.97970 1.000 22.52463 C ? B ? 52 CG 1
   ATOM 2125 CD . GLN B 79 ? 36.22911 -6.92715 24.07891 1.000 46.40474 C ? B ? 52 CD 1
   ATOM 2126 OE1 . GLN B 79 ? 35.12766 -6.42128 23.85592 1.000 46.18044 O ? B ? 52 OE1 1
   ATOM 2127 NE2 . GLN B 79 ? 36.84713 -6.85876 25.26903 1.000 35.55802 N ? B ? 52 NE2 1
   ATOM 2128 N . ILE B 80 ? 37.49053 -10.07481 20.55031 1.000 16.28081 N ? B ? 53 N 1
   ATOM 2129 CA . ILE B 80 ? 36.80515 -11.29153 20.07213 1.000 16.75709 C ? B ? 53 CA 1
   ATOM 2130 C . ILE B 80 ? 35.85089 -11.83340 21.12970 1.000 22.63049 C ? B ? 53 C 1
   ATOM 2131 O . ILE B 80 ? 36.00609 -11.59574 22.33600 1.000 19.68222 O ? B ? 53 O 1
   ATOM 2132 CB . ILE B 80 ? 37.92342 -12.31444 19.72114 1.000 15.21529 C ? B ? 53 CB 1
   ATOM 2133 CG1 . ILE B 80 ? 37.44708 -13.42829 18.73211 1.000 16.13818 C ? B ? 53 CG1 1
   ATOM 2134 CG2 . ILE B 80 ? 38.52868 -12.97796 21.06990 1.000 14.23871 C ? B ? 53 CG2 1
   ATOM 2135 CD1 . ILE B 80 ? 37.03339 -12.83586 17.35632 1.000 15.51899 C ? B ? 53 CD1 1
   ATOM 2136 N A GLY B 81 ? 34.84642 -12.55717 20.66180 0.562 17.34095 N ? B ? 54 N 1
   ATOM 2137 CA A GLY B 81 ? 33.88314 -13.23665 21.51618 0.562 20.01607 C ? B ? 54 CA 1
   ATOM 2138 C A GLY B 81 ? 32.77134 -12.36879 22.06069 0.562 21.46608 C ? B ? 54 C 1
   ATOM 2139 O A GLY B 81 ? 31.91512 -12.88799 22.79237 0.562 22.76701 O ? B ? 54 O 1
   ATOM 2140 N B GLY B 81 ? 34.86925 -12.60447 20.69011 0.438 17.48206 N ? B ? 54 N 1
   ATOM 2141 CA B GLY B 81 ? 33.92624 -13.20339 21.62928 0.438 20.18060 C ? B ? 54 CA 1
   ATOM 2142 C B GLY B 81 ? 33.05274 -12.20407 22.36168 0.438 21.80749 C ? B ? 54 C 1
   ATOM 2143 O B GLY B 81 ? 32.66787 -12.44255 23.52204 0.438 22.07225 O ? B ? 54 O 1
   ATOM 2144 N . THR B 82 ? 32.73961 -11.07747 21.73442 1.000 23.05226 N ? B ? 55 N 1
   ATOM 2145 CA . THR B 82 ? 31.77801 -10.13538 22.29678 1.000 22.61667 C ? B ? 55 CA 1
   ATOM 2146 C . THR B 82 ? 30.74332 -9.68153 21.29328 1.000 21.65222 C ? B ? 55 C 1
   ATOM 2147 O . THR B 82 ? 30.06140 -8.68877 21.53895 1.000 25.50947 O ? B ? 55 O 1
   ATOM 2148 CB . THR B 82 ? 32.48605 -8.91869 22.87928 1.000 27.57718 C ? B ? 55 CB 1
   ATOM 2149 OG1 . THR B 82 ? 33.20393 -8.21773 21.83485 1.000 22.36095 O ? B ? 55 OG1 1
   ATOM 2150 CG2 . THR B 82 ? 33.48398 -9.34172 24.00130 1.000 26.67834 C ? B ? 55 CG2 1
   ATOM 2151 N A GLY B 83 ? 30.55948 -10.41242 20.17365 0.601 19.72322 N ? B ? 56 N 1
   ATOM 2152 CA A GLY B 83 ? 29.53222 -10.03701 19.22113 0.601 20.75949 C ? B ? 56 CA 1
   ATOM 2153 C A GLY B 83 ? 29.86372 -8.89053 18.30924 0.601 20.27821 C ? B ? 56 C 1
   ATOM 2154 O A GLY B 83 ? 28.96754 -8.34086 17.67124 0.601 22.64468 O ? B ? 56 O 1
   ATOM 2155 N B GLY B 83 ? 30.57105 -10.40330 20.17515 0.399 19.69428 N ? B ? 56 N 1
   ATOM 2156 CA B GLY B 83 ? 29.53874 -10.04538 19.22235 0.399 20.76928 C ? B ? 56 CA 1
   ATOM 2157 C B GLY B 83 ? 29.86015 -8.89332 18.31211 0.399 20.29317 C ? B ? 56 C 1
   ATOM 2158 O B GLY B 83 ? 28.95841 -8.34344 17.68106 0.399 22.59283 O ? B ? 56 O 1
   ATOM 2159 N . ARG B 84 ? 31.12274 -8.49627 18.21024 1.000 15.31274 N ? B ? 57 N 1
   ATOM 2160 CA . ARG B 84 ? 31.45399 -7.38089 17.37441 1.000 12.61607 C ? B ? 57 CA 1
   ATOM 2161 C . ARG B 84 ? 31.68541 -7.83892 15.93000 1.000 19.42356 C ? B ? 57 C 1
   ATOM 2162 O . ARG B 84 ? 31.59405 -7.04192 15.00702 1.000 20.64447 O ? B ? 57 O 1
   ATOM 2163 CB . ARG B 84 ? 32.73335 -6.71503 17.90780 1.000 17.36707 C ? B ? 57 CB 1
   ATOM 2164 CG . ARG B 84 ? 32.41703 -5.96412 19.22438 1.000 26.12157 C ? B ? 57 CG 1
   ATOM 2165 CD . ARG B 84 ? 33.70512 -5.59849 19.88990 1.000 38.37232 C ? B ? 57 CD 1
   ATOM 2166 NE . ARG B 84 ? 33.48735 -5.11498 21.25929 1.000 52.37153 N ? B ? 57 NE 1
   ATOM 2167 CZ . ARG B 84 ? 33.17965 -3.86000 21.56126 1.000 72.45215 C ? B ? 57 CZ 1
   ATOM 2168 NH1 . ARG B 84 ? 33.04511 -2.93155 20.61754 1.000 58.30809 N ? B ? 57 NH1 1
   ATOM 2169 NH2 . ARG B 84 ? 32.98598 -3.53000 22.83656 1.000 69.31427 N ? B ? 57 NH2 1
   ATOM 2170 N . VAL B 85 ? 31.98060 -9.11251 15.74606 1.000 15.66937 N ? B ? 58 N 1
   ATOM 2171 CA . VAL B 85 ? 32.18010 -9.65290 14.40253 1.000 16.01011 C ? B ? 58 CA 1
   ATOM 2172 C . VAL B 85 ? 31.16240 -10.77658 14.20279 1.000 14.94952 C ? B ? 58 C 1
   ATOM 2173 O . VAL B 85 ? 30.47349 -11.19472 15.12262 1.000 18.40324 O ? B ? 58 O 1
   ATOM 2174 CB . VAL B 85 ? 33.61956 -10.14883 14.19285 1.000 13.28639 C ? B ? 58 CB 1
   ATOM 2175 CG1 . VAL B 85 ? 34.66485 -8.91909 14.18142 1.000 13.84520 C ? B ? 58 CG1 1
   ATOM 2176 CG2 . VAL B 85 ? 34.00951 -11.22325 15.31045 1.000 15.83747 C ? B ? 58 CG2 1
   ATOM 2177 N . ILE B 86 ? 31.08499 -11.29145 12.97352 1.000 13.11532 N ? B ? 59 N 1
   ATOM 2178 CA . ILE B 86 ? 30.17485 -12.38798 12.71508 1.000 14.37610 C ? B ? 59 CA 1
   ATOM 2179 C . ILE B 86 ? 30.46480 -13.57614 13.62096 1.000 12.75620 C ? B ? 59 C 1
   ATOM 2180 O . ILE B 86 ? 31.60204 -13.84564 14.04585 1.000 15.12582 O ? B ? 59 O 1
   ATOM 2181 CB . ILE B 86 ? 30.20399 -12.81345 11.23509 1.000 13.01103 C ? B ? 59 CB 1
   ATOM 2182 CG1 . ILE B 86 ? 31.64377 -13.15173 10.76481 1.000 13.00673 C ? B ? 59 CG1 1
   ATOM 2183 CG2 . ILE B 86 ? 29.55065 -11.67803 10.38588 1.000 14.21234 C ? B ? 59 CG2 1
   ATOM 2184 CD1 . ILE B 86 ? 31.64838 -13.72911 9.29045 1.000 16.88916 C ? B ? 59 CD1 1
   ATOM 2185 N . LYS B 87 ? 29.39190 -14.36106 13.83980 1.000 15.49280 N ? B ? 60 N 1
   ATOM 2186 CA . LYS B 87 ? 29.48719 -15.46725 14.80504 1.000 17.15715 C ? B ? 60 CA 1
   ATOM 2187 C . LYS B 87 ? 30.62985 -16.43589 14.47297 1.000 14.05478 C ? B ? 60 C 1
   ATOM 2188 O . LYS B 87 ? 31.35036 -16.87832 15.36230 1.000 13.87798 O ? B ? 60 O 1
   ATOM 2189 CB . LYS B 87 ? 28.14388 -16.19546 14.87460 1.000 17.88243 C ? B ? 60 CB 1
   ATOM 2190 CG . LYS B 87 ? 27.13698 -15.46275 15.70251 1.000 32.57792 C ? B ? 60 CG 1
   ATOM 2191 CD . LYS B 87 ? 25.81012 -16.22751 16.10887 1.000 61.29230 C ? B ? 60 CD 1
   ATOM 2192 CE . LYS B 87 ? 25.80764 -17.77299 16.04017 1.000 79.56703 C ? B ? 60 CE 1
   ATOM 2193 NZ . LYS B 87 ? 24.53964 -18.47515 16.62476 1.000 58.99354 N ? B ? 60 NZ 1
   ATOM 2194 N . GLY B 88 ? 30.83407 -16.77720 13.17516 1.000 16.25994 N ? B ? 61 N 1
   ATOM 2195 CA . GLY B 88 ? 31.88726 -17.73194 12.84798 1.000 17.29498 C ? B ? 61 CA 1
   ATOM 2196 C . GLY B 88 ? 33.29224 -17.28317 13.23455 1.000 12.68689 C ? B ? 61 C 1
   ATOM 2197 O . GLY B 88 ? 34.14707 -18.10193 13.52525 1.000 14.77185 O ? B ? 61 O 1
   ATOM 2198 N . TRP B 89 ? 33.55924 -15.95898 13.20587 1.000 13.94832 N ? B ? 62 N 1
   ATOM 2199 CA . TRP B 89 ? 34.82905 -15.46648 13.74460 1.000 15.73496 C ? B ? 62 CA 1
   ATOM 2200 C . TRP B 89 ? 34.85307 -15.54250 15.26840 1.000 14.49741 C ? B ? 62 C 1
   ATOM 2201 O . TRP B 89 ? 35.88320 -15.92620 15.86077 1.000 13.10804 O ? B ? 62 O 1
   ATOM 2202 CB . TRP B 89 ? 35.08225 -13.99106 13.28388 1.000 13.42457 C ? B ? 62 CB 1
   ATOM 2203 CG . TRP B 89 ? 35.71881 -13.86413 11.94494 1.000 15.51816 C ? B ? 62 CG 1
   ATOM 2204 CD1 . TRP B 89 ? 35.24438 -14.35122 10.76342 1.000 15.55654 C ? B ? 62 CD1 1
   ATOM 2205 CD2 . TRP B 89 ? 36.90176 -13.12343 11.66289 1.000 12.27253 C ? B ? 62 CD2 1
   ATOM 2206 NE1 . TRP B 89 ? 36.15458 -13.98505 9.69006 1.000 14.79613 N ? B ? 62 NE1 1
   ATOM 2207 CE2 . TRP B 89 ? 37.16552 -13.24039 10.24998 1.000 15.26471 C ? B ? 62 CE2 1
   ATOM 2208 CE3 . TRP B 89 ? 37.79743 -12.42520 12.47889 1.000 14.13673 C ? B ? 62 CE3 1
   ATOM 2209 CZ2 . TRP B 89 ? 38.24414 -12.61984 9.66667 1.000 15.41061 C ? B ? 62 CZ2 1
   ATOM 2210 CZ3 . TRP B 89 ? 38.93601 -11.81193 11.87293 1.000 14.38749 C ? B ? 62 CZ3 1
   ATOM 2211 CH2 . TRP B 89 ? 39.12319 -11.90878 10.47389 1.000 15.80216 C ? B ? 62 CH2 1
   ATOM 2212 N . ASP B 90 ? 33.77671 -15.08518 15.91979 1.000 13.59107 N ? B ? 63 N 1
   ATOM 2213 CA . ASP B 90 ? 33.79723 -15.19157 17.40744 1.000 15.44232 C ? B ? 63 CA 1
   ATOM 2214 C . ASP B 90 ? 34.00080 -16.62586 17.88873 1.000 20.16801 C ? B ? 63 C 1
   ATOM 2215 O . ASP B 90 ? 34.48595 -16.81865 19.00457 1.000 16.46691 O ? B ? 63 O 1
   ATOM 2216 CB . ASP B 90 ? 32.49854 -14.63122 18.03246 1.000 12.91319 C ? B ? 63 CB 1
   ATOM 2217 CG . ASP B 90 ? 32.57274 -13.11752 18.31101 1.000 15.33886 C ? B ? 63 CG 1
   ATOM 2218 OD1 . ASP B 90 ? 33.69237 -12.54767 18.20999 1.000 16.21058 O ? B ? 63 OD1 1
   ATOM 2219 OD2 . ASP B 90 ? 31.49887 -12.58006 18.67142 1.000 17.92689 O ? B ? 63 OD2 1
   ATOM 2220 N . GLU B 91 ? 33.48592 -17.60651 17.14992 1.000 15.57891 N ? B ? 64 N 1
   ATOM 2221 CA . GLU B 91 ? 33.65893 -19.00959 17.48907 1.000 17.11253 C ? B ? 64 CA 1
   ATOM 2222 C . GLU B 91 ? 34.96993 -19.58334 17.02242 1.000 15.93189 C ? B ? 64 C 1
   ATOM 2223 O . GLU B 91 ? 35.58343 -20.40664 17.72722 1.000 17.32515 O ? B ? 64 O 1
   ATOM 2224 CB . GLU B 91 ? 32.51223 -19.80960 16.87847 1.000 17.22485 C ? B ? 64 CB 1
   ATOM 2225 CG . GLU B 91 ? 31.14551 -19.39256 17.45812 1.000 16.39888 C ? B ? 64 CG 1
   ATOM 2226 CD . GLU B 91 ? 29.96260 -19.53158 16.47908 1.000 24.72510 C ? B ? 64 CD 1
   ATOM 2227 OE1 . GLU B 91 ? 28.83154 -19.33290 16.96227 1.000 30.18895 O ? B ? 64 OE1 1
   ATOM 2228 OE2 . GLU B 91 ? 30.13219 -19.82174 15.25988 1.000 28.13842 O ? B ? 64 OE2 1
   ATOM 2229 N . GLY B 92 ? 35.41321 -19.19493 15.84087 1.000 14.31795 N ? B ? 65 N 1
   ATOM 2230 CA . GLY B 92 ? 36.58901 -19.81795 15.25677 1.000 16.53767 C ? B ? 65 CA 1
   ATOM 2231 C . GLY B 92 ? 37.93491 -19.29247 15.75055 1.000 16.15499 C ? B ? 65 C 1
   ATOM 2232 O . GLY B 92 ? 38.88945 -20.08046 15.93646 1.000 16.22787 O ? B ? 65 O 1
   ATOM 2233 N . VAL B 93 ? 38.00518 -17.96680 15.97247 1.000 14.46055 N ? B ? 66 N 1
   ATOM 2234 CA . VAL B 93 ? 39.27601 -17.34143 16.34636 1.000 13.20314 C ? B ? 66 CA 1
   ATOM 2235 C . VAL B 93 ? 39.78767 -17.87267 17.67555 1.000 15.93415 C ? B ? 66 C 1
   ATOM 2236 O . VAL B 93 ? 41.00147 -18.11328 17.79021 1.000 16.99924 O ? B ? 66 O 1
   ATOM 2237 CB . VAL B 93 ? 39.14793 -15.80980 16.28846 1.000 14.43374 C ? B ? 66 CB 1
   ATOM 2238 CG1 . VAL B 93 ? 40.38283 -15.12913 16.98068 1.000 17.64860 C ? B ? 66 CG1 1
   ATOM 2239 CG2 . VAL B 93 ? 39.11410 -15.43301 14.75681 1.000 13.44399 C ? B ? 66 CG2 1
   ATOM 2240 N . PRO B 94 ? 38.96099 -18.02223 18.72971 1.000 16.76995 N ? B ? 67 N 1
   ATOM 2241 CA . PRO B 94 ? 39.46887 -18.55203 20.00936 1.000 16.88592 C ? B ? 67 CA 1
   ATOM 2242 C . PRO B 94 ? 40.04011 -19.96226 19.88839 1.000 19.22124 C ? B ? 67 C 1
   ATOM 2243 O . PRO B 94 ? 40.75257 -20.39179 20.81377 1.000 20.66985 O ? B ? 67 O 1
   ATOM 2244 CB . PRO B 94 ? 38.23645 -18.51888 20.92959 1.000 16.94863 C ? B ? 67 CB 1
   ATOM 2245 CG . PRO B 94 ? 37.37786 -17.41180 20.30107 1.000 20.34441 C ? B ? 67 CG 1
   ATOM 2246 CD . PRO B 94 ? 37.55800 -17.58513 18.85550 1.000 16.24491 C ? B ? 67 CD 1
   ATOM 2247 N . GLN B 95 ? 39.78063 -20.68398 18.79047 1.000 17.47846 N ? B ? 68 N 1
   ATOM 2248 CA . GLN B 95 ? 40.46355 -21.97529 18.60897 1.000 17.92590 C ? B ? 68 CA 1
   ATOM 2249 C . GLN B 95 ? 41.81594 -21.89628 17.89709 1.000 23.79716 C ? B ? 68 C 1
   ATOM 2250 O . GLN B 95 ? 42.48691 -22.93844 17.72006 1.000 22.43825 O ? B ? 68 O 1
   ATOM 2251 CB . GLN B 95 ? 39.52414 -22.90996 17.83493 1.000 17.29907 C ? B ? 68 CB 1
   ATOM 2252 CG . GLN B 95 ? 38.17661 -23.10967 18.59310 1.000 20.10864 C ? B ? 68 CG 1
   ATOM 2253 CD . GLN B 95 ? 38.39214 -23.77125 19.97391 1.000 22.85610 C ? B ? 68 CD 1
   ATOM 2254 OE1 . GLN B 95 ? 39.35693 -24.51500 20.20424 1.000 23.34104 O ? B ? 68 OE1 1
   ATOM 2255 NE2 . GLN B 95 ? 37.48569 -23.51158 20.86242 1.000 23.70951 N ? B ? 68 NE2 1
   ATOM 2256 N . MET B 96 ? 42.24855 -20.71795 17.47797 1.000 16.43142 N ? B ? 69 N 1
   ATOM 2257 CA . MET B 96 ? 43.57816 -20.51368 16.88156 1.000 13.20529 C ? B ? 69 CA 1
   ATOM 2258 C . MET B 96 ? 44.62516 -20.18993 17.93601 1.000 17.70165 C ? B ? 69 C 1
   ATOM 2259 O . MET B 96 ? 44.34124 -19.45116 18.86279 1.000 19.87264 O ? B ? 69 O 1
   ATOM 2260 CB . MET B 96 ? 43.50666 -19.33799 15.91897 1.000 16.69784 C ? B ? 69 CB 1
   ATOM 2261 CG . MET B 96 ? 42.44335 -19.61414 14.81882 1.000 18.66317 C ? B ? 69 CG 1
   ATOM 2262 SD . MET B 96 ? 42.41129 -18.26019 13.58835 1.000 19.77060 S ? B ? 69 SD 1
   ATOM 2263 CE . MET B 96 ? 44.03443 -18.48276 12.78324 1.000 18.42747 C ? B ? 69 CE 1
   ATOM 2264 N . SER B 97 ? 45.84893 -20.70300 17.77797 1.000 19.24265 N ? B ? 70 N 1
   ATOM 2265 CA . SER B 97 ? 46.92209 -20.25411 18.67472 1.000 21.18126 C ? B ? 70 CA 1
   ATOM 2266 C . SER B 97 ? 47.74556 -19.15882 17.96588 1.000 18.43039 C ? B ? 70 C 1
   ATOM 2267 O . SER B 97 ? 47.71280 -18.99781 16.75431 1.000 18.53241 O ? B ? 70 O 1
   ATOM 2268 CB . SER B 97 ? 47.81219 -21.45137 19.13705 1.000 20.29618 C ? B ? 70 CB 1
   ATOM 2269 OG . SER B 97 ? 48.63586 -21.92126 18.08673 1.000 22.45735 O ? B ? 70 OG 1
   ATOM 2270 N . LEU B 98 ? 48.46868 -18.37044 18.75763 1.000 18.84445 N ? B ? 71 N 1
   ATOM 2271 CA . LEU B 98 ? 49.23341 -17.22579 18.21369 1.000 17.14703 C ? B ? 71 CA 1
   ATOM 2272 C . LEU B 98 ? 50.16340 -17.60361 17.06859 1.000 23.12010 C ? B ? 71 C 1
   ATOM 2273 O . LEU B 98 ? 51.02478 -18.48428 17.18301 1.000 23.67086 O ? B ? 71 O 1
   ATOM 2274 CB . LEU B 98 ? 50.03817 -16.61147 19.37413 1.000 22.32739 C ? B ? 71 CB 1
   ATOM 2275 CG . LEU B 98 ? 50.97074 -15.43421 19.04626 1.000 23.03802 C ? B ? 71 CG 1
   ATOM 2276 CD1 . LEU B 98 ? 50.06552 -14.22699 18.58060 1.000 20.06941 C ? B ? 71 CD1 1
   ATOM 2277 CD2 . LEU B 98 ? 51.67982 -15.08497 20.37175 1.000 31.24801 C ? B ? 71 CD2 1
   ATOM 2278 N . GLY B 99 ? 50.00037 -16.93402 15.95004 1.000 16.59161 N ? B ? 72 N 1
   ATOM 2279 CA . GLY B 99 ? 50.85162 -17.14439 14.79022 1.000 21.00529 C ? B ? 72 CA 1
   ATOM 2280 C . GLY B 99 ? 50.22608 -18.06081 13.76374 1.000 22.13069 C ? B ? 72 C 1
   ATOM 2281 O . GLY B 99 ? 50.73228 -18.16482 12.64737 1.000 22.34087 O ? B ? 72 O 1
   ATOM 2282 N . GLU B 100 ? 49.08995 -18.65892 14.10926 1.000 18.89668 N ? B ? 73 N 1
   ATOM 2283 CA . GLU B 100 ? 48.47486 -19.66705 13.26426 1.000 19.62849 C ? B ? 73 CA 1
   ATOM 2284 C . GLU B 100 ? 47.95128 -19.04712 11.97535 1.000 19.31205 C ? B ? 73 C 1
   ATOM 2285 O . GLU B 100 ? 47.37328 -17.95927 11.98776 1.000 17.90548 O ? B ? 73 O 1
   ATOM 2286 CB . GLU B 100 ? 47.30549 -20.32576 14.00063 1.000 18.88604 C ? B ? 73 CB 1
   ATOM 2287 CG . GLU B 100 ? 46.55560 -21.35386 13.17109 1.000 21.41230 C ? B ? 73 CG 1
   ATOM 2288 CD . GLU B 100 ? 45.51442 -22.09860 14.00524 1.000 19.74740 C ? B ? 73 CD 1
   ATOM 2289 OE1 . GLU B 100 ? 45.82367 -22.42735 15.16900 1.000 20.82602 O ? B ? 73 OE1 1
   ATOM 2290 OE2 . GLU B 100 ? 44.37857 -22.29646 13.54236 1.000 19.98938 O ? B ? 73 OE2 1
   ATOM 2291 N . LYS B 101 ? 48.04719 -19.80675 10.89920 1.000 19.63532 N ? B ? 74 N 1
   ATOM 2292 CA . LYS B 101 ? 47.30012 -19.51690 9.67612 1.000 17.27001 C ? B ? 74 CA 1
   ATOM 2293 C . LYS B 101 ? 46.27118 -20.61538 9.46634 1.000 18.67702 C ? B ? 74 C 1
   ATOM 2294 O . LYS B 101 ? 46.62406 -21.80239 9.52427 1.000 17.44141 O ? B ? 74 O 1
   ATOM 2295 CB . LYS B 101 ? 48.20983 -19.48183 8.44289 1.000 22.09072 C ? B ? 74 CB 1
   ATOM 2296 CG . LYS B 101 ? 49.25380 -18.33111 8.42262 1.000 22.06791 C ? B ? 74 CG 1
   ATOM 2297 CD . LYS B 101 ? 50.11774 -18.47959 7.17071 1.000 26.69545 C ? B ? 74 CD 1
   ATOM 2298 CE . LYS B 101 ? 51.09140 -17.29749 7.03018 1.000 48.91338 C ? B ? 74 CE 1
   ATOM 2299 NZ . LYS B 101 ? 52.25237 -17.67203 6.17700 1.000 54.64923 N ? B ? 74 NZ 1
   ATOM 2300 N . ALA B 102 ? 45.04725 -20.22833 9.09885 1.000 15.28722 N ? B ? 75 N 1
   ATOM 2301 CA . ALA B 102 ? 43.97708 -21.22755 8.96800 1.000 16.21560 C ? B ? 75 CA 1
   ATOM 2302 C . ALA B 102 ? 42.97167 -20.74021 7.96070 1.000 21.15516 C ? B ? 75 C 1
   ATOM 2303 O . ALA B 102 ? 43.04296 -19.59457 7.50807 1.000 17.33831 O ? B ? 75 O 1
   ATOM 2304 CB . ALA B 102 ? 43.29673 -21.48830 10.34024 1.000 16.16845 C ? B ? 75 CB 1
   ATOM 2305 N . VAL B 103 ? 42.10730 -21.65240 7.49191 1.000 14.70311 N ? B ? 76 N 1
   ATOM 2306 CA . VAL B 103 ? 40.98445 -21.26410 6.64001 1.000 12.78295 C ? B ? 76 CA 1
   ATOM 2307 C . VAL B 103 ? 39.70393 -21.52842 7.41805 1.000 16.74823 C ? B ? 76 C 1
   ATOM 2308 O . VAL B 103 ? 39.49065 -22.63574 7.92097 1.000 19.11314 O ? B ? 76 O 1
   ATOM 2309 CB . VAL B 103 ? 40.96707 -22.03540 5.29862 1.000 19.38758 C ? B ? 76 CB 1
   ATOM 2310 CG1 . VAL B 103 ? 39.72498 -21.66454 4.49702 1.000 19.92513 C ? B ? 76 CG1 1
   ATOM 2311 CG2 . VAL B 103 ? 42.23967 -21.72453 4.54280 1.000 23.14680 C ? B ? 76 CG2 1
   ATOM 2312 N . LEU B 104 ? 38.88353 -20.49927 7.55345 1.000 15.23460 N ? B ? 77 N 1
   ATOM 2313 CA . LEU B 104 ? 37.60594 -20.61357 8.23854 1.000 14.91687 C ? B ? 77 CA 1
   ATOM 2314 C . LEU B 104 ? 36.49560 -20.58196 7.23127 1.000 18.11637 C ? B ? 77 C 1
   ATOM 2315 O . LEU B 104 ? 36.37511 -19.59392 6.47644 1.000 20.40529 O ? B ? 77 O 1
   ATOM 2316 CB . LEU B 104 ? 37.45621 -19.42723 9.20596 1.000 21.79639 C ? B ? 77 CB 1
   ATOM 2317 CG . LEU B 104 ? 37.74028 -19.34140 10.67629 1.000 37.98815 C ? B ? 77 CG 1
   ATOM 2318 CD1 . LEU B 104 ? 37.17266 -17.93173 11.15969 1.000 21.86471 C ? B ? 77 CD1 1
   ATOM 2319 CD2 . LEU B 104 ? 37.04044 -20.51485 11.39790 1.000 26.34492 C ? B ? 77 CD2 1
   ATOM 2320 N . THR B 105 ? 35.68857 -21.65525 7.18403 1.000 12.22254 N ? B ? 78 N 1
   ATOM 2321 CA . THR B 105 ? 34.54577 -21.70006 6.28745 1.000 14.07757 C ? B ? 78 CA 1
   ATOM 2322 C . THR B 105 ? 33.28420 -21.53162 7.12747 1.000 16.78189 C ? B ? 78 C 1
   ATOM 2323 O . THR B 105 ? 33.12707 -22.20582 8.14549 1.000 18.61111 O ? B ? 78 O 1
   ATOM 2324 CB . THR B 105 ? 34.51997 -23.03772 5.51157 1.000 16.76442 C ? B ? 78 CB 1
   ATOM 2325 OG1 . THR B 105 ? 35.77949 -23.21431 4.82065 1.000 22.17959 O ? B ? 78 OG1 1
   ATOM 2326 CG2 . THR B 105 ? 33.35767 -23.02673 4.50957 1.000 18.71808 C ? B ? 78 CG2 1
   ATOM 2327 N . ILE B 106 ? 32.45907 -20.56638 6.74877 1.000 13.89036 N ? B ? 79 N 1
   ATOM 2328 CA . ILE B 106 ? 31.33515 -20.10422 7.58518 1.000 15.04140 C ? B ? 79 CA 1
   ATOM 2329 C . ILE B 106 ? 30.07234 -20.10716 6.75101 1.000 14.72806 C ? B ? 79 C 1
   ATOM 2330 O . ILE B 106 ? 29.92127 -19.31661 5.79858 1.000 16.59973 O ? B ? 79 O 1
   ATOM 2331 CB . ILE B 106 ? 31.64965 -18.69986 8.13508 1.000 16.29783 C ? B ? 79 CB 1
   ATOM 2332 CG1 . ILE B 106 ? 32.90620 -18.77174 9.01268 1.000 12.96959 C ? B ? 79 CG1 1
   ATOM 2333 CG2 . ILE B 106 ? 30.41478 -18.08473 8.95900 1.000 15.50800 C ? B ? 79 CG2 1
   ATOM 2334 CD1 . ILE B 106 ? 33.39404 -17.33011 9.38446 1.000 16.10303 C ? B ? 79 CD1 1
   ATOM 2335 N . THR B 107 ? 29.11025 -20.96260 7.13337 1.000 13.92008 N ? B ? 80 N 1
   ATOM 2336 CA . THR B 107 ? 27.85940 -20.90288 6.38858 1.000 14.61886 C ? B ? 80 CA 1
   ATOM 2337 C . THR B 107 ? 27.05193 -19.66760 6.81175 1.000 19.88003 C ? B ? 80 C 1
   ATOM 2338 O . THR B 107 ? 27.33495 -19.05215 7.83370 1.000 17.93770 O ? B ? 80 O 1
   ATOM 2339 CB . THR B 107 ? 27.07231 -22.21609 6.58522 1.000 15.33311 C ? B ? 80 CB 1
   ATOM 2340 OG1 . THR B 107 ? 26.78185 -22.39305 7.97613 1.000 19.07940 O ? B ? 80 OG1 1
   ATOM 2341 CG2 . THR B 107 ? 27.94688 -23.40390 6.09009 1.000 16.07822 C ? B ? 80 CG2 1
   ATOM 2342 N . PRO B 108 ? 26.09415 -19.24601 6.00739 1.000 17.07379 N ? B ? 81 N 1
   ATOM 2343 CA . PRO B 108 ? 25.46982 -17.92317 6.22855 1.000 16.54695 C ? B ? 81 CA 1
   ATOM 2344 C . PRO B 108 ? 24.76230 -17.79211 7.56461 1.000 17.89748 C ? B ? 81 C 1
   ATOM 2345 O . PRO B 108 ? 24.73329 -16.66082 8.08296 1.000 18.77091 O ? B ? 81 O 1
   ATOM 2346 CB . PRO B 108 ? 24.47654 -17.76996 5.05779 1.000 17.64772 C ? B ? 81 CB 1
   ATOM 2347 CG . PRO B 108 ? 24.52354 -19.09348 4.28804 1.000 20.69284 C ? B ? 81 CG 1
   ATOM 2348 CD . PRO B 108 ? 25.67029 -19.89939 4.72321 1.000 18.17674 C ? B ? 81 CD 1
   ATOM 2349 N . ASP B 109 ? 24.28631 -18.91553 8.17700 1.000 17.57645 N ? B ? 82 N 1
   ATOM 2350 CA . ASP B 109 ? 23.65987 -18.76020 9.48702 1.000 19.12285 C ? B ? 82 CA 1
   ATOM 2351 C . ASP B 109 ? 24.67725 -18.37340 10.55118 1.000 20.88028 C ? B ? 82 C 1
   ATOM 2352 O . ASP B 109 ? 24.28235 -17.94306 11.64673 1.000 23.50362 O ? B ? 82 O 1
   ATOM 2353 CB . ASP B 109 ? 22.88181 -20.03497 9.87331 1.000 18.79026 C ? B ? 82 CB 1
   ATOM 2354 CG . ASP B 109 ? 23.63426 -21.36973 9.53685 1.000 34.46861 C ? B ? 82 CG 1
   ATOM 2355 OD1 . ASP B 109 ? 24.47941 -21.44297 8.62601 1.000 29.37529 O ? B ? 82 OD1 1
   ATOM 2356 OD2 . ASP B 109 ? 23.31087 -22.41270 10.14180 1.000 35.88340 O ? B ? 82 OD2 1
   ATOM 2357 N . TYR B 110 ? 25.98080 -18.45573 10.25586 1.000 15.10018 N ? B ? 83 N 1
   ATOM 2358 CA . TYR B 110 ? 26.99489 -18.00292 11.18399 1.000 15.91033 C ? B ? 83 CA 1
   ATOM 2359 C . TYR B 110 ? 27.72423 -16.79228 10.61598 1.000 15.25727 C ? B ? 83 C 1
   ATOM 2360 O . TYR B 110 ? 28.75777 -16.36374 11.14771 1.000 15.83992 O ? B ? 83 O 1
   ATOM 2361 CB . TYR B 110 ? 28.00309 -19.14790 11.46717 1.000 17.85327 C ? B ? 83 CB 1
   ATOM 2362 CG . TYR B 110 ? 27.35879 -20.31282 12.15434 1.000 15.54908 C ? B ? 83 CG 1
   ATOM 2363 CD1 . TYR B 110 ? 26.75039 -21.32173 11.41101 1.000 18.35000 C ? B ? 83 CD1 1
   ATOM 2364 CD2 . TYR B 110 ? 27.40304 -20.43587 13.52257 1.000 19.85130 C ? B ? 83 CD2 1
   ATOM 2365 CE1 . TYR B 110 ? 26.14595 -22.45751 12.07037 1.000 23.48509 C ? B ? 83 CE1 1
   ATOM 2366 CE2 . TYR B 110 ? 26.80482 -21.56413 14.16455 1.000 17.70091 C ? B ? 83 CE2 1
   ATOM 2367 CZ . TYR B 110 ? 26.18622 -22.52975 13.40741 1.000 22.23255 C ? B ? 83 CZ 1
   ATOM 2368 OH . TYR B 110 ? 25.61251 -23.61334 14.09316 1.000 29.22108 O ? B ? 83 OH 1
   ATOM 2369 N . GLY B 111 ? 27.19636 -16.22706 9.51106 1.000 15.10451 N ? B ? 84 N 1
   ATOM 2370 CA . GLY B 111 ? 27.77146 -15.09043 8.81603 1.000 16.08988 C ? B ? 84 CA 1
   ATOM 2371 C . GLY B 111 ? 26.74106 -13.97117 8.70510 1.000 13.10408 C ? B ? 84 C 1
   ATOM 2372 O . GLY B 111 ? 26.29727 -13.39739 9.73241 1.000 15.47798 O ? B ? 84 O 1
   ATOM 2373 N . TYR B 112 ? 26.39708 -13.60400 7.45104 1.000 15.56918 N ? B ? 85 N 1
   ATOM 2374 CA . TYR B 112 ? 25.51071 -12.49182 7.21576 1.000 16.21640 C ? B ? 85 CA 1
   ATOM 2375 C . TYR B 112 ? 24.08466 -12.94039 6.84215 1.000 18.01457 C ? B ? 85 C 1
   ATOM 2376 O . TYR B 112 ? 23.23618 -12.07043 6.56713 1.000 17.00939 O ? B ? 85 O 1
   ATOM 2377 CB . TYR B 112 ? 26.07668 -11.57431 6.11388 1.000 12.19124 C ? B ? 85 CB 1
   ATOM 2378 CG . TYR B 112 ? 27.36541 -10.89266 6.56571 1.000 14.57196 C ? B ? 85 CG 1
   ATOM 2379 CD1 . TYR B 112 ? 27.28445 -9.84448 7.50197 1.000 17.50192 C ? B ? 85 CD1 1
   ATOM 2380 CD2 . TYR B 112 ? 28.62317 -11.32306 6.11584 1.000 15.57680 C ? B ? 85 CD2 1
   ATOM 2381 CE1 . TYR B 112 ? 28.42000 -9.20741 7.93256 1.000 17.89980 C ? B ? 85 CE1 1
   ATOM 2382 CE2 . TYR B 112 ? 29.80436 -10.66699 6.53816 1.000 18.95583 C ? B ? 85 CE2 1
   ATOM 2383 CZ . TYR B 112 ? 29.66263 -9.63939 7.47189 1.000 15.17408 C ? B ? 85 CZ 1
   ATOM 2384 OH . TYR B 112 ? 30.79457 -9.01706 7.88628 1.000 17.10629 O ? B ? 85 OH 1
   ATOM 2385 N . GLY B 113 ? 23.81459 -14.26537 6.87238 1.000 16.50190 N ? B ? 86 N 1
   ATOM 2386 CA . GLY B 113 ? 22.40506 -14.73971 6.88736 1.000 16.98431 C ? B ? 86 CA 1
   ATOM 2387 C . GLY B 113 ? 21.75153 -14.38683 5.55489 1.000 21.44658 C ? B ? 86 C 1
   ATOM 2388 O . GLY B 113 ? 22.39573 -14.20352 4.56340 1.000 20.86207 O ? B ? 86 O 1
   ATOM 2389 N A ALA B 114 ? 20.41795 -14.29066 5.57728 0.281 21.69397 N ? B ? 87 N 1
   ATOM 2390 CA A ALA B 114 ? 19.68578 -14.03040 4.33275 0.281 21.98385 C ? B ? 87 CA 1
   ATOM 2391 C A ALA B 114 ? 19.90134 -12.61095 3.81173 0.281 26.13093 C ? B ? 87 C 1
   ATOM 2392 O A ALA B 114 ? 19.80065 -12.37699 2.60452 0.281 23.19797 O ? B ? 87 O 1
   ATOM 2393 CB A ALA B 114 ? 18.18938 -14.29214 4.53299 0.281 25.38620 C ? B ? 87 CB 1
   ATOM 2394 N B ALA B 114 ? 20.41331 -14.32763 5.56656 0.719 21.55831 N ? B ? 87 N 1
   ATOM 2395 CA B ALA B 114 ? 19.70177 -14.03477 4.30718 0.719 21.85987 C ? B ? 87 CA 1
   ATOM 2396 C B ALA B 114 ? 19.92183 -12.60151 3.80842 0.719 26.09316 C ? B ? 87 C 1
   ATOM 2397 O B ALA B 114 ? 19.81758 -12.34486 2.60662 0.719 23.34370 O ? B ? 87 O 1
   ATOM 2398 CB B ALA B 114 ? 18.19682 -14.30498 4.46789 0.719 25.32501 C ? B ? 87 CB 1
   ATOM 2399 N . ARG B 115 ? 20.17437 -11.65565 4.69533 1.000 22.87182 N ? B ? 88 N 1
   ATOM 2400 CA . ARG B 115 ? 20.34576 -10.26477 4.28230 1.000 27.69660 C ? B ? 88 CA 1
   ATOM 2401 C . ARG B 115 ? 21.64124 -10.06197 3.47592 1.000 23.12147 C ? B ? 88 C 1
   ATOM 2402 O . ARG B 115 ? 21.65636 -9.34192 2.46653 1.000 27.74856 O ? B ? 88 O 1
   ATOM 2403 CB . ARG B 115 ? 20.31710 -9.39921 5.55496 1.000 28.47604 C ? B ? 88 CB 1
   ATOM 2404 CG . ARG B 115 ? 20.96231 -7.99898 5.47928 1.000 43.37338 C ? B ? 88 CG 1
   ATOM 2405 CD . ARG B 115 ? 20.08447 -6.86865 4.96267 1.000 47.83745 C ? B ? 88 CD 1
   ATOM 2406 NE . ARG B 115 ? 18.88381 -6.73051 5.78095 1.000 45.08271 N ? B ? 88 NE 1
   ATOM 2407 CZ . ARG B 115 ? 17.83026 -6.00582 5.43692 1.000 51.32643 C ? B ? 88 CZ 1
   ATOM 2408 NH1 . ARG B 115 ? 17.83793 -5.26536 4.33927 1.000 46.03998 N ? B ? 88 NH1 1
   ATOM 2409 NH2 . ARG B 115 ? 16.74825 -6.02272 6.21515 1.000 63.96046 N ? B ? 88 NH2 1
   ATOM 2410 N . GLY B 116 ? 22.72310 -10.79917 3.82561 1.000 19.21406 N ? B ? 89 N 1
   ATOM 2411 CA . GLY B 116 ? 24.03584 -10.51499 3.33057 1.000 20.00884 C ? B ? 89 CA 1
   ATOM 2412 C . GLY B 116 ? 24.52450 -9.15202 3.83255 1.000 16.76388 C ? B ? 89 C 1
   ATOM 2413 O . GLY B 116 ? 24.12210 -8.67968 4.88404 1.000 20.77082 O ? B ? 89 O 1
   ATOM 2414 N . PHE B 117 ? 25.51240 -8.62288 3.11143 1.000 16.18947 N ? B ? 90 N 1
   ATOM 2415 CA . PHE B 117 ? 26.09047 -7.33813 3.51296 1.000 18.50749 C ? B ? 90 CA 1
   ATOM 2416 C . PHE B 117 ? 25.96056 -6.43706 2.30189 1.000 20.29298 C ? B ? 90 C 1
   ATOM 2417 O . PHE B 117 ? 26.55144 -6.75080 1.26093 1.000 19.65854 O ? B ? 90 O 1
   ATOM 2418 CB . PHE B 117 ? 27.55786 -7.45831 3.94038 1.000 16.59051 C ? B ? 90 CB 1
   ATOM 2419 CG . PHE B 117 ? 28.07195 -6.16743 4.56145 1.000 19.25679 C ? B ? 90 CG 1
   ATOM 2420 CD1 . PHE B 117 ? 28.56368 -5.14578 3.75319 1.000 29.96237 C ? B ? 90 CD1 1
   ATOM 2421 CD2 . PHE B 117 ? 27.94672 -6.01651 5.93208 1.000 25.75939 C ? B ? 90 CD2 1
   ATOM 2422 CE1 . PHE B 117 ? 28.99059 -3.91393 4.37788 1.000 24.82400 C ? B ? 90 CE1 1
   ATOM 2423 CE2 . PHE B 117 ? 28.35166 -4.84331 6.53573 1.000 29.71733 C ? B ? 90 CE2 1
   ATOM 2424 CZ . PHE B 117 ? 28.85750 -3.84858 5.76930 1.000 20.64047 C ? B ? 90 CZ 1
   ATOM 2425 N . PRO B 118 ? 25.27047 -5.30187 2.42245 1.000 19.94108 N ? B ? 91 N 1
   ATOM 2426 CA . PRO B 118 ? 24.98443 -4.45925 1.24668 1.000 22.24659 C ? B ? 91 CA 1
   ATOM 2427 C . PRO B 118 ? 26.22062 -4.09006 0.47171 1.000 21.30510 C ? B ? 91 C 1
   ATOM 2428 O . PRO B 118 ? 27.24641 -3.63882 1.01936 1.000 26.03531 O ? B ? 91 O 1
   ATOM 2429 CB . PRO B 118 ? 24.33060 -3.19365 1.85769 1.000 25.52236 C ? B ? 91 CB 1
   ATOM 2430 CG . PRO B 118 ? 23.58013 -3.66896 3.02438 1.000 21.82670 C ? B ? 91 CG 1
   ATOM 2431 CD . PRO B 118 ? 24.56570 -4.77656 3.59335 1.000 21.64241 C ? B ? 91 CD 1
   ATOM 2432 N . GLY B 119 ? 26.12683 -4.33270 -0.78671 1.000 23.91496 N ? B ? 92 N 1
   ATOM 2433 CA . GLY B 119 ? 27.19377 -4.00720 -1.72612 1.000 31.33830 C ? B ? 92 CA 1
   ATOM 2434 C . GLY B 119 ? 28.36868 -4.95245 -1.73282 1.000 30.12091 C ? B ? 92 C 1
   ATOM 2435 O . GLY B 119 ? 29.29568 -4.75440 -2.52721 1.000 29.59947 O ? B ? 92 O 1
   ATOM 2436 N . VAL B 120 ? 28.38719 -5.98058 -0.87450 1.000 21.72026 N ? B ? 93 N 1
   ATOM 2437 CA . VAL B 120 ? 29.61509 -6.76651 -0.75930 1.000 17.99178 C ? B ? 93 CA 1
   ATOM 2438 C . VAL B 120 ? 29.31975 -8.27394 -0.75861 1.000 20.33508 C ? B ? 93 C 1
   ATOM 2439 O . VAL B 120 ? 30.02581 -9.05581 -1.40502 1.000 25.34564 O ? B ? 93 O 1
   ATOM 2440 CB . VAL B 120 ? 30.40395 -6.39195 0.52546 1.000 21.85284 C ? B ? 93 CB 1
   ATOM 2441 CG1 . VAL B 120 ? 31.77509 -7.12980 0.55769 1.000 25.56619 C ? B ? 93 CG1 1
   ATOM 2442 CG2 . VAL B 120 ? 30.63204 -4.81483 0.63891 1.000 29.47799 C ? B ? 93 CG2 1
   ATOM 2443 N . ILE B 121 ? 28.37139 -8.70407 0.05638 1.000 18.68700 N ? B ? 94 N 1
   ATOM 2444 CA . ILE B 121 ? 28.15723 -10.12725 0.29336 1.000 19.55326 C ? B ? 94 CA 1
   ATOM 2445 C . ILE B 121 ? 26.71834 -10.47677 -0.06491 1.000 23.02617 C ? B ? 94 C 1
   ATOM 2446 O . ILE B 121 ? 25.77744 -10.00051 0.56550 1.000 18.70649 O ? B ? 94 O 1
   ATOM 2447 CB . ILE B 121 ? 28.45544 -10.49316 1.75818 1.000 17.69107 C ? B ? 94 CB 1
   ATOM 2448 CG1 . ILE B 121 ? 29.98462 -10.41097 1.91710 1.000 24.90810 C ? B ? 94 CG1 1
   ATOM 2449 CG2 . ILE B 121 ? 28.02247 -11.96500 2.01087 1.000 19.49907 C ? B ? 94 CG2 1
   ATOM 2450 CD1 . ILE B 121 ? 30.42685 -10.68279 3.26542 1.000 32.24846 C ? B ? 94 CD1 1
   ATOM 2451 N . PRO B 122 ? 26.47480 -11.37031 -1.00442 1.000 22.62534 N ? B ? 95 N 1
   ATOM 2452 CA . PRO B 122 ? 25.07995 -11.67873 -1.32963 1.000 25.13275 C ? B ? 95 CA 1
   ATOM 2453 C . PRO B 122 ? 24.34834 -12.37186 -0.16345 1.000 20.45682 C ? B ? 95 C 1
   ATOM 2454 O . PRO B 122 ? 24.96109 -12.99774 0.72360 1.000 18.66001 O ? B ? 95 O 1
   ATOM 2455 CB . PRO B 122 ? 25.20290 -12.58913 -2.56620 1.000 22.43171 C ? B ? 95 CB 1
   ATOM 2456 CG . PRO B 122 ? 26.54936 -12.34292 -3.16911 1.000 20.73980 C ? B ? 95 CG 1
   ATOM 2457 CD . PRO B 122 ? 27.47409 -11.93252 -1.95021 1.000 19.97348 C ? B ? 95 CD 1
   ATOM 2458 N . GLY B 123 ? 23.01439 -12.25876 -0.14631 1.000 19.98216 N ? B ? 96 N 1
   ATOM 2459 CA . GLY B 123 ? 22.24640 -13.05535 0.81827 1.000 21.32888 C ? B ? 96 CA 1
   ATOM 2460 C . GLY B 123 ? 22.57053 -14.52583 0.65687 1.000 25.10750 C ? B ? 96 C 1
   ATOM 2461 O . GLY B 123 ? 22.93024 -14.97436 -0.42520 1.000 20.32027 O ? B ? 96 O 1
   ATOM 2462 N . ASN B 124 ? 22.53286 -15.23429 1.77205 1.000 19.83750 N ? B ? 97 N 1
   ATOM 2463 CA . ASN B 124 ? 22.73983 -16.68797 1.87209 1.000 22.24970 C ? B ? 97 CA 1
   ATOM 2464 C . ASN B 124 ? 24.08678 -17.16047 1.33797 1.000 25.02599 C ? B ? 97 C 1
   ATOM 2465 O . ASN B 124 ? 24.19080 -18.22013 0.69195 1.000 22.00532 O ? B ? 97 O 1
   ATOM 2466 CB . ASN B 124 ? 21.54582 -17.37821 1.19346 1.000 25.03864 C ? B ? 97 CB 1
   ATOM 2467 CG . ASN B 124 ? 20.28271 -17.16599 2.04796 1.000 41.43426 C ? B ? 97 CG 1
   ATOM 2468 OD1 . ASN B 124 ? 20.32560 -17.21337 3.30799 1.000 35.33567 O ? B ? 97 OD1 1
   ATOM 2469 ND2 . ASN B 124 ? 19.18246 -16.85224 1.38109 1.000 76.42482 N ? B ? 97 ND2 1
   ATOM 2470 N . SER B 125 ? 25.17012 -16.41880 1.66554 1.000 16.56380 N ? B ? 98 N 1
   ATOM 2471 CA . SER B 125 ? 26.50789 -16.77233 1.20226 1.000 16.84450 C ? B ? 98 CA 1
   ATOM 2472 C . SER B 125 ? 27.32880 -17.50862 2.24644 1.000 15.93257 C ? B ? 98 C 1
   ATOM 2473 O . SER B 125 ? 27.50388 -16.99898 3.35022 1.000 18.46705 O ? B ? 98 O 1
   ATOM 2474 CB . SER B 125 ? 27.34173 -15.53458 0.82311 1.000 21.00585 C ? B ? 98 CB 1
   ATOM 2475 OG . SER B 125 ? 26.76475 -14.83346 -0.28335 1.000 19.77796 O ? B ? 98 OG 1
   ATOM 2476 N . THR B 126 ? 27.92320 -18.61908 1.85509 1.000 14.81202 N ? B ? 99 N 1
   ATOM 2477 CA . THR B 126 ? 28.98950 -19.21742 2.63998 1.000 15.80607 C ? B ? 99 CA 1
   ATOM 2478 C . THR B 126 ? 30.26509 -18.40959 2.41265 1.000 18.01341 C ? B ? 99 C 1
   ATOM 2479 O . THR B 126 ? 30.54474 -17.93858 1.27543 1.000 17.35733 O ? B ? 99 O 1
   ATOM 2480 CB . THR B 126 ? 29.20019 -20.67912 2.22297 1.000 19.51508 C ? B ? 99 CB 1
   ATOM 2481 OG1 . THR B 126 ? 28.01772 -21.40635 2.62536 1.000 18.22845 O ? B ? 99 OG1 1
   ATOM 2482 CG2 . THR B 126 ? 30.46614 -21.24122 2.88185 1.000 16.36090 C ? B ? 99 CG2 1
   ATOM 2483 N . LEU B 127 ? 30.97272 -18.15418 3.51353 1.000 15.18824 N ? B ? 100 N 1
   ATOM 2484 CA . LEU B 127 ? 32.16977 -17.30511 3.49527 1.000 14.92391 C ? B ? 100 CA 1
   ATOM 2485 C . LEU B 127 ? 33.40204 -18.15443 3.75664 1.000 13.87448 C ? B ? 100 C 1
   ATOM 2486 O . LEU B 127 ? 33.38232 -19.04827 4.60126 1.000 16.33956 O ? B ? 100 O 1
   ATOM 2487 CB . LEU B 127 ? 32.11771 -16.14724 4.58618 1.000 12.47289 C ? B ? 100 CB 1
   ATOM 2488 CG . LEU B 127 ? 30.76907 -15.52002 4.60460 1.000 14.25130 C ? B ? 100 CG 1
   ATOM 2489 CD1 . LEU B 127 ? 30.70783 -14.49885 5.72441 1.000 18.59015 C ? B ? 100 CD1 1
   ATOM 2490 CD2 . LEU B 127 ? 30.51067 -14.71431 3.31958 1.000 13.29534 C ? B ? 100 CD2 1
   ATOM 2491 N . ILE B 128 ? 34.48715 -17.90057 3.00137 1.000 13.63479 N ? B ? 101 N 1
   ATOM 2492 CA . ILE B 128 ? 35.75799 -18.60618 3.19338 1.000 13.27802 C ? B ? 101 CA 1
   ATOM 2493 C . ILE B 128 ? 36.80931 -17.57864 3.54306 1.000 20.14138 C ? B ? 101 C 1
   ATOM 2494 O . ILE B 128 ? 37.19162 -16.77986 2.67928 1.000 20.85228 O ? B ? 101 O 1
   ATOM 2495 CB . ILE B 128 ? 36.16451 -19.35161 1.91004 1.000 13.81988 C ? B ? 101 CB 1
   ATOM 2496 CG1 . ILE B 128 ? 35.02156 -20.31772 1.53977 1.000 20.43922 C ? B ? 101 CG1 1
   ATOM 2497 CG2 . ILE B 128 ? 37.34492 -20.16594 2.11769 1.000 18.45244 C ? B ? 101 CG2 1
   ATOM 2498 CD1 . ILE B 128 ? 35.38377 -21.04556 0.25111 1.000 36.65144 C ? B ? 101 CD1 1
   ATOM 2499 N . PHE B 129 ? 37.27169 -17.56908 4.79681 1.000 14.03589 N ? B ? 102 N 1
   ATOM 2500 CA . PHE B 129 ? 38.30307 -16.60570 5.20547 1.000 14.89998 C ? B ? 102 CA 1
   ATOM 2501 C . PHE B 129 ? 39.64606 -17.28832 5.38866 1.000 17.98994 C ? B ? 102 C 1
   ATOM 2502 O . PHE B 129 ? 39.74378 -18.26740 6.13579 1.000 19.10348 O ? B ? 102 O 1
   ATOM 2503 CB . PHE B 129 ? 37.94862 -15.93303 6.54796 1.000 14.25743 C ? B ? 102 CB 1
   ATOM 2504 CG . PHE B 129 ? 36.87586 -14.91908 6.45543 1.000 13.34862 C ? B ? 102 CG 1
   ATOM 2505 CD1 . PHE B 129 ? 37.15717 -13.54705 6.21039 1.000 13.55885 C ? B ? 102 CD1 1
   ATOM 2506 CD2 . PHE B 129 ? 35.50996 -15.31461 6.64427 1.000 12.88536 C ? B ? 102 CD2 1
   ATOM 2507 CE1 . PHE B 129 ? 36.08783 -12.59027 6.16802 1.000 15.33032 C ? B ? 102 CE1 1
   ATOM 2508 CE2 . PHE B 129 ? 34.46627 -14.36921 6.62049 1.000 14.24049 C ? B ? 102 CE2 1
   ATOM 2509 CZ . PHE B 129 ? 34.75113 -12.99512 6.37874 1.000 16.77674 C ? B ? 102 CZ 1
   ATOM 2510 N . GLU B 130 ? 40.71200 -16.72509 4.79673 1.000 13.75155 N ? B ? 103 N 1
   ATOM 2511 CA . GLU B 130 ? 42.05354 -17.07741 5.22709 1.000 14.93571 C ? B ? 103 CA 1
   ATOM 2512 C . GLU B 130 ? 42.34084 -16.16251 6.40118 1.000 20.47114 C ? B ? 103 C 1
   ATOM 2513 O . GLU B 130 ? 42.11750 -14.95376 6.31044 1.000 19.47610 O ? B ? 103 O 1
   ATOM 2514 CB . GLU B 130 ? 43.08218 -16.80458 4.11540 1.000 21.58898 C ? B ? 103 CB 1
   ATOM 2515 CG . GLU B 130 ? 42.71415 -17.53227 2.90275 1.000 25.17816 C ? B ? 103 CG 1
   ATOM 2516 CD . GLU B 130 ? 43.77559 -17.43927 1.84257 1.000 56.88091 C ? B ? 103 CD 1
   ATOM 2517 OE1 . GLU B 130 ? 43.96880 -16.33592 1.29405 1.000 71.37424 O ? B ? 103 OE1 1
   ATOM 2518 OE2 . GLU B 130 ? 44.42819 -18.47027 1.59112 1.000 70.86930 O ? B ? 103 OE2 1
   ATOM 2519 N A VAL B 131 ? 42.78137 -16.71354 7.50522 0.500 15.75226 N ? B ? 104 N 1
   ATOM 2520 CA A VAL B 131 ? 42.98173 -15.90829 8.69995 0.500 16.02108 C ? B ? 104 CA 1
   ATOM 2521 C A VAL B 131 ? 44.33091 -16.23652 9.31359 0.500 17.95926 C ? B ? 104 C 1
   ATOM 2522 O A VAL B 131 ? 44.70227 -17.40805 9.47766 0.500 17.13307 O ? B ? 104 O 1
   ATOM 2523 CB A VAL B 131 ? 41.86754 -16.14048 9.74259 0.500 15.19942 C ? B ? 104 CB 1
   ATOM 2524 CG1 A VAL B 131 ? 40.48453 -15.60676 9.22959 0.500 16.60122 C ? B ? 104 CG1 1
   ATOM 2525 CG2 A VAL B 131 ? 41.83684 -17.58828 10.15117 0.500 16.29428 C ? B ? 104 CG2 1
   ATOM 2526 N B VAL B 131 ? 42.77359 -16.73358 7.51398 0.500 15.77371 N ? B ? 104 N 1
   ATOM 2527 CA B VAL B 131 ? 42.95456 -16.00109 8.76549 0.500 16.15480 C ? B ? 104 CA 1
   ATOM 2528 C B VAL B 131 ? 44.36085 -16.25658 9.28426 0.500 17.97594 C ? B ? 104 C 1
   ATOM 2529 O B VAL B 131 ? 44.79826 -17.41235 9.36793 0.500 17.31256 O ? B ? 104 O 1
   ATOM 2530 CB B VAL B 131 ? 41.93669 -16.44265 9.84281 0.500 13.80312 C ? B ? 104 CB 1
   ATOM 2531 CG1 B VAL B 131 ? 42.09167 -15.59055 11.14164 0.500 13.30372 C ? B ? 104 CG1 1
   ATOM 2532 CG2 B VAL B 131 ? 40.50341 -16.38860 9.31626 0.500 16.97710 C ? B ? 104 CG2 1
   ATOM 2533 N . GLU B 132 ? 45.05290 -15.19606 9.69923 1.000 14.62668 N ? B ? 105 N 1
   ATOM 2534 CA . GLU B 132 ? 46.33857 -15.37596 10.36275 1.000 16.27452 C ? B ? 105 CA 1
   ATOM 2535 C . GLU B 132 ? 46.24674 -14.63048 11.68013 1.000 15.36645 C ? B ? 105 C 1
   ATOM 2536 O . GLU B 132 ? 45.96640 -13.42689 11.66417 1.000 16.75265 O ? B ? 105 O 1
   ATOM 2537 CB . GLU B 132 ? 47.45807 -14.80623 9.49199 1.000 15.61710 C ? B ? 105 CB 1
   ATOM 2538 CG . GLU B 132 ? 48.82643 -15.00025 10.11277 1.000 20.20368 C ? B ? 105 CG 1
   ATOM 2539 CD . GLU B 132 ? 49.97396 -14.46592 9.18472 1.000 17.34146 C ? B ? 105 CD 1
   ATOM 2540 OE1 . GLU B 132 ? 51.10743 -14.84277 9.51080 1.000 22.17750 O ? B ? 105 OE1 1
   ATOM 2541 OE2 . GLU B 132 ? 49.67655 -13.66262 8.24766 1.000 24.64665 O ? B ? 105 OE2 1
   ATOM 2542 N . LEU B 133 ? 46.47560 -15.31992 12.80012 1.000 17.05138 N ? B ? 106 N 1
   ATOM 2543 CA . LEU B 133 ? 46.38980 -14.66219 14.09897 1.000 16.89830 C ? B ? 106 CA 1
   ATOM 2544 C . LEU B 133 ? 47.76602 -14.04813 14.40235 1.000 18.79223 C ? B ? 106 C 1
   ATOM 2545 O . LEU B 133 ? 48.70323 -14.76369 14.78691 1.000 18.79185 O ? B ? 106 O 1
   ATOM 2546 CB . LEU B 133 ? 45.97773 -15.67627 15.16366 1.000 15.34682 C ? B ? 106 CB 1
   ATOM 2547 CG . LEU B 133 ? 45.82416 -15.07900 16.58587 1.000 16.46327 C ? B ? 106 CG 1
   ATOM 2548 CD1 . LEU B 133 ? 44.83373 -13.92674 16.59093 1.000 14.79803 C ? B ? 106 CD1 1
   ATOM 2549 CD2 . LEU B 133 ? 45.32719 -16.15840 17.53827 1.000 17.35790 C ? B ? 106 CD2 1
   ATOM 2550 N . LEU B 134 ? 47.87052 -12.72760 14.18764 1.000 15.14389 N ? B ? 107 N 1
   ATOM 2551 CA . LEU B 134 ? 49.13155 -11.98527 14.30783 1.000 14.25652 C ? B ? 107 CA 1
   ATOM 2552 C . LEU B 134 ? 49.45712 -11.65907 15.75933 1.000 21.39371 C ? B ? 107 C 1
   ATOM 2553 O . LEU B 134 ? 50.63347 -11.42057 16.11484 1.000 22.44966 O ? B ? 107 O 1
   ATOM 2554 CB . LEU B 134 ? 49.01935 -10.68025 13.51220 1.000 14.12373 C ? B ? 107 CB 1
   ATOM 2555 CG . LEU B 134 ? 48.58542 -10.86023 12.02370 1.000 16.22140 C ? B ? 107 CG 1
   ATOM 2556 CD1 . LEU B 134 ? 48.32203 -9.48069 11.63430 1.000 14.48225 C ? B ? 107 CD1 1
   ATOM 2557 CD2 . LEU B 134 ? 49.71492 -11.50712 11.17821 1.000 16.67691 C ? B ? 107 CD2 1
   ATOM 2558 N . GLY B 135 ? 48.44189 -11.55423 16.61405 1.000 20.82605 N ? B ? 108 N 1
   ATOM 2559 CA . GLY B 135 ? 48.66300 -10.98135 17.91883 1.000 21.43645 C ? B ? 108 CA 1
   ATOM 2560 C . GLY B 135 ? 47.48789 -11.26947 18.83541 1.000 21.46565 C ? B ? 108 C 1
   ATOM 2561 O . GLY B 135 ? 46.33747 -11.35396 18.36206 1.000 17.57608 O ? B ? 108 O 1
   ATOM 2562 N . ILE B 136 ? 47.73751 -11.43052 20.13571 1.000 16.31651 N ? B ? 109 N 1
   ATOM 2563 CA . ILE B 136 ? 46.65143 -11.55901 21.11528 1.000 15.70856 C ? B ? 109 CA 1
   ATOM 2564 C . ILE B 136 ? 46.96025 -10.56744 22.20387 1.000 21.34827 C ? B ? 109 C 1
   ATOM 2565 O . ILE B 136 ? 48.01598 -10.69498 22.83208 1.000 22.08253 O ? B ? 109 O 1
   ATOM 2566 CB . ILE B 136 ? 46.57565 -12.96406 21.74075 1.000 18.60414 C ? B ? 109 CB 1
   ATOM 2567 CG1 . ILE B 136 ? 46.34633 -14.04141 20.69665 1.000 18.89434 C ? B ? 109 CG1 1
   ATOM 2568 CG2 . ILE B 136 ? 45.41650 -12.97574 22.83722 1.000 19.99857 C ? B ? 109 CG2 1
   ATOM 2569 CD1 . ILE B 136 ? 46.49063 -15.57060 21.21240 1.000 21.29444 C ? B ? 109 CD1 1
   ATOM 2570 N . ASN B 137 ? 46.08989 -9.55493 22.37357 1.000 19.82399 N ? B ? 110 N 1
   ATOM 2571 CA . ASN B 137 ? 46.43765 -8.36448 23.15982 1.000 21.77210 C ? B ? 110 CA 1
   ATOM 2572 C . ASN B 137 ? 47.80057 -7.87517 22.72015 1.000 23.21765 C ? B ? 110 C 1
   ATOM 2573 O . ASN B 137 ? 48.00729 -7.61829 21.51876 1.000 24.69265 O ? B ? 110 O 1
   ATOM 2574 CB . ASN B 137 ? 46.36954 -8.67932 24.66913 1.000 20.42116 C ? B ? 110 CB 1
   ATOM 2575 CG . ASN B 137 ? 44.94237 -9.16548 25.08297 1.000 23.31562 C ? B ? 110 CG 1
   ATOM 2576 OD1 . ASN B 137 ? 43.94078 -8.56248 24.69956 1.000 26.90275 O ? B ? 110 OD1 1
   ATOM 2577 ND2 . ASN B 137 ? 44.86925 -10.22546 25.84264 1.000 26.73577 N ? B ? 110 ND2 1
   ATOM 2578 N . ASN B 138 ? 48.76236 -7.77358 23.63810 1.000 23.09402 N ? B ? 111 N 1
   ATOM 2579 CA . ASN B 138 ? 50.09844 -7.28816 23.23194 1.000 23.71094 C ? B ? 111 CA 1
   ATOM 2580 C . ASN B 138 ? 51.08761 -8.40091 22.92117 1.000 27.25863 C ? B ? 111 C 1
   ATOM 2581 O . ASN B 138 ? 52.25910 -8.10911 22.64427 1.000 29.20414 O ? B ? 111 O 1
   ATOM 2582 CB . ASN B 138 ? 50.69599 -6.39160 24.35111 1.000 29.54145 C ? B ? 111 CB 1
   ATOM 2583 CG . ASN B 138 ? 49.94858 -5.12713 24.50944 1.000 44.82562 C ? B ? 111 CG 1
   ATOM 2584 OD1 . ASN B 138 ? 49.32914 -4.63341 23.55815 1.000 50.71226 O ? B ? 111 OD1 1
   ATOM 2585 ND2 . ASN B 138 ? 49.96931 -4.57595 25.72589 1.000 72.67730 N ? B ? 111 ND2 1
   ATOM 2586 N . LYS B 139 ? 50.65611 -9.65966 22.89739 1.000 25.25332 N ? B ? 112 N 1
   ATOM 2587 CA . LYS B 139 ? 51.54181 -10.77954 22.61215 1.000 23.99617 C ? B ? 112 CA 1
   ATOM 2588 C . LYS B 139 ? 51.77671 -10.90934 21.11706 1.000 25.88977 C ? B ? 112 C 1
   ATOM 2589 O . LYS B 139 ? 50.83261 -10.83934 20.34323 1.000 21.96931 O ? B ? 112 O 1
   ATOM 2590 CB . LYS B 139 ? 50.92199 -12.08959 23.10587 1.000 24.67117 C ? B ? 112 CB 1
   ATOM 2591 CG . LYS B 139 ? 51.13622 -12.42784 24.53182 1.000 39.89752 C ? B ? 112 CG 1
   ATOM 2592 CD . LYS B 139 ? 50.42588 -13.73260 24.95502 1.000 48.47630 C ? B ? 112 CD 1
   ATOM 2593 CE . LYS B 139 ? 50.59913 -14.91583 24.00829 1.000 83.46716 C ? B ? 112 CE 1
   ATOM 2594 NZ . LYS B 139 ? 50.29648 -16.29190 24.60612 1.000 75.71467 N ? B ? 112 NZ 1
   ATOM 2595 N . ARG B 140 ? 53.02838 -11.12645 20.73042 1.000 23.21835 N ? B ? 113 N 1
   ATOM 2596 CA . ARG B 140 ? 53.41978 -11.42602 19.35181 1.000 22.63980 C ? B ? 113 CA 1
   ATOM 2597 C . ARG B 140 ? 54.28289 -12.67794 19.33099 1.000 23.49470 C ? B ? 113 C 1
   ATOM 2598 O . ARG B 140 ? 54.83743 -13.10045 20.36842 1.000 24.74896 O ? B ? 113 O 1
   ATOM 2599 CB . ARG B 140 ? 54.18654 -10.24078 18.74437 1.000 21.60215 C ? B ? 113 CB 1
   ATOM 2600 CG . ARG B 140 ? 53.42541 -8.90644 18.85722 1.000 22.08876 C ? B ? 113 CG 1
   ATOM 2601 CD . ARG B 140 ? 52.17486 -8.97273 17.94383 1.000 20.07948 C ? B ? 113 CD 1
   ATOM 2602 NE . ARG B 140 ? 51.54361 -7.66211 17.88985 1.000 23.93636 N ? B ? 113 NE 1
   ATOM 2603 CZ . ARG B 140 ? 50.55551 -7.30522 18.69948 1.000 23.61893 C ? B ? 113 CZ 1
   ATOM 2604 NH1 . ARG B 140 ? 50.04505 -8.15448 19.57574 1.000 20.52827 N ? B ? 113 NH1 1
   ATOM 2605 NH2 . ARG B 140 ? 50.06282 -6.08047 18.62696 1.000 19.81835 N ? B ? 113 NH2 1
   ATOM 2606 N . ALA B 141 ? 54.38385 -13.30185 18.15903 1.000 22.44674 N ? B ? 114 N 1
   ATOM 2607 CA . ALA B 141 ? 54.93992 -14.68139 18.13142 1.000 23.21242 C ? B ? 114 CA 1
   ATOM 2608 C . ALA B 141 ? 56.51387 -14.77016 18.38605 1.000 32.18961 C ? B ? 114 C 1
   ATOM 2609 O . ALA B 141 ? 57.20821 -13.71797 18.18201 1.000 24.97833 O ? B ? 114 O 1
   ATOM 2610 CB . ALA B 141 ? 54.58338 -15.32365 16.79914 1.000 25.44012 C ? B ? 114 CB 1
   HETATM 2611 C01 . KXX A 201 ? 25.20877 -6.52755 8.07588 1.000 22.64542 C ? C ? . C01 1
   HETATM 2612 C02 . KXX A 201 ? 24.37528 -5.56513 7.21015 1.000 18.60899 C ? C ? . C02 1
   HETATM 2613 C03 . KXX A 201 ? 23.26697 -4.81855 7.99705 1.000 17.39164 C ? C ? . C03 1
   HETATM 2614 C04 . KXX A 201 ? 22.56069 -3.87491 7.04227 1.000 16.73460 C ? C ? . C04 1
   HETATM 2615 C05 . KXX A 201 ? 21.23539 -3.61361 7.11371 1.000 17.44252 C ? C ? . C05 1
   HETATM 2616 C06 . KXX A 201 ? 20.56439 -2.70720 6.11283 1.000 21.58071 C ? C ? . C06 1
   HETATM 2617 C07 . KXX A 201 ? 20.43962 -1.26062 6.66776 1.000 22.11584 C ? C ? . C07 1
   HETATM 2618 C08 . KXX A 201 ? 21.79960 -0.54831 6.64261 1.000 20.17007 C ? C ? . C08 1
   HETATM 2619 C09 . KXX A 201 ? 22.19741 0.18033 5.38967 1.000 18.10190 C ? C ? . C09 1
   HETATM 2620 C10 . KXX A 201 ? 23.52671 0.95314 5.46596 1.000 21.45030 C ? C ? . C10 1
   HETATM 2621 C11 . KXX A 201 ? 24.73778 0.37428 6.21712 1.000 23.31000 C ? C ? . C11 1
   HETATM 2622 C12 . KXX A 201 ? 25.90884 1.38047 6.16391 1.000 21.80441 C ? C ? . C12 1
   HETATM 2623 C13 . KXX A 201 ? 25.48798 2.63192 6.98300 1.000 15.25975 C ? C ? . C13 1
   HETATM 2624 C14 . KXX A 201 ? 24.14229 3.12062 6.38948 1.000 20.59158 C ? C ? . C14 1
   HETATM 2625 C16 . KXX A 201 ? 23.40601 4.21670 7.23348 1.000 21.78409 C ? C ? . C16 1
   HETATM 2626 C18 . KXX A 201 ? 23.54692 4.24104 8.73602 1.000 18.38472 C ? C ? . C18 1
   HETATM 2627 C21 . KXX A 201 ? 21.53856 2.85193 8.88070 1.000 17.31584 C ? C ? . C21 1
   HETATM 2628 C22 . KXX A 201 ? 20.26213 3.28566 9.59254 1.000 17.00872 C ? C ? . C22 1
   HETATM 2629 C23 . KXX A 201 ? 20.41103 3.27446 11.13394 1.000 15.13595 C ? C ? . C23 1
   HETATM 2630 C24 . KXX A 201 ? 21.57423 4.20880 11.56250 1.000 12.67354 C ? C ? . C24 1
   HETATM 2631 C25 . KXX A 201 ? 22.85275 3.60164 10.94285 1.000 14.72784 C ? C ? . C25 1
   HETATM 2632 C26 . KXX A 201 ? 23.34920 2.33264 11.58861 1.000 14.77952 C ? C ? . C26 1
   HETATM 2633 C29 . KXX A 201 ? 23.88373 0.00772 11.32926 1.000 16.07525 C ? C ? . C29 1
   HETATM 2634 C30 . KXX A 201 ? 23.18151 -1.13043 10.56503 1.000 19.06572 C ? C ? . C30 1
   HETATM 2635 C31 . KXX A 201 ? 23.61541 -2.49519 11.16895 1.000 21.49528 C ? C ? . C31 1
   HETATM 2636 C32 . KXX A 201 ? 23.12580 -3.70826 10.32746 1.000 18.38699 C ? C ? . C32 1
   HETATM 2637 C33 . KXX A 201 ? 23.91780 -3.92452 9.06054 1.000 20.22339 C ? C ? . C33 1
   HETATM 2638 C36 . KXX A 201 ? 21.64402 -0.96767 10.55290 1.000 19.86359 C ? C ? . C36 1
   HETATM 2639 C37 . KXX A 201 ? 25.40472 -0.12334 11.40968 1.000 15.66047 C ? C ? . C37 1
   HETATM 2640 C38 . KXX A 201 ? 26.00314 -0.25472 12.58511 1.000 15.10684 C ? C ? . C38 1
   HETATM 2641 C39 . KXX A 201 ? 27.47972 -0.40132 12.87017 1.000 15.50905 C ? C ? . C39 1
   HETATM 2642 C40 . KXX A 201 ? 27.81704 -1.91036 13.16789 1.000 14.71665 C ? C ? . C40 1
   HETATM 2643 C41 . KXX A 201 ? 29.36726 -2.00849 13.36199 1.000 14.31635 C ? C ? . C41 1
   HETATM 2644 C42 . KXX A 201 ? 29.64070 -1.20684 14.63622 1.000 18.13908 C ? C ? . C42 1
   HETATM 2645 C43 . KXX A 201 ? 29.34240 0.25288 14.35815 1.000 16.24838 C ? C ? . C43 1
   HETATM 2646 C44 . KXX A 201 ? 27.85450 0.45913 14.11526 1.000 16.02955 C ? C ? . C44 1
   HETATM 2647 C46 . KXX A 201 ? 30.13898 2.29859 15.23037 1.000 19.74530 C ? C ? . C46 1
   HETATM 2648 C48 . KXX A 201 ? 26.12504 -0.01398 10.07442 1.000 15.50826 C ? C ? . C48 1
   HETATM 2649 C50 . KXX A 201 ? 26.62825 3.67137 6.86394 1.000 18.59598 C ? C ? . C50 1
   HETATM 2650 C52 . KXX A 201 ? 25.83525 -1.75743 6.01630 1.000 24.67267 C ? C ? . C52 1
   HETATM 2651 C54 . KXX A 201 ? 22.24272 -0.13503 3.11598 1.000 22.87778 C ? C ? . C54 1
   HETATM 2652 C55 . KXX A 201 ? 19.33448 -0.49284 5.91321 1.000 21.29342 C ? C ? . C55 1
   HETATM 2653 C56 . KXX A 201 ? 20.28780 -4.20624 8.13037 1.000 17.86121 C ? C ? . C56 1
   HETATM 2654 N20 . KXX A 201 ? 22.69522 3.56700 9.47709 1.000 15.12681 N ? C ? . N20 1
   HETATM 2655 O15 . KXX A 201 ? 23.12048 2.10461 6.27085 1.000 23.55294 O ? C ? . O15 1
   HETATM 2656 O17 . KXX A 201 ? 22.74307 5.07016 6.69585 1.000 24.17986 O ? C ? . O17 1
   HETATM 2657 O19 . KXX A 201 ? 24.52611 4.84632 9.08884 1.000 17.01776 O ? C ? . O19 1
   HETATM 2658 O27 . KXX A 201 ? 23.54238 2.30043 12.79371 1.000 15.99494 O ? C ? . O27 1
   HETATM 2659 O28 . KXX A 201 ? 23.44437 1.30488 10.75067 1.000 15.80086 O ? C ? . O28 1
   HETATM 2660 O34 . KXX A 201 ? 24.99385 -3.37138 8.82909 1.000 19.89255 O ? C ? . O34 1
   HETATM 2661 O35 . KXX A 201 ? 23.05469 -2.67654 12.46791 1.000 22.02403 O ? C ? . O35 1
   HETATM 2662 O45 . KXX A 201 ? 29.75897 0.98097 15.54938 1.000 20.57435 O ? C ? . O45 1
   HETATM 2663 O47 . KXX A 201 ? 31.06496 -1.24294 14.82830 1.000 20.40165 O ? C ? . O47 1
   HETATM 2664 O49 . KXX A 201 ? 24.36713 3.64774 5.13040 1.000 21.58992 O ? C ? . O49 1
   HETATM 2665 O51 . KXX A 201 ? 25.09397 -0.72302 5.36712 1.000 24.95962 O ? C ? . O51 1
   HETATM 2666 O53 . KXX A 201 ? 22.31022 -0.80169 4.37643 1.000 18.82546 O ? C ? . O53 1
   HETATM 2667 O1 . SO4 A 202 ? 37.27776 4.44413 14.60649 0.877 23.43745 O ? D ? . O1 1
   HETATM 2668 O2 . SO4 A 202 ? 36.64662 5.88828 16.56168 0.877 19.35256 O ? D ? . O2 1
   HETATM 2669 O3 . SO4 A 202 ? 38.43947 4.31965 16.78927 0.877 30.26402 O ? D ? . O3 1
   HETATM 2670 O4 . SO4 A 202 ? 36.23617 3.45605 16.64150 0.877 26.96294 O ? D ? . O4 1
   HETATM 2671 S . SO4 A 202 ? 37.12686 4.52844 16.08090 0.877 22.22771 S ? D ? . S 1
   HETATM 2672 C1 . PG4 A 203 ? 34.90735 6.43486 3.09077 1.000 35.56699 C ? E ? . C1 1
   HETATM 2673 C2 . PG4 A 203 ? 36.17786 5.89673 2.49627 1.000 35.27439 C ? E ? . C2 1
   HETATM 2674 C3 . PG4 A 203 ? 36.80563 4.00597 1.27050 1.000 33.84609 C ? E ? . C3 1
   HETATM 2675 C4 . PG4 A 203 ? 36.79101 2.51113 1.15914 1.000 41.50958 C ? E ? . C4 1
   HETATM 2676 C5 . PG4 A 203 ? 37.55583 0.52436 2.16789 1.000 28.89124 C ? E ? . C5 1
   HETATM 2677 C6 . PG4 A 203 ? 38.70447 0.00299 2.97803 1.000 20.92907 C ? E ? . C6 1
   HETATM 2678 C7 . PG4 A 203 ? 39.37381 -0.23322 5.17381 1.000 19.01130 C ? E ? . C7 1
   HETATM 2679 C8 . PG4 A 203 ? 38.94496 -0.23682 6.61703 1.000 21.62745 C ? E ? . C8 1
   HETATM 2680 O1 . PG4 A 203 ? 34.16590 7.05896 2.05251 1.000 43.38912 O ? E ? . O1 1
   HETATM 2681 O2 . PG4 A 203 ? 35.91181 4.53305 2.22939 1.000 33.75175 O ? E ? . O2 1
   HETATM 2682 O3 . PG4 A 203 ? 37.63946 1.93372 2.12825 1.000 34.15233 O ? E ? . O3 1
   HETATM 2683 O4 . PG4 A 203 ? 38.40122 0.32991 4.32868 1.000 21.40767 O ? E ? . O4 1
   HETATM 2684 O5 . PG4 A 203 ? 38.58234 1.09189 7.08353 1.000 20.46239 O ? E ? . O5 1
   HETATM 2685 C11 . P6G A 204 ? 9.29945 17.13562 30.93940 1.000 39.97802 C ? F ? . C11 1
   HETATM 2686 C12 . P6G A 204 ? 9.76221 18.47685 30.42334 1.000 48.37816 C ? F ? . C12 1
   HETATM 2687 C14 . P6G A 204 ? 12.04972 18.79607 29.81193 1.000 61.36594 C ? F ? . C14 1
   HETATM 2688 C15 . P6G A 204 ? 12.83435 20.08177 29.63135 1.000 51.06657 C ? F ? . C15 1
   HETATM 2689 C17 . P6G A 204 ? 14.64843 19.51181 28.39784 1.000 46.14485 C ? F ? . C17 1
   HETATM 2690 C18 . P6G A 204 ? 14.95022 18.80980 27.09723 1.000 45.78720 C ? F ? . C18 1
   HETATM 2691 C2 . P6G A 204 ? 12.21435 9.91521 26.90267 1.000 38.29390 C ? F ? . C2 1
   HETATM 2692 C3 . P6G A 204 ? 10.80141 10.06809 26.38189 1.000 40.70645 C ? F ? . C3 1
   HETATM 2693 C5 . P6G A 204 ? 9.01925 11.58498 26.76849 1.000 40.44066 C ? F ? . C5 1
   HETATM 2694 C6 . P6G A 204 ? 8.92427 11.99352 28.23917 1.000 83.78157 C ? F ? . C6 1
   HETATM 2695 C8 . P6G A 204 ? 8.73043 14.42113 28.43371 1.000 64.93085 C ? F ? . C8 1
   HETATM 2696 C9 . P6G A 204 ? 9.20666 15.07476 29.71964 1.000 42.22770 C ? F ? . C9 1
   HETATM 2697 O1 . P6G A 204 ? 12.49338 10.63482 28.07957 1.000 57.50158 O ? F ? . O1 1
   HETATM 2698 O10 . P6G A 204 ? 8.65080 16.36312 29.93419 1.000 61.17444 O ? F ? . O10 1
   HETATM 2699 O13 . P6G A 204 ? 11.06905 18.81895 30.83681 1.000 60.45175 O ? F ? . O13 1
   HETATM 2700 O16 . P6G A 204 ? 13.45868 20.31960 28.37661 1.000 40.34005 O ? F ? . O16 1
   HETATM 2701 O19 . P6G A 204 ? 15.09230 17.39885 27.15011 1.000 57.40655 O ? F ? . O19 1
   HETATM 2702 O4 . P6G A 204 ? 10.38793 11.39383 26.46922 1.000 42.61097 O ? F ? . O4 1
   HETATM 2703 O7 . P6G A 204 ? 8.13550 13.13390 28.56659 1.000 77.57226 O ? F ? . O7 1
   HETATM 2704 C3 . PG4 A 205 ? 4.71283 22.50258 10.74907 1.000 47.91943 C ? G ? . C3 1
   HETATM 2705 C4 . PG4 A 205 ? 4.34500 21.92713 12.08600 1.000 47.36612 C ? G ? . C4 1
   HETATM 2706 C5 . PG4 A 205 ? 2.31639 20.69012 12.19427 1.000 35.56705 C ? G ? . C5 1
   HETATM 2707 C6 . PG4 A 205 ? 1.44447 20.59318 10.95604 1.000 60.09837 C ? G ? . C6 1
   HETATM 2708 O2 . PG4 A 205 ? 5.99312 22.07123 10.39551 1.000 60.01897 O ? G ? . O2 1
   HETATM 2709 O3 . PG4 A 205 ? 2.94358 21.93628 12.28374 1.000 53.53205 O ? G ? . O3 1
   HETATM 2710 O4 . PG4 A 205 ? 1.25655 19.23763 10.60909 1.000 54.58800 O ? G ? . O4 1
   HETATM 2711 C . ACT A 206 ? 10.46922 23.37694 10.15288 1.000 56.34009 C ? H ? . C 1
   HETATM 2712 O . ACT A 206 ? 9.97514 22.91489 11.21603 1.000 45.85907 O ? H ? . O 1
   HETATM 2713 CH3 . ACT A 206 ? 10.16564 22.61812 8.84071 1.000 36.49536 C ? H ? . CH3 1
   HETATM 2714 OH2 . 1PE A 207 ? 25.15437 3.31226 -1.31091 1.000 66.22992 O ? I ? . OH2 1
   HETATM 2715 OH3 . 1PE A 207 ? 25.33264 2.01183 1.76924 1.000 51.91794 O ? I ? . OH3 1
   HETATM 2716 C12 . 1PE A 207 ? 24.35541 2.64431 -0.35440 1.000 51.64077 C ? I ? . C12 1
   HETATM 2717 C13 . 1PE A 207 ? 26.76225 0.02513 1.91854 1.000 42.37752 C ? I ? . C13 1
   HETATM 2718 C14 . 1PE A 207 ? 29.94540 -0.91566 0.11086 1.000 57.26618 C ? I ? . C14 1
   HETATM 2719 C15 . 1PE A 207 ? 32.62492 -1.92996 1.62343 1.000 63.47038 C ? I ? . C15 1
   HETATM 2720 C16 . 1PE A 207 ? 34.87256 -3.45447 0.83659 1.000 44.33992 C ? I ? . C16 1
   HETATM 2721 C22 . 1PE A 207 ? 24.73281 3.07143 1.03998 1.000 49.46390 C ? I ? . C22 1
   HETATM 2722 C23 . 1PE A 207 ? 25.86934 0.90821 1.05652 1.000 60.48201 C ? I ? . C23 1
   HETATM 2723 C24 . 1PE A 207 ? 28.46645 -0.98118 0.47923 1.000 55.54492 C ? I ? . C24 1
   HETATM 2724 C25 . 1PE A 207 ? 31.30497 -1.33181 2.11529 1.000 44.13457 C ? I ? . C25 1
   HETATM 2725 C26 . 1PE A 207 ? 34.02760 -3.85521 2.02785 1.000 45.61834 C ? I ? . C26 1
   HETATM 2726 OH4 . 1PE A 207 ? 28.08911 0.00671 1.40813 1.000 76.38060 O ? I ? . OH4 1
   HETATM 2727 OH5 . 1PE A 207 ? 30.75799 -0.42119 1.17417 1.000 64.24894 O ? I ? . OH5 1
   HETATM 2728 OH6 . 1PE A 207 ? 33.31464 -2.74026 2.58110 1.000 51.03478 O ? I ? . OH6 1
   HETATM 2729 OH7 . 1PE A 207 ? 36.24245 -3.75141 1.00978 1.000 57.75947 O ? I ? . OH7 1
   HETATM 2731 O . HOH A 302 ? 33.31643 9.47365 0.81947 1.000 50.34867 O ? J ? . O 1
   HETATM 2732 O . HOH A 304 ? 1.07120 16.74705 21.07664 0.744 29.08711 O ? J ? . O 1
   HETATM 2733 O . HOH A 305 ? 6.88734 2.39081 23.35859 0.701 28.22430 O ? J ? . O 1
   HETATM 2734 O . HOH A 306 ? 11.95399 22.28314 15.93086 0.770 25.20340 O ? J ? . O 1
   HETATM 2735 O A HOH A 307 ? 6.51513 14.25827 18.06375 0.635 20.90971 O ? J ? . O 1
   HETATM 2736 O B HOH A 307 ? 6.38621 14.07974 20.41663 0.365 16.67654 O ? J ? . O 1
   HETATM 2739 O . HOH A 310 ? 18.50460 20.19526 12.81344 0.807 25.66369 O ? J ? . O 1
   HETATM 2740 O . HOH A 311 ? 18.30121 4.30190 24.17322 0.849 37.49420 O ? J ? . O 1
   HETATM 2741 O . HOH A 313 ? 16.26478 0.39245 4.36480 0.972 32.34736 O ? J ? . O 1
   HETATM 2742 O . HOH A 314 ? 11.49961 7.02261 25.19939 0.915 24.49931 O ? J ? . O 1
   HETATM 2743 O . HOH A 315 ? 18.45759 -3.63792 11.12049 0.717 34.46747 O ? J ? . O 1
   HETATM 2744 O . HOH A 316 ? 17.27531 9.09379 24.87664 0.848 24.53389 O ? J ? . O 1
   HETATM 2745 O A HOH A 317 ? 33.72362 3.24883 15.58890 0.447 23.49996 O ? J ? . O 1
   HETATM 2746 O B HOH A 317 ? 32.19449 5.04338 16.86063 0.553 20.74606 O ? J ? . O 1
   HETATM 2747 O . HOH A 318 ? 28.91526 8.18420 0.66917 0.996 35.55085 O ? J ? . O 1
   HETATM 2748 O . HOH A 319 ? 19.77089 -0.63843 19.09001 0.984 17.94930 O ? J ? . O 1
   HETATM 2749 O . HOH A 321 ? 19.69367 18.25610 14.32204 0.995 19.03179 O ? J ? . O 1
   HETATM 2750 O . HOH A 322 ? 16.27917 14.69293 1.35867 1.000 34.14493 O ? J ? . O 1
   HETATM 2751 O . HOH A 324 ? 22.39708 19.92745 11.36256 0.964 32.69242 O ? J ? . O 1
   HETATM 2752 O . HOH A 325 ? 35.49974 4.85059 6.40933 0.923 20.08023 O ? J ? . O 1
   HETATM 2753 O . HOH A 326 ? 29.66190 5.76040 19.75469 0.904 36.36083 O ? J ? . O 1
   HETATM 2756 O . HOH A 329 ? 4.94556 14.28802 11.15170 0.688 32.29164 O ? J ? . O 1
   HETATM 2757 O . HOH A 330 ? 2.80034 19.49911 23.14609 0.854 21.05938 O ? J ? . O 1
   HETATM 2758 O . HOH A 331 ? 13.45308 18.01143 24.73222 0.730 20.72980 O ? J ? . O 1
   HETATM 2759 O . HOH A 332 ? 36.52304 12.24901 15.67655 0.814 20.57486 O ? J ? . O 1
   HETATM 2760 O . HOH A 333 ? 24.34947 2.41170 20.14184 0.694 20.05599 O ? J ? . O 1
   HETATM 2761 O . HOH A 335 ? 19.95469 -2.97146 13.15747 0.899 27.79706 O ? J ? . O 1
   HETATM 2762 O . HOH A 336 ? 32.98739 0.48251 15.80306 0.961 38.19055 O ? J ? . O 1
   HETATM 2763 O . HOH A 337 ? 26.71444 18.04115 19.61718 1.000 39.89829 O ? J ? . O 1
   HETATM 2765 O . HOH A 339 ? 33.65039 3.20393 12.60568 0.923 19.58126 O ? J ? . O 1
   HETATM 2766 O . HOH A 341 ? 29.43314 17.31208 24.99654 0.999 46.43088 O ? J ? . O 1
   HETATM 2767 O . HOH A 343 ? 30.13160 15.27146 7.43975 0.987 21.97783 O ? J ? . O 1
   HETATM 2768 O . HOH A 344 ? 32.57496 14.10598 6.20464 0.844 30.55766 O ? J ? . O 1
   HETATM 2769 O . HOH A 345 ? 0.29874 15.86760 17.66404 0.962 40.04306 O ? J ? . O 1
   HETATM 2770 O . HOH A 347 ? 7.85419 -0.92548 14.22426 1.000 21.86248 O ? J ? . O 1
   HETATM 2771 O . HOH A 348 ? 33.13423 9.08450 10.97156 0.934 14.36568 O ? J ? . O 1
   HETATM 2773 O . HOH A 350 ? 9.23924 14.36828 20.59862 1.000 17.97163 O ? J ? . O 1
   HETATM 2774 O . HOH A 351 ? 30.46404 9.32962 11.94452 1.000 18.56088 O ? J ? . O 1
   HETATM 2777 O . HOH A 354 ? 27.06636 6.34321 -0.40946 0.913 38.36610 O ? J ? . O 1
   HETATM 2778 O . HOH A 355 ? -2.18977 12.46086 20.17203 0.760 36.63840 O ? J ? . O 1
   HETATM 2779 O . HOH A 356 ? 5.03122 5.88436 25.07395 0.891 29.77523 O ? J ? . O 1
   HETATM 2780 O . HOH A 357 ? 19.15374 4.65790 -1.38163 0.632 30.32034 O ? J ? . O 1
   HETATM 2781 O . HOH A 358 ? 34.95168 10.80104 23.07808 0.756 36.72300 O ? J ? . O 1
   HETATM 2782 O . HOH A 359 ? 25.15540 -3.46259 14.84229 0.769 35.02958 O ? J ? . O 1
   HETATM 2783 O . HOH A 360 ? 28.08514 4.91124 17.61077 0.917 14.68968 O ? J ? . O 1
   HETATM 2784 O . HOH A 362 ? 38.11696 8.38712 5.80411 0.801 30.84609 O ? J ? . O 1
   HETATM 2785 O . HOH A 364 ? 14.16681 3.44917 27.22000 0.861 31.11225 O ? J ? . O 1
   HETATM 2788 O . HOH A 367 ? 31.98266 16.49397 9.57935 1.000 26.45814 O ? J ? . O 1
   HETATM 2789 O . HOH A 368 ? 17.14097 -5.30389 15.29621 0.762 26.73697 O ? J ? . O 1
   HETATM 2790 O . HOH A 369 ? -1.79511 6.06326 21.23829 1.000 48.44389 O ? J ? . O 1
   HETATM 2791 O . HOH A 370 ? 10.05618 13.82654 4.27573 1.000 54.40007 O ? J ? . O 1
   HETATM 2793 O . HOH A 372 ? 25.16000 17.45355 17.72648 0.917 27.68082 O ? J ? . O 1
   HETATM 2794 O . HOH A 373 ? 15.89888 11.35185 0.15156 1.000 45.10133 O ? J ? . O 1
   HETATM 2796 O B HOH A 374 ? 12.82645 10.69433 6.05464 0.714 32.30849 O ? J ? . O 1
   HETATM 2798 O A HOH A 376 ? 15.50216 -2.92641 7.75941 0.468 21.61364 O ? J ? . O 1
   HETATM 2799 O B HOH A 376 ? 15.97485 -2.22391 5.63618 0.532 22.37150 O ? J ? . O 1
   HETATM 2800 O . HOH A 378 ? 35.13529 17.06618 13.62008 1.000 40.84309 O ? J ? . O 1
   HETATM 2801 O . HOH A 379 ? 30.05333 8.11030 23.32482 1.000 46.95046 O ? J ? . O 1
   HETATM 2802 O . HOH A 380 ? 12.97469 -3.79484 6.91147 0.827 40.26916 O ? J ? . O 1
   HETATM 2803 O . HOH A 381 ? -0.85937 15.20964 21.64817 0.996 45.41108 O ? J ? . O 1
   HETATM 2804 O . HOH A 383 ? 40.24749 3.75085 14.10979 0.996 38.86079 O ? J ? . O 1
   HETATM 2805 O . HOH A 384 ? 28.10768 4.05412 -1.20668 1.000 47.68163 O ? J ? . O 1
   HETATM 2807 O . HOH A 386 ? 12.84300 15.21257 8.48414 0.999 40.76490 O ? J ? . O 1
   HETATM 2808 O . HOH A 387 ? 31.76239 19.10862 9.92777 0.999 45.82628 O ? J ? . O 1
   HETATM 2810 O . HOH A 389 ? 3.93495 -1.20406 21.92841 1.000 35.45800 O ? J ? . O 1
   HETATM 2811 O . HOH A 390 ? 16.37328 13.85943 28.39716 1.000 43.76547 O ? J ? . O 1
   HETATM 2813 O . HOH A 392 ? -0.39357 1.22098 24.13996 1.000 47.40800 O ? J ? . O 1
   HETATM 2815 O . HOH A 394 ? 13.64853 6.27678 26.83514 0.676 29.77235 O ? J ? . O 1
   HETATM 2824 O . HOH A 403 ? 37.37643 -19.82161 24.28085 0.996 33.55537 O ? J ? . O 1
   HETATM 2832 O . HOH A 414 ? 21.18149 22.32228 15.03163 1.000 54.35377 O ? J ? . O 1
   HETATM 2833 O . HOH A 415 ? 9.64515 6.65160 27.02242 0.889 36.35502 O ? J ? . O 1
   HETATM 2836 C01 . KXX B 201 ? 31.72121 0.69097 11.26494 1.000 18.51891 C ? K ? . C01 1
   HETATM 2837 C02 . KXX B 201 ? 32.76045 0.22052 10.18088 1.000 16.48225 C ? K ? . C02 1
   HETATM 2838 C03 . KXX B 201 ? 33.60995 -0.92156 10.83111 1.000 14.67212 C ? K ? . C03 1
   HETATM 2839 C04 . KXX B 201 ? 34.76441 -1.29978 9.93266 1.000 13.24050 C ? K ? . C04 1
   HETATM 2840 C05 . KXX B 201 ? 35.97124 -1.72669 10.27628 1.000 17.10638 C ? K ? . C05 1
   HETATM 2841 C06 . KXX B 201 ? 37.02658 -2.03354 9.23121 1.000 12.73224 C ? K ? . C06 1
   HETATM 2842 C07 . KXX B 201 ? 37.11875 -3.59286 8.99162 1.000 14.25488 C ? K ? . C07 1
   HETATM 2843 C08 . KXX B 201 ? 35.93436 -4.18817 8.22204 1.000 17.95881 C ? K ? . C08 1
   HETATM 2844 C09 . KXX B 201 ? 35.99047 -4.18439 6.69219 1.000 20.52813 C ? K ? . C09 1
   HETATM 2845 C10 . KXX B 201 ? 34.81478 -4.84916 5.93969 1.000 19.18162 C ? K ? . C10 1
   HETATM 2846 C11 . KXX B 201 ? 33.38111 -4.47923 6.35287 1.000 15.47123 C ? K ? . C11 1
   HETATM 2847 C12 . KXX B 201 ? 32.30344 -5.30930 5.59813 1.000 17.57771 C ? K ? . C12 1
   HETATM 2848 C13 . KXX B 201 ? 32.68556 -6.82967 5.60479 1.000 19.77811 C ? K ? . C13 1
   HETATM 2849 C14 . KXX B 201 ? 34.19483 -7.09650 5.38659 1.000 20.64724 C ? K ? . C14 1
   HETATM 2850 C16 . KXX B 201 ? 34.72446 -8.50788 5.84187 1.000 21.04491 C ? K ? . C16 1
   HETATM 2851 C18 . KXX B 201 ? 34.06898 -9.21136 7.02147 1.000 20.31745 C ? K ? . C18 1
   HETATM 2852 C21 . KXX B 201 ? 35.71594 -8.20762 8.60703 1.000 15.55598 C ? K ? . C21 1
   HETATM 2853 C22 . KXX B 201 ? 36.75330 -9.05008 9.39458 1.000 15.33219 C ? K ? . C22 1
   HETATM 2854 C23 . KXX B 201 ? 36.08078 -9.70412 10.62405 1.000 14.17064 C ? K ? . C23 1
   HETATM 2855 C24 . KXX B 201 ? 34.93398 -10.60748 10.11078 1.000 13.72376 C ? K ? . C24 1
   HETATM 2856 C25 . KXX B 201 ? 33.88320 -9.78445 9.34226 1.000 14.29997 C ? K ? . C25 1
   HETATM 2857 C26 . KXX B 201 ? 33.11228 -8.88148 10.34268 1.000 14.78409 C ? K ? . C26 1
   HETATM 2858 C29 . KXX B 201 ? 32.42889 -6.73228 11.15776 1.000 13.28713 C ? K ? . C29 1
   HETATM 2859 C30 . KXX B 201 ? 33.20676 -5.39761 11.21938 1.000 12.46505 C ? K ? . C30 1
   HETATM 2860 C31 . KXX B 201 ? 32.50574 -4.48327 12.27699 1.000 17.56256 C ? K ? . C31 1
   HETATM 2861 C32 . KXX B 201 ? 33.08445 -3.04788 12.32663 1.000 17.28962 C ? K ? . C32 1
   HETATM 2862 C33 . KXX B 201 ? 32.77863 -2.19366 11.09635 1.000 15.11488 C ? K ? . C33 1
   HETATM 2863 C36 . KXX B 201 ? 34.70703 -5.63764 11.50113 1.000 15.77094 C ? K ? . C36 1
   HETATM 2864 C37 . KXX B 201 ? 30.99821 -6.57562 10.65904 1.000 14.95132 C ? K ? . C37 1
   HETATM 2865 C38 . KXX B 201 ? 29.99577 -6.92181 11.51416 1.000 17.01805 C ? K ? . C38 1
   HETATM 2866 C39 . KXX B 201 ? 28.49835 -6.78991 11.23098 1.000 13.73856 C ? K ? . C39 1
   HETATM 2867 C40 . KXX B 201 ? 27.96768 -5.64802 12.15069 1.000 16.16556 C ? K ? . C40 1
   HETATM 2868 C41 . KXX B 201 ? 26.45941 -5.50510 11.99526 1.000 19.08363 C ? K ? . C41 1
   HETATM 2869 C42 . KXX B 201 ? 25.77379 -6.82195 12.36834 1.000 21.46208 C ? K ? . C42 1
   HETATM 2870 C43 . KXX B 201 ? 26.26750 -7.96151 11.48188 1.000 20.56581 C ? K ? . C43 1
   HETATM 2871 C44 . KXX B 201 ? 27.80647 -8.11602 11.61412 1.000 18.03783 C ? K ? . C44 1
   HETATM 2872 C46 . KXX B 201 ? 25.65304 -10.19916 10.95677 1.000 20.78988 C ? K ? . C46 1
   HETATM 2873 C48 . KXX B 201 ? 30.78504 -5.95071 9.27294 1.000 17.01229 C ? K ? . C48 1
   HETATM 2874 C50 . KXX B 201 ? 31.69714 -7.66705 4.75727 1.000 18.63259 C ? K ? . C50 1
   HETATM 2875 C52 . KXX B 201 ? 32.24363 -2.41636 6.90742 1.000 21.90190 C ? K ? . C52 1
   HETATM 2876 C54 . KXX B 201 ? 36.75265 -2.76406 4.97697 1.000 19.50320 C ? K ? . C54 1
   HETATM 2877 C55 . KXX B 201 ? 38.50168 -4.04476 8.38818 1.000 18.74212 C ? K ? . C55 1
   HETATM 2878 C56 . KXX B 201 ? 36.47735 -1.84727 11.68742 1.000 16.63844 C ? K ? . C56 1
   HETATM 2879 N20 . KXX B 201 ? 34.55907 -9.07450 8.26885 1.000 14.31672 N ? K ? . N20 1
   HETATM 2880 O15 . KXX B 201 ? 34.96905 -6.28937 6.26801 1.000 19.57386 O ? K ? . O15 1
   HETATM 2881 O17 . KXX B 201 ? 35.68099 -9.05611 5.35853 1.000 20.23244 O ? K ? . O17 1
   HETATM 2882 O19 . KXX B 201 ? 33.12925 -9.89939 6.68594 1.000 19.63241 O ? K ? . O19 1
   HETATM 2883 O27 . KXX B 201 ? 32.44188 -9.39766 11.24097 1.000 15.89275 O ? K ? . O27 1
   HETATM 2884 O28 . KXX B 201 ? 33.16875 -7.56856 10.15108 1.000 14.87137 O ? K ? . O28 1
   HETATM 2885 O34 . KXX B 201 ? 31.90243 -2.51526 10.35114 1.000 17.39995 O ? K ? . O34 1
   HETATM 2886 O35 . KXX B 201 ? 32.76332 -5.00184 13.58829 1.000 17.33824 O ? K ? . O35 1
   HETATM 2887 O45 . KXX B 201 ? 25.66119 -9.19410 11.97870 1.000 21.38341 O ? K ? . O45 1
   HETATM 2888 O47 . KXX B 201 ? 24.36938 -6.69478 12.09897 1.000 21.91067 O ? K ? . O47 1
   HETATM 2889 O49 . KXX B 201 ? 34.51076 -6.89896 4.07639 1.000 22.36854 O ? K ? . O49 1
   HETATM 2890 O51 . KXX B 201 ? 33.21746 -3.06245 6.06700 1.000 20.03262 O ? K ? . O51 1
   HETATM 2891 O53 . KXX B 201 ? 36.12156 -2.81630 6.26706 1.000 17.04520 O ? K ? . O53 1
   HETATM 2892 O1 . SO4 B 202 ? 25.88331 -31.38243 2.58909 1.000 53.19036 O ? L ? . O1 1
   HETATM 2893 O2 . SO4 B 202 ? 23.34836 -31.41752 2.51277 1.000 62.36134 O ? L ? . O2 1
   HETATM 2894 O3 . SO4 B 202 ? 24.50831 -32.10391 4.49514 1.000 84.17550 O ? L ? . O3 1
   HETATM 2895 O4 . SO4 B 202 ? 24.59109 -29.71604 3.75111 1.000 70.79486 O ? L ? . O4 1
   HETATM 2896 S . SO4 B 202 ? 24.58596 -31.15725 3.32460 1.000 53.61325 S ? L ? . S 1
   HETATM 2897 C1 . PG4 B 203 ? 38.76553 -7.29433 -4.23378 1.000 52.26233 C ? M ? . C1 1
   HETATM 2898 C2 . PG4 B 203 ? 38.75365 -7.43738 -5.73921 1.000 64.38326 C ? M ? . C2 1
   HETATM 2899 C3 . PG4 B 203 ? 40.57974 -8.06632 -7.11223 1.000 57.32115 C ? M ? . C3 1
   HETATM 2900 C4 . PG4 B 203 ? 42.03919 -7.80219 -7.43567 1.000 63.55281 C ? M ? . C4 1
   HETATM 2901 C5 . PG4 B 203 ? 43.16105 -9.74704 -6.76461 1.000 82.05928 C ? M ? . C5 1
   HETATM 2902 C6 . PG4 B 203 ? 44.47664 -10.38123 -6.34388 1.000 88.94835 C ? M ? . C6 1
   HETATM 2903 C7 . PG4 B 203 ? 44.56086 -12.80105 -6.10719 1.000 73.81964 C ? M ? . C7 1
   HETATM 2904 C8 . PG4 B 203 ? 44.07529 -13.95879 -5.24452 1.000 49.58737 C ? M ? . C8 1
   HETATM 2905 O1 . PG4 B 203 ? 37.62787 -6.60700 -3.73251 1.000 56.51545 O ? M ? . O1 1
   HETATM 2906 O2 . PG4 B 203 ? 40.02855 -7.10670 -6.24517 1.000 89.14568 O ? M ? . O2 1
   HETATM 2907 O3 . PG4 B 203 ? 42.92109 -8.38167 -6.48720 1.000 71.02624 O ? M ? . O3 1
   HETATM 2908 O4 . PG4 B 203 ? 44.22150 -11.53496 -5.55179 1.000 86.30826 O ? M ? . O4 1
   HETATM 2909 O5 . PG4 B 203 ? 44.44950 -13.68451 -3.92256 1.000 60.34945 O ? M ? . O5 1
   HETATM 2911 O . HOH B 303 ? 20.72660 -31.35065 2.49176 0.847 36.32745 O ? N ? . O 1
   HETATM 2912 O . HOH B 304 ? 42.09388 -25.16726 18.99440 0.622 21.46477 O ? N ? . O 1
   HETATM 2913 O . HOH B 305 ? 48.15063 -13.35831 6.17075 0.564 24.54013 O ? N ? . O 1
   HETATM 2914 O . HOH B 306 ? 40.21840 -19.91527 23.50140 0.980 26.18892 O ? N ? . O 1
   HETATM 2917 O . HOH B 310 ? 28.53098 -19.54891 19.53419 1.000 48.28230 O ? N ? . O 1
   HETATM 2918 O . HOH B 311 ? 29.29414 -12.84937 16.93836 0.815 24.67668 O ? N ? . O 1
   HETATM 2920 O . HOH B 314 ? 38.58719 -11.96484 28.76119 0.855 24.20804 O ? N ? . O 1
   HETATM 2921 O . HOH B 315 ? 50.74587 -5.75089 7.61879 0.894 20.00945 O ? N ? . O 1
   HETATM 2922 O . HOH B 316 ? 44.49201 -24.39771 16.42840 0.684 20.04089 O ? N ? . O 1
   HETATM 2923 O . HOH B 317 ? 33.56729 -9.97212 19.00119 1.000 16.77655 O ? N ? . O 1
   HETATM 2924 O . HOH B 319 ? 48.10727 -23.68780 15.67224 1.000 30.30195 O ? N ? . O 1
   HETATM 2925 O . HOH B 320 ? 37.66250 -24.36793 6.35320 0.885 16.50984 O ? N ? . O 1
   HETATM 2926 O . HOH B 321 ? 36.90295 -17.95950 -9.27993 0.782 24.89460 O ? N ? . O 1
   HETATM 2927 O . HOH B 322 ? 35.09268 -21.62508 20.05551 0.996 28.11756 O ? N ? . O 1
   HETATM 2928 O . HOH B 323 ? 41.68101 -6.59797 -1.97016 0.871 46.47153 O ? N ? . O 1
   HETATM 2929 O . HOH B 324 ? 44.21054 -28.45025 7.14540 0.710 25.51573 O ? N ? . O 1
   HETATM 2930 O . HOH B 326 ? 46.18618 -19.56918 25.93529 0.935 28.23378 O ? N ? . O 1
   HETATM 2932 O . HOH B 328 ? 45.20274 -13.95541 3.40664 1.000 27.22770 O ? N ? . O 1
   HETATM 2933 O . HOH B 329 ? 28.19340 -24.06055 2.02935 0.790 35.78500 O ? N ? . O 1
   HETATM 2934 O . HOH B 330 ? 24.99123 -13.84701 3.36718 1.000 17.47113 O ? N ? . O 1
   HETATM 2935 O . HOH B 331 ? 51.20078 -11.70602 7.38198 0.566 23.63493 O ? N ? . O 1
   HETATM 2936 O . HOH B 332 ? 35.11195 -5.10726 15.27365 0.982 24.81049 O ? N ? . O 1
   HETATM 2937 O . HOH B 333 ? 45.85958 -7.88049 19.65345 0.927 24.74718 O ? N ? . O 1
   HETATM 2938 O . HOH B 334 ? 29.65519 -17.80402 -1.36270 0.987 20.34610 O ? N ? . O 1
   HETATM 2940 O . HOH B 336 ? 42.31003 -4.02036 8.00155 0.991 21.25695 O ? N ? . O 1
   HETATM 2941 O . HOH B 337 ? 23.46271 -9.43886 7.46866 0.944 22.70822 O ? N ? . O 1
   HETATM 2942 O . HOH B 338 ? 54.81978 -15.43882 22.16011 1.000 42.76494 O ? N ? . O 1
   HETATM 2943 O . HOH B 339 ? 27.17509 -14.76738 4.95706 1.000 16.79773 O ? N ? . O 1
   HETATM 2944 O . HOH B 340 ? 41.50807 -12.91467 28.95928 0.999 47.49075 O ? N ? . O 1
   HETATM 2945 O . HOH B 341 ? 35.34326 -19.75899 22.57739 0.955 38.82417 O ? N ? . O 1
   HETATM 2949 O . HOH B 345 ? 33.67708 -2.69667 17.73884 0.999 46.38109 O ? N ? . O 1
   HETATM 2950 O . HOH B 346 ? 26.92771 -13.70892 12.48603 1.000 18.52612 O ? N ? . O 1
   HETATM 2952 O . HOH B 349 ? 21.70399 -10.96127 -2.26033 0.874 40.31366 O ? N ? . O 1
   HETATM 2953 O . HOH B 350 ? 48.26999 -4.73940 20.34533 0.922 31.77695 O ? N ? . O 1
   HETATM 2954 O . HOH B 351 ? 19.03206 -14.91894 7.99457 0.904 32.56998 O ? N ? . O 1
   HETATM 2955 O . HOH B 353 ? 41.71913 -4.93506 0.27889 0.680 25.73329 O ? N ? . O 1
   HETATM 2956 O . HOH B 354 ? 47.95933 2.35265 10.02060 0.944 26.08317 O ? N ? . O 1
   HETATM 2959 O . HOH B 357 ? 25.59125 -20.83523 1.46093 0.977 34.87485 O ? N ? . O 1
   HETATM 2960 O . HOH B 358 ? 39.70634 -17.52907 1.14458 0.518 22.30520 O ? N ? . O 1
   HETATM 2961 O . HOH B 359 ? 23.25986 -5.14663 14.11164 1.000 36.51250 O ? N ? . O 1
   HETATM 2962 O . HOH B 360 ? 41.41568 -2.77196 12.70644 1.000 24.85342 O ? N ? . O 1
   HETATM 2963 O . HOH B 361 ? 37.16065 -3.42616 14.90208 0.855 35.16127 O ? N ? . O 1
   HETATM 2964 O . HOH B 362 ? 45.47797 -19.03653 5.88590 0.901 35.94177 O ? N ? . O 1
   HETATM 2965 O . HOH B 363 ? 45.02481 -11.21991 -0.70879 0.935 42.02303 O ? N ? . O 1
   HETATM 2969 O . HOH B 367 ? 53.40598 -14.47816 8.37734 0.996 37.16669 O ? N ? . O 1
   HETATM 2971 O . HOH B 370 ? 40.64076 -2.44594 0.92216 0.850 29.29064 O ? N ? . O 1
   HETATM 2972 O . HOH B 371 ? 19.55838 -11.78779 7.62539 0.894 32.12116 O ? N ? . O 1
   HETATM 2973 O . HOH B 372 ? 27.49374 -19.68755 -0.92777 1.000 22.61683 O ? N ? . O 1
   HETATM 2974 O . HOH B 373 ? 47.16902 -11.46028 27.54144 1.000 48.56916 O ? N ? . O 1
   HETATM 2975 O . HOH B 374 ? 45.66991 -14.15085 6.02278 0.991 26.24591 O ? N ? . O 1
   HETATM 2979 O . HOH B 378 ? 23.40490 -8.26033 -0.27919 0.802 43.57209 O ? N ? . O 1
   HETATM 2983 O . HOH B 382 ? 47.77327 -0.08486 0.87089 1.000 43.66991 O ? N ? . O 1
   HETATM 2985 O . HOH B 384 ? 23.36108 -20.05025 14.60689 1.000 47.44482 O ? N ? . O 1
   HETATM 2988 O . HOH B 388 ? 40.55473 -2.27089 18.49266 1.000 44.25150 O ? N ? . O 1
   HETATM 2989 O . HOH B 389 ? 54.25463 -9.72180 25.34290 1.000 48.18462 O ? N ? . O 1
   HETATM 2992 O . HOH B 393 ? 23.01203 -13.55032 10.56147 1.000 39.27283 O ? N ? . O 1
   HETATM 2994 O . HOH B 395 ? 46.65481 -16.77944 6.12566 0.824 33.75187 O ? N ? . O 1
   HETATM 2998 O . HOH B 400 ? 21.93398 -8.11508 9.21446 1.000 41.79572 O ? N ? . O 1
   HETATM 3001 O . HOH B 403 ? 21.51754 -11.51046 9.98331 1.000 52.32643 O ? N ? . O 1
   HETATM 3363 O . HOH S 417 ? 2.50870 -2.31416 19.79498 0.988 33.93469 O ? O ? . O 1
   HETATM 3366 O . HOH S 420 ? 19.93051 14.66099 5.86826 0.479 24.82104 O ? O ? . O 1
   HETATM 3367 O . HOH S 421 ? 33.62212 -17.20360 21.45571 0.642 27.93736 O ? O ? . O 1
   HETATM 3368 O . HOH S 422 ? 39.63340 7.49018 3.95725 0.705 30.65224 O ? O ? . O 1
   HETATM 3369 O . HOH S 423 ? 18.89186 21.97155 18.93614 0.609 31.36569 O ? O ? . O 1
   HETATM 3371 O . HOH S 425 ? 36.30405 -23.97185 2.28230 0.751 30.16535 O ? O ? . O 1
   HETATM 3374 O . HOH S 428 ? 4.32890 19.84817 9.60927 0.626 34.26442 O ? O ? . O 1
   HETATM 3379 O . HOH S 433 ? 40.14782 -14.68126 -4.92067 0.651 34.14609 O ? O ? . O 1
   HETATM 3380 O . HOH S 434 ? 10.70138 -2.97214 24.63481 0.518 24.85159 O ? O ? . O 1
   HETATM 3383 O . HOH S 437 ? 36.40277 -4.41622 19.26422 0.890 42.63288 O ? O ? . O 1
   HETATM 3385 O . HOH S 439 ? 3.35070 3.94563 24.37865 0.574 25.58267 O ? O ? . O 1
   HETATM 3386 O . HOH S 440 ? 19.24615 9.70606 26.85349 0.983 43.23191 O ? O ? . O 1
   HETATM 3388 O . HOH S 442 ? 41.69456 -25.90806 16.64926 0.871 39.93434 O ? O ? . O 1
   HETATM 3389 O . HOH S 443 ? 14.78842 11.90729 28.54033 1.000 53.73662 O ? O ? . O 1
   HETATM 3392 O . HOH S 446 ? 34.54344 0.86126 13.67227 0.505 26.84003 O ? O ? . O 1
   HETATM 3393 O . HOH S 447 ? 24.16318 -6.17590 -1.87777 0.987 53.63105 O ? O ? . O 1
   HETATM 3395 O . HOH S 449 ? 4.62037 2.07002 21.88985 0.816 41.31687 O ? O ? . O 1
   HETATM 3399 O . HOH S 453 ? 38.18040 -2.80828 18.76435 1.000 51.23818 O ? O ? . O 1
   HETATM 3400 O . HOH S 454 ? 14.83561 -5.90456 8.58585 1.000 52.33067 O ? O ? . O 1
   HETATM 3407 O . HOH S 461 ? 52.32878 -20.05859 11.23837 0.605 35.69168 O ? O ? . O 1
   HETATM 3414 O . HOH S 468 ? 39.19124 2.04654 18.16437 0.997 43.82837 O ? O ? . O 1
   HETATM 3418 O . HOH S 472 ? 27.90279 11.46658 0.58907 0.885 39.15987 O ? O ? . O 1
   HETATM 3419 O . HOH S 473 ? 10.30152 10.19300 5.22553 0.679 36.21837 O ? O ? . O 1
   HETATM 3422 O . HOH S 476 ? 50.50055 -11.09210 5.02096 0.579 26.42021 O ? O ? . O 1
   HETATM 3428 O . HOH S 482 ? 11.89371 12.90155 7.20148 0.986 42.27703 O ? O ? . O 1
   HETATM 3430 O . HOH S 484 ? 44.90500 -0.00000 -0.28602 1.000 43.00149 O ? O ? . O 1
   HETATM 3434 O . HOH S 488 ? 34.86137 8.22892 23.11466 0.711 42.55194 O ? O ? . O 1
   HETATM 3438 O . HOH S 492 ? 19.87439 -10.49851 11.72838 0.926 49.27629 O ? O ? . O 1
   HETATM 3445 O . HOH S 499 ? 16.58856 6.66566 25.78247 0.666 33.93781 O ? O ? . O 1
   HETATM 3446 O . HOH S 500 ? 48.10459 -2.64610 18.69897 0.507 28.15388 O ? O ? . O 1
   HETATM 3450 O . HOH S 504 ? 48.50586 -16.53779 3.70317 0.920 47.78626 O ? O ? . O 1
   HETATM 3457 O . HOH S 511 ? 33.39678 -10.98105 -4.19231 0.416 22.90203 O ? O ? . O 1
   HETATM 3462 O . HOH S 516 ? 49.63598 -10.54282 27.80430 1.000 59.23624 O ? O ? . O 1
   HETATM 3473 O . HOH S 527 ? 22.50168 -6.63328 1.80614 0.489 26.59835 O ? O ? . O 1
   HETATM 3476 O . HOH S 530 ? 22.60592 -8.64044 11.90983 0.420 26.85666 O ? O ? . O 1
   HETATM 3516 O . HOH S 534 ? 14.10542 11.58760 4.04915 0.641 26.34611 O ? P ? . O 1
   HETATM 3520 O . HOH S 538 ? 11.81920 16.57978 28.17973 0.550 36.88656 O ? P ? . O 1
   HETATM 3521 O . HOH S 539 ? 21.50757 -26.75281 8.58687 0.684 33.00504 O ? P ? . O 1
   HETATM 3522 O . HOH S 540 ? 15.77935 -5.50867 25.77891 1.000 48.94777 O ? P ? . O 1
   HETATM 3524 O . HOH S 542 ? 27.94600 -21.99436 -2.02335 1.000 51.99159 O ? P ? . O 1
   HETATM 3525 O . HOH S 543 ? 33.06853 16.33042 12.40759 0.995 42.10174 O ? P ? . O 1
   HETATM 3527 O . HOH S 545 ? 49.21173 -8.73809 26.24130 0.696 39.35935 O ? P ? . O 1
   HETATM 3532 O . HOH S 550 ? 16.98331 21.56604 9.80499 0.973 51.49147 O ? P ? . O 1
   HETATM 3535 O . HOH S 553 ? 36.70326 -19.59154 -2.54332 0.857 37.42635 O ? P ? . O 1
   HETATM 3540 O . HOH S 558 ? 39.08820 -6.04998 -1.68297 0.634 46.34275 O ? P ? . O 1
   HETATM 3542 O . HOH S 560 ? 39.23945 -1.96762 14.01755 0.678 36.99125 O ? P ? . O 1
   HETATM 3551 O . HOH S 569 ? 45.39633 -7.60858 -5.86177 0.997 64.63332 O ? P ? . O 1
   HETATM 3553 O . HOH S 571 ? 36.77009 -2.29289 20.84706 1.000 54.26182 O ? P ? . O 1
   HETATM 3555 O . HOH S 573 ? 37.39675 9.19679 2.52580 1.000 54.85979 O ? P ? . O 1
   HETATM 3559 O . HOH S 577 ? 45.16374 -15.06593 -0.72873 0.592 36.56462 O ? P ? . O 1
   HETATM 3563 O . HOH S 581 ? 21.25643 6.09570 -1.01511 0.696 50.71422 O ? P ? . O 1
   HETATM 3566 O . HOH S 584 ? 8.28639 3.02050 1.66175 0.688 37.45295 O ? P ? . O 1
   HETATM 3575 O . HOH S 593 ? 49.22470 -2.01229 -0.09134 0.692 45.65976 O ? P ? . O 1
   HETATM 3579 O . HOH S 597 ? 20.35597 -6.87727 10.70085 0.895 37.34780 O ? P ? . O 1
   HETATM 3585 O . HOH S 603 ? 52.24954 -9.83984 28.15868 1.000 60.50389 O ? P ? . O 1
   HETATM 3589 O . HOH S 607 ? 3.85992 15.23873 29.85719 0.531 36.21201 O ? P ? . O 1
   HETATM 3598 O . HOH S 616 ? 4.75050 10.17567 9.81436 0.402 30.91703 O ? P ? . O 1
   HETATM 3599 O . HOH S 617 ? 51.61155 -11.82041 2.78437 0.739 40.58885 O ? P ? . O 1
   HETATM 3604 O . HOH S 622 ? 53.77758 -24.12022 7.54041 0.709 45.39463 O ? P ? . O 1
   HETATM 3626 O . HOH S 623 ? 46.35397 -1.18667 10.81526 0.542 19.07879 O ? Q ? . O 1
   HETATM 3627 O . HOH S 624 ? 20.03223 7.21988 -2.78974 0.603 30.40575 O ? Q ? . O 1
   HETATM 3630 O . HOH S 627 ? 43.92082 -1.18300 12.58396 0.431 24.39024 O ? Q ? . O 1
   HETATM 3634 O . HOH S 631 ? 32.30018 7.30785 0.52932 0.593 41.08121 O ? Q ? . O 1
   HETATM 3637 O . HOH S 634 ? 12.23533 22.94785 12.32441 0.523 34.50020 O ? Q ? . O 1
   HETATM 3643 O . HOH S 640 ? 19.17433 -7.85313 8.07012 0.456 38.27787 O ? Q ? . O 1
   HETATM 3648 O . HOH S 645 ? 13.77282 -4.80796 27.04002 0.585 40.47048 O ? Q ? . O 1
   HETATM 3657 O . HOH S 654 ? 23.29739 7.36510 -2.29684 0.635 42.54699 O ? Q ? . O 1
   HETATM 3658 O . HOH S 655 ? 40.96087 -20.22839 0.53150 0.525 36.39293 O ? Q ? . O 1
   HETATM 3666 O . HOH S 663 ? 33.51209 6.89761 18.14033 0.295 18.19371 O ? Q ? . O 1
   HETATM 3683 O . HOH S 680 ? 36.03786 -5.09717 -1.34607 0.431 39.03006 O ? Q ? . O 1
   HETATM 3699 O . HOH S 696 ? 49.80757 -12.84048 1.14014 0.390 30.30066 O ? Q ? . O 1
   HETATM 3702 O . HOH S 699 ? 36.76295 0.96483 17.71760 0.410 36.85638 O ? Q ? . O 1
   HETATM 3705 O . HOH S 702 ? 19.00916 -10.05423 9.44329 0.287 33.35137 O ? Q ? . O 1
   HETATM 3708 O . HOH S 705 ? 52.06478 -17.69630 10.12921 0.442 32.60275 O ? Q ? . O 1
   HETATM 3721 O . HOH S 706 ? 31.69492 -3.66142 16.07765 0.547 24.70689 O ? R ? . O 1
   HETATM 3724 O . HOH S 709 ? 0.89102 9.29601 14.47703 0.570 30.33723 O ? R ? . O 1
   HETATM 3725 O . HOH S 710 ? 20.64301 -5.86370 13.66167 0.432 34.72713 O ? R ? . O 1
   HETATM 3735 O . HOH S 720 ? 38.92941 -19.79568 -0.99013 0.460 32.18271 O ? R ? . O 1
   HETATM 3740 O . HOH S 725 ? 29.66248 14.65540 27.87200 0.477 40.24143 O ? R ? . O 1
   HETATM 3744 O . HOH S 729 ? 40.58255 -10.77689 -7.56331 0.246 31.93935 O ? R ? . O 1
   HETATM 3745 O . HOH S 730 ? 46.99271 -27.47168 3.82261 0.523 37.85605 O ? R ? . O 1
   HETATM 3758 O . HOH S 743 ? 26.32577 19.16534 16.49761 0.369 31.29126 O ? R ? . O 1
   HETATM 3767 O . HOH S 752 ? 45.88937 -19.80987 3.41461 0.467 33.74222 O ? R ? . O 1
   HETATM 3770 O . HOH S 755 ? 31.85432 17.07865 4.62901 0.532 36.38198 O ? R ? . O 1
   HETATM 3784 O . HOH S 769 ? 16.89292 -4.41527 9.24039 0.274 33.62329 O ? R ? . O 1
   HETATM 3786 O . HOH S 771 ? 5.36694 0.89643 8.66919 0.418 34.05350 O ? R ? . O 1
   HETATM 3787 O . HOH S 772 ? 22.82585 4.44026 -2.08977 0.290 41.71230 O ? R ? . O 1
   HETATM 3797 O . HOH S 782 ? 47.28055 -24.51780 18.27197 0.229 17.20556 O ? R ? . O 1
   HETATM 3819 O . HOH S 792 ? 30.64457 16.99605 27.31034 0.446 41.23534 O ? S ? . O 1
   HETATM 3835 O . HOH S 808 ? 38.48966 -23.38787 0.67810 0.381 32.04956 O ? S ? . O 1
   HETATM 3847 O . HOH S 820 ? 32.60017 17.32370 14.82467 0.396 28.90358 O ? S ? . O 1
   HETATM 3869 O . HOH S 842 ? 42.03639 4.33328 15.53401 0.243 34.56085 O ? S ? . O 1
   HETATM 3871 O . HOH S 844 ? 7.83765 12.43829 4.13456 0.325 40.16759 O ? S ? . O 1
   HETATM 3880 O . HOH S 853 ? 29.54781 2.82505 25.02676 0.457 40.78843 O ? S ? . O 1

data_comp_KXX
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
   KXX C16 C C 0 0.183 23.5629 4.1906 7.4279
   KXX C18 C C 0 0.226 23.5841 4.0190 8.9474
   KXX C14 C CT 0 0.322 24.3400 3.1965 6.5226
   KXX C10 C CH1 0 0.114 23.7416 1.0153 5.6259
   KXX C13 C CH1 0 -0.048 25.6297 2.6550 7.1427
   KXX C12 C CH2 0 -0.212 26.0769 1.3987 6.3923
   KXX C11 C CH1 0 0.024 24.9588 0.3642 6.2731
   KXX C03 C CH1 0 0.070 23.1551 -4.9159 7.8960
   KXX C04 C C1 0 -0.314 22.3888 -3.9371 7.0378
   KXX C05 C C 0 0.070 21.1050 -3.5794 7.1403
   KXX C06 C CH2 0 -0.181 20.5415 -2.4876 6.2639
   KXX C07 C CH1 0 0.103 20.6625 -1.0904 6.9241
   KXX C08 C CH2 0 -0.429 22.0893 -0.5168 6.8313
   KXX C09 C CH1 0 0.268 22.4453 0.1903 5.5318
   KXX C21 C CH2 0 -0.218 21.4715 2.7238 8.8695
   KXX C22 C CH2 0 -0.183 20.1447 3.2944 9.3532
   KXX C23 C CH2 0 -0.176 20.0434 3.2087 10.8749
   KXX C24 C CH2 0 -0.191 21.2344 3.9089 11.5259
   KXX C25 C CH1 0 0.063 22.5686 3.3425 11.0219
   KXX C26 C C 0 0.272 22.8838 1.9857 11.6531
   KXX C29 C CH1 0 0.145 23.8659 -0.1847 11.3631
   KXX C30 C CH1 0 -0.098 23.1954 -1.3061 10.5592
   KXX C31 C CH1 0 0.189 23.7315 -2.6685 11.0526
   KXX C32 C CH2 0 -0.245 23.2244 -3.8472 10.2379
   KXX C33 C C 0 0.208 23.9098 -4.0564 8.9091
   KXX C36 C CH3 0 -0.463 21.6746 -1.2006 10.6672
   KXX C37 C C 0 -0.031 25.3725 -0.1952 11.3579
   KXX C38 C C1 0 -0.096 26.0002 -0.3166 12.5305
   KXX C39 C CH1 0 0.014 27.4687 -0.4476 12.7880
   KXX C40 C CH2 0 -0.248 27.7945 -1.8613 13.3046
   KXX C41 C CH2 0 -0.141 29.2768 -2.0092 13.6455
   KXX C42 C CH1 0 0.130 29.7172 -0.9572 14.6492
   KXX C43 C CH1 0 0.113 29.4221 0.4422 14.1301
   KXX C44 C CH2 0 -0.259 27.9405 0.6058 13.8041
   KXX C48 C CH3 0 -0.477 26.0400 -0.1067 10.0170
   KXX C50 C CH3 0 -0.402 26.7427 3.6957 7.2146
   KXX C55 C CH3 0 -0.450 19.5973 -0.1337 6.3869
   KXX C56 C CH3 0 -0.411 20.1293 -4.1591 8.1253
   KXX N20 N NT 0 -0.010 22.6029 3.3503 9.5619
   KXX O15 O O2 0 -0.351 23.3651 2.1711 6.3970
   KXX O17 O O 0 -0.318 23.0072 5.1459 6.9402
   KXX O19 O O 0 -0.447 24.5263 4.5825 9.5071
   KXX O27 O O 0 -0.403 22.6991 1.7912 12.8336
   KXX O28 O O2 0 -0.306 23.4116 1.1035 10.8080
   KXX O34 O O 0 -0.402 24.9987 -3.5757 8.6585
   KXX O35 O OH1 0 -0.530 23.3605 -2.9196 12.4183
   KXX O45 O O2 0 -0.378 29.8656 1.3515 15.1401
   KXX O47 O OH1 0 -0.519 31.1144 -1.1197 14.9047
   KXX O49 O OH1 0 -0.485 24.6132 3.8002 5.2977
   KXX O51 O O2 0 -0.365 25.3435 -0.7342 5.4588
   KXX O53 O O2 0 -0.378 22.4955 -0.7565 4.4682
   KXX H1 H HCH1 0 0.072 24.0209 1.3383 4.6191
   KXX H2 H HCH1 0 0.124 25.3624 2.3554 8.1585
   KXX H3 H HCH2 0 0.125 26.9312 0.9703 6.9187
   KXX H4 H HCH2 0 0.100 26.4120 1.6643 5.3856
   KXX H5 H HCH1 0 0.116 24.6876 0.0016 7.2709
   KXX H6 H HCH3 0 0.122 25.4425 -7.4826 7.2532
   KXX H7 H HCH3 0 0.119 25.4283 -6.4181 8.6599
   KXX H8 H HCH3 0 0.115 24.0793 -7.5218 8.3756
   KXX H11 H HCH1 0 0.092 22.4623 -5.5517 8.4489
   KXX H12 H H 0 0.145 22.9975 -3.4482 6.2825
   KXX H13 H HCH2 0 0.099 19.4836 -2.6927 6.0770
   KXX H14 H HCH2 0 0.118 21.0475 -2.4630 5.3001
   KXX H15 H HCH1 0 0.071 20.4605 -1.2223 7.9900
   KXX H16 H HCH2 0 0.148 22.8118 -1.3118 7.0189
   KXX H17 H HCH2 0 0.165 22.2244 0.2109 7.6317
   KXX H18 H HCH1 0 0.076 21.6679 0.9265 5.3007
   KXX H19 H HCH2 0 0.165 21.5955 2.8523 7.7995
   KXX H20 H HCH2 0 0.133 21.5116 1.6526 9.0706
   KXX H21 H HCH2 0 0.106 20.0608 4.3373 9.0335
   KXX H22 H HCH2 0 0.118 19.3369 2.7365 8.8756
   KXX H23 H HCH2 0 0.112 19.1131 3.6616 11.2221
   KXX H24 H HCH2 0 0.108 20.0209 2.1569 11.1801
   KXX H25 H HCH2 0 0.118 21.2062 3.8188 12.6104
   KXX H26 H HCH2 0 0.114 21.2161 4.9732 11.2798
   KXX H27 H HCH1 0 0.126 23.3821 3.9882 11.3556
   KXX H28 H HCH1 0 0.117 23.5110 -0.2237 12.3887
   KXX H29 H HCH1 0 0.157 23.4896 -1.2072 9.5112
   KXX H30 H HCH1 0 0.115 24.8196 -2.6578 10.9810
   KXX H31 H HCH2 0 0.162 22.1449 -3.8198 10.0991
   KXX H32 H HCH2 0 0.131 23.4242 -4.7669 10.8018
   KXX H33 H HCH3 0 0.144 21.3247 -0.2342 10.3087
   KXX H34 H HCH3 0 0.144 21.1820 -1.9638 10.0687
   KXX H35 H HCH3 0 0.116 21.3541 -1.3190 11.7031
   KXX H36 H H 0 0.141 25.3842 -0.3653 13.4270
   KXX H37 H HCH1 0 0.062 28.0261 -0.2962 11.8608
   KXX H38 H HCH2 0 0.101 27.1885 -2.0613 14.1948
   KXX H39 H HCH2 0 0.114 27.5075 -2.5993 12.5529
   KXX H40 H HCH2 0 0.104 29.4803 -3.0020 14.0530
   KXX H41 H HCH2 0 0.089 29.8798 -1.8985 12.7386
   KXX H42 H HCH1 0 0.062 29.1590 -1.0922 15.5862
   KXX H43 H HCH1 0 0.061 30.0229 0.6049 13.2244
   KXX H44 H HCH2 0 0.118 27.7510 1.6062 13.4110
   KXX H45 H HCH2 0 0.097 27.3654 0.5036 14.7302
   KXX H46 H HCH3 0 0.134 30.5138 3.2367 15.5113
   KXX H47 H HCH3 0 0.116 30.8211 2.6729 13.8492
   KXX H48 H HCH3 0 0.121 29.1792 3.1571 14.3411
   KXX H49 H HCH3 0 0.133 27.1208 -0.0208 10.0971
   KXX H50 H HCH3 0 0.156 25.8142 -0.9849 9.4075
   KXX H51 H HCH3 0 0.124 25.6698 0.7618 9.4715
   KXX H52 H HCH3 0 0.125 26.4110 4.6008 7.7230
   KXX H53 H HCH3 0 0.126 27.5890 3.2876 7.7698
   KXX H54 H HCH3 0 0.119 27.0868 3.9641 6.2156
   KXX H55 H HCH3 0 0.133 26.3612 -2.4849 5.4153
   KXX H56 H HCH3 0 0.122 27.2225 -1.1844 6.2639
   KXX H57 H HCH3 0 0.131 25.8361 -1.9923 7.0403
   KXX H58 H HCH3 0 0.133 22.2175 -1.0362 2.4813
   KXX H59 H HCH3 0 0.113 21.2742 0.3104 3.1681
   KXX H60 H HCH3 0 0.120 23.0200 0.4972 2.8760
   KXX H61 H HCH3 0 0.133 19.7091 0.8652 6.8157
   KXX H62 H HCH3 0 0.134 19.6494 -0.0412 5.2997
   KXX H63 H HCH3 0 0.122 18.6005 -0.5009 6.6396
   KXX H64 H HCH3 0 0.131 20.5587 -4.9263 8.7652
   KXX H65 H HCH3 0 0.136 19.7181 -3.3734 8.7661
   KXX H66 H HCH3 0 0.136 19.2811 -4.5948 7.5887
   KXX H67 H HOH1 0 0.335 23.9581 -2.4273 12.9938
   KXX H68 H HOH1 0 0.331 31.3940 -0.3409 15.4059
   KXX H69 H HOH1 0 0.335 23.8793 4.4016 5.0923
   KXX C02 C CH2 0 -0.195 24.0906 -5.7941 7.0608
   KXX C46 C CH3 0 -0.195 30.1016 2.6728 14.6756
   KXX C01 C CH3 0 -0.381 24.8016 -6.8644 7.8847
   KXX C52 C CH3 0 -0.217 26.2416 -1.6375 6.0895
   KXX C54 C CH3 0 -0.205 22.2408 -0.2063 3.1865
   KXX H9 H HCH2 0 0.106 23.4944 -6.2656 6.2754
   KXX H10 H HCH2 0 0.101 24.8215 -5.1547 6.5605

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
   KXX C54 O53 single 1.418 0.020 1.418
   KXX O53 C09 single 1.425 0.020 1.425
   KXX O49 C14 single 1.393 0.020 1.393
   KXX O51 C52 single 1.421 0.020 1.421
   KXX O51 C11 single 1.420 0.020 1.420
   KXX C09 C10 single 1.539 0.020 1.539
   KXX C09 C08 single 1.522 0.020 1.522
   KXX C10 C11 single 1.525 0.020 1.525
   KXX C10 O15 single 1.440 0.020 1.440
   KXX C55 C07 single 1.529 0.020 1.529
   KXX C11 C12 single 1.528 0.020 1.528
   KXX C06 C07 single 1.550 0.020 1.550
   KXX C06 C05 single 1.509 0.020 1.509
   KXX O15 C14 single 1.420 0.020 1.420
   KXX C12 C13 single 1.530 0.020 1.530
   KXX C14 C13 single 1.530 0.020 1.530
   KXX C14 C16 single 1.553 0.020 1.553
   KXX O17 C16 double 1.208 0.020 1.208
   KXX C07 C08 single 1.541 0.020 1.541
   KXX C50 C13 single 1.525 0.020 1.525
   KXX C04 C05 double 1.337 0.020 1.337
   KXX C04 C03 single 1.511 0.020 1.511
   KXX C05 C56 single 1.503 0.020 1.503
   KXX C16 C18 single 1.529 0.020 1.529
   KXX C02 C03 single 1.531 0.020 1.531
   KXX C02 C01 single 1.526 0.020 1.526
   KXX C03 C33 single 1.528 0.020 1.528
   KXX C18 O19 double 1.232 0.020 1.232
   KXX C18 N20 single 1.337 0.020 1.337
   KXX O34 C33 double 1.216 0.020 1.216
   KXX C21 N20 single 1.467 0.020 1.467
   KXX C21 C22 single 1.523 0.020 1.523
   KXX C33 C32 single 1.510 0.020 1.510
   KXX N20 C25 single 1.460 0.020 1.460
   KXX C22 C23 single 1.528 0.020 1.528
   KXX C48 C37 single 1.500 0.020 1.500
   KXX C32 C31 single 1.520 0.020 1.520
   KXX C36 C30 single 1.528 0.020 1.528
   KXX C30 C31 single 1.545 0.020 1.545
   KXX C30 C29 single 1.534 0.020 1.534
   KXX O28 C29 single 1.474 0.020 1.474
   KXX O28 C26 single 1.331 0.020 1.331
   KXX C25 C26 single 1.529 0.020 1.529
   KXX C25 C24 single 1.535 0.020 1.535
   KXX C23 C24 single 1.527 0.020 1.527
   KXX C31 O35 single 1.437 0.020 1.437
   KXX C29 C37 single 1.507 0.020 1.507
   KXX C37 C38 double 1.336 0.020 1.336
   KXX C26 O27 double 1.211 0.020 1.211
   KXX C38 C39 single 1.497 0.020 1.497
   KXX C39 C40 single 1.540 0.020 1.540
   KXX C39 C44 single 1.538 0.020 1.538
   KXX C40 C41 single 1.528 0.020 1.528
   KXX C41 C42 single 1.519 0.020 1.519
   KXX C44 C43 single 1.526 0.020 1.526
   KXX C43 C42 single 1.522 0.020 1.522
   KXX C43 O45 single 1.430 0.020 1.430
   KXX C42 O47 single 1.430 0.020 1.430
   KXX C46 O45 single 1.420 0.020 1.420
   KXX C10 H1 single 0.970 0.020 1.090
   KXX C13 H2 single 0.970 0.020 1.090
   KXX C12 H3 single 0.970 0.020 1.090
   KXX C12 H4 single 0.970 0.020 1.090
   KXX C11 H5 single 0.970 0.020 1.090
   KXX C01 H6 single 0.970 0.020 1.090
   KXX C01 H7 single 0.970 0.020 1.090
   KXX C01 H8 single 0.970 0.020 1.090
   KXX C02 H9 single 0.970 0.020 1.090
   KXX C02 H10 single 0.970 0.020 1.090
   KXX C03 H11 single 0.970 0.020 1.090
   KXX C04 H12 single 0.930 0.020 1.080
   KXX C06 H13 single 0.970 0.020 1.090
   KXX C06 H14 single 0.970 0.020 1.090
   KXX C07 H15 single 0.970 0.020 1.090
   KXX C08 H16 single 0.970 0.020 1.090
   KXX C08 H17 single 0.970 0.020 1.090
   KXX C09 H18 single 0.970 0.020 1.090
   KXX C21 H19 single 0.970 0.020 1.090
   KXX C21 H20 single 0.970 0.020 1.090
   KXX C22 H21 single 0.970 0.020 1.090
   KXX C22 H22 single 0.970 0.020 1.090
   KXX C23 H23 single 0.970 0.020 1.090
   KXX C23 H24 single 0.970 0.020 1.090
   KXX C24 H25 single 0.970 0.020 1.090
   KXX C24 H26 single 0.970 0.020 1.090
   KXX C25 H27 single 0.970 0.020 1.090
   KXX C29 H28 single 0.970 0.020 1.090
   KXX C30 H29 single 0.970 0.020 1.090
   KXX C31 H30 single 0.970 0.020 1.090
   KXX C32 H31 single 0.970 0.020 1.090
   KXX C32 H32 single 0.970 0.020 1.090
   KXX C36 H33 single 0.970 0.020 1.090
   KXX C36 H34 single 0.970 0.020 1.090
   KXX C36 H35 single 0.970 0.020 1.090
   KXX C38 H36 single 0.930 0.020 1.080
   KXX C39 H37 single 0.970 0.020 1.090
   KXX C40 H38 single 0.970 0.020 1.090
   KXX C40 H39 single 0.970 0.020 1.090
   KXX C41 H40 single 0.970 0.020 1.090
   KXX C41 H41 single 0.970 0.020 1.090
   KXX C42 H42 single 0.970 0.020 1.090
   KXX C43 H43 single 0.970 0.020 1.090
   KXX C44 H44 single 0.970 0.020 1.090
   KXX C44 H45 single 0.970 0.020 1.090
   KXX C46 H46 single 0.970 0.020 1.090
   KXX C46 H47 single 0.970 0.020 1.090
   KXX C46 H48 single 0.970 0.020 1.090
   KXX C48 H49 single 0.970 0.020 1.090
   KXX C48 H50 single 0.970 0.020 1.090
   KXX C48 H51 single 0.970 0.020 1.090
   KXX C50 H52 single 0.970 0.020 1.090
   KXX C50 H53 single 0.970 0.020 1.090
   KXX C50 H54 single 0.970 0.020 1.090
   KXX C52 H55 single 0.970 0.020 1.090
   KXX C52 H56 single 0.970 0.020 1.090
   KXX C52 H57 single 0.970 0.020 1.090
   KXX C54 H58 single 0.970 0.020 1.090
   KXX C54 H59 single 0.970 0.020 1.090
   KXX C54 H60 single 0.970 0.020 1.090
   KXX C55 H61 single 0.970 0.020 1.090
   KXX C55 H62 single 0.970 0.020 1.090
   KXX C55 H63 single 0.970 0.020 1.090
   KXX C56 H64 single 0.970 0.020 1.090
   KXX C56 H65 single 0.970 0.020 1.090
   KXX C56 H66 single 0.970 0.020 1.090
   KXX O35 H67 single 0.850 0.020 0.980
   KXX O47 H68 single 0.850 0.020 0.980
   KXX O49 H69 single 0.850 0.020 0.980

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
   KXX O17 C16 C14 120.07 3.000
   KXX O17 C16 C18 119.76 3.000
   KXX C14 C16 C18 120.03 3.000
   KXX O19 C18 N20 125.53 3.000
   KXX N20 C18 C16 120.18 3.000
   KXX O19 C18 C16 114.23 3.000
   KXX O49 C14 O15 111.70 3.000
   KXX O15 C14 C13 111.03 3.000
   KXX O49 C14 C13 110.15 3.000
   KXX C13 C14 C16 114.34 3.000
   KXX O15 C14 C16 99.80 3.000
   KXX O49 C14 C16 109.47 3.000
   KXX H1 C10 O15 108.83 3.000
   KXX H1 C10 C09 108.49 3.000
   KXX O15 C10 C09 104.05 3.000
   KXX H1 C10 C11 108.24 3.000
   KXX O15 C10 C11 108.92 3.000
   KXX C09 C10 C11 117.99 3.000
   KXX H2 C13 C50 108.77 3.000
   KXX H2 C13 C12 107.60 3.000
   KXX C50 C13 C12 111.72 3.000
   KXX H2 C13 C14 105.52 3.000
   KXX C50 C13 C14 113.12 3.000
   KXX C12 C13 C14 109.77 3.000
   KXX H4 C12 H3 107.43 3.000
   KXX H4 C12 C11 108.47 3.000
   KXX H3 C12 C11 110.17 3.000
   KXX H4 C12 C13 109.97 3.000
   KXX H3 C12 C13 108.34 3.000
   KXX C11 C12 C13 112.35 3.000
   KXX H5 C11 O51 109.46 3.000
   KXX H5 C11 C12 109.52 3.000
   KXX O51 C11 C12 111.73 3.000
   KXX H5 C11 C10 109.28 3.000
   KXX C12 C11 C10 109.16 3.000
   KXX O51 C11 C10 107.64 3.000
   KXX H11 C03 C33 107.79 3.000
   KXX H11 C03 C04 110.08 3.000
   KXX C33 C03 C04 105.23 3.000
   KXX H11 C03 C02 109.29 3.000
   KXX C33 C03 C02 112.49 3.000
   KXX C04 C03 C02 111.82 3.000
   KXX H12 C04 C05 118.11 3.000
   KXX H12 C04 C03 113.72 3.000
   KXX C05 C04 C03 128.10 3.000
   KXX C56 C05 C06 114.66 3.000
   KXX C56 C05 C04 124.80 3.000
   KXX C06 C05 C04 120.50 3.000
   KXX H14 C06 H13 107.61 3.000
   KXX H14 C06 C07 108.69 3.000
   KXX H13 C06 C07 108.50 3.000
   KXX H14 C06 C05 110.91 3.000
   KXX H13 C06 C05 108.95 3.000
   KXX C07 C06 C05 112.06 3.000
   KXX H15 C07 C55 106.82 3.000
   KXX H15 C07 C08 105.95 3.000
   KXX C55 C07 C08 113.02 3.000
   KXX H15 C07 C06 106.99 3.000
   KXX C08 C07 C06 112.47 3.000
   KXX C55 C07 C06 111.10 3.000
   KXX H17 C08 H16 106.16 3.000
   KXX H17 C08 C09 106.73 3.000
   KXX H16 C08 C09 109.31 3.000
   KXX H17 C08 C07 108.61 3.000
   KXX H16 C08 C07 109.37 3.000
   KXX C09 C08 C07 116.17 3.000
   KXX H18 C09 O53 108.30 3.000
   KXX H18 C09 C08 109.06 3.000
   KXX O53 C09 C08 109.70 3.000
   KXX H18 C09 C10 104.49 3.000
   KXX C08 C09 C10 113.19 3.000
   KXX O53 C09 C10 111.84 3.000
   KXX H20 C21 H19 107.10 3.000
   KXX H20 C21 N20 107.70 3.000
   KXX H19 C21 N20 109.08 3.000
   KXX H20 C21 C22 109.97 3.000
   KXX H19 C21 C22 111.62 3.000
   KXX N20 C21 C22 111.22 3.000
   KXX H22 C22 H21 107.62 3.000
   KXX H22 C22 C23 110.98 3.000
   KXX H21 C22 C23 109.85 3.000
   KXX H22 C22 C21 108.31 3.000
   KXX H21 C22 C21 109.34 3.000
   KXX C23 C22 C21 110.68 3.000
   KXX H24 C23 H23 107.00 3.000
   KXX H24 C23 C24 109.72 3.000
   KXX H23 C23 C24 109.81 3.000
   KXX H24 C23 C22 109.44 3.000
   KXX H23 C23 C22 110.50 3.000
   KXX C24 C23 C22 110.31 3.000
   KXX H26 C24 H25 107.74 3.000
   KXX H26 C24 C25 107.47 3.000
   KXX H25 C24 C25 108.61 3.000
   KXX H26 C24 C23 109.73 3.000
   KXX H25 C24 C23 111.50 3.000
   KXX C25 C24 C23 111.64 3.000
   KXX H27 C25 N20 106.57 3.000
   KXX H27 C25 C26 104.19 3.000
   KXX N20 C25 C26 114.36 3.000
   KXX H27 C25 C24 109.24 3.000
   KXX C26 C25 C24 111.79 3.000
   KXX N20 C25 C24 110.29 3.000
   KXX O28 C26 O27 124.98 3.000
   KXX O27 C26 C25 120.90 3.000
   KXX O28 C26 C25 114.07 3.000
   KXX H28 C29 O28 106.63 3.000
   KXX H28 C29 C37 109.26 3.000
   KXX O28 C29 C37 108.24 3.000
   KXX H28 C29 C30 109.01 3.000
   KXX C37 C29 C30 115.48 3.000
   KXX O28 C29 C30 107.86 3.000
   KXX H29 C30 C36 109.23 3.000
   KXX H29 C30 C31 107.01 3.000
   KXX C36 C30 C31 112.55 3.000
   KXX H29 C30 C29 108.59 3.000
   KXX C31 C30 C29 109.00 3.000
   KXX C36 C30 C29 110.34 3.000
   KXX H30 C31 O35 108.76 3.000
   KXX H30 C31 C32 107.77 3.000
   KXX O35 C31 C32 106.72 3.000
   KXX H30 C31 C30 108.46 3.000
   KXX O35 C31 C30 111.59 3.000
   KXX C32 C31 C30 113.39 3.000
   KXX H32 C32 H31 105.49 3.000
   KXX H32 C32 C33 104.69 3.000
   KXX H31 C32 C33 109.96 3.000
   KXX H32 C32 C31 108.29 3.000
   KXX H31 C32 C31 112.31 3.000
   KXX C33 C32 C31 115.33 3.000
   KXX O34 C33 C32 122.20 3.000
   KXX C32 C33 C03 115.93 3.000
   KXX O34 C33 C03 121.86 3.000
   KXX H35 C36 H34 108.26 3.000
   KXX H35 C36 H33 108.34 3.000
   KXX H34 C36 H33 107.23 3.000
   KXX H35 C36 C30 110.61 3.000
   KXX H34 C36 C30 111.31 3.000
   KXX H33 C36 C30 110.97 3.000
   KXX C48 C37 C38 125.51 3.000
   KXX C38 C37 C29 117.88 3.000
   KXX C48 C37 C29 116.59 3.000
   KXX H36 C38 C39 114.18 3.000
   KXX H36 C38 C37 117.45 3.000
   KXX C39 C38 C37 128.33 3.000
   KXX H37 C39 C44 108.02 3.000
   KXX H37 C39 C40 107.70 3.000
   KXX C44 C39 C40 110.01 3.000
   KXX H37 C39 C38 110.03 3.000
   KXX C44 C39 C38 110.78 3.000
   KXX C40 C39 C38 110.22 3.000
   KXX H39 C40 H38 106.90 3.000
   KXX H39 C40 C41 110.07 3.000
   KXX H38 C40 C41 109.74 3.000
   KXX H39 C40 C39 109.51 3.000
   KXX H38 C40 C39 108.86 3.000
   KXX C41 C40 C39 111.65 3.000
   KXX H41 C41 H40 107.36 3.000
   KXX H41 C41 C42 108.52 3.000
   KXX H40 C41 C42 109.20 3.000
   KXX H41 C41 C40 109.85 3.000
   KXX H40 C41 C40 110.60 3.000
   KXX C42 C41 C40 111.20 3.000
   KXX H42 C42 O47 109.27 3.000
   KXX H42 C42 C43 107.78 3.000
   KXX O47 C42 C43 110.80 3.000
   KXX H42 C42 C41 109.33 3.000
   KXX O47 C42 C41 108.82 3.000
   KXX C43 C42 C41 110.81 3.000
   KXX H43 C43 O45 108.58 3.000
   KXX H43 C43 C44 109.81 3.000
   KXX O45 C43 C44 112.58 3.000
   KXX H43 C43 C42 108.14 3.000
   KXX O45 C43 C42 106.49 3.000
   KXX C44 C43 C42 111.09 3.000
   KXX H45 C44 H44 107.39 3.000
   KXX H45 C44 C43 108.62 3.000
   KXX H44 C44 C43 110.11 3.000
   KXX H45 C44 C39 109.50 3.000
   KXX H44 C44 C39 109.67 3.000
   KXX C43 C44 C39 111.45 3.000
   KXX H51 C48 H50 106.92 3.000
   KXX H51 C48 H49 108.14 3.000
   KXX H50 C48 H49 108.06 3.000
   KXX H51 C48 C37 110.06 3.000
   KXX H50 C48 C37 111.05 3.000
   KXX H49 C48 C37 112.40 3.000
   KXX H54 C50 H53 108.28 3.000
   KXX H54 C50 H52 108.60 3.000
   KXX H53 C50 H52 108.01 3.000
   KXX H54 C50 C13 110.80 3.000
   KXX H53 C50 C13 109.55 3.000
   KXX H52 C50 C13 111.49 3.000
   KXX H63 C55 H62 107.60 3.000
   KXX H63 C55 H61 108.06 3.000
   KXX H62 C55 H61 107.96 3.000
   KXX H63 C55 C07 110.13 3.000
   KXX H62 C55 C07 111.67 3.000
   KXX H61 C55 C07 111.27 3.000
   KXX H66 C56 H65 106.37 3.000
   KXX H66 C56 H64 108.29 3.000
   KXX H65 C56 H64 108.08 3.000
   KXX H66 C56 C05 109.61 3.000
   KXX H65 C56 C05 110.54 3.000
   KXX H64 C56 C05 113.67 3.000
   KXX C25 N20 C21 116.84 3.000
   KXX C25 N20 C18 118.65 3.000
   KXX C21 N20 C18 124.24 3.000
   KXX C10 O15 C14 116.58 3.000
   KXX C29 O28 C26 117.54 3.000
   KXX H67 O35 C31 108.53 3.000
   KXX C46 O45 C43 114.34 3.000
   KXX H68 O47 C42 106.47 3.000
   KXX H69 O49 C14 107.84 3.000
   KXX C52 O51 C11 114.09 3.000
   KXX C54 O53 C09 114.25 3.000
   KXX H10 C02 H9 106.76 3.000
   KXX H10 C02 C03 108.84 3.000
   KXX H9 C02 C03 107.83 3.000
   KXX H10 C02 C01 110.24 3.000
   KXX H9 C02 C01 109.84 3.000
   KXX C03 C02 C01 113.10 3.000
   KXX H48 C46 H47 108.84 3.000
   KXX H48 C46 H46 108.93 3.000
   KXX H47 C46 H46 109.28 3.000
   KXX H48 C46 O45 111.82 3.000
   KXX H47 C46 O45 110.84 3.000
   KXX H46 C46 O45 107.07 3.000
   KXX H8 C01 H7 107.83 3.000
   KXX H8 C01 H6 107.89 3.000
   KXX H7 C01 H6 107.76 3.000
   KXX H8 C01 C02 110.87 3.000
   KXX H7 C01 C02 111.33 3.000
   KXX H6 C01 C02 110.99 3.000
   KXX H57 C52 H56 109.17 3.000
   KXX H57 C52 H55 109.07 3.000
   KXX H56 C52 H55 108.79 3.000
   KXX H57 C52 O51 110.97 3.000
   KXX H56 C52 O51 111.96 3.000
   KXX H55 C52 O51 106.80 3.000
   KXX H60 C54 H59 108.66 3.000
   KXX H60 C54 H58 108.73 3.000
   KXX H59 C54 H58 109.23 3.000
   KXX H60 C54 O53 112.20 3.000
   KXX H59 C54 O53 110.88 3.000
   KXX H58 C54 O53 107.07 3.000

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
   KXX CONST_01 C21 N20 C18 C16 0.00 0.0 0
   KXX CONST_02 C25 N20 C18 C16 180.00 0.0 0
   KXX CONST_03 O19 C18 N20 C21 180.00 0.0 0
   KXX CONST_04 O19 C18 N20 C25 0.00 0.0 0
   KXX Var_01 C06 C05 C04 C03 174.50 0.0 0
   KXX Var_02 C22 C21 N20 C18 -120.77 30.0 3
   KXX Var_03 N20 C18 C16 C14 -94.86 30.0 1
   KXX Var_04 C31 C32 C33 C03 -161.16 30.0 1
   KXX Var_05 C07 C06 C05 C04 -90.60 30.0 1
   KXX Var_06 C24 C23 C22 C21 55.68 30.0 1
   KXX Var_07 C25 N20 C21 C22 53.10 30.0 3
   KXX Var_08 C25 C24 C23 C22 -55.63 30.0 1
   KXX Var_09 N20 C21 C22 C23 -53.16 30.0 1
   KXX Var_10 C29 O28 C26 C25 174.22 30.0 1
   KXX Var_11 H2 C13 C14 C16 46.95 30.0 1
   KXX Var_12 H27 C25 N20 C18 3.71 30.0 1
   KXX Var_13 H1 C10 O15 C14 -57.76 30.0 1
   KXX Var_14 H3 C12 C13 C14 -173.81 30.0 1
   KXX Var_15 H4 C12 C13 C14 69.05 30.0 1
   KXX Var_16 H16 C08 C09 C10 -69.21 30.0 3
   KXX Var_17 C42 C41 C40 C39 55.88 30.0 1
   KXX Var_18 H17 C08 C09 C10 45.20 30.0 3
   KXX Var_19 H5 C11 C12 C13 -64.57 30.0 1
   KXX Var_20 H18 C09 C10 C11 165.00 30.0 3
   KXX Var_21 H15 C07 C06 C05 -38.42 30.0 3
   KXX Var_22 H11 C03 C04 C05 17.50 30.0 3
   KXX Var_23 H28 C29 O28 C26 9.55 30.0 3
   KXX Var_24 H30 C31 C30 C29 -55.19 30.0 3
   KXX Var_25 H29 C30 C31 C32 -57.61 30.0 3
   KXX Var_26 H43 C43 C44 C39 62.87 30.0 1
   KXX Var_27 H44 C44 C39 C40 177.27 30.0 1
   KXX Var_28 C56 C05 C04 C03 -3.34 0.0 0
   KXX Var_29 C10 O15 C14 C16 -178.49 30.0 1
   KXX Var_30 H45 C44 C39 C40 -65.13 30.0 1
   KXX Var_31 H42 C42 C41 C40 62.21 30.0 1
   KXX Var_32 H37 C39 C40 C41 62.83 30.0 1
   KXX Var_33 C54 O53 C09 C10 -79.50 30.0 1
   KXX Var_34 C52 O51 C11 C10 -165.05 30.0 1
   KXX Var_35 C52 O51 C11 C12 75.12 30.0 1
   KXX Var_36 C01 C02 C03 C04 -175.68 30.0 2
   KXX Var_37 C54 O53 C09 C08 154.05 30.0 1
   KXX Var_38 O19 C18 C16 C14 87.78 30.0 1
   KXX Var_39 C12 C13 C14 C16 162.63 30.0 1
   KXX Var_40 C48 C37 C29 C30 58.38 30.0 3
   KXX Var_41 C38 C37 C29 C30 -119.91 30.0 3
   KXX Var_42 C01 C02 C03 C33 66.15 30.0 2
   KXX Var_43 O35 C31 C30 C36 -58.15 30.0 3
   KXX Var_44 C37 C29 C30 C36 178.87 30.0 3
   KXX Var_45 C40 C39 C38 C37 -110.94 30.0 3
   KXX Var_46 C44 C39 C38 C37 127.06 30.0 3
   KXX Var_47 O28 C29 C37 C38 119.11 30.0 1
   KXX Var_48 C46 O45 C43 C42 159.45 30.0 3
   KXX Var_49 C46 O45 C43 C44 -78.58 30.0 3
   KXX Var_50 C56 C05 C06 C07 87.45 30.0 1
   KXX Var_51 O15 C14 C16 C18 85.37 30.0 3
   KXX Var_52 O28 C29 C37 C48 -62.60 30.0 1
   KXX Var_53 O49 C14 C13 C50 51.90 30.0 1
   KXX Var_54 O49 C14 C16 O17 18.28 30.0 3
   KXX Var_55 C02 C03 C33 O34 36.03 30.0 3
   KXX Var_56 O47 C42 C43 O45 -59.28 30.0 1
   KXX Var_57 H69 O49 C14 C16 -32.89 30.0 3
   KXX Var_58 H52 C50 C13 C14 53.80 30.0 3
   KXX Var_59 O27 C26 O28 C29 -3.12 30.0 1
   KXX Var_60 C13 C14 C16 C18 -33.17 30.0 3
   KXX Var_61 H53 C50 C13 C14 173.32 30.0 3
   KXX Var_62 H54 C50 C13 C14 -67.29 30.0 3
   KXX Var_63 H9 C02 C03 C04 -54.02 30.0 2
   KXX Var_64 H10 C02 C03 C04 61.44 30.0 2
   KXX Var_65 H61 C55 C07 C06 -177.35 30.0 3
   KXX Var_66 H62 C55 C07 C06 -56.64 30.0 3
   KXX Var_67 H63 C55 C07 C06 62.85 30.0 3
   KXX Var_68 H33 C36 C30 C29 58.29 30.0 3
   KXX Var_69 H34 C36 C30 C29 177.62 30.0 3
   KXX Var_70 H35 C36 C30 C29 -61.99 30.0 3
   KXX Var_71 O34 C33 C32 C31 19.10 30.0 1
   KXX Var_72 C26 C25 N20 C18 -110.84 30.0 1
   KXX Var_73 H67 O35 C31 C30 -79.45 30.0 3
   KXX Var_74 H36 C38 C39 C40 66.66 30.0 1
   KXX Var_75 H68 O47 C42 C41 169.34 30.0 3
   KXX Var_76 O17 C16 C18 N20 89.54 30.0 1
   KXX Var_77 C24 C25 N20 C18 122.16 30.0 1
   KXX Var_78 H12 C04 C05 C06 -2.38 0.0 0
   KXX Var_79 C09 C10 O15 C14 -173.27 30.0 1
   KXX Var_80 H19 C21 N20 C18 2.77 30.0 3
   KXX Var_81 C11 C10 O15 C14 60.05 30.0 1
   KXX Var_82 H20 C21 N20 C18 118.68 30.0 3
   KXX Var_83 C11 C12 C13 C14 -51.87 30.0 1
   KXX Var_84 H31 C32 C33 C03 -32.94 30.0 1
   KXX Var_85 C07 C08 C09 C10 166.46 30.0 3
   KXX Var_86 H32 C32 C33 C03 79.96 30.0 1
   KXX Var_87 C13 C12 C11 C10 55.04 30.0 1
   KXX Var_88 H13 C06 C05 C04 149.33 30.0 1
   KXX Var_89 C13 C14 O15 C10 -57.53 30.0 1
   KXX Var_90 H14 C06 C05 C04 31.07 30.0 1
   KXX Var_91 C09 C10 C11 C12 -174.16 30.0 1
   KXX Var_92 H23 C23 C22 C21 177.28 30.0 1
   KXX Var_93 O15 C10 C11 C12 -55.94 30.0 1
   KXX Var_94 H24 C23 C22 C21 -65.14 30.0 1
   KXX Var_95 O15 C14 C13 C12 50.66 30.0 1
   KXX Var_96 H25 C24 C23 C22 -177.31 30.0 1
   KXX Var_97 C08 C09 C10 C11 46.47 30.0 3
   KXX Var_98 H26 C24 C23 C22 63.41 30.0 1
   KXX Var_99 C32 C33 C03 C04 94.30 30.0 3
   KXX Var_100 H19 C21 C22 C23 -175.23 30.0 1
   KXX Var_101 C08 C07 C06 C05 77.52 30.0 3
   KXX Var_102 H20 C21 C22 C23 66.05 30.0 1
   KXX Var_103 C33 C03 C04 C05 -98.40 30.0 3
   KXX Var_104 H21 C22 C23 C24 -65.16 30.0 1
   KXX Var_105 C09 C08 C07 C06 83.41 30.0 3
   KXX Var_106 H22 C22 C23 C24 175.96 30.0 1
   KXX Var_107 O15 C10 C09 C08 -74.31 30.0 3
   KXX Var_108 H19 C21 N20 C25 176.64 30.0 3
   KXX Var_109 C26 C25 N20 C21 74.93 30.0 1
   KXX Var_110 H20 C21 N20 C25 -67.46 30.0 3
   KXX Var_111 C24 C25 N20 C21 -52.07 30.0 1
   KXX Var_112 H23 C23 C24 C25 -177.64 30.0 1
   KXX Var_113 N20 C25 C24 C23 52.29 30.0 1
   KXX Var_114 H24 C23 C24 C25 65.02 30.0 1
   KXX Var_115 C26 C25 C24 C23 -76.13 30.0 1
   KXX Var_116 H40 C41 C40 C39 177.39 30.0 1
   KXX Var_117 O28 C26 C25 C24 139.71 30.0 3
   KXX Var_118 H41 C41 C40 C39 -64.27 30.0 1
   KXX Var_119 C30 C29 O28 C26 126.52 30.0 3
   KXX Var_120 H38 C40 C41 C42 -64.90 30.0 1
   KXX Var_121 C32 C31 C30 C29 -174.86 30.0 3
   KXX Var_122 H39 C40 C41 C42 177.72 30.0 1
   KXX Var_123 C33 C32 C31 C30 78.10 30.0 3
   KXX Var_124 H21 C22 C21 N20 67.98 30.0 1
   KXX Var_125 O28 C29 C30 C31 175.97 30.0 3
   KXX Var_126 H22 C22 C21 N20 -175.03 30.0 1
   KXX Var_127 C42 C43 C44 C39 -56.71 30.0 1
   KXX Var_128 C39 C38 C37 C29 175.40 0.0 2
   KXX Var_129 C43 C44 C39 C40 55.07 30.0 1
   KXX Var_130 O19 C18 C16 O17 -87.81 30.0 1
   KXX Var_131 C43 C42 C41 C40 -56.45 30.0 1
   KXX Var_132 H12 C04 C05 C56 179.79 0.0 0
   KXX Var_133 C44 C39 C40 C41 -54.68 30.0 1
   KXX Var_134 H64 C56 C05 C04 -0.59 30.0 3
   KXX Var_135 C44 C43 C42 C41 56.90 30.0 1
   KXX Var_136 H65 C56 C05 C04 121.16 30.0 3
   KXX Var_137 O28 C26 C25 N20 13.48 30.0 3
   KXX Var_138 H66 C56 C05 C04 -121.91 30.0 3
   KXX Var_139 H64 C56 C05 C06 -178.54 30.0 3
   KXX Var_140 H65 C56 C05 C06 -56.79 30.0 3
   KXX Var_141 H66 C56 C05 C06 60.14 30.0 3
   KXX Var_142 H13 C06 C05 C56 -32.62 30.0 1
   KXX Var_143 H14 C06 C05 C56 -150.89 30.0 1
   KXX Var_144 H31 C32 C33 O34 147.32 30.0 1
   KXX Var_145 C50 C13 C14 C16 -71.86 30.0 1
   KXX Var_146 H32 C32 C33 O34 -99.78 30.0 1
   KXX Var_147 O49 C14 C16 C18 -157.30 30.0 3
   KXX Var_148 C48 C37 C38 C39 -2.72 0.0 2
   KXX Var_149 O49 C14 O15 C10 65.86 30.0 1
   KXX Var_150 H36 C38 C37 C29 -2.13 0.0 2
   KXX Var_151 O51 C11 C12 C13 173.98 30.0 1
   KXX Var_152 H55 C52 O51 C11 173.32 30.0 3
   KXX Var_153 O17 C16 C14 C13 142.40 30.0 3
   KXX Var_154 H56 C52 O51 C11 -67.69 30.0 3
   KXX Var_155 O49 C14 C13 C12 -73.61 30.0 1
   KXX Var_156 H57 C52 O51 C11 54.56 30.0 3
   KXX Var_157 O53 C09 C10 C11 -78.05 30.0 3
   KXX Var_158 H6 C01 C02 C03 178.83 30.0 3
   KXX Var_159 C50 C13 C12 C11 -178.19 30.0 1
   KXX Var_160 H7 C01 C02 C03 -61.12 30.0 3
   KXX Var_161 O34 C33 C03 C04 -85.96 30.0 3
   KXX Var_162 H8 C01 C02 C03 58.93 30.0 3
   KXX Var_163 C55 C07 C06 C05 -154.66 30.0 3
   KXX Var_164 H58 C54 O53 C09 -174.93 30.0 3
   KXX Var_165 C02 C03 C04 C05 139.18 30.0 3
   KXX Var_166 H59 C54 O53 C09 -55.85 30.0 3
   KXX Var_167 O53 C09 C08 C07 -67.86 30.0 3
   KXX Var_168 H60 C54 O53 C09 65.85 30.0 3
   KXX Var_169 O51 C11 C10 C09 64.39 30.0 1
   KXX Var_170 H49 C48 C37 C29 174.34 30.0 3
   KXX Var_171 C55 C07 C08 C09 -43.39 30.0 3
   KXX Var_172 H50 C48 C37 C29 -64.45 30.0 3
   KXX Var_173 O27 C26 C25 C24 -42.84 30.0 3
   KXX Var_174 H51 C48 C37 C29 53.74 30.0 3
   KXX Var_175 C37 C29 O28 C26 -107.89 30.0 3
   KXX Var_176 H46 C46 O45 C43 -175.13 30.0 3
   KXX Var_177 O35 C31 C30 C29 64.59 30.0 3
   KXX Var_178 H47 C46 O45 C43 -56.03 30.0 3
   KXX Var_179 C37 C29 C30 C31 54.79 30.0 3
   KXX Var_180 H48 C46 O45 C43 65.62 30.0 3
   KXX Var_181 C02 C03 C33 C32 -143.71 30.0 3
   KXX Var_182 H36 C38 C37 C48 179.75 0.0 2
   KXX Var_183 C36 C30 C31 C32 62.39 30.0 3
   KXX Var_184 H49 C48 C37 C38 -7.51 30.0 3
   KXX Var_185 O35 C31 C32 C33 -158.64 30.0 3
   KXX Var_186 H50 C48 C37 C38 113.69 30.0 3
   KXX Var_187 O28 C29 C30 C36 -59.95 30.0 3
   KXX Var_188 H51 C48 C37 C38 -128.11 30.0 3
   KXX Var_189 C41 C40 C39 C38 -177.12 30.0 1
   KXX Var_190 C43 C44 C39 C38 177.19 30.0 1
   KXX Var_191 O45 C43 C44 C39 -176.04 30.0 1
   KXX Var_192 O47 C42 C41 C40 -178.51 30.0 1
   KXX Var_193 O45 C43 C42 C41 179.82 30.0 1
   KXX Var_194 O47 C42 C43 C44 177.81 30.0 1
   KXX Var_195 O15 C14 C13 C50 176.18 30.0 1
   KXX Var_196 O27 C26 C25 N20 -169.07 30.0 3
   KXX Var_197 O53 C09 C10 O15 161.17 30.0 3
   KXX Var_198 O51 C11 C10 O15 -177.38 30.0 1
   KXX Var_199 O17 C16 C14 O15 -99.05 30.0 3

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
   KXX chir_01 C14 O15 C13 C16 positiv
   KXX chir_02 C10 O15 C11 C09 negativ
   KXX chir_03 C13 C12 C14 C50 positiv
   KXX chir_04 C11 O51 C10 C12 positiv
   KXX chir_05 C03 C04 C02 C33 negativ
   KXX chir_06 C07 C55 C06 C08 negativ
   KXX chir_07 C09 O53 C10 C08 positiv
   KXX chir_08 C25 N20 C26 C24 positiv
   KXX chir_09 C29 O28 C30 C37 negativ
   KXX chir_10 C30 C29 C31 C36 negativ
   KXX chir_11 C31 O35 C30 C32 positiv
   KXX chir_12 C39 C38 C40 C44 positiv
   KXX chir_13 C42 O47 C41 C43 positiv
   KXX chir_14 C43 O45 C44 C42 positiv

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
   KXX plan-1 C16 0.020
   KXX plan-1 C18 0.020
   KXX plan-1 C21 0.020
   KXX plan-1 C25 0.020
   KXX plan-1 N20 0.020
   KXX plan-1 O19 0.020
   KXX plan-2 C25 0.020
   KXX plan-2 C26 0.020
   KXX plan-2 O27 0.020
   KXX plan-2 O28 0.020
   KXX plan-3 C16 0.020
   KXX plan-3 C18 0.020
   KXX plan-3 C14 0.020
   KXX plan-3 O17 0.020
   KXX plan-4 C03 0.020
   KXX plan-4 C32 0.020
   KXX plan-4 C33 0.020
   KXX plan-4 O34 0.020
   KXX plan-5 C03 0.020
   KXX plan-5 C04 0.020
   KXX plan-5 C05 0.020
   KXX plan-5 C06 0.020
   KXX plan-5 C56 0.020
   KXX plan-5 H12 0.020
   KXX plan-6 C29 0.020
   KXX plan-6 C37 0.020
   KXX plan-6 C38 0.020
   KXX plan-6 C39 0.020
   KXX plan-6 C48 0.020
   KXX plan-6 H36 0.020

loop_
  _chem_comp_plane.comp_id
  _chem_comp_plane.id
   KXX plan-1
   KXX plan-2
   KXX plan-3
   KXX plan-4
   KXX plan-5
   KXX plan-6

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
   KXX KXX (3S,4R,5S,8R,9E,12S,14S,15R,16S,18R,19R,22R,26aS)-8-ethyl-5,19-dihydroxy-3-{(1E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl}-14,16-dimethoxy-4,10,12,18-tetramethyl-5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-3H-15,19-epoxypyrido[2,1-c][1,4]oxazacyclotricosine-1,7,20,21(4H,23H)-tetrone ligand 125 56 .

data_comp_SO4
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
   SO4 S S S 0 1.474 16.5170 34.9547 5.4718
   SO4 O1 O OS 0 -0.869 17.8362 34.8083 4.7766
   SO4 O2 O OS 0 -0.868 16.6534 35.9274 6.6034
   SO4 O3 O OS -1 -0.869 15.4961 35.4603 4.4975
   SO4 O4 O OS -1 -0.868 16.0830 33.6233 6.0060

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
   SO4 S O1 deloc 1.498 0.020 1.498
   SO4 S O2 deloc 1.498 0.020 1.498
   SO4 S O3 deloc 1.499 0.020 1.499
   SO4 S O4 deloc 1.499 0.020 1.499

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
   SO4 O4 S O3 109.51 3.000
   SO4 O4 S O2 109.50 3.000
   SO4 O3 S O2 109.51 3.000
   SO4 O4 S O1 109.48 3.000
   SO4 O3 S O1 109.33 3.000
   SO4 O2 S O1 109.49 3.000

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
   SO4 SO4 'sulfate                  ' ligand 5 5 .

data_comp_PG4
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
   PG4 O1 O OH1 0 -0.672 0.6549 1.0518 5.0969
   PG4 C1 C CH2 0 -0.185 1.5539 0.2754 4.3387
   PG4 C2 C CH2 0 -0.161 0.8043 -0.8289 3.6394
   PG4 O2 O O2 0 -0.485 -0.0819 -0.2864 2.6932
   PG4 C3 C CH2 0 -0.169 -0.7999 -1.2719 1.9964
   PG4 C4 C CH2 0 -0.169 -1.7124 -0.6197 0.9899
   PG4 O3 O O2 0 -0.485 -0.9438 0.0191 0.0030
   PG4 C5 C CH2 0 -0.169 -1.7236 0.6646 -0.9705
   PG4 C6 C CH2 0 -0.168 -0.8223 1.3120 -1.9902
   PG4 O4 O O2 0 -0.485 -0.1198 0.3214 -2.6956
   PG4 C7 C CH2 0 -0.161 0.7580 0.8564 -3.6537
   PG4 C8 C CH2 0 -0.185 1.5014 -0.2538 -4.3506
   PG4 O5 O OH1 0 -0.672 0.5955 -1.0386 -5.0916
   PG4 HO1 H HOH1 0 0.455 1.1557 1.7467 5.5328
   PG4 H11 H HCH2 0 0.200 2.0875 0.8796 3.5935
   PG4 H12 H HCH2 0 0.202 2.3178 -0.1980 4.9684
   PG4 H21 H HCH2 0 0.204 1.5394 -1.4883 3.1566
   PG4 H22 H HCH2 0 0.202 0.2649 -1.4425 4.3761
   PG4 H31 H HCH2 0 0.203 -0.1188 -1.9691 1.4869
   PG4 H32 H HCH2 0 0.207 -1.4147 -1.8726 2.6812
   PG4 H41 H HCH2 0 0.207 -2.3528 -1.3977 0.5513
   PG4 H42 H HCH2 0 0.204 -2.3799 0.0929 1.4962
   PG4 H51 H HCH2 0 0.204 -2.4025 -0.0436 -1.4682
   PG4 H52 H HCH2 0 0.207 -2.3530 1.4454 -0.5211
   PG4 H61 H HCH2 0 0.207 -1.4437 1.9155 -2.6664
   PG4 H62 H HCH2 0 0.204 -0.1302 2.0060 -1.4912
   PG4 H71 H HCH2 0 0.202 0.2122 1.4645 -4.3904
   PG4 H72 H HCH2 0 0.204 1.4977 1.5191 -3.1823
   PG4 H81 H HCH2 0 0.202 2.2581 0.2147 -4.9927
   PG4 H82 H HCH2 0 0.200 2.0436 -0.8505 -3.6056
   PG4 HO5 H HOH1 0 0.455 1.0932 -1.7335 -5.5309

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
   PG4 O1 C1 single 1.409 0.020 1.409
   PG4 O1 HO1 single 0.850 0.020 0.980
   PG4 C1 C2 single 1.507 0.020 1.507
   PG4 C1 H11 single 0.970 0.020 1.090
   PG4 C1 H12 single 0.970 0.020 1.090
   PG4 C2 O2 single 1.405 0.020 1.405
   PG4 C2 H21 single 0.970 0.020 1.090
   PG4 C2 H22 single 0.970 0.020 1.090
   PG4 O2 C3 single 1.404 0.020 1.404
   PG4 C3 C4 single 1.507 0.020 1.507
   PG4 C3 H31 single 0.970 0.020 1.090
   PG4 C3 H32 single 0.970 0.020 1.090
   PG4 C4 O3 single 1.405 0.020 1.405
   PG4 C4 H41 single 0.970 0.020 1.090
   PG4 C4 H42 single 0.970 0.020 1.090
   PG4 O3 C5 single 1.405 0.020 1.405
   PG4 C5 C6 single 1.507 0.020 1.507
   PG4 C5 H51 single 0.970 0.020 1.090
   PG4 C5 H52 single 0.970 0.020 1.090
   PG4 C6 O4 single 1.404 0.020 1.404
   PG4 C6 H61 single 0.970 0.020 1.090
   PG4 C6 H62 single 0.970 0.020 1.090
   PG4 O4 C7 single 1.405 0.020 1.405
   PG4 C7 C8 single 1.507 0.020 1.507
   PG4 C7 H71 single 0.970 0.020 1.090
   PG4 C7 H72 single 0.970 0.020 1.090
   PG4 C8 O5 single 1.409 0.020 1.409
   PG4 C8 H81 single 0.970 0.020 1.090
   PG4 C8 H82 single 0.970 0.020 1.090
   PG4 O5 HO5 single 0.850 0.020 0.980

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
   PG4 HO1 O1 C1 108.06 3.000
   PG4 H12 C1 H11 106.77 3.000
   PG4 H12 C1 C2 107.25 3.000
   PG4 H11 C1 C2 109.28 3.000
   PG4 H12 C1 O1 111.90 3.000
   PG4 H11 C1 O1 111.84 3.000
   PG4 C2 C1 O1 109.64 3.000
   PG4 H22 C2 H21 106.71 3.000
   PG4 H22 C2 O2 110.92 3.000
   PG4 H21 C2 O2 110.95 3.000
   PG4 H22 C2 C1 109.99 3.000
   PG4 H21 C2 C1 108.10 3.000
   PG4 O2 C2 C1 110.07 3.000
   PG4 C3 O2 C2 112.68 3.000
   PG4 H32 C3 H31 106.78 3.000
   PG4 H32 C3 C4 108.30 3.000
   PG4 H31 C3 C4 109.87 3.000
   PG4 H32 C3 O2 111.13 3.000
   PG4 H31 C3 O2 110.98 3.000
   PG4 C4 C3 O2 109.71 3.000
   PG4 H42 C4 H41 106.78 3.000
   PG4 H42 C4 O3 111.15 3.000
   PG4 H41 C4 O3 111.13 3.000
   PG4 H42 C4 C3 109.90 3.000
   PG4 H41 C4 C3 108.24 3.000
   PG4 O3 C4 C3 109.56 3.000
   PG4 C5 O3 C4 113.09 3.000
   PG4 H52 C5 H51 106.79 3.000
   PG4 H52 C5 C6 108.30 3.000
   PG4 H51 C5 C6 109.85 3.000
   PG4 H52 C5 O3 111.17 3.000
   PG4 H51 C5 O3 111.13 3.000
   PG4 C6 C5 O3 109.53 3.000
   PG4 H62 C6 H61 106.77 3.000
   PG4 H62 C6 O4 110.99 3.000
   PG4 H61 C6 O4 111.17 3.000
   PG4 H62 C6 C5 109.91 3.000
   PG4 H61 C6 C5 108.30 3.000
   PG4 O4 C6 C5 109.63 3.000
   PG4 C7 O4 C6 112.72 3.000
   PG4 H72 C7 H71 106.72 3.000
   PG4 H72 C7 C8 108.08 3.000
   PG4 H71 C7 C8 110.01 3.000
   PG4 H72 C7 O4 110.95 3.000
   PG4 H71 C7 O4 110.93 3.000
   PG4 C8 C7 O4 110.06 3.000
   PG4 H82 C8 H81 106.77 3.000
   PG4 H82 C8 O5 111.82 3.000
   PG4 H81 C8 O5 111.92 3.000
   PG4 H82 C8 C7 109.29 3.000
   PG4 H81 C8 C7 107.23 3.000
   PG4 O5 C8 C7 109.65 3.000
   PG4 HO5 O5 C8 108.07 3.000

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
   PG4 Var_01 O2 C2 C1 O1 65.41 30.0 3
   PG4 Var_02 C4 C3 O2 C2 -179.23 30.0 3
   PG4 Var_03 O3 C4 C3 O2 65.83 30.0 3
   PG4 Var_04 C6 C5 O3 C4 -179.61 30.0 3
   PG4 Var_05 O4 C6 C5 O3 65.64 30.0 3
   PG4 Var_06 C8 C7 O4 C6 178.70 30.0 3
   PG4 Var_07 O5 C8 C7 O4 65.24 30.0 3
   PG4 Var_08 C3 O2 C2 C1 179.31 30.0 3
   PG4 Var_09 C5 O3 C4 C3 -179.45 30.0 3
   PG4 Var_10 C7 O4 C6 C5 -179.12 30.0 3
   PG4 Var_11 HO1 O1 C1 C2 179.94 30.0 3
   PG4 Var_12 HO5 O5 C8 C7 179.57 30.0 3

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
   PG4 PG4 2,2'-[oxybis(ethane-2,1-diyloxy)]diethanol ligand 31 13 .

data_comp_P6G
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
   P6G O1 O OH1 0 -0.672 7.5977 -0.5705 -0.3512
   P6G C2 C CH2 0 -0.185 6.7578 -1.3903 0.4289
   P6G C3 C CH2 0 -0.161 5.9095 -0.5331 1.3333
   P6G O4 O O2 0 -0.485 5.0379 0.2589 0.5663
   P6G C5 C CH2 0 -0.169 4.1648 1.0228 1.3571
   P6G C6 C CH2 0 -0.170 3.2893 1.8770 0.4768
   P6G O7 O O2 0 -0.485 2.4716 1.0593 -0.3212
   P6G C8 C CH2 0 -0.170 1.5778 1.7983 -1.1132
   P6G C9 C CH2 0 -0.169 0.7919 0.8703 -2.0032
   P6G O10 O O2 0 -0.485 -0.0051 0.0159 -1.2233
   P6G C11 C CH2 0 -0.169 -0.8069 -0.8322 -2.0053
   P6G C12 C CH2 0 -0.170 -1.5875 -1.7672 -1.1178
   P6G O13 O O2 0 -0.485 -2.4740 -1.0343 -0.3121
   P6G C14 C CH2 0 -0.170 -3.2817 -1.8584 0.4896
   P6G C15 C CH2 0 -0.169 -4.1575 -1.0115 1.3766
   P6G O16 O O2 0 -0.485 -5.0443 -0.2563 0.5925
   P6G C17 C CH2 0 -0.161 -5.9213 0.5230 1.3662
   P6G C18 C CH2 0 -0.185 -6.7938 1.3621 0.4679
   P6G O19 O OH1 0 -0.672 -7.6349 0.5245 -0.2919
   P6G H1 H HOH1 0 0.455 8.1230 -1.1388 -0.9213
   P6G H21 H HCH2 0 0.200 6.1038 -2.0141 -0.1940
   P6G H22 H HCH2 0 0.202 7.3303 -2.0722 1.0701
   P6G H31 H HCH2 0 0.203 5.3497 -1.1997 2.0042
   P6G H32 H HCH2 0 0.202 6.5511 0.0932 1.9709
   P6G H51 H HCH2 0 0.204 3.5408 0.3765 1.9918
   P6G H52 H HCH2 0 0.206 4.7193 1.6899 2.0320
   P6G H61 H HCH2 0 0.207 2.6870 2.5263 1.1274
   P6G H62 H HCH2 0 0.205 3.9103 2.5379 -0.1450
   P6G H81 H HCH2 0 0.205 0.8942 2.3904 -0.4877
   P6G H82 H HCH2 0 0.206 2.1130 2.5094 -1.7588
   P6G H91 H HCH2 0 0.207 0.1755 1.4866 -2.6725
   P6G H92 H HCH2 0 0.205 1.4763 0.2942 -2.6425
   P6G H111 H HCH2 0 0.205 -1.4946 -0.2509 -2.6363
   P6G H112 H HCH2 0 0.207 -0.1944 -1.4435 -2.6827
   P6G H121 H HCH2 0 0.207 -2.1284 -2.4719 -1.7652
   P6G H122 H HCH2 0 0.205 -0.8996 -2.3652 -0.5029
   P6G H141 H HCH2 0 0.205 -3.9028 -2.5219 -0.1297
   P6G H142 H HCH2 0 0.207 -2.6712 -2.5050 1.1351
   P6G H151 H HCH2 0 0.206 -4.7002 -1.6830 2.0568
   P6G H152 H HCH2 0 0.204 -3.5341 -0.3592 2.0054
   P6G H171 H HCH2 0 0.202 -6.5460 -0.1124 2.0111
   P6G H172 H HCH2 0 0.204 -5.3664 1.2004 2.0304
   P6G H181 H HCH2 0 0.202 -7.3653 2.0422 1.1118
   P6G H182 H HCH2 0 0.200 -6.1578 1.9891 -0.1704
   P6G H19 H HOH1 0 0.455 -8.1804 1.0806 -0.8548

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
   P6G O1 C2 single 1.409 0.020 1.409
   P6G O1 H1 single 0.850 0.020 0.980
   P6G C2 C3 single 1.507 0.020 1.507
   P6G C2 H21 single 0.970 0.020 1.090
   P6G C2 H22 single 0.970 0.020 1.090
   P6G C3 O4 single 1.405 0.020 1.405
   P6G C3 H31 single 0.970 0.020 1.090
   P6G C3 H32 single 0.970 0.020 1.090
   P6G O4 C5 single 1.404 0.020 1.404
   P6G C5 C6 single 1.507 0.020 1.507
   P6G C5 H51 single 0.970 0.020 1.090
   P6G C5 H52 single 0.970 0.020 1.090
   P6G C6 O7 single 1.405 0.020 1.405
   P6G C6 H61 single 0.970 0.020 1.090
   P6G C6 H62 single 0.970 0.020 1.090
   P6G O7 C8 single 1.404 0.020 1.404
   P6G C8 C9 single 1.507 0.020 1.507
   P6G C8 H81 single 0.970 0.020 1.090
   P6G C8 H82 single 0.970 0.020 1.090
   P6G C9 O10 single 1.405 0.020 1.405
   P6G C9 H91 single 0.970 0.020 1.090
   P6G C9 H92 single 0.970 0.020 1.090
   P6G O10 C11 single 1.405 0.020 1.405
   P6G C11 C12 single 1.507 0.020 1.507
   P6G C11 H111 single 0.970 0.020 1.090
   P6G C11 H112 single 0.970 0.020 1.090
   P6G C12 O13 single 1.404 0.020 1.404
   P6G C12 H121 single 0.970 0.020 1.090
   P6G C12 H122 single 0.970 0.020 1.090
   P6G O13 C14 single 1.405 0.020 1.405
   P6G C14 C15 single 1.507 0.020 1.507
   P6G C14 H141 single 0.970 0.020 1.090
   P6G C14 H142 single 0.970 0.020 1.090
   P6G C15 O16 single 1.404 0.020 1.404
   P6G C15 H151 single 0.970 0.020 1.090
   P6G C15 H152 single 0.970 0.020 1.090
   P6G O16 C17 single 1.405 0.020 1.405
   P6G C17 C18 single 1.507 0.020 1.507
   P6G C17 H171 single 0.970 0.020 1.090
   P6G C17 H172 single 0.970 0.020 1.090
   P6G C18 O19 single 1.409 0.020 1.409
   P6G C18 H181 single 0.970 0.020 1.090
   P6G C18 H182 single 0.970 0.020 1.090
   P6G O19 H19 single 0.850 0.020 0.980

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
   P6G H1 O1 C2 108.07 3.000
   P6G H22 C2 H21 106.81 3.000
   P6G H22 C2 C3 107.25 3.000
   P6G H21 C2 C3 109.17 3.000
   P6G H22 C2 O1 111.97 3.000
   P6G H21 C2 O1 111.81 3.000
   P6G C3 C2 O1 109.68 3.000
   P6G H32 C3 H31 106.77 3.000
   P6G H32 C3 O4 110.92 3.000
   P6G H31 C3 O4 111.04 3.000
   P6G H32 C3 C2 110.07 3.000
   P6G H31 C3 C2 107.94 3.000
   P6G O4 C3 C2 110.00 3.000
   P6G C5 O4 C3 112.64 3.000
   P6G H52 C5 H51 106.76 3.000
   P6G H52 C5 C6 107.93 3.000
   P6G H51 C5 C6 109.91 3.000
   P6G H52 C5 O4 111.24 3.000
   P6G H51 C5 O4 110.99 3.000
   P6G C6 C5 O4 109.92 3.000
   P6G H62 C6 H61 106.81 3.000
   P6G H62 C6 O7 110.93 3.000
   P6G H61 C6 O7 111.17 3.000
   P6G H62 C6 C5 110.05 3.000
   P6G H61 C6 C5 107.91 3.000
   P6G O7 C6 C5 109.88 3.000
   P6G C8 O7 C6 112.61 3.000
   P6G H82 C8 H81 106.76 3.000
   P6G H82 C8 C9 107.78 3.000
   P6G H81 C8 C9 110.08 3.000
   P6G H82 C8 O7 111.21 3.000
   P6G H81 C8 O7 110.99 3.000
   P6G C9 C8 O7 109.93 3.000
   P6G H92 C9 H91 106.79 3.000
   P6G H92 C9 O10 110.93 3.000
   P6G H91 C9 O10 111.16 3.000
   P6G H92 C9 C8 109.96 3.000
   P6G H91 C9 C8 107.87 3.000
   P6G O10 C9 C8 110.03 3.000
   P6G C11 O10 C9 112.46 3.000
   P6G H112 C11 H111 106.79 3.000
   P6G H112 C11 C12 107.85 3.000
   P6G H111 C11 C12 110.00 3.000
   P6G H112 C11 O10 111.15 3.000
   P6G H111 C11 O10 110.93 3.000
   P6G C12 C11 O10 110.02 3.000
   P6G H122 C12 H121 106.77 3.000
   P6G H122 C12 O13 110.97 3.000
   P6G H121 C12 O13 111.22 3.000
   P6G H122 C12 C11 110.04 3.000
   P6G H121 C12 C11 107.80 3.000
   P6G O13 C12 C11 109.94 3.000
   P6G C14 O13 C12 112.59 3.000
   P6G H142 C14 H141 106.83 3.000
   P6G H142 C14 C15 107.93 3.000
   P6G H141 C14 C15 110.02 3.000
   P6G H142 C14 O13 111.16 3.000
   P6G H141 C14 O13 110.92 3.000
   P6G C15 C14 O13 109.90 3.000
   P6G H152 C15 H151 106.76 3.000
   P6G H152 C15 O16 110.99 3.000
   P6G H151 C15 O16 111.24 3.000
   P6G H152 C15 C14 109.91 3.000
   P6G H151 C15 C14 107.93 3.000
   P6G O16 C15 C14 109.91 3.000
   P6G C17 O16 C15 112.64 3.000
   P6G H172 C17 H171 106.76 3.000
   P6G H172 C17 C18 108.02 3.000
   P6G H171 C17 C18 110.01 3.000
   P6G H172 C17 O16 111.07 3.000
   P6G H171 C17 O16 110.91 3.000
   P6G C18 C17 O16 109.99 3.000
   P6G H182 C18 H181 106.80 3.000
   P6G H182 C18 O19 111.82 3.000
   P6G H181 C18 O19 111.96 3.000
   P6G H182 C18 C17 109.21 3.000
   P6G H181 C18 C17 107.27 3.000
   P6G O19 C18 C17 109.62 3.000
   P6G H19 O19 C18 108.09 3.000

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
   P6G Var_01 O4 C3 C2 O1 64.89 30.0 3
   P6G Var_02 C6 C5 O4 C3 178.29 30.0 3
   P6G Var_03 O7 C6 C5 O4 63.79 30.0 3
   P6G Var_04 C9 C8 O7 C6 176.56 30.0 3
   P6G Var_05 O10 C9 C8 O7 63.88 30.0 3
   P6G Var_06 C12 C11 O10 C9 177.31 30.0 3
   P6G Var_07 O13 C12 C11 O10 63.73 30.0 3
   P6G Var_08 C15 C14 O13 C12 177.16 30.0 3
   P6G Var_09 O16 C15 C14 O13 64.04 30.0 3
   P6G Var_10 C18 C17 O16 C15 176.99 30.0 3
   P6G Var_11 O19 C18 C17 O16 65.38 30.0 3
   P6G Var_12 C5 O4 C3 C2 176.45 30.0 3
   P6G Var_13 C8 O7 C6 C5 176.71 30.0 3
   P6G Var_14 C11 O10 C9 C8 177.29 30.0 3
   P6G Var_15 C14 O13 C12 C11 176.87 30.0 3
   P6G Var_16 C17 O16 C15 C14 177.98 30.0 3
   P6G Var_17 H1 O1 C2 C3 -179.67 30.0 3
   P6G Var_18 H19 O19 C18 C17 179.97 30.0 3

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
   P6G P6G 3,6,9,12,15-pentaoxaheptadecane-1,17-diol ligand 45 19 .

data_comp_ACT
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
   ACT C C C 0 0.385 50.6323 -7.1466 41.5339
   ACT O O O 0 -0.623 50.8984 -7.3786 42.7319
   ACT OXT O OC -1 -0.618 51.4443 -7.0878 40.5890
   ACT CH3 C CH3 0 -0.780 49.1492 -6.8839 41.2121
   ACT H1 H HCH3 0 0.201 48.9411 -6.8660 40.1424
   ACT H2 H HCH3 0 0.213 48.5069 -7.6339 41.6777
   ACT H3 H HCH3 0 0.221 48.8449 -5.9188 41.6260

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
   ACT C O deloc 1.249 0.020 1.249
   ACT C OXT deloc 1.247 0.020 1.247
   ACT C CH3 single 1.540 0.020 1.540
   ACT CH3 H1 single 0.970 0.020 1.090
   ACT CH3 H2 single 0.970 0.020 1.090
   ACT CH3 H3 single 0.970 0.020 1.090

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
   ACT CH3 C OXT 117.43 3.000
   ACT CH3 C O 115.93 3.000
   ACT OXT C O 126.64 3.000
   ACT H3 CH3 H2 106.33 3.000
   ACT H3 CH3 H1 107.69 3.000
   ACT H2 CH3 H1 108.52 3.000
   ACT H3 CH3 C 109.84 3.000
   ACT H2 CH3 C 111.12 3.000
   ACT H1 CH3 C 113.06 3.000

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
   ACT Var_01 H1 CH3 C O -169.61 30.0 3

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
   ACT plan-1 C 0.020
   ACT plan-1 O 0.020
   ACT plan-1 OXT 0.020
   ACT plan-1 CH3 0.020

loop_
  _chem_comp_plane.comp_id
  _chem_comp_plane.id
   ACT plan-1

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
   ACT ACT 'acetate                  ' ligand 7 4 .

data_comp_1PE
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
   1PE OH2 O OH1 0 -0.672 -0.1834 -0.8846 6.4271
   1PE C12 C CH2 0 -0.185 -1.2966 -0.9778 5.5680
   1PE C22 C CH2 0 -0.160 -1.4149 0.2861 4.7554
   1PE OH3 O O2 0 -0.485 -0.3103 0.4122 3.8957
   1PE C13 C CH2 0 -0.170 0.8343 1.6446 2.2065
   1PE C23 C CH2 0 -0.169 -0.3864 1.5565 3.0851
   1PE OH4 O O2 0 -0.485 0.8550 0.5686 1.3033
   1PE C14 C CH2 0 -0.170 1.9634 -0.5912 -0.4626
   1PE C24 C CH2 0 -0.170 1.9638 0.6135 0.4419
   1PE OH5 O O2 0 -0.485 0.8511 -0.5496 -1.3198
   1PE C15 C CH2 0 -0.169 -0.3978 -1.5481 -3.0910
   1PE C25 C CH2 0 -0.170 0.8264 -1.6307 -2.2167
   1PE OH6 O O2 0 -0.485 -0.3244 -0.4104 -3.9111
   1PE C16 C CH2 0 -0.185 -1.3122 0.9602 -5.5982
   1PE C26 C CH2 0 -0.160 -1.4278 -0.2963 -4.7741
   1PE OH7 O OH1 0 -0.672 -0.1957 0.8632 -6.4526
   1PE HO2 H HOH1 0 0.455 -0.1303 -1.6990 6.9346
   1PE H121 H HCH2 0 0.200 -1.2190 -1.8390 4.8915
   1PE H122 H HCH2 0 0.202 -2.2354 -1.0950 6.1244
   1PE H221 H HCH2 0 0.204 -2.3542 0.2406 4.1861
   1PE H222 H HCH2 0 0.202 -1.4918 1.1560 5.4244
   1PE H131 H HCH2 0 0.207 0.8034 2.6063 1.6751
   1PE H132 H HCH2 0 0.205 1.7429 1.6545 2.8259
   1PE H231 H HCH2 0 0.204 -1.2954 1.5412 2.4664
   1PE H232 H HCH2 0 0.206 -0.4332 2.4713 3.6929
   1PE H141 H HCH2 0 0.207 2.9027 -0.5869 -1.0335
   1PE H142 H HCH2 0 0.205 1.9628 -1.5125 0.1382
   1PE H241 H HCH2 0 0.205 1.9588 1.5349 -0.1585
   1PE H242 H HCH2 0 0.207 2.9052 0.6110 1.0093
   1PE H151 H HCH2 0 0.206 -0.4477 -2.4677 -3.6912
   1PE H152 H HCH2 0 0.204 -1.3045 -1.5269 -2.4689
   1PE H251 H HCH2 0 0.204 1.7324 -1.6440 -2.8397
   1PE H252 H HCH2 0 0.207 0.7978 -2.5894 -1.6798
   1PE H161 H HCH2 0 0.201 -2.2494 1.0688 -6.1590
   1PE H162 H HCH2 0 0.200 -1.2400 1.8279 -4.9296
   1PE H261 H HCH2 0 0.202 -1.5001 -1.1730 -5.4346
   1PE H262 H HCH2 0 0.204 -2.3685 -0.2488 -4.2075
   1PE HO7 H HOH1 0 0.455 -0.1341 1.6795 -6.9561

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
   1PE OH2 C12 single 1.409 0.020 1.409
   1PE OH2 HO2 single 0.850 0.020 0.980
   1PE C12 C22 single 1.507 0.020 1.507
   1PE C12 H121 single 0.970 0.020 1.090
   1PE C12 H122 single 0.970 0.020 1.090
   1PE C22 OH3 single 1.405 0.020 1.405
   1PE C22 H221 single 0.970 0.020 1.090
   1PE C22 H222 single 0.970 0.020 1.090
   1PE OH3 C23 single 1.404 0.020 1.404
   1PE C13 C23 single 1.507 0.020 1.507
   1PE C13 OH4 single 1.405 0.020 1.405
   1PE C13 H131 single 0.970 0.020 1.090
   1PE C13 H132 single 0.970 0.020 1.090
   1PE C23 H231 single 0.970 0.020 1.090
   1PE C23 H232 single 0.970 0.020 1.090
   1PE OH4 C24 single 1.405 0.020 1.405
   1PE C14 C24 single 1.506 0.020 1.506
   1PE C14 OH5 single 1.405 0.020 1.405
   1PE C14 H141 single 0.970 0.020 1.090
   1PE C14 H142 single 0.970 0.020 1.090
   1PE C24 H241 single 0.970 0.020 1.090
   1PE C24 H242 single 0.970 0.020 1.090
   1PE OH5 C25 single 1.405 0.020 1.405
   1PE C15 C25 single 1.507 0.020 1.507
   1PE C15 OH6 single 1.404 0.020 1.404
   1PE C15 H151 single 0.970 0.020 1.090
   1PE C15 H152 single 0.970 0.020 1.090
   1PE C25 H251 single 0.970 0.020 1.090
   1PE C25 H252 single 0.970 0.020 1.090
   1PE OH6 C26 single 1.405 0.020 1.405
   1PE C16 C26 single 1.507 0.020 1.507
   1PE C16 OH7 single 1.409 0.020 1.409
   1PE C16 H161 single 0.970 0.020 1.090
   1PE C16 H162 single 0.970 0.020 1.090
   1PE C26 H261 single 0.970 0.020 1.090
   1PE C26 H262 single 0.970 0.020 1.090
   1PE OH7 HO7 single 0.850 0.020 0.980

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
   1PE HO2 OH2 C12 108.03 3.000
   1PE H122 C12 H121 106.80 3.000
   1PE H122 C12 C22 107.20 3.000
   1PE H121 C12 C22 109.34 3.000
   1PE H122 C12 OH2 111.94 3.000
   1PE H121 C12 OH2 111.82 3.000
   1PE C22 C12 OH2 109.59 3.000
   1PE H222 C22 H221 106.74 3.000
   1PE H222 C22 OH3 110.86 3.000
   1PE H221 C22 OH3 111.01 3.000
   1PE H222 C22 C12 109.92 3.000
   1PE H221 C22 C12 108.15 3.000
   1PE OH3 C22 C12 110.08 3.000
   1PE C23 OH3 C22 112.56 3.000
   1PE H132 C13 H131 106.72 3.000
   1PE H132 C13 OH4 110.90 3.000
   1PE H131 C13 OH4 111.08 3.000
   1PE H132 C13 C23 109.97 3.000
   1PE H131 C13 C23 108.08 3.000
   1PE OH4 C13 C23 110.00 3.000
   1PE H232 C23 H231 106.71 3.000
   1PE H232 C23 C13 107.95 3.000
   1PE H231 C23 C13 110.02 3.000
   1PE H232 C23 OH3 111.18 3.000
   1PE H231 C23 OH3 110.99 3.000
   1PE C13 C23 OH3 109.90 3.000
   1PE C24 OH4 C13 112.42 3.000
   1PE H142 C14 H141 106.70 3.000
   1PE H142 C14 OH5 110.96 3.000
   1PE H141 C14 OH5 111.07 3.000
   1PE H142 C14 C24 109.99 3.000
   1PE H141 C14 C24 107.97 3.000
   1PE OH5 C14 C24 110.06 3.000
   1PE H242 C24 H241 106.72 3.000
   1PE H242 C24 C14 107.96 3.000
   1PE H241 C24 C14 110.01 3.000
   1PE H242 C24 OH4 111.06 3.000
   1PE H241 C24 OH4 110.97 3.000
   1PE C14 C24 OH4 110.02 3.000
   1PE C25 OH5 C14 112.38 3.000
   1PE H152 C15 H151 106.71 3.000
   1PE H152 C15 OH6 110.97 3.000
   1PE H151 C15 OH6 111.18 3.000
   1PE H152 C15 C25 110.04 3.000
   1PE H151 C15 C25 107.93 3.000
   1PE OH6 C15 C25 109.92 3.000
   1PE H252 C25 H251 106.71 3.000
   1PE H252 C25 C15 108.07 3.000
   1PE H251 C25 C15 109.96 3.000
   1PE H252 C25 OH5 111.09 3.000
   1PE H251 C25 OH5 110.88 3.000
   1PE C15 C25 OH5 110.04 3.000
   1PE C26 OH6 C15 112.53 3.000
   1PE H162 C16 H161 106.81 3.000
   1PE H162 C16 OH7 111.81 3.000
   1PE H161 C16 OH7 111.93 3.000
   1PE H162 C16 C26 109.33 3.000
   1PE H161 C16 C26 107.24 3.000
   1PE OH7 C16 C26 109.57 3.000
   1PE H262 C26 H261 106.72 3.000
   1PE H262 C26 C16 108.15 3.000
   1PE H261 C26 C16 109.95 3.000
   1PE H262 C26 OH6 111.03 3.000
   1PE H261 C26 OH6 110.83 3.000
   1PE C16 C26 OH6 110.07 3.000
   1PE HO7 OH7 C16 108.05 3.000

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
   1PE Var_01 OH3 C22 C12 OH2 65.36 30.0 3
   1PE Var_02 C13 C23 OH3 C22 179.08 30.0 3
   1PE Var_03 OH4 C13 C23 OH3 65.23 30.0 2
   1PE Var_04 C14 C24 OH4 C13 177.68 30.0 3
   1PE Var_05 OH5 C14 C24 OH4 65.42 30.0 1
   1PE Var_06 C15 C25 OH5 C14 178.95 30.0 3
   1PE Var_07 OH6 C15 C25 OH5 65.36 30.0 1
   1PE Var_08 C16 C26 OH6 C15 178.39 30.0 3
   1PE Var_09 OH7 C16 C26 OH6 65.27 30.0 1
   1PE Var_10 C23 OH3 C22 C12 178.33 30.0 3
   1PE Var_11 C24 OH4 C13 C23 179.00 30.0 3
   1PE Var_12 C25 OH5 C14 C24 178.04 30.0 3
   1PE Var_13 C26 OH6 C15 C25 178.61 30.0 3
   1PE Var_14 HO2 OH2 C12 C22 179.87 30.0 3
   1PE Var_15 HO7 OH7 C16 C26 -179.08 30.0 3

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
   1PE 1PE 3,6,9,12-tetraoxatetradecane-1,14-diol ligand 38 16 .

