data_2xm0_qFit
_cell.length_a                    53.635
_cell.length_b                    53.635
_cell.length_c                    181.285
_cell.angle_alpha                 90.000
_cell.angle_beta                  90.000
_cell.angle_gamma                 120.000
_cell.volume                      451636.522
_space_group.crystal_system       hexagonal
_space_group.IT_number            179
_space_group.name_H-M_alt         'P 65 2 2'
_space_group.name_Hall            ' P 65 2 (x,y,z+1/12)'
_symmetry.space_group_name_H-M    'P 65 2 2'
_symmetry.space_group_name_Hall   ' P 65 2 (x,y,z+1/12)'
_symmetry.Int_Tables_number       179
_reflns.B_iso_Wilson_estimate     19.57
_refine.pdbx_refine_id            'X-RAY DIFFRACTION'
_refine.ls_d_res_low              46.45
_refine.ls_d_res_high             1.20
_refine.pdbx_ls_sigma_F           1.32
_refine.ls_percent_reflns_obs     97.76
_refine.ls_number_reflns_obs      48408
_refine.ls_number_reflns_R_work   46408
_refine.ls_number_reflns_R_free   2000
_refine.ls_R_factor_obs           0.2473
_refine.ls_R_factor_R_work        0.2456
_refine.ls_R_factor_R_free        0.2865
_refine.ls_percent_reflns_R_free  4.13
_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             0.1660
_refine.pdbx_overall_phase_error  38.0568
_refine.pdbx_stereochemistry_target_values 'GeoStd + Monomer Library + CDL v1.2'
_refine.B_iso_mean                26.21
_refine.pdbx_ls_cross_valid_method 'FREE R-VALUE'
_exptl.method                     'X-RAY DIFFRACTION'
loop_
  _space_group_symop.id
  _space_group_symop.operation_xyz
   1 x,y,z
   2 x-y,x,z+5/6
   3 y,-x+y,z+1/6
   4 -y,x-y,z+2/3
   5 -x+y,-x,z+1/3
   6 x-y,-y,-z
   7 -x,-x+y,-z+1/3
   8 -x,-y,z+1/2
   9 y,x,-z+2/3
   10 -y,-x,-z+1/6
   11 -x+y,y,-z+1/2
   12 x,x-y,-z+5/6

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

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

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

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

loop_
  _refine_ls_restr.pdbx_refine_id
  _refine_ls_restr.type
  _refine_ls_restr.number
  _refine_ls_restr.dev_ideal
  _refine_ls_restr.weight
  _refine_ls_restr.pdbx_restraint_function
   'X-RAY DIFFRACTION' f_bond_d 1517 0.0110 ? ?
   'X-RAY DIFFRACTION' f_angle_d 2103 1.3142 ? ?
   'X-RAY DIFFRACTION' f_chiral_restr 215 0.0837 ? ?
   'X-RAY DIFFRACTION' f_plane_restr 282 0.0093 ? ?
   'X-RAY DIFFRACTION' f_dihedral_angle_d 561 16.2413 ? ?

loop_
  _refine_ls_shell.pdbx_refine_id
  _refine_ls_shell.d_res_high
  _refine_ls_shell.d_res_low
  _refine_ls_shell.number_reflns_R_work
  _refine_ls_shell.R_factor_R_work
  _refine_ls_shell.percent_reflns_obs
  _refine_ls_shell.R_factor_R_free
  _refine_ls_shell.number_reflns_R_free
   'X-RAY DIFFRACTION' 2.89 46.45 3742 0.2160 99.80 0.2929 161
   'X-RAY DIFFRACTION' 2.29 2.89 3487 0.2401 99.62 0.2396 150
   'X-RAY DIFFRACTION' 2.00 2.29 3421 0.2414 99.36 0.2261 147
   'X-RAY DIFFRACTION' 1.82 2.00 3360 0.2687 98.98 0.3104 145
   'X-RAY DIFFRACTION' 1.69 1.82 3349 0.2802 98.87 0.3010 144
   'X-RAY DIFFRACTION' 1.59 1.69 3322 0.2750 98.47 0.3154 144
   'X-RAY DIFFRACTION' 1.51 1.59 3186 0.3203 94.89 0.3283 138
   'X-RAY DIFFRACTION' 1.45 1.51 3262 0.3161 97.84 0.3399 141
   'X-RAY DIFFRACTION' 1.39 1.45 3266 0.3226 97.57 0.4007 140
   'X-RAY DIFFRACTION' 1.34 1.39 3220 0.3196 97.25 0.3500 139
   'X-RAY DIFFRACTION' 1.30 1.34 3237 0.3295 96.96 0.3498 139
   'X-RAY DIFFRACTION' 1.26 1.30 3225 0.3442 96.70 0.4019 140
   'X-RAY DIFFRACTION' 1.23 1.26 3189 0.3646 96.43 0.4038 137
   'X-RAY DIFFRACTION' 1.20 1.23 3142 0.3955 95.54 0.4587 135

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

loop_
  _struct_conn.id
  _struct_conn.conn_type_id
  _struct_conn.ptnr1_auth_comp_id
  _struct_conn.ptnr1_auth_asym_id
  _struct_conn.ptnr1_auth_seq_id
  _struct_conn.ptnr1_auth_atom_id
  _struct_conn.ptnr1_label_comp_id
  _struct_conn.ptnr1_label_asym_id
  _struct_conn.ptnr1_label_seq_id
  _struct_conn.ptnr1_label_atom_id
  _struct_conn.ptnr1_role
  _struct_conn.ptnr2_auth_comp_id
  _struct_conn.ptnr2_auth_asym_id
  _struct_conn.ptnr2_auth_seq_id
  _struct_conn.ptnr2_auth_atom_id
  _struct_conn.ptnr2_label_comp_id
  _struct_conn.ptnr2_label_asym_id
  _struct_conn.ptnr2_label_seq_id
  _struct_conn.ptnr2_label_atom_id
  _struct_conn.ptnr2_role
  _struct_conn.details
   C00001 covale PHE A 2 N PHE A 1 N . PCA A 1 C PCA A 124 C . 'Bond created based on atom type and distance.'
   C00002 covale CYS A 116 SG CYS A 114 SG . HEC A 1128 CAB HEC B . CAB . 'Bond created based on atom type and distance.'
   C00003 covale CYS A 119 SG CYS A 117 SG . HEC A 1128 CAC HEC B . CAC . 'Bond created based on atom type and distance.'
   C00004 covale CYS A 119 SG CYS A 117 SG . HEC A 1128 CAC HEC B . CAC . 'Bond created based on atom type and distance.'
   C00005 covale HIS A 120 NE2 HIS A 118 NE2 . HEC A 1128 FE HEC B . FE . 'Bond created based on atom type and distance.'

loop_
  _atom_type.symbol
  _atom_type.scat_dispersion_real
  _atom_type.scat_dispersion_imag
  _atom_type.scat_Cromer_Mann_a1
  _atom_type.scat_Cromer_Mann_a2
  _atom_type.scat_Cromer_Mann_a3
  _atom_type.scat_Cromer_Mann_a4
  _atom_type.scat_Cromer_Mann_b1
  _atom_type.scat_Cromer_Mann_b2
  _atom_type.scat_Cromer_Mann_b3
  _atom_type.scat_Cromer_Mann_b4
  _atom_type.scat_Cromer_Mann_c
  _atom_type.scat_source
  _atom_type.scat_dispersion_source
   C . . 3.54356 2.42580 . . 25.62398 1.50364 . . 0.0 
;
2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD:
Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
 .
   Fe . . 20.90327 4.99816 . . 2.55100 38.46870 . . 0.0 
;
2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD:
Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
 .
   H . . 0.51345 0.48472 . . 24.73122 6.32584 . . 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
   ALA
   ARG
   ASN
   ASP
   CYS
   GLN
   GLU
   GLY
   HEC
   HIS
   HOH
   ILE
   LEU
   LYS
   MET
   PCA
   PHE
   PRO
   SER
   THR
   TRP
   TYR
   VAL

loop_
  _atom_site.group_PDB
  _atom_site.id
  _atom_site.label_atom_id
  _atom_site.label_alt_id
  _atom_site.label_comp_id
  _atom_site.auth_asym_id
  _atom_site.auth_seq_id
  _atom_site.pdbx_PDB_ins_code
  _atom_site.Cartn_x
  _atom_site.Cartn_y
  _atom_site.Cartn_z
  _atom_site.occupancy
  _atom_site.B_iso_or_equiv
  _atom_site.type_symbol
  _atom_site.pdbx_formal_charge
  _atom_site.label_asym_id
  _atom_site.label_entity_id
  _atom_site.label_seq_id
  _atom_site.auth_atom_id
  _atom_site.pdbx_PDB_model_num
   ATOM 1 N . PHE A 2 ? -3.47780 22.70708 27.45042 1.000 22.58618 N ? A ? 1 N 1
   ATOM 2 CA . PHE A 2 ? -2.16011 22.26388 27.06010 1.000 22.14090 C ? A ? 1 CA 1
   ATOM 3 C . PHE A 2 ? -1.85392 21.08690 27.87146 1.000 24.27459 C ? A ? 1 C 1
   ATOM 4 O . PHE A 2 ? -1.88191 21.05190 29.10180 1.000 25.50400 O ? A ? 1 O 1
   ATOM 5 HA . PHE A 2 ? -2.10451 22.02482 26.12166 1.000 26.68063 H ? A ? 1 HA 1
   ATOM 6 CB A PHE A 2 ? -1.14292 23.34034 27.31658 0.411 23.84248 C ? A ? 1 CB 1
   ATOM 7 CG A PHE A 2 ? -1.52125 24.64850 26.72307 0.411 21.00586 C ? A ? 1 CG 1
   ATOM 8 CD1 A PHE A 2 ? -1.66137 24.78836 25.35497 0.411 22.01866 C ? A ? 1 CD1 1
   ATOM 9 CD2 A PHE A 2 ? -1.72095 25.73683 27.53168 0.411 23.32810 C ? A ? 1 CD2 1
   ATOM 10 CE1 A PHE A 2 ? -1.98920 26.00343 24.81095 0.411 19.94890 C ? A ? 1 CE1 1
   ATOM 11 CE2 A PHE A 2 ? -2.04154 26.94450 27.00042 0.411 21.87502 C ? A ? 1 CE2 1
   ATOM 12 CZ A PHE A 2 ? -2.17683 27.08297 25.63263 0.411 20.38382 C ? A ? 1 CZ 1
   ATOM 13 HB2 A PHE A 2 ? -1.04800 23.46225 28.27419 0.411 28.72253 H ? A ? 1 HB2 1
   ATOM 14 HB3 A PHE A 2 ? -0.29479 23.07059 26.93080 0.411 28.72253 H ? A ? 1 HB3 1
   ATOM 15 HD1 A PHE A 2 ? -1.53242 24.05341 24.79989 0.411 26.53395 H ? A ? 1 HD1 1
   ATOM 16 HD2 A PHE A 2 ? -1.63604 25.64727 28.45346 0.411 28.10527 H ? A ? 1 HD2 1
   ATOM 17 HE1 A PHE A 2 ? -2.08353 26.09396 23.89018 0.411 24.05023 H ? A ? 1 HE1 1
   ATOM 18 HE2 A PHE A 2 ? -2.17001 27.67827 27.55719 0.411 26.36158 H ? A ? 1 HE2 1
   ATOM 19 HZ A PHE A 2 ? -2.39567 27.91057 25.26918 0.411 24.57214 H ? A ? 1 HZ 1
   ATOM 20 CB B PHE A 2 ? -1.14959 23.38336 27.23060 0.589 23.77975 C ? A ? 1 CB 1
   ATOM 21 CG B PHE A 2 ? -1.48956 24.59116 26.41233 0.589 20.33623 C ? A ? 1 CG 1
   ATOM 22 CD1 B PHE A 2 ? -1.63383 24.49887 25.03944 0.589 22.65618 C ? A ? 1 CD1 1
   ATOM 23 CD2 B PHE A 2 ? -1.66529 25.80130 27.01306 0.589 23.23251 C ? A ? 1 CD2 1
   ATOM 24 CE1 B PHE A 2 ? -1.95336 25.61480 24.29667 0.589 20.07264 C ? A ? 1 CE1 1
   ATOM 25 CE2 B PHE A 2 ? -1.96397 26.89953 26.28413 0.589 20.81290 C ? A ? 1 CE2 1
   ATOM 26 CZ B PHE A 2 ? -2.10670 26.81422 24.92631 0.589 19.54165 C ? A ? 1 CZ 1
   ATOM 27 HB2 B PHE A 2 ? -1.12470 23.64837 28.16337 0.589 28.64725 H ? A ? 1 HB2 1
   ATOM 28 HB3 B PHE A 2 ? -0.27600 23.06674 26.95224 0.589 28.64725 H ? A ? 1 HB3 1
   ATOM 29 HD1 B PHE A 2 ? -1.51458 23.67963 24.61573 0.589 27.29897 H ? A ? 1 HD1 1
   ATOM 30 HD2 B PHE A 2 ? -1.57864 25.87254 27.93627 0.589 27.99057 H ? A ? 1 HD2 1
   ATOM 31 HE1 B PHE A 2 ? -2.06326 25.55035 23.37543 0.589 24.19872 H ? A ? 1 HE1 1
   ATOM 32 HE2 B PHE A 2 ? -2.07331 27.71957 26.70895 0.589 25.08703 H ? A ? 1 HE2 1
   ATOM 33 HZ B PHE A 2 ? -2.30864 27.57562 24.43196 0.589 23.56153 H ? A ? 1 HZ 1
   ATOM 34 N . ALA A 3 ? -1.56934 20.04764 27.11757 1.000 27.66440 N ? A ? 2 N 1
   ATOM 35 CA . ALA A 3 ? -1.20784 18.77123 27.74602 1.000 32.48173 C ? A ? 2 CA 1
   ATOM 36 C . ALA A 3 ? 0.06488 18.92345 28.59237 1.000 35.70267 C ? A ? 2 C 1
   ATOM 37 O . ALA A 3 ? 0.12998 18.52130 29.76188 1.000 38.19722 O ? A ? 2 O 1
   ATOM 38 CB . ALA A 3 ? -1.24588 17.71346 26.62201 1.000 31.56219 C ? A ? 2 CB 1
   ATOM 39 H . ALA A 3 ? -1.57446 20.04222 26.25760 1.000 33.30883 H ? A ? 2 H 1
   ATOM 40 HA . ALA A 3 ? -1.83165 18.44350 28.41263 1.000 39.08962 H ? A ? 2 HA 1
   ATOM 41 HB1 . ALA A 3 ? -1.02018 16.84727 26.99573 1.000 37.98618 H ? A ? 2 HB1 1
   ATOM 42 HB2 . ALA A 3 ? -2.13827 17.68769 26.24268 1.000 37.98618 H ? A ? 2 HB2 1
   ATOM 43 HB3 . ALA A 3 ? -0.60255 17.95635 25.93788 1.000 37.98618 H ? A ? 2 HB3 1
   ATOM 44 N . LYS A 4 ? 1.13703 19.31188 27.95744 1.000 33.63344 N ? A ? 3 N 1
   ATOM 45 CA . LYS A 4 ? 2.39134 19.47129 28.63226 1.000 36.94419 C ? A ? 3 CA 1
   ATOM 46 C . LYS A 4 ? 2.73914 20.94981 28.61095 1.000 33.89110 C ? A ? 3 C 1
   ATOM 47 O . LYS A 4 ? 2.23830 21.69550 27.75773 1.000 30.44408 O ? A ? 3 O 1
   ATOM 48 H . LYS A 4 ? 1.16367 19.49310 27.11717 1.000 40.47168 H ? A ? 3 H 1
   ATOM 49 HA . LYS A 4 ? 2.35847 19.15864 29.54991 1.000 44.44459 H ? A ? 3 HA 1
   ATOM 50 CB A LYS A 4 ? 3.48349 18.68223 27.89803 0.422 37.37202 C ? A ? 3 CB 1
   ATOM 51 CG A LYS A 4 ? 3.26733 17.16775 27.81046 0.422 41.33303 C ? A ? 3 CG 1
   ATOM 52 CD A LYS A 4 ? 2.59269 16.76613 26.50533 0.422 40.62397 C ? A ? 3 CD 1
   ATOM 53 CE A LYS A 4 ? 2.80017 15.28233 26.19274 0.422 44.59407 C ? A ? 3 CE 1
   ATOM 54 NZ A LYS A 4 ? 2.30094 14.38517 27.27702 0.422 48.13746 N ? A ? 3 NZ 1
   ATOM 55 HB2 A LYS A 4 ? 3.54169 19.01723 26.98957 0.422 44.95798 H ? A ? 3 HB2 1
   ATOM 56 HB3 A LYS A 4 ? 4.32456 18.82629 28.35927 0.422 44.95798 H ? A ? 3 HB3 1
   ATOM 57 HG2 A LYS A 4 ? 4.12573 16.71865 27.85900 0.422 49.71119 H ? A ? 3 HG2 1
   ATOM 58 HG3 A LYS A 4 ? 2.70156 16.88227 28.54483 0.422 49.71119 H ? A ? 3 HG3 1
   ATOM 59 HD2 A LYS A 4 ? 1.63937 16.93185 26.57328 0.422 48.86031 H ? A ? 3 HD2 1
   ATOM 60 HD3 A LYS A 4 ? 2.96863 17.28540 25.77737 0.422 48.86031 H ? A ? 3 HD3 1
   ATOM 61 HE2 A LYS A 4 ? 2.32245 15.06141 25.37796 0.422 53.62443 H ? A ? 3 HE2 1
   ATOM 62 HE3 A LYS A 4 ? 3.74838 15.11343 26.07754 0.422 53.62443 H ? A ? 3 HE3 1
   ATOM 63 HZ1 A LYS A 4 ? 2.43052 13.53400 27.05161 0.422 57.87651 H ? A ? 3 HZ1 1
   ATOM 64 HZ2 A LYS A 4 ? 2.73603 14.55265 28.03514 0.422 57.87651 H ? A ? 3 HZ2 1
   ATOM 65 HZ3 A LYS A 4 ? 1.43096 14.52021 27.40740 0.422 57.87651 H ? A ? 3 HZ3 1
   ATOM 66 CB B LYS A 4 ? 3.47526 18.67680 27.89300 0.578 37.34262 C ? A ? 3 CB 1
   ATOM 67 CG B LYS A 4 ? 3.27884 17.15589 27.88624 0.578 41.32819 C ? A ? 3 CG 1
   ATOM 68 CD B LYS A 4 ? 3.74217 16.51373 29.19759 0.578 42.62387 C ? A ? 3 CD 1
   ATOM 69 CE B LYS A 4 ? 3.63837 14.98959 29.14267 0.578 45.29469 C ? A ? 3 CE 1
   ATOM 70 NZ B LYS A 4 ? 4.50504 14.39055 28.08272 0.578 51.57616 N ? A ? 3 NZ 1
   ATOM 71 HB2 B LYS A 4 ? 3.49405 18.97098 26.96888 0.578 44.92269 H ? A ? 3 HB2 1
   ATOM 72 HB3 B LYS A 4 ? 4.32935 18.85712 28.31599 0.578 44.92269 H ? A ? 3 HB3 1
   ATOM 73 HG2 B LYS A 4 ? 2.33728 16.95565 27.76678 0.578 49.70538 H ? A ? 3 HG2 1
   ATOM 74 HG3 B LYS A 4 ? 3.79468 16.77012 27.16100 0.578 49.70538 H ? A ? 3 HG3 1
   ATOM 75 HD2 B LYS A 4 ? 4.66844 16.75045 29.36154 0.578 51.26019 H ? A ? 3 HD2 1
   ATOM 76 HD3 B LYS A 4 ? 3.18482 16.83117 29.92526 0.578 51.26019 H ? A ? 3 HD3 1
   ATOM 77 HE2 B LYS A 4 ? 3.91292 14.62258 29.99756 0.578 54.46518 H ? A ? 3 HE2 1
   ATOM 78 HE3 B LYS A 4 ? 2.71968 14.74142 28.95474 0.578 54.46518 H ? A ? 3 HE3 1
   ATOM 79 HZ1 B LYS A 4 ? 4.46173 13.50239 28.12007 0.578 62.00294 H ? A ? 3 HZ1 1
   ATOM 80 HZ2 B LYS A 4 ? 4.23300 14.65946 27.27912 0.578 62.00294 H ? A ? 3 HZ2 1
   ATOM 81 HZ3 B LYS A 4 ? 5.34998 14.64376 28.20130 0.578 62.00294 H ? A ? 3 HZ3 1
   ATOM 82 N . PRO A 5 ? 3.56269 21.41861 29.54328 1.000 35.55053 N ? A ? 4 N 1
   ATOM 83 CA . PRO A 5 ? 4.02467 22.81103 29.45114 1.000 33.79437 C ? A ? 4 CA 1
   ATOM 84 C . PRO A 5 ? 4.58870 23.17741 28.08359 1.000 32.67268 C ? A ? 4 C 1
   ATOM 85 O . PRO A 5 ? 4.40206 24.31216 27.63216 1.000 29.22258 O ? A ? 4 O 1
   ATOM 86 CB . PRO A 5 ? 5.08145 22.91378 30.56130 1.000 37.91733 C ? A ? 4 CB 1
   ATOM 87 CG . PRO A 5 ? 4.65428 21.87402 31.57383 1.000 38.90246 C ? A ? 4 CG 1
   ATOM 88 CD . PRO A 5 ? 4.07837 20.73080 30.74626 1.000 39.93942 C ? A ? 4 CD 1
   ATOM 89 HA . PRO A 5 ? 3.29410 23.41279 29.66337 1.000 40.66480 H ? A ? 4 HA 1
   ATOM 90 HB2 . PRO A 5 ? 5.96110 22.71463 30.20429 1.000 45.61235 H ? A ? 4 HB2 1
   ATOM 91 HB3 . PRO A 5 ? 5.07395 23.80333 30.94801 1.000 45.61235 H ? A ? 4 HB3 1
   ATOM 92 HG2 . PRO A 5 ? 5.42194 21.57773 32.08745 1.000 46.79450 H ? A ? 4 HG2 1
   ATOM 93 HG3 . PRO A 5 ? 3.98225 22.24594 32.16625 1.000 46.79450 H ? A ? 4 HG3 1
   ATOM 94 HD2 . PRO A 5 ? 4.76890 20.09163 30.51060 1.000 48.03886 H ? A ? 4 HD2 1
   ATOM 95 HD3 . PRO A 5 ? 3.36188 20.28414 31.22380 1.000 48.03886 H ? A ? 4 HD3 1
   ATOM 96 N A GLU A 6 ? 5.28335 22.26747 27.40449 0.555 31.88699 N ? A ? 5 N 1
   ATOM 97 CA A GLU A 6 ? 5.85092 22.61906 26.10865 0.555 31.76352 C ? A ? 5 CA 1
   ATOM 98 C A GLU A 6 ? 4.78532 22.83198 25.04160 0.555 29.90644 C ? A ? 5 C 1
   ATOM 99 O A GLU A 6 ? 5.04716 23.52444 24.04983 0.555 28.15279 O ? A ? 5 O 1
   ATOM 100 CB A GLU A 6 ? 6.87521 21.56258 25.69187 0.555 33.97130 C ? A ? 5 CB 1
   ATOM 101 CG A GLU A 6 ? 8.23657 21.76273 26.36646 0.555 36.25223 C ? A ? 5 CG 1
   ATOM 102 CD A GLU A 6 ? 8.90157 23.00761 25.84156 0.555 37.03994 C ? A ? 5 CD 1
   ATOM 103 OE1 A GLU A 6 ? 8.85247 23.34012 24.65932 0.555 36.71566 O ? A ? 5 OE1 1
   ATOM 104 OE2 A GLU A 6 ? 9.47919 23.73125 26.61946 0.555 39.70108 O ? A ? 5 OE2 1
   ATOM 105 H A GLU A 6 ? 5.43569 21.46228 27.66538 0.555 38.37594 H ? A ? 5 H 1
   ATOM 106 HA A GLU A 6 ? 6.32860 23.46013 26.18156 0.555 38.22778 H ? A ? 5 HA 1
   ATOM 107 HB2 A GLU A 6 ? 6.54300 20.68537 25.93893 0.555 40.87711 H ? A ? 5 HB2 1
   ATOM 108 HB3 A GLU A 6 ? 7.00527 21.60978 24.73179 0.555 40.87711 H ? A ? 5 HB3 1
   ATOM 109 HG2 A GLU A 6 ? 8.11463 21.85636 27.32420 0.555 43.61423 H ? A ? 5 HG2 1
   ATOM 110 HG3 A GLU A 6 ? 8.80838 21.00230 26.17760 0.555 43.61423 H ? A ? 5 HG3 1
   ATOM 111 N C GLU A 6 ? 5.24567 22.24224 27.39438 0.152 31.93805 N ? A ? 5 N 1
   ATOM 112 CA C GLU A 6 ? 5.90226 22.59052 26.13846 0.152 31.80946 C ? A ? 5 CA 1
   ATOM 113 C C GLU A 6 ? 4.90680 23.01651 25.06415 0.152 29.98344 C ? A ? 5 C 1
   ATOM 114 O C GLU A 6 ? 5.22812 23.87768 24.23800 0.152 28.74356 O ? A ? 5 O 1
   ATOM 115 CB C GLU A 6 ? 6.76201 21.42730 25.64499 0.152 33.98577 C ? A ? 5 CB 1
   ATOM 116 CG C GLU A 6 ? 7.44664 21.68752 24.31005 0.152 35.26958 C ? A ? 5 CG 1
   ATOM 117 CD C GLU A 6 ? 8.25779 22.97285 24.29861 0.152 35.96339 C ? A ? 5 CD 1
   ATOM 118 OE1 C GLU A 6 ? 8.88385 23.30226 25.32940 0.152 36.82298 O ? A ? 5 OE1 1
   ATOM 119 OE2 C GLU A 6 ? 8.25738 23.66190 23.25723 0.152 35.38728 O ? A ? 5 OE2 1
   ATOM 120 H C GLU A 6 ? 5.32357 21.41822 27.62789 0.152 38.43721 H ? A ? 5 H 1
   ATOM 121 HA C GLU A 6 ? 6.49080 23.34357 26.30409 0.152 38.28291 H ? A ? 5 HA 1
   ATOM 122 HB2 C GLU A 6 ? 7.45342 21.25093 26.30206 0.152 40.89448 H ? A ? 5 HB2 1
   ATOM 123 HB3 C GLU A 6 ? 6.19716 20.64577 25.53981 0.152 40.89448 H ? A ? 5 HB3 1
   ATOM 124 HG2 C GLU A 6 ? 8.04900 20.95231 24.11627 0.152 42.43505 H ? A ? 5 HG2 1
   ATOM 125 HG3 C GLU A 6 ? 6.77106 21.75434 23.61721 0.152 42.43505 H ? A ? 5 HG3 1
   ATOM 126 N D GLU A 6 ? 5.24411 22.22685 27.40791 0.293 31.91619 N ? A ? 5 N 1
   ATOM 127 CA D GLU A 6 ? 5.82460 22.49744 26.09672 0.293 31.79643 C ? A ? 5 CA 1
   ATOM 128 C D GLU A 6 ? 4.76169 22.93315 25.10201 0.293 29.92511 C ? A ? 5 C 1
   ATOM 129 O D GLU A 6 ? 5.02169 23.77673 24.23704 0.293 28.50117 O ? A ? 5 O 1
   ATOM 130 CB D GLU A 6 ? 6.53498 21.24888 25.57271 0.293 33.92833 C ? A ? 5 CB 1
   ATOM 131 CG D GLU A 6 ? 7.33149 21.46314 24.28581 0.293 35.25156 C ? A ? 5 CG 1
   ATOM 132 CD D GLU A 6 ? 6.62093 20.97123 23.03020 0.293 35.20713 C ? A ? 5 CD 1
   ATOM 133 OE1 D GLU A 6 ? 5.45913 20.51571 23.12397 0.293 33.69514 O ? A ? 5 OE1 1
   ATOM 134 OE2 D GLU A 6 ? 7.23272 21.04502 21.93954 0.293 35.83126 O ? A ? 5 OE2 1
   ATOM 135 H D GLU A 6 ? 5.36440 21.42250 27.68747 0.293 38.41098 H ? A ? 5 H 1
   ATOM 136 HA D GLU A 6 ? 6.47411 23.21187 26.18958 0.293 38.26727 H ? A ? 5 HA 1
   ATOM 137 HB2 D GLU A 6 ? 7.15414 20.93830 26.25174 0.293 40.82555 H ? A ? 5 HB2 1
   ATOM 138 HB3 D GLU A 6 ? 5.86874 20.56682 25.39431 0.293 40.82555 H ? A ? 5 HB3 1
   ATOM 139 HG2 D GLU A 6 ? 7.49889 22.41241 24.17731 0.293 42.41343 H ? A ? 5 HG2 1
   ATOM 140 HG3 D GLU A 6 ? 8.17193 20.98396 24.35605 0.293 42.41343 H ? A ? 5 HG3 1
   ATOM 141 N A ASP A 7 ? 3.58434 22.28253 25.23185 0.555 29.16785 N ? A ? 6 N 1
   ATOM 142 CA A ASP A 7 ? 2.48606 22.60304 24.32497 0.555 27.65223 C ? A ? 6 CA 1
   ATOM 143 C A ASP A 7 ? 2.11074 24.08340 24.41741 0.555 25.60570 C ? A ? 6 C 1
   ATOM 144 O A ASP A 7 ? 1.77947 24.72152 23.40595 0.555 24.28853 O ? A ? 6 O 1
   ATOM 145 CB A ASP A 7 ? 1.28898 21.70863 24.64551 0.555 27.61806 C ? A ? 6 CB 1
   ATOM 146 CG A ASP A 7 ? 1.54389 20.23933 24.31844 0.555 28.69947 C ? A ? 6 CG 1
   ATOM 147 OD1 A ASP A 7 ? 1.85780 19.92769 23.15546 0.555 28.09259 O ? A ? 6 OD1 1
   ATOM 148 OD2 A ASP A 7 ? 1.40386 19.39255 25.21879 0.555 31.31861 O ? A ? 6 OD2 1
   ATOM 149 H A ASP A 7 ? 3.38492 21.73425 25.86368 0.555 35.11298 H ? A ? 6 H 1
   ATOM 150 HA A ASP A 7 ? 2.75663 22.42750 23.41016 0.555 33.29423 H ? A ? 6 HA 1
   ATOM 151 HB2 A ASP A 7 ? 1.08983 21.77473 25.59254 0.555 33.25323 H ? A ? 6 HB2 1
   ATOM 152 HB3 A ASP A 7 ? 0.52574 22.00363 24.12461 0.555 33.25323 H ? A ? 6 HB3 1
   ATOM 153 N C ASP A 7 ? 3.70442 22.43415 25.04488 0.152 29.25079 N ? A ? 6 N 1
   ATOM 154 CA C ASP A 7 ? 2.72963 22.84143 24.03630 0.152 28.06488 C ? A ? 6 CA 1
   ATOM 155 C C ASP A 7 ? 2.20301 24.24596 24.31002 0.152 25.67848 C ? A ? 6 C 1
   ATOM 156 O C ASP A 7 ? 1.78805 24.94512 23.37745 0.152 24.23046 O ? A ? 6 O 1
   ATOM 157 CB C ASP A 7 ? 1.58736 21.82879 23.94825 0.152 27.94131 C ? A ? 6 CB 1
   ATOM 158 CG C ASP A 7 ? 0.40124 22.21400 24.79592 0.152 27.32153 C ? A ? 6 CG 1
   ATOM 159 OD1 C ASP A 7 ? 0.59168 22.50217 25.99461 0.152 27.53773 O ? A ? 6 OD1 1
   ATOM 160 OD2 C ASP A 7 ? -0.72394 22.23335 24.25851 0.152 26.30813 O ? A ? 6 OD2 1
   ATOM 161 H C ASP A 7 ? 3.43871 21.82163 25.58693 0.152 35.21250 H ? A ? 6 H 1
   ATOM 162 HA C ASP A 7 ? 3.16215 22.85123 23.16812 0.152 33.78941 H ? A ? 6 HA 1
   ATOM 163 HB2 C ASP A 7 ? 1.29027 21.76644 23.02697 0.152 33.64112 H ? A ? 6 HB2 1
   ATOM 164 HB3 C ASP A 7 ? 1.90628 20.96496 24.25317 0.152 33.64112 H ? A ? 6 HB3 1
   ATOM 165 N D ASP A 7 ? 3.56224 22.35114 25.19334 0.293 29.19650 N ? A ? 6 N 1
   ATOM 166 CA D ASP A 7 ? 2.48620 22.73924 24.28765 0.293 27.71948 C ? A ? 6 CA 1
   ATOM 167 C D ASP A 7 ? 2.10050 24.20328 24.48120 0.293 25.66480 C ? A ? 6 C 1
   ATOM 168 O D ASP A 7 ? 1.74897 24.89007 23.51277 0.293 24.23419 O ? A ? 6 O 1
   ATOM 169 CB D ASP A 7 ? 1.28844 21.80865 24.48404 0.293 27.66206 C ? A ? 6 CB 1
   ATOM 170 CG D ASP A 7 ? 1.63829 20.34707 24.24296 0.293 28.78034 C ? A ? 6 CG 1
   ATOM 171 OD1 D ASP A 7 ? 2.59083 20.07556 23.48120 0.293 30.92090 O ? A ? 6 OD1 1
   ATOM 172 OD2 D ASP A 7 ? 0.94979 19.47602 24.81572 0.293 31.12586 O ? A ? 6 OD2 1
   ATOM 173 H D ASP A 7 ? 3.35190 21.74049 25.76118 0.293 35.14735 H ? A ? 6 H 1
   ATOM 174 HA D ASP A 7 ? 2.77971 22.64047 23.36841 0.293 33.37493 H ? A ? 6 HA 1
   ATOM 175 HB2 D ASP A 7 ? 0.96660 21.89449 25.39506 0.293 33.30603 H ? A ? 6 HB2 1
   ATOM 176 HB3 D ASP A 7 ? 0.58854 22.05717 23.86013 0.293 33.30603 H ? A ? 6 HB3 1
   ATOM 177 N A ALA A 8 ? 2.15605 24.64540 25.62076 0.555 24.97742 N ? A ? 7 N 1
   ATOM 178 CA A ALA A 8 ? 1.89345 26.06744 25.77397 0.555 23.88433 C ? A ? 7 CA 1
   ATOM 179 C A ALA A 8 ? 2.95690 26.90236 25.08244 0.555 22.67119 C ? A ? 7 C 1
   ATOM 180 O A ALA A 8 ? 2.63727 27.91571 24.45412 0.555 19.86195 O ? A ? 7 O 1
   ATOM 181 CB A ALA A 8 ? 1.83861 26.39925 27.25419 0.555 22.97528 C ? A ? 7 CB 1
   ATOM 182 H A ALA A 8 ? 2.33394 24.23093 26.35300 0.555 30.08445 H ? A ? 7 H 1
   ATOM 183 HA A ALA A 8 ? 1.03889 26.28471 25.36972 0.555 28.77274 H ? A ? 7 HA 1
   ATOM 184 HB1 A ALA A 8 ? 1.64825 27.34459 27.35907 0.555 27.68189 H ? A ? 7 HB1 1
   ATOM 185 HB2 A ALA A 8 ? 1.13818 25.87265 27.67013 0.555 27.68189 H ? A ? 7 HB2 1
   ATOM 186 HB3 A ALA A 8 ? 2.69515 26.18760 27.65722 0.555 27.68189 H ? A ? 7 HB3 1
   ATOM 187 N C ALA A 8 ? 2.21342 24.67644 25.57430 0.152 25.08765 N ? A ? 7 N 1
   ATOM 188 CA C ALA A 8 ? 1.91868 26.07310 25.87447 0.152 23.92122 C ? A ? 7 CA 1
   ATOM 189 C C ALA A 8 ? 2.99244 26.99791 25.31848 0.152 22.91660 C ? A ? 7 C 1
   ATOM 190 O C ALA A 8 ? 2.71021 28.16660 25.02834 0.152 21.18128 O ? A ? 7 O 1
   ATOM 191 CB C ALA A 8 ? 1.79080 26.27285 27.38392 0.152 23.17581 C ? A ? 7 CB 1
   ATOM 192 H C ALA A 8 ? 2.38489 24.18815 26.26116 0.152 30.21673 H ? A ? 7 H 1
   ATOM 193 HA C ALA A 8 ? 1.07009 26.30639 25.46657 0.152 28.81701 H ? A ? 7 HA 1
   ATOM 194 HB1 C ALA A 8 ? 1.59159 27.20507 27.56336 0.152 27.92252 H ? A ? 7 HB1 1
   ATOM 195 HB2 C ALA A 8 ? 1.07353 25.71125 27.71715 0.152 27.92252 H ? A ? 7 HB2 1
   ATOM 196 HB3 C ALA A 8 ? 2.62797 26.02610 27.80718 0.152 27.92252 H ? A ? 7 HB3 1
   ATOM 197 N D ALA A 8 ? 2.17739 24.70351 25.71478 0.293 25.01394 N ? A ? 7 N 1
   ATOM 198 CA D ALA A 8 ? 1.92668 26.11922 25.94689 0.293 23.88006 C ? A ? 7 CA 1
   ATOM 199 C D ALA A 8 ? 2.97968 26.98955 25.27993 0.293 22.85063 C ? A ? 7 C 1
   ATOM 200 O D ALA A 8 ? 2.67100 28.11365 24.86475 0.293 21.18150 O ? A ? 7 O 1
   ATOM 201 CB D ALA A 8 ? 1.89428 26.39519 27.44443 0.293 23.19160 C ? A ? 7 CB 1
   ATOM 202 H D ALA A 8 ? 2.36960 24.25092 26.42035 0.293 30.12828 H ? A ? 7 H 1
   ATOM 203 HA D ALA A 8 ? 1.06267 26.35147 25.57211 0.293 28.76762 H ? A ? 7 HA 1
   ATOM 204 HB1 D ALA A 8 ? 1.72202 27.33892 27.58797 0.293 27.94148 H ? A ? 7 HB1 1
   ATOM 205 HB2 D ALA A 8 ? 1.18929 25.86513 27.84805 0.293 27.94148 H ? A ? 7 HB2 1
   ATOM 206 HB3 D ALA A 8 ? 2.75139 26.15320 27.82876 0.293 27.94148 H ? A ? 7 HB3 1
   ATOM 207 N . VAL A 9 ? 4.22493 26.50523 25.19196 1.000 22.64394 N ? A ? 8 N 1
   ATOM 208 CA . VAL A 9 ? 5.30948 27.25439 24.54801 1.000 22.03044 C ? A ? 8 CA 1
   ATOM 209 C . VAL A 9 ? 5.07476 27.25042 23.04973 1.000 23.46453 C ? A ? 8 C 1
   ATOM 210 O . VAL A 9 ? 5.18228 28.30301 22.41338 1.000 21.08599 O ? A ? 8 O 1
   ATOM 211 CB . VAL A 9 ? 6.67281 26.64043 24.87512 1.000 25.66199 C ? A ? 8 CB 1
   ATOM 212 CG1 . VAL A 9 ? 7.76049 27.45372 24.20002 1.000 24.56859 C ? A ? 8 CG1 1
   ATOM 213 CG2 . VAL A 9 ? 6.89456 26.63700 26.35870 1.000 26.52118 C ? A ? 8 CG2 1
   ATOM 214 HA . VAL A 9 ? 5.31570 28.16800 24.87386 1.000 26.54808 H ? A ? 8 HA 1
   ATOM 215 HB . VAL A 9 ? 6.70387 25.72550 24.55444 1.000 30.90594 H ? A ? 8 HB 1
   ATOM 216 HG11 . VAL A 9 ? 8.62384 27.16851 24.53793 1.000 29.59386 H ? A ? 8 HG11 1
   ATOM 217 HG12 . VAL A 9 ? 7.71551 27.30766 23.24213 1.000 29.59386 H ? A ? 8 HG12 1
   ATOM 218 HG13 . VAL A 9 ? 7.62155 28.39302 24.39827 1.000 29.59386 H ? A ? 8 HG13 1
   ATOM 219 HG21 . VAL A 9 ? 7.81530 26.39137 26.53982 1.000 31.93697 H ? A ? 8 HG21 1
   ATOM 220 HG22 . VAL A 9 ? 6.71424 27.52417 26.70702 1.000 31.93697 H ? A ? 8 HG22 1
   ATOM 221 HG23 . VAL A 9 ? 6.29419 25.99330 26.76626 1.000 31.93697 H ? A ? 8 HG23 1
   ATOM 222 H A VAL A 9 ? 4.48302 25.81133 25.62956 0.555 27.28428 H ? A ? 8 H 1
   ATOM 223 H C VAL A 9 ? 4.46391 25.72876 25.47407 0.152 27.28428 H ? A ? 8 H 1
   ATOM 224 H D VAL A 9 ? 4.46794 25.73986 25.49981 0.293 27.28428 H ? A ? 8 H 1
   ATOM 225 N . TYR A 11 ? 2.32226 26.99191 21.63637 1.000 20.84907 N ? A ? 9 N 1
   ATOM 226 CA . TYR A 11 ? 1.15280 27.81490 21.30190 1.000 18.57928 C ? A ? 9 CA 1
   ATOM 227 C . TYR A 11 ? 1.52604 29.28708 21.27793 1.000 19.82927 C ? A ? 9 C 1
   ATOM 228 O . TYR A 11 ? 1.24073 29.98246 20.28413 1.000 17.30812 O ? A ? 9 O 1
   ATOM 229 HA . TYR A 11 ? 0.83322 27.57677 20.41756 1.000 22.40669 H ? A ? 9 HA 1
   ATOM 230 CB A TYR A 11 ? 0.02296 27.55502 22.25262 0.552 17.29207 C ? A ? 9 CB 1
   ATOM 231 CG A TYR A 11 ? -1.19957 28.36178 21.92616 0.552 17.74523 C ? A ? 9 CG 1
   ATOM 232 CD1 A TYR A 11 ? -1.25224 29.68345 22.27290 0.552 16.90780 C ? A ? 9 CD1 1
   ATOM 233 CD2 A TYR A 11 ? -2.29643 27.79676 21.28938 0.552 17.41281 C ? A ? 9 CD2 1
   ATOM 234 CE1 A TYR A 11 ? -2.34009 30.43877 22.01042 0.552 16.50187 C ? A ? 9 CE1 1
   ATOM 235 CE2 A TYR A 11 ? -3.39925 28.54191 21.01496 0.552 17.65927 C ? A ? 9 CE2 1
   ATOM 236 CZ A TYR A 11 ? -3.42570 29.84931 21.37896 0.552 15.11690 C ? A ? 9 CZ 1
   ATOM 237 OH A TYR A 11 ? -4.54954 30.58348 21.11343 0.552 17.87014 O ? A ? 9 OH 1
   ATOM 238 HB2 A TYR A 11 ? -0.21589 26.61579 22.21145 0.552 20.86204 H ? A ? 9 HB2 1
   ATOM 239 HB3 A TYR A 11 ? 0.30564 27.78637 23.15122 0.552 20.86204 H ? A ? 9 HB3 1
   ATOM 240 HD1 A TYR A 11 ? -0.52212 30.07087 22.69921 0.552 20.40092 H ? A ? 9 HD1 1
   ATOM 241 HD2 A TYR A 11 ? -2.27619 26.89883 21.04809 0.552 21.00693 H ? A ? 9 HD2 1
   ATOM 242 HE1 A TYR A 11 ? -2.36132 31.33753 22.24850 0.552 19.91380 H ? A ? 9 HE1 1
   ATOM 243 HE2 A TYR A 11 ? -4.12843 28.15998 20.58217 0.552 21.30268 H ? A ? 9 HE2 1
   ATOM 244 HH A TYR A 11 ? -4.52062 31.31329 21.52834 0.552 21.55572 H ? A ? 9 HH 1
   ATOM 245 CB B TYR A 11 ? 0.06465 27.54164 22.36856 0.448 17.32396 C ? A ? 9 CB 1
   ATOM 246 CG B TYR A 11 ? -1.17485 28.39686 22.27313 0.448 17.71808 C ? A ? 9 CG 1
   ATOM 247 CD1 B TYR A 11 ? -1.18451 29.66528 22.81567 0.448 17.30776 C ? A ? 9 CD1 1
   ATOM 248 CD2 B TYR A 11 ? -2.31394 27.93689 21.63731 0.448 17.60672 C ? A ? 9 CD2 1
   ATOM 249 CE1 B TYR A 11 ? -2.29523 30.47587 22.72947 0.448 14.70458 C ? A ? 9 CE1 1
   ATOM 250 CE2 B TYR A 11 ? -3.42202 28.73335 21.54454 0.448 17.11241 C ? A ? 9 CE2 1
   ATOM 251 CZ B TYR A 11 ? -3.41790 29.99931 22.09395 0.448 15.29271 C ? A ? 9 CZ 1
   ATOM 252 OH B TYR A 11 ? -4.55102 30.75085 21.96502 0.448 15.97900 O ? A ? 9 OH 1
   ATOM 253 HB2 B TYR A 11 ? -0.21673 26.61701 22.28621 0.448 20.90030 H ? A ? 9 HB2 1
   ATOM 254 HB3 B TYR A 11 ? 0.45235 27.69368 23.24461 0.448 20.90030 H ? A ? 9 HB3 1
   ATOM 255 HD1 B TYR A 11 ? -0.42439 29.98016 23.24922 0.448 20.88086 H ? A ? 9 HD1 1
   ATOM 256 HD2 B TYR A 11 ? -2.32642 27.08208 21.27119 0.448 21.23961 H ? A ? 9 HD2 1
   ATOM 257 HE1 B TYR A 11 ? -2.28596 31.33101 23.09493 0.448 17.75704 H ? A ? 9 HE1 1
   ATOM 258 HE2 B TYR A 11 ? -4.18184 28.42029 21.10915 0.448 20.64645 H ? A ? 9 HE2 1
   ATOM 259 HH B TYR A 11 ? -4.35407 31.56729 21.94979 0.448 19.28635 H ? A ? 9 HH 1
   ATOM 260 N . ARG A 12 ? 2.12849 29.74317 22.37916 1.000 18.78115 N ? A ? 10 N 1
   ATOM 261 CA . ARG A 12 ? 2.42939 31.15674 22.46646 1.000 20.27378 C ? A ? 10 CA 1
   ATOM 262 C . ARG A 12 ? 3.38547 31.59130 21.37020 1.000 18.93055 C ? A ? 10 C 1
   ATOM 263 O . ARG A 12 ? 3.23837 32.67520 20.81725 1.000 19.54845 O ? A ? 10 O 1
   ATOM 264 CB . ARG A 12 ? 2.86919 31.58261 23.86962 1.000 18.53211 C ? A ? 10 CB 1
   ATOM 265 CG . ARG A 12 ? 4.21526 31.15641 24.24261 1.000 16.89054 C ? A ? 10 CG 1
   ATOM 266 CD . ARG A 12 ? 4.27447 31.08988 25.74444 1.000 20.21662 C ? A ? 10 CD 1
   ATOM 267 NE . ARG A 12 ? 5.59637 30.69459 26.23318 1.000 18.83081 N ? A ? 10 NE 1
   ATOM 268 CZ . ARG A 12 ? 5.85396 30.15013 27.42156 1.000 23.91531 C ? A ? 10 CZ 1
   ATOM 269 NH1 . ARG A 12 ? 4.90063 29.77046 28.25481 1.000 22.78755 N ? A ? 10 NH1 1
   ATOM 270 NH2 . ARG A 12 ? 7.12086 29.94395 27.77555 1.000 24.04856 N ? A ? 10 NH2 1
   ATOM 271 H . ARG A 12 ? 2.36082 29.26855 23.05767 1.000 22.64894 H ? A ? 10 H 1
   ATOM 272 HA . ARG A 12 ? 1.60430 31.64665 22.32460 1.000 24.44008 H ? A ? 10 HA 1
   ATOM 273 HB2 . ARG A 12 ? 2.84504 32.55102 23.91950 1.000 22.35009 H ? A ? 10 HB2 1
   ATOM 274 HB3 . ARG A 12 ? 2.25291 31.20171 24.51461 1.000 22.35009 H ? A ? 10 HB3 1
   ATOM 275 HG2 . ARG A 12 ? 4.40330 30.27864 23.87510 1.000 20.38020 H ? A ? 10 HG2 1
   ATOM 276 HG3 . ARG A 12 ? 4.87044 31.79680 23.92394 1.000 20.38020 H ? A ? 10 HG3 1
   ATOM 277 HD2 . ARG A 12 ? 4.06726 31.96429 26.10963 1.000 24.37149 H ? A ? 10 HD2 1
   ATOM 278 HD3 . ARG A 12 ? 3.62934 30.43750 26.05925 1.000 24.37149 H ? A ? 10 HD3 1
   ATOM 279 HE . ARG A 12 ? 6.26459 30.82509 25.70776 1.000 22.70852 H ? A ? 10 HE 1
   ATOM 280 HH11 . ARG A 12 ? 4.07458 29.87130 28.03782 1.000 27.45661 H ? A ? 10 HH11 1
   ATOM 281 HH12 . ARG A 12 ? 5.10643 29.42260 29.01391 1.000 27.45661 H ? A ? 10 HH12 1
   ATOM 282 HH21 . ARG A 12 ? 7.75777 30.16141 27.24015 1.000 28.96982 H ? A ? 10 HH21 1
   ATOM 283 HH22 . ARG A 12 ? 7.30223 29.59332 28.53960 1.000 28.96982 H ? A ? 10 HH22 1
   ATOM 284 N . GLN A 13 ? 4.38257 30.77541 21.05611 1.000 20.22508 N ? A ? 11 N 1
   ATOM 285 CA . GLN A 13 ? 5.27900 31.16955 19.98466 1.000 18.81521 C ? A ? 11 CA 1
   ATOM 286 C . GLN A 13 ? 4.56510 31.30353 18.65266 1.000 20.29711 C ? A ? 11 C 1
   ATOM 287 O . GLN A 13 ? 4.89910 32.20120 17.86298 1.000 20.78744 O ? A ? 11 O 1
   ATOM 288 CB . GLN A 13 ? 6.45565 30.20427 19.91511 1.000 19.06829 C ? A ? 11 CB 1
   ATOM 289 CG . GLN A 13 ? 7.39397 30.36116 21.10649 1.000 20.84558 C ? A ? 11 CG 1
   ATOM 290 CD . GLN A 13 ? 8.50815 29.33611 21.12032 1.000 21.48974 C ? A ? 11 CD 1
   ATOM 291 OE1 . GLN A 13 ? 8.49511 28.40357 20.32474 1.000 21.72485 O ? A ? 11 OE1 1
   ATOM 292 NE2 . GLN A 13 ? 9.50648 29.55384 21.97726 1.000 23.10992 N ? A ? 11 NE2 1
   ATOM 293 H . GLN A 13 ? 4.55364 30.02111 21.43210 1.000 24.38165 H ? A ? 11 H 1
   ATOM 294 HA . GLN A 13 ? 5.64220 32.04731 20.18093 1.000 22.68981 H ? A ? 11 HA 1
   ATOM 295 HB2 . GLN A 13 ? 6.12100 29.29384 19.91003 1.000 22.99350 H ? A ? 11 HB2 1
   ATOM 296 HB3 . GLN A 13 ? 6.96147 30.37633 19.10552 1.000 22.99350 H ? A ? 11 HB3 1
   ATOM 297 HG2 . GLN A 13 ? 7.79859 31.24218 21.07521 1.000 25.12625 H ? A ? 11 HG2 1
   ATOM 298 HG3 . GLN A 13 ? 6.88377 30.25927 21.92516 1.000 25.12625 H ? A ? 11 HG3 1
   ATOM 299 HE21 . GLN A 13 ? 9.49396 30.24813 22.48461 1.000 27.84346 H ? A ? 11 HE21 1
   ATOM 300 HE22 . GLN A 13 ? 10.16282 28.99997 22.02253 1.000 27.84346 H ? A ? 11 HE22 1
   ATOM 301 N . SER A 14 ? 3.60756 30.42296 18.38502 1.000 18.50025 N ? A ? 12 N 1
   ATOM 302 CA . SER A 14 ? 2.89318 30.50343 17.12857 1.000 19.73671 C ? A ? 12 CA 1
   ATOM 303 C . SER A 14 ? 2.01628 31.73035 17.10829 1.000 21.07524 C ? A ? 12 C 1
   ATOM 304 O . SER A 14 ? 1.91125 32.40615 16.08018 1.000 19.27409 O ? A ? 12 O 1
   ATOM 305 CB . SER A 14 ? 2.02107 29.27745 16.97020 1.000 20.72119 C ? A ? 12 CB 1
   ATOM 306 OG . SER A 14 ? 2.82092 28.14805 16.69701 1.000 22.54332 O ? A ? 12 OG 1
   ATOM 307 H . SER A 14 ? 3.36040 29.78438 18.90534 1.000 22.31185 H ? A ? 12 H 1
   ATOM 308 HA . SER A 14 ? 3.52898 30.54311 16.39708 1.000 23.79561 H ? A ? 12 HA 1
   ATOM 309 HB2 . SER A 14 ? 1.52823 29.12811 17.79222 1.000 24.97697 H ? A ? 12 HB2 1
   ATOM 310 HB3 . SER A 14 ? 1.40455 29.41731 16.23450 1.000 24.97697 H ? A ? 12 HB3 1
   ATOM 311 HG . SER A 14 ? 2.35810 27.44896 16.74862 1.000 27.16354 H ? A ? 12 HG 1
   ATOM 312 N . ALA A 15 ? 1.39072 32.03398 18.24920 1.000 18.99809 N ? A ? 13 N 1
   ATOM 313 CA . ALA A 15 ? 0.51391 33.18704 18.31201 1.000 18.43981 C ? A ? 13 CA 1
   ATOM 314 C . ALA A 15 ? 1.31389 34.42972 18.06151 1.000 20.69811 C ? A ? 13 C 1
   ATOM 315 O . ALA A 15 ? 0.90868 35.31173 17.30068 1.000 20.40556 O ? A ? 13 O 1
   ATOM 316 CB . ALA A 15 ? -0.11734 33.25369 19.69783 1.000 21.36860 C ? A ? 13 CB 1
   ATOM 317 H . ALA A 15 ? 1.46033 31.59223 18.98378 1.000 22.90926 H ? A ? 13 H 1
   ATOM 318 HA . ALA A 15 ? -0.19125 33.11447 17.64991 1.000 22.23932 H ? A ? 13 HA 1
   ATOM 319 HB1 . ALA A 15 ? -0.65217 34.06030 19.76277 1.000 25.75388 H ? A ? 13 HB1 1
   ATOM 320 HB2 . ALA A 15 ? -0.67873 32.47327 19.82700 1.000 25.75388 H ? A ? 13 HB2 1
   ATOM 321 HB3 . ALA A 15 ? 0.58655 33.26891 20.36507 1.000 25.75388 H ? A ? 13 HB3 1
   ATOM 322 N A LEU A 16 ? 2.48542 34.52143 18.69471 0.229 20.67272 N ? A ? 14 N 1
   ATOM 323 CA A LEU A 16 ? 3.30914 35.71559 18.57643 0.229 19.39063 C ? A ? 14 CA 1
   ATOM 324 C A LEU A 16 ? 3.94489 35.83955 17.19186 0.229 19.56443 C ? A ? 14 C 1
   ATOM 325 O A LEU A 16 ? 4.19174 36.95811 16.72890 0.229 20.49566 O ? A ? 14 O 1
   ATOM 326 CB A LEU A 16 ? 4.35509 35.72715 19.69307 0.229 18.67366 C ? A ? 14 CB 1
   ATOM 327 CG A LEU A 16 ? 3.90393 36.06749 21.11938 0.229 18.52220 C ? A ? 14 CG 1
   ATOM 328 CD1 A LEU A 16 ? 4.82661 35.30435 22.10078 0.229 19.10068 C ? A ? 14 CD1 1
   ATOM 329 CD2 A LEU A 16 ? 3.88867 37.56224 21.40105 0.229 19.92335 C ? A ? 14 CD2 1
   ATOM 330 H A LEU A 16 ? 2.82123 33.90804 19.19530 0.229 24.91882 H ? A ? 14 H 1
   ATOM 331 HA A LEU A 16 ? 2.75543 36.50363 18.69180 0.229 23.38031 H ? A ? 14 HA 1
   ATOM 332 HB2 A LEU A 16 ? 4.74989 34.84201 19.73253 0.229 22.51995 H ? A ? 14 HB2 1
   ATOM 333 HB3 A LEU A 16 ? 5.03030 36.38122 19.45394 0.229 22.51995 H ? A ? 14 HB3 1
   ATOM 334 HG A LEU A 16 ? 2.98282 35.79041 21.24464 0.229 22.33819 H ? A ? 14 HG 1
   ATOM 335 HD11 A LEU A 16 ? 4.74265 35.69744 22.98358 0.229 23.03237 H ? A ? 14 HD11 1
   ATOM 336 HD12 A LEU A 16 ? 4.55825 34.37257 22.12672 0.229 23.03237 H ? A ? 14 HD12 1
   ATOM 337 HD13 A LEU A 16 ? 5.74356 35.37603 21.79262 0.229 23.03237 H ? A ? 14 HD13 1
   ATOM 338 HD21 A LEU A 16 ? 3.82259 37.70251 22.35858 0.229 24.01958 H ? A ? 14 HD21 1
   ATOM 339 HD22 A LEU A 16 ? 4.70932 37.95532 21.06502 0.229 24.01958 H ? A ? 14 HD22 1
   ATOM 340 HD23 A LEU A 16 ? 3.12459 37.95988 20.95499 0.229 24.01958 H ? A ? 14 HD23 1
   ATOM 341 N B LEU A 16 ? 2.49412 34.50781 18.67715 0.771 20.73551 N ? A ? 14 N 1
   ATOM 342 CA B LEU A 16 ? 3.32451 35.68379 18.56742 0.771 19.29793 C ? A ? 14 CA 1
   ATOM 343 C B LEU A 16 ? 3.87352 35.83030 17.15927 0.771 19.41892 C ? A ? 14 C 1
   ATOM 344 O B LEU A 16 ? 4.01553 36.94862 16.65836 0.771 20.46293 O ? A ? 14 O 1
   ATOM 345 CB B LEU A 16 ? 4.38788 35.54944 19.65339 0.771 18.70361 C ? A ? 14 CB 1
   ATOM 346 CG B LEU A 16 ? 3.87781 35.74439 21.08001 0.771 19.37577 C ? A ? 14 CG 1
   ATOM 347 CD1 B LEU A 16 ? 4.91337 35.26922 22.10536 0.771 19.05905 C ? A ? 14 CD1 1
   ATOM 348 CD2 B LEU A 16 ? 3.41718 37.18567 21.25688 0.771 19.95642 C ? A ? 14 CD2 1
   ATOM 349 H B LEU A 16 ? 2.83164 33.88548 19.16540 0.771 24.99417 H ? A ? 14 H 1
   ATOM 350 HA B LEU A 16 ? 2.84095 36.51054 18.72086 0.771 23.26907 H ? A ? 14 HA 1
   ATOM 351 HB2 B LEU A 16 ? 4.77097 34.65994 19.59926 0.771 22.55588 H ? A ? 14 HB2 1
   ATOM 352 HB3 B LEU A 16 ? 5.07414 36.21642 19.49496 0.771 22.55588 H ? A ? 14 HB3 1
   ATOM 353 HG B LEU A 16 ? 3.10099 35.18990 21.25318 0.771 23.36247 H ? A ? 14 HG 1
   ATOM 354 HD11 B LEU A 16 ? 4.82076 35.79552 22.91488 0.771 22.98241 H ? A ? 14 HD11 1
   ATOM 355 HD12 B LEU A 16 ? 4.75749 34.33194 22.30054 0.771 22.98241 H ? A ? 14 HD12 1
   ATOM 356 HD13 B LEU A 16 ? 5.80193 35.38652 21.73440 0.771 22.98241 H ? A ? 14 HD13 1
   ATOM 357 HD21 B LEU A 16 ? 3.11676 37.31133 22.17059 0.771 24.05925 H ? A ? 14 HD21 1
   ATOM 358 HD22 B LEU A 16 ? 4.16016 37.78007 21.06826 0.771 24.05925 H ? A ? 14 HD22 1
   ATOM 359 HD23 B LEU A 16 ? 2.68815 37.36196 20.64179 0.771 24.05925 H ? A ? 14 HD23 1
   ATOM 360 N . THR A 17 ? 4.23909 34.71686 16.53040 1.000 18.78331 N ? A ? 15 N 1
   ATOM 361 CA . THR A 17 ? 4.62099 34.74836 15.14057 1.000 16.61968 C ? A ? 15 CA 1
   ATOM 362 C . THR A 17 ? 3.50941 35.31761 14.27211 1.000 19.87506 C ? A ? 15 C 1
   ATOM 363 O . THR A 17 ? 3.79552 36.12558 13.36712 1.000 19.83052 O ? A ? 15 O 1
   ATOM 364 CB . THR A 17 ? 4.95190 33.30846 14.75408 1.000 18.59125 C ? A ? 15 CB 1
   ATOM 365 OG1 . THR A 17 ? 6.16406 32.87532 15.39734 1.000 19.53683 O ? A ? 15 OG1 1
   ATOM 366 CG2 . THR A 17 ? 5.14811 33.17099 13.27889 1.000 25.44317 C ? A ? 15 CG2 1
   ATOM 367 HA . THR A 17 ? 5.39240 35.31910 14.99885 1.000 20.05517 H ? A ? 15 HA 1
   ATOM 368 HB . THR A 17 ? 4.20791 32.75175 15.03240 1.000 22.42105 H ? A ? 15 HB 1
   ATOM 369 HG1 . THR A 17 ? 6.19960 33.18106 16.17892 1.000 23.55574 H ? A ? 15 HG1 1
   ATOM 370 HG21 . THR A 17 ? 5.62428 32.34900 13.08272 1.000 30.64335 H ? A ? 15 HG21 1
   ATOM 371 HG22 . THR A 17 ? 4.28832 33.15147 12.83025 1.000 30.64335 H ? A ? 15 HG22 1
   ATOM 372 HG23 . THR A 17 ? 5.66239 33.92096 12.94131 1.000 30.64335 H ? A ? 15 HG23 1
   ATOM 373 H A THR A 17 ? 4.22197 33.92845 16.87350 0.229 22.65153 H ? A ? 15 H 1
   ATOM 374 H B THR A 17 ? 4.27181 33.93698 16.89139 0.771 22.65153 H ? A ? 15 H 1
   ATOM 375 N . LEU A 18 ? 2.28234 34.84081 14.45867 1.000 18.92070 N ? A ? 16 N 1
   ATOM 376 CA . LEU A 18 ? 1.19938 35.42974 13.66697 1.000 19.64897 C ? A ? 16 CA 1
   ATOM 377 C . LEU A 18 ? 0.99107 36.92279 13.96153 1.000 21.41380 C ? A ? 16 C 1
   ATOM 378 O . LEU A 18 ? 0.77635 37.70851 13.03212 1.000 23.71704 O ? A ? 16 O 1
   ATOM 379 H . LEU A 18 ? 2.05951 34.21425 15.00398 1.000 22.81640 H ? A ? 16 H 1
   ATOM 380 HA . LEU A 18 ? 1.45634 35.34269 12.73568 1.000 23.69032 H ? A ? 16 HA 1
   ATOM 381 CB A LEU A 18 ? -0.10382 34.67864 13.87882 0.493 22.89090 C ? A ? 16 CB 1
   ATOM 382 CG A LEU A 18 ? -0.02605 33.21862 13.46110 0.493 21.65083 C ? A ? 16 CG 1
   ATOM 383 CD1 A LEU A 18 ? -1.39631 32.55384 13.58956 0.493 21.59288 C ? A ? 16 CD1 1
   ATOM 384 CD2 A LEU A 18 ? 0.51219 33.06721 12.05663 0.493 20.86926 C ? A ? 16 CD2 1
   ATOM 385 HB2 A LEU A 18 ? -0.33371 34.70885 14.82070 0.493 27.58063 H ? A ? 16 HB2 1
   ATOM 386 HB3 A LEU A 18 ? -0.79980 35.10375 13.35365 0.493 27.58063 H ? A ? 16 HB3 1
   ATOM 387 HG A LEU A 18 ? 0.59266 32.76426 14.05411 0.493 26.09254 H ? A ? 16 HG 1
   ATOM 388 HD11 A LEU A 18 ? -1.28527 31.59107 13.54915 0.493 26.02301 H ? A ? 16 HD11 1
   ATOM 389 HD12 A LEU A 18 ? -1.79122 32.80590 14.43892 0.493 26.02301 H ? A ? 16 HD12 1
   ATOM 390 HD13 A LEU A 18 ? -1.96182 32.85249 12.86024 0.493 26.02301 H ? A ? 16 HD13 1
   ATOM 391 HD21 A LEU A 18 ? 0.28646 32.18389 11.72544 0.493 25.15466 H ? A ? 16 HD21 1
   ATOM 392 HD22 A LEU A 18 ? 0.11172 33.74518 11.49017 0.493 25.15466 H ? A ? 16 HD22 1
   ATOM 393 HD23 A LEU A 18 ? 1.47572 33.17768 12.07408 0.493 25.15466 H ? A ? 16 HD23 1
   ATOM 394 CB B LEU A 18 ? -0.08135 34.63937 13.88157 0.507 22.90192 C ? A ? 16 CB 1
   ATOM 395 CG B LEU A 18 ? -0.65639 33.97944 12.62910 0.507 19.22591 C ? A ? 16 CG 1
   ATOM 396 CD1 B LEU A 18 ? 0.22069 32.94997 11.96415 0.507 21.03415 C ? A ? 16 CD1 1
   ATOM 397 CD2 B LEU A 18 ? -2.01855 33.34019 13.01130 0.507 20.75883 C ? A ? 16 CD2 1
   ATOM 398 HB2 B LEU A 18 ? 0.09807 33.93561 14.52456 0.507 27.59385 H ? A ? 16 HB2 1
   ATOM 399 HB3 B LEU A 18 ? -0.75751 35.24180 14.22913 0.507 27.59385 H ? A ? 16 HB3 1
   ATOM 400 HG B LEU A 18 ? -0.74598 34.67579 11.95980 0.507 23.18265 H ? A ? 16 HG 1
   ATOM 401 HD11 B LEU A 18 ? -0.28893 32.50066 11.27183 0.507 25.35253 H ? A ? 16 HD11 1
   ATOM 402 HD12 B LEU A 18 ? 0.98905 33.39472 11.57335 0.507 25.35253 H ? A ? 16 HD12 1
   ATOM 403 HD13 B LEU A 18 ? 0.51332 32.30739 12.62924 0.507 25.35253 H ? A ? 16 HD13 1
   ATOM 404 HD21 B LEU A 18 ? -2.40999 32.93517 12.22160 0.507 25.02214 H ? A ? 16 HD21 1
   ATOM 405 HD22 B LEU A 18 ? -1.87051 32.66412 13.69095 0.507 25.02214 H ? A ? 16 HD22 1
   ATOM 406 HD23 B LEU A 18 ? -2.60642 34.03117 13.35461 0.507 25.02214 H ? A ? 16 HD23 1
   ATOM 407 N . MET A 19 ? 1.12842 37.33943 15.22481 1.000 22.04925 N ? A ? 17 N 1
   ATOM 408 CA . MET A 19 ? 0.99853 38.77023 15.53877 1.000 24.47644 C ? A ? 17 CA 1
   ATOM 409 C . MET A 19 ? 2.03042 39.57192 14.80358 1.000 25.77625 C ? A ? 17 C 1
   ATOM 410 O . MET A 19 ? 1.79343 40.71377 14.39508 1.000 26.23448 O ? A ? 17 O 1
   ATOM 411 H . MET A 19 ? 1.29200 36.83197 15.89959 1.000 26.57065 H ? A ? 17 H 1
   ATOM 412 HA . MET A 19 ? 0.09328 39.02198 15.29782 1.000 29.48328 H ? A ? 17 HA 1
   ATOM 413 CB A MET A 19 ? 1.16614 38.98119 17.04457 0.450 22.75282 C ? A ? 17 CB 1
   ATOM 414 CG A MET A 19 ? 0.20891 39.94837 17.70671 0.450 19.74575 C ? A ? 17 CG 1
   ATOM 415 SD A MET A 19 ? 0.43285 39.77052 19.48334 0.450 21.39491 S ? A ? 17 SD 1
   ATOM 416 CE A MET A 19 ? 2.17468 40.12991 19.63847 0.450 21.24125 C ? A ? 17 CE 1
   ATOM 417 HB2 A MET A 19 ? 1.05061 38.12348 17.48263 0.450 27.41494 H ? A ? 17 HB2 1
   ATOM 418 HB3 A MET A 19 ? 2.06248 39.31649 17.20285 0.450 27.41494 H ? A ? 17 HB3 1
   ATOM 419 HG2 A MET A 19 ? 0.41255 40.85952 17.44360 0.450 23.80645 H ? A ? 17 HG2 1
   ATOM 420 HG3 A MET A 19 ? -0.70705 39.73209 17.47186 0.450 23.80645 H ? A ? 17 HG3 1
   ATOM 421 HE1 A MET A 19 ? 2.37836 40.30950 20.56968 0.450 25.60106 H ? A ? 17 HE1 1
   ATOM 422 HE2 A MET A 19 ? 2.68384 39.36398 19.33025 0.450 25.60106 H ? A ? 17 HE2 1
   ATOM 423 HE3 A MET A 19 ? 2.38617 40.90698 19.09779 0.450 25.60106 H ? A ? 17 HE3 1
   ATOM 424 CB B MET A 19 ? 1.23225 39.04091 17.02069 0.550 22.72237 C ? A ? 17 CB 1
   ATOM 425 CG B MET A 19 ? 0.06608 38.81021 17.89079 0.550 18.76886 C ? A ? 17 CG 1
   ATOM 426 SD B MET A 19 ? 0.51622 38.75923 19.63145 0.550 18.62562 S ? A ? 17 SD 1
   ATOM 427 CE B MET A 19 ? 1.61174 40.15229 19.74805 0.550 18.83339 C ? A ? 17 CE 1
   ATOM 428 HB2 B MET A 19 ? 1.94446 38.45942 17.32975 0.550 27.37839 H ? A ? 17 HB2 1
   ATOM 429 HB3 B MET A 19 ? 1.49309 39.96933 17.12514 0.550 27.37839 H ? A ? 17 HB3 1
   ATOM 430 HG2 B MET A 19 ? -0.57234 39.52950 17.76458 0.550 22.63418 H ? A ? 17 HG2 1
   ATOM 431 HG3 B MET A 19 ? -0.34094 37.96085 17.65880 0.550 22.63418 H ? A ? 17 HG3 1
   ATOM 432 HE1 B MET A 19 ? 1.79985 40.32871 20.68314 0.550 22.71162 H ? A ? 17 HE1 1
   ATOM 433 HE2 B MET A 19 ? 2.43503 39.94681 19.27808 0.550 22.71162 H ? A ? 17 HE2 1
   ATOM 434 HE3 B MET A 19 ? 1.18473 40.92445 19.34515 0.550 22.71162 H ? A ? 17 HE3 1
   ATOM 435 N . ALA A 20 ? 3.23572 39.08327 14.80068 1.000 24.75729 N ? A ? 18 N 1
   ATOM 436 CA . ALA A 20 ? 4.30053 39.82300 14.18617 1.000 23.77694 C ? A ? 18 CA 1
   ATOM 437 C . ALA A 20 ? 4.06104 39.95421 12.69994 1.000 24.49390 C ? A ? 18 C 1
   ATOM 438 O . ALA A 20 ? 4.38139 40.98874 12.10949 1.000 23.31019 O ? A ? 18 O 1
   ATOM 439 CB . ALA A 20 ? 5.62750 39.13622 14.46306 1.000 24.68752 C ? A ? 18 CB 1
   ATOM 440 H . ALA A 20 ? 3.46667 38.32974 15.14486 1.000 29.82030 H ? A ? 18 H 1
   ATOM 441 HA . ALA A 20 ? 4.34288 40.71404 14.56716 1.000 28.64387 H ? A ? 18 HA 1
   ATOM 442 HB1 . ALA A 20 ? 6.33508 39.62277 14.01196 1.000 29.73657 H ? A ? 18 HB1 1
   ATOM 443 HB2 . ALA A 20 ? 5.78714 39.13165 15.41982 1.000 29.73657 H ? A ? 18 HB2 1
   ATOM 444 HB3 . ALA A 20 ? 5.58757 38.22606 14.13002 1.000 29.73657 H ? A ? 18 HB3 1
   ATOM 445 N A SER A 21 ? 3.51534 38.92737 12.05142 0.368 20.43645 N ? A ? 19 N 1
   ATOM 446 CA A SER A 21 ? 3.32495 39.05970 10.60890 0.368 20.43541 C ? A ? 19 CA 1
   ATOM 447 C A SER A 21 ? 2.18394 40.01964 10.27943 0.368 21.52507 C ? A ? 19 C 1
   ATOM 448 O A SER A 21 ? 2.18600 40.66807 9.22676 0.368 19.70514 O ? A ? 19 O 1
   ATOM 449 CB A SER A 21 ? 3.05170 37.70325 9.97549 0.368 19.45349 C ? A ? 19 CB 1
   ATOM 450 OG A SER A 21 ? 2.67946 37.86317 8.62659 0.368 19.73563 O ? A ? 19 OG 1
   ATOM 451 H A SER A 21 ? 3.26076 38.18471 12.40249 0.368 24.63529 H ? A ? 19 H 1
   ATOM 452 HA A SER A 21 ? 4.14540 39.40888 10.22702 0.368 24.63404 H ? A ? 19 HA 1
   ATOM 453 HB2 A SER A 21 ? 3.85554 37.16235 10.02201 0.368 23.45574 H ? A ? 19 HB2 1
   ATOM 454 HB3 A SER A 21 ? 2.33022 37.26726 10.45537 0.368 23.45574 H ? A ? 19 HB3 1
   ATOM 455 HG A SER A 21 ? 2.57852 37.11155 8.26536 0.368 23.79431 H ? A ? 19 HG 1
   ATOM 456 N B SER A 21 ? 3.49138 38.92080 12.08050 0.632 20.38313 N ? A ? 19 N 1
   ATOM 457 CA B SER A 21 ? 3.20124 39.01530 10.65889 0.632 20.37386 C ? A ? 19 CA 1
   ATOM 458 C B SER A 21 ? 2.16580 40.10743 10.39879 0.632 21.55698 C ? A ? 19 C 1
   ATOM 459 O B SER A 21 ? 2.36299 40.97370 9.55154 0.632 20.65444 O ? A ? 19 O 1
   ATOM 460 CB B SER A 21 ? 2.71520 37.67287 10.12427 0.632 19.28880 C ? A ? 19 CB 1
   ATOM 461 OG B SER A 21 ? 2.46993 37.74618 8.75066 0.632 19.34820 O ? A ? 19 OG 1
   ATOM 462 H B SER A 21 ? 3.27079 38.17733 12.45225 0.632 24.57131 H ? A ? 19 H 1
   ATOM 463 HA B SER A 21 ? 4.01662 39.24071 10.18430 0.632 24.56018 H ? A ? 19 HA 1
   ATOM 464 HB2 B SER A 21 ? 3.39628 37.00198 10.28837 0.632 23.25811 H ? A ? 19 HB2 1
   ATOM 465 HB3 B SER A 21 ? 1.89380 37.43002 10.57949 0.632 23.25811 H ? A ? 19 HB3 1
   ATOM 466 HG B SER A 21 ? 2.15631 37.01712 8.47550 0.632 23.32939 H ? A ? 19 HG 1
   ATOM 467 N A HIS A 22 ? 1.19655 40.10446 11.14880 0.368 20.64511 N ? A ? 20 N 1
   ATOM 468 CA A HIS A 22 ? 0.06858 40.97762 10.88883 0.368 18.65350 C ? A ? 20 CA 1
   ATOM 469 C A HIS A 22 ? 0.40479 42.40765 11.23128 0.368 19.64943 C ? A ? 20 C 1
   ATOM 470 O A HIS A 22 ? -0.01513 43.34831 10.53168 0.368 18.50751 O ? A ? 20 O 1
   ATOM 471 CB A HIS A 22 ? -1.09596 40.46611 11.69931 0.368 18.90606 C ? A ? 20 CB 1
   ATOM 472 CG A HIS A 22 ? -1.80101 39.34737 11.02136 0.368 18.36750 C ? A ? 20 CG 1
   ATOM 473 ND1 A HIS A 22 ? -2.74603 39.54711 10.04356 0.368 17.96240 N ? A ? 20 ND1 1
   ATOM 474 CD2 A HIS A 22 ? -1.63083 38.00613 11.11104 0.368 16.85967 C ? A ? 20 CD2 1
   ATOM 475 CE1 A HIS A 22 ? -3.17034 38.37841 9.59518 0.368 18.51426 C ? A ? 20 CE1 1
   ATOM 476 NE2 A HIS A 22 ? -2.51032 37.42605 10.23148 0.368 18.17032 N ? A ? 20 NE2 1
   ATOM 477 H A HIS A 22 ? 1.15397 39.67173 11.89078 0.368 24.88568 H ? A ? 20 H 1
   ATOM 478 HA A HIS A 22 ? -0.17839 40.96752 9.95085 0.368 22.49575 H ? A ? 20 HA 1
   ATOM 479 HB2 A HIS A 22 ? -0.77145 40.14535 12.55529 0.368 22.79882 H ? A ? 20 HB2 1
   ATOM 480 HB3 A HIS A 22 ? -1.73084 41.18697 11.83418 0.368 22.79882 H ? A ? 20 HB3 1
   ATOM 481 HD1 A HIS A 22 ? -3.01908 40.31404 9.76631 0.368 21.66643 H ? A ? 20 HD1 1
   ATOM 482 HD2 A HIS A 22 ? -1.03037 37.56174 11.66500 0.368 20.34316 H ? A ? 20 HD2 1
   ATOM 483 HE1 A HIS A 22 ? -3.82138 38.24841 8.94392 0.368 22.32866 H ? A ? 20 HE1 1
   ATOM 484 N B HIS A 22 ? 1.04322 40.05960 11.09839 0.632 20.67155 N ? A ? 20 N 1
   ATOM 485 CA B HIS A 22 ? -0.04392 41.00241 10.85974 0.632 18.50533 C ? A ? 20 CA 1
   ATOM 486 C B HIS A 22 ? 0.23394 42.40856 11.38749 0.632 19.78733 C ? A ? 20 C 1
   ATOM 487 O B HIS A 22 ? -0.37636 43.37211 10.90971 0.632 18.25047 O ? A ? 20 O 1
   ATOM 488 CB B HIS A 22 ? -1.34551 40.40949 11.37088 0.632 20.15378 C ? A ? 20 CB 1
   ATOM 489 CG B HIS A 22 ? -1.84913 39.27784 10.53143 0.632 19.40345 C ? A ? 20 CG 1
   ATOM 490 ND1 B HIS A 22 ? -2.67200 39.43580 9.44289 0.632 19.08265 N ? A ? 20 ND1 1
   ATOM 491 CD2 B HIS A 22 ? -1.58137 37.94858 10.60422 0.632 16.68654 C ? A ? 20 CD2 1
   ATOM 492 CE1 B HIS A 22 ? -2.90146 38.25888 8.88849 0.632 18.92280 C ? A ? 20 CE1 1
   ATOM 493 NE2 B HIS A 22 ? -2.25285 37.34035 9.57657 0.632 19.24135 N ? A ? 20 NE2 1
   ATOM 494 H B HIS A 22 ? 0.88276 39.48850 11.72103 0.632 24.91742 H ? A ? 20 H 1
   ATOM 495 HA B HIS A 22 ? -0.16990 41.13065 9.90655 0.632 22.31795 H ? A ? 20 HA 1
   ATOM 496 HB2 B HIS A 22 ? -1.20581 40.07436 12.27036 0.632 24.29609 H ? A ? 20 HB2 1
   ATOM 497 HB3 B HIS A 22 ? -2.02485 41.10185 11.37659 0.632 24.29609 H ? A ? 20 HB3 1
   ATOM 498 HD1 B HIS A 22 ? -2.98897 40.18544 9.16509 0.632 23.01073 H ? A ? 20 HD1 1
   ATOM 499 HD2 B HIS A 22 ? -1.04202 37.52879 11.23492 0.632 20.13540 H ? A ? 20 HD2 1
   ATOM 500 HE1 B HIS A 22 ? -3.43089 38.10449 8.13965 0.632 22.81891 H ? A ? 20 HE1 1
   ATOM 501 N . PHE A 23 ? 1.19509 42.57637 12.28177 1.000 20.42706 N ? A ? 21 N 1
   ATOM 502 CA . PHE A 23 ? 1.68422 43.88698 12.60218 1.000 20.68251 C ? A ? 21 CA 1
   ATOM 503 C . PHE A 23 ? 2.69477 44.35049 11.56028 1.000 20.32119 C ? A ? 21 C 1
   ATOM 504 O . PHE A 23 ? 2.53235 45.40585 10.93499 1.000 23.22440 O ? A ? 21 O 1
   ATOM 505 HA . PHE A 23 ? 0.96266 44.53509 12.58817 1.000 24.93056 H ? A ? 21 HA 1
   ATOM 506 CB A PHE A 23 ? 2.22911 43.89275 14.02465 0.655 19.84043 C ? A ? 21 CB 1
   ATOM 507 CG A PHE A 23 ? 2.67505 45.24218 14.46996 0.655 19.77276 C ? A ? 21 CG 1
   ATOM 508 CD1 A PHE A 23 ? 4.02594 45.48810 14.61544 0.655 18.99500 C ? A ? 21 CD1 1
   ATOM 509 CD2 A PHE A 23 ? 1.76374 46.25913 14.70425 0.655 19.42797 C ? A ? 21 CD2 1
   ATOM 510 CE1 A PHE A 23 ? 4.49401 46.68705 15.00504 0.655 20.44186 C ? A ? 21 CE1 1
   ATOM 511 CE2 A PHE A 23 ? 2.21135 47.49236 15.09402 0.655 20.24141 C ? A ? 21 CE2 1
   ATOM 512 CZ A PHE A 23 ? 3.58768 47.70463 15.24272 0.655 20.99371 C ? A ? 21 CZ 1
   ATOM 513 H A PHE A 23 ? 1.45441 41.95131 12.81248 0.368 24.62402 H ? A ? 21 H 1
   ATOM 514 HB2 A PHE A 23 ? 1.53308 43.59246 14.62985 0.655 23.92007 H ? A ? 21 HB2 1
   ATOM 515 HB3 A PHE A 23 ? 2.99117 43.29453 14.07252 0.655 23.92007 H ? A ? 21 HB3 1
   ATOM 516 HD1 A PHE A 23 ? 4.63042 44.80383 14.43862 0.655 22.90555 H ? A ? 21 HD1 1
   ATOM 517 HD2 A PHE A 23 ? 0.85293 46.10462 14.59726 0.655 23.42512 H ? A ? 21 HD2 1
   ATOM 518 HE1 A PHE A 23 ? 5.40685 46.82893 15.11231 0.655 24.64179 H ? A ? 21 HE1 1
   ATOM 519 HE2 A PHE A 23 ? 1.60863 48.18133 15.25821 0.655 24.40125 H ? A ? 21 HE2 1
   ATOM 520 HZ A PHE A 23 ? 3.89668 48.54167 15.50499 0.655 25.30401 H ? A ? 21 HZ 1
   ATOM 521 CB B PHE A 23 ? 2.33167 43.89567 13.99275 0.345 19.92324 C ? A ? 21 CB 1
   ATOM 522 CG B PHE A 23 ? 3.15676 45.14154 14.26914 0.345 20.16785 C ? A ? 21 CG 1
   ATOM 523 CD1 B PHE A 23 ? 4.53237 45.12476 14.15845 0.345 20.18418 C ? A ? 21 CD1 1
   ATOM 524 CD2 B PHE A 23 ? 2.54880 46.33068 14.62600 0.345 19.41852 C ? A ? 21 CD2 1
   ATOM 525 CE1 B PHE A 23 ? 5.26694 46.26955 14.40348 0.345 19.83178 C ? A ? 21 CE1 1
   ATOM 526 CE2 B PHE A 23 ? 3.28441 47.46386 14.86555 0.345 19.95720 C ? A ? 21 CE2 1
   ATOM 527 CZ B PHE A 23 ? 4.64147 47.43584 14.76278 0.345 20.32868 C ? A ? 21 CZ 1
   ATOM 528 H B PHE A 23 ? 1.57749 41.93940 12.71493 0.632 24.62402 H ? A ? 21 H 1
   ATOM 529 HB2 B PHE A 23 ? 1.63275 43.84725 14.66361 0.345 24.01944 H ? A ? 21 HB2 1
   ATOM 530 HB3 B PHE A 23 ? 2.91883 43.12737 14.06932 0.345 24.01944 H ? A ? 21 HB3 1
   ATOM 531 HD1 B PHE A 23 ? 4.96740 44.33883 13.91767 0.345 24.33256 H ? A ? 21 HD1 1
   ATOM 532 HD2 B PHE A 23 ? 1.62276 46.36325 14.70529 0.345 23.41377 H ? A ? 21 HD2 1
   ATOM 533 HE1 B PHE A 23 ? 6.19331 46.24875 14.32401 0.345 23.90969 H ? A ? 21 HE1 1
   ATOM 534 HE2 B PHE A 23 ? 2.85400 48.25448 15.09915 0.345 24.06019 H ? A ? 21 HE2 1
   ATOM 535 HZ B PHE A 23 ? 5.14046 48.20154 14.93485 0.345 24.50597 H ? A ? 21 HZ 1
   ATOM 536 N . GLY A 24 ? 3.72694 43.54376 11.32404 1.000 21.06212 N ? A ? 22 N 1
   ATOM 537 CA . GLY A 24 ? 4.83027 43.92512 10.45566 1.000 20.61189 C ? A ? 22 CA 1
   ATOM 538 C . GLY A 24 ? 4.43105 44.13848 9.01125 1.000 20.28096 C ? A ? 22 C 1
   ATOM 539 O . GLY A 24 ? 5.01970 44.97439 8.32578 1.000 21.97460 O ? A ? 22 O 1
   ATOM 540 H . GLY A 24 ? 3.81263 42.75710 11.66081 1.000 25.38609 H ? A ? 22 H 1
   ATOM 541 HA2 . GLY A 24 ? 5.21787 44.75147 10.78401 1.000 24.84582 H ? A ? 22 HA2 1
   ATOM 542 HA3 . GLY A 24 ? 5.50480 43.22847 10.47973 1.000 24.84582 H ? A ? 22 HA3 1
   ATOM 543 N . ARG A 25 ? 3.44777 43.40410 8.52439 1.000 18.28147 N ? A ? 23 N 1
   ATOM 544 CA . ARG A 25 ? 3.08946 43.56887 7.13696 1.000 16.42274 C ? A ? 23 CA 1
   ATOM 545 C . ARG A 25 ? 2.51487 44.94930 6.82178 1.000 19.11506 C ? A ? 23 C 1
   ATOM 546 O . ARG A 25 ? 2.41635 45.28224 5.63594 1.000 21.19863 O ? A ? 23 O 1
   ATOM 547 CB . ARG A 25 ? 2.13118 42.46351 6.73724 1.000 20.81400 C ? A ? 23 CB 1
   ATOM 548 CG . ARG A 25 ? 0.75648 42.64239 7.32823 1.000 19.76353 C ? A ? 23 CG 1
   ATOM 549 CD . ARG A 25 ? -0.17643 41.61267 6.81023 1.000 19.78704 C ? A ? 23 CD 1
   ATOM 550 NE . ARG A 25 ? 0.31089 40.26721 7.08594 1.000 20.24740 N ? A ? 23 NE 1
   ATOM 551 CZ . ARG A 25 ? -0.26642 39.16801 6.62033 1.000 20.35681 C ? A ? 23 CZ 1
   ATOM 552 NH1 . ARG A 25 ? -1.26232 39.21414 5.76825 1.000 21.76924 N ? A ? 23 NH1 1
   ATOM 553 NH2 . ARG A 25 ? 0.23285 37.97570 6.94263 1.000 20.13887 N ? A ? 23 NH2 1
   ATOM 554 H . ARG A 25 ? 2.99002 42.82402 8.96436 1.000 22.04931 H ? A ? 23 H 1
   ATOM 555 HA . ARG A 25 ? 3.88439 43.48253 6.58784 1.000 19.81884 H ? A ? 23 HA 1
   ATOM 556 HB2 . ARG A 25 ? 2.04415 42.45513 5.77119 1.000 25.08835 H ? A ? 23 HB2 1
   ATOM 557 HB3 . ARG A 25 ? 2.48276 41.61385 7.04605 1.000 25.08835 H ? A ? 23 HB3 1
   ATOM 558 HG2 . ARG A 25 ? 0.80486 42.55661 8.29322 1.000 23.82779 H ? A ? 23 HG2 1
   ATOM 559 HG3 . ARG A 25 ? 0.41252 43.51745 7.08978 1.000 23.82779 H ? A ? 23 HG3 1
   ATOM 560 HD2 . ARG A 25 ? -1.04094 41.71802 7.23734 1.000 23.85601 H ? A ? 23 HD2 1
   ATOM 561 HD3 . ARG A 25 ? -0.26632 41.71424 5.84976 1.000 23.85601 H ? A ? 23 HD3 1
   ATOM 562 HE . ARG A 25 ? 1.01128 40.18141 7.57756 1.000 24.40844 H ? A ? 23 HE 1
   ATOM 563 HH11 . ARG A 25 ? -1.55968 39.97345 5.49508 1.000 26.23463 H ? A ? 23 HH11 1
   ATOM 564 HH12 . ARG A 25 ? -1.61802 38.48508 5.48268 1.000 26.23463 H ? A ? 23 HH12 1
   ATOM 565 HH21 . ARG A 25 ? 0.92538 37.92232 7.44972 1.000 24.27819 H ? A ? 23 HH21 1
   ATOM 566 HH22 . ARG A 25 ? -0.13739 37.25939 6.64360 1.000 24.27819 H ? A ? 23 HH22 1
   ATOM 567 N A MET A 26 ? 2.19029 45.75657 7.83722 0.492 20.54183 N ? A ? 24 N 1
   ATOM 568 CA A MET A 26 ? 1.71214 47.11611 7.63783 0.492 18.82152 C ? A ? 24 CA 1
   ATOM 569 C A MET A 26 ? 2.80525 48.14993 7.86260 0.492 19.69117 C ? A ? 24 C 1
   ATOM 570 O A MET A 26 ? 2.54946 49.35184 7.70343 0.492 18.52334 O ? A ? 24 O 1
   ATOM 571 CB A MET A 26 ? 0.52751 47.42565 8.55326 0.492 18.78424 C ? A ? 24 CB 1
   ATOM 572 CG A MET A 26 ? -0.62173 46.50841 8.32726 0.492 16.29522 C ? A ? 24 CG 1
   ATOM 573 SD A MET A 26 ? -1.93098 47.09805 9.39759 0.492 16.00106 S ? A ? 24 SD 1
   ATOM 574 CE A MET A 26 ? -1.24749 46.88224 11.04742 0.492 18.60874 C ? A ? 24 CE 1
   ATOM 575 H A MET A 26 ? 2.24181 45.52911 8.66500 0.492 24.76175 H ? A ? 24 H 1
   ATOM 576 HA A MET A 26 ? 1.38684 47.18524 6.72662 0.492 22.69738 H ? A ? 24 HA 1
   ATOM 577 HB2 A MET A 26 ? 0.80892 47.33435 9.47704 0.492 22.65264 H ? A ? 24 HB2 1
   ATOM 578 HB3 A MET A 26 ? 0.22675 48.33257 8.38615 0.492 22.65264 H ? A ? 24 HB3 1
   ATOM 579 HG2 A MET A 26 ? -0.91172 46.54393 7.40230 0.492 19.66581 H ? A ? 24 HG2 1
   ATOM 580 HG3 A MET A 26 ? -0.38596 45.59838 8.56631 0.492 19.66581 H ? A ? 24 HG3 1
   ATOM 581 HE1 A MET A 26 ? -1.96515 46.94378 11.69709 0.492 22.44204 H ? A ? 24 HE1 1
   ATOM 582 HE2 A MET A 26 ? -0.82506 46.01081 11.10274 0.492 22.44204 H ? A ? 24 HE2 1
   ATOM 583 HE3 A MET A 26 ? -0.59228 47.57845 11.21136 0.492 22.44204 H ? A ? 24 HE3 1
   ATOM 584 N B MET A 26 ? 2.06953 45.71176 7.82804 0.508 20.54174 N ? A ? 24 N 1
   ATOM 585 CA B MET A 26 ? 1.56306 47.06020 7.61782 0.508 18.61770 C ? A ? 24 CA 1
   ATOM 586 C B MET A 26 ? 2.69529 48.06755 7.40272 0.508 18.92735 C ? A ? 24 C 1
   ATOM 587 O B MET A 26 ? 2.43408 49.21260 6.96365 0.508 17.36748 O ? A ? 24 O 1
   ATOM 588 CB B MET A 26 ? 0.67432 47.47107 8.80996 0.508 19.09365 C ? A ? 24 CB 1
   ATOM 589 CG B MET A 26 ? -0.60435 46.60654 8.99317 0.508 16.50782 C ? A ? 24 CG 1
   ATOM 590 SD B MET A 26 ? -1.79161 47.20084 10.20582 0.508 16.96409 S ? A ? 24 SD 1
   ATOM 591 CE B MET A 26 ? -1.01669 46.57437 11.70863 0.508 18.40837 C ? A ? 24 CE 1
   ATOM 592 H B MET A 26 ? 2.05264 45.46191 8.65077 0.508 24.76164 H ? A ? 24 H 1
   ATOM 593 HA B MET A 26 ? 0.99433 47.07952 6.83228 0.508 22.45280 H ? A ? 24 HA 1
   ATOM 594 HB2 B MET A 26 ? 1.19660 47.39678 9.62397 0.508 23.02394 H ? A ? 24 HB2 1
   ATOM 595 HB3 B MET A 26 ? 0.39026 48.38949 8.68070 0.508 23.02394 H ? A ? 24 HB3 1
   ATOM 596 HG2 B MET A 26 ? -1.06475 46.56133 8.14059 0.508 19.92093 H ? A ? 24 HG2 1
   ATOM 597 HG3 B MET A 26 ? -0.33247 45.71782 9.27093 0.508 19.92093 H ? A ? 24 HG3 1
   ATOM 598 HE1 B MET A 26 ? -1.70284 46.41817 12.37624 0.508 22.20160 H ? A ? 24 HE1 1
   ATOM 599 HE2 B MET A 26 ? -0.55817 45.74419 11.50504 0.508 22.20160 H ? A ? 24 HE2 1
   ATOM 600 HE3 B MET A 26 ? -0.38192 47.23161 12.03421 0.508 22.20160 H ? A ? 24 HE3 1
   ATOM 601 N A THR A 27 ? 4.00990 47.73910 8.25843 0.492 17.51701 N ? A ? 25 N 1
   ATOM 602 CA A THR A 27 ? 5.13590 48.66545 8.23647 0.492 19.02193 C ? A ? 25 CA 1
   ATOM 603 C A THR A 27 ? 5.18254 49.45968 6.94028 0.492 20.58319 C ? A ? 25 C 1
   ATOM 604 O A THR A 27 ? 5.19607 50.69790 7.00293 0.492 20.43598 O ? A ? 25 O 1
   ATOM 605 CB A THR A 27 ? 6.45098 47.93634 8.54608 0.492 21.00661 C ? A ? 25 CB 1
   ATOM 606 OG1 A THR A 27 ? 6.53055 47.70318 9.95660 0.492 21.75607 O ? A ? 25 OG1 1
   ATOM 607 CG2 A THR A 27 ? 7.64688 48.74799 8.08647 0.492 20.94244 C ? A ? 25 CG2 1
   ATOM 608 H A THR A 27 ? 4.19546 46.94705 8.53739 0.492 21.13196 H ? A ? 25 H 1
   ATOM 609 HA A THR A 27 ? 5.02643 49.29821 8.96347 0.492 22.93787 H ? A ? 25 HA 1
   ATOM 610 HB A THR A 27 ? 6.47694 47.09024 8.07244 0.492 25.31948 H ? A ? 25 HB 1
   ATOM 611 HG1 A THR A 27 ? 7.30112 47.43854 10.16103 0.492 26.21883 H ? A ? 25 HG1 1
   ATOM 612 HG21 A THR A 27 ? 8.45484 48.41653 8.50866 0.492 25.24248 H ? A ? 25 HG21 1
   ATOM 613 HG22 A THR A 27 ? 7.74398 48.67970 7.12376 0.492 25.24248 H ? A ? 25 HG22 1
   ATOM 614 HG23 A THR A 27 ? 7.52663 49.68039 8.32538 0.492 25.24248 H ? A ? 25 HG23 1
   ATOM 615 N B THR A 27 ? 3.96429 47.67758 7.63266 0.508 18.25960 N ? A ? 25 N 1
   ATOM 616 CA B THR A 27 ? 5.02258 48.68410 7.69526 0.508 19.28524 C ? A ? 25 CA 1
   ATOM 617 C B THR A 27 ? 5.25897 49.38742 6.36735 0.508 21.13529 C ? A ? 25 C 1
   ATOM 618 O B THR A 27 ? 5.47761 50.60990 6.38624 0.508 18.87561 O ? A ? 25 O 1
   ATOM 619 CB B THR A 27 ? 6.35210 48.14840 8.23944 0.508 20.10770 C ? A ? 25 CB 1
   ATOM 620 OG1 B THR A 27 ? 6.11773 47.36258 9.40918 0.508 21.99182 O ? A ? 25 OG1 1
   ATOM 621 CG2 B THR A 27 ? 7.31414 49.26252 8.61440 0.508 22.38552 C ? A ? 25 CG2 1
   ATOM 622 H B THR A 27 ? 4.22248 46.86576 7.75049 0.508 22.02307 H ? A ? 25 H 1
   ATOM 623 HA B THR A 27 ? 4.70405 49.32401 8.35097 0.508 23.25384 H ? A ? 25 HA 1
   ATOM 624 HB B THR A 27 ? 6.76057 47.61542 7.53944 0.508 24.24079 H ? A ? 25 HB 1
   ATOM 625 HG1 B THR A 27 ? 5.79709 47.84338 10.01879 0.508 26.50174 H ? A ? 25 HG1 1
   ATOM 626 HG21 B THR A 27 ? 8.14575 48.88627 8.94267 0.508 26.97417 H ? A ? 25 HG21 1
   ATOM 627 HG22 B THR A 27 ? 7.50245 49.81336 7.83851 0.508 26.97417 H ? A ? 25 HG22 1
   ATOM 628 HG23 B THR A 27 ? 6.92456 49.81791 9.30770 0.508 26.97417 H ? A ? 25 HG23 1
   ATOM 629 N A PRO A 28 ? 5.16043 48.84278 5.75458 0.492 19.21787 N ? A ? 26 N 1
   ATOM 630 CA A PRO A 28 ? 5.40065 49.64345 4.53400 0.492 19.98628 C ? A ? 26 CA 1
   ATOM 631 C A PRO A 28 ? 4.29141 50.65076 4.25956 0.492 18.97792 C ? A ? 26 C 1
   ATOM 632 O A PRO A 28 ? 4.54079 51.73761 3.74669 0.492 20.49217 O ? A ? 26 O 1
   ATOM 633 CB A PRO A 28 ? 5.52988 48.60231 3.41693 0.492 18.18783 C ? A ? 26 CB 1
   ATOM 634 CG A PRO A 28 ? 5.69600 47.25916 4.13955 0.492 19.02305 C ? A ? 26 CG 1
   ATOM 635 CD A PRO A 28 ? 5.08045 47.38922 5.49761 0.492 19.67274 C ? A ? 26 CD 1
   ATOM 636 HA A PRO A 28 ? 6.24852 50.10783 4.61373 0.492 24.09508 H ? A ? 26 HA 1
   ATOM 637 HB2 A PRO A 28 ? 4.72906 48.60486 2.86958 0.492 21.93695 H ? A ? 26 HB2 1
   ATOM 638 HB3 A PRO A 28 ? 6.30617 48.80015 2.87001 0.492 21.93695 H ? A ? 26 HB3 1
   ATOM 639 HG2 A PRO A 28 ? 5.24611 46.56598 3.63160 0.492 22.93922 H ? A ? 26 HG2 1
   ATOM 640 HG3 A PRO A 28 ? 6.64076 47.05344 4.21705 0.492 22.93922 H ? A ? 26 HG3 1
   ATOM 641 HD2 A PRO A 28 ? 4.15845 47.08793 5.49127 0.492 23.71884 H ? A ? 26 HD2 1
   ATOM 642 HD3 A PRO A 28 ? 5.58760 46.89145 6.15786 0.492 23.71884 H ? A ? 26 HD3 1
   ATOM 643 N B PRO A 28 ? 5.26203 48.72703 5.20992 0.508 18.40650 N ? A ? 26 N 1
   ATOM 644 CA B PRO A 28 ? 5.34014 49.51610 3.97037 0.508 19.85854 C ? A ? 26 CA 1
   ATOM 645 C B PRO A 28 ? 4.19297 50.51106 3.84669 0.508 19.70906 C ? A ? 26 C 1
   ATOM 646 O B PRO A 28 ? 4.35498 51.51396 3.13571 0.508 19.03927 O ? A ? 26 O 1
   ATOM 647 CB B PRO A 28 ? 5.31298 48.47825 2.84617 0.508 19.57317 C ? A ? 26 CB 1
   ATOM 648 CG B PRO A 28 ? 5.68681 47.18922 3.50957 0.508 19.99620 C ? A ? 26 CG 1
   ATOM 649 CD B PRO A 28 ? 5.33949 47.26854 4.96964 0.508 17.86088 C ? A ? 26 CD 1
   ATOM 650 HA B PRO A 28 ? 6.19309 49.97609 3.92814 0.508 23.94180 H ? A ? 26 HA 1
   ATOM 651 HB2 B PRO A 28 ? 4.42312 48.42760 2.46345 0.508 23.59935 H ? A ? 26 HB2 1
   ATOM 652 HB3 B PRO A 28 ? 5.95615 48.71608 2.16011 0.508 23.59935 H ? A ? 26 HB3 1
   ATOM 653 HG2 B PRO A 28 ? 5.19423 46.46630 3.09046 0.508 24.10700 H ? A ? 26 HG2 1
   ATOM 654 HG3 B PRO A 28 ? 6.64031 47.04649 3.40294 0.508 24.10700 H ? A ? 26 HG3 1
   ATOM 655 HD2 B PRO A 28 ? 4.48669 46.84179 5.14719 0.508 21.54461 H ? A ? 26 HD2 1
   ATOM 656 HD3 B PRO A 28 ? 6.03283 46.86351 5.51381 0.508 21.54461 H ? A ? 26 HD3 1
   ATOM 657 N . VAL A 29 ? 3.04740 50.27717 4.51578 1.000 19.80124 N ? A ? 27 N 1
   ATOM 658 CA . VAL A 29 ? 1.90389 51.19634 4.38446 1.000 17.49897 C ? A ? 27 CA 1
   ATOM 659 C . VAL A 29 ? 2.08278 52.40683 5.29400 1.000 22.76682 C ? A ? 27 C 1
   ATOM 660 O . VAL A 29 ? 1.84563 53.56563 4.89238 1.000 20.83436 O ? A ? 27 O 1
   ATOM 661 CB . VAL A 29 ? 0.58371 50.46269 4.67158 1.000 19.26707 C ? A ? 27 CB 1
   ATOM 662 CG1 . VAL A 29 ? -0.64456 51.39780 4.63709 1.000 19.97273 C ? A ? 27 CG1 1
   ATOM 663 CG2 . VAL A 29 ? 0.36208 49.29832 3.68698 1.000 19.65500 C ? A ? 27 CG2 1
   ATOM 664 HA . VAL A 29 ? 1.87261 51.51370 3.46837 1.000 21.11031 H ? A ? 27 HA 1
   ATOM 665 HB . VAL A 29 ? 0.66297 50.11219 5.57256 1.000 23.23204 H ? A ? 27 HB 1
   ATOM 666 HG11 . VAL A 29 ? -1.45036 50.85934 4.59659 1.000 24.07882 H ? A ? 27 HG11 1
   ATOM 667 HG12 . VAL A 29 ? -0.65012 51.94159 5.44030 1.000 24.07882 H ? A ? 27 HG12 1
   ATOM 668 HG13 . VAL A 29 ? -0.58681 51.96621 3.85320 1.000 24.07882 H ? A ? 27 HG13 1
   ATOM 669 HG21 . VAL A 29 ? -0.49931 48.89092 3.86845 1.000 23.69755 H ? A ? 27 HG21 1
   ATOM 670 HG22 . VAL A 29 ? 0.38044 49.64335 2.78060 1.000 23.69755 H ? A ? 27 HG22 1
   ATOM 671 HG23 . VAL A 29 ? 1.06884 48.64479 3.80652 1.000 23.69755 H ? A ? 27 HG23 1
   ATOM 672 H A VAL A 29 ? 2.82373 49.48723 4.77185 0.492 23.87303 H ? A ? 27 H 1
   ATOM 673 H B VAL A 29 ? 2.91149 49.60866 5.03944 0.508 23.87303 H ? A ? 27 H 1
   ATOM 674 N . VAL A 30 ? 2.48220 52.16368 6.54822 1.000 21.24530 N ? A ? 28 N 1
   ATOM 675 CA . VAL A 30 ? 2.73312 53.27423 7.46657 1.000 23.37190 C ? A ? 28 CA 1
   ATOM 676 C . VAL A 30 ? 3.86283 54.14351 6.95089 1.000 24.68512 C ? A ? 28 C 1
   ATOM 677 O . VAL A 30 ? 3.85367 55.36206 7.16841 1.000 26.98813 O ? A ? 28 O 1
   ATOM 678 H . VAL A 30 ? 2.61188 51.38215 6.88289 1.000 25.60591 H ? A ? 28 H 1
   ATOM 679 HA . VAL A 30 ? 1.93619 53.82459 7.52046 1.000 28.15784 H ? A ? 28 HA 1
   ATOM 680 CB A VAL A 30 ? 3.03681 52.72751 8.87892 0.651 23.72852 C ? A ? 28 CB 1
   ATOM 681 CG1 A VAL A 30 ? 3.81358 53.77289 9.70098 0.651 26.15136 C ? A ? 28 CG1 1
   ATOM 682 CG2 A VAL A 30 ? 1.74538 52.29957 9.56322 0.651 23.48420 C ? A ? 28 CG2 1
   ATOM 683 HB A VAL A 30 ? 3.60137 51.94143 8.81377 0.651 28.58578 H ? A ? 28 HB 1
   ATOM 684 HG11 A VAL A 30 ? 3.69783 53.58188 10.64491 0.651 31.49318 H ? A ? 28 HG11 1
   ATOM 685 HG12 A VAL A 30 ? 4.75354 53.72413 9.46647 0.651 31.49318 H ? A ? 28 HG12 1
   ATOM 686 HG13 A VAL A 30 ? 3.46721 54.65574 9.49724 0.651 31.49318 H ? A ? 28 HG13 1
   ATOM 687 HG21 A VAL A 30 ? 1.95644 51.93793 10.43818 0.651 28.29259 H ? A ? 28 HG21 1
   ATOM 688 HG22 A VAL A 30 ? 1.16595 53.07199 9.65554 0.651 28.29259 H ? A ? 28 HG22 1
   ATOM 689 HG23 A VAL A 30 ? 1.31034 51.62257 9.02163 0.651 28.29259 H ? A ? 28 HG23 1
   ATOM 690 CB B VAL A 30 ? 2.95951 52.78511 8.90849 0.349 23.69777 C ? A ? 28 CB 1
   ATOM 691 CG1 B VAL A 30 ? 1.78531 51.93613 9.33139 0.349 22.33560 C ? A ? 28 CG1 1
   ATOM 692 CG2 B VAL A 30 ? 4.25571 52.04574 9.00980 0.349 22.42210 C ? A ? 28 CG2 1
   ATOM 693 HB B VAL A 30 ? 3.02017 53.53822 9.51679 0.349 28.54887 H ? A ? 28 HB 1
   ATOM 694 HG11 B VAL A 30 ? 1.87506 51.71936 10.27259 0.349 26.91427 H ? A ? 28 HG11 1
   ATOM 695 HG12 B VAL A 30 ? 0.96607 52.43393 9.18325 0.349 26.91427 H ? A ? 28 HG12 1
   ATOM 696 HG13 B VAL A 30 ? 1.77780 51.12222 8.80376 0.349 26.91427 H ? A ? 28 HG13 1
   ATOM 697 HG21 B VAL A 30 ? 4.22669 51.46211 9.78404 0.349 27.01808 H ? A ? 28 HG21 1
   ATOM 698 HG22 B VAL A 30 ? 4.38353 51.52061 8.20432 0.349 27.01808 H ? A ? 28 HG22 1
   ATOM 699 HG23 B VAL A 30 ? 4.97796 52.68617 9.10522 0.349 27.01808 H ? A ? 28 HG23 1
   ATOM 700 N . LYS A 31 ? 4.84567 53.57338 6.25969 1.000 22.62845 N ? A ? 29 N 1
   ATOM 701 CA . LYS A 31 ? 5.94500 54.35346 5.69357 1.000 24.37002 C ? A ? 29 CA 1
   ATOM 702 C . LYS A 31 ? 5.57793 55.00919 4.37028 1.000 22.82144 C ? A ? 29 C 1
   ATOM 703 O . LYS A 31 ? 6.32263 55.88840 3.91321 1.000 26.41595 O ? A ? 29 O 1
   ATOM 704 CB . LYS A 31 ? 7.17867 53.46821 5.48600 1.000 23.58064 C ? A ? 29 CB 1
   ATOM 705 CG . LYS A 31 ? 7.91875 53.08314 6.75038 1.000 28.21822 C ? A ? 29 CG 1
   ATOM 706 CD . LYS A 31 ? 8.97766 52.01273 6.44090 1.000 32.17798 C ? A ? 29 CD 1
   ATOM 707 CE . LYS A 31 ? 9.97768 51.85197 7.57972 1.000 50.47580 C ? A ? 29 CE 1
   ATOM 708 NZ . LYS A 31 ? 11.39253 51.87025 7.09494 1.000 59.16496 N ? A ? 29 NZ 1
   ATOM 709 H . LYS A 31 ? 4.90052 52.72964 6.10256 1.000 27.26570 H ? A ? 29 H 1
   ATOM 710 HA . LYS A 31 ? 6.18121 55.04988 6.32611 1.000 29.35558 H ? A ? 29 HA 1
   ATOM 711 HB2 . LYS A 31 ? 6.89654 52.64682 5.05401 1.000 28.40832 H ? A ? 29 HB2 1
   ATOM 712 HB3 . LYS A 31 ? 7.80440 53.94397 4.91766 1.000 28.40832 H ? A ? 29 HB3 1
   ATOM 713 HG2 . LYS A 31 ? 8.36380 53.86264 7.11808 1.000 33.97341 H ? A ? 29 HG2 1
   ATOM 714 HG3 . LYS A 31 ? 7.29284 52.72234 7.39766 1.000 33.97341 H ? A ? 29 HG3 1
   ATOM 715 HD2 . LYS A 31 ? 8.53790 51.15944 6.30159 1.000 38.72513 H ? A ? 29 HD2 1
   ATOM 716 HD3 . LYS A 31 ? 9.46630 52.26831 5.64289 1.000 38.72513 H ? A ? 29 HD3 1
   ATOM 717 HE2 . LYS A 31 ? 9.86425 52.58163 8.20871 1.000 60.68251 H ? A ? 29 HE2 1
   ATOM 718 HE3 . LYS A 31 ? 9.82126 51.00386 8.02374 1.000 60.68251 H ? A ? 29 HE3 1
   ATOM 719 HZ1 . LYS A 31 ? 11.94952 51.73782 7.77635 1.000 71.10950 H ? A ? 29 HZ1 1
   ATOM 720 HZ2 . LYS A 31 ? 11.51599 51.22749 6.49185 1.000 71.10950 H ? A ? 29 HZ2 1
   ATOM 721 HZ3 . LYS A 31 ? 11.57590 52.65662 6.72063 1.000 71.10950 H ? A ? 29 HZ3 1
   ATOM 722 N . GLY A 32 ? 4.46376 54.63633 3.75044 1.000 22.09236 N ? A ? 30 N 1
   ATOM 723 CA . GLY A 32 ? 4.11376 55.21449 2.46323 1.000 24.56002 C ? A ? 30 CA 1
   ATOM 724 C . GLY A 32 ? 4.75971 54.54659 1.27520 1.000 22.96663 C ? A ? 30 C 1
   ATOM 725 O . GLY A 32 ? 4.54982 54.97114 0.13437 1.000 23.24608 O ? A ? 30 O 1
   ATOM 726 H . GLY A 32 ? 3.90322 54.05816 4.05231 1.000 26.62238 H ? A ? 30 H 1
   ATOM 727 HA2 . GLY A 32 ? 3.15223 55.15859 2.34822 1.000 29.58358 H ? A ? 30 HA2 1
   ATOM 728 HA3 . GLY A 32 ? 4.37860 56.14762 2.45900 1.000 29.58358 H ? A ? 30 HA3 1
   ATOM 729 N A GLN A 33 ? 5.50118 53.46894 1.50555 0.532 20.99977 N ? A ? 31 N 1
   ATOM 730 CA A GLN A 33 ? 6.11323 52.68220 0.43787 0.532 20.84166 C ? A ? 31 CA 1
   ATOM 731 C A GLN A 33 ? 5.11983 51.76623 -0.27462 0.532 19.64801 C ? A ? 31 C 1
   ATOM 732 O A GLN A 33 ? 5.37663 51.37198 -1.41617 0.532 21.73296 O ? A ? 31 O 1
   ATOM 733 CB A GLN A 33 ? 7.25914 51.83473 1.00572 0.532 22.27325 C ? A ? 31 CB 1
   ATOM 734 CG A GLN A 33 ? 8.33017 52.60614 1.76009 0.532 24.96196 C ? A ? 31 CG 1
   ATOM 735 CD A GLN A 33 ? 9.16295 51.69407 2.64740 0.532 28.04020 C ? A ? 31 CD 1
   ATOM 736 OE1 A GLN A 33 ? 8.77399 50.56157 2.92087 0.532 28.47766 O ? A ? 31 OE1 1
   ATOM 737 NE2 A GLN A 33 ? 10.31308 52.18385 3.09785 0.532 31.12322 N ? A ? 31 NE2 1
   ATOM 738 H A GLN A 33 ? 5.67059 53.16281 2.29116 0.532 25.31128 H ? A ? 31 H 1
   ATOM 739 HA A GLN A 33 ? 6.47822 53.29364 -0.22079 0.532 25.12155 H ? A ? 31 HA 1
   ATOM 740 HB2 A GLN A 33 ? 6.88309 51.18585 1.62089 0.532 26.83945 H ? A ? 31 HB2 1
   ATOM 741 HB3 A GLN A 33 ? 7.69595 51.37919 0.26911 0.532 26.83945 H ? A ? 31 HB3 1
   ATOM 742 HG2 A GLN A 33 ? 8.92314 53.03551 1.12375 0.532 30.06591 H ? A ? 31 HG2 1
   ATOM 743 HG3 A GLN A 33 ? 7.90723 53.27394 2.32229 0.532 30.06591 H ? A ? 31 HG3 1
   ATOM 744 HE21 A GLN A 33 ? 10.55388 52.98135 2.88430 0.532 37.45941 H ? A ? 31 HE21 1
   ATOM 745 HE22 A GLN A 33 ? 10.81666 51.70335 3.60295 0.532 37.45941 H ? A ? 31 HE22 1
   ATOM 746 N C GLN A 33 ? 5.51278 53.47237 1.49330 0.468 21.01421 N ? A ? 31 N 1
   ATOM 747 CA C GLN A 33 ? 6.11064 52.71440 0.39671 0.468 20.84240 C ? A ? 31 CA 1
   ATOM 748 C C GLN A 33 ? 5.13815 51.73684 -0.26336 0.468 19.65000 C ? A ? 31 C 1
   ATOM 749 O C GLN A 33 ? 5.44319 51.24396 -1.35456 0.468 21.80084 O ? A ? 31 O 1
   ATOM 750 CB C GLN A 33 ? 7.37862 51.97388 0.85952 0.468 22.10160 C ? A ? 31 CB 1
   ATOM 751 CG C GLN A 33 ? 8.57062 52.87155 1.11442 0.468 24.60337 C ? A ? 31 CG 1
   ATOM 752 CD C GLN A 33 ? 9.84679 52.12472 1.34479 0.468 29.00904 C ? A ? 31 CD 1
   ATOM 753 OE1 C GLN A 33 ? 9.93761 50.90393 1.17552 0.468 30.14989 O ? A ? 31 OE1 1
   ATOM 754 NE2 C GLN A 33 ? 10.84821 52.86135 1.77873 0.468 30.44249 N ? A ? 31 NE2 1
   ATOM 755 H C GLN A 33 ? 5.69450 53.15884 2.27322 0.468 25.32860 H ? A ? 31 H 1
   ATOM 756 HA C GLN A 33 ? 6.39099 53.34703 -0.28305 0.468 25.12244 H ? A ? 31 HA 1
   ATOM 757 HB2 C GLN A 33 ? 7.18000 51.50825 1.68695 0.468 26.63347 H ? A ? 31 HB2 1
   ATOM 758 HB3 C GLN A 33 ? 7.63256 51.33714 0.17324 0.468 26.63347 H ? A ? 31 HB3 1
   ATOM 759 HG2 C GLN A 33 ? 8.69915 53.44676 0.34402 0.468 29.63560 H ? A ? 31 HG2 1
   ATOM 760 HG3 C GLN A 33 ? 8.39495 53.40792 1.90330 0.468 29.63560 H ? A ? 31 HG3 1
   ATOM 761 HE21 C GLN A 33 ? 10.73757 53.70439 1.90773 0.468 36.64254 H ? A ? 31 HE21 1
   ATOM 762 HE22 C GLN A 33 ? 11.61291 52.49942 1.93315 0.468 36.64254 H ? A ? 31 HE22 1
   ATOM 763 N . ALA A 34 ? 3.97173 51.50334 0.32593 1.000 20.49701 N ? A ? 32 N 1
   ATOM 764 CA . ALA A 34 ? 2.88196 50.74994 -0.27541 1.000 17.74703 C ? A ? 32 CA 1
   ATOM 765 C . ALA A 34 ? 1.62313 51.58271 -0.11514 1.000 20.88298 C ? A ? 32 C 1
   ATOM 766 O . ALA A 34 ? 1.51874 52.37036 0.83676 1.000 19.64545 O ? A ? 32 O 1
   ATOM 767 CB . ALA A 34 ? 2.68243 49.40054 0.44226 1.000 19.69996 C ? A ? 32 CB 1
   ATOM 768 HA . ALA A 34 ? 3.05866 50.57339 -1.21269 1.000 21.40799 H ? A ? 32 HA 1
   ATOM 769 HB1 . ALA A 34 ? 1.93790 48.93233 0.03316 1.000 23.75151 H ? A ? 32 HB1 1
   ATOM 770 HB2 . ALA A 34 ? 3.49233 48.87385 0.35538 1.000 23.75151 H ? A ? 32 HB2 1
   ATOM 771 HB3 . ALA A 34 ? 2.49440 49.56601 1.37937 1.000 23.75151 H ? A ? 32 HB3 1
   ATOM 772 H A ALA A 34 ? 3.79029 51.76465 1.12493 0.532 24.70797 H ? A ? 32 H 1
   ATOM 773 H C ALA A 34 ? 3.78041 51.78678 1.11502 0.468 24.70797 H ? A ? 32 H 1
   ATOM 774 N . PRO A 35 ? 0.62169 51.40936 -0.98221 1.000 19.67779 N ? A ? 33 N 1
   ATOM 775 CA . PRO A 35 ? -0.57819 52.24494 -0.90257 1.000 21.11327 C ? A ? 33 CA 1
   ATOM 776 C . PRO A 35 ? -1.40060 51.96075 0.33372 1.000 21.89410 C ? A ? 33 C 1
   ATOM 777 O . PRO A 35 ? -1.35066 50.87373 0.90813 1.000 20.84508 O ? A ? 33 O 1
   ATOM 778 CB . PRO A 35 ? -1.33716 51.90940 -2.18128 1.000 21.98348 C ? A ? 33 CB 1
   ATOM 779 CG . PRO A 35 ? -0.81599 50.54325 -2.56674 1.000 23.90796 C ? A ? 33 CG 1
   ATOM 780 CD . PRO A 35 ? 0.61494 50.56252 -2.18047 1.000 19.66819 C ? A ? 33 CD 1
   ATOM 781 HA . PRO A 35 ? -0.33703 53.18447 -0.90778 1.000 25.44747 H ? A ? 33 HA 1
   ATOM 782 HB2 . PRO A 35 ? -2.29111 51.88482 -2.00725 1.000 26.49173 H ? A ? 33 HB2 1
   ATOM 783 HB3 . PRO A 35 ? -1.14203 52.56605 -2.86804 1.000 26.49173 H ? A ? 33 HB3 1
   ATOM 784 HG2 . PRO A 35 ? -1.29781 49.85539 -2.08135 1.000 28.80110 H ? A ? 33 HG2 1
   ATOM 785 HG3 . PRO A 35 ? -0.91637 50.40737 -3.52192 1.000 28.80110 H ? A ? 33 HG3 1
   ATOM 786 HD2 . PRO A 35 ? 0.93024 49.66858 -1.97464 1.000 23.71338 H ? A ? 33 HD2 1
   ATOM 787 HD3 . PRO A 35 ? 1.15821 50.95233 -2.88318 1.000 23.71338 H ? A ? 33 HD3 1
   ATOM 788 N . TYR A 36 ? -2.22459 52.94570 0.70483 1.000 19.93807 N ? A ? 34 N 1
   ATOM 789 CA . TYR A 36 ? -3.06624 52.87821 1.88521 1.000 21.71244 C ? A ? 34 CA 1
   ATOM 790 C . TYR A 36 ? -4.48554 52.61062 1.37521 1.000 23.02588 C ? A ? 34 C 1
   ATOM 791 O . TYR A 36 ? -5.08569 53.45689 0.71017 1.000 21.86638 O ? A ? 34 O 1
   ATOM 792 CB . TYR A 36 ? -2.96593 54.13923 2.77674 1.000 24.23355 C ? A ? 34 CB 1
   ATOM 793 CG . TYR A 36 ? -3.98848 54.16236 3.90130 1.000 23.41546 C ? A ? 34 CG 1
   ATOM 794 CD1 . TYR A 36 ? -4.10958 53.07759 4.76560 1.000 21.67661 C ? A ? 34 CD1 1
   ATOM 795 CD2 . TYR A 36 ? -4.82727 55.25109 4.09615 1.000 22.12104 C ? A ? 34 CD2 1
   ATOM 796 CE1 . TYR A 36 ? -5.08526 53.03119 5.76199 1.000 22.58472 C ? A ? 34 CE1 1
   ATOM 797 CE2 . TYR A 36 ? -5.78740 55.22934 5.09343 1.000 23.60553 C ? A ? 34 CE2 1
   ATOM 798 CZ . TYR A 36 ? -5.90695 54.11879 5.93813 1.000 23.91964 C ? A ? 34 CZ 1
   ATOM 799 OH . TYR A 36 ? -6.86979 54.11887 6.91066 1.000 22.25780 O ? A ? 34 OH 1
   ATOM 800 H . TYR A 36 ? -2.31047 53.68270 0.27002 1.000 24.03723 H ? A ? 34 H 1
   ATOM 801 HA . TYR A 36 ? -2.78288 52.15073 2.46086 1.000 26.16648 H ? A ? 34 HA 1
   ATOM 802 HB2 . TYR A 36 ? -2.08260 54.17161 3.17621 1.000 29.19181 H ? A ? 34 HB2 1
   ATOM 803 HB3 . TYR A 36 ? -3.11014 54.92486 2.22638 1.000 29.19181 H ? A ? 34 HB3 1
   ATOM 804 HD1 . TYR A 36 ? -3.52226 52.36209 4.67608 1.000 26.12348 H ? A ? 34 HD1 1
   ATOM 805 HD2 . TYR A 36 ? -4.74365 56.00101 3.55253 1.000 26.65680 H ? A ? 34 HD2 1
   ATOM 806 HE1 . TYR A 36 ? -5.17804 52.27689 6.29801 1.000 27.21321 H ? A ? 34 HE1 1
   ATOM 807 HE2 . TYR A 36 ? -6.35644 55.95672 5.20304 1.000 28.43819 H ? A ? 34 HE2 1
   ATOM 808 HH . TYR A 36 ? -6.85984 54.84965 7.32473 1.000 26.82092 H ? A ? 34 HH 1
   ATOM 809 N A ASP A 37 ? -4.98953 51.41245 1.62442 0.862 22.32401 N ? A ? 35 N 1
   ATOM 810 CA A ASP A 37 ? -6.36556 51.02452 1.34781 0.862 21.97367 C ? A ? 35 CA 1
   ATOM 811 C A ASP A 37 ? -6.98522 50.90762 2.72978 0.862 19.87204 C ? A ? 35 C 1
   ATOM 812 O A ASP A 37 ? -6.65947 49.98635 3.49120 0.862 22.48884 O ? A ? 35 O 1
   ATOM 813 CB A ASP A 37 ? -6.37656 49.68816 0.60384 0.862 23.06870 C ? A ? 35 CB 1
   ATOM 814 CG A ASP A 37 ? -7.76501 49.14209 0.35622 0.862 23.92004 C ? A ? 35 CG 1
   ATOM 815 OD1 A ASP A 37 ? -8.64424 49.26009 1.23248 0.862 23.29726 O ? A ? 35 OD1 1
   ATOM 816 OD2 A ASP A 37 ? -7.92838 48.56352 -0.74360 0.862 25.72569 O ? A ? 35 OD2 1
   ATOM 817 H A ASP A 37 ? -4.53089 50.77321 1.97172 0.862 26.90037 H ? A ? 35 H 1
   ATOM 818 HA A ASP A 37 ? -6.85150 51.66515 0.80526 0.862 26.47996 H ? A ? 35 HA 1
   ATOM 819 HB2 A ASP A 37 ? -5.94707 49.80661 -0.25780 0.862 27.79399 H ? A ? 35 HB2 1
   ATOM 820 HB3 A ASP A 37 ? -5.89054 49.03376 1.12961 0.862 27.79399 H ? A ? 35 HB3 1
   ATOM 821 N B ASP A 37 ? -4.99891 51.41721 1.65607 0.138 22.35624 N ? A ? 35 N 1
   ATOM 822 CA B ASP A 37 ? -6.36983 51.03548 1.33378 0.138 21.99843 C ? A ? 35 CA 1
   ATOM 823 C B ASP A 37 ? -7.05172 50.86476 2.68515 0.138 20.16565 C ? A ? 35 C 1
   ATOM 824 O B ASP A 37 ? -6.83301 49.86912 3.37836 0.138 22.18484 O ? A ? 35 O 1
   ATOM 825 CB B ASP A 37 ? -6.38822 49.73946 0.52986 0.138 23.05647 C ? A ? 35 CB 1
   ATOM 826 CG B ASP A 37 ? -7.77060 49.38738 0.01652 0.138 24.11541 C ? A ? 35 CG 1
   ATOM 827 OD1 B ASP A 37 ? -8.75533 49.54387 0.76979 0.138 23.92942 O ? A ? 35 OD1 1
   ATOM 828 OD2 B ASP A 37 ? -7.86983 48.95121 -1.15042 0.138 25.16285 O ? A ? 35 OD2 1
   ATOM 829 H B ASP A 37 ? -4.55722 50.79093 2.04631 0.138 26.93904 H ? A ? 35 H 1
   ATOM 830 HA B ASP A 37 ? -6.81949 51.71548 0.80814 0.138 26.50966 H ? A ? 35 HA 1
   ATOM 831 HB2 B ASP A 37 ? -5.79919 49.83357 -0.23505 0.138 27.77931 H ? A ? 35 HB2 1
   ATOM 832 HB3 B ASP A 37 ? -6.08407 49.01238 1.09532 0.138 27.77931 H ? A ? 35 HB3 1
   ATOM 833 N . ALA A 38 ? -7.85609 51.84987 3.07994 1.000 20.55057 N ? A ? 36 N 1
   ATOM 834 CA . ALA A 38 ? -8.34999 51.87862 4.44106 1.000 19.22492 C ? A ? 36 CA 1
   ATOM 835 C . ALA A 38 ? -9.09975 50.59325 4.78716 1.000 20.27750 C ? A ? 36 C 1
   ATOM 836 O . ALA A 38 ? -9.01652 50.12024 5.91579 1.000 21.08760 O ? A ? 36 O 1
   ATOM 837 CB . ALA A 38 ? -9.27544 53.08355 4.62888 1.000 19.83641 C ? A ? 36 CB 1
   ATOM 838 HA . ALA A 38 ? -7.59505 51.96495 5.04398 1.000 23.18146 H ? A ? 36 HA 1
   ATOM 839 HB1 . ALA A 38 ? -9.62586 53.07465 5.53332 1.000 23.91524 H ? A ? 36 HB1 1
   ATOM 840 HB2 . ALA A 38 ? -8.76914 53.89711 4.47828 1.000 23.91524 H ? A ? 36 HB2 1
   ATOM 841 HB3 . ALA A 38 ? -10.00404 53.02456 3.99125 1.000 23.91524 H ? A ? 36 HB3 1
   ATOM 842 H A ALA A 38 ? -8.16438 52.46286 2.56148 0.862 24.77224 H ? A ? 36 H 1
   ATOM 843 H B ALA A 38 ? -8.12307 52.49975 2.58398 0.138 24.77224 H ? A ? 36 H 1
   ATOM 844 N A ALA A 39 ? -9.91249 50.07533 3.86865 0.313 21.55590 N ? A ? 37 N 1
   ATOM 845 CA A ALA A 39 ? -10.70470 48.89252 4.19289 0.313 21.96012 C ? A ? 37 CA 1
   ATOM 846 C A ALA A 39 ? -9.83115 47.66751 4.39692 0.313 20.11117 C ? A ? 37 C 1
   ATOM 847 O A ALA A 39 ? -10.15297 46.82885 5.24311 0.313 21.67252 O ? A ? 37 O 1
   ATOM 848 CB A ALA A 39 ? -11.75606 48.62384 3.12482 0.313 24.19285 C ? A ? 37 CB 1
   ATOM 849 H A ALA A 39 ? -10.02098 50.38086 3.07210 0.313 25.97863 H ? A ? 37 H 1
   ATOM 850 HA A ALA A 39 ? -11.17731 49.06862 5.02147 0.313 26.46370 H ? A ? 37 HA 1
   ATOM 851 HB1 A ALA A 39 ? -12.25983 47.83192 3.36973 0.313 29.14297 H ? A ? 37 HB1 1
   ATOM 852 HB2 A ALA A 39 ? -12.34978 49.38870 3.06665 0.313 29.14297 H ? A ? 37 HB2 1
   ATOM 853 HB3 A ALA A 39 ? -11.31275 48.48372 2.27351 0.313 29.14297 H ? A ? 37 HB3 1
   ATOM 854 N B ALA A 39 ? -9.86739 50.05791 3.83548 0.687 21.53407 N ? A ? 37 N 1
   ATOM 855 CA B ALA A 39 ? -10.56218 48.79218 4.05520 0.687 21.67954 C ? A ? 37 CA 1
   ATOM 856 C B ALA A 39 ? -9.58330 47.64841 4.28879 0.687 19.33020 C ? A ? 37 C 1
   ATOM 857 O B ALA A 39 ? -9.79606 46.84205 5.19862 0.687 22.25308 O ? A ? 37 O 1
   ATOM 858 CB B ALA A 39 ? -11.50002 48.47520 2.89437 0.687 24.16794 C ? A ? 37 CB 1
   ATOM 859 H B ALA A 39 ? -10.00096 50.40533 3.06020 0.687 25.95244 H ? A ? 37 H 1
   ATOM 860 HA B ALA A 39 ? -11.10875 48.88443 4.85122 0.687 26.12700 H ? A ? 37 HA 1
   ATOM 861 HB1 B ALA A 39 ? -11.93185 47.62275 3.06098 0.687 29.11308 H ? A ? 37 HB1 1
   ATOM 862 HB2 B ALA A 39 ? -12.16700 49.17625 2.82675 0.687 29.11308 H ? A ? 37 HB2 1
   ATOM 863 HB3 B ALA A 39 ? -10.98361 48.42975 2.07452 0.687 29.11308 H ? A ? 37 HB3 1
   ATOM 864 N A GLN A 40 ? -8.74752 47.54680 3.62504 0.313 21.00843 N ? A ? 38 N 1
   ATOM 865 CA A GLN A 40 ? -7.78723 46.46656 3.82587 0.313 20.65907 C ? A ? 38 CA 1
   ATOM 866 C A GLN A 40 ? -7.16238 46.57541 5.20504 0.313 19.47777 C ? A ? 38 C 1
   ATOM 867 O A GLN A 40 ? -7.10035 45.58717 5.95903 0.313 20.15784 O ? A ? 38 O 1
   ATOM 868 CB A GLN A 40 ? -6.71114 46.56662 2.74375 0.313 21.85266 C ? A ? 38 CB 1
   ATOM 869 CG A GLN A 40 ? -5.44826 45.79382 3.04422 0.313 21.93111 C ? A ? 38 CG 1
   ATOM 870 CD A GLN A 40 ? -4.21806 46.37938 2.35902 0.313 23.32758 C ? A ? 38 CD 1
   ATOM 871 OE1 A GLN A 40 ? -3.16602 46.49932 2.97117 0.313 26.05725 O ? A ? 38 OE1 1
   ATOM 872 NE2 A GLN A 40 ? -4.35503 46.76030 1.08829 0.313 23.48588 N ? A ? 38 NE2 1
   ATOM 873 H A GLN A 40 ? -8.54724 48.07805 2.97909 0.313 25.32167 H ? A ? 38 H 1
   ATOM 874 HA A GLN A 40 ? -8.22731 45.60506 3.75481 0.313 24.90244 H ? A ? 38 HA 1
   ATOM 875 HB2 A GLN A 40 ? -7.07503 46.22214 1.91320 0.313 26.33475 H ? A ? 38 HB2 1
   ATOM 876 HB3 A GLN A 40 ? -6.46588 47.49902 2.63703 0.313 26.33475 H ? A ? 38 HB3 1
   ATOM 877 HG2 A GLN A 40 ? -5.29162 45.80482 4.00143 0.313 26.42888 H ? A ? 38 HG2 1
   ATOM 878 HG3 A GLN A 40 ? -5.55629 44.88038 2.73621 0.313 26.42888 H ? A ? 38 HG3 1
   ATOM 879 HE21 A GLN A 40 ? -5.11291 46.67066 0.69182 0.313 28.29461 H ? A ? 38 HE21 1
   ATOM 880 HE22 A GLN A 40 ? -3.68548 47.09557 0.66532 0.313 28.29461 H ? A ? 38 HE22 1
   ATOM 881 N B GLN A 40 ? -8.51020 47.56860 3.49090 0.687 20.81422 N ? A ? 38 N 1
   ATOM 882 CA B GLN A 40 ? -7.51961 46.50444 3.65301 0.687 19.89594 C ? A ? 38 CA 1
   ATOM 883 C B GLN A 40 ? -6.94213 46.54220 5.05701 0.687 19.48504 C ? A ? 38 C 1
   ATOM 884 O B GLN A 40 ? -6.75444 45.49297 5.70894 0.687 19.80080 O ? A ? 38 O 1
   ATOM 885 CB B GLN A 40 ? -6.40003 46.72177 2.63001 0.687 21.16997 C ? A ? 38 CB 1
   ATOM 886 CG B GLN A 40 ? -5.29902 45.66774 2.76684 0.687 21.20976 C ? A ? 38 CG 1
   ATOM 887 CD B GLN A 40 ? -4.13633 45.86397 1.85648 0.687 23.28427 C ? A ? 38 CD 1
   ATOM 888 OE1 B GLN A 40 ? -3.74418 46.99971 1.59423 0.687 22.03242 O ? A ? 38 OE1 1
   ATOM 889 NE2 B GLN A 40 ? -3.56564 44.76154 1.34951 0.687 20.67828 N ? A ? 38 NE2 1
   ATOM 890 H B GLN A 40 ? -8.33530 48.11676 2.85173 0.687 25.08862 H ? A ? 38 H 1
   ATOM 891 HA B GLN A 40 ? -7.93102 45.63888 3.50321 0.687 23.98668 H ? A ? 38 HA 1
   ATOM 892 HB2 B GLN A 40 ? -6.76880 46.66348 1.73474 0.687 25.51551 H ? A ? 38 HB2 1
   ATOM 893 HB3 B GLN A 40 ? -6.00434 47.59633 2.76954 0.687 25.51551 H ? A ? 38 HB3 1
   ATOM 894 HG2 B GLN A 40 ? -4.96396 45.68721 3.67693 0.687 25.56326 H ? A ? 38 HG2 1
   ATOM 895 HG3 B GLN A 40 ? -5.67900 44.79684 2.57177 0.687 25.56326 H ? A ? 38 HG3 1
   ATOM 896 HE21 B GLN A 40 ? -3.87346 43.98504 1.55420 0.687 24.92549 H ? A ? 38 HE21 1
   ATOM 897 HE22 B GLN A 40 ? -2.89180 44.83099 0.81969 0.687 24.92549 H ? A ? 38 HE22 1
   ATOM 898 N . ILE A 41 ? -6.62752 47.75732 5.52384 1.000 19.90756 N ? A ? 39 N 1
   ATOM 899 CA . ILE A 41 ? -6.00510 47.94532 6.81698 1.000 17.96284 C ? A ? 39 CA 1
   ATOM 900 C . ILE A 41 ? -6.98505 47.64657 7.93827 1.000 18.75817 C ? A ? 39 C 1
   ATOM 901 O . ILE A 41 ? -6.63190 46.99923 8.93046 1.000 19.07598 O ? A ? 39 O 1
   ATOM 902 CB . ILE A 41 ? -5.30811 49.30587 6.96295 1.000 18.70677 C ? A ? 39 CB 1
   ATOM 903 CG1 . ILE A 41 ? -4.06317 49.35245 6.04269 1.000 19.23031 C ? A ? 39 CG1 1
   ATOM 904 CG2 . ILE A 41 ? -5.03813 49.49824 8.40480 1.000 19.23367 C ? A ? 39 CG2 1
   ATOM 905 CD1 . ILE A 41 ? -2.98403 48.39449 6.28117 1.000 22.10612 C ? A ? 39 CD1 1
   ATOM 906 HA . ILE A 41 ? -5.28753 47.29540 6.87686 1.000 21.66696 H ? A ? 39 HA 1
   ATOM 907 HB . ILE A 41 ? -5.85668 50.04958 6.66820 1.000 22.55967 H ? A ? 39 HB 1
   ATOM 908 HG12 . ILE A 41 ? -4.36531 49.20646 5.13258 1.000 23.18792 H ? A ? 39 HG12 1
   ATOM 909 HG13 . ILE A 41 ? -3.67075 50.23577 6.12430 1.000 23.18792 H ? A ? 39 HG13 1
   ATOM 910 HG21 . ILE A 41 ? -4.31532 50.13678 8.50830 1.000 23.19196 H ? A ? 39 HG21 1
   ATOM 911 HG22 . ILE A 41 ? -5.84036 49.83427 8.83422 1.000 23.19196 H ? A ? 39 HG22 1
   ATOM 912 HG23 . ILE A 41 ? -4.78582 48.64687 8.79519 1.000 23.19196 H ? A ? 39 HG23 1
   ATOM 913 HD11 . ILE A 41 ? -2.23424 48.61382 5.70618 1.000 26.63889 H ? A ? 39 HD11 1
   ATOM 914 HD12 . ILE A 41 ? -2.71422 48.44784 7.21137 1.000 26.63889 H ? A ? 39 HD12 1
   ATOM 915 HD13 . ILE A 41 ? -3.30459 47.50126 6.08045 1.000 26.63889 H ? A ? 39 HD13 1
   ATOM 916 H A ILE A 41 ? -6.61624 48.44892 5.01280 0.313 24.00062 H ? A ? 39 H 1
   ATOM 917 H B ILE A 41 ? -6.76957 48.49149 5.09909 0.687 24.00062 H ? A ? 39 H 1
   ATOM 918 N A LYS A 42 ? -8.23009 48.10664 7.80591 0.399 20.27818 N ? A ? 40 N 1
   ATOM 919 CA A LYS A 42 ? -9.21806 47.82159 8.83698 0.399 18.36135 C ? A ? 40 CA 1
   ATOM 920 C A LYS A 42 ? -9.36931 46.31596 9.04120 0.399 18.25281 C ? A ? 40 C 1
   ATOM 921 O A LYS A 42 ? -9.40144 45.83672 10.17751 0.399 19.53945 O ? A ? 40 O 1
   ATOM 922 CB A LYS A 42 ? -10.56506 48.46328 8.47943 0.399 20.91705 C ? A ? 40 CB 1
   ATOM 923 CG A LYS A 42 ? -11.61453 48.36538 9.58863 0.399 21.22476 C ? A ? 40 CG 1
   ATOM 924 CD A LYS A 42 ? -13.00891 48.84741 9.15412 0.399 25.74627 C ? A ? 40 CD 1
   ATOM 925 CE A LYS A 42 ? -14.00633 48.64703 10.28712 0.399 30.64690 C ? A ? 40 CE 1
   ATOM 926 NZ A LYS A 42 ? -15.35933 49.17027 9.94170 0.399 33.66458 N ? A ? 40 NZ 1
   ATOM 927 H A LYS A 42 ? -8.51836 48.57427 7.14423 0.399 24.44537 H ? A ? 40 H 1
   ATOM 928 HA A LYS A 42 ? -8.91994 48.21349 9.67271 0.399 22.14518 H ? A ? 40 HA 1
   ATOM 929 HB2 A LYS A 42 ? -10.42117 49.40394 8.29140 0.399 25.21201 H ? A ? 40 HB2 1
   ATOM 930 HB3 A LYS A 42 ? -10.92257 48.01900 7.69476 0.399 25.21201 H ? A ? 40 HB3 1
   ATOM 931 HG2 A LYS A 42 ? -11.69358 47.43906 9.86534 0.399 25.58126 H ? A ? 40 HG2 1
   ATOM 932 HG3 A LYS A 42 ? -11.33151 48.91247 10.33796 0.399 25.58126 H ? A ? 40 HG3 1
   ATOM 933 HD2 A LYS A 42 ? -12.97440 49.79133 8.93339 0.399 31.00707 H ? A ? 40 HD2 1
   ATOM 934 HD3 A LYS A 42 ? -13.30595 48.33734 8.38437 0.399 31.00707 H ? A ? 40 HD3 1
   ATOM 935 HE2 A LYS A 42 ? -14.08771 47.69918 10.47648 0.399 36.88784 H ? A ? 40 HE2 1
   ATOM 936 HE3 A LYS A 42 ? -13.69227 49.11706 11.07537 0.399 36.88784 H ? A ? 40 HE3 1
   ATOM 937 HZ1 A LYS A 42 ? -15.86798 49.20411 10.67123 0.399 40.50904 H ? A ? 40 HZ1 1
   ATOM 938 HZ2 A LYS A 42 ? -15.29080 49.98884 9.59914 0.399 40.50904 H ? A ? 40 HZ2 1
   ATOM 939 HZ3 A LYS A 42 ? -15.74775 48.63828 9.34319 0.399 40.50904 H ? A ? 40 HZ3 1
   ATOM 940 N B LYS A 42 ? -8.22894 48.09983 7.81283 0.601 20.26187 N ? A ? 40 N 1
   ATOM 941 CA B LYS A 42 ? -9.21524 47.81258 8.84568 0.601 18.27086 C ? A ? 40 CA 1
   ATOM 942 C B LYS A 42 ? -9.39129 46.30345 9.04181 0.601 18.19663 C ? A ? 40 C 1
   ATOM 943 O B LYS A 42 ? -9.50992 45.82041 10.17159 0.601 19.46566 O ? A ? 40 O 1
   ATOM 944 CB B LYS A 42 ? -10.53579 48.49489 8.46788 0.601 20.89483 C ? A ? 40 CB 1
   ATOM 945 CG B LYS A 42 ? -11.67472 48.30509 9.44173 0.601 21.11623 C ? A ? 40 CG 1
   ATOM 946 CD B LYS A 42 ? -12.90999 49.11605 9.03284 0.601 25.51879 C ? A ? 40 CD 1
   ATOM 947 CE B LYS A 42 ? -14.07935 48.77407 9.91862 0.601 30.87430 C ? A ? 40 CE 1
   ATOM 948 NZ B LYS A 42 ? -15.27490 49.56880 9.52110 0.601 32.70168 N ? A ? 40 NZ 1
   ATOM 949 H B LYS A 42 ? -8.52122 48.56669 7.15236 0.601 24.42579 H ? A ? 40 H 1
   ATOM 950 HA B LYS A 42 ? -8.91851 48.17224 9.69626 0.601 22.03658 H ? A ? 40 HA 1
   ATOM 951 HB2 B LYS A 42 ? -10.37529 49.44878 8.39546 0.601 25.18535 H ? A ? 40 HB2 1
   ATOM 952 HB3 B LYS A 42 ? -10.82677 48.14156 7.61267 0.601 25.18535 H ? A ? 40 HB3 1
   ATOM 953 HG2 B LYS A 42 ? -11.92145 47.36735 9.46783 0.601 25.45102 H ? A ? 40 HG2 1
   ATOM 954 HG3 B LYS A 42 ? -11.39565 48.59936 10.32288 0.601 25.45102 H ? A ? 40 HG3 1
   ATOM 955 HD2 B LYS A 42 ? -12.72134 50.06340 9.12135 0.601 30.73410 H ? A ? 40 HD2 1
   ATOM 956 HD3 B LYS A 42 ? -13.14603 48.90911 8.11504 0.601 30.73410 H ? A ? 40 HD3 1
   ATOM 957 HE2 B LYS A 42 ? -14.29003 47.83127 9.83111 0.601 37.16071 H ? A ? 40 HE2 1
   ATOM 958 HE3 B LYS A 42 ? -13.86142 48.98111 10.84086 0.601 37.16071 H ? A ? 40 HE3 1
   ATOM 959 HZ1 B LYS A 42 ? -16.01101 49.07656 9.61020 0.601 39.35356 H ? A ? 40 HZ1 1
   ATOM 960 HZ2 B LYS A 42 ? -15.34590 50.29057 10.03696 0.601 39.35356 H ? A ? 40 HZ2 1
   ATOM 961 HZ3 B LYS A 42 ? -15.20071 49.82647 8.67246 0.601 39.35356 H ? A ? 40 HZ3 1
   ATOM 962 N . ALA A 43 ? -9.54054 45.56655 7.94780 1.000 19.08794 N ? A ? 41 N 1
   ATOM 963 CA . ALA A 43 ? -9.68971 44.12344 8.06629 1.000 19.39197 C ? A ? 41 CA 1
   ATOM 964 C . ALA A 43 ? -8.45434 43.49062 8.68635 1.000 21.30422 C ? A ? 41 C 1
   ATOM 965 O . ALA A 43 ? -8.56661 42.56170 9.49933 1.000 21.35449 O ? A ? 41 O 1
   ATOM 966 CB . ALA A 43 ? -10.03473 43.55281 6.69793 1.000 19.38965 C ? A ? 41 CB 1
   ATOM 967 HA . ALA A 43 ? -10.42384 43.90257 8.66057 1.000 23.38191 H ? A ? 41 HA 1
   ATOM 968 HB1 . ALA A 43 ? -10.13904 42.59143 6.77384 1.000 23.37914 H ? A ? 41 HB1 1
   ATOM 969 HB2 . ALA A 43 ? -10.86303 43.95203 6.38899 1.000 23.37914 H ? A ? 41 HB2 1
   ATOM 970 HB3 . ALA A 43 ? -9.31685 43.75982 6.07930 1.000 23.37914 H ? A ? 41 HB3 1
   ATOM 971 H A ALA A 43 ? -9.57278 45.86741 7.14279 0.399 23.01709 H ? A ? 41 H 1
   ATOM 972 H B ALA A 43 ? -9.55849 45.87015 7.14337 0.601 23.01709 H ? A ? 41 H 1
   ATOM 973 N . ASN A 44 ? -7.27064 43.99739 8.36598 1.000 18.21965 N ? A ? 42 N 1
   ATOM 974 CA . ASN A 44 ? -6.05732 43.39614 8.89292 1.000 18.33895 C ? A ? 42 CA 1
   ATOM 975 C . ASN A 44 ? -5.90168 43.67433 10.37025 1.000 16.49892 C ? A ? 42 C 1
   ATOM 976 O . ASN A 44 ? -5.44146 42.79840 11.12578 1.000 19.10395 O ? A ? 42 O 1
   ATOM 977 CB . ASN A 44 ? -4.82330 43.87656 8.15023 1.000 18.82063 C ? A ? 42 CB 1
   ATOM 978 CG . ASN A 44 ? -3.55938 43.18559 8.65998 1.000 19.48762 C ? A ? 42 CG 1
   ATOM 979 OD1 . ASN A 44 ? -3.32679 41.96894 8.43011 1.000 19.92129 O ? A ? 42 OD1 1
   ATOM 980 ND2 . ASN A 44 ? -2.77628 43.92134 9.39656 1.000 22.82456 N ? A ? 42 ND2 1
   ATOM 981 H . ASN A 44 ? -7.14531 44.67711 7.85424 1.000 21.97513 H ? A ? 42 H 1
   ATOM 982 HA . ASN A 44 ? -6.12774 42.43869 8.75424 1.000 22.11829 H ? A ? 42 HA 1
   ATOM 983 HB2 . ASN A 44 ? -4.91975 43.67852 7.20557 1.000 22.69630 H ? A ? 42 HB2 1
   ATOM 984 HB3 . ASN A 44 ? -4.72228 44.83250 8.28016 1.000 22.69630 H ? A ? 42 HB3 1
   ATOM 985 HD21 . ASN A 44 ? -2.98681 44.73793 9.56523 1.000 27.50103 H ? A ? 42 HD21 1
   ATOM 986 HD22 . ASN A 44 ? -2.04877 43.59045 9.71413 1.000 27.50103 H ? A ? 42 HD22 1
   ATOM 987 N A VAL A 45 ? -6.25630 44.88765 10.81866 0.503 17.25109 N ? A ? 43 N 1
   ATOM 988 CA A VAL A 45 ? -6.17301 45.15154 12.23842 0.503 16.66554 C ? A ? 43 CA 1
   ATOM 989 C A VAL A 45 ? -7.20738 44.36757 13.01480 0.503 17.90063 C ? A ? 43 C 1
   ATOM 990 O A VAL A 45 ? -6.98866 44.04064 14.18201 0.503 18.82784 O ? A ? 43 O 1
   ATOM 991 CB A VAL A 45 ? -6.21630 46.66988 12.48457 0.503 18.32762 C ? A ? 43 CB 1
   ATOM 992 CG1 A VAL A 45 ? -6.54408 46.98631 13.91986 0.503 19.39124 C ? A ? 43 CG1 1
   ATOM 993 CG2 A VAL A 45 ? -4.88719 47.27263 12.08015 0.503 17.75479 C ? A ? 43 CG2 1
   ATOM 994 H A VAL A 45 ? -6.53524 45.54032 10.33306 0.503 20.81286 H ? A ? 43 H 1
   ATOM 995 HA A VAL A 45 ? -5.31874 44.83648 12.57287 0.503 20.11020 H ? A ? 43 HA 1
   ATOM 996 HB A VAL A 45 ? -6.92090 47.06432 11.94711 0.503 22.10469 H ? A ? 43 HB 1
   ATOM 997 HG11 A VAL A 45 ? -6.34775 47.92088 14.08999 0.503 23.38103 H ? A ? 43 HG11 1
   ATOM 998 HG12 A VAL A 45 ? -7.48582 46.81270 14.07440 0.503 23.38103 H ? A ? 43 HG12 1
   ATOM 999 HG13 A VAL A 45 ? -6.00488 46.42444 14.49820 0.503 23.38103 H ? A ? 43 HG13 1
   ATOM 1000 HG21 A VAL A 45 ? -4.92163 48.23258 12.21511 0.503 21.41730 H ? A ? 43 HG21 1
   ATOM 1001 HG22 A VAL A 45 ? -4.18569 46.88659 12.62766 0.503 21.41730 H ? A ? 43 HG22 1
   ATOM 1002 HG23 A VAL A 45 ? -4.72275 47.07581 11.14467 0.503 21.41730 H ? A ? 43 HG23 1
   ATOM 1003 N B VAL A 45 ? -6.26515 44.88357 10.81036 0.497 17.27344 N ? A ? 43 N 1
   ATOM 1004 CA B VAL A 45 ? -6.17120 45.17053 12.22141 0.497 16.69115 C ? A ? 43 CA 1
   ATOM 1005 C B VAL A 45 ? -7.21088 44.41256 13.01624 0.497 17.96337 C ? A ? 43 C 1
   ATOM 1006 O B VAL A 45 ? -6.99481 44.13996 14.19522 0.497 18.77098 O ? A ? 43 O 1
   ATOM 1007 CB B VAL A 45 ? -6.17033 46.69554 12.42587 0.497 18.29279 C ? A ? 43 CB 1
   ATOM 1008 CG1 B VAL A 45 ? -6.05176 47.04597 13.87309 0.497 18.58908 C ? A ? 43 CG1 1
   ATOM 1009 CG2 B VAL A 45 ? -5.01904 47.29803 11.58240 0.497 17.10825 C ? A ? 43 CG2 1
   ATOM 1010 H B VAL A 45 ? -6.55830 45.52661 10.32028 0.497 20.83968 H ? A ? 43 H 1
   ATOM 1011 HA B VAL A 45 ? -5.32707 44.84599 12.57215 0.497 20.14093 H ? A ? 43 HA 1
   ATOM 1012 HB B VAL A 45 ? -7.01066 47.07829 12.12879 0.497 22.06290 H ? A ? 43 HB 1
   ATOM 1013 HG11 B VAL A 45 ? -6.00665 48.01086 13.96171 0.497 22.41845 H ? A ? 43 HG11 1
   ATOM 1014 HG12 B VAL A 45 ? -6.82830 46.70641 14.34489 0.497 22.41845 H ? A ? 43 HG12 1
   ATOM 1015 HG13 B VAL A 45 ? -5.24513 46.64290 14.23056 0.497 22.41845 H ? A ? 43 HG13 1
   ATOM 1016 HG21 B VAL A 45 ? -5.11760 48.26267 11.55690 0.497 20.64145 H ? A ? 43 HG21 1
   ATOM 1017 HG22 B VAL A 45 ? -4.17146 47.06281 11.99128 0.497 20.64145 H ? A ? 43 HG22 1
   ATOM 1018 HG23 B VAL A 45 ? -5.06399 46.93705 10.68319 0.497 20.64145 H ? A ? 43 HG23 1
   ATOM 1019 N . GLU A 46 ? -8.35585 44.09396 12.42594 1.000 18.24008 N ? A ? 44 N 1
   ATOM 1020 CA . GLU A 46 ? -9.28375 43.24716 13.12425 1.000 17.08490 C ? A ? 44 CA 1
   ATOM 1021 C . GLU A 46 ? -8.68242 41.85511 13.39342 1.000 21.60184 C ? A ? 44 C 1
   ATOM 1022 O . GLU A 46 ? -8.88638 41.30624 14.47353 1.000 20.56789 O ? A ? 44 O 1
   ATOM 1023 CB . GLU A 46 ? -10.57519 43.13562 12.34373 1.000 20.07501 C ? A ? 44 CB 1
   ATOM 1024 CG . GLU A 46 ? -11.41206 44.41149 12.37454 1.000 23.55008 C ? A ? 44 CG 1
   ATOM 1025 CD . GLU A 46 ? -12.62213 44.37901 11.45990 1.000 36.57980 C ? A ? 44 CD 1
   ATOM 1026 OE1 . GLU A 46 ? -12.73896 43.43919 10.64344 1.000 42.21407 O ? A ? 44 OE1 1
   ATOM 1027 OE2 . GLU A 46 ? -13.44791 45.32313 11.53904 1.000 40.45652 O ? A ? 44 OE2 1
   ATOM 1028 HA . GLU A 46 ? -9.48943 43.65135 13.98170 1.000 20.61343 H ? A ? 44 HA 1
   ATOM 1029 HB2 . GLU A 46 ? -10.36554 42.93908 11.41728 1.000 24.20156 H ? A ? 44 HB2 1
   ATOM 1030 HB3 . GLU A 46 ? -11.10929 42.41973 12.72209 1.000 24.20156 H ? A ? 44 HB3 1
   ATOM 1031 HG2 . GLU A 46 ? -11.73080 44.55279 13.27972 1.000 28.37165 H ? A ? 44 HG2 1
   ATOM 1032 HG3 . GLU A 46 ? -10.85462 45.15600 12.09911 1.000 28.37165 H ? A ? 44 HG3 1
   ATOM 1033 H A GLU A 46 ? -8.60768 44.37669 11.65377 0.503 21.99965 H ? A ? 44 H 1
   ATOM 1034 H B GLU A 46 ? -8.60427 44.35188 11.64405 0.497 21.99965 H ? A ? 44 H 1
   ATOM 1035 N A VAL A 47 ? -7.79643 41.35463 12.52821 0.527 17.75614 N ? A ? 45 N 1
   ATOM 1036 CA A VAL A 47 ? -7.08578 40.09971 12.81508 0.527 16.17837 C ? A ? 45 CA 1
   ATOM 1037 C A VAL A 47 ? -6.12095 40.25795 13.99166 0.527 19.80646 C ? A ? 45 C 1
   ATOM 1038 O A VAL A 47 ? -6.07069 39.41255 14.89880 0.527 18.15658 O ? A ? 45 O 1
   ATOM 1039 CB A VAL A 47 ? -6.37693 39.57920 11.54934 0.527 17.56097 C ? A ? 45 CB 1
   ATOM 1040 CG1 A VAL A 47 ? -5.49631 38.36794 11.88270 0.527 17.15213 C ? A ? 45 CG1 1
   ATOM 1041 CG2 A VAL A 47 ? -7.40011 39.26239 10.45506 0.527 18.22908 C ? A ? 45 CG2 1
   ATOM 1042 H A VAL A 47 ? -7.58879 41.71563 11.77577 0.527 21.41892 H ? A ? 45 H 1
   ATOM 1043 HA A VAL A 47 ? -7.74442 39.43929 13.08142 0.527 19.52560 H ? A ? 45 HA 1
   ATOM 1044 HB A VAL A 47 ? -5.79060 40.26981 11.20266 0.527 21.18471 H ? A ? 45 HB 1
   ATOM 1045 HG11 A VAL A 47 ? -5.31099 37.87798 11.06630 0.527 20.69411 H ? A ? 45 HG11 1
   ATOM 1046 HG12 A VAL A 47 ? -4.66667 38.67962 12.27699 0.527 20.69411 H ? A ? 45 HG12 1
   ATOM 1047 HG13 A VAL A 47 ? -5.96746 37.79823 12.51067 0.527 20.69411 H ? A ? 45 HG13 1
   ATOM 1048 HG21 A VAL A 47 ? -6.93475 38.91188 9.67950 0.527 21.98644 H ? A ? 45 HG21 1
   ATOM 1049 HG22 A VAL A 47 ? -8.02728 38.60282 10.79053 0.527 21.98644 H ? A ? 45 HG22 1
   ATOM 1050 HG23 A VAL A 47 ? -7.87136 40.07643 10.21810 0.527 21.98644 H ? A ? 45 HG23 1
   ATOM 1051 N B VAL A 47 ? -8.08788 41.23508 12.35283 0.473 16.85246 N ? A ? 45 N 1
   ATOM 1052 CA B VAL A 47 ? -7.32812 39.98980 12.50825 0.473 16.62703 C ? A ? 45 CA 1
   ATOM 1053 C B VAL A 47 ? -6.17026 40.18460 13.47337 0.473 18.47472 C ? A ? 45 C 1
   ATOM 1054 O B VAL A 47 ? -5.93521 39.35550 14.35362 0.473 17.73199 O ? A ? 45 O 1
   ATOM 1055 CB B VAL A 47 ? -6.84075 39.44806 11.14946 0.473 16.98419 C ? A ? 45 CB 1
   ATOM 1056 CG1 B VAL A 47 ? -5.86656 38.25603 11.31069 0.473 16.02126 C ? A ? 45 CG1 1
   ATOM 1057 CG2 B VAL A 47 ? -8.02274 39.04096 10.29652 0.473 18.68948 C ? A ? 45 CG2 1
   ATOM 1058 H B VAL A 47 ? -8.11276 41.52149 11.54231 0.473 20.33451 H ? A ? 45 H 1
   ATOM 1059 HA B VAL A 47 ? -7.92994 39.32879 12.88479 0.473 20.06398 H ? A ? 45 HA 1
   ATOM 1060 HB B VAL A 47 ? -6.35307 40.15933 10.70544 0.473 20.49258 H ? A ? 45 HB 1
   ATOM 1061 HG11 B VAL A 47 ? -5.74825 37.82613 10.44924 0.473 19.33707 H ? A ? 45 HG11 1
   ATOM 1062 HG12 B VAL A 47 ? -5.01429 38.58638 11.63534 0.473 19.33707 H ? A ? 45 HG12 1
   ATOM 1063 HG13 B VAL A 47 ? -6.24088 37.62598 11.94616 0.473 19.33707 H ? A ? 45 HG13 1
   ATOM 1064 HG21 B VAL A 47 ? -7.70123 38.75486 9.42721 0.473 22.53893 H ? A ? 45 HG21 1
   ATOM 1065 HG22 B VAL A 47 ? -8.49059 38.31168 10.73260 0.473 22.53893 H ? A ? 45 HG22 1
   ATOM 1066 HG23 B VAL A 47 ? -8.61633 39.80148 10.19578 0.473 22.53893 H ? A ? 45 HG23 1
   ATOM 1067 N A LEU A 48 ? -5.33750 41.32715 13.98717 0.527 16.61843 N ? A ? 46 N 1
   ATOM 1068 CA A LEU A 48 ? -4.34976 41.55175 15.02459 0.527 16.80562 C ? A ? 46 CA 1
   ATOM 1069 C A LEU A 48 ? -4.99451 41.71089 16.39619 0.527 18.36168 C ? A ? 46 C 1
   ATOM 1070 O A LEU A 48 ? -4.42780 41.28689 17.40039 0.527 18.64476 O ? A ? 46 O 1
   ATOM 1071 CB A LEU A 48 ? -3.58284 42.79850 14.65577 0.527 16.16736 C ? A ? 46 CB 1
   ATOM 1072 CG A LEU A 48 ? -2.42703 43.20144 15.52778 0.527 18.39011 C ? A ? 46 CG 1
   ATOM 1073 CD1 A LEU A 48 ? -1.43409 42.12340 15.51122 0.527 17.20825 C ? A ? 46 CD1 1
   ATOM 1074 CD2 A LEU A 48 ? -1.90313 44.48424 14.94885 0.527 16.62350 C ? A ? 46 CD2 1
   ATOM 1075 H A LEU A 48 ? -5.35890 41.94356 13.38785 0.527 20.05367 H ? A ? 46 H 1
   ATOM 1076 HA A LEU A 48 ? -3.74828 40.79297 15.08251 0.527 20.27830 H ? A ? 46 HA 1
   ATOM 1077 HB2 A LEU A 48 ? -3.22648 42.67133 13.76261 0.527 19.51238 H ? A ? 46 HB2 1
   ATOM 1078 HB3 A LEU A 48 ? -4.20746 43.54060 14.66119 0.527 19.51238 H ? A ? 46 HB3 1
   ATOM 1079 HG A LEU A 48 ? -2.66295 43.34534 16.45758 0.527 22.17969 H ? A ? 46 HG 1
   ATOM 1080 HD11 A LEU A 48 ? -0.63933 42.41881 15.98237 0.527 20.76146 H ? A ? 46 HD11 1
   ATOM 1081 HD12 A LEU A 48 ? -1.80779 41.34310 15.94983 0.527 20.76146 H ? A ? 46 HD12 1
   ATOM 1082 HD13 A LEU A 48 ? -1.21336 41.91147 14.59075 0.527 20.76146 H ? A ? 46 HD13 1
   ATOM 1083 HD21 A LEU A 48 ? -1.09739 44.73963 15.42473 0.527 20.05975 H ? A ? 46 HD21 1
   ATOM 1084 HD22 A LEU A 48 ? -1.70344 44.34841 14.00940 0.527 20.05975 H ? A ? 46 HD22 1
   ATOM 1085 HD23 A LEU A 48 ? -2.57805 45.17396 15.04720 0.527 20.05975 H ? A ? 46 HD23 1
   ATOM 1086 N B LEU A 48 ? -5.40657 41.25790 13.32634 0.473 17.20396 N ? A ? 46 N 1
   ATOM 1087 CA B LEU A 48 ? -4.34074 41.51839 14.28128 0.473 15.49325 C ? A ? 46 CA 1
   ATOM 1088 C B LEU A 48 ? -4.87677 41.66586 15.71457 0.473 17.61907 C ? A ? 46 C 1
   ATOM 1089 O B LEU A 48 ? -4.26326 41.17935 16.67451 0.473 19.00372 O ? A ? 46 O 1
   ATOM 1090 CB B LEU A 48 ? -3.55601 42.74602 13.83793 0.473 16.27348 C ? A ? 46 CB 1
   ATOM 1091 CG B LEU A 48 ? -2.63758 43.26070 14.90345 0.473 16.02909 C ? A ? 46 CG 1
   ATOM 1092 CD1 B LEU A 48 ? -1.24055 43.45933 14.36891 0.473 19.27699 C ? A ? 46 CD1 1
   ATOM 1093 CD2 B LEU A 48 ? -3.18439 44.59493 15.40398 0.473 20.41771 C ? A ? 46 CD2 1
   ATOM 1094 H B LEU A 48 ? -5.48226 41.83872 12.69665 0.473 20.75630 H ? A ? 46 H 1
   ATOM 1095 HA B LEU A 48 ? -3.73070 40.76436 14.29503 0.473 18.70345 H ? A ? 46 HA 1
   ATOM 1096 HB2 B LEU A 48 ? -3.01945 42.51456 13.06370 0.473 19.63973 H ? A ? 46 HB2 1
   ATOM 1097 HB3 B LEU A 48 ? -4.17943 43.45336 13.61008 0.473 19.63973 H ? A ? 46 HB3 1
   ATOM 1098 HG B LEU A 48 ? -2.58712 42.61902 15.62912 0.473 19.34646 H ? A ? 46 HG 1
   ATOM 1099 HD11 B LEU A 48 ? -0.70046 43.89087 15.04934 0.473 23.24394 H ? A ? 46 HD11 1
   ATOM 1100 HD12 B LEU A 48 ? -0.86206 42.59466 14.14532 0.473 23.24394 H ? A ? 46 HD12 1
   ATOM 1101 HD13 B LEU A 48 ? -1.28198 44.01718 13.57645 0.473 23.24394 H ? A ? 46 HD13 1
   ATOM 1102 HD21 B LEU A 48 ? -2.53617 44.99709 16.00313 0.473 24.61281 H ? A ? 46 HD21 1
   ATOM 1103 HD22 B LEU A 48 ? -3.33883 45.17791 14.64426 0.473 24.61281 H ? A ? 46 HD22 1
   ATOM 1104 HD23 B LEU A 48 ? -4.01756 44.43796 15.87523 0.473 24.61281 H ? A ? 46 HD23 1
   ATOM 1105 N A LYS A 49 ? -6.14248 42.38877 16.47543 0.527 17.56380 N ? A ? 47 N 1
   ATOM 1106 CA A LYS A 49 ? -6.91530 42.40119 17.72023 0.527 17.20982 C ? A ? 47 CA 1
   ATOM 1107 C A LYS A 49 ? -7.21651 40.98512 18.23979 0.527 16.20981 C ? A ? 47 C 1
   ATOM 1108 O A LYS A 49 ? -7.06839 40.70609 19.43395 0.527 18.06243 O ? A ? 47 O 1
   ATOM 1109 CB A LYS A 49 ? -8.21400 43.19379 17.51453 0.527 18.02152 C ? A ? 47 CB 1
   ATOM 1110 CG A LYS A 49 ? -9.29064 42.92437 18.59374 0.527 21.44728 C ? A ? 47 CG 1
   ATOM 1111 CD A LYS A 49 ? -10.58479 43.74235 18.38223 0.527 24.72784 C ? A ? 47 CD 1
   ATOM 1112 CE A LYS A 49 ? -11.58442 43.42800 19.50688 0.527 28.33119 C ? A ? 47 CE 1
   ATOM 1113 NZ A LYS A 49 ? -12.98482 43.86147 19.20738 0.527 34.25379 N ? A ? 47 NZ 1
   ATOM 1114 H A LYS A 49 ? -6.49093 42.84269 15.83345 0.527 21.18812 H ? A ? 47 H 1
   ATOM 1115 HA A LYS A 49 ? -6.38504 42.84488 18.40057 0.527 20.76333 H ? A ? 47 HA 1
   ATOM 1116 HB2 A LYS A 49 ? -8.00680 44.14120 17.53379 0.527 21.73737 H ? A ? 47 HB2 1
   ATOM 1117 HB3 A LYS A 49 ? -8.59183 42.95425 16.65385 0.527 21.73737 H ? A ? 47 HB3 1
   ATOM 1118 HG2 A LYS A 49 ? -9.52685 41.98377 18.57452 0.527 25.84829 H ? A ? 47 HG2 1
   ATOM 1119 HG3 A LYS A 49 ? -8.92984 43.15813 19.46327 0.527 25.84829 H ? A ? 47 HG3 1
   ATOM 1120 HD2 A LYS A 49 ? -10.38077 44.69046 18.40127 0.527 29.78496 H ? A ? 47 HD2 1
   ATOM 1121 HD3 A LYS A 49 ? -10.98693 43.50655 17.53159 0.527 29.78496 H ? A ? 47 HD3 1
   ATOM 1122 HE2 A LYS A 49 ? -11.59711 42.46942 19.65472 0.527 34.10899 H ? A ? 47 HE2 1
   ATOM 1123 HE3 A LYS A 49 ? -11.30015 43.88446 20.31418 0.527 34.10899 H ? A ? 47 HE3 1
   ATOM 1124 HZ1 A LYS A 49 ? -13.51831 43.66093 19.89095 0.527 41.21610 H ? A ? 47 HZ1 1
   ATOM 1125 HZ2 A LYS A 49 ? -13.00869 44.74057 19.07059 0.527 41.21610 H ? A ? 47 HZ2 1
   ATOM 1126 HZ3 A LYS A 49 ? -13.28216 43.44746 18.47780 0.527 41.21610 H ? A ? 47 HZ3 1
   ATOM 1127 N B LYS A 49 ? -6.01443 42.34195 15.88455 0.473 17.81604 N ? A ? 47 N 1
   ATOM 1128 CA B LYS A 49 ? -6.58679 42.52680 17.22127 0.473 17.21215 C ? A ? 47 CA 1
   ATOM 1129 C B LYS A 49 ? -6.98825 41.19203 17.85030 0.473 17.48782 C ? A ? 47 C 1
   ATOM 1130 O B LYS A 49 ? -6.80200 40.98474 19.05432 0.473 18.28980 O ? A ? 47 O 1
   ATOM 1131 CB B LYS A 49 ? -7.77676 43.49413 17.11598 0.473 18.48115 C ? A ? 47 CB 1
   ATOM 1132 CG B LYS A 49 ? -8.98004 43.17222 17.98934 0.473 21.91755 C ? A ? 47 CG 1
   ATOM 1133 CD B LYS A 49 ? -8.74862 43.49062 19.45165 0.473 22.86252 C ? A ? 47 CD 1
   ATOM 1134 CE B LYS A 49 ? -10.09476 43.40689 20.21659 0.473 25.81697 C ? A ? 47 CE 1
   ATOM 1135 NZ B LYS A 49 ? -9.99368 43.86080 21.65586 0.473 29.25661 N ? A ? 47 NZ 1
   ATOM 1136 H B LYS A 49 ? -6.47133 42.70067 15.25038 0.473 21.49080 H ? A ? 47 H 1
   ATOM 1137 HA B LYS A 49 ? -5.92768 42.92043 17.81416 0.473 20.76613 H ? A ? 47 HA 1
   ATOM 1138 HB2 B LYS A 49 ? -7.47010 44.37963 17.36649 0.473 22.28893 H ? A ? 47 HB2 1
   ATOM 1139 HB3 B LYS A 49 ? -8.08374 43.49734 16.19584 0.473 22.28893 H ? A ? 47 HB3 1
   ATOM 1140 HG2 B LYS A 49 ? -9.73923 43.69437 17.68621 0.473 26.41261 H ? A ? 47 HG2 1
   ATOM 1141 HG3 B LYS A 49 ? -9.17854 42.22549 17.91730 0.473 26.41261 H ? A ? 47 HG3 1
   ATOM 1142 HD2 B LYS A 49 ? -8.12999 42.84897 19.83439 0.473 27.54658 H ? A ? 47 HD2 1
   ATOM 1143 HD3 B LYS A 49 ? -8.39262 44.38852 19.54074 0.473 27.54658 H ? A ? 47 HD3 1
   ATOM 1144 HE2 B LYS A 49 ? -10.74502 43.97237 19.77128 0.473 31.09192 H ? A ? 47 HE2 1
   ATOM 1145 HE3 B LYS A 49 ? -10.40000 42.48616 20.21576 0.473 31.09192 H ? A ? 47 HE3 1
   ATOM 1146 HZ1 B LYS A 49 ? -10.64842 43.49691 22.13649 0.473 35.21949 H ? A ? 47 HZ1 1
   ATOM 1147 HZ2 B LYS A 49 ? -9.21102 43.61239 21.99913 0.473 35.21949 H ? A ? 47 HZ2 1
   ATOM 1148 HZ3 B LYS A 49 ? -10.06058 44.74713 21.70092 0.473 35.21949 H ? A ? 47 HZ3 1
   ATOM 1149 N A THR A 50 ? -7.71221 40.10976 17.38332 0.527 19.16075 N ? A ? 48 N 1
   ATOM 1150 CA A THR A 50 ? -7.94740 38.73808 17.82187 0.527 18.77762 C ? A ? 48 CA 1
   ATOM 1151 C A THR A 50 ? -6.65741 38.13717 18.37814 0.527 17.66771 C ? A ? 48 C 1
   ATOM 1152 O A THR A 50 ? -6.60359 37.65981 19.52265 0.527 16.64442 O ? A ? 48 O 1
   ATOM 1153 CB A THR A 50 ? -8.48724 37.92609 16.63036 0.527 17.70706 C ? A ? 48 CB 1
   ATOM 1154 OG1 A THR A 50 ? -9.74423 38.47209 16.17346 0.527 21.99237 O ? A ? 48 OG1 1
   ATOM 1155 CG2 A THR A 50 ? -8.66574 36.49032 16.98941 0.527 17.98729 C ? A ? 48 CG2 1
   ATOM 1156 H A THR A 50 ? -7.91691 40.27478 16.56450 0.527 23.10445 H ? A ? 48 H 1
   ATOM 1157 HA A THR A 50 ? -8.61193 38.71138 18.52798 0.527 22.64469 H ? A ? 48 HA 1
   ATOM 1158 HB A THR A 50 ? -7.84184 37.97572 15.90794 0.527 21.36003 H ? A ? 48 HB 1
   ATOM 1159 HG1 A THR A 50 ? -9.64697 39.27920 15.96201 0.527 26.50239 H ? A ? 48 HG1 1
   ATOM 1160 HG21 A THR A 50 ? -9.16291 36.03351 16.29296 0.527 21.69630 H ? A ? 48 HG21 1
   ATOM 1161 HG22 A THR A 50 ? -7.80053 36.06351 17.09016 0.527 21.69630 H ? A ? 48 HG22 1
   ATOM 1162 HG23 A THR A 50 ? -9.15293 36.41535 17.82482 0.527 21.69630 H ? A ? 48 HG23 1
   ATOM 1163 N B THR A 50 ? -7.57595 40.29863 17.06869 0.473 18.66567 N ? A ? 48 N 1
   ATOM 1164 CA B THR A 50 ? -7.97973 39.02031 17.64348 0.473 18.99568 C ? A ? 48 CA 1
   ATOM 1165 C B THR A 50 ? -6.76606 38.17425 17.94045 0.473 18.41688 C ? A ? 48 C 1
   ATOM 1166 O B THR A 50 ? -6.75489 37.41464 18.91253 0.473 15.26150 O ? A ? 48 O 1
   ATOM 1167 CB B THR A 50 ? -8.85854 38.22868 16.68527 0.473 18.55561 C ? A ? 48 CB 1
   ATOM 1168 OG1 B THR A 50 ? -10.10007 38.91554 16.52328 0.473 20.34950 O ? A ? 48 OG1 1
   ATOM 1169 CG2 B THR A 50 ? -9.12841 36.81008 17.19579 0.473 19.65218 C ? A ? 48 CG2 1
   ATOM 1170 H B THR A 50 ? -7.74768 40.40099 16.23225 0.473 22.51035 H ? A ? 48 H 1
   ATOM 1171 HA B THR A 50 ? -8.48456 39.21198 18.44928 0.473 22.90636 H ? A ? 48 HA 1
   ATOM 1172 HB B THR A 50 ? -8.40235 38.14557 15.83328 0.473 22.37828 H ? A ? 48 HB 1
   ATOM 1173 HG1 B THR A 50 ? -9.97037 39.66155 16.15962 0.473 24.53095 H ? A ? 48 HG1 1
   ATOM 1174 HG21 B THR A 50 ? -9.80090 36.38117 16.64380 0.473 23.69417 H ? A ? 48 HG21 1
   ATOM 1175 HG22 B THR A 50 ? -8.31328 36.28526 17.16368 0.473 23.69417 H ? A ? 48 HG22 1
   ATOM 1176 HG23 B THR A 50 ? -9.44641 36.84197 18.11162 0.473 23.69417 H ? A ? 48 HG23 1
   ATOM 1177 N A LEU A 51 ? -5.59092 38.22144 17.59418 0.527 18.30777 N ? A ? 49 N 1
   ATOM 1178 CA A LEU A 51 ? -4.32978 37.56260 17.91397 0.527 15.31653 C ? A ? 49 CA 1
   ATOM 1179 C A LEU A 51 ? -3.66631 38.14508 19.15117 0.527 17.32413 C ? A ? 49 C 1
   ATOM 1180 O A LEU A 51 ? -3.13545 37.39866 19.98826 0.527 17.76931 O ? A ? 49 O 1
   ATOM 1181 CB A LEU A 51 ? -3.40332 37.69551 16.71273 0.527 16.47038 C ? A ? 49 CB 1
   ATOM 1182 CG A LEU A 51 ? -3.74333 37.00886 15.39594 0.527 16.47207 C ? A ? 49 CG 1
   ATOM 1183 CD1 A LEU A 51 ? -2.77802 37.42099 14.32564 0.527 17.15368 C ? A ? 49 CD1 1
   ATOM 1184 CD2 A LEU A 51 ? -3.61556 35.53175 15.58843 0.527 18.89973 C ? A ? 49 CD2 1
   ATOM 1185 H A LEU A 51 ? -5.56831 38.66215 16.85603 0.527 22.08088 H ? A ? 49 H 1
   ATOM 1186 HA A LEU A 51 ? -4.50402 36.62687 18.10093 0.527 18.49139 H ? A ? 49 HA 1
   ATOM 1187 HB2 A LEU A 51 ? -3.33263 38.64165 16.51093 0.527 19.87600 H ? A ? 49 HB2 1
   ATOM 1188 HB3 A LEU A 51 ? -2.53824 37.34785 16.98046 0.527 19.87600 H ? A ? 49 HB3 1
   ATOM 1189 HG A LEU A 51 ? -4.64249 37.25159 15.12483 0.527 19.87804 H ? A ? 49 HG 1
   ATOM 1190 HD11 A LEU A 51 ? -3.00913 36.96712 13.50012 0.527 20.69597 H ? A ? 49 HD11 1
   ATOM 1191 HD12 A LEU A 51 ? -2.83462 38.38143 14.20211 0.527 20.69597 H ? A ? 49 HD12 1
   ATOM 1192 HD13 A LEU A 51 ? -1.88024 37.17490 14.59828 0.527 20.69597 H ? A ? 49 HD13 1
   ATOM 1193 HD21 A LEU A 51 ? -3.72275 35.09110 14.73097 0.527 22.79123 H ? A ? 49 HD21 1
   ATOM 1194 HD22 A LEU A 51 ? -2.73869 35.33557 15.95382 0.527 22.79123 H ? A ? 49 HD22 1
   ATOM 1195 HD23 A LEU A 51 ? -4.30428 35.23255 16.20247 0.527 22.79123 H ? A ? 49 HD23 1
   ATOM 1196 N B LEU A 51 ? -5.79115 38.18283 17.04240 0.473 16.48553 N ? A ? 49 N 1
   ATOM 1197 CA B LEU A 51 ? -4.55641 37.44974 17.31311 0.473 15.27977 C ? A ? 49 CA 1
   ATOM 1198 C B LEU A 51 ? -3.80882 37.97786 18.54175 0.473 16.58617 C ? A ? 49 C 1
   ATOM 1199 O B LEU A 51 ? -3.04802 37.22076 19.17664 0.473 16.36450 O ? A ? 49 O 1
   ATOM 1200 CB B LEU A 51 ? -3.69023 37.46822 16.05947 0.473 15.24984 C ? A ? 49 CB 1
   ATOM 1201 CG B LEU A 51 ? -4.24693 36.70158 14.85682 0.473 16.06649 C ? A ? 49 CG 1
   ATOM 1202 CD1 B LEU A 51 ? -3.32140 36.98474 13.63842 0.473 16.41455 C ? A ? 49 CD1 1
   ATOM 1203 CD2 B LEU A 51 ? -4.49263 35.23406 15.07362 0.473 15.85778 C ? A ? 49 CD2 1
   ATOM 1204 H B LEU A 51 ? -5.81471 38.59319 16.28699 0.473 19.89419 H ? A ? 49 H 1
   ATOM 1205 HA B LEU A 51 ? -4.76715 36.52564 17.51935 0.473 18.44727 H ? A ? 49 HA 1
   ATOM 1206 HB2 B LEU A 51 ? -3.57369 38.39111 15.78453 0.473 18.41137 H ? A ? 49 HB2 1
   ATOM 1207 HB3 B LEU A 51 ? -2.83046 37.07625 16.27867 0.473 18.41137 H ? A ? 49 HB3 1
   ATOM 1208 HG B LEU A 51 ? -5.14459 37.02544 14.68295 0.473 19.39134 H ? A ? 49 HG 1
   ATOM 1209 HD11 B LEU A 51 ? -3.66079 36.50604 12.86605 0.473 19.80901 H ? A ? 49 HD11 1
   ATOM 1210 HD12 B LEU A 51 ? -3.31628 37.93828 13.46060 0.473 19.80901 H ? A ? 49 HD12 1
   ATOM 1211 HD13 B LEU A 51 ? -2.42362 36.68229 13.84680 0.473 19.80901 H ? A ? 49 HD13 1
   ATOM 1212 HD21 B LEU A 51 ? -4.78409 34.83591 14.23851 0.473 19.14089 H ? A ? 49 HD21 1
   ATOM 1213 HD22 B LEU A 51 ? -3.66873 34.81625 15.36948 0.473 19.14089 H ? A ? 49 HD22 1
   ATOM 1214 HD23 B LEU A 51 ? -5.17987 35.12540 15.74949 0.473 19.14089 H ? A ? 49 HD23 1
   ATOM 1215 N A SER A 52 ? -3.60279 39.48166 19.22816 0.527 16.66309 N ? A ? 50 N 1
   ATOM 1216 CA A SER A 52 ? -3.01766 40.16703 20.36920 0.527 16.44697 C ? A ? 50 CA 1
   ATOM 1217 C A SER A 52 ? -3.67460 39.77259 21.67176 0.527 16.44625 C ? A ? 50 C 1
   ATOM 1218 O A SER A 52 ? -3.13057 40.07932 22.74611 0.527 16.27180 O ? A ? 50 O 1
   ATOM 1219 CB A SER A 52 ? -3.04478 41.66596 20.12774 0.527 16.70249 C ? A ? 50 CB 1
   ATOM 1220 OG A SER A 52 ? -2.10143 41.93894 19.08664 0.527 18.94074 O ? A ? 50 OG 1
   ATOM 1221 H A SER A 52 ? -3.89743 40.01467 18.62096 0.527 20.10726 H ? A ? 50 H 1
   ATOM 1222 HA A SER A 52 ? -2.08204 39.92872 20.46253 0.527 19.84792 H ? A ? 50 HA 1
   ATOM 1223 HB2 A SER A 52 ? -3.93274 41.94048 19.85015 0.527 20.15454 H ? A ? 50 HB2 1
   ATOM 1224 HB3 A SER A 52 ? -2.78995 42.13623 20.93695 0.527 20.15454 H ? A ? 50 HB3 1
   ATOM 1225 HG A SER A 52 ? -1.38069 41.53528 19.23892 0.527 22.84044 H ? A ? 50 HG 1
   ATOM 1226 N B SER A 52 ? -4.01908 39.26247 18.89516 0.473 16.09541 N ? A ? 50 N 1
   ATOM 1227 CA B SER A 52 ? -3.23338 39.92656 19.94502 0.473 16.16825 C ? A ? 50 CA 1
   ATOM 1228 C B SER A 52 ? -3.61267 39.55064 21.38210 0.473 16.27271 C ? A ? 50 C 1
   ATOM 1229 O B SER A 52 ? -2.83644 39.79677 22.29668 0.473 19.06083 O ? A ? 50 O 1
   ATOM 1230 CB B SER A 52 ? -3.30462 41.45375 19.81202 0.473 17.16260 C ? A ? 50 CB 1
   ATOM 1231 OG B SER A 52 ? -4.57188 41.94043 20.18900 0.473 18.17302 O ? A ? 50 OG 1
   ATOM 1232 H B SER A 52 ? -4.61450 39.76992 18.53800 0.473 19.42604 H ? A ? 50 H 1
   ATOM 1233 HA B SER A 52 ? -2.31747 39.64004 19.80387 0.473 19.51345 H ? A ? 50 HA 1
   ATOM 1234 HB2 B SER A 52 ? -2.63182 41.85089 20.38694 0.473 20.70667 H ? A ? 50 HB2 1
   ATOM 1235 HB3 B SER A 52 ? -3.13687 41.69680 18.88807 0.473 20.70667 H ? A ? 50 HB3 1
   ATOM 1236 HG B SER A 52 ? -4.59386 42.77638 20.10964 0.473 21.91918 H ? A ? 50 HG 1
   ATOM 1237 N . ALA A 53 ? -4.83315 39.08617 21.61455 1.000 17.20922 N ? A ? 51 N 1
   ATOM 1238 CA . ALA A 53 ? -5.33646 38.59143 22.88417 1.000 19.01852 C ? A ? 51 CA 1
   ATOM 1239 C . ALA A 53 ? -4.91147 37.16278 23.21271 1.000 17.76818 C ? A ? 51 C 1
   ATOM 1240 O . ALA A 53 ? -5.11928 36.75337 24.35652 1.000 23.48562 O ? A ? 51 O 1
   ATOM 1241 CB . ALA A 53 ? -6.85906 38.69628 22.90260 1.000 20.21060 C ? A ? 51 CB 1
   ATOM 1242 HA . ALA A 53 ? -4.97996 39.15202 23.59095 1.000 22.93378 H ? A ? 51 HA 1
   ATOM 1243 HB1 . ALA A 53 ? -7.19043 38.33439 23.73934 1.000 24.36427 H ? A ? 51 HB1 1
   ATOM 1244 HB2 . ALA A 53 ? -7.11236 39.62918 22.82231 1.000 24.36427 H ? A ? 51 HB2 1
   ATOM 1245 HB3 . ALA A 53 ? -7.21949 38.19037 22.15759 1.000 24.36427 H ? A ? 51 HB3 1
   ATOM 1246 H A ALA A 53 ? -5.29513 38.91606 20.90939 0.527 20.76261 H ? A ? 51 H 1
   ATOM 1247 H B ALA A 53 ? -5.43654 39.04416 21.00318 0.473 20.76261 H ? A ? 51 H 1
   ATOM 1248 N . LEU A 54 ? -4.29338 36.45945 22.29800 1.000 17.03474 N ? A ? 52 N 1
   ATOM 1249 CA . LEU A 54 ? -4.07888 35.02679 22.46900 1.000 17.49901 C ? A ? 52 CA 1
   ATOM 1250 C . LEU A 54 ? -2.85848 34.57569 23.24758 1.000 19.61453 C ? A ? 52 C 1
   ATOM 1251 O . LEU A 54 ? -2.92837 33.58208 23.96547 1.000 16.48362 O ? A ? 52 O 1
   ATOM 1252 CB . LEU A 54 ? -4.05853 34.32007 21.13731 1.000 18.37881 C ? A ? 52 CB 1
   ATOM 1253 CG . LEU A 54 ? -5.40980 34.46652 20.42740 1.000 19.63130 C ? A ? 52 CG 1
   ATOM 1254 CD1 . LEU A 54 ? -5.37244 33.77071 19.10448 1.000 16.94715 C ? A ? 52 CD1 1
   ATOM 1255 CD2 . LEU A 54 ? -6.64910 34.00527 21.17843 1.000 19.93115 C ? A ? 52 CD2 1
   ATOM 1256 H . LEU A 54 ? -3.98349 36.78015 21.56267 1.000 20.55324 H ? A ? 52 H 1
   ATOM 1257 HA . LEU A 54 ? -4.83153 34.77204 23.02535 1.000 21.11036 H ? A ? 52 HA 1
   ATOM 1258 HB2 . LEU A 54 ? -3.36965 34.70855 20.57569 1.000 22.16612 H ? A ? 52 HB2 1
   ATOM 1259 HB3 . LEU A 54 ? -3.88135 33.37636 21.27486 1.000 22.16612 H ? A ? 52 HB3 1
   ATOM 1260 HG . LEU A 54 ? -5.52102 35.42635 20.34223 1.000 23.66911 H ? A ? 52 HG 1
   ATOM 1261 HD11 . LEU A 54 ? -6.22493 33.89424 18.65850 1.000 20.44813 H ? A ? 52 HD11 1
   ATOM 1262 HD12 . LEU A 54 ? -4.65996 34.15135 18.56746 1.000 20.44813 H ? A ? 52 HD12 1
   ATOM 1263 HD13 . LEU A 54 ? -5.20875 32.82564 19.24925 1.000 20.44813 H ? A ? 52 HD13 1
   ATOM 1264 HD21 . LEU A 54 ? -7.39162 33.94725 20.55699 1.000 24.02893 H ? A ? 52 HD21 1
   ATOM 1265 HD22 . LEU A 54 ? -6.47582 33.13445 21.56900 1.000 24.02893 H ? A ? 52 HD22 1
   ATOM 1266 HD23 . LEU A 54 ? -6.85191 34.64676 21.87718 1.000 24.02893 H ? A ? 52 HD23 1
   ATOM 1267 N . PRO A 55 ? -1.70692 35.23452 23.12404 1.000 17.14496 N ? A ? 53 N 1
   ATOM 1268 CA . PRO A 55 ? -0.50221 34.66982 23.76313 1.000 14.10279 C ? A ? 53 CA 1
   ATOM 1269 C . PRO A 55 ? -0.61093 34.56944 25.27452 1.000 17.63689 C ? A ? 53 C 1
   ATOM 1270 O . PRO A 55 ? -0.03400 33.63698 25.83034 1.000 18.32354 O ? A ? 53 O 1
   ATOM 1271 CB . PRO A 55 ? 0.63195 35.60391 23.33306 1.000 18.51485 C ? A ? 53 CB 1
   ATOM 1272 CG . PRO A 55 ? 0.09879 36.39984 22.18526 1.000 18.17689 C ? A ? 53 CG 1
   ATOM 1273 CD . PRO A 55 ? -1.40311 36.38996 22.27610 1.000 18.23378 C ? A ? 53 CD 1
   ATOM 1274 HA . PRO A 55 ? -0.32802 33.79062 23.39224 1.000 17.03490 H ? A ? 53 HA 1
   ATOM 1275 HB2 . PRO A 55 ? 0.87311 36.18511 24.07127 1.000 22.32938 H ? A ? 53 HB2 1
   ATOM 1276 HB3 . PRO A 55 ? 1.40037 35.07902 23.05936 1.000 22.32938 H ? A ? 53 HB3 1
   ATOM 1277 HG2 . PRO A 55 ? 0.43327 37.30843 22.24436 1.000 21.92382 H ? A ? 53 HG2 1
   ATOM 1278 HG3 . PRO A 55 ? 0.38802 35.99329 21.35342 1.000 21.92382 H ? A ? 53 HG3 1
   ATOM 1279 HD2 . PRO A 55 ? -1.72571 37.20804 22.68547 1.000 21.99209 H ? A ? 53 HD2 1
   ATOM 1280 HD3 . PRO A 55 ? -1.79758 36.28112 21.39665 1.000 21.99209 H ? A ? 53 HD3 1
   ATOM 1281 N A TRP A 56 ? -1.32719 35.47457 25.95272 0.372 19.05344 N ? A ? 54 N 1
   ATOM 1282 CA A TRP A 56 ? -1.11968 35.63267 27.39220 0.372 20.59397 C ? A ? 54 CA 1
   ATOM 1283 C A TRP A 56 ? -1.59075 34.41259 28.16721 0.372 22.19447 C ? A ? 54 C 1
   ATOM 1284 O A TRP A 56 ? -0.93446 33.99698 29.12944 0.372 21.51159 O ? A ? 54 O 1
   ATOM 1285 CB A TRP A 56 ? -1.76905 36.92257 27.91806 0.372 21.73838 C ? A ? 54 CB 1
   ATOM 1286 CG A TRP A 56 ? -1.47158 38.02192 26.97835 0.372 19.90707 C ? A ? 54 CG 1
   ATOM 1287 CD1 A TRP A 56 ? -2.36570 38.81512 26.33999 0.372 20.30499 C ? A ? 54 CD1 1
   ATOM 1288 CD2 A TRP A 56 ? -0.17685 38.38122 26.47158 0.372 18.64464 C ? A ? 54 CD2 1
   ATOM 1289 NE1 A TRP A 56 ? -1.71195 39.66874 25.48726 0.372 20.55486 N ? A ? 54 NE1 1
   ATOM 1290 CE2 A TRP A 56 ? -0.36696 39.41523 25.54557 0.372 19.61359 C ? A ? 54 CE2 1
   ATOM 1291 CE3 A TRP A 56 ? 1.12722 37.93556 26.72649 0.372 18.81155 C ? A ? 54 CE3 1
   ATOM 1292 CZ2 A TRP A 56 ? 0.68852 40.01078 24.87594 0.372 19.88280 C ? A ? 54 CZ2 1
   ATOM 1293 CZ3 A TRP A 56 ? 2.17255 38.52300 26.06058 0.372 19.45327 C ? A ? 54 CZ3 1
   ATOM 1294 CH2 A TRP A 56 ? 1.94487 39.54340 25.14107 0.372 19.21128 C ? A ? 54 CH2 1
   ATOM 1295 H A TRP A 56 ? -1.92184 35.99365 25.61133 0.372 22.97568 H ? A ? 54 H 1
   ATOM 1296 HA A TRP A 56 ? -0.16623 35.72460 27.54514 0.372 24.82432 H ? A ? 54 HA 1
   ATOM 1297 HB2 A TRP A 56 ? -2.73044 36.80844 27.97805 0.372 26.19761 H ? A ? 54 HB2 1
   ATOM 1298 HB3 A TRP A 56 ? -1.40622 37.14411 28.78994 0.372 26.19761 H ? A ? 54 HB3 1
   ATOM 1299 HD1 A TRP A 56 ? -3.28720 38.78539 26.46187 0.372 24.47754 H ? A ? 54 HD1 1
   ATOM 1300 HE1 A TRP A 56 ? -2.08636 40.26663 24.99540 0.372 24.77738 H ? A ? 54 HE1 1
   ATOM 1301 HE3 A TRP A 56 ? 1.28144 37.25193 27.33786 0.372 22.68541 H ? A ? 54 HE3 1
   ATOM 1302 HZ2 A TRP A 56 ? 0.54791 40.70174 24.26956 0.372 23.97091 H ? A ? 54 HZ2 1
   ATOM 1303 HZ3 A TRP A 56 ? 3.04206 38.23690 26.22488 0.372 23.45547 H ? A ? 54 HZ3 1
   ATOM 1304 HH2 A TRP A 56 ? 2.66931 39.91796 24.69409 0.372 23.16508 H ? A ? 54 HH2 1
   ATOM 1305 N B TRP A 56 ? -1.36027 35.43867 25.95850 0.628 18.89636 N ? A ? 54 N 1
   ATOM 1306 CA B TRP A 56 ? -1.15852 35.66788 27.38802 0.628 20.57217 C ? A ? 54 CA 1
   ATOM 1307 C B TRP A 56 ? -1.70374 34.53791 28.25694 0.628 22.46900 C ? A ? 54 C 1
   ATOM 1308 O B TRP A 56 ? -1.12447 34.23852 29.31937 0.628 22.06202 O ? A ? 54 O 1
   ATOM 1309 CB B TRP A 56 ? -1.64155 37.08545 27.72341 0.628 21.65812 C ? A ? 54 CB 1
   ATOM 1310 CG B TRP A 56 ? -1.33130 37.99877 26.53275 0.628 20.32007 C ? A ? 54 CG 1
   ATOM 1311 CD1 B TRP A 56 ? -2.23858 38.66831 25.76165 0.628 20.70430 C ? A ? 54 CD1 1
   ATOM 1312 CD2 B TRP A 56 ? -0.03094 38.24132 25.91869 0.628 19.17300 C ? A ? 54 CD2 1
   ATOM 1313 NE1 B TRP A 56 ? -1.59053 39.33757 24.74715 0.628 20.61468 N ? A ? 54 NE1 1
   ATOM 1314 CE2 B TRP A 56 ? -0.24343 39.09497 24.82433 0.628 19.25978 C ? A ? 54 CE2 1
   ATOM 1315 CE3 B TRP A 56 ? 1.28820 37.82965 26.20038 0.628 17.37213 C ? A ? 54 CE3 1
   ATOM 1316 CZ2 B TRP A 56 ? 0.79031 39.54020 24.02108 0.628 18.03127 C ? A ? 54 CZ2 1
   ATOM 1317 CZ3 B TRP A 56 ? 2.33108 38.28352 25.38575 0.628 18.91752 C ? A ? 54 CZ3 1
   ATOM 1318 CH2 B TRP A 56 ? 2.05476 39.11045 24.30329 0.628 18.99633 C ? A ? 54 CH2 1
   ATOM 1319 H B TRP A 56 ? -1.99360 35.90910 25.61617 0.628 22.78719 H ? A ? 54 H 1
   ATOM 1320 HA B TRP A 56 ? -0.21840 35.66402 27.62686 0.628 24.79815 H ? A ? 54 HA 1
   ATOM 1321 HB2 B TRP A 56 ? -2.59875 37.08167 27.88047 0.628 26.10130 H ? A ? 54 HB2 1
   ATOM 1322 HB3 B TRP A 56 ? -1.17791 37.41730 28.50815 0.628 26.10130 H ? A ? 54 HB3 1
   ATOM 1323 HD1 B TRP A 56 ? -3.15805 38.67174 25.90110 0.628 24.95671 H ? A ? 54 HD1 1
   ATOM 1324 HE1 B TRP A 56 ? -1.97238 39.83182 24.15596 0.628 24.84916 H ? A ? 54 HE1 1
   ATOM 1325 HE3 B TRP A 56 ? 1.46244 37.26419 26.91788 0.628 20.95811 H ? A ? 54 HE3 1
   ATOM 1326 HZ2 B TRP A 56 ? 0.62867 40.11602 23.30890 0.628 21.74908 H ? A ? 54 HZ2 1
   ATOM 1327 HZ3 B TRP A 56 ? 3.20774 38.03236 25.56819 0.628 22.81257 H ? A ? 54 HZ3 1
   ATOM 1328 HH2 B TRP A 56 ? 2.75450 39.37985 23.75312 0.628 22.90715 H ? A ? 54 HH2 1
   ATOM 1329 N . ALA A 57 ? -2.72581 33.82789 27.77420 1.000 22.32705 N ? A ? 55 N 1
   ATOM 1330 CA . ALA A 57 ? -3.25664 32.66550 28.47326 1.000 20.37830 C ? A ? 55 CA 1
   ATOM 1331 C . ALA A 57 ? -2.35645 31.43733 28.35708 1.000 22.09084 C ? A ? 55 C 1
   ATOM 1332 O . ALA A 57 ? -2.63232 30.43060 29.02452 1.000 24.99018 O ? A ? 55 O 1
   ATOM 1333 CB . ALA A 57 ? -4.67154 32.36894 27.98115 1.000 21.36440 C ? A ? 55 CB 1
   ATOM 1334 HA . ALA A 57 ? -3.32326 32.86523 29.42014 1.000 24.56552 H ? A ? 55 HA 1
   ATOM 1335 HB1 . ALA A 57 ? -5.01507 31.59541 28.45501 1.000 25.74883 H ? A ? 55 HB1 1
   ATOM 1336 HB2 . ALA A 57 ? -5.23424 33.13980 28.15448 1.000 25.74883 H ? A ? 55 HB2 1
   ATOM 1337 HB3 . ALA A 57 ? -4.64311 32.18762 27.02868 1.000 25.74883 H ? A ? 55 HB3 1
   ATOM 1338 H A ALA A 57 ? -3.20277 34.08741 27.10730 0.372 26.90402 H ? A ? 55 H 1
   ATOM 1339 H B ALA A 57 ? -3.13095 34.00326 27.03616 0.628 26.90402 H ? A ? 55 H 1
   ATOM 1340 N A ALA A 58 ? -1.27693 31.51279 27.57447 0.359 21.94490 N ? A ? 56 N 1
   ATOM 1341 CA A ALA A 58 ? -0.29003 30.45417 27.45958 0.359 21.37284 C ? A ? 56 CA 1
   ATOM 1342 C A ALA A 58 ? 0.95895 30.72501 28.29190 0.359 22.99163 C ? A ? 56 C 1
   ATOM 1343 O A ALA A 58 ? 1.92588 29.95881 28.21939 0.359 21.77911 O ? A ? 56 O 1
   ATOM 1344 CB A ALA A 58 ? 0.04903 30.23625 25.99083 0.359 20.38057 C ? A ? 56 CB 1
   ATOM 1345 H A ALA A 58 ? -1.09370 32.19561 27.08479 0.359 26.44543 H ? A ? 56 H 1
   ATOM 1346 HA A ALA A 58 ? -0.66400 29.62363 27.79312 0.359 25.75896 H ? A ? 56 HA 1
   ATOM 1347 HB1 A ALA A 58 ? 0.78468 29.60729 25.92650 0.359 24.56823 H ? A ? 56 HB1 1
   ATOM 1348 HB2 A ALA A 58 ? -0.73064 29.88098 25.53608 0.359 24.56823 H ? A ? 56 HB2 1
   ATOM 1349 HB3 A ALA A 58 ? 0.30397 31.08492 25.59629 0.359 24.56823 H ? A ? 56 HB3 1
   ATOM 1350 N B ALA A 58 ? -1.31062 31.48897 27.52023 0.641 21.88463 N ? A ? 56 N 1
   ATOM 1351 CA B ALA A 58 ? -0.33918 30.42478 27.35262 0.641 21.27668 C ? A ? 56 CA 1
   ATOM 1352 C B ALA A 58 ? 0.96369 30.70166 28.09401 0.641 22.88224 C ? A ? 56 C 1
   ATOM 1353 O B ALA A 58 ? 1.98406 30.05805 27.81233 0.641 21.33530 O ? A ? 56 O 1
   ATOM 1354 CB B ALA A 58 ? -0.10576 30.19713 25.86935 0.641 20.43887 C ? A ? 56 CB 1
   ATOM 1355 H B ALA A 58 ? -1.14338 32.16747 27.01896 0.641 26.37311 H ? A ? 56 H 1
   ATOM 1356 HA B ALA A 58 ? -0.69077 29.60116 27.72535 0.641 25.64357 H ? A ? 56 HA 1
   ATOM 1357 HB1 B ALA A 58 ? 0.60810 29.54995 25.75767 0.641 24.63820 H ? A ? 56 HB1 1
   ATOM 1358 HB2 B ALA A 58 ? -0.92279 29.86077 25.46906 0.641 24.63820 H ? A ? 56 HB2 1
   ATOM 1359 HB3 B ALA A 58 ? 0.14302 31.03865 25.45600 0.641 24.63820 H ? A ? 56 HB3 1
   ATOM 1360 N A PHE A 59 ? 0.94609 31.77332 29.10829 0.359 22.86561 N ? A ? 57 N 1
   ATOM 1361 CA A PHE A 59 ? 1.96607 31.98117 30.13394 0.359 26.05521 C ? A ? 57 CA 1
   ATOM 1362 C A PHE A 59 ? 1.43960 31.58419 31.50610 0.359 27.37175 C ? A ? 57 C 1
   ATOM 1363 O A PHE A 59 ? 1.75672 32.21244 32.51842 0.359 28.50680 O ? A ? 57 O 1
   ATOM 1364 CB A PHE A 59 ? 2.45462 33.42530 30.13944 0.359 24.31556 C ? A ? 57 CB 1
   ATOM 1365 CG A PHE A 59 ? 3.19190 33.82433 28.89785 0.359 23.40498 C ? A ? 57 CG 1
   ATOM 1366 CD1 A PHE A 59 ? 4.55193 33.57268 28.76608 0.359 24.07364 C ? A ? 57 CD1 1
   ATOM 1367 CD2 A PHE A 59 ? 2.52981 34.46963 27.86631 0.359 22.36639 C ? A ? 57 CD2 1
   ATOM 1368 CE1 A PHE A 59 ? 5.23157 33.95554 27.62504 0.359 24.11163 C ? A ? 57 CE1 1
   ATOM 1369 CE2 A PHE A 59 ? 3.19393 34.85082 26.72523 0.359 20.63573 C ? A ? 57 CE2 1
   ATOM 1370 CZ A PHE A 59 ? 4.55393 34.58936 26.59937 0.359 21.20995 C ? A ? 57 CZ 1
   ATOM 1371 H A PHE A 59 ? 0.34638 32.38938 29.08785 0.359 27.55029 H ? A ? 57 H 1
   ATOM 1372 HA A PHE A 59 ? 2.73520 31.42827 29.92503 0.359 31.37781 H ? A ? 57 HA 1
   ATOM 1373 HB2 A PHE A 59 ? 1.68777 34.01256 30.22868 0.359 29.29022 H ? A ? 57 HB2 1
   ATOM 1374 HB3 A PHE A 59 ? 3.05527 33.54741 30.89124 0.359 29.29022 H ? A ? 57 HB3 1
   ATOM 1375 HD1 A PHE A 59 ? 5.00934 33.14255 29.45213 0.359 28.99992 H ? A ? 57 HD1 1
   ATOM 1376 HD2 A PHE A 59 ? 1.62066 34.64787 27.94735 0.359 26.95122 H ? A ? 57 HD2 1
   ATOM 1377 HE1 A PHE A 59 ? 6.14290 33.78726 27.54711 0.359 29.04551 H ? A ? 57 HE1 1
   ATOM 1378 HE2 A PHE A 59 ? 2.73584 35.28178 26.04015 0.359 24.87443 H ? A ? 57 HE2 1
   ATOM 1379 HZ A PHE A 59 ? 5.00700 34.84024 25.82691 0.359 25.56349 H ? A ? 57 HZ 1
   ATOM 1380 N B PHE A 59 ? 0.93484 31.63726 29.04271 0.641 22.78229 N ? A ? 57 N 1
   ATOM 1381 CA B PHE A 59 ? 1.98625 31.84128 30.03453 0.641 26.08486 C ? A ? 57 CA 1
   ATOM 1382 C B PHE A 59 ? 1.47928 31.51188 31.44065 0.641 27.39406 C ? A ? 57 C 1
   ATOM 1383 O B PHE A 59 ? 1.85877 32.16353 32.41458 0.641 28.60315 O ? A ? 57 O 1
   ATOM 1384 CB B PHE A 59 ? 2.49113 33.28361 30.00088 0.641 24.33741 C ? A ? 57 CB 1
   ATOM 1385 CG B PHE A 59 ? 3.25837 33.65301 28.75085 0.641 23.27774 C ? A ? 57 CG 1
   ATOM 1386 CD1 B PHE A 59 ? 2.59460 34.09246 27.61552 0.641 22.09138 C ? A ? 57 CD1 1
   ATOM 1387 CD2 B PHE A 59 ? 4.64681 33.60408 28.72633 0.641 24.04037 C ? A ? 57 CD2 1
   ATOM 1388 CE1 B PHE A 59 ? 3.28119 34.46724 26.46310 0.641 20.50712 C ? A ? 57 CE1 1
   ATOM 1389 CE2 B PHE A 59 ? 5.34989 33.97687 27.58120 0.641 24.14035 C ? A ? 57 CE2 1
   ATOM 1390 CZ B PHE A 59 ? 4.66205 34.39977 26.43948 0.641 20.83082 C ? A ? 57 CZ 1
   ATOM 1391 H B PHE A 59 ? 0.28431 32.19210 29.13525 0.641 27.45030 H ? A ? 57 H 1
   ATOM 1392 HA B PHE A 59 ? 2.73062 31.25733 29.82053 0.641 31.41339 H ? A ? 57 HA 1
   ATOM 1393 HB2 B PHE A 59 ? 1.72802 33.87924 30.06239 0.641 29.31644 H ? A ? 57 HB2 1
   ATOM 1394 HB3 B PHE A 59 ? 3.08160 33.42165 30.75797 0.641 29.31644 H ? A ? 57 HB3 1
   ATOM 1395 HD1 B PHE A 59 ? 1.66576 34.13819 27.62376 0.641 26.62121 H ? A ? 57 HD1 1
   ATOM 1396 HD2 B PHE A 59 ? 5.11134 33.32019 29.48033 0.641 28.96000 H ? A ? 57 HD2 1
   ATOM 1397 HE1 B PHE A 59 ? 2.81400 34.76091 25.71451 0.641 24.72009 H ? A ? 57 HE1 1
   ATOM 1398 HE2 B PHE A 59 ? 6.27930 33.94412 27.57679 0.641 29.07998 H ? A ? 57 HE2 1
   ATOM 1399 HZ B PHE A 59 ? 5.12965 34.63379 25.67039 0.641 25.10853 H ? A ? 57 HZ 1
   ATOM 1400 N A GLY A 60 ? 0.62326 30.53720 31.56800 0.359 29.08654 N ? A ? 58 N 1
   ATOM 1401 CA A GLY A 60 ? 0.02682 30.11864 32.81232 0.359 31.66238 C ? A ? 58 CA 1
   ATOM 1402 C A GLY A 60 ? 1.04660 29.55990 33.77986 0.359 34.59049 C ? A ? 58 C 1
   ATOM 1403 O A GLY A 60 ? 2.21696 29.35087 33.43794 0.359 34.19782 O ? A ? 58 O 1
   ATOM 1404 H A GLY A 60 ? 0.40222 30.05359 30.89208 0.359 35.01540 H ? A ? 58 H 1
   ATOM 1405 HA2 A GLY A 60 ? -0.40840 30.87757 33.23125 0.359 38.10641 H ? A ? 58 HA2 1
   ATOM 1406 HA3 A GLY A 60 ? -0.63565 29.43234 32.63618 0.359 38.10641 H ? A ? 58 HA3 1
   ATOM 1407 N B GLY A 60 ? 0.61228 30.50213 31.56435 0.641 29.10908 N ? A ? 58 N 1
   ATOM 1408 CA B GLY A 60 ? 0.03381 30.18079 32.83734 0.641 31.67223 C ? A ? 58 CA 1
   ATOM 1409 C B GLY A 60 ? 1.05520 29.58575 33.78901 0.641 34.59889 C ? A ? 58 C 1
   ATOM 1410 O B GLY A 60 ? 2.22570 29.37011 33.43468 0.641 34.20532 O ? A ? 58 O 1
   ATOM 1411 H B GLY A 60 ? 0.35308 29.99789 30.91771 0.641 35.04244 H ? A ? 58 H 1
   ATOM 1412 HA2 B GLY A 60 ? -0.32935 30.98530 33.23957 0.641 38.11822 H ? A ? 58 HA2 1
   ATOM 1413 HA3 B GLY A 60 ? -0.68246 29.53843 32.71387 0.641 38.11822 H ? A ? 58 HA3 1
   ATOM 1414 N . PRO A 61 ? 0.61272 29.29348 35.01098 1.000 36.18808 N ? A ? 59 N 1
   ATOM 1415 CA . PRO A 61 ? 1.53884 28.75022 36.01468 1.000 38.52154 C ? A ? 59 CA 1
   ATOM 1416 C . PRO A 61 ? 2.18761 27.46655 35.52273 1.000 36.19723 C ? A ? 59 C 1
   ATOM 1417 O . PRO A 61 ? 1.51528 26.55723 35.03478 1.000 39.28381 O ? A ? 59 O 1
   ATOM 1418 CB . PRO A 61 ? 0.64444 28.49626 37.23548 1.000 41.35598 C ? A ? 59 CB 1
   ATOM 1419 CG . PRO A 61 ? -0.57747 29.37430 37.02751 1.000 40.59953 C ? A ? 59 CG 1
   ATOM 1420 CD . PRO A 61 ? -0.76382 29.44352 35.52449 1.000 39.48991 C ? A ? 59 CD 1
   ATOM 1421 HA . PRO A 61 ? 2.22027 29.40333 36.23830 1.000 46.33741 H ? A ? 59 HA 1
   ATOM 1422 HB2 . PRO A 61 ? 0.39525 27.55950 37.27136 1.000 49.73873 H ? A ? 59 HB2 1
   ATOM 1423 HB3 . PRO A 61 ? 1.11565 28.74548 38.04587 1.000 49.73873 H ? A ? 59 HB3 1
   ATOM 1424 HG2 . PRO A 61 ? -1.34994 28.97136 37.45393 1.000 48.83099 H ? A ? 59 HG2 1
   ATOM 1425 HG3 . PRO A 61 ? -0.41685 30.25649 37.39743 1.000 48.83099 H ? A ? 59 HG3 1
   ATOM 1426 HD2 . PRO A 61 ? -1.33054 28.72087 35.21223 1.000 47.49944 H ? A ? 59 HD2 1
   ATOM 1427 HD3 . PRO A 61 ? -1.14034 30.29784 35.26128 1.000 47.49944 H ? A ? 59 HD3 1
   ATOM 1428 N . GLY A 62 ? 3.50984 27.40300 35.65333 1.000 37.48046 N ? A ? 60 N 1
   ATOM 1429 CA . GLY A 62 ? 4.25628 26.21298 35.31368 1.000 33.62038 C ? A ? 60 CA 1
   ATOM 1430 C . GLY A 62 ? 4.67553 26.08717 33.86750 1.000 35.72726 C ? A ? 60 C 1
   ATOM 1431 O . GLY A 62 ? 5.39823 25.14032 33.53733 1.000 34.54485 O ? A ? 60 O 1
   ATOM 1432 H . GLY A 62 ? 3.99814 28.04959 35.94157 1.000 45.08810 H ? A ? 60 H 1
   ATOM 1433 HA2 . GLY A 62 ? 5.06196 26.19218 35.85344 1.000 40.45601 H ? A ? 60 HA2 1
   ATOM 1434 HA3 . GLY A 62 ? 3.71261 25.43873 35.52782 1.000 40.45601 H ? A ? 60 HA3 1
   ATOM 1435 N . THR A 63 ? 4.25518 27.00393 32.99146 1.000 33.98960 N ? A ? 61 N 1
   ATOM 1436 CA . THR A 63 ? 4.60033 26.94156 31.57576 1.000 33.70433 C ? A ? 61 CA 1
   ATOM 1437 C . THR A 63 ? 5.94600 27.59082 31.26533 1.000 32.06428 C ? A ? 61 C 1
   ATOM 1438 O . THR A 63 ? 6.15824 28.08163 30.14956 1.000 27.32089 O ? A ? 61 O 1
   ATOM 1439 CB . THR A 63 ? 3.47893 27.54177 30.73070 1.000 31.58747 C ? A ? 61 CB 1
   ATOM 1440 OG1 . THR A 63 ? 3.37349 28.94186 30.99823 1.000 31.41289 O ? A ? 61 OG1 1
   ATOM 1441 CG2 . THR A 63 ? 2.16197 26.85780 31.04087 1.000 31.46626 C ? A ? 61 CG2 1
   ATOM 1442 H . THR A 63 ? 3.76327 27.67800 33.19945 1.000 40.89908 H ? A ? 61 H 1
   ATOM 1443 HA . THR A 63 ? 4.67671 26.00880 31.32079 1.000 40.55675 H ? A ? 61 HA 1
   ATOM 1444 HB . THR A 63 ? 3.67272 27.41315 29.78900 1.000 38.01651 H ? A ? 61 HB 1
   ATOM 1445 HG1 . THR A 63 ? 3.69999 29.11563 31.75242 1.000 37.80701 H ? A ? 61 HG1 1
   ATOM 1446 HG21 . THR A 63 ? 1.48416 27.14008 30.40699 1.000 37.87107 H ? A ? 61 HG21 1
   ATOM 1447 HG22 . THR A 63 ? 2.26622 25.89519 30.98244 1.000 37.87107 H ? A ? 61 HG22 1
   ATOM 1448 HG23 . THR A 63 ? 1.87093 27.08911 31.93680 1.000 37.87107 H ? A ? 61 HG23 1
   ATOM 1449 N A GLU A 64 ? 6.87041 27.57950 32.22093 0.613 32.33687 N ? A ? 62 N 1
   ATOM 1450 CA A GLU A 64 ? 8.20696 28.08654 31.96925 0.613 31.33766 C ? A ? 62 CA 1
   ATOM 1451 C A GLU A 64 ? 8.80772 27.37638 30.76458 0.613 30.90228 C ? A ? 62 C 1
   ATOM 1452 O A GLU A 64 ? 8.60653 26.17581 30.56558 0.613 31.96337 O ? A ? 62 O 1
   ATOM 1453 CB A GLU A 64 ? 9.07968 27.83793 33.19893 0.613 30.22914 C ? A ? 62 CB 1
   ATOM 1454 CG A GLU A 64 ? 8.64188 28.59529 34.44962 0.613 30.63258 C ? A ? 62 CG 1
   ATOM 1455 CD A GLU A 64 ? 7.39396 28.02992 35.09893 0.613 30.34238 C ? A ? 62 CD 1
   ATOM 1456 OE1 A GLU A 64 ? 7.09053 26.83541 34.89595 0.613 32.02210 O ? A ? 62 OE1 1
   ATOM 1457 OE2 A GLU A 64 ? 6.71430 28.77123 35.82529 0.613 29.93679 O ? A ? 62 OE2 1
   ATOM 1458 H A GLU A 64 ? 6.74664 27.28423 33.01911 0.613 38.91580 H ? A ? 62 H 1
   ATOM 1459 HA A GLU A 64 ? 8.17782 29.03939 31.79001 0.613 37.71675 H ? A ? 62 HA 1
   ATOM 1460 HB2 A GLU A 64 ? 9.05735 26.89081 33.40717 0.613 36.38652 H ? A ? 62 HB2 1
   ATOM 1461 HB3 A GLU A 64 ? 9.98750 28.11119 32.99375 0.613 36.38652 H ? A ? 62 HB3 1
   ATOM 1462 HG2 A GLU A 64 ? 9.35771 28.55940 35.10322 0.613 36.87065 H ? A ? 62 HG2 1
   ATOM 1463 HG3 A GLU A 64 ? 8.45851 29.51683 34.20869 0.613 36.87065 H ? A ? 62 HG3 1
   ATOM 1464 N B GLU A 64 ? 6.87897 27.58353 32.21641 0.387 32.32176 N ? A ? 62 N 1
   ATOM 1465 CA B GLU A 64 ? 8.19948 28.13787 31.96221 0.387 31.35175 C ? A ? 62 CA 1
   ATOM 1466 C B GLU A 64 ? 8.88585 27.37715 30.83345 0.387 30.87946 C ? A ? 62 C 1
   ATOM 1467 O B GLU A 64 ? 8.82482 26.14869 30.75684 0.387 31.86506 O ? A ? 62 O 1
   ATOM 1468 CB B GLU A 64 ? 9.04204 28.06442 33.23867 0.387 30.33529 C ? A ? 62 CB 1
   ATOM 1469 CG B GLU A 64 ? 8.84129 29.23787 34.20594 0.387 30.24483 C ? A ? 62 CG 1
   ATOM 1470 CD B GLU A 64 ? 7.69634 29.02156 35.19595 0.387 30.52546 C ? A ? 62 CD 1
   ATOM 1471 OE1 B GLU A 64 ? 6.89571 28.07777 35.01262 0.387 30.35236 O ? A ? 62 OE1 1
   ATOM 1472 OE2 B GLU A 64 ? 7.60123 29.79588 36.17429 0.387 31.36360 O ? A ? 62 OE2 1
   ATOM 1473 H B GLU A 64 ? 6.77084 27.26608 33.00833 0.387 38.89766 H ? A ? 62 H 1
   ATOM 1474 HA B GLU A 64 ? 8.12174 29.06766 31.69699 0.387 37.73365 H ? A ? 62 HA 1
   ATOM 1475 HB2 B GLU A 64 ? 8.81136 27.25096 33.71402 0.387 36.51390 H ? A ? 62 HB2 1
   ATOM 1476 HB3 B GLU A 64 ? 9.97923 28.04837 32.98902 0.387 36.51390 H ? A ? 62 HB3 1
   ATOM 1477 HG2 B GLU A 64 ? 9.65573 29.36551 34.71711 0.387 36.40535 H ? A ? 62 HG2 1
   ATOM 1478 HG3 B GLU A 64 ? 8.64311 30.03672 33.69267 0.387 36.40535 H ? A ? 62 HG3 1
   ATOM 1479 N . GLY A 65 ? 9.52363 28.11863 29.94413 1.000 30.44414 N ? A ? 63 N 1
   ATOM 1480 CA . GLY A 65 ? 10.16018 27.52857 28.78757 1.000 27.59414 C ? A ? 63 CA 1
   ATOM 1481 C . GLY A 65 ? 10.31686 28.55508 27.68682 1.000 29.29196 C ? A ? 63 C 1
   ATOM 1482 O . GLY A 65 ? 10.00766 29.72842 27.86309 1.000 27.68466 O ? A ? 63 O 1
   ATOM 1483 HA2 . GLY A 65 ? 11.03750 27.19345 29.03025 1.000 33.22452 H ? A ? 63 HA2 1
   ATOM 1484 HA3 . GLY A 65 ? 9.62196 26.79311 28.45542 1.000 33.22452 H ? A ? 63 HA3 1
   ATOM 1485 H A GLY A 65 ? 9.65513 28.96359 30.03554 0.613 36.64452 H ? A ? 63 H 1
   ATOM 1486 H B GLY A 65 ? 9.60165 28.97386 29.98995 0.387 36.64452 H ? A ? 63 H 1
   ATOM 1487 N . GLY A 66 ? 10.76529 28.07397 26.53461 1.000 25.38617 N ? A ? 64 N 1
   ATOM 1488 CA . GLY A 66 ? 10.98925 28.95494 25.40348 1.000 29.56789 C ? A ? 64 CA 1
   ATOM 1489 C . GLY A 66 ? 11.96370 30.06469 25.74586 1.000 31.79586 C ? A ? 64 C 1
   ATOM 1490 O . GLY A 66 ? 12.88001 29.90270 26.56354 1.000 33.14284 O ? A ? 64 O 1
   ATOM 1491 H . GLY A 66 ? 10.94598 27.24672 26.38424 1.000 30.57496 H ? A ? 64 H 1
   ATOM 1492 HA2 . GLY A 66 ? 11.35010 28.44492 24.66148 1.000 35.59302 H ? A ? 64 HA2 1
   ATOM 1493 HA3 . GLY A 66 ? 10.14822 29.35500 25.13232 1.000 35.59302 H ? A ? 64 HA3 1
   ATOM 1494 N A ASP A 67 ? 11.80474 31.19607 25.05704 0.333 30.40898 N ? A ? 65 N 1
   ATOM 1495 CA A ASP A 67 ? 12.62963 32.37387 25.28070 0.333 31.54276 C ? A ? 65 CA 1
   ATOM 1496 C A ASP A 67 ? 11.99835 33.32302 26.28439 0.333 31.72479 C ? A ? 65 C 1
   ATOM 1497 O A ASP A 67 ? 12.32825 34.51372 26.29788 0.333 31.33483 O ? A ? 65 O 1
   ATOM 1498 CB A ASP A 67 ? 12.91174 33.08626 23.95266 0.333 32.36798 C ? A ? 65 CB 1
   ATOM 1499 CG A ASP A 67 ? 13.69124 32.21747 22.97613 0.333 35.39598 C ? A ? 65 CG 1
   ATOM 1500 OD1 A ASP A 67 ? 14.64126 31.52864 23.40906 0.333 36.61903 O ? A ? 65 OD1 1
   ATOM 1501 OD2 A ASP A 67 ? 13.34841 32.21255 21.77450 0.333 36.32609 O ? A ? 65 OD2 1
   ATOM 1502 H A ASP A 67 ? 11.21217 31.30353 24.44310 0.333 36.60233 H ? A ? 65 H 1
   ATOM 1503 HA A ASP A 67 ? 13.48790 32.09591 25.63709 0.333 37.96286 H ? A ? 65 HA 1
   ATOM 1504 HB2 A ASP A 67 ? 12.06885 33.32466 23.53600 0.333 38.95312 H ? A ? 65 HB2 1
   ATOM 1505 HB3 A ASP A 67 ? 13.43353 33.88524 24.12660 0.333 38.95312 H ? A ? 65 HB3 1
   ATOM 1506 N B ASP A 67 ? 11.73104 31.23721 25.15289 0.667 30.33986 N ? A ? 65 N 1
   ATOM 1507 CA B ASP A 67 ? 12.53245 32.42086 25.44392 0.667 31.43654 C ? A ? 65 CA 1
   ATOM 1508 C B ASP A 67 ? 11.89367 33.31491 26.50112 0.667 31.73282 C ? A ? 65 C 1
   ATOM 1509 O B ASP A 67 ? 12.27478 34.48548 26.62914 0.667 30.90193 O ? A ? 65 O 1
   ATOM 1510 CB B ASP A 67 ? 12.80238 33.22508 24.17120 0.667 32.26234 C ? A ? 65 CB 1
   ATOM 1511 CG B ASP A 67 ? 13.55070 32.43023 23.12260 0.667 35.31997 C ? A ? 65 CG 1
   ATOM 1512 OD1 B ASP A 67 ? 14.59016 31.81441 23.45603 0.667 36.93667 O ? A ? 65 OD1 1
   ATOM 1513 OD2 B ASP A 67 ? 13.09096 32.40357 21.96062 0.667 36.29401 O ? A ? 65 OD2 1
   ATOM 1514 H B ASP A 67 ? 11.10888 31.37008 24.57421 0.667 36.51938 H ? A ? 65 H 1
   ATOM 1515 HA B ASP A 67 ? 13.39040 32.12048 25.78243 0.667 37.83540 H ? A ? 65 HA 1
   ATOM 1516 HB2 B ASP A 67 ? 11.95594 33.50410 23.78833 0.667 38.82636 H ? A ? 65 HB2 1
   ATOM 1517 HB3 B ASP A 67 ? 13.33708 34.00249 24.39618 0.667 38.82636 H ? A ? 65 HB3 1
   ATOM 1518 N A ALA A 68 ? 11.08165 32.82378 27.10943 0.333 29.52791 N ? A ? 66 N 1
   ATOM 1519 CA A ALA A 68 ? 10.45430 33.63314 28.14316 0.333 30.77788 C ? A ? 66 CA 1
   ATOM 1520 C A ALA A 68 ? 11.33909 33.68710 29.38374 0.333 32.43648 C ? A ? 66 C 1
   ATOM 1521 O A ALA A 68 ? 11.82353 32.65598 29.85830 0.333 33.15392 O ? A ? 66 O 1
   ATOM 1522 CB A ALA A 68 ? 9.08786 33.05375 28.50522 0.333 29.75606 C ? A ? 66 CB 1
   ATOM 1523 H A ALA A 68 ? 10.80426 32.01000 27.08897 0.333 35.54504 H ? A ? 66 H 1
   ATOM 1524 HA A ALA A 68 ? 10.33421 34.53742 27.81338 0.333 37.04500 H ? A ? 66 HA 1
   ATOM 1525 HB1 A ALA A 68 ? 8.71110 33.56693 29.23706 0.333 35.81882 H ? A ? 66 HB1 1
   ATOM 1526 HB2 A ALA A 68 ? 8.50686 33.10706 27.73031 0.333 35.81882 H ? A ? 66 HB2 1
   ATOM 1527 HB3 A ALA A 68 ? 9.19825 32.12795 28.77282 0.333 35.81882 H ? A ? 66 HB3 1
   ATOM 1528 N B ALA A 68 ? 10.92979 32.79129 27.25593 0.667 29.14715 N ? A ? 66 N 1
   ATOM 1529 CA B ALA A 68 ? 10.27347 33.55594 28.30883 0.667 30.71587 C ? A ? 66 CA 1
   ATOM 1530 C B ALA A 68 ? 11.19884 33.65897 29.51652 0.667 32.49768 C ? A ? 66 C 1
   ATOM 1531 O B ALA A 68 ? 11.59317 32.63963 30.09352 0.667 33.30674 O ? A ? 66 O 1
   ATOM 1532 CB B ALA A 68 ? 8.94685 32.89903 28.69717 0.667 29.53560 C ? A ? 66 CB 1
   ATOM 1533 H B ALA A 68 ? 10.63626 31.98692 27.17579 0.667 35.08813 H ? A ? 66 H 1
   ATOM 1534 HA B ALA A 68 ? 10.08607 34.45183 27.98765 0.667 36.97059 H ? A ? 66 HA 1
   ATOM 1535 HB1 B ALA A 68 ? 8.55791 33.38755 29.43944 0.667 35.55427 H ? A ? 66 HB1 1
   ATOM 1536 HB2 B ALA A 68 ? 8.34743 32.92318 27.93493 0.667 35.55427 H ? A ? 66 HB2 1
   ATOM 1537 HB3 B ALA A 68 ? 9.11398 31.97969 28.95754 0.667 35.55427 H ? A ? 66 HB3 1
   ATOM 1538 N . ARG A 69 ? 11.52577 34.88196 29.91851 1.000 33.16306 N ? A ? 67 N 1
   ATOM 1539 CA . ARG A 69 ? 12.35636 35.04205 31.09870 1.000 34.99176 C ? A ? 67 CA 1
   ATOM 1540 C . ARG A 69 ? 11.55528 34.65810 32.33639 1.000 33.53065 C ? A ? 67 C 1
   ATOM 1541 O . ARG A 69 ? 10.36160 34.96557 32.42089 1.000 34.16463 O ? A ? 67 O 1
   ATOM 1542 HA . ARG A 69 ? 13.13618 34.46893 31.03312 1.000 42.10166 H ? A ? 67 HA 1
   ATOM 1543 CB A ARG A 69 ? 12.83920 36.48207 31.22896 0.672 35.33618 C ? A ? 67 CB 1
   ATOM 1544 CG A ARG A 69 ? 13.92780 36.86196 30.23173 0.672 36.75149 C ? A ? 67 CG 1
   ATOM 1545 CD A ARG A 69 ? 15.16813 37.38439 30.95940 0.672 40.88087 C ? A ? 67 CD 1
   ATOM 1546 NE A ARG A 69 ? 16.29983 37.62890 30.07393 0.672 44.82424 N ? A ? 67 NE 1
   ATOM 1547 CZ A ARG A 69 ? 17.37728 36.86378 30.05510 0.672 44.10140 C ? A ? 67 CZ 1
   ATOM 1548 NH1 A ARG A 69 ? 17.49399 35.82842 30.86825 0.672 39.27564 N ? A ? 67 NH1 1
   ATOM 1549 NH2 A ARG A 69 ? 18.34887 37.13256 29.19233 0.672 43.81161 N ? A ? 67 NH2 1
   ATOM 1550 H A ARG A 69 ? 11.18497 35.61274 29.61949 0.333 39.90723 H ? A ? 67 H 1
   ATOM 1551 HB2 A ARG A 69 ? 12.08648 37.07678 31.08536 0.672 42.51497 H ? A ? 67 HB2 1
   ATOM 1552 HB3 A ARG A 69 ? 13.19794 36.61042 32.12100 0.672 42.51497 H ? A ? 67 HB3 1
   ATOM 1553 HG2 A ARG A 69 ? 14.18000 36.08158 29.71374 0.672 44.21334 H ? A ? 67 HG2 1
   ATOM 1554 HG3 A ARG A 69 ? 13.59932 37.55914 29.64272 0.672 44.21334 H ? A ? 67 HG3 1
   ATOM 1555 HD2 A ARG A 69 ? 14.94631 38.22181 31.39577 0.672 49.16860 H ? A ? 67 HD2 1
   ATOM 1556 HD3 A ARG A 69 ? 15.44379 36.72919 31.61942 0.672 49.16860 H ? A ? 67 HD3 1
   ATOM 1557 HE A ARG A 69 ? 16.26483 38.30169 29.53939 0.672 53.90064 H ? A ? 67 HE 1
   ATOM 1558 HH11 A ARG A 69 ? 16.86244 35.64304 31.42177 0.672 47.24232 H ? A ? 67 HH11 1
   ATOM 1559 HH12 A ARG A 69 ? 18.20148 35.34009 30.84384 0.672 47.24232 H ? A ? 67 HH12 1
   ATOM 1560 HH21 A ARG A 69 ? 18.27335 37.79851 28.65344 0.672 52.68549 H ? A ? 67 HH21 1
   ATOM 1561 HH22 A ARG A 69 ? 19.05411 36.64080 29.17202 0.672 52.68549 H ? A ? 67 HH22 1
   ATOM 1562 CB B ARG A 69 ? 12.81723 36.49045 31.23208 0.328 35.33805 C ? A ? 67 CB 1
   ATOM 1563 CG B ARG A 69 ? 13.86417 36.88967 30.20472 0.328 36.78676 C ? A ? 67 CG 1
   ATOM 1564 CD B ARG A 69 ? 14.35568 38.22377 30.54526 0.328 38.07710 C ? A ? 67 CD 1
   ATOM 1565 NE B ARG A 69 ? 15.67702 38.60685 30.06942 0.328 41.36549 N ? A ? 67 NE 1
   ATOM 1566 CZ B ARG A 69 ? 15.86779 39.66555 29.29640 0.328 40.77668 C ? A ? 67 CZ 1
   ATOM 1567 NH1 B ARG A 69 ? 14.85876 40.44502 28.93974 0.328 38.19258 N ? A ? 67 NH1 1
   ATOM 1568 NH2 B ARG A 69 ? 17.08882 39.93743 28.84815 0.328 39.99818 N ? A ? 67 NH2 1
   ATOM 1569 H B ARG A 69 ? 11.28549 35.61333 29.53517 0.667 39.90723 H ? A ? 67 H 1
   ATOM 1570 HB2 B ARG A 69 ? 12.05107 37.07435 31.11823 0.328 42.51722 H ? A ? 67 HB2 1
   ATOM 1571 HB3 B ARG A 69 ? 13.20228 36.61640 32.11343 0.328 42.51722 H ? A ? 67 HB3 1
   ATOM 1572 HG2 B ARG A 69 ? 14.60475 36.26348 30.22268 0.328 44.25566 H ? A ? 67 HG2 1
   ATOM 1573 HG3 B ARG A 69 ? 13.47020 36.91224 29.31862 0.328 44.25566 H ? A ? 67 HG3 1
   ATOM 1574 HD2 B ARG A 69 ? 13.73159 38.87099 30.18122 0.328 45.80407 H ? A ? 67 HD2 1
   ATOM 1575 HD3 B ARG A 69 ? 14.37866 38.29277 31.51253 0.328 45.80407 H ? A ? 67 HD3 1
   ATOM 1576 HE B ARG A 69 ? 16.35571 38.13046 30.29752 0.328 49.75014 H ? A ? 67 HE 1
   ATOM 1577 HH11 B ARG A 69 ? 14.06196 40.26783 29.21051 0.328 45.94264 H ? A ? 67 HH11 1
   ATOM 1578 HH12 B ARG A 69 ? 15.00015 41.12852 28.43731 0.328 45.94264 H ? A ? 67 HH12 1
   ATOM 1579 HH21 B ARG A 69 ? 17.74817 39.42766 29.06030 0.328 48.10937 H ? A ? 67 HH21 1
   ATOM 1580 HH22 B ARG A 69 ? 17.21972 40.62315 28.34590 0.328 48.10937 H ? A ? 67 HH22 1
   ATOM 1581 N . PRO A 70 ? 12.18252 34.00766 33.32070 1.000 35.07207 N ? A ? 68 N 1
   ATOM 1582 CA . PRO A 70 ? 11.42481 33.59122 34.51417 1.000 31.85928 C ? A ? 68 CA 1
   ATOM 1583 C . PRO A 70 ? 10.75522 34.74270 35.23005 1.000 36.57338 C ? A ? 68 C 1
   ATOM 1584 O . PRO A 70 ? 9.80251 34.51861 35.98188 1.000 33.34835 O ? A ? 68 O 1
   ATOM 1585 CB . PRO A 70 ? 12.47870 32.90490 35.40782 1.000 34.28178 C ? A ? 68 CB 1
   ATOM 1586 CG . PRO A 70 ? 13.69118 32.70963 34.53921 1.000 37.08019 C ? A ? 68 CG 1
   ATOM 1587 CD . PRO A 70 ? 13.62641 33.73794 33.43641 1.000 36.52616 C ? A ? 68 CD 1
   ATOM 1588 HA . PRO A 70 ? 10.75808 32.93247 34.26430 1.000 38.34268 H ? A ? 68 HA 1
   ATOM 1589 HB2 . PRO A 70 ? 12.68612 33.47500 36.16470 1.000 41.24969 H ? A ? 68 HB2 1
   ATOM 1590 HB3 . PRO A 70 ? 12.13745 32.05180 35.71874 1.000 41.24969 H ? A ? 68 HB3 1
   ATOM 1591 HG2 . PRO A 70 ? 14.49156 32.83602 35.07242 1.000 44.60778 H ? A ? 68 HG2 1
   ATOM 1592 HG3 . PRO A 70 ? 13.67842 31.81392 34.16714 1.000 44.60778 H ? A ? 68 HG3 1
   ATOM 1593 HD2 . PRO A 70 ? 14.11037 34.54157 33.68309 1.000 43.94295 H ? A ? 68 HD2 1
   ATOM 1594 HD3 . PRO A 70 ? 13.97950 33.37941 32.60714 1.000 43.94295 H ? A ? 68 HD3 1
   ATOM 1595 N . GLU A 71 ? 11.24064 35.96923 35.05069 1.000 35.39820 N ? A ? 69 N 1
   ATOM 1596 CA . GLU A 71 ? 10.60176 37.10788 35.69038 1.000 39.04532 C ? A ? 69 CA 1
   ATOM 1597 C . GLU A 71 ? 9.12164 37.23246 35.32867 1.000 36.09435 C ? A ? 69 C 1
   ATOM 1598 O . GLU A 71 ? 8.37668 37.87673 36.07113 1.000 39.55026 O ? A ? 69 O 1
   ATOM 1599 CB . GLU A 71 ? 11.38934 38.37517 35.35707 1.000 38.14047 C ? A ? 69 CB 1
   ATOM 1600 CG . GLU A 71 ? 12.72252 38.48228 36.11889 1.000 41.87480 C ? A ? 69 CG 1
   ATOM 1601 CD . GLU A 71 ? 13.70057 37.35469 35.81343 1.000 43.10920 C ? A ? 69 CD 1
   ATOM 1602 OE1 . GLU A 71 ? 13.79395 36.92912 34.64165 1.000 42.46297 O ? A ? 69 OE1 1
   ATOM 1603 OE2 . GLU A 71 ? 14.38252 36.89565 36.75526 1.000 54.87628 O ? A ? 69 OE2 1
   ATOM 1604 H . GLU A 71 ? 11.92750 36.16306 34.57085 1.000 42.58939 H ? A ? 69 H 1
   ATOM 1605 HA . GLU A 71 ? 10.62561 37.00163 36.65425 1.000 46.96594 H ? A ? 69 HA 1
   ATOM 1606 HB2 . GLU A 71 ? 11.58748 38.38045 34.40754 1.000 45.88012 H ? A ? 69 HB2 1
   ATOM 1607 HB3 . GLU A 71 ? 10.85122 39.14848 35.58799 1.000 45.88012 H ? A ? 69 HB3 1
   ATOM 1608 HG2 . GLU A 71 ? 13.15204 39.31837 35.87937 1.000 50.36131 H ? A ? 69 HG2 1
   ATOM 1609 HG3 . GLU A 71 ? 12.53956 38.46423 37.07131 1.000 50.36131 H ? A ? 69 HG3 1
   ATOM 1610 N A ILE A 72 ? 8.67672 36.62442 34.22667 0.191 35.97576 N ? A ? 70 N 1
   ATOM 1611 CA A ILE A 72 ? 7.26121 36.69489 33.86943 0.191 34.99574 C ? A ? 70 CA 1
   ATOM 1612 C A ILE A 72 ? 6.39709 36.16943 35.00674 0.191 35.97495 C ? A ? 70 C 1
   ATOM 1613 O A ILE A 72 ? 5.29628 36.67476 35.25758 0.191 37.12391 O ? A ? 70 O 1
   ATOM 1614 CB A ILE A 72 ? 6.99683 35.94172 32.55182 0.191 32.86362 C ? A ? 70 CB 1
   ATOM 1615 CG1 A ILE A 72 ? 7.72209 36.64259 31.40453 0.191 32.37630 C ? A ? 70 CG1 1
   ATOM 1616 CG2 A ILE A 72 ? 5.50156 35.84617 32.28756 0.191 32.11028 C ? A ? 70 CG2 1
   ATOM 1617 CD1 A ILE A 72 ? 7.59936 35.95356 30.07067 0.191 30.27950 C ? A ? 70 CD1 1
   ATOM 1618 H A ILE A 72 ? 9.16457 36.17383 33.68027 0.191 43.28247 H ? A ? 70 H 1
   ATOM 1619 HA A ILE A 72 ? 7.02832 37.62566 33.72687 0.191 42.10644 H ? A ? 70 HA 1
   ATOM 1620 HB A ILE A 72 ? 7.34238 35.03833 32.62515 0.191 39.54789 H ? A ? 70 HB 1
   ATOM 1621 HG12 A ILE A 72 ? 7.35544 37.53534 31.30729 0.191 38.96311 H ? A ? 70 HG12 1
   ATOM 1622 HG13 A ILE A 72 ? 8.66613 36.69348 31.62157 0.191 38.96311 H ? A ? 70 HG13 1
   ATOM 1623 HG21 A ILE A 72 ? 5.36044 35.55578 31.37287 0.191 38.64389 H ? A ? 70 HG21 1
   ATOM 1624 HG22 A ILE A 72 ? 5.11263 35.20433 32.90211 0.191 38.64389 H ? A ? 70 HG22 1
   ATOM 1625 HG23 A ILE A 72 ? 5.10050 36.71891 32.42314 0.191 38.64389 H ? A ? 70 HG23 1
   ATOM 1626 HD11 A ILE A 72 ? 8.42323 36.07791 29.57399 0.191 36.44695 H ? A ? 70 HD11 1
   ATOM 1627 HD12 A ILE A 72 ? 7.44095 35.00785 30.21713 0.191 36.44695 H ? A ? 70 HD12 1
   ATOM 1628 HD13 A ILE A 72 ? 6.85672 36.34154 29.58194 0.191 36.44695 H ? A ? 70 HD13 1
   ATOM 1629 N B ILE A 72 ? 8.67824 36.62109 34.22309 0.809 35.99195 N ? A ? 70 N 1
   ATOM 1630 CA B ILE A 72 ? 7.26277 36.67525 33.85336 0.809 34.96788 C ? A ? 70 CA 1
   ATOM 1631 C B ILE A 72 ? 6.39329 36.15708 34.98950 0.809 35.93415 C ? A ? 70 C 1
   ATOM 1632 O B ILE A 72 ? 5.28799 36.65741 35.22651 0.809 37.12988 O ? A ? 70 O 1
   ATOM 1633 CB B ILE A 72 ? 7.01260 35.90402 32.54097 0.809 32.78861 C ? A ? 70 CB 1
   ATOM 1634 CG1 B ILE A 72 ? 7.62358 36.67380 31.37207 0.809 32.39589 C ? A ? 70 CG1 1
   ATOM 1635 CG2 B ILE A 72 ? 5.51184 35.66500 32.33921 0.809 32.10408 C ? A ? 70 CG2 1
   ATOM 1636 CD1 B ILE A 72 ? 7.75048 35.90217 30.09474 0.809 30.22422 C ? A ? 70 CD1 1
   ATOM 1637 H B ILE A 72 ? 9.17128 36.17447 33.67807 0.809 43.30189 H ? A ? 70 H 1
   ATOM 1638 HA B ILE A 72 ? 7.02497 37.60270 33.69782 0.809 42.07301 H ? A ? 70 HA 1
   ATOM 1639 HB B ILE A 72 ? 7.44167 35.03551 32.59072 0.809 39.45789 H ? A ? 70 HB 1
   ATOM 1640 HG12 B ILE A 72 ? 7.06597 37.44624 31.18953 0.809 38.98662 H ? A ? 70 HG12 1
   ATOM 1641 HG13 B ILE A 72 ? 8.51452 36.96055 31.62684 0.809 38.98662 H ? A ? 70 HG13 1
   ATOM 1642 HG21 B ILE A 72 ? 5.35347 35.41324 31.41594 0.809 38.63645 H ? A ? 70 HG21 1
   ATOM 1643 HG22 B ILE A 72 ? 5.22326 34.95231 32.93057 0.809 38.63645 H ? A ? 70 HG22 1
   ATOM 1644 HG23 B ILE A 72 ? 5.03131 36.48173 32.54645 0.809 38.63645 H ? A ? 70 HG23 1
   ATOM 1645 HD11 B ILE A 72 ? 8.67917 35.90552 29.81470 0.809 36.38061 H ? A ? 70 HD11 1
   ATOM 1646 HD12 B ILE A 72 ? 7.45370 34.99105 30.24538 0.809 36.38061 H ? A ? 70 HD12 1
   ATOM 1647 HD13 B ILE A 72 ? 7.19885 36.32181 29.41614 0.809 36.38061 H ? A ? 70 HD13 1
   ATOM 1648 N . TRP A 73 ? 6.88047 35.15376 35.71586 1.000 36.23032 N ? A ? 71 N 1
   ATOM 1649 CA . TRP A 73 ? 6.09894 34.52344 36.76530 1.000 37.15283 C ? A ? 71 CA 1
   ATOM 1650 C . TRP A 73 ? 6.45007 35.02651 38.15692 1.000 35.47447 C ? A ? 71 C 1
   ATOM 1651 O . TRP A 73 ? 5.59882 34.97312 39.05040 1.000 39.89982 O ? A ? 71 O 1
   ATOM 1652 CB . TRP A 73 ? 6.28361 33.00675 36.68686 1.000 35.25675 C ? A ? 71 CB 1
   ATOM 1653 CG . TRP A 73 ? 5.72277 32.40777 35.41197 1.000 33.59266 C ? A ? 71 CG 1
   ATOM 1654 CD1 . TRP A 73 ? 4.46361 31.90562 35.22778 1.000 35.65683 C ? A ? 71 CD1 1
   ATOM 1655 CD2 . TRP A 73 ? 6.40373 32.23560 34.16073 1.000 32.80614 C ? A ? 71 CD2 1
   ATOM 1656 NE1 . TRP A 73 ? 4.32512 31.42300 33.94107 1.000 33.84929 N ? A ? 71 NE1 1
   ATOM 1657 CE2 . TRP A 73 ? 5.49335 31.63058 33.26193 1.000 31.69955 C ? A ? 71 CE2 1
   ATOM 1658 CE3 . TRP A 73 ? 7.68885 32.53733 33.71021 1.000 31.50965 C ? A ? 71 CE3 1
   ATOM 1659 CZ2 . TRP A 73 ? 5.84522 31.31489 31.94604 1.000 31.54593 C ? A ? 71 CZ2 1
   ATOM 1660 CZ3 . TRP A 73 ? 8.02455 32.24412 32.40566 1.000 32.90218 C ? A ? 71 CZ3 1
   ATOM 1661 CH2 . TRP A 73 ? 7.11110 31.63282 31.53920 1.000 31.86571 C ? A ? 71 CH2 1
   ATOM 1662 HA . TRP A 73 ? 5.15668 34.71216 36.63331 1.000 44.69495 H ? A ? 71 HA 1
   ATOM 1663 HB2 . TRP A 73 ? 7.23123 32.80257 36.72195 1.000 42.41965 H ? A ? 71 HB2 1
   ATOM 1664 HB3 . TRP A 73 ? 5.82743 32.59465 37.43718 1.000 42.41965 H ? A ? 71 HB3 1
   ATOM 1665 HD1 . TRP A 73 ? 3.79672 31.89129 35.87582 1.000 42.89975 H ? A ? 71 HD1 1
   ATOM 1666 HE1 . TRP A 73 ? 3.61893 31.05226 33.61945 1.000 40.73071 H ? A ? 71 HE1 1
   ATOM 1667 HE3 . TRP A 73 ? 8.30939 32.93007 34.28081 1.000 37.92313 H ? A ? 71 HE3 1
   ATOM 1668 HZ2 . TRP A 73 ? 5.24148 30.90451 31.36985 1.000 37.96667 H ? A ? 71 HZ2 1
   ATOM 1669 HZ3 . TRP A 73 ? 8.87500 32.45678 32.09515 1.000 39.59416 H ? A ? 71 HZ3 1
   ATOM 1670 HH2 . TRP A 73 ? 7.37094 31.43864 30.66761 1.000 38.35040 H ? A ? 71 HH2 1
   ATOM 1671 H A TRP A 73 ? 7.66214 34.81273 35.60500 0.191 43.58793 H ? A ? 71 H 1
   ATOM 1672 H B TRP A 73 ? 7.66710 34.82082 35.61608 0.809 43.58793 H ? A ? 71 H 1
   ATOM 1673 N . SER A 74 ? 7.66713 35.52728 38.35882 1.000 39.83849 N ? A ? 72 N 1
   ATOM 1674 CA . SER A 74 ? 8.00074 36.13917 39.63788 1.000 40.54446 C ? A ? 72 CA 1
   ATOM 1675 C . SER A 74 ? 7.41914 37.54420 39.76146 1.000 44.12683 C ? A ? 72 C 1
   ATOM 1676 O . SER A 74 ? 7.16016 38.00227 40.88174 1.000 42.88006 O ? A ? 72 O 1
   ATOM 1677 CB . SER A 74 ? 9.51653 36.20929 39.82178 1.000 38.47843 C ? A ? 72 CB 1
   ATOM 1678 OG . SER A 74 ? 10.19316 35.07306 39.29650 1.000 36.19367 O ? A ? 72 OG 1
   ATOM 1679 H . SER A 74 ? 8.30454 35.52462 37.78150 1.000 47.91774 H ? A ? 72 H 1
   ATOM 1680 HA . SER A 74 ? 7.63536 35.58315 40.34374 1.000 48.76490 H ? A ? 72 HA 1
   ATOM 1681 HB2 . SER A 74 ? 9.84494 37.00014 39.36615 1.000 46.28567 H ? A ? 72 HB2 1
   ATOM 1682 HB3 . SER A 74 ? 9.70833 36.26944 40.77073 1.000 46.28567 H ? A ? 72 HB3 1
   ATOM 1683 HG . SER A 74 ? 11.02284 35.16323 39.39191 1.000 43.54396 H ? A ? 72 HG 1
   ATOM 1684 N . ASP A 75 ? 7.22024 38.23736 38.63083 1.000 44.85229 N ? A ? 73 N 1
   ATOM 1685 CA . ASP A 75 ? 6.65029 39.58298 38.60807 1.000 47.11751 C ? A ? 73 CA 1
   ATOM 1686 C . ASP A 75 ? 5.35510 39.60052 37.79912 1.000 46.85891 C ? A ? 73 C 1
   ATOM 1687 O . ASP A 75 ? 5.21292 40.37961 36.84827 1.000 47.30319 O ? A ? 73 O 1
   ATOM 1688 CB . ASP A 75 ? 7.63543 40.58405 37.99680 1.000 48.68357 C ? A ? 73 CB 1
   ATOM 1689 CG . ASP A 75 ? 9.03907 40.44742 38.55469 1.000 53.62050 C ? A ? 73 CG 1
   ATOM 1690 OD1 . ASP A 75 ? 9.18896 39.98124 39.70510 1.000 70.06381 O ? A ? 73 OD1 1
   ATOM 1691 OD2 . ASP A 75 ? 9.99689 40.81276 37.83726 1.000 53.50564 O ? A ? 73 OD2 1
   ATOM 1692 H . ASP A 75 ? 7.41317 37.93935 37.84752 1.000 53.93430 H ? A ? 73 H 1
   ATOM 1693 HA . ASP A 75 ? 6.46287 39.85235 39.52087 1.000 56.65256 H ? A ? 73 HA 1
   ATOM 1694 HB2 . ASP A 75 ? 7.67883 40.43898 37.03870 1.000 58.53184 H ? A ? 73 HB2 1
   ATOM 1695 HB3 . ASP A 75 ? 7.32604 41.48447 38.18234 1.000 58.53184 H ? A ? 73 HB3 1
   ATOM 1696 N . ALA A 76 ? 4.40022 38.74940 38.17852 1.000 43.35043 N ? A ? 74 N 1
   ATOM 1697 CA . ALA A 76 ? 3.19999 38.57439 37.36665 1.000 44.76990 C ? A ? 74 CA 1
   ATOM 1698 C . ALA A 76 ? 2.43078 39.87917 37.21849 1.000 44.84236 C ? A ? 74 C 1
   ATOM 1699 O . ALA A 76 ? 1.94305 40.19633 36.13057 1.000 44.20442 O ? A ? 74 O 1
   ATOM 1700 CB . ALA A 76 ? 2.30232 37.49488 37.97185 1.000 44.57629 C ? A ? 74 CB 1
   ATOM 1701 H . ALA A 76 ? 4.42355 38.26884 38.89135 1.000 52.13207 H ? A ? 74 H 1
   ATOM 1702 HA . ALA A 76 ? 3.47014 38.28183 36.48216 1.000 53.83543 H ? A ? 74 HA 1
   ATOM 1703 HB1 . ALA A 76 ? 1.51670 37.38766 37.41309 1.000 53.60309 H ? A ? 74 HB1 1
   ATOM 1704 HB2 . ALA A 76 ? 2.79543 36.66057 38.01285 1.000 53.60309 H ? A ? 74 HB2 1
   ATOM 1705 HB3 . ALA A 76 ? 2.03857 37.76744 38.86462 1.000 53.60309 H ? A ? 74 HB3 1
   ATOM 1706 N . ALA A 77 ? 2.27908 40.63452 38.30673 1.000 46.41217 N ? A ? 75 N 1
   ATOM 1707 CA . ALA A 77 ? 1.57156 41.90657 38.21455 1.000 49.33440 C ? A ? 75 CA 1
   ATOM 1708 C . ALA A 77 ? 2.23394 42.82631 37.19604 1.000 47.22366 C ? A ? 75 C 1
   ATOM 1709 O . ALA A 77 ? 1.54954 43.54793 36.46170 1.000 45.46045 O ? A ? 75 O 1
   ATOM 1710 CB . ALA A 77 ? 1.51337 42.57603 39.58828 1.000 58.13961 C ? A ? 75 CB 1
   ATOM 1711 H . ALA A 77 ? 2.56995 40.43692 39.09155 1.000 55.80616 H ? A ? 75 H 1
   ATOM 1712 HA . ALA A 77 ? 0.66066 41.74091 37.92520 1.000 59.31284 H ? A ? 75 HA 1
   ATOM 1713 HB1 . ALA A 77 ? 1.03854 43.41817 39.50933 1.000 69.87908 H ? A ? 75 HB1 1
   ATOM 1714 HB2 . ALA A 77 ? 1.04769 41.99034 40.20554 1.000 69.87908 H ? A ? 75 HB2 1
   ATOM 1715 HB3 . ALA A 77 ? 2.41783 42.73432 39.90102 1.000 69.87908 H ? A ? 75 HB3 1
   ATOM 1716 N A SER A 78 ? 3.56711 42.81443 37.13459 0.508 46.73296 N ? A ? 76 N 1
   ATOM 1717 CA A SER A 78 ? 4.26722 43.65994 36.17519 0.508 47.36054 C ? A ? 76 CA 1
   ATOM 1718 C A SER A 78 ? 4.15020 43.13062 34.75174 0.508 44.85386 C ? A ? 76 C 1
   ATOM 1719 O A SER A 78 ? 4.30072 43.90057 33.79799 0.508 43.78123 O ? A ? 76 O 1
   ATOM 1720 CB A SER A 78 ? 5.74608 43.77406 36.54896 0.508 49.91396 C ? A ? 76 CB 1
   ATOM 1721 OG A SER A 78 ? 5.91745 44.46268 37.77723 0.508 53.01986 O ? A ? 76 OG 1
   ATOM 1722 H A SER A 78 ? 4.07885 42.33280 37.63032 0.508 56.19111 H ? A ? 76 H 1
   ATOM 1723 HA A SER A 78 ? 3.87655 44.54720 36.20744 0.508 56.94420 H ? A ? 76 HA 1
   ATOM 1724 HB2 A SER A 78 ? 6.11752 42.88213 36.63501 0.508 60.00831 H ? A ? 76 HB2 1
   ATOM 1725 HB3 A SER A 78 ? 6.20971 44.26044 35.84941 0.508 60.00831 H ? A ? 76 HB3 1
   ATOM 1726 HG A SER A 78 ? 6.72260 44.43080 38.01457 0.508 63.73538 H ? A ? 76 HG 1
   ATOM 1727 N B SER A 78 ? 3.56591 42.81176 37.13495 0.492 46.74110 N ? A ? 76 N 1
   ATOM 1728 CA B SER A 78 ? 4.27828 43.65056 36.18109 0.492 47.35923 C ? A ? 76 CA 1
   ATOM 1729 C B SER A 78 ? 4.16938 43.12501 34.75730 0.492 44.84606 C ? A ? 76 C 1
   ATOM 1730 O B SER A 78 ? 4.31169 43.90118 33.80912 0.492 43.77288 O ? A ? 76 O 1
   ATOM 1731 CB B SER A 78 ? 5.74767 43.75056 36.58036 0.492 49.91437 C ? A ? 76 CB 1
   ATOM 1732 OG B SER A 78 ? 6.49779 44.43024 35.59030 0.492 48.71511 O ? A ? 76 OG 1
   ATOM 1733 H B SER A 78 ? 4.07418 42.32791 37.63210 0.492 56.20087 H ? A ? 76 H 1
   ATOM 1734 HA B SER A 78 ? 3.89502 44.54142 36.20046 0.492 56.94263 H ? A ? 76 HA 1
   ATOM 1735 HB2 B SER A 78 ? 5.81455 44.23806 37.41629 0.492 60.00879 H ? A ? 76 HB2 1
   ATOM 1736 HB3 B SER A 78 ? 6.10638 42.85583 36.68849 0.492 60.00879 H ? A ? 76 HB3 1
   ATOM 1737 HG B SER A 78 ? 7.23424 44.67934 35.90840 0.492 58.56968 H ? A ? 76 HG 1
   ATOM 1738 N . PHE A 79 ? 3.92757 41.82974 34.58110 1.000 41.83921 N ? A ? 77 N 1
   ATOM 1739 CA . PHE A 79 ? 3.77085 41.28929 33.23926 1.000 38.77452 C ? A ? 77 CA 1
   ATOM 1740 C . PHE A 79 ? 2.36539 41.54576 32.72154 1.000 38.13394 C ? A ? 77 C 1
   ATOM 1741 O . PHE A 79 ? 2.19080 42.00477 31.58752 1.000 36.01922 O ? A ? 77 O 1
   ATOM 1742 HA . PHE A 79 ? 4.40520 41.72102 32.64587 1.000 46.64098 H ? A ? 77 HA 1
   ATOM 1743 CB A PHE A 79 ? 4.07046 39.79498 33.23780 0.556 35.70061 C ? A ? 77 CB 1
   ATOM 1744 CG A PHE A 79 ? 4.08429 39.18247 31.87146 0.556 32.78310 C ? A ? 77 CG 1
   ATOM 1745 CD1 A PHE A 79 ? 5.15739 39.38277 31.02430 0.556 30.80640 C ? A ? 77 CD1 1
   ATOM 1746 CD2 A PHE A 79 ? 3.03522 38.38191 31.44223 0.556 30.31841 C ? A ? 77 CD2 1
   ATOM 1747 CE1 A PHE A 79 ? 5.18918 38.81038 29.77327 0.556 28.93151 C ? A ? 77 CE1 1
   ATOM 1748 CE2 A PHE A 79 ? 3.06653 37.79646 30.19155 0.556 26.98014 C ? A ? 77 CE2 1
   ATOM 1749 CZ A PHE A 79 ? 4.13938 38.02801 29.34835 0.556 27.21281 C ? A ? 77 CZ 1
   ATOM 1750 H A PHE A 79 ? 3.86449 41.25163 35.21467 0.508 50.31860 H ? A ? 77 H 1
   ATOM 1751 HB2 A PHE A 79 ? 4.94374 39.65182 33.63500 0.556 42.95228 H ? A ? 77 HB2 1
   ATOM 1752 HB3 A PHE A 79 ? 3.39037 39.34025 33.75895 0.556 42.95228 H ? A ? 77 HB3 1
   ATOM 1753 HD1 A PHE A 79 ? 5.86889 39.91242 31.30381 0.556 37.07923 H ? A ? 77 HD1 1
   ATOM 1754 HD2 A PHE A 79 ? 2.30563 38.23849 32.00082 0.556 36.49365 H ? A ? 77 HD2 1
   ATOM 1755 HE1 A PHE A 79 ? 5.91953 38.95206 29.21522 0.556 34.82936 H ? A ? 77 HE1 1
   ATOM 1756 HE2 A PHE A 79 ? 2.36792 37.24764 29.91654 0.556 32.48772 H ? A ? 77 HE2 1
   ATOM 1757 HZ A PHE A 79 ? 4.15097 37.65568 28.49622 0.556 32.76692 H ? A ? 77 HZ 1
   ATOM 1758 CB B PHE A 79 ? 4.07175 39.79366 33.26588 0.444 35.69148 C ? A ? 77 CB 1
   ATOM 1759 CG B PHE A 79 ? 3.81196 39.08494 31.96933 0.444 32.94089 C ? A ? 77 CG 1
   ATOM 1760 CD1 B PHE A 79 ? 2.63330 38.38714 31.77299 0.444 30.35787 C ? A ? 77 CD1 1
   ATOM 1761 CD2 B PHE A 79 ? 4.75142 39.09537 30.95676 0.444 30.78663 C ? A ? 77 CD2 1
   ATOM 1762 CE1 B PHE A 79 ? 2.39431 37.70967 30.58635 0.444 27.66406 C ? A ? 77 CE1 1
   ATOM 1763 CE2 B PHE A 79 ? 4.51631 38.42963 29.76464 0.444 27.46001 C ? A ? 77 CE2 1
   ATOM 1764 CZ B PHE A 79 ? 3.34141 37.72163 29.58603 0.444 26.28608 C ? A ? 77 CZ 1
   ATOM 1765 H B PHE A 79 ? 3.85101 41.25200 35.21352 0.492 50.31860 H ? A ? 77 H 1
   ATOM 1766 HB2 B PHE A 79 ? 5.00873 39.67061 33.48457 0.444 42.94133 H ? A ? 77 HB2 1
   ATOM 1767 HB3 B PHE A 79 ? 3.51561 39.37838 33.94349 0.444 42.94133 H ? A ? 77 HB3 1
   ATOM 1768 HD1 B PHE A 79 ? 1.99204 38.37214 32.44638 0.444 36.54099 H ? A ? 77 HD1 1
   ATOM 1769 HD2 B PHE A 79 ? 5.55117 39.55466 31.07662 0.444 37.05551 H ? A ? 77 HD2 1
   ATOM 1770 HE1 B PHE A 79 ? 1.59592 37.24810 30.46626 0.444 33.30843 H ? A ? 77 HE1 1
   ATOM 1771 HE2 B PHE A 79 ? 5.14911 38.45879 29.08374 0.444 33.06356 H ? A ? 77 HE2 1
   ATOM 1772 HZ B PHE A 79 ? 3.19171 37.25622 28.79490 0.444 31.65485 H ? A ? 77 HZ 1
   ATOM 1773 N . LYS A 80 ? 1.35066 41.25267 33.54028 1.000 38.65076 N ? A ? 78 N 1
   ATOM 1774 CA . LYS A 80 ? -0.01306 41.62237 33.18563 1.000 40.02513 C ? A ? 78 CA 1
   ATOM 1775 C . LYS A 80 ? -0.08858 43.10998 32.88795 1.000 38.89033 C ? A ? 78 C 1
   ATOM 1776 O . LYS A 80 ? -0.84497 43.54126 32.01044 1.000 36.69527 O ? A ? 78 O 1
   ATOM 1777 H . LYS A 80 ? 1.42758 40.84653 34.29443 1.000 46.49247 H ? A ? 78 H 1
   ATOM 1778 HA . LYS A 80 ? -0.28988 41.13079 32.39657 1.000 48.14171 H ? A ? 78 HA 1
   ATOM 1779 CB A LYS A 80 ? -0.95840 41.26101 34.32988 0.454 40.45943 C ? A ? 78 CB 1
   ATOM 1780 CG A LYS A 80 ? -2.42894 41.46048 34.01396 0.454 42.26465 C ? A ? 78 CG 1
   ATOM 1781 CD A LYS A 80 ? -3.28101 41.23379 35.25629 0.454 44.65984 C ? A ? 78 CD 1
   ATOM 1782 CE A LYS A 80 ? -3.01463 39.86452 35.85790 0.454 46.10298 C ? A ? 78 CE 1
   ATOM 1783 NZ A LYS A 80 ? -3.77748 39.65070 37.12159 0.454 44.83369 N ? A ? 78 NZ 1
   ATOM 1784 HB2 A LYS A 80 ? -0.83042 40.32581 34.55330 0.454 48.66287 H ? A ? 78 HB2 1
   ATOM 1785 HB3 A LYS A 80 ? -0.74455 41.81723 35.09525 0.454 48.66287 H ? A ? 78 HB3 1
   ATOM 1786 HG2 A LYS A 80 ? -2.57372 42.36746 33.70198 0.454 50.82913 H ? A ? 78 HG2 1
   ATOM 1787 HG3 A LYS A 80 ? -2.70317 40.82736 33.33216 0.454 50.82913 H ? A ? 78 HG3 1
   ATOM 1788 HD2 A LYS A 80 ? -3.06866 41.90754 35.92103 0.454 53.70337 H ? A ? 78 HD2 1
   ATOM 1789 HD3 A LYS A 80 ? -4.21984 41.28692 35.01823 0.454 53.70337 H ? A ? 78 HD3 1
   ATOM 1790 HE2 A LYS A 80 ? -3.28080 39.18021 35.22405 0.454 55.43513 H ? A ? 78 HE2 1
   ATOM 1791 HE3 A LYS A 80 ? -2.06896 39.78213 36.05744 0.454 55.43513 H ? A ? 78 HE3 1
   ATOM 1792 HZ1 A LYS A 80 ? -3.59947 38.84360 37.45176 0.454 53.91198 H ? A ? 78 HZ1 1
   ATOM 1793 HZ2 A LYS A 80 ? -3.54880 40.26565 37.72296 0.454 53.91198 H ? A ? 78 HZ2 1
   ATOM 1794 HZ3 A LYS A 80 ? -4.65123 39.71193 36.96377 0.454 53.91198 H ? A ? 78 HZ3 1
   ATOM 1795 CB B LYS A 80 ? -0.97122 41.24857 34.31724 0.546 40.45601 C ? A ? 78 CB 1
   ATOM 1796 CG B LYS A 80 ? -2.43899 41.47697 33.97416 0.546 42.24604 C ? A ? 78 CG 1
   ATOM 1797 CD B LYS A 80 ? -3.35858 41.06153 35.11697 0.546 44.65921 C ? A ? 78 CD 1
   ATOM 1798 CE B LYS A 80 ? -4.82271 41.25293 34.74029 0.546 47.66768 C ? A ? 78 CE 1
   ATOM 1799 NZ B LYS A 80 ? -5.73864 40.91154 35.86308 0.546 52.55565 N ? A ? 78 NZ 1
   ATOM 1800 HB2 B LYS A 80 ? -0.85776 40.30785 34.52478 0.546 48.65877 H ? A ? 78 HB2 1
   ATOM 1801 HB3 B LYS A 80 ? -0.76090 41.78775 35.09566 0.546 48.65877 H ? A ? 78 HB3 1
   ATOM 1802 HG2 B LYS A 80 ? -2.58319 42.41945 33.79570 0.546 50.80680 H ? A ? 78 HG2 1
   ATOM 1803 HG3 B LYS A 80 ? -2.67045 40.95201 33.19203 0.546 50.80680 H ? A ? 78 HG3 1
   ATOM 1804 HD2 B LYS A 80 ? -3.21493 40.12451 35.32258 0.546 53.70261 H ? A ? 78 HD2 1
   ATOM 1805 HD3 B LYS A 80 ? -3.16929 41.60528 35.89762 0.546 53.70261 H ? A ? 78 HD3 1
   ATOM 1806 HE2 B LYS A 80 ? -4.97148 42.18081 34.49987 0.546 57.31277 H ? A ? 78 HE2 1
   ATOM 1807 HE3 B LYS A 80 ? -5.03673 40.67726 33.98949 0.546 57.31277 H ? A ? 78 HE3 1
   ATOM 1808 HZ1 B LYS A 80 ? -6.58442 41.03045 35.61286 0.546 63.17834 H ? A ? 78 HZ1 1
   ATOM 1809 HZ2 B LYS A 80 ? -5.62464 40.06161 36.10124 0.546 63.17834 H ? A ? 78 HZ2 1
   ATOM 1810 HZ3 B LYS A 80 ? -5.56870 41.43316 36.56389 0.546 63.17834 H ? A ? 78 HZ3 1
   ATOM 1811 N . GLN A 81 ? 0.67002 43.91250 33.63507 1.000 42.74477 N ? A ? 79 N 1
   ATOM 1812 CA . GLN A 81 ? 0.79758 45.32998 33.31429 1.000 42.58770 C ? A ? 79 CA 1
   ATOM 1813 C . GLN A 81 ? 1.15241 45.50737 31.84521 1.000 37.65667 C ? A ? 79 C 1
   ATOM 1814 O . GLN A 81 ? 0.44813 46.19400 31.09248 1.000 36.99334 O ? A ? 79 O 1
   ATOM 1815 CB . GLN A 81 ? 1.92044 45.95258 34.15656 1.000 46.08948 C ? A ? 79 CB 1
   ATOM 1816 CG . GLN A 81 ? 1.52339 46.71279 35.41585 1.000 49.16657 C ? A ? 79 CG 1
   ATOM 1817 CD . GLN A 81 ? 2.73715 47.33727 36.12147 1.000 47.73614 C ? A ? 79 CD 1
   ATOM 1818 OE1 . GLN A 81 ? 3.82729 47.45317 35.54400 1.000 46.34896 O ? A ? 79 OE1 1
   ATOM 1819 NE2 . GLN A 81 ? 2.55305 47.72183 37.37933 1.000 50.02006 N ? A ? 79 NE2 1
   ATOM 1820 H . GLN A 81 ? 1.11635 43.66199 34.32619 1.000 51.40527 H ? A ? 79 H 1
   ATOM 1821 HA . GLN A 81 ? -0.04296 45.77145 33.51306 1.000 51.21679 H ? A ? 79 HA 1
   ATOM 1822 HB2 . GLN A 81 ? 2.51180 45.23683 34.43748 1.000 55.41893 H ? A ? 79 HB2 1
   ATOM 1823 HB3 . GLN A 81 ? 2.40152 46.57840 33.59282 1.000 55.41893 H ? A ? 79 HB3 1
   ATOM 1824 HG2 . GLN A 81 ? 0.91156 47.42673 35.17738 1.000 59.11143 H ? A ? 79 HG2 1
   ATOM 1825 HG3 . GLN A 81 ? 1.09471 46.10154 36.03513 1.000 59.11143 H ? A ? 79 HG3 1
   ATOM 1826 HE21 . GLN A 81 ? 1.78617 47.61529 37.75370 1.000 60.13563 H ? A ? 79 HE21 1
   ATOM 1827 HE22 . GLN A 81 ? 3.20072 48.07739 37.81945 1.000 60.13563 H ? A ? 79 HE22 1
   ATOM 1828 N A LYS A 82 ? 2.25870 44.89171 31.42710 0.524 36.67293 N ? A ? 80 N 1
   ATOM 1829 CA A LYS A 82 ? 2.75367 45.07757 30.06976 0.524 34.47212 C ? A ? 80 CA 1
   ATOM 1830 C A LYS A 82 ? 1.74539 44.58799 29.03537 0.524 31.79750 C ? A ? 80 C 1
   ATOM 1831 O A LYS A 82 ? 1.49702 45.26676 28.03677 0.524 29.68648 O ? A ? 80 O 1
   ATOM 1832 CB A LYS A 82 ? 4.10276 44.36904 29.91599 0.524 34.44029 C ? A ? 80 CB 1
   ATOM 1833 CG A LYS A 82 ? 5.32541 45.25812 30.16930 0.524 35.62411 C ? A ? 80 CG 1
   ATOM 1834 CD A LYS A 82 ? 5.22385 46.00785 31.49039 0.524 39.91336 C ? A ? 80 CD 1
   ATOM 1835 CE A LYS A 82 ? 6.31932 47.07168 31.62461 0.524 42.61736 C ? A ? 80 CE 1
   ATOM 1836 NZ A LYS A 82 ? 6.07527 47.96507 32.79755 0.524 47.94460 N ? A ? 80 NZ 1
   ATOM 1837 H A LYS A 82 ? 2.73746 44.36408 31.90876 0.524 44.11907 H ? A ? 80 H 1
   ATOM 1838 HA A LYS A 82 ? 2.89294 46.02337 29.90557 0.524 41.47810 H ? A ? 80 HA 1
   ATOM 1839 HB2 A LYS A 82 ? 4.13920 43.63490 30.54893 0.524 41.43991 H ? A ? 80 HB2 1
   ATOM 1840 HB3 A LYS A 82 ? 4.17106 44.02958 29.00990 0.524 41.43991 H ? A ? 80 HB3 1
   ATOM 1841 HG2 A LYS A 82 ? 6.12200 44.70526 30.19579 0.524 42.86049 H ? A ? 80 HG2 1
   ATOM 1842 HG3 A LYS A 82 ? 5.39840 45.91118 29.45580 0.524 42.86049 H ? A ? 80 HG3 1
   ATOM 1843 HD2 A LYS A 82 ? 4.36232 46.45054 31.54222 0.524 48.00758 H ? A ? 80 HD2 1
   ATOM 1844 HD3 A LYS A 82 ? 5.31873 45.37973 32.22344 0.524 48.00758 H ? A ? 80 HD3 1
   ATOM 1845 HE2 A LYS A 82 ? 7.17710 46.63556 31.74674 0.524 51.25239 H ? A ? 80 HE2 1
   ATOM 1846 HE3 A LYS A 82 ? 6.33607 47.61812 30.82335 0.524 51.25239 H ? A ? 80 HE3 1
   ATOM 1847 HZ1 A LYS A 82 ? 5.27916 48.35575 32.72218 0.524 57.64507 H ? A ? 80 HZ1 1
   ATOM 1848 HZ2 A LYS A 82 ? 6.09419 47.49091 33.55049 0.524 57.64507 H ? A ? 80 HZ2 1
   ATOM 1849 HZ3 A LYS A 82 ? 6.70332 48.59445 32.83670 0.524 57.64507 H ? A ? 80 HZ3 1
   ATOM 1850 N B LYS A 82 ? 2.23267 44.85951 31.40874 0.476 36.64644 N ? A ? 80 N 1
   ATOM 1851 CA B LYS A 82 ? 2.74863 45.10013 30.06752 0.476 34.45124 C ? A ? 80 CA 1
   ATOM 1852 C B LYS A 82 ? 1.84111 44.52820 28.98383 0.476 31.79252 C ? A ? 80 C 1
   ATOM 1853 O B LYS A 82 ? 1.79283 45.07665 27.87887 0.476 29.88579 O ? A ? 80 O 1
   ATOM 1854 CB B LYS A 82 ? 4.15665 44.52328 29.93539 0.476 34.44516 C ? A ? 80 CB 1
   ATOM 1855 CG B LYS A 82 ? 5.20469 45.26337 30.74538 0.476 36.24878 C ? A ? 80 CG 1
   ATOM 1856 CD B LYS A 82 ? 6.60655 44.92551 30.27409 0.476 34.67422 C ? A ? 80 CD 1
   ATOM 1857 CE B LYS A 82 ? 7.65004 45.63788 31.11568 0.476 38.84294 C ? A ? 80 CE 1
   ATOM 1858 NZ B LYS A 82 ? 7.54558 47.12204 30.99785 0.476 38.49517 N ? A ? 80 NZ 1
   ATOM 1859 H B LYS A 82 ? 2.67860 44.28294 31.86516 0.476 44.08728 H ? A ? 80 H 1
   ATOM 1860 HA B LYS A 82 ? 2.79766 46.05917 29.93059 0.476 41.45304 H ? A ? 80 HA 1
   ATOM 1861 HB2 B LYS A 82 ? 4.14505 43.60212 30.23908 0.476 41.44574 H ? A ? 80 HB2 1
   ATOM 1862 HB3 B LYS A 82 ? 4.42232 44.56199 29.00328 0.476 41.44574 H ? A ? 80 HB3 1
   ATOM 1863 HG2 B LYS A 82 ? 5.07147 46.21918 30.64747 0.476 43.61009 H ? A ? 80 HG2 1
   ATOM 1864 HG3 B LYS A 82 ? 5.12715 45.01150 31.67889 0.476 43.61009 H ? A ? 80 HG3 1
   ATOM 1865 HD2 B LYS A 82 ? 6.75142 43.96940 30.35011 0.476 41.72061 H ? A ? 80 HD2 1
   ATOM 1866 HD3 B LYS A 82 ? 6.71344 45.20492 29.35138 0.476 41.72061 H ? A ? 80 HD3 1
   ATOM 1867 HE2 B LYS A 82 ? 7.52624 45.39855 32.04750 0.476 46.72308 H ? A ? 80 HE2 1
   ATOM 1868 HE3 B LYS A 82 ? 8.53467 45.37205 30.81958 0.476 46.72308 H ? A ? 80 HE3 1
   ATOM 1869 HZ1 B LYS A 82 ? 8.20975 47.51041 31.44523 0.476 46.30576 H ? A ? 80 HZ1 1
   ATOM 1870 HZ2 B LYS A 82 ? 7.59336 47.36362 30.14260 0.476 46.30576 H ? A ? 80 HZ2 1
   ATOM 1871 HZ3 B LYS A 82 ? 6.76970 47.40020 31.33364 0.476 46.30576 H ? A ? 80 HZ3 1
   ATOM 1872 N . GLN A 83 ? 1.14427 43.41911 29.24757 1.000 31.26222 N ? A ? 81 N 1
   ATOM 1873 CA . GLN A 83 ? 0.24469 42.89568 28.22064 1.000 26.93525 C ? A ? 81 CA 1
   ATOM 1874 C . GLN A 83 ? -1.03419 43.72392 28.10631 1.000 29.16649 C ? A ? 81 C 1
   ATOM 1875 O . GLN A 83 ? -1.50654 43.97994 26.99924 1.000 27.70491 O ? A ? 81 O 1
   ATOM 1876 CB . GLN A 83 ? -0.01139 41.38861 28.38562 1.000 29.09277 C ? A ? 81 CB 1
   ATOM 1877 CG . GLN A 83 ? -0.68663 40.96281 29.66925 1.000 31.68859 C ? A ? 81 CG 1
   ATOM 1878 CD . GLN A 83 ? -2.12909 40.58644 29.47663 1.000 31.42388 C ? A ? 81 CD 1
   ATOM 1879 OE1 . GLN A 83 ? -2.84137 41.19467 28.68201 1.000 30.90648 O ? A ? 81 OE1 1
   ATOM 1880 NE2 . GLN A 83 ? -2.57473 39.58927 30.22076 1.000 34.14835 N ? A ? 81 NE2 1
   ATOM 1881 HA . GLN A 83 ? 0.69103 42.96865 27.36252 1.000 32.43385 H ? A ? 81 HA 1
   ATOM 1882 HB2 . GLN A 83 ? -0.57784 41.09646 27.65440 1.000 35.02287 H ? A ? 81 HB2 1
   ATOM 1883 HB3 . GLN A 83 ? 0.84291 40.93084 28.34682 1.000 35.02287 H ? A ? 81 HB3 1
   ATOM 1884 HG2 . GLN A 83 ? -0.22178 40.19122 30.02907 1.000 38.13786 H ? A ? 81 HG2 1
   ATOM 1885 HG3 . GLN A 83 ? -0.65110 41.69663 30.30260 1.000 38.13786 H ? A ? 81 HG3 1
   ATOM 1886 HE21 . GLN A 83 ? -2.04684 39.19693 30.77484 1.000 41.08958 H ? A ? 81 HE21 1
   ATOM 1887 HE22 . GLN A 83 ? -3.39260 39.33274 30.15089 1.000 41.08958 H ? A ? 81 HE22 1
   ATOM 1888 H A GLN A 83 ? 1.23550 42.92853 29.94800 0.524 37.62622 H ? A ? 81 H 1
   ATOM 1889 H B GLN A 83 ? 1.17387 42.97141 29.98124 0.476 37.62622 H ? A ? 81 H 1
   ATOM 1890 N A GLN A 84 ? -1.61983 44.11312 29.23733 0.375 31.16763 N ? A ? 82 N 1
   ATOM 1891 CA A GLN A 84 ? -2.79162 44.97954 29.21099 0.375 29.83153 C ? A ? 82 CA 1
   ATOM 1892 C A GLN A 84 ? -2.48663 46.25972 28.44553 0.375 29.40617 C ? A ? 82 C 1
   ATOM 1893 O A GLN A 84 ? -3.26363 46.68491 27.58873 0.375 28.75679 O ? A ? 82 O 1
   ATOM 1894 CB A GLN A 84 ? -3.22129 45.26354 30.65242 0.375 33.44610 C ? A ? 82 CB 1
   ATOM 1895 CG A GLN A 84 ? -3.82962 46.60759 30.90320 0.375 34.61100 C ? A ? 82 CG 1
   ATOM 1896 CD A GLN A 84 ? -3.31661 47.23827 32.20720 0.375 35.68742 C ? A ? 82 CD 1
   ATOM 1897 OE1 A GLN A 84 ? -3.87293 47.02380 33.29086 0.375 38.17919 O ? A ? 82 OE1 1
   ATOM 1898 NE2 A GLN A 84 ? -2.23801 48.00544 32.10082 0.375 33.69521 N ? A ? 82 NE2 1
   ATOM 1899 H A GLN A 84 ? -1.35972 43.89080 30.02632 0.375 37.51271 H ? A ? 82 H 1
   ATOM 1900 HA A GLN A 84 ? -3.53071 44.54330 28.75895 0.375 35.90938 H ? A ? 82 HA 1
   ATOM 1901 HB2 A GLN A 84 ? -3.87949 44.59881 30.90896 0.375 40.24687 H ? A ? 82 HB2 1
   ATOM 1902 HB3 A GLN A 84 ? -2.43890 45.19254 31.22140 0.375 40.24687 H ? A ? 82 HB3 1
   ATOM 1903 HG2 A GLN A 84 ? -3.60409 47.20148 30.17017 0.375 41.64476 H ? A ? 82 HG2 1
   ATOM 1904 HG3 A GLN A 84 ? -4.79278 46.51419 30.97022 0.375 41.64476 H ? A ? 82 HG3 1
   ATOM 1905 HE21 A GLN A 84 ? -1.86898 48.12444 31.33319 0.375 40.54580 H ? A ? 82 HE21 1
   ATOM 1906 HE22 A GLN A 84 ? -1.90848 48.38331 32.79956 0.375 40.54580 H ? A ? 82 HE22 1
   ATOM 1907 N B GLN A 84 ? -1.59806 44.18611 29.22132 0.625 31.21452 N ? A ? 82 N 1
   ATOM 1908 CA B GLN A 84 ? -2.83079 44.96318 29.10913 0.625 29.76405 C ? A ? 82 CA 1
   ATOM 1909 C B GLN A 84 ? -2.56770 46.36086 28.55643 0.625 29.35396 C ? A ? 82 C 1
   ATOM 1910 O B GLN A 84 ? -3.45867 46.95702 27.94032 0.625 29.84993 O ? A ? 82 O 1
   ATOM 1911 CB B GLN A 84 ? -3.56628 45.01294 30.44921 0.625 32.77918 C ? A ? 82 CB 1
   ATOM 1912 CG B GLN A 84 ? -4.40173 43.77718 30.68200 0.625 36.50262 C ? A ? 82 CG 1
   ATOM 1913 CD B GLN A 84 ? -5.05922 43.76006 32.03607 0.625 44.14510 C ? A ? 82 CD 1
   ATOM 1914 OE1 B GLN A 84 ? -4.53912 44.32114 32.99745 0.625 42.87580 O ? A ? 82 OE1 1
   ATOM 1915 NE2 B GLN A 84 ? -6.21575 43.11297 32.12197 0.625 50.75472 N ? A ? 82 NE2 1
   ATOM 1916 H B GLN A 84 ? -1.30086 44.06937 30.01985 0.625 37.56898 H ? A ? 82 H 1
   ATOM 1917 HA B GLN A 84 ? -3.42511 44.51574 28.48664 0.625 35.82841 H ? A ? 82 HA 1
   ATOM 1918 HB2 B GLN A 84 ? -2.91695 45.08000 31.16668 0.625 39.44657 H ? A ? 82 HB2 1
   ATOM 1919 HB3 B GLN A 84 ? -4.15476 45.78394 30.46120 0.625 39.44657 H ? A ? 82 HB3 1
   ATOM 1920 HG2 B GLN A 84 ? -5.09997 43.73728 30.00986 0.625 43.91470 H ? A ? 82 HG2 1
   ATOM 1921 HG3 B GLN A 84 ? -3.83250 42.99455 30.61590 0.625 43.91470 H ? A ? 82 HG3 1
   ATOM 1922 HE21 B GLN A 84 ? -6.54864 42.73304 31.42595 0.625 61.01722 H ? A ? 82 HE21 1
   ATOM 1923 HE22 B GLN A 84 ? -6.63180 43.07387 32.87361 0.625 61.01722 H ? A ? 82 HE22 1
   ATOM 1924 N . ALA A 85 ? -1.35470 46.89221 28.75197 1.000 30.07151 N ? A ? 83 N 1
   ATOM 1925 CA . ALA A 85 ? -0.99436 48.14041 28.07878 1.000 27.43599 C ? A ? 83 CA 1
   ATOM 1926 C . ALA A 85 ? -0.80078 47.92067 26.57853 1.000 26.37775 C ? A ? 83 C 1
   ATOM 1927 O . ALA A 85 ? -1.25462 48.71789 25.75636 1.000 24.21019 O ? A ? 83 O 1
   ATOM 1928 CB . ALA A 85 ? 0.26766 48.74782 28.69231 1.000 31.15060 C ? A ? 83 CB 1
   ATOM 1929 HA . ALA A 85 ? -1.71760 48.77354 28.20903 1.000 33.03473 H ? A ? 83 HA 1
   ATOM 1930 HB1 . ALA A 85 ? 0.52877 49.52456 28.17327 1.000 37.49227 H ? A ? 83 HB1 1
   ATOM 1931 HB2 . ALA A 85 ? 0.07961 49.00936 29.60726 1.000 37.49227 H ? A ? 83 HB2 1
   ATOM 1932 HB3 . ALA A 85 ? 0.97654 48.08590 28.67653 1.000 37.49227 H ? A ? 83 HB3 1
   ATOM 1933 H A ALA A 85 ? -0.78463 46.62477 29.33772 0.375 36.19736 H ? A ? 83 H 1
   ATOM 1934 H B ALA A 85 ? -0.74169 46.55870 29.25456 0.625 36.19736 H ? A ? 83 H 1
   ATOM 1935 N . PHE A 86 ? -0.16639 46.81142 26.19616 1.000 24.48538 N ? A ? 84 N 1
   ATOM 1936 CA . PHE A 86 ? -0.06347 46.47060 24.78187 1.000 22.08927 C ? A ? 84 CA 1
   ATOM 1937 C . PHE A 86 ? -1.46274 46.32310 24.17962 1.000 20.45429 C ? A ? 84 C 1
   ATOM 1938 O . PHE A 86 ? -1.74698 46.84352 23.10662 1.000 19.68954 O ? A ? 84 O 1
   ATOM 1939 CB . PHE A 86 ? 0.78642 45.19248 24.63185 1.000 21.71010 C ? A ? 84 CB 1
   ATOM 1940 CG . PHE A 86 ? 0.61931 44.52314 23.31164 1.000 20.56258 C ? A ? 84 CG 1
   ATOM 1941 CD1 . PHE A 86 ? 1.17536 45.02739 22.15267 1.000 20.32633 C ? A ? 84 CD1 1
   ATOM 1942 CD2 . PHE A 86 ? -0.15848 43.36918 23.22116 1.000 19.55770 C ? A ? 84 CD2 1
   ATOM 1943 CE1 . PHE A 86 ? 0.94701 44.43031 20.95209 1.000 21.46460 C ? A ? 84 CE1 1
   ATOM 1944 CE2 . PHE A 86 ? -0.34723 42.74803 22.02028 1.000 19.40492 C ? A ? 84 CE2 1
   ATOM 1945 CZ . PHE A 86 ? 0.21597 43.29161 20.87731 1.000 23.55546 C ? A ? 84 CZ 1
   ATOM 1946 H . PHE A 86 ? 0.20696 46.24873 26.72869 1.000 29.49401 H ? A ? 84 H 1
   ATOM 1947 HA . PHE A 86 ? 0.39074 47.16911 24.28520 1.000 26.61868 H ? A ? 84 HA 1
   ATOM 1948 HB2 . PHE A 86 ? 1.72280 45.42538 24.73110 1.000 26.16367 H ? A ? 84 HB2 1
   ATOM 1949 HB3 . PHE A 86 ? 0.52682 44.56090 25.32077 1.000 26.16367 H ? A ? 84 HB3 1
   ATOM 1950 HD1 . PHE A 86 ? 1.71302 45.78512 22.19351 1.000 24.50315 H ? A ? 84 HD1 1
   ATOM 1951 HD2 . PHE A 86 ? -0.55284 43.01902 23.98717 1.000 23.58079 H ? A ? 84 HD2 1
   ATOM 1952 HE1 . PHE A 86 ? 1.29537 44.80654 20.17620 1.000 25.86907 H ? A ? 84 HE1 1
   ATOM 1953 HE2 . PHE A 86 ? -0.84944 41.96691 21.96993 1.000 23.39745 H ? A ? 84 HE2 1
   ATOM 1954 HZ . PHE A 86 ? 0.09198 42.87366 20.05582 1.000 28.37811 H ? A ? 84 HZ 1
   ATOM 1955 N A GLN A 87 ? -2.35489 45.61792 24.86448 0.684 20.69604 N ? A ? 85 N 1
   ATOM 1956 CA A GLN A 87 ? -3.67891 45.45278 24.29390 0.684 20.71501 C ? A ? 85 CA 1
   ATOM 1957 C A GLN A 87 ? -4.43835 46.76141 24.23511 0.684 21.52818 C ? A ? 85 C 1
   ATOM 1958 O A GLN A 87 ? -5.18780 46.96228 23.28745 0.684 20.64426 O ? A ? 85 O 1
   ATOM 1959 CB A GLN A 87 ? -4.44412 44.35899 25.01644 0.684 20.83682 C ? A ? 85 CB 1
   ATOM 1960 CG A GLN A 87 ? -3.90569 42.99094 24.67068 0.684 19.43767 C ? A ? 85 CG 1
   ATOM 1961 CD A GLN A 87 ? -4.85944 41.91186 25.09356 0.684 22.25218 C ? A ? 85 CD 1
   ATOM 1962 OE1 A GLN A 87 ? -5.81879 41.60474 24.37653 0.684 23.18815 O ? A ? 85 OE1 1
   ATOM 1963 NE2 A GLN A 87 ? -4.63069 41.35050 26.28285 0.684 20.62724 N ? A ? 85 NE2 1
   ATOM 1964 H A GLN A 87 ? -2.22297 45.24252 25.62688 0.684 24.94680 H ? A ? 85 H 1
   ATOM 1965 HA A GLN A 87 ? -3.59130 45.15034 23.37642 0.684 24.96956 H ? A ? 85 HA 1
   ATOM 1966 HB2 A GLN A 87 ? -4.36085 44.48787 25.97422 0.684 25.11573 H ? A ? 85 HB2 1
   ATOM 1967 HB3 A GLN A 87 ? -5.37801 44.39524 24.75677 0.684 25.11573 H ? A ? 85 HB3 1
   ATOM 1968 HG2 A GLN A 87 ? -3.77704 42.92812 23.71130 0.684 23.43676 H ? A ? 85 HG2 1
   ATOM 1969 HG3 A GLN A 87 ? -3.06193 42.85142 25.12839 0.684 23.43676 H ? A ? 85 HG3 1
   ATOM 1970 HE21 A GLN A 87 ? -3.96537 41.61200 26.76095 0.684 24.86425 H ? A ? 85 HE21 1
   ATOM 1971 HE22 A GLN A 87 ? -5.14863 40.72735 26.57097 0.684 24.86425 H ? A ? 85 HE22 1
   ATOM 1972 N B GLN A 87 ? -2.35465 45.61533 24.86875 0.316 20.78710 N ? A ? 85 N 1
   ATOM 1973 CA B GLN A 87 ? -3.69349 45.43682 24.32551 0.316 20.77763 C ? A ? 85 CA 1
   ATOM 1974 C B GLN A 87 ? -4.45025 46.75428 24.24482 0.316 21.55167 C ? A ? 85 C 1
   ATOM 1975 O B GLN A 87 ? -5.21200 46.95751 23.29735 0.316 20.79552 O ? A ? 85 O 1
   ATOM 1976 CB B GLN A 87 ? -4.44688 44.38389 25.13173 0.316 20.95058 C ? A ? 85 CB 1
   ATOM 1977 CG B GLN A 87 ? -3.83762 42.99220 24.99416 0.316 20.53800 C ? A ? 85 CG 1
   ATOM 1978 CD B GLN A 87 ? -4.53719 41.97179 25.86081 0.316 22.44488 C ? A ? 85 CD 1
   ATOM 1979 OE1 B GLN A 87 ? -4.96384 40.92704 25.38282 0.316 19.96235 O ? A ? 85 OE1 1
   ATOM 1980 NE2 B GLN A 87 ? -4.67497 42.27996 27.14155 0.316 26.03139 N ? A ? 85 NE2 1
   ATOM 1981 H B GLN A 87 ? -2.21299 45.24018 25.62954 0.316 25.05608 H ? A ? 85 H 1
   ATOM 1982 HA B GLN A 87 ? -3.63173 45.10035 23.41784 0.316 25.04470 H ? A ? 85 HA 1
   ATOM 1983 HB2 B GLN A 87 ? -4.42670 44.62981 26.06982 0.316 25.25225 H ? A ? 85 HB2 1
   ATOM 1984 HB3 B GLN A 87 ? -5.36423 44.34301 24.81915 0.316 25.25225 H ? A ? 85 HB3 1
   ATOM 1985 HG2 B GLN A 87 ? -3.90913 42.70381 24.07079 0.316 24.75715 H ? A ? 85 HG2 1
   ATOM 1986 HG3 B GLN A 87 ? -2.90536 43.02569 25.26001 0.316 24.75715 H ? A ? 85 HG3 1
   ATOM 1987 HE21 B GLN A 87 ? -4.37296 43.02837 27.43864 0.316 31.34922 H ? A ? 85 HE21 1
   ATOM 1988 HE22 B GLN A 87 ? -5.06645 41.73165 27.67605 0.316 31.34922 H ? A ? 85 HE22 1
   ATOM 1989 N . ASP A 88 ? -4.22647 47.66616 25.19730 1.000 21.41311 N ? A ? 86 N 1
   ATOM 1990 CA . ASP A 88 ? -4.83012 48.99746 25.10840 1.000 22.68868 C ? A ? 86 CA 1
   ATOM 1991 C . ASP A 88 ? -4.30620 49.77485 23.90566 1.000 21.08034 C ? A ? 86 C 1
   ATOM 1992 O . ASP A 88 ? -5.06646 50.49497 23.26248 1.000 18.92884 O ? A ? 86 O 1
   ATOM 1993 CB . ASP A 88 ? -4.61545 49.79182 26.40322 1.000 25.36721 C ? A ? 86 CB 1
   ATOM 1994 CG . ASP A 88 ? -5.41704 49.24722 27.57916 1.000 32.87547 C ? A ? 86 CG 1
   ATOM 1995 OD1 . ASP A 88 ? -6.39937 48.49713 27.35703 1.000 38.36234 O ? A ? 86 OD1 1
   ATOM 1996 OD2 . ASP A 88 ? -5.06170 49.57593 28.73381 1.000 35.19829 O ? A ? 86 OD2 1
   ATOM 1997 HA . ASP A 88 ? -5.78668 48.88109 24.99729 1.000 27.33797 H ? A ? 86 HA 1
   ATOM 1998 HB2 . ASP A 88 ? -3.67573 49.75761 26.64128 1.000 30.55221 H ? A ? 86 HB2 1
   ATOM 1999 HB3 . ASP A 88 ? -4.88739 50.71137 26.25704 1.000 30.55221 H ? A ? 86 HB3 1
   ATOM 2000 H A ASP A 88 ? -3.74615 47.53634 25.89875 0.684 25.80728 H ? A ? 86 H 1
   ATOM 2001 H B ASP A 88 ? -3.73724 47.54103 25.89343 0.316 25.80728 H ? A ? 86 H 1
   ATOM 2002 N . ASN A 89 ? -3.00560 49.68581 23.61018 1.000 20.50369 N ? A ? 87 N 1
   ATOM 2003 CA . ASN A 89 ? -2.48256 50.29275 22.39373 1.000 21.48982 C ? A ? 87 CA 1
   ATOM 2004 C . ASN A 89 ? -3.04883 49.65172 21.14327 1.000 22.16562 C ? A ? 87 C 1
   ATOM 2005 O . ASN A 89 ? -3.15850 50.30091 20.10250 1.000 20.39755 O ? A ? 87 O 1
   ATOM 2006 H . ASN A 89 ? -2.41711 49.28487 24.09238 1.000 24.71598 H ? A ? 87 H 1
   ATOM 2007 HA . ASN A 89 ? -2.72835 51.23110 22.39352 1.000 25.89933 H ? A ? 87 HA 1
   ATOM 2008 CB A ASN A 89 ? -0.96040 50.20697 22.38839 0.260 22.44093 C ? A ? 87 CB 1
   ATOM 2009 CG A ASN A 89 ? -0.32610 51.27711 23.24083 0.260 24.24775 C ? A ? 87 CG 1
   ATOM 2010 OD1 A ASN A 89 ? -0.32815 52.45091 22.87566 0.260 25.04491 O ? A ? 87 OD1 1
   ATOM 2011 ND2 A ASN A 89 ? 0.21296 50.88395 24.38513 0.260 23.67511 N ? A ? 87 ND2 1
   ATOM 2012 HB2 A ASN A 89 ? -0.68916 49.34311 22.73635 0.260 27.04067 H ? A ? 87 HB2 1
   ATOM 2013 HB3 A ASN A 89 ? -0.63883 50.31439 21.47957 0.260 27.04067 H ? A ? 87 HB3 1
   ATOM 2014 HD21 A ASN A 89 ? 0.58626 51.45881 24.90453 0.260 28.52169 H ? A ? 87 HD21 1
   ATOM 2015 HD22 A ASN A 89 ? 0.18963 50.05384 24.60866 0.260 28.52169 H ? A ? 87 HD22 1
   ATOM 2016 CB B ASN A 89 ? -0.96547 50.23928 22.38337 0.310 22.44999 C ? A ? 87 CB 1
   ATOM 2017 CG B ASN A 89 ? -0.36657 51.42923 23.05813 0.310 24.29472 C ? A ? 87 CG 1
   ATOM 2018 OD1 B ASN A 89 ? -1.06419 52.40871 23.33963 0.310 24.72920 O ? A ? 87 OD1 1
   ATOM 2019 ND2 B ASN A 89 ? 0.92813 51.36510 23.32643 0.310 24.18979 N ? A ? 87 ND2 1
   ATOM 2020 HB2 B ASN A 89 ? -0.66996 49.44292 22.85175 0.310 27.05154 H ? A ? 87 HB2 1
   ATOM 2021 HB3 B ASN A 89 ? -0.65204 50.21991 21.46561 0.310 27.05154 H ? A ? 87 HB3 1
   ATOM 2022 HD21 B ASN A 89 ? 1.32009 52.02501 23.71437 0.310 29.13930 H ? A ? 87 HD21 1
   ATOM 2023 HD22 B ASN A 89 ? 1.37730 50.66352 23.11280 0.310 29.13930 H ? A ? 87 HD22 1
   ATOM 2024 CB C ASN A 89 ? -0.95538 50.16099 22.37133 0.430 22.42030 C ? A ? 87 CB 1
   ATOM 2025 CG C ASN A 89 ? -0.25698 51.23978 23.18626 0.430 24.25559 C ? A ? 87 CG 1
   ATOM 2026 OD1 C ASN A 89 ? -0.00192 52.33947 22.68722 0.430 24.85589 O ? A ? 87 OD1 1
   ATOM 2027 ND2 C ASN A 89 ? 0.05645 50.93291 24.43986 0.430 23.72894 N ? A ? 87 ND2 1
   ATOM 2028 HB2 C ASN A 89 ? -0.70742 49.29900 22.74064 0.430 27.01591 H ? A ? 87 HB2 1
   ATOM 2029 HB3 C ASN A 89 ? -0.64590 50.23062 21.45467 0.430 27.01591 H ? A ? 87 HB3 1
   ATOM 2030 HD21 C ASN A 89 ? 0.45213 51.51150 24.93813 0.430 28.58628 H ? A ? 87 HD21 1
   ATOM 2031 HD22 C ASN A 89 ? -0.13627 50.15561 24.75334 0.430 28.58628 H ? A ? 87 HD22 1
   ATOM 2032 N . ILE A 90 ? -3.35253 48.36268 21.19838 1.000 20.33622 N ? A ? 88 N 1
   ATOM 2033 CA . ILE A 90 ? -4.02846 47.74544 20.05973 1.000 19.32348 C ? A ? 88 CA 1
   ATOM 2034 C . ILE A 90 ? -5.42159 48.34308 19.85750 1.000 19.60308 C ? A ? 88 C 1
   ATOM 2035 O . ILE A 90 ? -5.83317 48.58914 18.72205 1.000 20.75395 O ? A ? 88 O 1
   ATOM 2036 CB . ILE A 90 ? -4.12157 46.22436 20.25622 1.000 19.90700 C ? A ? 88 CB 1
   ATOM 2037 CG1 . ILE A 90 ? -2.80472 45.47174 20.14854 1.000 21.00989 C ? A ? 88 CG1 1
   ATOM 2038 CG2 . ILE A 90 ? -5.15622 45.58271 19.24793 1.000 22.76405 C ? A ? 88 CG2 1
   ATOM 2039 CD1 . ILE A 90 ? -2.25965 45.43512 18.78168 1.000 22.74481 C ? A ? 88 CD1 1
   ATOM 2040 H . ILE A 90 ? -3.18557 47.83794 21.85896 1.000 24.51502 H ? A ? 88 H 1
   ATOM 2041 HA . ILE A 90 ? -3.49957 47.93053 19.26795 1.000 23.29973 H ? A ? 88 HA 1
   ATOM 2042 HB . ILE A 90 ? -4.41911 46.12981 21.17461 1.000 23.99995 H ? A ? 88 HB 1
   ATOM 2043 HG12 . ILE A 90 ? -2.14959 45.90440 20.71819 1.000 25.32342 H ? A ? 88 HG12 1
   ATOM 2044 HG13 . ILE A 90 ? -2.94299 44.55630 20.43792 1.000 25.32342 H ? A ? 88 HG13 1
   ATOM 2045 HG21 . ILE A 90 ? -5.16648 44.62116 19.37526 1.000 27.42841 H ? A ? 88 HG21 1
   ATOM 2046 HG22 . ILE A 90 ? -6.03704 45.94905 19.42353 1.000 27.42841 H ? A ? 88 HG22 1
   ATOM 2047 HG23 . ILE A 90 ? -4.88521 45.79336 18.34069 1.000 27.42841 H ? A ? 88 HG23 1
   ATOM 2048 HD11 . ILE A 90 ? -1.42758 44.93658 18.78675 1.000 27.40532 H ? A ? 88 HD11 1
   ATOM 2049 HD12 . ILE A 90 ? -2.90129 45.00186 18.19732 1.000 27.40532 H ? A ? 88 HD12 1
   ATOM 2050 HD13 . ILE A 90 ? -2.09925 46.34336 18.48122 1.000 27.40532 H ? A ? 88 HD13 1
   ATOM 2051 N . VAL A 91 ? -6.14089 48.64391 20.94022 1.000 21.36247 N ? A ? 89 N 1
   ATOM 2052 CA . VAL A 91 ? -7.41945 49.34448 20.80275 1.000 22.03857 C ? A ? 89 CA 1
   ATOM 2053 C . VAL A 91 ? -7.24689 50.65667 20.05994 1.000 21.03961 C ? A ? 89 C 1
   ATOM 2054 O . VAL A 91 ? -8.08414 51.02242 19.21679 1.000 23.40185 O ? A ? 89 O 1
   ATOM 2055 CB . VAL A 91 ? -8.05551 49.57015 22.18066 1.000 23.21103 C ? A ? 89 CB 1
   ATOM 2056 CG1 . VAL A 91 ? -9.34218 50.41684 22.05996 1.000 23.41042 C ? A ? 89 CG1 1
   ATOM 2057 CG2 . VAL A 91 ? -8.42333 48.26449 22.83505 1.000 24.15557 C ? A ? 89 CG2 1
   ATOM 2058 H . VAL A 91 ? -5.91653 48.45785 21.74932 1.000 25.74651 H ? A ? 89 H 1
   ATOM 2059 HA . VAL A 91 ? -8.01201 48.78378 20.27798 1.000 26.55784 H ? A ? 89 HA 1
   ATOM 2060 HB . VAL A 91 ? -7.40018 50.03409 22.72491 1.000 27.96479 H ? A ? 89 HB 1
   ATOM 2061 HG11 . VAL A 91 ? -9.74183 50.51106 22.93877 1.000 28.20405 H ? A ? 89 HG11 1
   ATOM 2062 HG12 . VAL A 91 ? -9.11340 51.29020 21.70526 1.000 28.20405 H ? A ? 89 HG12 1
   ATOM 2063 HG13 . VAL A 91 ? -9.96032 49.96847 21.46183 1.000 28.20405 H ? A ? 89 HG13 1
   ATOM 2064 HG21 . VAL A 91 ? -8.79632 48.44487 23.71212 1.000 29.09824 H ? A ? 89 HG21 1
   ATOM 2065 HG22 . VAL A 91 ? -9.07889 47.80879 22.28416 1.000 29.09824 H ? A ? 89 HG22 1
   ATOM 2066 HG23 . VAL A 91 ? -7.62617 47.71848 22.92052 1.000 29.09824 H ? A ? 89 HG23 1
   ATOM 2067 N A LYS A 92 ? -6.17689 51.40277 20.35970 0.491 22.39699 N ? A ? 90 N 1
   ATOM 2068 CA A LYS A 92 ? -5.93630 52.67318 19.67864 0.491 23.36150 C ? A ? 90 CA 1
   ATOM 2069 C A LYS A 92 ? -5.69041 52.45659 18.19311 0.491 21.79107 C ? A ? 90 C 1
   ATOM 2070 O A LYS A 92 ? -6.21477 53.18939 17.35444 0.491 21.95618 O ? A ? 90 O 1
   ATOM 2071 CB A LYS A 92 ? -4.74284 53.38060 20.32706 0.491 22.98364 C ? A ? 90 CB 1
   ATOM 2072 CG A LYS A 92 ? -4.24590 54.65361 19.64920 0.491 26.44147 C ? A ? 90 CG 1
   ATOM 2073 CD A LYS A 92 ? -5.22612 55.78941 19.88117 0.491 29.19486 C ? A ? 90 CD 1
   ATOM 2074 CE A LYS A 92 ? -4.96985 56.93313 18.93199 0.491 31.00342 C ? A ? 90 CE 1
   ATOM 2075 NZ A LYS A 92 ? -3.85118 57.79766 19.34223 0.491 32.65842 N ? A ? 90 NZ 1
   ATOM 2076 H A LYS A 92 ? -5.58341 51.19644 20.94691 0.491 26.98794 H ? A ? 90 H 1
   ATOM 2077 HA A LYS A 92 ? -6.71604 53.24253 19.77217 0.491 28.14535 H ? A ? 90 HA 1
   ATOM 2078 HB2 A LYS A 92 ? -4.99296 53.62146 21.23278 0.491 27.69192 H ? A ? 90 HB2 1
   ATOM 2079 HB3 A LYS A 92 ? -3.99822 52.75916 20.34264 0.491 27.69192 H ? A ? 90 HB3 1
   ATOM 2080 HG2 A LYS A 92 ? -3.38569 54.90583 20.01976 0.491 31.84132 H ? A ? 90 HG2 1
   ATOM 2081 HG3 A LYS A 92 ? -4.16481 54.50415 18.69422 0.491 31.84132 H ? A ? 90 HG3 1
   ATOM 2082 HD2 A LYS A 92 ? -6.13046 55.46928 19.73772 0.491 35.14539 H ? A ? 90 HD2 1
   ATOM 2083 HD3 A LYS A 92 ? -5.13045 56.11761 20.78893 0.491 35.14539 H ? A ? 90 HD3 1
   ATOM 2084 HE2 A LYS A 92 ? -4.76020 56.57259 18.05623 0.491 37.31565 H ? A ? 90 HE2 1
   ATOM 2085 HE3 A LYS A 92 ? -5.76701 57.48352 18.88203 0.491 37.31565 H ? A ? 90 HE3 1
   ATOM 2086 HZ1 A LYS A 92 ? -3.69490 58.41077 18.71632 0.491 39.30165 H ? A ? 90 HZ1 1
   ATOM 2087 HZ2 A LYS A 92 ? -4.04865 58.20887 20.10644 0.491 39.30165 H ? A ? 90 HZ2 1
   ATOM 2088 HZ3 A LYS A 92 ? -3.11605 57.30961 19.45842 0.491 39.30165 H ? A ? 90 HZ3 1
   ATOM 2089 N B LYS A 92 ? -6.21864 51.43293 20.42510 0.509 22.42800 N ? A ? 90 N 1
   ATOM 2090 CA B LYS A 92 ? -5.98906 52.72548 19.78751 0.509 23.37269 C ? A ? 90 CA 1
   ATOM 2091 C B LYS A 92 ? -5.68514 52.54361 18.30813 0.509 21.76071 C ? A ? 90 C 1
   ATOM 2092 O B LYS A 92 ? -6.11989 53.33741 17.47280 0.509 21.97893 O ? A ? 90 O 1
   ATOM 2093 CB B LYS A 92 ? -4.84103 53.43904 20.51039 0.509 22.93065 C ? A ? 90 CB 1
   ATOM 2094 CG B LYS A 92 ? -4.46081 54.83543 20.01349 0.509 26.38597 C ? A ? 90 CG 1
   ATOM 2095 CD B LYS A 92 ? -3.28760 55.38888 20.82820 0.509 27.38660 C ? A ? 90 CD 1
   ATOM 2096 CE B LYS A 92 ? -2.82601 56.73226 20.29712 0.509 30.21777 C ? A ? 90 CE 1
   ATOM 2097 NZ B LYS A 92 ? -2.26211 56.61366 18.91847 0.509 28.81690 N ? A ? 90 NZ 1
   ATOM 2098 H B LYS A 92 ? -5.64607 51.23279 21.03478 0.509 27.02515 H ? A ? 90 H 1
   ATOM 2099 HA B LYS A 92 ? -6.78053 53.28180 19.85796 0.509 28.15878 H ? A ? 90 HA 1
   ATOM 2100 HB2 B LYS A 92 ? -5.08759 53.53038 21.44407 0.509 27.62833 H ? A ? 90 HB2 1
   ATOM 2101 HB3 B LYS A 92 ? -4.04814 52.88621 20.42919 0.509 27.62833 H ? A ? 90 HB3 1
   ATOM 2102 HG2 B LYS A 92 ? -4.19604 54.78867 19.08149 0.509 31.77471 H ? A ? 90 HG2 1
   ATOM 2103 HG3 B LYS A 92 ? -5.21739 55.43412 20.11380 0.509 31.77471 H ? A ? 90 HG3 1
   ATOM 2104 HD2 B LYS A 92 ? -3.56350 55.50444 21.75093 0.509 32.97547 H ? A ? 90 HD2 1
   ATOM 2105 HD3 B LYS A 92 ? -2.54250 54.76970 20.77978 0.509 32.97547 H ? A ? 90 HD3 1
   ATOM 2106 HE2 B LYS A 92 ? -3.58020 57.34149 20.26652 0.509 36.37287 H ? A ? 90 HE2 1
   ATOM 2107 HE3 B LYS A 92 ? -2.13602 57.08743 20.87907 0.509 36.37287 H ? A ? 90 HE3 1
   ATOM 2108 HZ1 B LYS A 92 ? -2.02358 57.41638 18.61706 0.509 34.69183 H ? A ? 90 HZ1 1
   ATOM 2109 HZ2 B LYS A 92 ? -1.54694 56.08398 18.92663 0.509 34.69183 H ? A ? 90 HZ2 1
   ATOM 2110 HZ3 B LYS A 92 ? -2.87118 56.26815 18.36915 0.509 34.69183 H ? A ? 90 HZ3 1
   ATOM 2111 N A LEU A 93 ? -4.84335 51.48155 17.84966 0.491 21.42291 N ? A ? 91 N 1
   ATOM 2112 CA A LEU A 93 ? -4.65331 51.12798 16.44744 0.491 22.14140 C ? A ? 91 CA 1
   ATOM 2113 C A LEU A 93 ? -5.97592 50.77284 15.78541 0.491 23.23485 C ? A ? 91 C 1
   ATOM 2114 O A LEU A 93 ? -6.24724 51.18148 14.64895 0.491 22.18072 O ? A ? 91 O 1
   ATOM 2115 CB A LEU A 93 ? -3.71291 49.92253 16.36343 0.491 21.92945 C ? A ? 91 CB 1
   ATOM 2116 CG A LEU A 93 ? -3.00404 49.67147 15.03830 0.491 19.82127 C ? A ? 91 CG 1
   ATOM 2117 CD1 A LEU A 93 ? -2.19605 50.90658 14.69361 0.491 19.69960 C ? A ? 91 CD1 1
   ATOM 2118 CD2 A LEU A 93 ? -2.08056 48.45847 15.07920 0.491 18.40654 C ? A ? 91 CD2 1
   ATOM 2119 H A LEU A 93 ? -4.37518 51.01822 18.40260 0.491 25.81905 H ? A ? 91 H 1
   ATOM 2120 HA A LEU A 93 ? -4.26442 51.88353 15.97968 0.491 26.68123 H ? A ? 91 HA 1
   ATOM 2121 HB2 A LEU A 93 ? -3.02137 50.03919 17.03355 0.491 26.42689 H ? A ? 91 HB2 1
   ATOM 2122 HB3 A LEU A 93 ? -4.23287 49.12718 16.55825 0.491 26.42689 H ? A ? 91 HB3 1
   ATOM 2123 HG A LEU A 93 ? -3.67254 49.48552 14.36049 0.491 23.89708 H ? A ? 91 HG 1
   ATOM 2124 HD11 A LEU A 93 ? -1.61210 50.70351 13.94617 0.491 23.75107 H ? A ? 91 HD11 1
   ATOM 2125 HD12 A LEU A 93 ? -2.80298 51.62421 14.45374 0.491 23.75107 H ? A ? 91 HD12 1
   ATOM 2126 HD13 A LEU A 93 ? -1.66800 51.16407 15.46546 0.491 23.75107 H ? A ? 91 HD13 1
   ATOM 2127 HD21 A LEU A 93 ? -1.85344 48.20372 14.17122 0.491 22.19940 H ? A ? 91 HD21 1
   ATOM 2128 HD22 A LEU A 93 ? -1.27593 48.69050 15.56873 0.491 22.19940 H ? A ? 91 HD22 1
   ATOM 2129 HD23 A LEU A 93 ? -2.53861 47.72766 15.52304 0.491 22.19940 H ? A ? 91 HD23 1
   ATOM 2130 N B LEU A 93 ? -4.92077 51.50270 17.96355 0.509 21.50978 N ? A ? 91 N 1
   ATOM 2131 CA B LEU A 93 ? -4.68587 51.20059 16.55543 0.509 22.10144 C ? A ? 91 CA 1
   ATOM 2132 C B LEU A 93 ? -5.98043 50.82620 15.83975 0.509 23.21214 C ? A ? 91 C 1
   ATOM 2133 O B LEU A 93 ? -6.21683 51.25115 14.70179 0.509 22.20913 O ? A ? 91 O 1
   ATOM 2134 CB B LEU A 93 ? -3.68225 50.04770 16.44845 0.509 21.95913 C ? A ? 91 CB 1
   ATOM 2135 CG B LEU A 93 ? -3.48249 49.40590 15.07350 0.509 20.94521 C ? A ? 91 CG 1
   ATOM 2136 CD1 B LEU A 93 ? -2.91471 50.49350 14.13314 0.509 22.04737 C ? A ? 91 CD1 1
   ATOM 2137 CD2 B LEU A 93 ? -2.62597 48.16484 15.10567 0.509 18.98300 C ? A ? 91 CD2 1
   ATOM 2138 H B LEU A 93 ? -4.53554 50.96817 18.51624 0.509 25.92328 H ? A ? 91 H 1
   ATOM 2139 HA B LEU A 93 ? -4.31873 51.98690 16.12204 0.509 26.63328 H ? A ? 91 HA 1
   ATOM 2140 HB2 B LEU A 93 ? -2.81632 50.38202 16.73003 0.509 26.46251 H ? A ? 91 HB2 1
   ATOM 2141 HB3 B LEU A 93 ? -3.97626 49.34290 17.04654 0.509 26.46251 H ? A ? 91 HB3 1
   ATOM 2142 HG B LEU A 93 ? -4.33233 49.08392 14.73441 0.509 25.24580 H ? A ? 91 HG 1
   ATOM 2143 HD11 B LEU A 93 ? -2.78802 50.11268 13.25006 0.509 26.56839 H ? A ? 91 HD11 1
   ATOM 2144 HD12 B LEU A 93 ? -3.54277 51.23135 14.08817 0.509 26.56839 H ? A ? 91 HD12 1
   ATOM 2145 HD13 B LEU A 93 ? -2.06537 50.80304 14.48484 0.509 26.56839 H ? A ? 91 HD13 1
   ATOM 2146 HD21 B LEU A 93 ? -2.53351 47.82147 14.20320 0.509 22.89115 H ? A ? 91 HD21 1
   ATOM 2147 HD22 B LEU A 93 ? -1.75376 48.39229 15.46402 0.509 22.89115 H ? A ? 91 HD22 1
   ATOM 2148 HD23 B LEU A 93 ? -3.05263 47.50121 15.66998 0.509 22.89115 H ? A ? 91 HD23 1
   ATOM 2149 N . SER A 94 ? -6.79886 49.97715 16.46330 1.000 20.71091 N ? A ? 92 N 1
   ATOM 2150 CA . SER A 94 ? -8.10175 49.63048 15.90176 1.000 22.43758 C ? A ? 92 CA 1
   ATOM 2151 C . SER A 94 ? -8.95370 50.86461 15.64726 1.000 22.98671 C ? A ? 92 C 1
   ATOM 2152 O . SER A 94 ? -9.55612 50.98231 14.58628 1.000 21.83838 O ? A ? 92 O 1
   ATOM 2153 CB . SER A 94 ? -8.86169 48.72670 16.83722 1.000 22.48624 C ? A ? 92 CB 1
   ATOM 2154 OG . SER A 94 ? -8.29151 47.43283 16.83591 1.000 23.99922 O ? A ? 92 OG 1
   ATOM 2155 HA . SER A 94 ? -7.93744 49.16895 15.06457 1.000 27.03665 H ? A ? 92 HA 1
   ATOM 2156 HB2 . SER A 94 ? -8.82143 49.09148 17.73511 1.000 27.09504 H ? A ? 92 HB2 1
   ATOM 2157 HB3 . SER A 94 ? -9.78445 48.66830 16.54392 1.000 27.09504 H ? A ? 92 HB3 1
   ATOM 2158 HG . SER A 94 ? -7.50224 47.46640 17.12142 1.000 28.91062 H ? A ? 92 HG 1
   ATOM 2159 H A SER A 94 ? -6.63188 49.63185 17.23303 0.491 24.96464 H ? A ? 92 H 1
   ATOM 2160 H B SER A 94 ? -6.62371 49.58932 17.21063 0.509 24.96464 H ? A ? 92 H 1
   ATOM 2161 N . ALA A 95 ? -8.98520 51.81375 16.59051 1.000 21.70462 N ? A ? 93 N 1
   ATOM 2162 CA . ALA A 95 ? -9.71417 53.05850 16.36265 1.000 23.76089 C ? A ? 93 CA 1
   ATOM 2163 C . ALA A 95 ? -9.19703 53.80334 15.14380 1.000 22.30495 C ? A ? 93 C 1
   ATOM 2164 O . ALA A 95 ? -9.98739 54.35944 14.36919 1.000 25.66369 O ? A ? 93 O 1
   ATOM 2165 CB . ALA A 95 ? -9.63238 53.91928 17.61609 1.000 27.58548 C ? A ? 93 CB 1
   ATOM 2166 H . ALA A 95 ? -8.59858 51.75993 17.35682 1.000 26.15710 H ? A ? 93 H 1
   ATOM 2167 HA . ALA A 95 ? -10.64711 52.85703 16.18966 1.000 28.62462 H ? A ? 93 HA 1
   ATOM 2168 HB1 . ALA A 95 ? -10.04452 54.77879 17.43637 1.000 33.21413 H ? A ? 93 HB1 1
   ATOM 2169 HB2 . ALA A 95 ? -10.10156 53.47187 18.33760 1.000 33.21413 H ? A ? 93 HB2 1
   ATOM 2170 HB3 . ALA A 95 ? -8.70019 54.04275 17.85413 1.000 33.21413 H ? A ? 93 HB3 1
   ATOM 2171 N . ALA A 96 ? -7.88124 53.89969 14.99325 1.000 23.01030 N ? A ? 94 N 1
   ATOM 2172 CA . ALA A 96 ? -7.31451 54.60556 13.85337 1.000 25.07092 C ? A ? 94 CA 1
   ATOM 2173 C . ALA A 96 ? -7.67766 53.92267 12.54840 1.000 26.33646 C ? A ? 94 C 1
   ATOM 2174 O . ALA A 96 ? -7.98682 54.58471 11.55118 1.000 24.95150 O ? A ? 94 O 1
   ATOM 2175 CB . ALA A 96 ? -5.79602 54.61335 13.98428 1.000 28.31690 C ? A ? 94 CB 1
   ATOM 2176 H . ALA A 96 ? -7.29914 53.56795 15.53242 1.000 27.72391 H ? A ? 94 H 1
   ATOM 2177 HA . ALA A 96 ? -7.65788 55.51270 13.84398 1.000 30.19665 H ? A ? 94 HA 1
   ATOM 2178 HB1 . ALA A 96 ? -5.42434 55.20836 13.31441 1.000 34.09183 H ? A ? 94 HB1 1
   ATOM 2179 HB2 . ALA A 96 ? -5.55713 54.92388 14.87164 1.000 34.09183 H ? A ? 94 HB2 1
   ATOM 2180 HB3 . ALA A 96 ? -5.46268 53.71265 13.84816 1.000 34.09183 H ? A ? 94 HB3 1
   ATOM 2181 N A ALA A 97 ? -7.59567 52.58586 12.52179 0.889 23.50268 N ? A ? 95 N 1
   ATOM 2182 CA A ALA A 97 ? -7.93824 51.84371 11.31631 0.889 22.85404 C ? A ? 95 CA 1
   ATOM 2183 C A ALA A 97 ? -9.40934 52.00700 10.98455 0.889 23.66790 C ? A ? 95 C 1
   ATOM 2184 O A ALA A 97 ? -9.77938 52.12722 9.81452 0.889 25.15197 O ? A ? 95 O 1
   ATOM 2185 CB A ALA A 97 ? -7.62385 50.35825 11.52458 0.889 21.33033 C ? A ? 95 CB 1
   ATOM 2186 H A ALA A 97 ? -7.34687 52.09559 13.18311 0.889 28.31476 H ? A ? 95 H 1
   ATOM 2187 HA A ALA A 97 ? -7.40921 52.17870 10.57550 0.889 27.53640 H ? A ? 95 HA 1
   ATOM 2188 HB1 A ALA A 97 ? -7.83422 49.87384 10.71096 0.889 25.70795 H ? A ? 95 HB1 1
   ATOM 2189 HB2 A ALA A 97 ? -6.68152 50.26111 11.73311 0.889 25.70795 H ? A ? 95 HB2 1
   ATOM 2190 HB3 A ALA A 97 ? -8.16144 50.02154 12.25841 0.889 25.70795 H ? A ? 95 HB3 1
   ATOM 2191 N B ALA A 97 ? -7.59268 52.59146 12.51595 0.111 23.61544 N ? A ? 95 N 1
   ATOM 2192 CA B ALA A 97 ? -7.92443 51.86416 11.29675 0.111 23.01795 C ? A ? 95 CA 1
   ATOM 2193 C B ALA A 97 ? -9.40697 51.98552 10.97525 0.111 23.91871 C ? A ? 95 C 1
   ATOM 2194 O B ALA A 97 ? -9.78965 52.08951 9.80430 0.111 25.18328 O ? A ? 95 O 1
   ATOM 2195 CB B ALA A 97 ? -7.53859 50.39379 11.44863 0.111 21.43066 C ? A ? 95 CB 1
   ATOM 2196 H B ALA A 97 ? -7.34961 52.09614 13.17563 0.111 28.45008 H ? A ? 95 H 1
   ATOM 2197 HA B ALA A 97 ? -7.41853 52.23936 10.55906 0.111 27.73309 H ? A ? 95 HA 1
   ATOM 2198 HB1 B ALA A 97 ? -7.74807 49.92566 10.62530 0.111 25.82835 H ? A ? 95 HB1 1
   ATOM 2199 HB2 B ALA A 97 ? -6.58764 50.33398 11.63038 0.111 25.82835 H ? A ? 95 HB2 1
   ATOM 2200 HB3 B ALA A 97 ? -8.04076 50.00989 12.18439 0.111 25.82835 H ? A ? 95 HB3 1
   ATOM 2201 N . ASP A 98 ? -10.25769 51.94825 12.00089 1.000 25.48002 N ? A ? 96 N 1
   ATOM 2202 CA . ASP A 98 ? -11.68205 52.13670 11.77686 1.000 26.86475 C ? A ? 96 CA 1
   ATOM 2203 C . ASP A 98 ? -11.98498 53.53877 11.25859 1.000 27.81094 C ? A ? 96 C 1
   ATOM 2204 O . ASP A 98 ? -12.87908 53.71128 10.42237 1.000 33.39653 O ? A ? 96 O 1
   ATOM 2205 CB . ASP A 98 ? -12.43228 51.83866 13.06852 1.000 29.91369 C ? A ? 96 CB 1
   ATOM 2206 CG . ASP A 98 ? -12.30285 50.36943 13.48919 1.000 37.27229 C ? A ? 96 CG 1
   ATOM 2207 OD1 . ASP A 98 ? -11.65052 49.57318 12.75655 1.000 32.78094 O ? A ? 96 OD1 1
   ATOM 2208 OD2 . ASP A 98 ? -12.84056 50.01027 14.56038 1.000 40.67362 O ? A ? 96 OD2 1
   ATOM 2209 HA . ASP A 98 ? -11.99783 51.51495 11.10260 1.000 32.34925 H ? A ? 96 HA 1
   ATOM 2210 HB2 . ASP A 98 ? -12.07124 52.38972 13.78048 1.000 36.00798 H ? A ? 96 HB2 1
   ATOM 2211 HB3 . ASP A 98 ? -13.37377 52.03491 12.94207 1.000 36.00798 H ? A ? 96 HB3 1
   ATOM 2212 H A ASP A 98 ? -10.03807 51.80258 12.81952 0.889 30.68757 H ? A ? 96 H 1
   ATOM 2213 H B ASP A 98 ? -10.03630 51.81741 12.82154 0.111 30.68757 H ? A ? 96 H 1
   ATOM 2214 N A ALA A 99 ? -11.25649 54.54882 11.73037 0.213 27.35540 N ? A ? 97 N 1
   ATOM 2215 CA A ALA A 99 ? -11.47730 55.90993 11.25983 0.213 31.06464 C ? A ? 97 CA 1
   ATOM 2216 C A ALA A 99 ? -10.92811 56.14282 9.85857 0.213 31.74609 C ? A ? 97 C 1
   ATOM 2217 O A ALA A 99 ? -11.33597 57.10697 9.20089 0.213 32.97907 O ? A ? 97 O 1
   ATOM 2218 CB A ALA A 99 ? -10.84882 56.90524 12.23408 0.213 32.99275 C ? A ? 97 CB 1
   ATOM 2219 H A ALA A 99 ? -10.63383 54.47113 12.31847 0.213 32.93804 H ? A ? 97 H 1
   ATOM 2220 HA A ALA A 99 ? -12.43175 56.08080 11.23296 0.213 37.38913 H ? A ? 97 HA 1
   ATOM 2221 HB1 A ALA A 99 ? -11.00291 57.80593 11.90862 0.213 39.70285 H ? A ? 97 HB1 1
   ATOM 2222 HB2 A ALA A 99 ? -11.25787 56.79431 13.10659 0.213 39.70285 H ? A ? 97 HB2 1
   ATOM 2223 HB3 A ALA A 99 ? -9.89601 56.73262 12.29109 0.213 39.70285 H ? A ? 97 HB3 1
   ATOM 2224 N B ALA A 99 ? -11.24744 54.54388 11.72510 0.787 27.20436 N ? A ? 97 N 1
   ATOM 2225 CA B ALA A 99 ? -11.46139 55.91076 11.26873 0.787 31.12479 C ? A ? 97 CA 1
   ATOM 2226 C B ALA A 99 ? -10.90631 56.15664 9.87408 0.787 31.74547 C ? A ? 97 C 1
   ATOM 2227 O B ALA A 99 ? -11.30496 57.13284 9.22754 0.787 32.99170 O ? A ? 97 O 1
   ATOM 2228 CB B ALA A 99 ? -10.84086 56.88894 12.26235 0.787 33.01210 C ? A ? 97 CB 1
   ATOM 2229 H B ALA A 99 ? -10.61835 54.45927 12.30534 0.787 32.75678 H ? A ? 97 H 1
   ATOM 2230 HA B ALA A 99 ? -12.41445 56.08811 11.23502 0.787 37.46130 H ? A ? 97 HA 1
   ATOM 2231 HB1 B ALA A 99 ? -10.99563 57.79489 11.95220 0.787 39.72607 H ? A ? 97 HB1 1
   ATOM 2232 HB2 B ALA A 99 ? -11.25382 56.76152 13.13076 0.787 39.72607 H ? A ? 97 HB2 1
   ATOM 2233 HB3 B ALA A 99 ? -9.88790 56.71763 12.32091 0.787 39.72607 H ? A ? 97 HB3 1
   ATOM 2234 N . GLY A 100 ? -10.03596 55.27733 9.38126 1.000 28.67731 N ? A ? 98 N 1
   ATOM 2235 CA . GLY A 100 ? -9.47302 55.43570 8.05488 1.000 28.56502 C ? A ? 98 CA 1
   ATOM 2236 C . GLY A 100 ? -8.54835 56.62011 7.87741 1.000 32.05073 C ? A ? 98 C 1
   ATOM 2237 O . GLY A 100 ? -8.47612 57.18735 6.78110 1.000 31.09659 O ? A ? 98 O 1
   ATOM 2238 HA2 . GLY A 100 ? -8.96982 54.63584 7.83599 1.000 34.38958 H ? A ? 98 HA2 1
   ATOM 2239 HA3 . GLY A 100 ? -10.20053 55.53447 7.42095 1.000 34.38958 H ? A ? 98 HA3 1
   ATOM 2240 H A GLY A 100 ? -9.74326 54.59144 9.80960 0.213 34.52433 H ? A ? 98 H 1
   ATOM 2241 H B GLY A 100 ? -9.75751 54.57986 9.80031 0.787 34.52433 H ? A ? 98 H 1
   ATOM 2242 N . ASP A 101 ? -7.77343 56.96309 8.89165 1.000 32.84949 N ? A ? 99 N 1
   ATOM 2243 CA . ASP A 101 ? -6.86924 58.09708 8.80288 1.000 36.83424 C ? A ? 99 CA 1
   ATOM 2244 C . ASP A 101 ? -5.43349 57.60990 8.92977 1.000 32.54329 C ? A ? 99 C 1
   ATOM 2245 O . ASP A 101 ? -5.05015 57.04999 9.96519 1.000 28.86190 O ? A ? 99 O 1
   ATOM 2246 CB . ASP A 101 ? -7.20631 59.14922 9.85588 1.000 42.75199 C ? A ? 99 CB 1
   ATOM 2247 CG . ASP A 101 ? -6.03902 60.00204 10.17013 1.000 51.41236 C ? A ? 99 CG 1
   ATOM 2248 OD1 . ASP A 101 ? -5.74834 60.23568 11.32042 1.000 55.17518 O ? A ? 99 OD1 1
   ATOM 2249 OD2 . ASP A 101 ? -5.33763 60.45188 9.30062 1.000 53.27754 O ? A ? 99 OD2 1
   ATOM 2250 H . ASP A 101 ? -7.75320 56.55184 9.64668 1.000 39.53094 H ? A ? 99 H 1
   ATOM 2251 HA . ASP A 101 ? -6.95553 58.51327 7.93097 1.000 44.31264 H ? A ? 99 HA 1
   ATOM 2252 HB2 . ASP A 101 ? -7.91828 59.71808 9.52363 1.000 51.41394 H ? A ? 99 HB2 1
   ATOM 2253 HB3 . ASP A 101 ? -7.48851 58.70679 10.67167 1.000 51.41394 H ? A ? 99 HB3 1
   ATOM 2254 N . LEU A 102 ? -4.64877 57.84779 7.88177 1.000 31.47627 N ? A ? 100 N 1
   ATOM 2255 CA . LEU A 102 ? -3.28672 57.34125 7.85472 1.000 32.27467 C ? A ? 100 CA 1
   ATOM 2256 C . LEU A 102 ? -2.40608 58.01239 8.89662 1.000 33.18362 C ? A ? 100 C 1
   ATOM 2257 O . LEU A 102 ? -1.48601 57.37785 9.41054 1.000 30.26562 O ? A ? 100 O 1
   ATOM 2258 CB . LEU A 102 ? -2.67519 57.47111 6.46346 1.000 31.24027 C ? A ? 100 CB 1
   ATOM 2259 CG . LEU A 102 ? -1.23438 56.97533 6.31850 1.000 30.37505 C ? A ? 100 CG 1
   ATOM 2260 CD1 . LEU A 102 ? -1.07580 55.52477 6.74113 1.000 29.28579 C ? A ? 100 CD1 1
   ATOM 2261 CD2 . LEU A 102 ? -0.77221 57.14498 4.86839 1.000 33.17440 C ? A ? 100 CD2 1
   ATOM 2262 H . LEU A 102 ? -4.87986 58.29415 7.18394 1.000 37.88307 H ? A ? 100 H 1
   ATOM 2263 HA . LEU A 102 ? -3.31937 56.39410 8.06149 1.000 38.84115 H ? A ? 100 HA 1
   ATOM 2264 HB2 . LEU A 102 ? -3.21923 56.95949 5.84446 1.000 37.59988 H ? A ? 100 HB2 1
   ATOM 2265 HB3 . LEU A 102 ? -2.68321 58.40881 6.21535 1.000 37.59988 H ? A ? 100 HB3 1
   ATOM 2266 HG . LEU A 102 ? -0.67499 57.50608 6.90696 1.000 36.56161 H ? A ? 100 HG 1
   ATOM 2267 HD11 . LEU A 102 ? -0.19151 55.21690 6.48783 1.000 35.25450 H ? A ? 100 HD11 1
   ATOM 2268 HD12 . LEU A 102 ? -1.18487 55.46233 7.70295 1.000 35.25450 H ? A ? 100 HD12 1
   ATOM 2269 HD13 . LEU A 102 ? -1.75212 54.99044 6.29616 1.000 35.25450 H ? A ? 100 HD13 1
   ATOM 2270 HD21 . LEU A 102 ? 0.14580 56.84116 4.79193 1.000 39.92084 H ? A ? 100 HD21 1
   ATOM 2271 HD22 . LEU A 102 ? -1.34474 56.61652 4.29059 1.000 39.92084 H ? A ? 100 HD22 1
   ATOM 2272 HD23 . LEU A 102 ? -0.83178 58.08220 4.62554 1.000 39.92084 H ? A ? 100 HD23 1
   ATOM 2273 N A ASP A 103 ? -2.68705 59.27701 9.24671 0.396 35.16467 N ? A ? 101 N 1
   ATOM 2274 CA A ASP A 103 ? -1.86744 59.94371 10.26298 0.396 34.98788 C ? A ? 101 CA 1
   ATOM 2275 C A ASP A 103 ? -2.01102 59.25940 11.61462 0.396 32.11798 C ? A ? 101 C 1
   ATOM 2276 O A ASP A 103 ? -1.01547 58.91405 12.25669 0.396 29.19759 O ? A ? 101 O 1
   ATOM 2277 CB A ASP A 103 ? -2.23006 61.41556 10.45102 0.396 38.23845 C ? A ? 101 CB 1
   ATOM 2278 CG A ASP A 103 ? -2.88305 62.00688 9.25217 0.396 42.01026 C ? A ? 101 CG 1
   ATOM 2279 OD1 A ASP A 103 ? -2.38758 61.75367 8.11882 0.396 43.58887 O ? A ? 101 OD1 1
   ATOM 2280 OD2 A ASP A 103 ? -3.91723 62.66749 9.49965 0.396 45.67383 O ? A ? 101 OD2 1
   ATOM 2281 H A ASP A 103 ? -3.32507 59.75284 8.92096 0.396 42.30916 H ? A ? 101 H 1
   ATOM 2282 HA A ASP A 103 ? -0.95462 59.89610 9.93833 0.396 42.09700 H ? A ? 101 HA 1
   ATOM 2283 HB2 A ASP A 103 ? -2.84428 61.49664 11.19738 0.396 45.99769 H ? A ? 101 HB2 1
   ATOM 2284 HB3 A ASP A 103 ? -1.42107 61.91965 10.63084 0.396 45.99769 H ? A ? 101 HB3 1
   ATOM 2285 N B ASP A 103 ? -2.63587 59.29076 9.19859 0.604 35.16358 N ? A ? 101 N 1
   ATOM 2286 CA B ASP A 103 ? -1.83130 59.93819 10.22991 0.604 34.98605 C ? A ? 101 CA 1
   ATOM 2287 C B ASP A 103 ? -2.06049 59.29501 11.58905 0.604 32.11901 C ? A ? 101 C 1
   ATOM 2288 O B ASP A 103 ? -1.10606 59.02288 12.32610 0.604 29.20215 O ? A ? 101 O 1
   ATOM 2289 CB B ASP A 103 ? -2.15181 61.43012 10.29476 0.604 38.20637 C ? A ? 101 CB 1
   ATOM 2290 CG B ASP A 103 ? -1.29898 62.24369 9.34986 0.604 41.05817 C ? A ? 101 CG 1
   ATOM 2291 OD1 B ASP A 103 ? -1.42757 62.04102 8.12259 0.604 44.08333 O ? A ? 101 OD1 1
   ATOM 2292 OD2 B ASP A 103 ? -0.49719 63.07772 9.83115 0.604 41.52724 O ? A ? 101 OD2 1
   ATOM 2293 H B ASP A 103 ? -3.23317 59.78931 8.83215 0.604 42.30785 H ? A ? 101 H 1
   ATOM 2294 HA B ASP A 103 ? -0.89493 59.84000 9.99651 0.604 42.09481 H ? A ? 101 HA 1
   ATOM 2295 HB2 B ASP A 103 ? -3.08168 61.56582 10.05428 0.604 45.95920 H ? A ? 101 HB2 1
   ATOM 2296 HB3 B ASP A 103 ? -1.99220 61.75024 11.19640 0.604 45.95920 H ? A ? 101 HB3 1
   ATOM 2297 N A LYS A 104 ? -3.25109 59.10688 12.08358 0.396 32.03223 N ? A ? 102 N 1
   ATOM 2298 CA A LYS A 104 ? -3.51767 58.44974 13.35531 0.396 30.48019 C ? A ? 102 CA 1
   ATOM 2299 C A LYS A 104 ? -3.11111 56.98277 13.31581 0.396 28.12771 C ? A ? 102 C 1
   ATOM 2300 O A LYS A 104 ? -2.64609 56.44439 14.32444 0.396 26.01423 O ? A ? 102 O 1
   ATOM 2301 CB A LYS A 104 ? -5.00860 58.59395 13.64799 0.396 33.03516 C ? A ? 102 CB 1
   ATOM 2302 CG A LYS A 104 ? -5.50421 58.07557 14.96678 0.396 33.96046 C ? A ? 102 CG 1
   ATOM 2303 CD A LYS A 104 ? -7.01023 58.30173 15.07195 0.396 36.15112 C ? A ? 102 CD 1
   ATOM 2304 CE A LYS A 104 ? -7.61596 57.34162 16.12941 0.396 33.54745 C ? A ? 102 CE 1
   ATOM 2305 NZ A LYS A 104 ? -9.08180 57.54099 16.43845 0.396 33.67417 N ? A ? 102 NZ 1
   ATOM 2306 H A LYS A 104 ? -3.95987 59.37828 11.67913 0.396 38.55022 H ? A ? 102 H 1
   ATOM 2307 HA A LYS A 104 ? -3.01047 58.86571 14.06988 0.396 36.68778 H ? A ? 102 HA 1
   ATOM 2308 HB2 A LYS A 104 ? -5.22850 59.53818 13.61670 0.396 39.75374 H ? A ? 102 HB2 1
   ATOM 2309 HB3 A LYS A 104 ? -5.49533 58.11691 12.95776 0.396 39.75374 H ? A ? 102 HB3 1
   ATOM 2310 HG2 A LYS A 104 ? -5.32513 57.12464 15.03434 0.396 40.86410 H ? A ? 102 HG2 1
   ATOM 2311 HG3 A LYS A 104 ? -5.06548 58.54809 15.69144 0.396 40.86410 H ? A ? 102 HG3 1
   ATOM 2312 HD2 A LYS A 104 ? -7.18572 59.21598 15.34443 0.396 43.49290 H ? A ? 102 HD2 1
   ATOM 2313 HD3 A LYS A 104 ? -7.42845 58.12493 14.21479 0.396 43.49290 H ? A ? 102 HD3 1
   ATOM 2314 HE2 A LYS A 104 ? -7.51197 56.43187 15.80934 0.396 40.36849 H ? A ? 102 HE2 1
   ATOM 2315 HE3 A LYS A 104 ? -7.12964 57.45855 16.96051 0.396 40.36849 H ? A ? 102 HE3 1
   ATOM 2316 HZ1 A LYS A 104 ? -9.39137 56.84917 16.90498 0.396 40.52056 H ? A ? 102 HZ1 1
   ATOM 2317 HZ2 A LYS A 104 ? -9.19407 58.28420 16.91503 0.396 40.52056 H ? A ? 102 HZ2 1
   ATOM 2318 HZ3 A LYS A 104 ? -9.54570 57.61007 15.68206 0.396 40.52056 H ? A ? 102 HZ3 1
   ATOM 2319 N B LYS A 104 ? -3.32367 59.06274 11.94793 0.604 32.05536 N ? A ? 102 N 1
   ATOM 2320 CA B LYS A 104 ? -3.62083 58.38068 13.19911 0.604 30.35684 C ? A ? 102 CA 1
   ATOM 2321 C B LYS A 104 ? -3.09141 56.94727 13.18648 0.604 28.09481 C ? A ? 102 C 1
   ATOM 2322 O B LYS A 104 ? -2.64114 56.44836 14.22268 0.604 25.99710 O ? A ? 102 O 1
   ATOM 2323 CB B LYS A 104 ? -5.13114 58.38541 13.45994 0.604 32.97092 C ? A ? 102 CB 1
   ATOM 2324 CG B LYS A 104 ? -5.73292 59.73492 13.91624 0.604 34.38353 C ? A ? 102 CG 1
   ATOM 2325 CD B LYS A 104 ? -7.23089 59.78502 13.55342 0.604 38.89347 C ? A ? 102 CD 1
   ATOM 2326 CE B LYS A 104 ? -7.85264 61.12676 13.87944 0.604 40.79466 C ? A ? 102 CE 1
   ATOM 2327 NZ B LYS A 104 ? -7.82340 61.40559 15.32113 0.604 40.41421 N ? A ? 102 NZ 1
   ATOM 2328 H B LYS A 104 ? -4.01549 59.28784 11.48933 0.604 38.57798 H ? A ? 102 H 1
   ATOM 2329 HA B LYS A 104 ? -3.19279 58.85871 13.92655 0.604 36.53975 H ? A ? 102 HA 1
   ATOM 2330 HB2 B LYS A 104 ? -5.58179 58.13313 12.63886 0.604 39.67666 H ? A ? 102 HB2 1
   ATOM 2331 HB3 B LYS A 104 ? -5.32111 57.73656 14.15550 0.604 39.67666 H ? A ? 102 HB3 1
   ATOM 2332 HG2 B LYS A 104 ? -5.64103 59.82694 14.87748 0.604 41.37178 H ? A ? 102 HG2 1
   ATOM 2333 HG3 B LYS A 104 ? -5.27831 60.46524 13.46808 0.604 41.37178 H ? A ? 102 HG3 1
   ATOM 2334 HD2 B LYS A 104 ? -7.33391 59.62752 12.60185 0.604 46.78372 H ? A ? 102 HD2 1
   ATOM 2335 HD3 B LYS A 104 ? -7.70359 59.10296 14.05567 0.604 46.78372 H ? A ? 102 HD3 1
   ATOM 2336 HE2 B LYS A 104 ? -7.35919 61.82709 13.42453 0.604 49.06515 H ? A ? 102 HE2 1
   ATOM 2337 HE3 B LYS A 104 ? -8.77786 61.12994 13.58814 0.604 49.06515 H ? A ? 102 HE3 1
   ATOM 2338 HZ1 B LYS A 104 ? -8.11959 62.23011 15.47777 0.604 48.60861 H ? A ? 102 HZ1 1
   ATOM 2339 HZ2 B LYS A 104 ? -8.34138 60.82552 15.75392 0.604 48.60861 H ? A ? 102 HZ2 1
   ATOM 2340 HZ3 B LYS A 104 ? -6.99104 61.33451 15.62809 0.604 48.60861 H ? A ? 102 HZ3 1
   ATOM 2341 N A LEU A 105 ? -3.28615 56.32317 12.16840 0.396 25.17738 N ? A ? 103 N 1
   ATOM 2342 CA A LEU A 105 ? -2.78812 54.96100 12.01669 0.396 25.40955 C ? A ? 103 CA 1
   ATOM 2343 C A LEU A 105 ? -1.27798 54.91355 12.19109 0.396 24.58352 C ? A ? 103 C 1
   ATOM 2344 O A LEU A 105 ? -0.75370 54.01687 12.85902 0.396 23.48045 O ? A ? 103 O 1
   ATOM 2345 CB A LEU A 105 ? -3.16909 54.42557 10.63681 0.396 25.36774 C ? A ? 103 CB 1
   ATOM 2346 CG A LEU A 105 ? -3.17891 52.91986 10.37870 0.396 25.52823 C ? A ? 103 CG 1
   ATOM 2347 CD1 A LEU A 105 ? -4.14674 52.26214 11.31701 0.396 23.72057 C ? A ? 103 CD1 1
   ATOM 2348 CD2 A LEU A 105 ? -3.53042 52.68111 8.92197 0.396 26.00787 C ? A ? 103 CD2 1
   ATOM 2349 H A LEU A 105 ? -3.68409 56.63870 11.47437 0.396 30.32440 H ? A ? 103 H 1
   ATOM 2350 HA A LEU A 105 ? -3.19564 54.39710 12.69259 0.396 30.60301 H ? A ? 103 HA 1
   ATOM 2351 HB2 A LEU A 105 ? -4.06737 54.73799 10.44605 0.396 30.55284 H ? A ? 103 HB2 1
   ATOM 2352 HB3 A LEU A 105 ? -2.54369 54.80459 9.99953 0.396 30.55284 H ? A ? 103 HB3 1
   ATOM 2353 HG A LEU A 105 ? -2.31005 52.52077 10.54215 0.396 30.74543 H ? A ? 103 HG 1
   ATOM 2354 HD11 A LEU A 105 ? -4.30518 51.35223 11.02058 0.396 28.57624 H ? A ? 103 HD11 1
   ATOM 2355 HD12 A LEU A 105 ? -3.76764 52.25787 12.20985 0.396 28.57624 H ? A ? 103 HD12 1
   ATOM 2356 HD13 A LEU A 105 ? -4.97870 52.76086 11.31327 0.396 28.57624 H ? A ? 103 HD13 1
   ATOM 2357 HD21 A LEU A 105 ? -2.98845 51.95215 8.58170 0.396 31.32100 H ? A ? 103 HD21 1
   ATOM 2358 HD22 A LEU A 105 ? -4.47082 52.45223 8.85744 0.396 31.32100 H ? A ? 103 HD22 1
   ATOM 2359 HD23 A LEU A 105 ? -3.35145 53.48991 8.41727 0.396 31.32100 H ? A ? 103 HD23 1
   ATOM 2360 N B LEU A 105 ? -3.15432 56.27353 12.03426 0.604 25.06380 N ? A ? 103 N 1
   ATOM 2361 CA B LEU A 105 ? -2.58558 54.93173 11.92959 0.604 25.26807 C ? A ? 103 CA 1
   ATOM 2362 C B LEU A 105 ? -1.09681 54.93110 12.25379 0.604 24.57644 C ? A ? 103 C 1
   ATOM 2363 O B LEU A 105 ? -0.61437 54.05145 12.97557 0.604 23.48099 O ? A ? 103 O 1
   ATOM 2364 CB B LEU A 105 ? -2.82482 54.36371 10.52745 0.604 25.39487 C ? A ? 103 CB 1
   ATOM 2365 CG B LEU A 105 ? -2.55382 52.86785 10.33326 0.604 23.95912 C ? A ? 103 CG 1
   ATOM 2366 CD1 B LEU A 105 ? -3.67102 52.14932 11.07408 0.604 23.20617 C ? A ? 103 CD1 1
   ATOM 2367 CD2 B LEU A 105 ? -2.52626 52.52556 8.87422 0.604 24.63696 C ? A ? 103 CD2 1
   ATOM 2368 H B LEU A 105 ? -3.51524 56.56709 11.31096 0.604 30.18811 H ? A ? 103 H 1
   ATOM 2369 HA B LEU A 105 ? -3.03386 54.35714 12.56974 0.604 30.43324 H ? A ? 103 HA 1
   ATOM 2370 HB2 B LEU A 105 ? -3.75477 54.51594 10.29744 0.604 30.58539 H ? A ? 103 HB2 1
   ATOM 2371 HB3 B LEU A 105 ? -2.24804 54.83929 9.90936 0.604 30.58539 H ? A ? 103 HB3 1
   ATOM 2372 HG B LEU A 105 ? -1.69034 52.59262 10.67903 0.604 28.86250 H ? A ? 103 HG 1
   ATOM 2373 HD11 B LEU A 105 ? -3.59033 51.19524 10.91876 0.604 27.95896 H ? A ? 103 HD11 1
   ATOM 2374 HD12 B LEU A 105 ? -3.59332 52.33780 12.02242 0.604 27.95896 H ? A ? 103 HD12 1
   ATOM 2375 HD13 B LEU A 105 ? -4.52533 52.46734 10.74254 0.604 27.95896 H ? A ? 103 HD13 1
   ATOM 2376 HD21 B LEU A 105 ? -2.29085 51.58994 8.77373 0.604 29.67591 H ? A ? 103 HD21 1
   ATOM 2377 HD22 B LEU A 105 ? -3.40410 52.68835 8.49502 0.604 29.67591 H ? A ? 103 HD22 1
   ATOM 2378 HD23 B LEU A 105 ? -1.86641 53.08205 8.43170 0.604 29.67591 H ? A ? 103 HD23 1
   ATOM 2379 N A ARG A 106 ? -0.55723 55.86547 11.58882 0.396 25.29349 N ? A ? 104 N 1
   ATOM 2380 CA A ARG A 106 ? 0.90024 55.86808 11.68434 0.396 24.60761 C ? A ? 104 CA 1
   ATOM 2381 C A ARG A 106 ? 1.35371 55.97828 13.13326 0.396 23.50164 C ? A ? 104 C 1
   ATOM 2382 O A ARG A 106 ? 2.28724 55.28525 13.56210 0.396 22.61104 O ? A ? 104 O 1
   ATOM 2383 CB A ARG A 106 ? 1.48195 57.04902 10.90599 0.396 27.51201 C ? A ? 104 CB 1
   ATOM 2384 CG A ARG A 106 ? 1.59946 56.88180 9.41159 0.396 29.97809 C ? A ? 104 CG 1
   ATOM 2385 CD A ARG A 106 ? 2.77371 57.72168 8.88131 0.396 33.36290 C ? A ? 104 CD 1
   ATOM 2386 NE A ARG A 106 ? 2.95499 58.97443 9.61554 0.396 35.41194 N ? A ? 104 NE 1
   ATOM 2387 CZ A ARG A 106 ? 4.05915 59.71239 9.58487 0.396 35.77396 C ? A ? 104 CZ 1
   ATOM 2388 NH1 A ARG A 106 ? 5.09117 59.38352 8.82750 0.396 35.76198 N ? A ? 104 NH1 1
   ATOM 2389 NH2 A ARG A 106 ? 4.13005 60.81026 10.33411 0.396 34.55374 N ? A ? 104 NH2 1
   ATOM 2390 H A ARG A 106 ? -0.88557 56.51138 11.12558 0.396 30.46374 H ? A ? 104 H 1
   ATOM 2391 HA A ARG A 106 ? 1.22408 55.03772 11.30155 0.396 29.64068 H ? A ? 104 HA 1
   ATOM 2392 HB2 A ARG A 106 ? 0.91455 57.82024 11.06148 0.396 33.12597 H ? A ? 104 HB2 1
   ATOM 2393 HB3 A ARG A 106 ? 2.37500 57.22076 11.24341 0.396 33.12597 H ? A ? 104 HB3 1
   ATOM 2394 HG2 A ARG A 106 ? 1.76188 55.94959 9.19829 0.396 36.08527 H ? A ? 104 HG2 1
   ATOM 2395 HG3 A ARG A 106 ? 0.78281 57.18272 8.98331 0.396 36.08527 H ? A ? 104 HG3 1
   ATOM 2396 HD2 A ARG A 106 ? 3.59183 57.20677 8.96165 0.396 40.14704 H ? A ? 104 HD2 1
   ATOM 2397 HD3 A ARG A 106 ? 2.60997 57.94130 7.95080 0.396 40.14704 H ? A ? 104 HD3 1
   ATOM 2398 HE A ARG A 106 ? 2.30137 59.25219 10.10055 0.396 42.60588 H ? A ? 104 HE 1
   ATOM 2399 HH11 A ARG A 106 ? 5.05791 58.67673 8.33869 0.396 43.02593 H ? A ? 104 HH11 1
   ATOM 2400 HH12 A ARG A 106 ? 5.79596 59.87633 8.82349 0.396 43.02593 H ? A ? 104 HH12 1
   ATOM 2401 HH21 A ARG A 106 ? 3.46531 61.03529 10.83119 0.396 41.57604 H ? A ? 104 HH21 1
   ATOM 2402 HH22 A ARG A 106 ? 4.84059 61.29458 10.32111 0.396 41.57604 H ? A ? 104 HH22 1
   ATOM 2403 N B ARG A 106 ? -0.34287 55.89379 11.71382 0.604 24.81812 N ? A ? 104 N 1
   ATOM 2404 CA B ARG A 106 ? 1.10119 55.91304 11.92988 0.604 24.09503 C ? A ? 104 CA 1
   ATOM 2405 C B ARG A 106 ? 1.42378 56.04660 13.40819 0.604 23.27004 C ? A ? 104 C 1
   ATOM 2406 O B ARG A 106 ? 2.29268 55.34107 13.93929 0.604 22.35198 O ? A ? 104 O 1
   ATOM 2407 CB B ARG A 106 ? 1.72040 57.10173 11.18896 0.604 27.16843 C ? A ? 104 CB 1
   ATOM 2408 CG B ARG A 106 ? 2.09741 56.88285 9.73773 0.604 29.24845 C ? A ? 104 CG 1
   ATOM 2409 CD B ARG A 106 ? 3.26518 57.79470 9.31143 0.604 33.51677 C ? A ? 104 CD 1
   ATOM 2410 NE B ARG A 106 ? 3.28549 59.09844 9.97703 0.604 35.60505 N ? A ? 104 NE 1
   ATOM 2411 CZ B ARG A 106 ? 4.23129 60.01487 9.79441 0.604 35.74015 C ? A ? 104 CZ 1
   ATOM 2412 NH1 B ARG A 106 ? 5.21081 59.83475 8.92573 0.604 35.60177 N ? A ? 104 NH1 1
   ATOM 2413 NH2 B ARG A 106 ? 4.19392 61.14195 10.50133 0.604 34.30861 N ? A ? 104 NH2 1
   ATOM 2414 H B ARG A 106 ? -0.64042 56.53660 11.22611 0.604 29.89330 H ? A ? 104 H 1
   ATOM 2415 HA B ARG A 106 ? 1.47308 55.08509 11.58768 0.604 29.02559 H ? A ? 104 HA 1
   ATOM 2416 HB2 B ARG A 106 ? 1.08249 57.83221 11.20832 0.604 32.71367 H ? A ? 104 HB2 1
   ATOM 2417 HB3 B ARG A 106 ? 2.53117 57.35682 11.65637 0.604 32.71367 H ? A ? 104 HB3 1
   ATOM 2418 HG2 B ARG A 106 ? 2.36998 55.96040 9.61251 0.604 35.20969 H ? A ? 104 HG2 1
   ATOM 2419 HG3 B ARG A 106 ? 1.33368 57.08256 9.17405 0.604 35.20969 H ? A ? 104 HG3 1
   ATOM 2420 HD2 B ARG A 106 ? 4.10026 57.34676 9.51854 0.604 40.33167 H ? A ? 104 HD2 1
   ATOM 2421 HD3 B ARG A 106 ? 3.20202 57.95393 8.35667 0.604 40.33167 H ? A ? 104 HD3 1
   ATOM 2422 HE B ARG A 106 ? 2.64514 59.28324 10.52054 0.604 42.83762 H ? A ? 104 HE 1
   ATOM 2423 HH11 B ARG A 106 ? 5.24691 59.11121 8.46228 0.604 42.83367 H ? A ? 104 HH11 1
   ATOM 2424 HH12 B ARG A 106 ? 5.81213 60.44108 8.82387 0.604 42.83367 H ? A ? 104 HH12 1
   ATOM 2425 HH21 B ARG A 106 ? 3.56199 61.27213 11.06995 0.604 41.28189 H ? A ? 104 HH21 1
   ATOM 2426 HH22 B ARG A 106 ? 4.80170 61.74003 10.38950 0.604 41.28189 H ? A ? 104 HH22 1
   ATOM 2427 N A ALA A 107 ? 0.74947 56.90387 13.88336 0.396 24.75658 N ? A ? 105 N 1
   ATOM 2428 CA A ALA A 107 ? 1.14112 57.11771 15.27076 0.396 24.10016 C ? A ? 105 CA 1
   ATOM 2429 C A ALA A 107 ? 0.79039 55.90795 16.12735 0.396 24.07739 C ? A ? 105 C 1
   ATOM 2430 O A ALA A 107 ? 1.62980 55.41086 16.87713 0.396 23.57378 O ? A ? 105 O 1
   ATOM 2431 CB A ALA A 107 ? 0.47527 58.38801 15.81058 0.396 24.95833 C ? A ? 105 CB 1
   ATOM 2432 H A ALA A 107 ? 0.11443 57.41629 13.61180 0.396 29.81945 H ? A ? 105 H 1
   ATOM 2433 HA A ALA A 107 ? 2.10174 57.24481 15.31493 0.396 29.03174 H ? A ? 105 HA 1
   ATOM 2434 HB1 A ALA A 107 ? 0.75032 58.52198 16.73107 0.396 30.06155 H ? A ? 105 HB1 1
   ATOM 2435 HB2 A ALA A 107 ? 0.75185 59.14396 15.26934 0.396 30.06155 H ? A ? 105 HB2 1
   ATOM 2436 HB3 A ALA A 107 ? -0.48800 58.28341 15.76507 0.396 30.06155 H ? A ? 105 HB3 1
   ATOM 2437 N B ALA A 107 ? 0.78103 57.00272 14.07561 0.604 24.62890 N ? A ? 105 N 1
   ATOM 2438 CA B ALA A 107 ? 1.06834 57.23944 15.48245 0.604 24.10371 C ? A ? 105 CA 1
   ATOM 2439 C B ALA A 107 ? 0.69477 56.03275 16.32503 0.604 24.41059 C ? A ? 105 C 1
   ATOM 2440 O B ALA A 107 ? 1.42563 55.66193 17.24665 0.604 23.70703 O ? A ? 105 O 1
   ATOM 2441 CB B ALA A 107 ? 0.30908 58.48139 15.95416 0.604 24.94914 C ? A ? 105 CB 1
   ATOM 2442 H B ALA A 107 ? 0.18214 57.52067 13.73995 0.604 29.66623 H ? A ? 105 H 1
   ATOM 2443 HA B ALA A 107 ? 2.01836 57.39982 15.59491 0.604 29.03600 H ? A ? 105 HA 1
   ATOM 2444 HB1 B ALA A 107 ? 0.50368 58.63315 16.89225 0.604 30.05052 H ? A ? 105 HB1 1
   ATOM 2445 HB2 B ALA A 107 ? 0.59560 59.24505 15.42915 0.604 30.05052 H ? A ? 105 HB2 1
   ATOM 2446 HB3 B ALA A 107 ? -0.64213 58.33493 15.83315 0.604 30.05052 H ? A ? 105 HB3 1
   ATOM 2447 N . ALA A 108 ? -0.45145 55.43563 16.04626 1.000 21.89201 N ? A ? 106 N 1
   ATOM 2448 CA . ALA A 108 ? -0.84780 54.24000 16.78439 1.000 23.43115 C ? A ? 106 CA 1
   ATOM 2449 C . ALA A 108 ? 0.08319 53.05618 16.49341 1.000 22.38995 C ? A ? 106 C 1
   ATOM 2450 O . ALA A 108 ? 0.37302 52.25446 17.39031 1.000 24.59849 O ? A ? 106 O 1
   ATOM 2451 CB . ALA A 108 ? -2.28306 53.90918 16.41712 1.000 25.26752 C ? A ? 106 CB 1
   ATOM 2452 HA . ALA A 108 ? -0.79423 54.40942 17.73798 1.000 28.22893 H ? A ? 106 HA 1
   ATOM 2453 HB1 . ALA A 108 ? -2.56272 53.12347 16.91246 1.000 30.43258 H ? A ? 106 HB1 1
   ATOM 2454 HB2 . ALA A 108 ? -2.84924 54.66299 16.64543 1.000 30.43258 H ? A ? 106 HB2 1
   ATOM 2455 HB3 . ALA A 108 ? -2.33301 53.73462 15.46427 1.000 30.43258 H ? A ? 106 HB3 1
   ATOM 2456 H A ALA A 108 ? -1.07949 55.78582 15.57452 0.396 26.38196 H ? A ? 106 H 1
   ATOM 2457 H B ALA A 108 ? -1.01118 55.69362 15.44646 0.604 26.38196 H ? A ? 106 H 1
   ATOM 2458 N . PHE A 109 ? 0.50888 52.91246 15.23988 1.000 19.41542 N ? A ? 107 N 1
   ATOM 2459 CA . PHE A 109 ? 1.41494 51.82828 14.87268 1.000 22.42630 C ? A ? 107 CA 1
   ATOM 2460 C . PHE A 109 ? 2.70227 51.95329 15.66922 1.000 20.19590 C ? A ? 107 C 1
   ATOM 2461 O . PHE A 109 ? 3.21629 50.95954 16.21178 1.000 22.89206 O ? A ? 107 O 1
   ATOM 2462 H . PHE A 109 ? 0.28940 53.42631 14.58613 1.000 23.41006 H ? A ? 107 H 1
   ATOM 2463 HA . PHE A 109 ? 1.01940 50.96372 15.06500 1.000 27.02311 H ? A ? 107 HA 1
   ATOM 2464 CB A PHE A 109 ? 1.71617 51.89691 13.37304 0.406 21.67027 C ? A ? 107 CB 1
   ATOM 2465 CG A PHE A 109 ? 2.72894 50.86890 12.88924 0.406 20.81541 C ? A ? 107 CG 1
   ATOM 2466 CD1 A PHE A 109 ? 2.32633 49.62395 12.43836 0.406 20.09930 C ? A ? 107 CD1 1
   ATOM 2467 CD2 A PHE A 109 ? 4.06664 51.16675 12.85163 0.406 20.71026 C ? A ? 107 CD2 1
   ATOM 2468 CE1 A PHE A 109 ? 3.25332 48.68506 11.98298 0.406 21.11436 C ? A ? 107 CE1 1
   ATOM 2469 CE2 A PHE A 109 ? 4.99370 50.24214 12.39260 0.406 20.93974 C ? A ? 107 CE2 1
   ATOM 2470 CZ A PHE A 109 ? 4.58063 49.00158 11.94850 0.406 20.70868 C ? A ? 107 CZ 1
   ATOM 2471 HB2 A PHE A 109 ? 0.89138 51.74901 12.88442 0.406 26.11587 H ? A ? 107 HB2 1
   ATOM 2472 HB3 A PHE A 109 ? 2.06995 52.77656 13.16819 0.406 26.11587 H ? A ? 107 HB3 1
   ATOM 2473 HD1 A PHE A 109 ? 1.42152 49.40898 12.43881 0.406 24.23071 H ? A ? 107 HD1 1
   ATOM 2474 HD2 A PHE A 109 ? 4.35743 52.00224 13.13850 0.406 24.96386 H ? A ? 107 HD2 1
   ATOM 2475 HE1 A PHE A 109 ? 2.96717 47.84544 11.70359 0.406 25.44879 H ? A ? 107 HE1 1
   ATOM 2476 HE2 A PHE A 109 ? 5.89802 50.45901 12.38396 0.406 25.23923 H ? A ? 107 HE2 1
   ATOM 2477 HZ A PHE A 109 ? 5.20127 48.38719 11.62876 0.406 24.96197 H ? A ? 107 HZ 1
   ATOM 2478 CB B PHE A 109 ? 1.68183 51.89340 13.37109 0.594 21.65986 C ? A ? 107 CB 1
   ATOM 2479 CG B PHE A 109 ? 2.38703 50.66913 12.80719 0.594 20.85158 C ? A ? 107 CG 1
   ATOM 2480 CD1 B PHE A 109 ? 1.67362 49.51941 12.44092 0.594 21.55597 C ? A ? 107 CD1 1
   ATOM 2481 CD2 B PHE A 109 ? 3.75969 50.69872 12.60111 0.594 20.03129 C ? A ? 107 CD2 1
   ATOM 2482 CE1 B PHE A 109 ? 2.33949 48.39717 11.90887 0.594 18.63551 C ? A ? 107 CE1 1
   ATOM 2483 CE2 B PHE A 109 ? 4.41521 49.60404 12.05584 0.594 21.49392 C ? A ? 107 CE2 1
   ATOM 2484 CZ B PHE A 109 ? 3.70202 48.45253 11.70751 0.594 20.38889 C ? A ? 107 CZ 1
   ATOM 2485 HB2 B PHE A 109 ? 0.83352 51.98252 12.90922 0.594 26.10338 H ? A ? 107 HB2 1
   ATOM 2486 HB3 B PHE A 109 ? 2.24133 52.66457 13.18902 0.594 26.10338 H ? A ? 107 HB3 1
   ATOM 2487 HD1 B PHE A 109 ? 0.75035 49.49699 12.55029 0.594 25.97872 H ? A ? 107 HD1 1
   ATOM 2488 HD2 B PHE A 109 ? 4.24401 51.45879 12.83052 0.594 24.14910 H ? A ? 107 HD2 1
   ATOM 2489 HE1 B PHE A 109 ? 1.86429 47.62670 11.69567 0.594 22.47417 H ? A ? 107 HE1 1
   ATOM 2490 HE2 B PHE A 109 ? 5.33483 49.63628 11.92113 0.594 25.90426 H ? A ? 107 HE2 1
   ATOM 2491 HZ B PHE A 109 ? 4.14736 47.72361 11.33975 0.594 24.57821 H ? A ? 107 HZ 1
   ATOM 2492 N . GLY A 110 ? 3.21467 53.17420 15.79528 1.000 24.39438 N ? A ? 108 N 1
   ATOM 2493 CA . GLY A 110 ? 4.41630 53.38480 16.57477 1.000 22.69401 C ? A ? 108 CA 1
   ATOM 2494 C . GLY A 110 ? 4.25588 53.07661 18.04192 1.000 21.90884 C ? A ? 108 C 1
   ATOM 2495 O . GLY A 110 ? 5.14817 52.48262 18.65835 1.000 21.38240 O ? A ? 108 O 1
   ATOM 2496 H . GLY A 110 ? 2.88646 53.88629 15.44198 1.000 29.38480 H ? A ? 108 H 1
   ATOM 2497 HA2 . GLY A 110 ? 5.12161 52.81785 16.22547 1.000 27.34437 H ? A ? 108 HA2 1
   ATOM 2498 HA3 . GLY A 110 ? 4.68679 54.31263 16.49192 1.000 27.34437 H ? A ? 108 HA3 1
   ATOM 2499 N A ASP A 111 ? 3.10875 53.46860 18.61958 0.608 22.76121 N ? A ? 109 N 1
   ATOM 2500 CA A ASP A 111 ? 2.79699 53.14781 20.00233 0.608 21.53010 C ? A ? 109 CA 1
   ATOM 2501 C A ASP A 111 ? 2.83142 51.64511 20.19989 0.608 21.22485 C ? A ? 109 C 1
   ATOM 2502 O A ASP A 111 ? 3.41335 51.14809 21.17311 0.608 20.66407 O ? A ? 109 O 1
   ATOM 2503 CB A ASP A 111 ? 1.40550 53.69378 20.38179 0.608 23.25921 C ? A ? 109 CB 1
   ATOM 2504 CG A ASP A 111 ? 1.36846 55.21577 20.50710 0.608 24.87261 C ? A ? 109 CG 1
   ATOM 2505 OD1 A ASP A 111 ? 2.45178 55.83490 20.64369 0.608 24.34174 O ? A ? 109 OD1 1
   ATOM 2506 OD2 A ASP A 111 ? 0.25346 55.79383 20.47553 0.608 25.49450 O ? A ? 109 OD2 1
   ATOM 2507 H A ASP A 111 ? 2.49627 53.92371 18.22291 0.608 27.42500 H ? A ? 109 H 1
   ATOM 2508 HA A ASP A 111 ? 3.45113 53.56914 20.58154 0.608 25.94768 H ? A ? 109 HA 1
   ATOM 2509 HB2 A ASP A 111 ? 0.76921 53.43579 19.69660 0.608 28.02260 H ? A ? 109 HB2 1
   ATOM 2510 HB3 A ASP A 111 ? 1.14300 53.31809 21.23668 0.608 28.02260 H ? A ? 109 HB3 1
   ATOM 2511 N B ASP A 111 ? 3.14673 53.47840 18.66113 0.097 22.74987 N ? A ? 109 N 1
   ATOM 2512 CA B ASP A 111 ? 2.99410 53.12494 20.06756 0.097 21.79585 C ? A ? 109 CA 1
   ATOM 2513 C B ASP A 111 ? 2.76470 51.62856 20.25065 0.097 21.31115 C ? A ? 109 C 1
   ATOM 2514 O B ASP A 111 ? 2.97292 51.11403 21.35490 0.097 20.95621 O ? A ? 109 O 1
   ATOM 2515 CB B ASP A 111 ? 1.92118 53.97527 20.75211 0.097 23.21004 C ? A ? 109 CB 1
   ATOM 2516 CG B ASP A 111 ? 0.54642 53.69410 20.24484 0.097 23.45797 C ? A ? 109 CG 1
   ATOM 2517 OD1 B ASP A 111 ? 0.16784 52.51410 20.20187 0.097 22.64388 O ? A ? 109 OD1 1
   ATOM 2518 OD2 B ASP A 111 ? -0.16665 54.65561 19.91406 0.097 24.26014 O ? A ? 109 OD2 1
   ATOM 2519 H B ASP A 111 ? 2.50557 53.93042 18.30872 0.097 27.41140 H ? A ? 109 H 1
   ATOM 2520 HA B ASP A 111 ? 3.81249 53.34468 20.53963 0.097 26.26657 H ? A ? 109 HA 1
   ATOM 2521 HB2 B ASP A 111 ? 1.93242 53.79085 21.70435 0.097 27.96360 H ? A ? 109 HB2 1
   ATOM 2522 HB3 B ASP A 111 ? 2.11284 54.91282 20.59347 0.097 27.96360 H ? A ? 109 HB3 1
   ATOM 2523 N C ASP A 111 ? 3.11147 53.42194 18.63403 0.295 22.74932 N ? A ? 109 N 1
   ATOM 2524 CA C ASP A 111 ? 2.94538 53.21079 20.06729 0.295 21.74696 C ? A ? 109 CA 1
   ATOM 2525 C C ASP A 111 ? 2.79536 51.72999 20.39857 0.295 21.37385 C ? A ? 109 C 1
   ATOM 2526 O C ASP A 111 ? 3.32224 51.26262 21.41652 0.295 20.76106 O ? A ? 109 O 1
   ATOM 2527 CB C ASP A 111 ? 1.77616 54.04769 20.58787 0.295 23.25660 C ? A ? 109 CB 1
   ATOM 2528 CG C ASP A 111 ? 2.07170 55.54281 20.53294 0.295 25.50598 C ? A ? 109 CG 1
   ATOM 2529 OD1 C ASP A 111 ? 3.26310 55.89735 20.40230 0.295 26.27907 O ? A ? 109 OD1 1
   ATOM 2530 OD2 C ASP A 111 ? 1.12523 56.35636 20.62875 0.295 26.32077 O ? A ? 109 OD2 1
   ATOM 2531 H C ASP A 111 ? 2.43348 53.77157 18.23692 0.295 27.41074 H ? A ? 109 H 1
   ATOM 2532 HA C ASP A 111 ? 3.73881 53.51906 20.53241 0.295 26.20790 H ? A ? 109 HA 1
   ATOM 2533 HB2 C ASP A 111 ? 0.99248 53.87379 20.04335 0.295 28.01948 H ? A ? 109 HB2 1
   ATOM 2534 HB3 C ASP A 111 ? 1.59869 53.80788 21.51086 0.295 28.01948 H ? A ? 109 HB3 1
   ATOM 2535 N A VAL A 112 ? 2.14730 50.92070 19.30870 0.608 20.78458 N ? A ? 110 N 1
   ATOM 2536 CA A VAL A 112 ? 2.11020 49.46419 19.39282 0.608 19.83542 C ? A ? 110 CA 1
   ATOM 2537 C A VAL A 112 ? 3.51503 48.90000 19.35481 0.608 19.83038 C ? A ? 110 C 1
   ATOM 2538 O A VAL A 112 ? 3.86390 48.06768 20.19217 0.608 20.80188 O ? A ? 110 O 1
   ATOM 2539 CB A VAL A 112 ? 1.22280 48.82959 18.30730 0.608 20.06551 C ? A ? 110 CB 1
   ATOM 2540 CG1 A VAL A 112 ? 1.42339 47.28758 18.33917 0.608 19.95458 C ? A ? 110 CG1 1
   ATOM 2541 CG2 A VAL A 112 ? -0.24264 49.17773 18.52132 0.608 20.16454 C ? A ? 110 CG2 1
   ATOM 2542 H A VAL A 112 ? 1.70015 51.24858 18.65132 0.608 25.05305 H ? A ? 110 H 1
   ATOM 2543 HA A VAL A 112 ? 1.70443 49.24177 20.24534 0.608 23.91406 H ? A ? 110 HA 1
   ATOM 2544 HB A VAL A 112 ? 1.47608 49.17641 17.43755 0.608 24.19016 H ? A ? 110 HB 1
   ATOM 2545 HG11 A VAL A 112 ? 0.71193 46.86602 17.83221 0.608 24.05705 H ? A ? 110 HG11 1
   ATOM 2546 HG12 A VAL A 112 ? 2.28298 47.07271 17.94440 0.608 24.05705 H ? A ? 110 HG12 1
   ATOM 2547 HG13 A VAL A 112 ? 1.39746 46.98471 19.26031 0.608 24.05705 H ? A ? 110 HG13 1
   ATOM 2548 HG21 A VAL A 112 ? -0.76348 48.81689 17.78686 0.608 24.30900 H ? A ? 110 HG21 1
   ATOM 2549 HG22 A VAL A 112 ? -0.54011 48.79041 19.35941 0.608 24.30900 H ? A ? 110 HG22 1
   ATOM 2550 HG23 A VAL A 112 ? -0.33693 50.14268 18.55096 0.608 24.30900 H ? A ? 110 HG23 1
   ATOM 2551 N B VAL A 112 ? 2.33669 50.92691 19.19733 0.097 20.65341 N ? A ? 110 N 1
   ATOM 2552 CA B VAL A 112 ? 2.29086 49.46808 19.24406 0.097 19.99536 C ? A ? 110 CA 1
   ATOM 2553 C B VAL A 112 ? 3.70111 48.89652 19.18619 0.097 19.85456 C ? A ? 110 C 1
   ATOM 2554 O B VAL A 112 ? 4.06093 48.01187 19.96941 0.097 20.55916 O ? A ? 110 O 1
   ATOM 2555 CB B VAL A 112 ? 1.41035 48.90657 18.11287 0.097 20.17261 C ? A ? 110 CB 1
   ATOM 2556 CG1 B VAL A 112 ? 1.61067 47.39063 17.99901 0.097 19.97042 C ? A ? 110 CG1 1
   ATOM 2557 CG2 B VAL A 112 ? -0.05109 49.24511 18.35166 0.097 20.59478 C ? A ? 110 CG2 1
   ATOM 2558 H B VAL A 112 ? 2.07116 51.26883 18.45424 0.097 24.89564 H ? A ? 110 H 1
   ATOM 2559 HA B VAL A 112 ? 1.88795 49.20477 20.08623 0.097 24.10598 H ? A ? 110 HA 1
   ATOM 2560 HB B VAL A 112 ? 1.67155 49.31384 17.27216 0.097 24.31869 H ? A ? 110 HB 1
   ATOM 2561 HG11 B VAL A 112 ? 0.87976 47.01322 17.48498 0.097 24.07605 H ? A ? 110 HG11 1
   ATOM 2562 HG12 B VAL A 112 ? 2.45385 47.21617 17.55235 0.097 24.07605 H ? A ? 110 HG12 1
   ATOM 2563 HG13 B VAL A 112 ? 1.62217 47.00585 18.88936 0.097 24.07605 H ? A ? 110 HG13 1
   ATOM 2564 HG21 B VAL A 112 ? -0.55950 49.02986 17.55411 0.097 24.82528 H ? A ? 110 HG21 1
   ATOM 2565 HG22 B VAL A 112 ? -0.37725 48.72459 19.10237 0.097 24.82528 H ? A ? 110 HG22 1
   ATOM 2566 HG23 B VAL A 112 ? -0.12799 50.19204 18.54742 0.097 24.82528 H ? A ? 110 HG23 1
   ATOM 2567 N C VAL A 112 ? 2.07375 50.98127 19.56023 0.295 20.70997 N ? A ? 110 N 1
   ATOM 2568 CA C VAL A 112 ? 1.98002 49.53537 19.75128 0.295 20.21209 C ? A ? 110 CA 1
   ATOM 2569 C C VAL A 112 ? 3.36159 48.90903 19.69972 0.295 20.00900 C ? A ? 110 C 1
   ATOM 2570 O C VAL A 112 ? 3.74767 48.15222 20.59560 0.295 19.98685 O ? A ? 110 O 1
   ATOM 2571 CB C VAL A 112 ? 1.02710 48.90026 18.72209 0.295 20.11031 C ? A ? 110 CB 1
   ATOM 2572 CG1 C VAL A 112 ? 1.11616 47.37021 18.78868 0.295 20.29271 C ? A ? 110 CG1 1
   ATOM 2573 CG2 C VAL A 112 ? -0.39634 49.37554 18.97495 0.295 20.36461 C ? A ? 110 CG2 1
   ATOM 2574 H C VAL A 112 ? 1.63617 51.28242 18.88390 0.295 24.96351 H ? A ? 110 H 1
   ATOM 2575 HA C VAL A 112 ? 1.60623 49.36973 20.63090 0.295 24.36606 H ? A ? 110 HA 1
   ATOM 2576 HB C VAL A 112 ? 1.28465 49.17361 17.82775 0.295 24.24392 H ? A ? 110 HB 1
   ATOM 2577 HG11 C VAL A 112 ? 0.33015 46.98946 18.36663 0.295 24.46281 H ? A ? 110 HG11 1
   ATOM 2578 HG12 C VAL A 112 ? 1.91552 47.07980 18.32222 0.295 24.46281 H ? A ? 110 HG12 1
   ATOM 2579 HG13 C VAL A 112 ? 1.15780 47.09646 19.71832 0.295 24.46281 H ? A ? 110 HG13 1
   ATOM 2580 HG21 C VAL A 112 ? -0.93039 49.20886 18.18254 0.295 24.54908 H ? A ? 110 HG21 1
   ATOM 2581 HG22 C VAL A 112 ? -0.76273 48.88810 19.72931 0.295 24.54908 H ? A ? 110 HG22 1
   ATOM 2582 HG23 C VAL A 112 ? -0.38205 50.32554 19.17040 0.295 24.54908 H ? A ? 110 HG23 1
   ATOM 2583 N A GLY A 113 ? 4.33639 49.33907 18.38713 0.608 20.68253 N ? A ? 111 N 1
   ATOM 2584 CA A GLY A 113 ? 5.69445 48.83639 18.28991 0.608 20.53524 C ? A ? 111 CA 1
   ATOM 2585 C A GLY A 113 ? 6.46197 49.03521 19.57204 0.608 20.89235 C ? A ? 111 C 1
   ATOM 2586 O A GLY A 113 ? 7.22442 48.16047 19.97993 0.608 20.35930 O ? A ? 111 O 1
   ATOM 2587 H A GLY A 113 ? 4.12622 49.91907 17.78795 0.608 24.93059 H ? A ? 111 H 1
   ATOM 2588 HA2 A GLY A 113 ? 5.67377 47.88792 18.08769 0.608 24.75384 H ? A ? 111 HA2 1
   ATOM 2589 HA3 A GLY A 113 ? 6.16033 49.30114 17.57726 0.608 24.75384 H ? A ? 111 HA3 1
   ATOM 2590 N B GLY A 113 ? 4.52162 49.39318 18.25709 0.097 20.27664 N ? A ? 111 N 1
   ATOM 2591 CA B GLY A 113 ? 5.89548 48.93519 18.15695 0.097 20.11346 C ? A ? 111 CA 1
   ATOM 2592 C B GLY A 113 ? 6.72828 49.22957 19.38467 0.097 21.29021 C ? A ? 111 C 1
   ATOM 2593 O B GLY A 113 ? 7.75721 48.57695 19.59288 0.097 21.34307 O ? A ? 111 O 1
   ATOM 2594 H B GLY A 113 ? 4.30315 49.99179 17.67957 0.097 24.44352 H ? A ? 111 H 1
   ATOM 2595 HA2 B GLY A 113 ? 5.89817 47.97554 18.01565 0.097 24.24771 H ? A ? 111 HA2 1
   ATOM 2596 HA3 B GLY A 113 ? 6.31710 49.36736 17.39776 0.097 24.24771 H ? A ? 111 HA3 1
   ATOM 2597 N C GLY A 113 ? 4.11608 49.20098 18.63908 0.295 20.48433 N ? A ? 111 N 1
   ATOM 2598 CA C GLY A 113 ? 5.45875 48.65789 18.52069 0.295 20.35100 C ? A ? 111 CA 1
   ATOM 2599 C C GLY A 113 ? 6.32846 48.96233 19.72375 0.295 20.77371 C ? A ? 111 C 1
   ATOM 2600 O C GLY A 113 ? 7.05038 48.08849 20.21061 0.295 20.63442 O ? A ? 111 O 1
   ATOM 2601 H C GLY A 113 ? 3.87422 49.70443 17.98513 0.295 24.69274 H ? A ? 111 H 1
   ATOM 2602 HA2 C GLY A 113 ? 5.40518 47.69448 18.42132 0.295 24.53275 H ? A ? 111 HA2 1
   ATOM 2603 HA3 C GLY A 113 ? 5.88612 49.03313 17.73490 0.295 24.53275 H ? A ? 111 HA3 1
   ATOM 2604 N . ALA A 114 ? 6.32248 50.21733 20.18789 1.000 22.23045 N ? A ? 112 N 1
   ATOM 2605 CA . ALA A 114 ? 7.02720 50.52136 21.43230 1.000 21.94208 C ? A ? 112 CA 1
   ATOM 2606 C . ALA A 114 ? 6.63677 49.55277 22.54403 1.000 22.11658 C ? A ? 112 C 1
   ATOM 2607 O . ALA A 114 ? 7.49619 49.12153 23.33175 1.000 23.62228 O ? A ? 112 O 1
   ATOM 2608 CB . ALA A 114 ? 6.79345 51.98492 21.82148 1.000 22.53879 C ? A ? 112 CB 1
   ATOM 2609 HA . ALA A 114 ? 7.98243 50.41814 21.29895 1.000 26.44205 H ? A ? 112 HA 1
   ATOM 2610 HB1 . ALA A 114 ? 7.26686 52.17158 22.64728 1.000 27.15810 H ? A ? 112 HB1 1
   ATOM 2611 HB2 . ALA A 114 ? 7.12649 52.55724 21.11266 1.000 27.15810 H ? A ? 112 HB2 1
   ATOM 2612 HB3 . ALA A 114 ? 5.84249 52.13080 21.94513 1.000 27.15810 H ? A ? 112 HB3 1
   ATOM 2613 H A ALA A 114 ? 5.82507 50.85870 19.90359 0.608 26.78809 H ? A ? 112 H 1
   ATOM 2614 H B ALA A 114 ? 5.64446 50.72373 20.03479 0.097 26.78809 H ? A ? 112 H 1
   ATOM 2615 H C ALA A 114 ? 5.93148 50.88546 19.81331 0.295 26.78809 H ? A ? 112 H 1
   ATOM 2616 N . SER A 115 ? 5.34948 49.17917 22.58601 1.000 21.30293 N ? A ? 113 N 1
   ATOM 2617 CA . SER A 115 ? 4.82738 48.27974 23.61320 1.000 23.74046 C ? A ? 113 CA 1
   ATOM 2618 C . SER A 115 ? 5.36183 46.87300 23.42263 1.000 20.15200 C ? A ? 113 C 1
   ATOM 2619 O . SER A 115 ? 5.73585 46.21471 24.39755 1.000 23.02772 O ? A ? 113 O 1
   ATOM 2620 CB . SER A 115 ? 3.28818 48.27743 23.59706 1.000 25.85575 C ? A ? 113 CB 1
   ATOM 2621 OG . SER A 115 ? 2.75658 49.49259 24.06619 1.000 30.70345 O ? A ? 113 OG 1
   ATOM 2622 H . SER A 115 ? 4.75304 49.43744 22.02284 1.000 25.67507 H ? A ? 113 H 1
   ATOM 2623 HA . SER A 115 ? 5.11195 48.60259 24.48250 1.000 28.60010 H ? A ? 113 HA 1
   ATOM 2624 HB2 . SER A 115 ? 2.98642 48.13648 22.68603 1.000 31.13845 H ? A ? 113 HB2 1
   ATOM 2625 HB3 . SER A 115 ? 2.97177 47.55859 24.16632 1.000 31.13845 H ? A ? 113 HB3 1
   ATOM 2626 HG . SER A 115 ? 1.92373 49.42705 24.15376 1.000 36.95569 H ? A ? 113 HG 1
   ATOM 2627 N . CYS A 116 ? 5.50182 46.43320 22.17613 1.000 19.47358 N ? A ? 114 N 1
   ATOM 2628 CA . CYS A 116 ? 6.18078 45.15366 21.93781 1.000 19.64557 C ? A ? 114 CA 1
   ATOM 2629 C . CYS A 116 ? 7.58805 45.17595 22.53238 1.000 20.04019 C ? A ? 114 C 1
   ATOM 2630 O . CYS A 116 ? 7.99595 44.27411 23.26969 1.000 24.57178 O ? A ? 114 O 1
   ATOM 2631 CB . CYS A 116 ? 6.34820 44.94952 20.44616 1.000 19.45433 C ? A ? 114 CB 1
   ATOM 2632 SG . CYS A 116 ? 4.90813 45.07991 19.35107 1.000 21.40776 S ? A ? 114 SG 1
   ATOM 2633 H . CYS A 116 ? 5.22385 46.83902 21.47069 1.000 23.47985 H ? A ? 114 H 1
   ATOM 2634 HA . CYS A 116 ? 5.64781 44.44597 22.33280 1.000 23.68623 H ? A ? 114 HA 1
   ATOM 2635 HB2 . CYS A 116 ? 6.98506 45.61152 20.13462 1.000 23.45675 H ? A ? 114 HB2 1
   ATOM 2636 HB3 . CYS A 116 ? 6.70642 44.05754 20.31601 1.000 23.45675 H ? A ? 114 HB3 1
   ATOM 2637 N . LYS A 117 ? 8.35090 46.23464 22.23075 1.000 21.09574 N ? A ? 115 N 1
   ATOM 2638 CA . LYS A 117 ? 9.77381 46.26411 22.56049 1.000 22.41487 C ? A ? 115 CA 1
   ATOM 2639 C . LYS A 117 ? 9.97755 46.41084 24.04855 1.000 22.37719 C ? A ? 115 C 1
   ATOM 2640 O . LYS A 117 ? 10.94230 45.87352 24.60002 1.000 27.78473 O ? A ? 115 O 1
   ATOM 2641 CB . LYS A 117 ? 10.43074 47.43909 21.84155 1.000 26.49522 C ? A ? 115 CB 1
   ATOM 2642 CG . LYS A 117 ? 11.85910 47.75038 22.27039 1.000 40.62124 C ? A ? 115 CG 1
   ATOM 2643 CD . LYS A 117 ? 12.46020 48.91960 21.46706 1.000 46.32781 C ? A ? 115 CD 1
   ATOM 2644 CE . LYS A 117 ? 13.97396 48.98337 21.63721 1.000 63.81242 C ? A ? 115 CE 1
   ATOM 2645 NZ . LYS A 117 ? 14.37605 48.92152 23.07757 1.000 63.91828 N ? A ? 115 NZ 1
   ATOM 2646 H . LYS A 117 ? 8.06727 46.94448 21.83669 1.000 25.42644 H ? A ? 115 H 1
   ATOM 2647 HA . LYS A 117 ? 10.18673 45.43660 22.26788 1.000 27.00940 H ? A ? 115 HA 1
   ATOM 2648 HB2 . LYS A 117 ? 10.44993 47.24397 20.89158 1.000 31.90582 H ? A ? 115 HB2 1
   ATOM 2649 HB3 . LYS A 117 ? 9.89952 48.23380 22.00635 1.000 31.90582 H ? A ? 115 HB3 1
   ATOM 2650 HG2 . LYS A 117 ? 11.86500 47.99343 23.20943 1.000 48.85704 H ? A ? 115 HG2 1
   ATOM 2651 HG3 . LYS A 117 ? 12.41360 46.96756 22.12682 1.000 48.85704 H ? A ? 115 HG3 1
   ATOM 2652 HD2 . LYS A 117 ? 12.26267 48.79905 20.52506 1.000 55.70492 H ? A ? 115 HD2 1
   ATOM 2653 HD3 . LYS A 117 ? 12.08118 49.75540 21.78120 1.000 55.70492 H ? A ? 115 HD3 1
   ATOM 2654 HE2 . LYS A 117 ? 14.37943 48.23228 21.17639 1.000 76.68646 H ? A ? 115 HE2 1
   ATOM 2655 HE3 . LYS A 117 ? 14.30260 49.81705 21.26589 1.000 76.68646 H ? A ? 115 HE3 1
   ATOM 2656 HZ1 . LYS A 117 ? 15.25874 49.00838 23.15120 1.000 76.81349 H ? A ? 115 HZ1 1
   ATOM 2657 HZ2 . LYS A 117 ? 13.98235 49.57775 23.53196 1.000 76.81349 H ? A ? 115 HZ2 1
   ATOM 2658 HZ3 . LYS A 117 ? 14.13239 48.14071 23.42837 1.000 76.81349 H ? A ? 115 HZ3 1
   ATOM 2659 N . ALA A 118 ? 9.06998 47.11799 24.71354 1.000 20.76470 N ? A ? 116 N 1
   ATOM 2660 CA . ALA A 118 ? 9.15560 47.27415 26.15307 1.000 25.98395 C ? A ? 116 CA 1
   ATOM 2661 C . ALA A 118 ? 9.02350 45.93412 26.84942 1.000 27.06654 C ? A ? 116 C 1
   ATOM 2662 O . ALA A 118 ? 9.78842 45.62586 27.77128 1.000 28.32934 O ? A ? 116 O 1
   ATOM 2663 CB . ALA A 118 ? 8.07175 48.23124 26.62784 1.000 26.23184 C ? A ? 116 CB 1
   ATOM 2664 H . ALA A 118 ? 8.39774 47.51524 24.35314 1.000 25.02920 H ? A ? 116 H 1
   ATOM 2665 HA . ALA A 118 ? 10.01935 47.65130 26.38241 1.000 31.29229 H ? A ? 116 HA 1
   ATOM 2666 HB1 . ALA A 118 ? 8.13694 48.32962 27.59064 1.000 31.58976 H ? A ? 116 HB1 1
   ATOM 2667 HB2 . ALA A 118 ? 8.19959 49.09137 26.19805 1.000 31.58976 H ? A ? 116 HB2 1
   ATOM 2668 HB3 . ALA A 118 ? 7.20402 47.86852 26.39040 1.000 31.58976 H ? A ? 116 HB3 1
   ATOM 2669 N . CYS A 119 ? 8.06491 45.10616 26.41006 1.000 23.29721 N ? A ? 117 N 1
   ATOM 2670 CA . CYS A 119 ? 7.93687 43.78954 27.01749 1.000 23.31169 C ? A ? 117 CA 1
   ATOM 2671 C . CYS A 119 ? 9.15827 42.93784 26.72707 1.000 24.78350 C ? A ? 117 C 1
   ATOM 2672 O . CYS A 119 ? 9.67359 42.27643 27.62930 1.000 26.51837 O ? A ? 117 O 1
   ATOM 2673 H . CYS A 119 ? 7.50069 45.28186 25.78525 1.000 28.06821 H ? A ? 117 H 1
   ATOM 2674 HA . CYS A 119 ? 7.86471 43.92953 27.97462 1.000 28.08558 H ? A ? 117 HA 1
   ATOM 2675 CB A CYS A 119 ? 6.64348 43.05386 26.62528 0.577 23.03673 C ? A ? 117 CB 1
   ATOM 2676 SG A CYS A 119 ? 6.17338 41.71720 27.78786 0.577 19.32891 S ? A ? 117 SG 1
   ATOM 2677 HB2 A CYS A 119 ? 5.91563 43.69458 26.60050 0.577 27.75563 H ? A ? 117 HB2 1
   ATOM 2678 HB3 A CYS A 119 ? 6.76478 42.65552 25.74921 0.577 27.75563 H ? A ? 117 HB3 1
   ATOM 2679 CB B CYS A 119 ? 6.66883 43.12658 26.49652 0.423 23.11971 C ? A ? 117 CB 1
   ATOM 2680 SG B CYS A 119 ? 6.51296 41.46520 27.01628 0.423 18.07450 S ? A ? 117 SG 1
   ATOM 2681 HB2 B CYS A 119 ? 5.89875 43.61738 26.82362 0.423 27.85520 H ? A ? 117 HB2 1
   ATOM 2682 HB3 B CYS A 119 ? 6.68214 43.13814 25.52668 0.423 27.85520 H ? A ? 117 HB3 1
   ATOM 2683 N . HIS A 120 ? 9.63296 42.93701 25.48584 1.000 20.20212 N ? A ? 118 N 1
   ATOM 2684 CA . HIS A 120 ? 10.76111 42.09474 25.12186 1.000 24.68705 C ? A ? 118 CA 1
   ATOM 2685 C . HIS A 120 ? 11.98584 42.44465 25.93007 1.000 29.36736 C ? A ? 118 C 1
   ATOM 2686 O . HIS A 120 ? 12.75078 41.56342 26.31754 1.000 25.68733 O ? A ? 118 O 1
   ATOM 2687 CB . HIS A 120 ? 11.04497 42.30398 23.65180 1.000 25.09671 C ? A ? 118 CB 1
   ATOM 2688 CG . HIS A 120 ? 10.02565 41.66550 22.77021 1.000 19.57263 C ? A ? 118 CG 1
   ATOM 2689 ND1 . HIS A 120 ? 9.98733 41.82998 21.40397 1.000 23.49317 N ? A ? 118 ND1 1
   ATOM 2690 CD2 . HIS A 120 ? 8.98077 40.85217 23.08047 1.000 22.34364 C ? A ? 118 CD2 1
   ATOM 2691 CE1 . HIS A 120 ? 8.97314 41.12821 20.91236 1.000 23.70740 C ? A ? 118 CE1 1
   ATOM 2692 NE2 . HIS A 120 ? 8.37220 40.50213 21.90650 1.000 23.88390 N ? A ? 118 NE2 1
   ATOM 2693 H . HIS A 120 ? 9.32113 43.41224 24.84046 1.000 24.35409 H ? A ? 118 H 1
   ATOM 2694 HA . HIS A 120 ? 10.54623 41.16401 25.29057 1.000 29.73601 H ? A ? 118 HA 1
   ATOM 2695 HB2 . HIS A 120 ? 11.05072 43.25556 23.46376 1.000 30.22761 H ? A ? 118 HB2 1
   ATOM 2696 HB3 . HIS A 120 ? 11.90936 41.91857 23.43926 1.000 30.22761 H ? A ? 118 HB3 1
   ATOM 2697 HD1 . HIS A 120 ? 10.53236 42.30986 20.94326 1.000 28.30335 H ? A ? 118 HD1 1
   ATOM 2698 HD2 . HIS A 120 ? 8.72674 40.58341 23.93378 1.000 26.92391 H ? A ? 118 HD2 1
   ATOM 2699 HE1 . HIS A 120 ? 8.72718 41.08506 20.01652 1.000 28.56044 H ? A ? 118 HE1 1
   ATOM 2700 N . ASP A 121 ? 12.19056 43.73076 26.17914 1.000 29.93501 N ? A ? 119 N 1
   ATOM 2701 CA . ASP A 121 ? 13.38379 44.18105 26.87905 1.000 31.64732 C ? A ? 119 CA 1
   ATOM 2702 C . ASP A 121 ? 13.43345 43.65695 28.30086 1.000 34.83318 C ? A ? 119 C 1
   ATOM 2703 O . ASP A 121 ? 14.52479 43.49633 28.86010 1.000 34.42906 O ? A ? 119 O 1
   ATOM 2704 CB . ASP A 121 ? 13.41560 45.70688 26.90427 1.000 34.74722 C ? A ? 119 CB 1
   ATOM 2705 CG . ASP A 121 ? 13.89875 46.30129 25.59850 1.000 41.57794 C ? A ? 119 CG 1
   ATOM 2706 OD1 . ASP A 121 ? 14.33762 45.54420 24.70618 1.000 41.81750 O ? A ? 119 OD1 1
   ATOM 2707 OD2 . ASP A 121 ? 13.83297 47.53899 25.46491 1.000 45.70654 O ? A ? 119 OD2 1
   ATOM 2708 H . ASP A 121 ? 11.65419 44.36407 25.95369 1.000 36.03356 H ? A ? 119 H 1
   ATOM 2709 HA . ASP A 121 ? 14.16357 43.85365 26.40401 1.000 38.08833 H ? A ? 119 HA 1
   ATOM 2710 HB2 . ASP A 121 ? 12.52007 46.03944 27.07262 1.000 41.80821 H ? A ? 119 HB2 1
   ATOM 2711 HB3 . ASP A 121 ? 14.01584 45.99941 27.60785 1.000 41.80821 H ? A ? 119 HB3 1
   ATOM 2712 N . ALA A 122 ? 12.27673 43.39542 28.90590 1.000 31.39757 N ? A ? 120 N 1
   ATOM 2713 CA . ALA A 122 ? 12.22733 42.96213 30.29111 1.000 33.79467 C ? A ? 120 CA 1
   ATOM 2714 C . ALA A 122 ? 11.84717 41.50666 30.48541 1.000 35.61178 C ? A ? 120 C 1
   ATOM 2715 O . ALA A 122 ? 12.07975 40.97137 31.57848 1.000 39.01611 O ? A ? 120 O 1
   ATOM 2716 CB . ALA A 122 ? 11.22355 43.80303 31.08364 1.000 37.07732 C ? A ? 120 CB 1
   ATOM 2717 H . ALA A 122 ? 11.50619 43.46309 28.53002 1.000 37.78863 H ? A ? 120 H 1
   ATOM 2718 HA . ALA A 122 ? 13.11291 43.09455 30.66409 1.000 40.66515 H ? A ? 120 HA 1
   ATOM 2719 HB1 . ALA A 122 ? 11.21567 43.50003 32.00506 1.000 44.60434 H ? A ? 120 HB1 1
   ATOM 2720 HB2 . ALA A 122 ? 11.49111 44.73456 31.04403 1.000 44.60434 H ? A ? 120 HB2 1
   ATOM 2721 HB3 . ALA A 122 ? 10.34257 43.69500 30.69236 1.000 44.60434 H ? A ? 120 HB3 1
   ATOM 2722 N A TYR A 123 ? 11.25776 40.85372 29.47879 0.308 33.12468 N ? A ? 121 N 1
   ATOM 2723 CA A TYR A 123 ? 10.71750 39.51700 29.68028 0.308 32.50126 C ? A ? 121 CA 1
   ATOM 2724 C A TYR A 123 ? 11.00100 38.53219 28.55526 0.308 31.48605 C ? A ? 121 C 1
   ATOM 2725 O A TYR A 123 ? 10.53716 37.39122 28.64182 0.308 30.42869 O ? A ? 121 O 1
   ATOM 2726 CB A TYR A 123 ? 9.19903 39.59057 29.90780 0.308 31.80662 C ? A ? 121 CB 1
   ATOM 2727 CG A TYR A 123 ? 8.79901 40.57580 30.97920 0.308 33.01647 C ? A ? 121 CG 1
   ATOM 2728 CD1 A TYR A 123 ? 9.04793 40.30406 32.31613 0.308 34.87866 C ? A ? 121 CD1 1
   ATOM 2729 CD2 A TYR A 123 ? 8.18580 41.77847 30.65787 0.308 33.15030 C ? A ? 121 CD2 1
   ATOM 2730 CE1 A TYR A 123 ? 8.69603 41.19617 33.30557 0.308 36.93401 C ? A ? 121 CE1 1
   ATOM 2731 CE2 A TYR A 123 ? 7.83013 42.67976 31.64134 0.308 35.85183 C ? A ? 121 CE2 1
   ATOM 2732 CZ A TYR A 123 ? 8.08579 42.38227 32.96415 0.308 37.71553 C ? A ? 121 CZ 1
   ATOM 2733 OH A TYR A 123 ? 7.73158 43.28086 33.94574 0.308 41.88491 O ? A ? 121 OH 1
   ATOM 2734 H A TYR A 123 ? 11.16206 41.16346 28.68223 0.308 39.86117 H ? A ? 121 H 1
   ATOM 2735 HA A TYR A 123 ? 11.13261 39.15213 30.47744 0.308 39.11307 H ? A ? 121 HA 1
   ATOM 2736 HB2 A TYR A 123 ? 8.77129 39.86115 29.08032 0.308 38.27949 H ? A ? 121 HB2 1
   ATOM 2737 HB3 A TYR A 123 ? 8.87979 38.71452 30.17525 0.308 38.27949 H ? A ? 121 HB3 1
   ATOM 2738 HD1 A TYR A 123 ? 9.46051 39.50393 32.54950 0.308 41.96594 H ? A ? 121 HD1 1
   ATOM 2739 HD2 A TYR A 123 ? 8.01186 41.98032 29.76686 0.308 39.89192 H ? A ? 121 HD2 1
   ATOM 2740 HE1 A TYR A 123 ? 8.86947 40.99854 34.19763 0.308 44.43236 H ? A ? 121 HE1 1
   ATOM 2741 HE2 A TYR A 123 ? 7.42048 43.48298 31.41346 0.308 43.13375 H ? A ? 121 HE2 1
   ATOM 2742 HH A TYR A 123 ? 7.37737 43.95943 33.59980 0.308 50.37344 H ? A ? 121 HH 1
   ATOM 2743 N B TYR A 123 ? 11.25828 40.85801 29.47496 0.692 33.10845 N ? A ? 121 N 1
   ATOM 2744 CA B TYR A 123 ? 10.73356 39.51736 29.67291 0.692 32.50672 C ? A ? 121 CA 1
   ATOM 2745 C B TYR A 123 ? 11.03193 38.52875 28.56384 0.692 31.47037 C ? A ? 121 C 1
   ATOM 2746 O B TYR A 123 ? 10.57943 37.38632 28.66079 0.692 30.32191 O ? A ? 121 O 1
   ATOM 2747 CB B TYR A 123 ? 9.22193 39.57357 29.86334 0.692 31.77258 C ? A ? 121 CB 1
   ATOM 2748 CG B TYR A 123 ? 8.84214 40.30322 31.10770 0.692 33.06202 C ? A ? 121 CG 1
   ATOM 2749 CD1 B TYR A 123 ? 9.18156 39.79005 32.34820 0.692 34.48050 C ? A ? 121 CD1 1
   ATOM 2750 CD2 B TYR A 123 ? 8.17025 41.51447 31.05534 0.692 33.07749 C ? A ? 121 CD2 1
   ATOM 2751 CE1 B TYR A 123 ? 8.85215 40.45431 33.50285 0.692 36.37352 C ? A ? 121 CE1 1
   ATOM 2752 CE2 B TYR A 123 ? 7.82904 42.18387 32.20978 0.692 36.22141 C ? A ? 121 CE2 1
   ATOM 2753 CZ B TYR A 123 ? 8.17384 41.65009 33.43198 0.692 38.12248 C ? A ? 121 CZ 1
   ATOM 2754 OH B TYR A 123 ? 7.84232 42.30550 34.59276 0.692 42.07339 O ? A ? 121 OH 1
   ATOM 2755 H B TYR A 123 ? 11.15531 41.17300 28.68137 0.692 39.84169 H ? A ? 121 H 1
   ATOM 2756 HA B TYR A 123 ? 11.14861 39.16773 30.47690 0.692 39.11962 H ? A ? 121 HA 1
   ATOM 2757 HB2 B TYR A 123 ? 8.82253 40.03305 29.10819 0.692 38.23865 H ? A ? 121 HB2 1
   ATOM 2758 HB3 B TYR A 123 ? 8.87454 38.66990 29.92337 0.692 38.23865 H ? A ? 121 HB3 1
   ATOM 2759 HD1 B TYR A 123 ? 9.63998 38.98251 32.39961 0.692 41.48816 H ? A ? 121 HD1 1
   ATOM 2760 HD2 B TYR A 123 ? 7.94687 41.87999 30.22987 0.692 39.80453 H ? A ? 121 HD2 1
   ATOM 2761 HE1 B TYR A 123 ? 9.08609 40.09827 34.32953 0.692 43.75977 H ? A ? 121 HE1 1
   ATOM 2762 HE2 B TYR A 123 ? 7.36896 42.99082 32.16440 0.692 43.57724 H ? A ? 121 HE2 1
   ATOM 2763 HH B TYR A 123 ? 7.28070 42.90899 34.43158 0.692 50.59962 H ? A ? 121 HH 1
   ATOM 2764 N . LYS A 124 ? 11.70421 38.92519 27.49971 1.000 28.00506 N ? A ? 122 N 1
   ATOM 2765 CA . LYS A 124 ? 12.12842 38.00451 26.45731 1.000 28.87247 C ? A ? 122 CA 1
   ATOM 2766 C . LYS A 124 ? 13.64404 37.84732 26.56910 1.000 34.83371 C ? A ? 122 C 1
   ATOM 2767 O . LYS A 124 ? 14.38269 38.83481 26.48730 1.000 34.91495 O ? A ? 122 O 1
   ATOM 2768 CB . LYS A 124 ? 11.70874 38.51255 25.07516 1.000 28.14065 C ? A ? 122 CB 1
   ATOM 2769 CG . LYS A 124 ? 11.92653 37.52187 23.95780 1.000 27.89180 C ? A ? 122 CG 1
   ATOM 2770 CD . LYS A 124 ? 11.50929 38.05506 22.60579 1.000 27.37156 C ? A ? 122 CD 1
   ATOM 2771 CE . LYS A 124 ? 11.82593 37.09454 21.45168 1.000 29.46121 C ? A ? 122 CE 1
   ATOM 2772 NZ . LYS A 124 ? 11.59292 37.77883 20.13519 1.000 32.35025 N ? A ? 122 NZ 1
   ATOM 2773 HA . LYS A 124 ? 11.71899 37.13362 26.57908 1.000 34.75852 H ? A ? 122 HA 1
   ATOM 2774 HB2 . LYS A 124 ? 10.76298 38.72683 25.09787 1.000 33.88033 H ? A ? 122 HB2 1
   ATOM 2775 HB3 . LYS A 124 ? 12.22417 39.30766 24.86769 1.000 33.88033 H ? A ? 122 HB3 1
   ATOM 2776 HG2 . LYS A 124 ? 12.86956 37.29924 23.91280 1.000 33.58171 H ? A ? 122 HG2 1
   ATOM 2777 HG3 . LYS A 124 ? 11.40544 36.72374 24.13767 1.000 33.58171 H ? A ? 122 HG3 1
   ATOM 2778 HD2 . LYS A 124 ? 10.55162 38.20912 22.61027 1.000 32.95743 H ? A ? 122 HD2 1
   ATOM 2779 HD3 . LYS A 124 ? 11.97840 38.88721 22.43737 1.000 32.95743 H ? A ? 122 HD3 1
   ATOM 2780 HE2 . LYS A 124 ? 12.75521 36.82067 21.50001 1.000 35.46501 H ? A ? 122 HE2 1
   ATOM 2781 HE3 . LYS A 124 ? 11.24784 36.31747 21.50525 1.000 35.46501 H ? A ? 122 HE3 1
   ATOM 2782 HZ1 . LYS A 124 ? 11.77686 37.22184 19.46585 1.000 38.93185 H ? A ? 122 HZ1 1
   ATOM 2783 HZ2 . LYS A 124 ? 10.74318 38.03580 20.07189 1.000 38.93185 H ? A ? 122 HZ2 1
   ATOM 2784 HZ3 . LYS A 124 ? 12.11705 38.49493 20.06737 1.000 38.93185 H ? A ? 122 HZ3 1
   ATOM 2785 H A LYS A 124 ? 11.95167 39.73764 27.36445 0.308 33.71762 H ? A ? 122 H 1
   ATOM 2786 H B LYS A 124 ? 11.93272 39.74135 27.35386 0.692 33.71762 H ? A ? 122 H 1
   ATOM 2787 N . LYS A 125 ? 14.10062 36.61507 26.77869 1.000 34.62019 N ? A ? 123 N 1
   ATOM 2788 CA . LYS A 125 ? 15.53179 36.31637 26.84460 1.000 38.97627 C ? A ? 123 CA 1
   ATOM 2789 C . LYS A 125 ? 16.24067 36.91958 25.63188 1.000 38.85317 C ? A ? 123 C 1
   ATOM 2790 O . LYS A 125 ? 15.86995 36.66186 24.48226 1.000 39.37416 O ? A ? 123 O 1
   ATOM 2791 H . LYS A 125 ? 13.59764 35.92599 26.88721 1.000 41.65579 H ? A ? 123 H 1
   ATOM 2792 HA . LYS A 125 ? 15.92582 36.70894 27.63929 1.000 46.88307 H ? A ? 123 HA 1
   ATOM 2793 CB A LYS A 125 ? 15.76428 34.80390 26.95978 0.641 39.97368 C ? A ? 123 CB 1
   ATOM 2794 CG A LYS A 125 ? 15.23025 34.24064 28.28351 0.641 38.13876 C ? A ? 123 CG 1
   ATOM 2795 CD A LYS A 125 ? 15.58001 32.76898 28.51569 0.641 38.26446 C ? A ? 123 CD 1
   ATOM 2796 CE A LYS A 125 ? 15.06358 32.31858 29.88609 0.641 36.97868 C ? A ? 123 CE 1
   ATOM 2797 NZ A LYS A 125 ? 15.42659 30.90809 30.21708 0.641 35.51882 N ? A ? 123 NZ 1
   ATOM 2798 HB2 A LYS A 125 ? 15.30676 34.35472 26.23190 0.641 48.07997 H ? A ? 123 HB2 1
   ATOM 2799 HB3 A LYS A 125 ? 16.71628 34.62340 26.91487 0.641 48.07997 H ? A ? 123 HB3 1
   ATOM 2800 HG2 A LYS A 125 ? 15.60795 34.75256 29.01575 0.641 45.87807 H ? A ? 123 HG2 1
   ATOM 2801 HG3 A LYS A 125 ? 14.26337 34.31826 28.28850 0.641 45.87807 H ? A ? 123 HG3 1
   ATOM 2802 HD2 A LYS A 125 ? 15.16412 32.22192 27.83110 0.641 46.02891 H ? A ? 123 HD2 1
   ATOM 2803 HD3 A LYS A 125 ? 16.54289 32.65399 28.49270 0.641 46.02891 H ? A ? 123 HD3 1
   ATOM 2804 HE2 A LYS A 125 ? 15.44377 32.89223 30.56967 0.641 44.48597 H ? A ? 123 HE2 1
   ATOM 2805 HE3 A LYS A 125 ? 14.09606 32.38724 29.89581 0.641 44.48597 H ? A ? 123 HE3 1
   ATOM 2806 HZ1 A LYS A 125 ? 15.08943 30.68505 31.00997 0.641 42.73414 H ? A ? 123 HZ1 1
   ATOM 2807 HZ2 A LYS A 125 ? 15.10050 30.35682 29.59913 0.641 42.73414 H ? A ? 123 HZ2 1
   ATOM 2808 HZ3 A LYS A 125 ? 16.31180 30.82002 30.24451 0.641 42.73414 H ? A ? 123 HZ3 1
   ATOM 2809 CB B LYS A 125 ? 15.74474 34.79980 26.89434 0.359 39.99908 C ? A ? 123 CB 1
   ATOM 2810 CG B LYS A 125 ? 16.84339 34.27737 26.00145 0.359 40.71633 C ? A ? 123 CG 1
   ATOM 2811 CD B LYS A 125 ? 16.72683 32.74571 25.81678 0.359 39.50178 C ? A ? 123 CD 1
   ATOM 2812 CE B LYS A 125 ? 17.68750 32.23364 24.75126 0.359 38.83056 C ? A ? 123 CE 1
   ATOM 2813 NZ B LYS A 125 ? 17.41194 30.82789 24.34428 0.359 37.28438 N ? A ? 123 NZ 1
   ATOM 2814 HB2 B LYS A 125 ? 15.96802 34.55138 27.80501 0.359 48.11045 H ? A ? 123 HB2 1
   ATOM 2815 HB3 B LYS A 125 ? 14.92036 34.36556 26.62464 0.359 48.11045 H ? A ? 123 HB3 1
   ATOM 2816 HG2 B LYS A 125 ? 16.77843 34.69746 25.12955 0.359 48.97115 H ? A ? 123 HG2 1
   ATOM 2817 HG3 B LYS A 125 ? 17.70525 34.47364 26.40090 0.359 48.97115 H ? A ? 123 HG3 1
   ATOM 2818 HD2 B LYS A 125 ? 16.93831 32.30461 26.65440 0.359 47.51369 H ? A ? 123 HD2 1
   ATOM 2819 HD3 B LYS A 125 ? 15.82300 32.52340 25.54370 0.359 47.51369 H ? A ? 123 HD3 1
   ATOM 2820 HE2 B LYS A 125 ? 17.61068 32.79314 23.96261 0.359 46.70823 H ? A ? 123 HE2 1
   ATOM 2821 HE3 B LYS A 125 ? 18.59249 32.27189 25.09830 0.359 46.70823 H ? A ? 123 HE3 1
   ATOM 2822 HZ1 B LYS A 125 ? 17.99169 30.57279 23.71905 0.359 44.85281 H ? A ? 123 HZ1 1
   ATOM 2823 HZ2 B LYS A 125 ? 17.48833 30.28703 25.04694 0.359 44.85281 H ? A ? 123 HZ2 1
   ATOM 2824 HZ3 B LYS A 125 ? 16.58683 30.76183 24.01729 0.359 44.85281 H ? A ? 123 HZ3 1
   HETATM 2825 N . PCA A 1 ? -5.55102 24.20162 28.12137 1.000 19.28016 N ? A ? 124 N 1
   HETATM 2826 CA . PCA A 1 ? -5.75610 23.47542 26.86518 1.000 20.74543 C ? A ? 124 CA 1
   HETATM 2827 C . PCA A 1 ? -4.49064 22.71753 26.44673 1.000 21.55970 C ? A ? 124 C 1
   HETATM 2828 O . PCA A 1 ? -4.40892 22.23983 25.32614 1.000 23.80744 O ? A ? 124 O 1
   HETATM 2829 CB . PCA A 1 ? -6.07444 24.48210 25.78665 1.000 24.31513 C ? A ? 124 CB 1
   HETATM 2830 CG . PCA A 1 ? -5.59594 25.78308 26.43417 1.000 24.09587 C ? A ? 124 CG 1
   HETATM 2831 CD . PCA A 1 ? -5.43500 25.54392 27.92062 1.000 22.08528 C ? A ? 124 CD 1
   HETATM 2832 OE . PCA A 1 ? -5.19276 26.45475 28.71865 1.000 24.28522 O ? A ? 124 OE 1
   HETATM 2833 H2 . PCA A 1 ? -6.26237 24.70667 28.30352 1.000 23.24775 H ? A ? 124 H2 1
   HETATM 2834 HA . PCA A 1 ? -6.47749 22.83584 26.97214 1.000 25.00607 H ? A ? 124 HA 1
   HETATM 2835 HB2 . PCA A 1 ? -5.60124 24.27888 24.96465 1.000 29.28970 H ? A ? 124 HB2 1
   HETATM 2836 HB3 . PCA A 1 ? -7.02306 24.49332 25.58446 1.000 29.28970 H ? A ? 124 HB3 1
   HETATM 2837 HG2 . PCA A 1 ? -4.74168 26.08139 26.08467 1.000 29.02660 H ? A ? 124 HG2 1
   HETATM 2838 HG3 . PCA A 1 ? -6.22431 26.51229 26.31453 1.000 29.02660 H ? A ? 124 HG3 1
   HETATM 2839 NB . HEC A 1128 ? 5.76491 40.46346 20.33554 1.000 15.88092 N ? B ? . NB 1
   HETATM 2840 ND . HEC A 1128 ? 7.26436 37.83842 23.09980 1.000 13.73122 N ? B ? . ND 1
   HETATM 2841 C1A . HEC A 1128 ? 8.03648 36.80132 20.32240 1.000 18.52213 C ? B ? . C1A 1
   HETATM 2842 C1B . HEC A 1128 ? 6.00109 40.44836 19.00796 1.000 17.64445 C ? B ? . C1B 1
   HETATM 2843 C1C . HEC A 1128 ? 4.82681 41.31946 23.13306 1.000 16.70266 C ? B ? . C1C 1
   HETATM 2844 C1D . HEC A 1128 ? 7.08913 37.91992 24.44577 1.000 17.09291 C ? B ? . C1D 1
   HETATM 2845 C2A . HEC A 1128 ? 8.38545 36.34608 18.99742 1.000 16.17152 C ? B ? . C2A 1
   HETATM 2846 C2B . HEC A 1128 ? 5.39794 41.62237 18.41072 1.000 20.88591 C ? B ? . C2B 1
   HETATM 2847 C2C . HEC A 1128 ? 4.40598 41.79411 24.44257 1.000 20.10745 C ? B ? . C2C 1
   HETATM 2848 C2D . HEC A 1128 ? 7.71586 36.80937 25.17163 1.000 20.34483 C ? B ? . C2D 1
   HETATM 2849 C3A . HEC A 1128 ? 7.94374 37.25675 18.10697 1.000 19.53735 C ? B ? . C3A 1
   HETATM 2850 C3B . HEC A 1128 ? 4.73877 42.25223 19.40411 1.000 19.72171 C ? B ? . C3B 1
   HETATM 2851 C3C . HEC A 1128 ? 4.93377 40.94347 25.37213 1.000 19.61537 C ? B ? . C3C 1
   HETATM 2852 C3D . HEC A 1128 ? 8.23728 35.97801 24.06126 1.000 16.41223 C ? B ? . C3D 1
   HETATM 2853 C4A . HEC A 1128 ? 7.33394 38.33342 18.84923 1.000 17.83954 C ? B ? . C4A 1
   HETATM 2854 C4B . HEC A 1128 ? 4.99574 41.57605 20.65625 1.000 17.41535 C ? B ? . C4B 1
   HETATM 2855 C4C . HEC A 1128 ? 5.71337 39.97269 24.63555 1.000 19.41722 C ? B ? . C4C 1
   HETATM 2856 C4D . HEC A 1128 ? 7.93133 36.67172 22.82583 1.000 20.18738 C ? B ? . C4D 1
   HETATM 2857 CAA . HEC A 1128 ? 9.05615 34.98960 18.75176 1.000 17.38006 C ? B ? . CAA 1
   HETATM 2858 CAB . HEC A 1128 ? 3.97268 43.58459 19.28270 1.000 18.88038 C ? B ? . CAB 1
   HETATM 2859 CAC . HEC A 1128 ? 4.81814 40.98737 26.90055 1.000 20.02922 C ? B ? . CAC 1
   HETATM 2860 CAD . HEC A 1128 ? 8.96950 34.64152 24.21929 1.000 16.92752 C ? B ? . CAD 1
   HETATM 2861 CBA . HEC A 1128 ? 7.97335 33.92215 18.73107 1.000 19.34313 C ? B ? . CBA 1
   HETATM 2862 CBB . HEC A 1128 ? 2.96066 43.59045 18.10597 1.000 20.67521 C ? B ? . CBB 1
   HETATM 2863 CBC . HEC A 1128 ? 3.50866 41.64481 27.35279 1.000 21.10852 C ? B ? . CBC 1
   HETATM 2864 CBD . HEC A 1128 ? 7.90743 33.53939 24.19147 1.000 18.28667 C ? B ? . CBD 1
   HETATM 2865 CGA . HEC A 1128 ? 8.59946 32.60197 18.35443 1.000 21.77761 C ? B ? . CGA 1
   HETATM 2866 CGD . HEC A 1128 ? 8.50220 32.17052 24.35116 1.000 21.63622 C ? B ? . CGD 1
   HETATM 2867 CHA . HEC A 1128 ? 8.25542 36.23613 21.57347 1.000 18.24112 C ? B ? . CHA 1
   HETATM 2868 CHB . HEC A 1128 ? 6.73466 39.48437 18.32005 1.000 18.33115 C ? B ? . CHB 1
   HETATM 2869 CHC . HEC A 1128 ? 4.56647 41.92169 21.90830 1.000 17.93027 C ? B ? . CHC 1
   HETATM 2870 CHD . HEC A 1128 ? 6.46169 38.91351 25.13785 1.000 18.04507 C ? B ? . CHD 1
   HETATM 2871 CMA . HEC A 1128 ? 8.04971 37.15939 16.60726 1.000 18.05503 C ? B ? . CMA 1
   HETATM 2872 CMB . HEC A 1128 ? 5.45280 41.93045 16.90372 1.000 21.27687 C ? B ? . CMB 1
   HETATM 2873 CMC . HEC A 1128 ? 3.46961 43.00391 24.61292 1.000 18.23014 C ? B ? . CMC 1
   HETATM 2874 CMD . HEC A 1128 ? 7.74612 36.59491 26.69022 1.000 24.51949 C ? B ? . CMD 1
   HETATM 2875 NA . HEC A 1128 ? 7.43318 38.04414 20.15973 1.000 17.05207 N ? B ? . NA 1
   HETATM 2876 NC . HEC A 1128 ? 5.59296 40.22341 23.30787 1.000 14.96984 N ? B ? . NC 1
   HETATM 2877 O1A . HEC A 1128 ? 9.40209 32.05292 19.15953 1.000 26.32344 O ? B ? . O1A 1
   HETATM 2878 O1D . HEC A 1128 ? 8.09887 31.42371 25.27093 1.000 22.60187 O ? B ? . O1D 1
   HETATM 2879 O2A . HEC A 1128 ? 8.34630 32.12707 17.23655 1.000 24.43915 O ? B ? . O2A 1
   HETATM 2880 O2D . HEC A 1128 ? 9.47915 31.86984 23.61288 1.000 23.96636 O ? B ? . O2D 1
   HETATM 2881 FE . HEC A 1128 ? 6.71044 39.27921 21.72840 1.000 17.17872 Fe ? B ? . FE 1
   HETATM 2887 O . HOH A 2009 ? 8.69081 36.48803 13.21593 0.398 23.53693 O ? C ? . O 1
   HETATM 2910 O . HOH A 2039 ? 6.10824 49.42763 -4.18566 0.429 21.83105 O ? C ? . O 1
   HETATM 2918 O . HOH A 2048 ? 6.75332 52.93800 13.31614 0.329 20.88819 O ? C ? . O 1
   HETATM 2930 O . HOH A 2060 ? -16.13598 48.48294 7.15666 0.668 28.40812 O ? C ? . O 1
   HETATM 2938 O . HOH A 2070 ? -11.99547 40.32919 18.16242 0.635 25.16166 O ? C ? . O 1
   HETATM 2943 O . HOH A 2077 ? -3.60919 30.69704 31.70330 0.596 26.70911 O ? C ? . O 1
   HETATM 2944 O . HOH A 2078 ? 1.25231 34.85460 33.20420 0.571 29.82680 O ? C ? . O 1
   HETATM 2948 O . HOH A 2086 ? -0.66225 38.22791 32.34115 0.665 32.64151 O ? C ? . O 1
   HETATM 2957 O . HOH A 2099 ? 1.11090 60.68004 12.66323 0.794 29.54609 O ? C ? . O 1
   HETATM 2961 O . HOH A 2105 ? 4.22723 56.77612 17.43039 0.622 28.49483 O ? C ? . O 1
   HETATM 4999 O . HOH S 2107 ? 3.42398 27.67049 19.66652 0.916 19.07219 O ? D ? . O 1
   HETATM 5000 O . HOH S 2108 ? -9.00613 36.71200 20.61992 0.830 18.85530 O ? D ? . O 1
   HETATM 5002 O . HOH S 2110 ? -3.26873 49.45975 2.68661 0.639 16.61622 O ? D ? . O 1
   HETATM 5003 O . HOH S 2111 ? -7.77292 51.62534 7.86900 0.882 21.87771 O ? D ? . O 1
   HETATM 5004 O . HOH S 2112 ? -3.02081 41.45065 5.14106 0.747 21.94004 O ? D ? . O 1
   HETATM 5005 O . HOH S 2113 ? -10.57430 40.88390 9.19436 0.890 22.61420 O ? D ? . O 1
   HETATM 5006 O . HOH S 2114 ? 0.57918 54.32541 2.58408 0.695 18.55925 O ? D ? . O 1
   HETATM 5007 O . HOH S 2115 ? 10.27314 33.04914 21.42342 0.811 21.87107 O ? D ? . O 1
   HETATM 5008 O . HOH S 2116 ? 6.23753 36.60011 11.95114 0.793 24.39128 O ? D ? . O 1
   HETATM 5009 O . HOH S 2117 ? -6.87375 42.93597 4.64862 0.716 22.02186 O ? D ? . O 1
   HETATM 5010 O . HOH S 2118 ? -4.67577 28.95447 27.92578 0.647 18.63705 O ? D ? . O 1
   HETATM 5011 O . HOH S 2119 ? 3.41240 43.87175 3.48442 0.597 19.13926 O ? D ? . O 1
   HETATM 5012 O . HOH S 2120 ? -0.82680 48.29618 0.17150 0.634 17.34284 O ? D ? . O 1
   HETATM 5013 O . HOH S 2121 ? -10.88605 51.53507 1.41915 0.918 27.64167 O ? D ? . O 1
   HETATM 5014 O . HOH S 2122 ? -12.52290 46.15694 6.02910 0.786 23.66745 O ? D ? . O 1
   HETATM 5015 O . HOH S 2123 ? -4.70583 35.34963 26.41191 0.458 19.44330 O ? D ? . O 1
   HETATM 5016 O . HOH S 2124 ? -1.97472 52.42022 19.36244 0.496 21.69892 O ? D ? . O 1
   HETATM 5017 O . HOH S 2125 ? 4.80092 38.77512 7.45878 0.800 26.30026 O ? D ? . O 1
   HETATM 5018 O . HOH S 2126 ? -9.83657 46.05866 14.97593 0.668 18.90976 O ? D ? . O 1
   HETATM 5019 O . HOH S 2127 ? -0.18606 45.58743 4.58729 0.698 21.21880 O ? D ? . O 1
   HETATM 5020 O . HOH S 2128 ? -0.72382 28.44783 29.97501 0.783 24.92499 O ? D ? . O 1
   HETATM 5021 O . HOH S 2129 ? -11.70336 52.49879 7.63177 0.971 28.69603 O ? D ? . O 1
   HETATM 5022 O . HOH S 2130 ? 8.66120 34.01269 14.61874 0.612 18.26528 O ? D ? . O 1
   HETATM 5023 O . HOH S 2131 ? 7.59132 51.83233 -2.62546 0.646 22.13787 O ? D ? . O 1
   HETATM 5024 O . HOH S 2132 ? -2.48663 55.36527 -1.02184 0.606 20.57570 O ? D ? . O 1
   HETATM 5025 O . HOH S 2133 ? 3.38379 52.76688 23.63050 0.888 28.76190 O ? D ? . O 1
   HETATM 5029 O . HOH S 2137 ? -10.80660 50.50017 19.12100 0.578 21.90482 O ? D ? . O 1
   HETATM 5030 O . HOH S 2138 ? -14.19247 48.43783 5.50166 0.934 29.16404 O ? D ? . O 1
   HETATM 5031 O . HOH S 2139 ? 3.37846 59.78095 13.83681 0.736 27.04612 O ? D ? . O 1
   HETATM 5032 O . HOH S 2140 ? -9.73602 47.40761 12.72028 0.548 19.02180 O ? D ? . O 1
   HETATM 5033 O . HOH S 2141 ? 12.23155 43.76984 20.53788 0.982 36.24276 O ? D ? . O 1
   HETATM 5034 O . HOH S 2142 ? -12.47752 50.99022 17.00582 0.549 25.09277 O ? D ? . O 1
   HETATM 5035 O . HOH S 2143 ? 7.88978 24.75877 33.26746 0.600 28.97567 O ? D ? . O 1
   HETATM 5036 O . HOH S 2144 ? -0.11876 36.02061 31.09649 0.433 25.37987 O ? D ? . O 1
   HETATM 5037 O . HOH S 2145 ? -12.51294 55.22873 15.26063 0.576 27.62454 O ? D ? . O 1
   HETATM 5038 O . HOH S 2146 ? 6.53665 19.74174 28.33899 0.875 34.36216 O ? D ? . O 1
   HETATM 5039 O . HOH S 2147 ? 9.67116 50.76655 23.98179 0.708 24.03787 O ? D ? . O 1
   HETATM 5045 O . HOH S 2153 ? -2.07823 22.10369 22.18311 0.712 26.18343 O ? D ? . O 1
   HETATM 5046 O . HOH S 2154 ? -14.77434 52.16055 9.21369 0.625 26.82795 O ? D ? . O 1
   HETATM 5047 O . HOH S 2155 ? 10.78378 30.54462 31.27055 0.864 33.32352 O ? D ? . O 1
   HETATM 5048 O . HOH S 2156 ? -3.97698 28.07451 32.38473 0.715 25.57885 O ? D ? . O 1
   HETATM 5049 O . HOH S 2157 ? -4.98744 56.19124 0.09521 0.620 21.89448 O ? D ? . O 1
   HETATM 5052 O . HOH S 2160 ? 4.35366 46.31086 26.74396 0.684 26.91643 O ? D ? . O 1
   HETATM 5053 O . HOH S 2161 ? -10.76182 38.54748 13.54383 0.473 23.03592 O ? D ? . O 1
   HETATM 5058 O . HOH S 2166 ? -6.27509 38.80783 26.50598 0.528 22.05011 O ? D ? . O 1
   HETATM 5059 O . HOH S 2167 ? -12.71003 42.33252 8.24720 0.457 24.07308 O ? D ? . O 1
   HETATM 5062 O . HOH S 2170 ? 2.56019 36.09818 35.05102 0.851 36.46873 O ? D ? . O 1
   HETATM 5064 O . HOH S 2172 ? 7.39703 49.68581 29.80561 0.635 33.56313 O ? D ? . O 1
   HETATM 5065 O . HOH S 2173 ? -1.83988 19.89394 24.23621 0.739 27.92804 O ? D ? . O 1
   HETATM 5067 O . HOH S 2175 ? 18.50246 36.49829 23.08918 1.000 42.42736 O ? D ? . O 1
   HETATM 5071 O . HOH S 2179 ? -8.66999 46.64034 19.51263 0.431 22.68025 O ? D ? . O 1
   HETATM 5127 O . HOH S 2180 ? -5.07468 31.94372 23.97205 0.660 14.13955 O ? E ? . O 1
   HETATM 5128 O . HOH S 2181 ? 0.02791 46.26494 1.82930 0.561 14.42947 O ? E ? . O 1
   HETATM 5129 O . HOH S 2182 ? -2.56322 44.34241 5.66825 0.780 23.29125 O ? E ? . O 1
   HETATM 5130 O . HOH S 2183 ? -9.47272 35.29743 22.90577 0.846 24.98706 O ? E ? . O 1
   HETATM 5131 O . HOH S 2184 ? -9.48210 39.63891 7.03057 0.699 23.44425 O ? E ? . O 1
   HETATM 5132 O . HOH S 2185 ? -3.26409 57.35108 16.56257 0.777 29.60562 O ? E ? . O 1
   HETATM 5133 O . HOH S 2186 ? -12.80803 50.89027 5.65262 0.937 25.56421 O ? E ? . O 1
   HETATM 5134 O . HOH S 2187 ? 2.71231 46.21277 1.96817 0.515 16.20783 O ? E ? . O 1
   HETATM 5136 O . HOH S 2189 ? -3.69753 54.35092 -3.51604 0.710 24.12893 O ? E ? . O 1
   HETATM 5137 O . HOH S 2190 ? -4.64706 42.34275 2.96260 0.611 23.06676 O ? E ? . O 1
   HETATM 5138 O . HOH S 2191 ? -5.54416 52.98991 -1.93784 0.515 19.23685 O ? E ? . O 1
   HETATM 5139 O . HOH S 2192 ? -3.12061 26.92517 30.27994 0.461 23.91010 O ? E ? . O 1
   HETATM 5140 O . HOH S 2193 ? -7.05203 55.54915 17.82696 0.751 31.28345 O ? E ? . O 1
   HETATM 5142 O . HOH S 2195 ? 6.65075 39.11183 10.70630 0.547 26.44876 O ? E ? . O 1
   HETATM 5143 O . HOH S 2196 ? 0.97973 38.28833 34.72837 0.702 35.87697 O ? E ? . O 1
   HETATM 5144 O . HOH S 2197 ? 8.05262 22.34615 33.97443 0.835 34.46449 O ? E ? . O 1
   HETATM 5145 O . HOH S 2198 ? 4.52387 54.26904 12.87195 0.796 28.97834 O ? E ? . O 1
   HETATM 5148 O . HOH S 2201 ? 8.47307 23.94873 29.14267 0.660 30.94020 O ? E ? . O 1
   HETATM 5149 O . HOH S 2202 ? -13.23762 45.15749 8.37504 0.638 25.46668 O ? E ? . O 1
   HETATM 5151 O . HOH S 2204 ? -13.34077 44.15001 4.21476 0.961 34.81994 O ? E ? . O 1
   HETATM 5152 O . HOH S 2205 ? -13.72175 53.21622 17.02693 0.806 33.62057 O ? E ? . O 1
   HETATM 5157 O . HOH S 2210 ? -5.08377 40.84523 6.95233 0.620 24.57221 O ? E ? . O 1
   HETATM 5158 O . HOH S 2211 ? -15.27638 48.46467 2.98690 0.746 32.92782 O ? E ? . O 1
   HETATM 5159 O . HOH S 2212 ? 4.63873 55.18252 22.54406 0.942 31.20166 O ? E ? . O 1
   HETATM 5161 O . HOH S 2214 ? 18.99524 37.29748 25.42892 1.000 50.05804 O ? E ? . O 1
   HETATM 5162 O . HOH S 2215 ? 7.47096 27.58809 17.67894 0.803 30.84384 O ? E ? . O 1
   HETATM 5163 O . HOH S 2216 ? 1.79946 34.41889 36.90253 0.764 39.68528 O ? E ? . O 1
   HETATM 5164 O . HOH S 2217 ? 5.47675 48.79291 28.53301 0.527 32.54237 O ? E ? . O 1
   HETATM 5167 O . HOH S 2220 ? -4.50691 19.03777 24.77507 0.801 29.67815 O ? E ? . O 1
   HETATM 5168 O . HOH S 2221 ? -0.78721 63.40627 5.46081 0.975 39.49786 O ? E ? . O 1
   HETATM 5172 O . HOH S 2225 ? -12.50934 50.24428 -0.21125 0.942 35.77028 O ? E ? . O 1
   HETATM 5176 O . HOH S 2229 ? 0.09854 23.99179 21.29117 0.788 29.83008 O ? E ? . O 1
   HETATM 5177 O . HOH S 2230 ? -9.07816 42.29537 3.22044 0.574 26.48177 O ? E ? . O 1
   HETATM 5179 O . HOH S 2232 ? -7.34775 41.01922 6.39978 0.337 21.38599 O ? E ? . O 1
   HETATM 5186 O . HOH S 2239 ? 18.88786 36.20778 20.54788 0.964 40.68455 O ? E ? . O 1
   HETATM 5191 O . HOH S 2244 ? -10.47214 39.63610 20.65150 0.862 31.72147 O ? E ? . O 1
   HETATM 5192 O . HOH S 2245 ? -1.60978 37.49278 36.44193 1.000 44.97871 O ? E ? . O 1
   HETATM 5193 O . HOH S 2246 ? 10.86945 47.44760 29.43597 0.897 36.34221 O ? E ? . O 1
   HETATM 5196 O . HOH S 2249 ? 8.03519 52.26498 25.77326 0.730 30.19256 O ? E ? . O 1
   HETATM 5239 O . HOH S 2250 ? -5.18336 29.35878 25.17100 0.840 19.54314 O ? F ? . O 1
   HETATM 5240 O . HOH S 2251 ? 4.63788 46.44927 0.00000 0.538 16.73597 O ? F ? . O 1
   HETATM 5241 O . HOH S 2252 ? -6.30134 42.59085 21.79723 0.467 19.03270 O ? F ? . O 1
   HETATM 5242 O . HOH S 2253 ? -7.58095 32.66990 25.04725 0.548 22.00174 O ? F ? . O 1
   HETATM 5243 O . HOH S 2254 ? -5.90670 38.27533 7.06072 0.358 17.70498 O ? F ? . O 1
   HETATM 5246 O . HOH S 2257 ? 6.32898 20.75426 34.83831 0.455 25.88659 O ? F ? . O 1
   HETATM 5252 O . HOH S 2263 ? 5.32912 29.77975 37.44276 0.415 32.36686 O ? F ? . O 1
   HETATM 5253 O . HOH S 2264 ? -0.84812 49.08591 34.45442 0.767 37.49588 O ? F ? . O 1
   HETATM 5256 O . HOH S 2267 ? -11.79400 39.52578 11.49432 0.390 17.80976 O ? F ? . O 1
   HETATM 5258 O . HOH S 2269 ? 2.01910 24.41537 33.94470 0.527 33.91522 O ? F ? . O 1
   HETATM 5259 O . HOH S 2270 ? -10.70670 44.16862 2.72186 0.456 28.78600 O ? F ? . O 1
   HETATM 5264 O . HOH S 2275 ? 3.79271 49.01215 30.79380 0.487 34.24382 O ? F ? . O 1
   HETATM 5274 O . HOH S 2285 ? 6.28112 48.48204 -0.62706 0.417 21.21273 O ? F ? . O 1
   HETATM 5284 O . HOH S 2295 ? 13.81526 41.40232 20.61420 0.929 47.40955 O ? F ? . O 1
   HETATM 5306 O . HOH S 2301 ? 5.27599 41.46024 6.49742 0.403 22.71442 O ? G ? . O 1
   HETATM 5320 O . HOH S 2315 ? -5.79352 46.12332 28.21955 0.303 34.07356 O ? G ? . O 1
   HETATM 5322 O . HOH S 2317 ? 4.68426 38.13246 40.97035 0.428 32.61116 O ? G ? . O 1
   HETATM 5331 O . HOH S 2326 ? 11.70897 41.61939 19.15647 0.215 27.89875 O ? G ? . O 1
   HETATM 5333 O . HOH S 2328 ? -13.18026 41.80367 5.45570 0.379 21.26766 O ? G ? . O 1
   HETATM 5334 O . HOH S 2329 ? -5.35192 36.20274 28.81806 0.460 24.98389 O ? G ? . O 1
   HETATM 5343 O . HOH S 2338 ? -4.06893 35.18123 30.69658 0.408 26.50869 O ? G ? . O 1
   HETATM 5345 O . HOH S 2339 ? -1.24212 25.67648 30.84689 0.721 37.21027 O ? H ? . O 1
   HETATM 5355 O . HOH S 2349 ? 5.99889 41.14407 8.66224 0.429 26.33391 O ? H ? . O 1
   HETATM 5380 O . HOH S 2374 ? -6.72823 57.16303 -1.43159 0.225 21.63133 O ? H ? . O 1
   HETATM 5383 O . HOH S 2377 ? 13.29758 45.15288 22.41926 0.302 31.03625 O ? H ? . O 1

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

