data_6tx4_qFit
_cell.length_a                    42.432
_cell.length_b                    54.387
_cell.length_c                    56.689
_cell.angle_alpha                 90.000
_cell.angle_beta                  90.000
_cell.angle_gamma                 90.000
_cell.volume                      130823.992
_space_group.crystal_system       orthorhombic
_space_group.IT_number            19
_space_group.name_H-M_alt         'P 21 21 21'
_space_group.name_Hall            ' P 2ac 2ab'
_symmetry.space_group_name_H-M    'P 21 21 21'
_symmetry.space_group_name_Hall   ' P 2ac 2ab'
_symmetry.Int_Tables_number       19
_reflns.B_iso_Wilson_estimate     10.75
_refine.pdbx_refine_id            'X-RAY DIFFRACTION'
_refine.ls_d_res_low              33.97
_refine.ls_d_res_high             1.06
_refine.pdbx_ls_sigma_F           1.36
_refine.ls_percent_reflns_obs     91.23
_refine.ls_number_reflns_obs      54920
_refine.ls_number_reflns_R_work   52920
_refine.ls_number_reflns_R_free   2000
_refine.ls_R_factor_obs           0.1613
_refine.ls_R_factor_R_work        0.1608
_refine.ls_R_factor_R_free        0.1763
_refine.ls_percent_reflns_R_free  3.64
_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             0.0750
_refine.pdbx_overall_phase_error  17.1328
_refine.pdbx_stereochemistry_target_values 'GeoStd + Monomer Library + CDL v1.2'
_refine.B_iso_mean                16.46
_refine.pdbx_ls_cross_valid_method 'FREE R-VALUE'
_exptl.method                     'X-RAY DIFFRACTION'
loop_
  _space_group_symop.id
  _space_group_symop.operation_xyz
   1 x,y,z
   2 x+1/2,-y+1/2,-z
   3 -x,y+1/2,-z+1/2
   4 -x+1/2,-y,z+1/2

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 1215 0.0130 ? ?
   'X-RAY DIFFRACTION' f_angle_d 1651 1.3797 ? ?
   'X-RAY DIFFRACTION' f_chiral_restr 168 0.1299 ? ?
   'X-RAY DIFFRACTION' f_plane_restr 224 0.0089 ? ?
   'X-RAY DIFFRACTION' f_dihedral_angle_d 486 13.8332 ? ?

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' 2.55 33.97 4387 0.1568 99.58 0.1843 156
   'X-RAY DIFFRACTION' 2.03 2.55 4195 0.1634 99.89 0.1602 158
   'X-RAY DIFFRACTION' 1.77 2.03 4178 0.1591 99.98 0.1781 159
   'X-RAY DIFFRACTION' 1.61 1.77 4174 0.1571 100.00 0.1722 153
   'X-RAY DIFFRACTION' 1.49 1.61 4140 0.1531 99.98 0.1755 155
   'X-RAY DIFFRACTION' 1.41 1.49 4135 0.1609 99.98 0.1669 158
   'X-RAY DIFFRACTION' 1.34 1.41 4112 0.1579 100.00 0.1718 160
   'X-RAY DIFFRACTION' 1.28 1.34 4101 0.1595 99.98 0.1706 159
   'X-RAY DIFFRACTION' 1.23 1.28 4101 0.1597 99.95 0.1747 157
   'X-RAY DIFFRACTION' 1.19 1.23 4088 0.1657 99.55 0.1723 139
   'X-RAY DIFFRACTION' 1.15 1.19 3836 0.1728 94.02 0.1963 158
   'X-RAY DIFFRACTION' 1.12 1.15 3152 0.1759 77.11 0.1640 123
   'X-RAY DIFFRACTION' 1.09 1.12 2465 0.1965 60.27 0.2439 90
   'X-RAY DIFFRACTION' 1.06 1.09 1856 0.2373 45.44 0.2522 75

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

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.
;
 .
   Cl . . 9.50761 7.44341 . . 1.04373 23.83732 . . 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.
;
 .
   Na1+ . . 5.56094 4.42395 . . 7.30808 1.06976 . . 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
   CL
   CYS
   GLN
   GLU
   GLY
   HIS
   HOH
   HRZ
   ILE
   LEU
   LYS
   MET
   NA
   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 . GLY A 13 ? -4.64614 0.39010 -6.67764 1.000 13.68274 N ? A ? 1 N 1
   ATOM 2 CA . GLY A 13 ? -4.69513 -1.07028 -6.75961 1.000 12.87676 C ? A ? 1 CA 1
   ATOM 3 C . GLY A 13 ? -3.35325 -1.64716 -6.36068 1.000 10.27698 C ? A ? 1 C 1
   ATOM 4 O . GLY A 13 ? -2.48533 -0.93375 -5.84587 1.000 10.49002 O ? A ? 1 O 1
   ATOM 5 N . ALA A 14 ? -3.19019 -2.94450 -6.54988 1.000 10.46647 N ? A ? 2 N 1
   ATOM 6 CA . ALA A 14 ? -1.97270 -3.61160 -6.09049 1.000 9.34616 C ? A ? 2 CA 1
   ATOM 7 C . ALA A 14 ? -0.68969 -3.04091 -6.69640 1.000 8.26344 C ? A ? 2 C 1
   ATOM 8 O . ALA A 14 ? 0.29256 -2.87744 -5.93770 1.000 8.50113 O ? A ? 2 O 1
   ATOM 9 CB . ALA A 14 ? -2.06123 -5.12009 -6.31620 1.000 11.10026 C ? A ? 2 CB 1
   ATOM 10 N . PRO A 15 ? -0.63495 -2.69029 -7.98018 1.000 8.82932 N ? A ? 3 N 1
   ATOM 11 CA . PRO A 15 ? 0.61434 -2.11367 -8.49021 1.000 9.00484 C ? A ? 3 CA 1
   ATOM 12 C . PRO A 15 ? 0.95751 -0.80355 -7.81185 1.000 7.88605 C ? A ? 3 C 1
   ATOM 13 O . PRO A 15 ? 2.13664 -0.53933 -7.47260 1.000 8.22502 O ? A ? 3 O 1
   ATOM 14 CB . PRO A 15 ? 0.33568 -1.96274 -9.99128 1.000 9.89249 C ? A ? 3 CB 1
   ATOM 15 CG . PRO A 15 ? -0.66403 -3.05648 -10.26610 1.000 11.21479 C ? A ? 3 CG 1
   ATOM 16 CD . PRO A 15 ? -1.56853 -3.03358 -9.07347 1.000 11.05482 C ? A ? 3 CD 1
   ATOM 17 N . ALA A 16 ? -0.03025 0.05347 -7.60522 1.000 8.76339 N ? A ? 4 N 1
   ATOM 18 CA . ALA A 16 ? 0.24742 1.31188 -6.92432 1.000 8.93050 C ? A ? 4 CA 1
   ATOM 19 C . ALA A 16 ? 0.73655 1.06244 -5.50385 1.000 7.94001 C ? A ? 4 C 1
   ATOM 20 O . ALA A 16 ? 1.63237 1.74896 -5.00170 1.000 8.36171 O ? A ? 4 O 1
   ATOM 21 CB . ALA A 16 ? -1.02933 2.16947 -6.87648 1.000 10.92851 C ? A ? 4 CB 1
   ATOM 22 N . THR A 17 ? 0.11665 0.08095 -4.82299 1.000 8.00848 N ? A ? 5 N 1
   ATOM 23 CA . THR A 17 ? 0.50098 -0.20041 -3.44155 1.000 8.42944 C ? A ? 5 CA 1
   ATOM 24 C . THR A 17 ? 1.93361 -0.69975 -3.33154 1.000 7.71166 C ? A ? 5 C 1
   ATOM 25 O . THR A 17 ? 2.67273 -0.24833 -2.45137 1.000 8.19415 O ? A ? 5 O 1
   ATOM 26 CB . THR A 17 ? -0.51272 -1.13299 -2.81326 1.000 8.45377 C ? A ? 5 CB 1
   ATOM 27 OG1 . THR A 17 ? -1.75524 -0.42705 -2.76721 1.000 9.51095 O ? A ? 5 OG1 1
   ATOM 28 CG2 . THR A 17 ? -0.09127 -1.53563 -1.40061 1.000 9.73989 C ? A ? 5 CG2 1
   ATOM 29 N . VAL A 18 ? 2.36222 -1.60082 -4.22531 1.000 7.33277 N ? A ? 6 N 1
   ATOM 30 CA . VAL A 18 ? 3.74603 -2.02916 -4.11605 1.000 7.45738 C ? A ? 6 CA 1
   ATOM 31 C . VAL A 18 ? 4.70526 -0.91636 -4.54352 1.000 7.82460 C ? A ? 6 C 1
   ATOM 32 O . VAL A 18 ? 5.81180 -0.78497 -3.98692 1.000 8.24077 O ? A ? 6 O 1
   ATOM 33 CB . VAL A 18 ? 4.00439 -3.36565 -4.84690 1.000 8.73118 C ? A ? 6 CB 1
   ATOM 34 CG1 . VAL A 18 ? 3.70150 -3.33857 -6.30728 1.000 9.48636 C ? A ? 6 CG1 1
   ATOM 35 CG2 . VAL A 18 ? 5.41507 -3.89170 -4.57113 1.000 9.21516 C ? A ? 6 CG2 1
   ATOM 36 N . THR A 19 ? 4.29429 -0.05493 -5.48654 1.000 7.51435 N ? A ? 7 N 1
   ATOM 37 CA . THR A 19 ? 5.14772 1.06533 -5.85875 1.000 8.45273 C ? A ? 7 CA 1
   ATOM 38 C . THR A 19 ? 5.38980 1.96941 -4.65370 1.000 8.05717 C ? A ? 7 C 1
   ATOM 39 O . THR A 19 ? 6.51851 2.46363 -4.43714 1.000 9.29040 O ? A ? 7 O 1
   ATOM 40 CB . THR A 19 ? 4.46432 1.86374 -6.98125 1.000 7.90877 C ? A ? 7 CB 1
   ATOM 41 OG1 . THR A 19 ? 4.28078 1.03771 -8.12990 1.000 8.72821 O ? A ? 7 OG1 1
   ATOM 42 CG2 . THR A 19 ? 5.29157 3.08754 -7.37939 1.000 9.74613 C ? A ? 7 CG2 1
   ATOM 43 N . GLU A 20 ? 4.34076 2.27031 -3.89382 1.000 8.73127 N ? A ? 8 N 1
   ATOM 44 CA . GLU A 20 ? 4.39611 3.25254 -2.83403 1.000 10.01124 C ? A ? 8 CA 1
   ATOM 45 C . GLU A 20 ? 4.75655 2.66965 -1.48443 1.000 8.89631 C ? A ? 8 C 1
   ATOM 46 O . GLU A 20 ? 5.22192 3.42569 -0.60603 1.000 12.55607 O ? A ? 8 O 1
   ATOM 47 CB . GLU A 20 ? 3.02221 3.93974 -2.71937 1.000 11.33241 C ? A ? 8 CB 1
   ATOM 48 CG . GLU A 20 ? 2.69667 4.64285 -4.02547 1.000 15.25752 C ? A ? 8 CG 1
   ATOM 49 CD . GLU A 20 ? 1.30462 5.32111 -4.12226 1.000 25.64969 C ? A ? 8 CD 1
   ATOM 50 OE1 . GLU A 20 ? 0.33706 4.94185 -3.41874 1.000 22.83569 O ? A ? 8 OE1 1
   ATOM 51 OE2 . GLU A 20 ? 1.18895 6.25174 -4.96836 1.000 28.63080 O ? A ? 8 OE2 1
   ATOM 52 N . GLN A 21 ? 4.57749 1.37139 -1.27261 1.000 8.23051 N ? A ? 9 N 1
   ATOM 53 CA . GLN A 21 ? 4.69865 0.74705 0.02729 1.000 8.32271 C ? A ? 9 CA 1
   ATOM 54 C . GLN A 21 ? 5.59097 -0.46978 0.01481 1.000 7.66698 C ? A ? 9 C 1
   ATOM 55 O . GLN A 21 ? 5.67334 -1.16427 1.03706 1.000 8.97354 O ? A ? 9 O 1
   ATOM 56 CB . GLN A 21 ? 3.32327 0.33274 0.57290 1.000 8.57443 C ? A ? 9 CB 1
   ATOM 57 CG . GLN A 21 ? 2.25780 1.41980 0.57428 1.000 10.49855 C ? A ? 9 CG 1
   ATOM 58 CD . GLN A 21 ? 2.54876 2.59776 1.47051 1.000 10.43199 C ? A ? 9 CD 1
   ATOM 59 OE1 . GLN A 21 ? 3.31981 2.49841 2.44776 1.000 11.17583 O ? A ? 9 OE1 1
   ATOM 60 NE2 . GLN A 21 ? 1.98618 3.76200 1.13405 1.000 12.48478 N ? A ? 9 NE2 1
   ATOM 61 N A GLY A 22 ? 6.23881 -0.78344 -1.11210 0.558 8.52369 N ? A ? 10 N 1
   ATOM 62 CA A GLY A 22 ? 7.09089 -1.94971 -1.18684 0.558 8.44760 C ? A ? 10 CA 1
   ATOM 63 C A GLY A 22 ? 8.45282 -1.72815 -0.54102 0.558 8.00452 C ? A ? 10 C 1
   ATOM 64 O A GLY A 22 ? 8.86364 -0.59618 -0.25836 0.558 8.93446 O ? A ? 10 O 1
   ATOM 65 N B GLY A 22 ? 6.26077 -0.74972 -1.10724 0.442 8.68462 N ? A ? 10 N 1
   ATOM 66 CA B GLY A 22 ? 7.10766 -1.91304 -1.21620 0.442 8.32742 C ? A ? 10 CA 1
   ATOM 67 C B GLY A 22 ? 8.51308 -1.69543 -0.66536 0.442 7.96953 C ? A ? 10 C 1
   ATOM 68 O B GLY A 22 ? 9.08135 -0.60804 -0.60322 0.442 9.12624 O ? A ? 10 O 1
   ATOM 69 N A GLU A 23 ? 9.13319 -2.84959 -0.30741 0.558 8.31618 N ? A ? 11 N 1
   ATOM 70 CA A GLU A 23 ? 10.47787 -2.88381 0.24866 0.558 8.74641 C ? A ? 11 CA 1
   ATOM 71 C A GLU A 23 ? 11.48443 -3.02431 -0.88425 0.558 7.63422 C ? A ? 11 C 1
   ATOM 72 O A GLU A 23 ? 11.35871 -3.91412 -1.73589 0.558 7.45332 O ? A ? 11 O 1
   ATOM 73 CB A GLU A 23 ? 10.62932 -4.09286 1.16496 0.558 10.68781 C ? A ? 11 CB 1
   ATOM 74 CG A GLU A 23 ? 12.05779 -4.31120 1.62277 0.558 14.72997 C ? A ? 11 CG 1
   ATOM 75 CD A GLU A 23 ? 12.15805 -5.26870 2.76083 0.558 28.37118 C ? A ? 11 CD 1
   ATOM 76 OE1 A GLU A 23 ? 11.16053 -5.96922 3.02470 0.558 19.17849 O ? A ? 11 OE1 1
   ATOM 77 OE2 A GLU A 23 ? 13.23268 -5.29751 3.39593 0.558 33.26886 O ? A ? 11 OE2 1
   ATOM 78 N B GLU A 23 ? 9.13759 -2.79030 -0.29700 0.442 8.12549 N ? A ? 11 N 1
   ATOM 79 CA B GLU A 23 ? 10.46554 -2.73109 0.27802 0.442 8.78383 C ? A ? 11 CA 1
   ATOM 80 C B GLU A 23 ? 11.49842 -3.05688 -0.78901 0.442 7.59210 C ? A ? 11 C 1
   ATOM 81 O B GLU A 23 ? 11.37836 -4.06251 -1.51563 0.442 7.63034 O ? A ? 11 O 1
   ATOM 82 CB B GLU A 23 ? 10.57502 -3.72067 1.42328 0.442 7.61724 C ? A ? 11 CB 1
   ATOM 83 CG B GLU A 23 ? 11.91922 -3.78193 2.05669 0.442 6.56500 C ? A ? 11 CG 1
   ATOM 84 CD B GLU A 23 ? 11.92793 -4.80076 3.18354 0.442 20.73570 C ? A ? 11 CD 1
   ATOM 85 OE1 B GLU A 23 ? 11.26953 -4.53399 4.22405 0.442 15.64588 O ? A ? 11 OE1 1
   ATOM 86 OE2 B GLU A 23 ? 12.54888 -5.88260 2.99858 0.442 23.71436 O ? A ? 11 OE2 1
   ATOM 87 N . ASP A 24 ? 12.51825 -2.21002 -0.86889 1.000 8.50392 N ? A ? 12 N 1
   ATOM 88 CA . ASP A 24 ? 13.61447 -2.37942 -1.83068 1.000 8.76256 C ? A ? 12 CA 1
   ATOM 89 C . ASP A 24 ? 14.43103 -3.59823 -1.42110 1.000 8.93557 C ? A ? 12 C 1
   ATOM 90 O . ASP A 24 ? 15.02527 -3.62660 -0.31882 1.000 11.43324 O ? A ? 12 O 1
   ATOM 91 CB . ASP A 24 ? 14.46783 -1.12491 -1.83925 1.000 9.68862 C ? A ? 12 CB 1
   ATOM 92 CG . ASP A 24 ? 15.56794 -1.14014 -2.85875 1.000 10.10614 C ? A ? 12 CG 1
   ATOM 93 OD1 . ASP A 24 ? 15.74100 -2.11924 -3.60260 1.000 10.28664 O ? A ? 12 OD1 1
   ATOM 94 OD2 . ASP A 24 ? 16.30053 -0.09421 -2.97276 1.000 11.62409 O ? A ? 12 OD2 1
   ATOM 95 N . ILE A 25 ? 14.51134 -4.59752 -2.29077 1.000 8.29178 N ? A ? 13 N 1
   ATOM 96 CA . ILE A 25 ? 15.25748 -5.82584 -2.04240 1.000 9.65587 C ? A ? 13 CA 1
   ATOM 97 C . ILE A 25 ? 16.52486 -5.89531 -2.86849 1.000 9.87530 C ? A ? 13 C 1
   ATOM 98 O . ILE A 25 ? 17.19268 -6.95154 -2.87364 1.000 11.64364 O ? A ? 13 O 1
   ATOM 99 CB . ILE A 25 ? 14.39970 -7.07146 -2.24896 1.000 9.14764 C ? A ? 13 CB 1
   ATOM 100 CG1 . ILE A 25 ? 13.83892 -7.15806 -3.66270 1.000 10.04506 C ? A ? 13 CG1 1
   ATOM 101 CG2 . ILE A 25 ? 13.25863 -7.08993 -1.20858 1.000 10.72589 C ? A ? 13 CG2 1
   ATOM 102 CD1 . ILE A 25 ? 13.22624 -8.53505 -3.98635 1.000 10.45663 C ? A ? 13 CD1 1
   ATOM 103 N . THR A 26 ? 16.88629 -4.83571 -3.57341 1.000 9.47890 N ? A ? 14 N 1
   ATOM 104 CA . THR A 26 ? 18.12576 -4.87483 -4.33482 1.000 11.23741 C ? A ? 14 CA 1
   ATOM 105 C . THR A 26 ? 19.36114 -4.72908 -3.43806 1.000 11.41716 C ? A ? 14 C 1
   ATOM 106 O . THR A 26 ? 19.34811 -4.01271 -2.43301 1.000 13.35764 O ? A ? 14 O 1
   ATOM 107 CB . THR A 26 ? 18.12570 -3.76970 -5.38034 1.000 10.03238 C ? A ? 14 CB 1
   ATOM 108 OG1 . THR A 26 ? 18.14752 -2.46084 -4.76596 1.000 11.11484 O ? A ? 14 OG1 1
   ATOM 109 CG2 . THR A 26 ? 17.00598 -3.91626 -6.35930 1.000 12.58591 C ? A ? 14 CG2 1
   ATOM 110 N B SER A 27 ? 20.46139 -5.37774 -3.85833 0.408 11.00240 N ? A ? 15 N 1
   ATOM 111 CA B SER A 27 ? 21.76249 -5.15908 -3.21971 0.408 11.66094 C ? A ? 15 CA 1
   ATOM 112 C B SER A 27 ? 22.19235 -3.71348 -3.32132 0.408 13.22299 C ? A ? 15 C 1
   ATOM 113 O B SER A 27 ? 22.74077 -3.13780 -2.36244 0.408 14.00927 O ? A ? 15 O 1
   ATOM 114 CB B SER A 27 ? 22.83084 -6.05077 -3.84007 0.408 11.08022 C ? A ? 15 CB 1
   ATOM 115 OG B SER A 27 ? 22.56227 -7.35124 -3.39678 0.408 12.86026 O ? A ? 15 OG 1
   ATOM 116 N C SER A 27 ? 20.46376 -5.37599 -3.84147 0.592 10.86370 N ? A ? 15 N 1
   ATOM 117 CA C SER A 27 ? 21.72659 -5.15885 -3.13338 0.592 12.81233 C ? A ? 15 CA 1
   ATOM 118 C C SER A 27 ? 22.27980 -3.75753 -3.35344 0.592 13.06206 C ? A ? 15 C 1
   ATOM 119 O C SER A 27 ? 23.01475 -3.25177 -2.49086 0.592 13.28336 O ? A ? 15 O 1
   ATOM 120 CB C SER A 27 ? 22.77307 -6.19743 -3.50343 0.592 15.92924 C ? A ? 15 CB 1
   ATOM 121 OG C SER A 27 ? 23.10807 -6.04992 -4.86337 0.592 13.73045 O ? A ? 15 OG 1
   ATOM 122 N . LYS A 28 ? 21.96856 -3.11926 -4.47952 1.000 12.04611 N ? A ? 16 N 1
   ATOM 123 CA . LYS A 28 ? 22.41543 -1.75625 -4.71821 1.000 14.78154 C ? A ? 16 CA 1
   ATOM 124 C . LYS A 28 ? 21.58145 -0.73019 -4.00695 1.000 12.18227 C ? A ? 16 C 1
   ATOM 125 O . LYS A 28 ? 21.98603 0.43794 -3.96527 1.000 15.74060 O ? A ? 16 O 1
   ATOM 126 CB . LYS A 28 ? 22.36793 -1.43743 -6.21492 1.000 17.46173 C ? A ? 16 CB 1
   ATOM 127 CG . LYS A 28 ? 23.49620 -2.05843 -7.02452 1.000 25.42827 C ? A ? 16 CG 1
   ATOM 128 CD . LYS A 28 ? 23.48104 -1.50024 -8.44652 1.000 38.37198 C ? A ? 16 CD 1
   ATOM 129 CE . LYS A 28 ? 23.63163 0.02095 -8.43964 1.000 54.22702 C ? A ? 16 CE 1
   ATOM 130 NZ . LYS A 28 ? 25.00908 0.50123 -8.07983 1.000 60.53587 N ? A ? 16 NZ 1
   ATOM 131 N . LYS A 29 ? 20.39761 -1.09351 -3.50905 1.000 11.83098 N ? A ? 17 N 1
   ATOM 132 CA . LYS A 29 ? 19.47333 -0.14698 -2.88167 1.000 12.25113 C ? A ? 17 CA 1
   ATOM 133 C . LYS A 29 ? 19.11083 0.98201 -3.83912 1.000 12.12881 C ? A ? 17 C 1
   ATOM 134 O . LYS A 29 ? 19.09403 2.17077 -3.47861 1.000 13.94930 O ? A ? 17 O 1
   ATOM 135 CB . LYS A 29 ? 19.96635 0.35343 -1.52039 1.000 15.53787 C ? A ? 17 CB 1
   ATOM 136 CG . LYS A 29 ? 20.03129 -0.80283 -0.50353 1.000 20.56610 C ? A ? 17 CG 1
   ATOM 137 CD . LYS A 29 ? 18.67065 -1.53100 -0.47055 1.000 40.48621 C ? A ? 17 CD 1
   ATOM 138 CE . LYS A 29 ? 18.56478 -2.63296 0.61408 1.000 49.47611 C ? A ? 17 CE 1
   ATOM 139 NZ . LYS A 29 ? 19.44007 -3.82667 0.42137 1.000 40.14425 N ? A ? 17 NZ 1
   ATOM 140 N . ASP A 30 ? 18.79313 0.60686 -5.06946 1.000 11.96902 N ? A ? 18 N 1
   ATOM 141 CA . ASP A 30 ? 18.42848 1.55987 -6.09885 1.000 11.80496 C ? A ? 18 CA 1
   ATOM 142 C . ASP A 30 ? 16.94517 1.55362 -6.39409 1.000 11.81168 C ? A ? 18 C 1
   ATOM 143 O . ASP A 30 ? 16.52070 2.16475 -7.38723 1.000 14.12321 O ? A ? 18 O 1
   ATOM 144 CB . ASP A 30 ? 19.25848 1.32470 -7.35073 1.000 13.88068 C ? A ? 18 CB 1
   ATOM 145 CG . ASP A 30 ? 19.00547 -0.03111 -7.98030 1.000 12.98182 C ? A ? 18 CG 1
   ATOM 146 OD1 . ASP A 30 ? 18.00635 -0.71823 -7.61467 1.000 13.19102 O ? A ? 18 OD1 1
   ATOM 147 OD2 . ASP A 30 ? 19.78008 -0.41052 -8.88170 1.000 16.10826 O ? A ? 18 OD2 1
   ATOM 148 N . ARG A 31 ? 16.14954 0.90838 -5.55203 1.000 11.83819 N ? A ? 19 N 1
   ATOM 149 CA . ARG A 31 ? 14.70447 0.84758 -5.71611 1.000 11.51083 C ? A ? 19 CA 1
   ATOM 150 C . ARG A 31 ? 14.25273 0.16837 -7.00932 1.000 11.27981 C ? A ? 19 C 1
   ATOM 151 O . ARG A 31 ? 13.10992 0.31660 -7.43478 1.000 11.50595 O ? A ? 19 O 1
   ATOM 152 CB . ARG A 31 ? 13.95020 2.12968 -5.36159 1.000 16.45541 C ? A ? 19 CB 1
   ATOM 153 CG . ARG A 31 ? 14.06150 2.39980 -3.81502 1.000 17.98125 C ? A ? 19 CG 1
   ATOM 154 CD . ARG A 31 ? 13.37444 3.62419 -3.35618 1.000 18.75208 C ? A ? 19 CD 1
   ATOM 155 NE . ARG A 31 ? 11.95974 3.58457 -3.67611 1.000 15.02971 N ? A ? 19 NE 1
   ATOM 156 CZ . ARG A 31 ? 11.01822 3.11191 -2.86825 1.000 15.22220 C ? A ? 19 CZ 1
   ATOM 157 NH1 . ARG A 31 ? 11.30080 2.57767 -1.69426 1.000 14.17887 N ? A ? 19 NH1 1
   ATOM 158 NH2 . ARG A 31 ? 9.75066 3.22225 -3.21151 1.000 17.13645 N ? A ? 19 NH2 1
   ATOM 159 N . GLY A 32 ? 15.11166 -0.64859 -7.61662 1.000 9.80983 N ? A ? 20 N 1
   ATOM 160 CA . GLY A 32 ? 14.76605 -1.25003 -8.89173 1.000 10.08128 C ? A ? 20 CA 1
   ATOM 161 C . GLY A 32 ? 13.81276 -2.42447 -8.78663 1.000 8.72673 C ? A ? 20 C 1
   ATOM 162 O . GLY A 32 ? 13.18216 -2.80897 -9.78937 1.000 9.17329 O ? A ? 20 O 1
   ATOM 163 N . VAL A 33 ? 13.74554 -3.04845 -7.61006 1.000 8.08479 N ? A ? 21 N 1
   ATOM 164 CA . VAL A 33 ? 12.85029 -4.16769 -7.34066 1.000 7.73292 C ? A ? 21 CA 1
   ATOM 165 C . VAL A 33 ? 12.25766 -3.93034 -5.96292 1.000 7.50052 C ? A ? 21 C 1
   ATOM 166 O . VAL A 33 ? 12.99493 -3.90444 -4.97677 1.000 8.25940 O ? A ? 21 O 1
   ATOM 167 CB . VAL A 33 ? 13.55384 -5.52396 -7.39143 1.000 9.26566 C ? A ? 21 CB 1
   ATOM 168 CG1 . VAL A 33 ? 12.53477 -6.63531 -7.23713 1.000 10.58577 C ? A ? 21 CG1 1
   ATOM 169 CG2 . VAL A 33 ? 14.36659 -5.66413 -8.68025 1.000 10.14393 C ? A ? 21 CG2 1
   ATOM 170 N . LEU A 34 ? 10.94144 -3.75367 -5.89804 1.000 7.58665 N ? A ? 22 N 1
   ATOM 171 CA . LEU A 34 ? 10.22656 -3.54995 -4.64528 1.000 7.63342 C ? A ? 22 CA 1
   ATOM 172 C . LEU A 34 ? 9.32327 -4.74278 -4.40050 1.000 6.98647 C ? A ? 22 C 1
   ATOM 173 O . LEU A 34 ? 8.72915 -5.28478 -5.34902 1.000 8.13369 O ? A ? 22 O 1
   ATOM 174 CB . LEU A 34 ? 9.38778 -2.28464 -4.68177 1.000 8.51935 C ? A ? 22 CB 1
   ATOM 175 CG . LEU A 34 ? 10.11781 -0.98474 -4.99137 1.000 9.03072 C ? A ? 22 CG 1
   ATOM 176 CD1 . LEU A 34 ? 9.16669 0.15636 -5.15302 1.000 11.60330 C ? A ? 22 CD1 1
   ATOM 177 CD2 . LEU A 34 ? 11.26540 -0.67520 -4.00124 1.000 12.02405 C ? A ? 22 CD2 1
   ATOM 178 N . LYS A 35 ? 9.17617 -5.14559 -3.14331 1.000 7.02963 N ? A ? 23 N 1
   ATOM 179 CA . LYS A 35 ? 8.47254 -6.36798 -2.77843 1.000 6.88372 C ? A ? 23 CA 1
   ATOM 180 C . LYS A 35 ? 7.49897 -6.11382 -1.63767 1.000 7.17203 C ? A ? 23 C 1
   ATOM 181 O . LYS A 35 ? 7.81092 -5.40434 -0.66398 1.000 7.79690 O ? A ? 23 O 1
   ATOM 182 CB . LYS A 35 ? 9.48086 -7.43274 -2.32733 1.000 7.93605 C ? A ? 23 CB 1
   ATOM 183 CG . LYS A 35 ? 8.87321 -8.76787 -1.95977 1.000 7.90836 C ? A ? 23 CG 1
   ATOM 184 CD . LYS A 35 ? 9.86699 -9.76440 -1.42972 1.000 8.46426 C ? A ? 23 CD 1
   ATOM 185 CE . LYS A 35 ? 9.18643 -11.06863 -1.04527 1.000 7.96004 C ? A ? 23 CE 1
   ATOM 186 NZ . LYS A 35 ? 10.01708 -11.97041 -0.21291 1.000 8.44298 N ? A ? 23 NZ 1
   ATOM 187 N . ILE A 36 ? 6.32756 -6.76558 -1.70449 1.000 7.30047 N ? A ? 24 N 1
   ATOM 188 CA . ILE A 36 ? 5.44477 -6.94994 -0.54546 1.000 7.29624 C ? A ? 24 CA 1
   ATOM 189 C . ILE A 36 ? 5.15093 -8.42970 -0.39831 1.000 7.34284 C ? A ? 24 C 1
   ATOM 190 O . ILE A 36 ? 4.76681 -9.08939 -1.37623 1.000 7.75156 O ? A ? 24 O 1
   ATOM 191 CB . ILE A 36 ? 4.12509 -6.15810 -0.69014 1.000 7.37412 C ? A ? 24 CB 1
   ATOM 192 CG1 . ILE A 36 ? 4.37355 -4.65282 -0.71038 1.000 7.97977 C ? A ? 24 CG1 1
   ATOM 193 CG2 . ILE A 36 ? 3.13635 -6.53979 0.38251 1.000 8.80796 C ? A ? 24 CG2 1
   ATOM 194 CD1 . ILE A 36 ? 3.15520 -3.80246 -1.03302 1.000 8.45875 C ? A ? 24 CD1 1
   ATOM 195 N . VAL A 37 ? 5.29797 -8.94862 0.81935 1.000 7.48869 N ? A ? 25 N 1
   ATOM 196 CA . VAL A 37 ? 4.87843 -10.31386 1.10367 1.000 7.56503 C ? A ? 25 CA 1
   ATOM 197 C . VAL A 37 ? 3.37764 -10.30916 1.34179 1.000 8.28749 C ? A ? 25 C 1
   ATOM 198 O . VAL A 37 ? 2.89046 -9.61794 2.25729 1.000 8.84193 O ? A ? 25 O 1
   ATOM 199 CB . VAL A 37 ? 5.62427 -10.90103 2.31369 1.000 8.24917 C ? A ? 25 CB 1
   ATOM 200 CG1 . VAL A 37 ? 5.08628 -12.31173 2.62874 1.000 9.52810 C ? A ? 25 CG1 1
   ATOM 201 CG2 . VAL A 37 ? 7.10726 -10.93288 2.08898 1.000 10.04855 C ? A ? 25 CG2 1
   ATOM 202 N . LYS A 38 ? 2.62339 -11.06422 0.54170 1.000 7.67329 N ? A ? 26 N 1
   ATOM 203 CA . LYS A 38 ? 1.17743 -11.15507 0.64835 1.000 8.52053 C ? A ? 26 CA 1
   ATOM 204 C . LYS A 38 ? 0.75898 -12.34870 1.48917 1.000 7.92859 C ? A ? 26 C 1
   ATOM 205 O . LYS A 38 ? -0.20757 -12.24697 2.28928 1.000 9.71500 O ? A ? 26 O 1
   ATOM 206 CB . LYS A 38 ? 0.57887 -11.23922 -0.76071 1.000 9.30662 C ? A ? 26 CB 1
   ATOM 207 CG . LYS A 38 ? 0.82043 -9.98888 -1.60737 1.000 9.91840 C ? A ? 26 CG 1
   ATOM 208 CD . LYS A 38 ? 0.19028 -8.71435 -1.08263 1.000 9.84904 C ? A ? 26 CD 1
   ATOM 209 CE . LYS A 38 ? -1.29618 -8.76856 -1.25708 1.000 9.63972 C ? A ? 26 CE 1
   ATOM 210 NZ . LYS A 38 ? -2.02521 -7.54897 -0.80933 1.000 12.33664 N ? A ? 26 NZ 1
   ATOM 211 N . ARG A 39 ? 1.40814 -13.50815 1.31655 1.000 9.16585 N ? A ? 27 N 1
   ATOM 212 CA . ARG A 39 ? 1.15553 -14.67520 2.15577 1.000 10.56394 C ? A ? 27 CA 1
   ATOM 213 C . ARG A 39 ? 2.48313 -15.18245 2.65221 1.000 10.17263 C ? A ? 27 C 1
   ATOM 214 O . ARG A 39 ? 3.37378 -15.49993 1.83246 1.000 9.73511 O ? A ? 27 O 1
   ATOM 215 CB . ARG A 39 ? 0.44622 -15.79576 1.43917 1.000 12.34731 C ? A ? 27 CB 1
   ATOM 216 CG . ARG A 39 ? 0.13720 -16.95373 2.40042 1.000 13.31134 C ? A ? 27 CG 1
   ATOM 217 CD . ARG A 39 ? -0.63065 -18.04434 1.78240 1.000 14.80589 C ? A ? 27 CD 1
   ATOM 218 NE . ARG A 39 ? 0.19999 -18.78509 0.84552 1.000 13.03212 N ? A ? 27 NE 1
   ATOM 219 CZ . ARG A 39 ? -0.31890 -19.51908 -0.11186 1.000 13.64656 C ? A ? 27 CZ 1
   ATOM 220 NH1 . ARG A 39 ? -1.64189 -19.58191 -0.29417 1.000 16.72076 N ? A ? 27 NH1 1
   ATOM 221 NH2 . ARG A 39 ? 0.46433 -20.23701 -0.91056 1.000 15.22762 N ? A ? 27 NH2 1
   ATOM 222 N . VAL A 40 ? 2.64428 -15.26345 3.97560 1.000 11.87324 N ? A ? 28 N 1
   ATOM 223 CA . VAL A 40 ? 3.85874 -15.78233 4.57231 1.000 11.81561 C ? A ? 28 CA 1
   ATOM 224 C . VAL A 40 ? 3.95056 -17.26805 4.26708 1.000 10.95788 C ? A ? 28 C 1
   ATOM 225 O . VAL A 40 ? 2.96641 -18.01238 4.40319 1.000 12.38526 O ? A ? 28 O 1
   ATOM 226 CB . VAL A 40 ? 3.88694 -15.51092 6.08909 1.000 13.68855 C ? A ? 28 CB 1
   ATOM 227 CG1 . VAL A 40 ? 5.05603 -16.21320 6.78066 1.000 15.58671 C ? A ? 28 CG1 1
   ATOM 228 CG2 . VAL A 40 ? 3.93002 -13.98847 6.36476 1.000 15.14116 C ? A ? 28 CG2 1
   ATOM 229 N . GLY A 41 ? 5.11948 -17.70116 3.85211 1.000 10.88578 N ? A ? 29 N 1
   ATOM 230 CA . GLY A 41 ? 5.36945 -19.09288 3.53862 1.000 10.93354 C ? A ? 29 CA 1
   ATOM 231 C . GLY A 41 ? 5.82916 -19.89346 4.76563 1.000 13.04448 C ? A ? 29 C 1
   ATOM 232 O . GLY A 41 ? 5.67233 -19.48695 5.92347 1.000 14.15343 O ? A ? 29 O 1
   ATOM 233 N . ASN A 42 ? 6.46912 -21.02823 4.49445 1.000 13.15427 N ? A ? 30 N 1
   ATOM 234 CA . ASN A 42 ? 6.72987 -22.04739 5.51128 1.000 13.66354 C ? A ? 30 CA 1
   ATOM 235 C . ASN A 42 ? 8.18738 -22.03697 5.96954 1.000 15.29993 C ? A ? 30 C 1
   ATOM 236 O . ASN A 42 ? 9.12902 -22.10765 5.14979 1.000 19.43876 O ? A ? 30 O 1
   ATOM 237 CB . ASN A 42 ? 6.39427 -23.41340 4.92075 1.000 15.75874 C ? A ? 30 CB 1
   ATOM 238 CG . ASN A 42 ? 4.95761 -23.48673 4.49665 1.000 17.18206 C ? A ? 30 CG 1
   ATOM 239 OD1 . ASN A 42 ? 4.09822 -22.88503 5.15236 1.000 22.05322 O ? A ? 30 OD1 1
   ATOM 240 ND2 . ASN A 42 ? 4.67140 -24.15012 3.39823 1.000 18.36033 N ? A ? 30 ND2 1
   ATOM 241 N . GLY A 43 ? 8.37395 -22.00747 7.27966 1.000 18.10985 N ? A ? 31 N 1
   ATOM 242 CA . GLY A 43 ? 9.72035 -22.19264 7.76111 1.000 24.64673 C ? A ? 31 CA 1
   ATOM 243 C . GLY A 43 ? 10.54030 -20.94129 7.52782 1.000 22.23667 C ? A ? 31 C 1
   ATOM 244 O . GLY A 43 ? 10.02175 -19.83128 7.39247 1.000 27.56533 O ? A ? 31 O 1
   ATOM 245 N . GLU A 44 ? 11.85115 -21.13261 7.51142 1.000 18.82719 N ? A ? 32 N 1
   ATOM 246 CA . GLU A 44 ? 12.76120 -20.02393 7.34736 1.000 18.11800 C ? A ? 32 CA 1
   ATOM 247 C . GLU A 44 ? 13.63517 -20.15893 6.11773 1.000 14.81270 C ? A ? 32 C 1
   ATOM 248 O . GLU A 44 ? 14.40581 -19.22395 5.81238 1.000 19.42475 O ? A ? 32 O 1
   ATOM 249 CB . GLU A 44 ? 13.61189 -19.84063 8.61128 1.000 24.55028 C ? A ? 32 CB 1
   ATOM 250 CG . GLU A 44 ? 12.81355 -19.19150 9.75480 1.000 41.58844 C ? A ? 32 CG 1
   ATOM 251 CD . GLU A 44 ? 12.34272 -17.77525 9.40926 1.000 52.10882 C ? A ? 32 CD 1
   ATOM 252 OE1 . GLU A 44 ? 13.04147 -17.07190 8.63610 1.000 55.51009 O ? A ? 32 OE1 1
   ATOM 253 OE2 . GLU A 44 ? 11.27052 -17.36518 9.91156 1.000 50.61974 O ? A ? 32 OE2 1
   ATOM 254 N . GLU A 45 ? 13.57726 -21.27524 5.40240 1.000 12.76053 N ? A ? 33 N 1
   ATOM 255 CA . GLU A 45 ? 14.58710 -21.49020 4.37289 1.000 10.45697 C ? A ? 33 CA 1
   ATOM 256 C . GLU A 45 ? 14.17443 -20.89671 3.03320 1.000 9.81696 C ? A ? 33 C 1
   ATOM 257 O . GLU A 45 ? 13.02760 -21.05819 2.60815 1.000 12.31203 O ? A ? 33 O 1
   ATOM 258 CB . GLU A 45 ? 14.84451 -22.98561 4.24220 1.000 12.00723 C ? A ? 33 CB 1
   ATOM 259 CG . GLU A 45 ? 16.06632 -23.24335 3.35222 1.000 14.19598 C ? A ? 33 CG 1
   ATOM 260 CD . GLU A 45 ? 16.47464 -24.70498 3.22249 1.000 13.79682 C ? A ? 33 CD 1
   ATOM 261 OE1 . GLU A 45 ? 15.69228 -25.61856 3.61562 1.000 15.75984 O ? A ? 33 OE1 1
   ATOM 262 OE2 . GLU A 45 ? 17.60720 -24.91866 2.72296 1.000 14.74822 O ? A ? 33 OE2 1
   ATOM 263 N . THR A 46 ? 15.06846 -20.18328 2.41044 1.000 10.43432 N ? A ? 34 N 1
   ATOM 264 CA . THR A 46 ? 14.91118 -19.70593 1.05406 1.000 8.89039 C ? A ? 34 CA 1
   ATOM 265 C . THR A 46 ? 15.70734 -20.59172 0.12119 1.000 8.80661 C ? A ? 34 C 1
   ATOM 266 O . THR A 46 ? 16.61142 -21.32399 0.57172 1.000 9.70321 O ? A ? 34 O 1
   ATOM 267 CB . THR A 46 ? 15.39831 -18.26280 0.96041 1.000 9.56856 C ? A ? 34 CB 1
   ATOM 268 OG1 . THR A 46 ? 16.78320 -18.26160 1.27744 1.000 11.19450 O ? A ? 34 OG1 1
   ATOM 269 CG2 . THR A 46 ? 14.62431 -17.30476 1.84228 1.000 11.94358 C ? A ? 34 CG2 1
   ATOM 270 N A PRO A 47 ? 15.43542 -20.53826 -1.17660 0.336 8.63971 N ? A ? 35 N 1
   ATOM 271 CA A PRO A 47 ? 16.15202 -21.42668 -2.09328 0.336 9.14536 C ? A ? 35 CA 1
   ATOM 272 C A PRO A 47 ? 17.63457 -21.11098 -2.08885 0.336 8.66123 C ? A ? 35 C 1
   ATOM 273 O A PRO A 47 ? 18.10619 -20.13877 -1.51413 0.336 9.15044 O ? A ? 35 O 1
   ATOM 274 CB A PRO A 47 ? 15.50945 -21.12852 -3.45630 0.336 10.92877 C ? A ? 35 CB 1
   ATOM 275 CG A PRO A 47 ? 14.16524 -20.54428 -3.12879 0.336 7.47194 C ? A ? 35 CG 1
   ATOM 276 CD A PRO A 47 ? 14.46089 -19.69755 -1.90944 0.336 7.78908 C ? A ? 35 CD 1
   ATOM 277 N B PRO A 47 ? 15.39398 -20.60663 -1.16318 0.664 8.53097 N ? A ? 35 N 1
   ATOM 278 CA B PRO A 47 ? 16.09169 -21.52720 -2.07971 0.664 9.25426 C ? A ? 35 CA 1
   ATOM 279 C B PRO A 47 ? 17.57035 -21.19717 -2.25458 0.664 9.00363 C ? A ? 35 C 1
   ATOM 280 O B PRO A 47 ? 18.04037 -20.08941 -1.97409 0.664 10.49784 O ? A ? 35 O 1
   ATOM 281 CB B PRO A 47 ? 15.32340 -21.34951 -3.40225 0.664 10.28126 C ? A ? 35 CB 1
   ATOM 282 CG B PRO A 47 ? 14.61964 -19.98891 -3.27921 0.664 10.13104 C ? A ? 35 CG 1
   ATOM 283 CD B PRO A 47 ? 14.24776 -19.93216 -1.82632 0.664 9.53030 C ? A ? 35 CD 1
   ATOM 284 N A MET A 48 ? 18.38959 -21.97403 -2.72917 0.336 8.15399 N ? A ? 36 N 1
   ATOM 285 CA A MET A 48 ? 19.81162 -21.77399 -2.90104 0.336 7.66214 C ? A ? 36 CA 1
   ATOM 286 C A MET A 48 ? 20.03510 -21.68019 -4.38882 0.336 9.00685 C ? A ? 36 C 1
   ATOM 287 O A MET A 48 ? 19.30192 -22.28144 -5.18507 0.336 8.55779 O ? A ? 36 O 1
   ATOM 288 CB A MET A 48 ? 20.62443 -22.97613 -2.34914 0.336 14.51869 C ? A ? 36 CB 1
   ATOM 289 CG A MET A 48 ? 22.11670 -22.99201 -2.72201 0.336 12.60612 C ? A ? 36 CG 1
   ATOM 290 SD A MET A 48 ? 23.16060 -24.37422 -2.22870 0.336 16.56117 S ? A ? 36 SD 1
   ATOM 291 CE A MET A 48 ? 22.34608 -25.81521 -2.82458 0.336 4.41766 C ? A ? 36 CE 1
   ATOM 292 N B MET A 48 ? 18.31949 -22.20590 -2.72829 0.664 9.90844 N ? A ? 36 N 1
   ATOM 293 CA B MET A 48 ? 19.75646 -22.09520 -3.00782 0.664 10.44212 C ? A ? 36 CA 1
   ATOM 294 C B MET A 48 ? 19.99881 -21.70574 -4.47300 0.664 9.48688 C ? A ? 36 C 1
   ATOM 295 O B MET A 48 ? 19.29152 -22.16803 -5.37225 0.664 9.21292 O ? A ? 36 O 1
   ATOM 296 CB B MET A 48 ? 20.49648 -23.42868 -2.64997 0.664 9.06567 C ? A ? 36 CB 1
   ATOM 297 CG B MET A 48 ? 21.95005 -23.34650 -2.76089 0.664 10.10373 C ? A ? 36 CG 1
   ATOM 298 SD B MET A 48 ? 22.68198 -24.72445 -2.06518 0.664 8.76613 S ? A ? 36 SD 1
   ATOM 299 CE B MET A 48 ? 24.39141 -24.30217 -2.61769 0.664 8.36176 C ? A ? 36 CE 1
   ATOM 300 N . ILE A 49 ? 21.06972 -20.92530 -4.73622 1.000 9.31789 N ? A ? 37 N 1
   ATOM 301 CA . ILE A 49 ? 21.52115 -20.76387 -6.10491 1.000 9.51749 C ? A ? 37 CA 1
   ATOM 302 C . ILE A 49 ? 21.61859 -22.11103 -6.78723 1.000 9.46271 C ? A ? 37 C 1
   ATOM 303 O . ILE A 49 ? 22.13420 -23.09774 -6.21987 1.000 10.12425 O ? A ? 37 O 1
   ATOM 304 CB . ILE A 49 ? 22.88096 -20.03972 -6.12720 1.000 11.17284 C ? A ? 37 CB 1
   ATOM 305 CG1 . ILE A 49 ? 23.31510 -19.81324 -7.55523 1.000 12.02735 C ? A ? 37 CG1 1
   ATOM 306 CG2 . ILE A 49 ? 23.98368 -20.75403 -5.30737 1.000 12.09146 C ? A ? 37 CG2 1
   ATOM 307 CD1 . ILE A 49 ? 24.55715 -18.92024 -7.72091 1.000 14.90152 C ? A ? 37 CD1 1
   ATOM 308 N . GLY A 50 ? 21.08395 -22.18534 -8.00537 1.000 9.78413 N ? A ? 38 N 1
   ATOM 309 CA . GLY A 50 ? 21.07795 -23.37818 -8.78245 1.000 11.47712 C ? A ? 38 CA 1
   ATOM 310 C . GLY A 50 ? 19.91857 -24.30586 -8.50769 1.000 11.36896 C ? A ? 38 C 1
   ATOM 311 O . GLY A 50 ? 19.75377 -25.29753 -9.26181 1.000 12.40709 O ? A ? 38 O 1
   ATOM 312 N . ASP A 51 ? 19.12413 -24.07239 -7.46748 1.000 10.34886 N ? A ? 39 N 1
   ATOM 313 CA . ASP A 51 ? 17.97559 -24.92059 -7.24090 1.000 10.13041 C ? A ? 39 CA 1
   ATOM 314 C . ASP A 51 ? 16.96794 -24.78793 -8.37637 1.000 9.74870 C ? A ? 39 C 1
   ATOM 315 O . ASP A 51 ? 16.81914 -23.73571 -8.99428 1.000 10.21504 O ? A ? 39 O 1
   ATOM 316 CB . ASP A 51 ? 17.22569 -24.53963 -5.96652 1.000 10.94293 C ? A ? 39 CB 1
   ATOM 317 CG . ASP A 51 ? 17.86314 -25.02738 -4.69672 1.000 10.10800 C ? A ? 39 CG 1
   ATOM 318 OD1 . ASP A 51 ? 18.83205 -25.81006 -4.72811 1.000 11.48741 O ? A ? 39 OD1 1
   ATOM 319 OD2 . ASP A 51 ? 17.34498 -24.62796 -3.63657 1.000 12.48731 O ? A ? 39 OD2 1
   ATOM 320 N A LYS A 52 ? 16.30469 -25.91270 -8.66572 0.428 9.77627 N ? A ? 40 N 1
   ATOM 321 CA A LYS A 52 ? 15.05310 -25.88611 -9.41377 0.428 9.42228 C ? A ? 40 CA 1
   ATOM 322 C A LYS A 52 ? 14.01182 -25.18026 -8.57530 0.428 10.03419 C ? A ? 40 C 1
   ATOM 323 O A LYS A 52 ? 13.78278 -25.55807 -7.41765 0.428 9.00596 O ? A ? 40 O 1
   ATOM 324 CB A LYS A 52 ? 14.56517 -27.30419 -9.71921 0.428 12.61121 C ? A ? 40 CB 1
   ATOM 325 CG A LYS A 52 ? 15.04471 -27.83661 -11.04123 0.428 25.86587 C ? A ? 40 CG 1
   ATOM 326 CD A LYS A 52 ? 16.42653 -28.43675 -10.92785 0.428 36.92478 C ? A ? 40 CD 1
   ATOM 327 CE A LYS A 52 ? 17.07232 -28.72513 -12.28465 0.428 41.91822 C ? A ? 40 CE 1
   ATOM 328 NZ A LYS A 52 ? 18.47234 -29.19170 -12.13844 0.428 41.16100 N ? A ? 40 NZ 1
   ATOM 329 N B LYS A 52 ? 16.26578 -25.87250 -8.63968 0.572 9.76995 N ? A ? 40 N 1
   ATOM 330 CA B LYS A 52 ? 15.12910 -25.81970 -9.54653 0.572 10.69916 C ? A ? 40 CA 1
   ATOM 331 C B LYS A 52 ? 13.93674 -25.31149 -8.74939 0.572 11.13477 C ? A ? 40 C 1
   ATOM 332 O B LYS A 52 ? 13.53073 -25.95900 -7.78086 0.572 12.00189 O ? A ? 40 O 1
   ATOM 333 CB B LYS A 52 ? 14.88708 -27.24541 -10.02916 0.572 13.86433 C ? A ? 40 CB 1
   ATOM 334 CG B LYS A 52 ? 13.74782 -27.46176 -10.98370 0.572 14.78533 C ? A ? 40 CG 1
   ATOM 335 CD B LYS A 52 ? 13.75910 -28.88768 -11.48154 0.572 23.04915 C ? A ? 40 CD 1
   ATOM 336 CE B LYS A 52 ? 14.81899 -29.01631 -12.51460 0.572 38.07278 C ? A ? 40 CE 1
   ATOM 337 NZ B LYS A 52 ? 14.50140 -30.11753 -13.40412 0.572 47.04001 N ? A ? 40 NZ 1
   ATOM 338 N . VAL A 53 ? 13.39592 -24.14764 -9.14162 1.000 9.81189 N ? A ? 41 N 1
   ATOM 339 CA . VAL A 53 ? 12.30970 -23.46420 -8.46780 1.000 10.14949 C ? A ? 41 CA 1
   ATOM 340 C . VAL A 53 ? 11.06096 -23.57437 -9.31620 1.000 10.09657 C ? A ? 41 C 1
   ATOM 341 O . VAL A 53 ? 11.13436 -23.46950 -10.54416 1.000 11.67682 O ? A ? 41 O 1
   ATOM 342 CB . VAL A 53 ? 12.65125 -22.00887 -8.08904 1.000 11.86229 C ? A ? 41 CB 1
   ATOM 343 CG1 . VAL A 53 ? 13.80879 -21.99926 -7.13886 1.000 13.47122 C ? A ? 41 CG1 1
   ATOM 344 CG2 . VAL A 53 ? 12.97148 -21.13423 -9.24602 1.000 13.39604 C ? A ? 41 CG2 1
   ATOM 345 N . TYR A 54 ? 9.92888 -23.76572 -8.66997 1.000 9.67582 N ? A ? 42 N 1
   ATOM 346 CA . TYR A 54 ? 8.62794 -23.92496 -9.31317 1.000 9.15031 C ? A ? 42 CA 1
   ATOM 347 C . TYR A 54 ? 7.76174 -22.78560 -8.84089 1.000 8.78393 C ? A ? 42 C 1
   ATOM 348 O . TYR A 54 ? 7.55914 -22.64616 -7.62844 1.000 9.48055 O ? A ? 42 O 1
   ATOM 349 CB . TYR A 54 ? 7.98539 -25.24304 -8.86559 1.000 10.73606 C ? A ? 42 CB 1
   ATOM 350 CG . TYR A 54 ? 8.78205 -26.46199 -9.27029 1.000 19.64208 C ? A ? 42 CG 1
   ATOM 351 CD1 . TYR A 54 ? 9.96001 -26.80075 -8.60750 1.000 33.92521 C ? A ? 42 CD1 1
   ATOM 352 CD2 . TYR A 54 ? 8.37650 -27.25547 -10.33550 1.000 39.10247 C ? A ? 42 CD2 1
   ATOM 353 CE1 . TYR A 54 ? 10.70601 -27.90722 -8.99189 1.000 45.33472 C ? A ? 42 CE1 1
   ATOM 354 CE2 . TYR A 54 ? 9.11696 -28.36603 -10.72115 1.000 47.32018 C ? A ? 42 CE2 1
   ATOM 355 CZ . TYR A 54 ? 10.27699 -28.68023 -10.04615 1.000 51.68918 C ? A ? 42 CZ 1
   ATOM 356 OH . TYR A 54 ? 11.00435 -29.78243 -10.43177 1.000 58.25313 O ? A ? 42 OH 1
   ATOM 357 N . VAL A 55 ? 7.27695 -21.96995 -9.77227 1.000 8.35881 N ? A ? 43 N 1
   ATOM 358 CA . VAL A 55 ? 6.47261 -20.81482 -9.41667 1.000 8.83849 C ? A ? 43 CA 1
   ATOM 359 C . VAL A 55 ? 5.18387 -20.76991 -10.20760 1.000 9.78037 C ? A ? 43 C 1
   ATOM 360 O . VAL A 55 ? 5.10294 -21.22910 -11.35327 1.000 10.52263 O ? A ? 43 O 1
   ATOM 361 CB . VAL A 55 ? 7.22522 -19.46329 -9.55760 1.000 9.64596 C ? A ? 43 CB 1
   ATOM 362 CG1 . VAL A 55 ? 8.46261 -19.42140 -8.71377 1.000 10.39045 C ? A ? 43 CG1 1
   ATOM 363 CG2 . VAL A 55 ? 7.53031 -19.14558 -11.00077 1.000 11.20432 C ? A ? 43 CG2 1
   ATOM 364 N A HIS A 56 ? 4.17991 -20.12276 -9.62527 0.319 8.56983 N ? A ? 44 N 1
   ATOM 365 CA A HIS A 56 ? 3.01554 -19.66134 -10.37606 0.319 8.16154 C ? A ? 44 CA 1
   ATOM 366 C A HIS A 56 ? 2.92600 -18.15857 -10.26681 0.319 7.08473 C ? A ? 44 C 1
   ATOM 367 O A HIS A 56 ? 3.10496 -17.58840 -9.17028 0.319 5.20116 O ? A ? 44 O 1
   ATOM 368 CB A HIS A 56 ? 1.72383 -20.24433 -9.87090 0.319 10.31311 C ? A ? 44 CB 1
   ATOM 369 CG A HIS A 56 ? 1.23596 -21.38962 -10.68475 0.319 6.37437 C ? A ? 44 CG 1
   ATOM 370 ND1 A HIS A 56 ? 1.13785 -21.33630 -12.05850 0.319 7.49910 N ? A ? 44 ND1 1
   ATOM 371 CD2 A HIS A 56 ? 0.78889 -22.60636 -10.31086 0.319 11.38338 C ? A ? 44 CD2 1
   ATOM 372 CE1 A HIS A 56 ? 0.65254 -22.48181 -12.49535 0.319 6.30778 C ? A ? 44 CE1 1
   ATOM 373 NE2 A HIS A 56 ? 0.43056 -23.26383 -11.45608 0.319 6.45074 N ? A ? 44 NE2 1
   ATOM 374 N B HIS A 56 ? 4.16043 -20.18297 -9.60020 0.681 8.68912 N ? A ? 44 N 1
   ATOM 375 CA B HIS A 56 ? 3.02647 -19.65977 -10.36377 0.681 8.35294 C ? A ? 44 CA 1
   ATOM 376 C B HIS A 56 ? 3.17112 -18.14764 -10.37107 0.681 8.71714 C ? A ? 44 C 1
   ATOM 377 O B HIS A 56 ? 3.71496 -17.53819 -9.44117 0.681 8.94690 O ? A ? 44 O 1
   ATOM 378 CB B HIS A 56 ? 1.68639 -20.09735 -9.75544 0.681 11.21721 C ? A ? 44 CB 1
   ATOM 379 CG B HIS A 56 ? 1.11177 -21.33934 -10.36239 0.681 11.25622 C ? A ? 44 CG 1
   ATOM 380 ND1 B HIS A 56 ? 1.02499 -21.48607 -11.72201 0.681 12.07246 N ? A ? 44 ND1 1
   ATOM 381 CD2 B HIS A 56 ? 0.55036 -22.45107 -9.82384 0.681 11.82681 C ? A ? 44 CD2 1
   ATOM 382 CE1 B HIS A 56 ? 0.42946 -22.63440 -12.00399 0.681 10.26327 C ? A ? 44 CE1 1
   ATOM 383 NE2 B HIS A 56 ? 0.14317 -23.24068 -10.87052 0.681 13.04136 N ? A ? 44 NE2 1
   ATOM 384 N . TYR A 57 ? 2.67817 -17.52799 -11.42486 1.000 8.73604 N ? A ? 45 N 1
   ATOM 385 CA . TYR A 57 ? 2.76749 -16.07631 -11.49941 1.000 8.93459 C ? A ? 45 CA 1
   ATOM 386 C . TYR A 57 ? 1.73310 -15.50270 -12.43269 1.000 8.47537 C ? A ? 45 C 1
   ATOM 387 O . TYR A 57 ? 1.20805 -16.18047 -13.33169 1.000 9.50304 O ? A ? 45 O 1
   ATOM 388 CB . TYR A 57 ? 4.15087 -15.60969 -11.92310 1.000 11.21364 C ? A ? 45 CB 1
   ATOM 389 CG . TYR A 57 ? 4.44023 -15.90086 -13.37525 1.000 10.46382 C ? A ? 45 CG 1
   ATOM 390 CD1 . TYR A 57 ? 4.82082 -17.19577 -13.79088 1.000 12.92004 C ? A ? 45 CD1 1
   ATOM 391 CD2 . TYR A 57 ? 4.31634 -14.94352 -14.35358 1.000 12.33837 C ? A ? 45 CD2 1
   ATOM 392 CE1 . TYR A 57 ? 5.09654 -17.49995 -15.10805 1.000 13.62822 C ? A ? 45 CE1 1
   ATOM 393 CE2 . TYR A 57 ? 4.57742 -15.26724 -15.70139 1.000 14.25447 C ? A ? 45 CE2 1
   ATOM 394 CZ . TYR A 57 ? 4.96985 -16.56134 -16.05996 1.000 14.24889 C ? A ? 45 CZ 1
   ATOM 395 OH . TYR A 57 ? 5.28696 -16.91828 -17.37274 1.000 16.09346 O ? A ? 45 OH 1
   ATOM 396 N . LYS A 58 ? 1.51630 -14.20763 -12.25049 1.000 9.24244 N ? A ? 46 N 1
   ATOM 397 CA . LYS A 58 ? 0.83365 -13.38515 -13.24089 1.000 10.21078 C ? A ? 46 CA 1
   ATOM 398 C . LYS A 58 ? 1.58939 -12.07714 -13.35133 1.000 9.78147 C ? A ? 46 C 1
   ATOM 399 O . LYS A 58 ? 2.14294 -11.58657 -12.33928 1.000 11.24865 O ? A ? 46 O 1
   ATOM 400 CB . LYS A 58 ? -0.61317 -13.17979 -12.95345 1.000 15.62158 C ? A ? 46 CB 1
   ATOM 401 CG . LYS A 58 ? -0.91485 -12.67703 -11.66263 1.000 21.32534 C ? A ? 46 CG 1
   ATOM 402 CD . LYS A 58 ? -2.42560 -12.60255 -11.49967 1.000 41.49394 C ? A ? 46 CD 1
   ATOM 403 CE . LYS A 58 ? -2.89455 -11.15637 -11.47925 1.000 52.24249 C ? A ? 46 CE 1
   ATOM 404 NZ . LYS A 58 ? -2.15391 -10.39985 -10.42130 1.000 53.95397 N ? A ? 46 NZ 1
   ATOM 405 N . GLY A 59 ? 1.67918 -11.54077 -14.56816 1.000 10.60612 N ? A ? 47 N 1
   ATOM 406 CA . GLY A 59 ? 2.39505 -10.28853 -14.81551 1.000 11.06859 C ? A ? 47 CA 1
   ATOM 407 C . GLY A 59 ? 1.49839 -9.27179 -15.49665 1.000 11.32376 C ? A ? 47 C 1
   ATOM 408 O . GLY A 59 ? 0.69814 -9.63161 -16.38176 1.000 12.93255 O ? A ? 47 O 1
   ATOM 409 N . LYS A 60 ? 1.59683 -8.00568 -15.06735 1.000 11.08357 N ? A ? 48 N 1
   ATOM 410 CA . LYS A 60 ? 0.86973 -6.89000 -15.67487 1.000 11.39874 C ? A ? 48 CA 1
   ATOM 411 C . LYS A 60 ? 1.80833 -5.75453 -16.04840 1.000 9.53569 C ? A ? 48 C 1
   ATOM 412 O . LYS A 60 ? 2.80087 -5.48043 -15.34325 1.000 10.21985 O ? A ? 48 O 1
   ATOM 413 CB . LYS A 60 ? -0.14117 -6.27772 -14.66780 1.000 15.44518 C ? A ? 48 CB 1
   ATOM 414 CG . LYS A 60 ? -1.32137 -7.15293 -14.29865 1.000 27.04717 C ? A ? 48 CG 1
   ATOM 415 CD . LYS A 60 ? -2.19078 -6.42091 -13.26353 1.000 29.63639 C ? A ? 48 CD 1
   ATOM 416 CE . LYS A 60 ? -3.66250 -6.78663 -13.38480 1.000 44.83183 C ? A ? 48 CE 1
   ATOM 417 NZ . LYS A 60 ? -3.92132 -8.24367 -13.16774 1.000 59.12582 N ? A ? 48 NZ 1
   ATOM 418 N . LEU A 61 ? 1.47953 -5.08115 -17.14880 1.000 9.63962 N ? A ? 49 N 1
   ATOM 419 CA . LEU A 61 ? 2.16842 -3.88233 -17.54794 1.000 10.23211 C ? A ? 49 CA 1
   ATOM 420 C . LEU A 61 ? 1.60218 -2.68651 -16.79316 1.000 10.17626 C ? A ? 49 C 1
   ATOM 421 O . LEU A 61 ? 0.52617 -2.74195 -16.18904 1.000 10.84086 O ? A ? 49 O 1
   ATOM 422 CB . LEU A 61 ? 1.91318 -3.62916 -19.03189 1.000 11.84194 C ? A ? 49 CB 1
   ATOM 423 CG . LEU A 61 ? 2.41591 -4.68508 -20.03749 1.000 14.06678 C ? A ? 49 CG 1
   ATOM 424 CD1 . LEU A 61 ? 2.12094 -4.20109 -21.47269 1.000 17.23523 C ? A ? 49 CD1 1
   ATOM 425 CD2 . LEU A 61 ? 3.87507 -4.95950 -19.89062 1.000 14.09478 C ? A ? 49 CD2 1
   ATOM 426 N A SER A 62 ? 2.33979 -1.57988 -16.86127 0.566 11.85208 N ? A ? 50 N 1
   ATOM 427 CA A SER A 62 ? 1.89839 -0.36012 -16.20607 0.566 12.56546 C ? A ? 50 CA 1
   ATOM 428 C A SER A 62 ? 0.66967 0.25826 -16.86498 0.566 13.97197 C ? A ? 50 C 1
   ATOM 429 O A SER A 62 ? 0.06736 1.17140 -16.27408 0.566 15.13945 O ? A ? 50 O 1
   ATOM 430 CB A SER A 62 ? 3.04488 0.64370 -16.15749 0.566 15.03916 C ? A ? 50 CB 1
   ATOM 431 OG A SER A 62 ? 3.51983 0.88075 -17.47548 0.566 14.32856 O ? A ? 50 OG 1
   ATOM 432 N B SER A 62 ? 2.32979 -1.56889 -16.87615 0.434 11.87072 N ? A ? 50 N 1
   ATOM 433 CA B SER A 62 ? 1.89422 -0.33182 -16.23629 0.434 12.66099 C ? A ? 50 CA 1
   ATOM 434 C B SER A 62 ? 0.63164 0.23965 -16.85838 0.434 14.07204 C ? A ? 50 C 1
   ATOM 435 O B SER A 62 ? -0.00518 1.12270 -16.26080 0.434 14.77379 O ? A ? 50 O 1
   ATOM 436 CB B SER A 62 ? 2.98023 0.72843 -16.34680 0.434 15.47098 C ? A ? 50 CB 1
   ATOM 437 OG B SER A 62 ? 4.07494 0.41501 -15.51897 0.434 15.69755 O ? A ? 50 OG 1
   ATOM 438 N . ASN A 63 ? 0.25836 -0.20803 -18.03578 1.000 13.95542 N ? A ? 51 N 1
   ATOM 439 CA . ASN A 63 ? -0.99705 0.21342 -18.64763 1.000 18.02594 C ? A ? 51 CA 1
   ATOM 440 C . ASN A 63 ? -2.15994 -0.67423 -18.23284 1.000 14.95149 C ? A ? 51 C 1
   ATOM 441 O . ASN A 63 ? -3.28417 -0.51011 -18.74372 1.000 17.37492 O ? A ? 51 O 1
   ATOM 442 CB . ASN A 63 ? -0.86656 0.30503 -20.16892 1.000 17.92414 C ? A ? 51 CB 1
   ATOM 443 CG . ASN A 63 ? -0.61350 -1.02041 -20.80910 1.000 18.82894 C ? A ? 51 CG 1
   ATOM 444 OD1 . ASN A 63 ? -0.77483 -2.07580 -20.20290 1.000 17.32011 O ? A ? 51 OD1 1
   ATOM 445 ND2 . ASN A 63 ? -0.22123 -0.97915 -22.07895 1.000 26.71493 N ? A ? 51 ND2 1
   ATOM 446 N . GLY A 64 ? -1.92922 -1.59709 -17.30100 1.000 13.26152 N ? A ? 52 N 1
   ATOM 447 CA . GLY A 64 ? -2.97918 -2.42316 -16.81795 1.000 16.13512 C ? A ? 52 CA 1
   ATOM 448 C . GLY A 64 ? -3.13349 -3.73960 -17.53081 1.000 15.46995 C ? A ? 52 C 1
   ATOM 449 O . GLY A 64 ? -3.83322 -4.59951 -17.00500 1.000 19.48464 O ? A ? 52 O 1
   ATOM 450 N . LYS A 65 ? -2.51187 -3.93624 -18.68743 1.000 14.25109 N ? A ? 53 N 1
   ATOM 451 CA . LYS A 65 ? -2.73070 -5.18912 -19.41060 1.000 15.66198 C ? A ? 53 CA 1
   ATOM 452 C . LYS A 65 ? -1.98930 -6.35539 -18.76408 1.000 15.41040 C ? A ? 53 C 1
   ATOM 453 O . LYS A 65 ? -0.82241 -6.22721 -18.38283 1.000 15.05377 O ? A ? 53 O 1
   ATOM 454 CB . LYS A 65 ? -2.25709 -5.05448 -20.85222 1.000 22.54870 C ? A ? 53 CB 1
   ATOM 455 CG . LYS A 65 ? -3.25858 -4.31708 -21.75974 1.000 42.89891 C ? A ? 53 CG 1
   ATOM 456 CD . LYS A 65 ? -4.63477 -5.01056 -21.76037 1.000 55.05475 C ? A ? 53 CD 1
   ATOM 457 CE . LYS A 65 ? -5.48303 -4.66086 -23.00140 1.000 68.25016 C ? A ? 53 CE 1
   ATOM 458 NZ . LYS A 65 ? -5.96779 -3.24194 -23.05605 1.000 62.18440 N ? A ? 53 NZ 1
   ATOM 459 N . LYS A 66 ? -2.66279 -7.49749 -18.62673 1.000 16.32234 N ? A ? 54 N 1
   ATOM 460 CA . LYS A 66 ? -1.95771 -8.73336 -18.28988 1.000 15.74243 C ? A ? 54 CA 1
   ATOM 461 C . LYS A 66 ? -1.11457 -9.13677 -19.48768 1.000 16.52447 C ? A ? 54 C 1
   ATOM 462 O . LYS A 66 ? -1.56488 -9.05920 -20.63930 1.000 20.14496 O ? A ? 54 O 1
   ATOM 463 CB . LYS A 66 ? -2.96144 -9.84475 -17.97388 1.000 20.43904 C ? A ? 54 CB 1
   ATOM 464 CG . LYS A 66 ? -2.29537 -11.22676 -17.82228 1.000 28.09556 C ? A ? 54 CG 1
   ATOM 465 CD . LYS A 66 ? -3.22236 -12.28966 -17.20506 1.000 43.84452 C ? A ? 54 CD 1
   ATOM 466 CE . LYS A 66 ? -4.42357 -12.61577 -18.09263 1.000 46.43190 C ? A ? 54 CE 1
   ATOM 467 NZ . LYS A 66 ? -5.35384 -13.58940 -17.41991 1.000 43.38738 N ? A ? 54 NZ 1
   ATOM 468 N . PHE A 67 ? 0.12672 -9.49738 -19.26938 1.000 14.15473 N ? A ? 55 N 1
   ATOM 469 CA . PHE A 67 ? 0.92768 -9.98601 -20.37143 1.000 14.66797 C ? A ? 55 CA 1
   ATOM 470 C . PHE A 67 ? 1.31087 -11.44689 -20.23717 1.000 16.05588 C ? A ? 55 C 1
   ATOM 471 O . PHE A 67 ? 1.82111 -12.01051 -21.22462 1.000 17.46124 O ? A ? 55 O 1
   ATOM 472 CB . PHE A 67 ? 2.18011 -9.11319 -20.57546 1.000 15.85015 C ? A ? 55 CB 1
   ATOM 473 CG . PHE A 67 ? 3.15644 -9.14926 -19.43170 1.000 15.50672 C ? A ? 55 CG 1
   ATOM 474 CD1 . PHE A 67 ? 4.11374 -10.14834 -19.32414 1.000 15.68411 C ? A ? 55 CD1 1
   ATOM 475 CD2 . PHE A 67 ? 3.12310 -8.15761 -18.47083 1.000 14.63153 C ? A ? 55 CD2 1
   ATOM 476 CE1 . PHE A 67 ? 5.01549 -10.15048 -18.24470 1.000 17.15663 C ? A ? 55 CE1 1
   ATOM 477 CE2 . PHE A 67 ? 4.01387 -8.15599 -17.42214 1.000 15.02283 C ? A ? 55 CE2 1
   ATOM 478 CZ . PHE A 67 ? 4.95792 -9.14641 -17.31320 1.000 15.11294 C ? A ? 55 CZ 1
   ATOM 479 N . ASP A 68 ? 1.09558 -12.07534 -19.07513 1.000 13.55326 N ? A ? 56 N 1
   ATOM 480 CA . ASP A 68 ? 1.48333 -13.47044 -18.91696 1.000 14.30407 C ? A ? 56 CA 1
   ATOM 481 C . ASP A 68 ? 0.84649 -14.01060 -17.64865 1.000 12.68702 C ? A ? 56 C 1
   ATOM 482 O . ASP A 68 ? 0.58394 -13.25302 -16.70275 1.000 13.66474 O ? A ? 56 O 1
   ATOM 483 CB . ASP A 68 ? 3.02064 -13.55042 -18.85045 1.000 19.13593 C ? A ? 56 CB 1
   ATOM 484 CG . ASP A 68 ? 3.57957 -14.91647 -19.15099 1.000 15.66490 C ? A ? 56 CG 1
   ATOM 485 OD1 . ASP A 68 ? 2.82900 -15.85776 -19.48819 1.000 19.06921 O ? A ? 56 OD1 1
   ATOM 486 OD2 . ASP A 68 ? 4.82192 -15.03056 -19.02639 1.000 18.35503 O ? A ? 56 OD2 1
   ATOM 487 N . SER A 69 ? 0.59593 -15.31681 -17.63876 1.000 13.58265 N ? A ? 57 N 1
   ATOM 488 CA . SER A 69 ? 0.10018 -16.02161 -16.45497 1.000 12.59313 C ? A ? 57 CA 1
   ATOM 489 C . SER A 69 ? 0.37250 -17.50669 -16.59204 1.000 11.04782 C ? A ? 57 C 1
   ATOM 490 O . SER A 69 ? -0.07470 -18.14490 -17.57456 1.000 14.30055 O ? A ? 57 O 1
   ATOM 491 CB . SER A 69 ? -1.39949 -15.83465 -16.33201 1.000 17.42872 C ? A ? 57 CB 1
   ATOM 492 OG . SER A 69 ? -1.93217 -16.76264 -15.41325 1.000 16.00748 O ? A ? 57 OG 1
   ATOM 493 N . SER A 70 ? 1.03779 -18.10058 -15.60458 1.000 10.48056 N ? A ? 58 N 1
   ATOM 494 CA . SER A 70 ? 1.16961 -19.54840 -15.58394 1.000 10.86119 C ? A ? 58 CA 1
   ATOM 495 C . SER A 70 ? -0.12487 -20.21713 -15.18328 1.000 9.50788 C ? A ? 58 C 1
   ATOM 496 O . SER A 70 ? -0.37925 -21.36234 -15.63468 1.000 10.14034 O ? A ? 58 O 1
   ATOM 497 CB . SER A 70 ? 2.30591 -19.93740 -14.67058 1.000 11.72386 C ? A ? 58 CB 1
   ATOM 498 OG . SER A 70 ? 2.04810 -19.44595 -13.37940 1.000 10.83000 O ? A ? 58 OG 1
   ATOM 499 N . HIS A 71 ? -0.94485 -19.57640 -14.36642 1.000 11.15780 N ? A ? 59 N 1
   ATOM 500 CA . HIS A 71 ? -2.18048 -20.19517 -13.96555 1.000 11.39613 C ? A ? 59 CA 1
   ATOM 501 C . HIS A 71 ? -3.02359 -20.56018 -15.17948 1.000 11.41558 C ? A ? 59 C 1
   ATOM 502 O . HIS A 71 ? -3.67620 -21.62915 -15.22345 1.000 12.14768 O ? A ? 59 O 1
   ATOM 503 CB . HIS A 71 ? -2.94573 -19.22668 -13.09314 1.000 12.12087 C ? A ? 59 CB 1
   ATOM 504 CG . HIS A 71 ? -2.24924 -18.86331 -11.82832 1.000 15.07505 C ? A ? 59 CG 1
   ATOM 505 ND1 . HIS A 71 ? -2.26655 -19.68133 -10.72496 1.000 17.92457 N ? A ? 59 ND1 1
   ATOM 506 CD2 . HIS A 71 ? -1.49573 -17.78954 -11.49954 1.000 16.20456 C ? A ? 59 CD2 1
   ATOM 507 CE1 . HIS A 71 ? -1.60292 -19.09423 -9.73880 1.000 15.39325 C ? A ? 59 CE1 1
   ATOM 508 NE2 . HIS A 71 ? -1.10901 -17.95910 -10.19156 1.000 17.96668 N ? A ? 59 NE2 1
   ATOM 509 N A ASP A 72 ? -3.12898 -19.64953 -16.12751 0.320 11.32108 N ? A ? 60 N 1
   ATOM 510 CA A ASP A 72 ? -3.96414 -19.90534 -17.29393 0.320 12.72033 C ? A ? 60 CA 1
   ATOM 511 C A ASP A 72 ? -3.51688 -21.14711 -18.05307 0.320 9.16554 C ? A ? 60 C 1
   ATOM 512 O A ASP A 72 ? -4.30135 -21.72054 -18.82383 0.320 8.16189 O ? A ? 60 O 1
   ATOM 513 CB A ASP A 72 ? -3.91446 -18.68699 -18.22402 0.320 15.92615 C ? A ? 60 CB 1
   ATOM 514 CG A ASP A 72 ? -4.55058 -17.45229 -17.60655 0.320 18.28380 C ? A ? 60 CG 1
   ATOM 515 OD1 A ASP A 72 ? -5.38974 -17.63402 -16.70836 0.320 19.19402 O ? A ? 60 OD1 1
   ATOM 516 OD2 A ASP A 72 ? -4.21933 -16.31365 -18.01962 0.320 20.27985 O ? A ? 60 OD2 1
   ATOM 517 N B ASP A 72 ? -3.00620 -19.68239 -16.17699 0.680 11.63152 N ? A ? 60 N 1
   ATOM 518 CA B ASP A 72 ? -3.79730 -19.86458 -17.39235 0.680 12.51827 C ? A ? 60 CA 1
   ATOM 519 C B ASP A 72 ? -3.24135 -20.97049 -18.28465 0.680 10.14110 C ? A ? 60 C 1
   ATOM 520 O B ASP A 72 ? -3.95619 -21.42301 -19.20254 0.680 12.44590 O ? A ? 60 O 1
   ATOM 521 CB B ASP A 72 ? -3.92215 -18.55792 -18.18681 0.680 16.05277 C ? A ? 60 CB 1
   ATOM 522 CG B ASP A 72 ? -4.73600 -17.48319 -17.45219 0.680 15.97312 C ? A ? 60 CG 1
   ATOM 523 OD1 B ASP A 72 ? -5.47498 -17.82611 -16.50007 0.680 19.25097 O ? A ? 60 OD1 1
   ATOM 524 OD2 B ASP A 72 ? -4.59865 -16.30933 -17.86956 0.680 21.62071 O ? A ? 60 OD2 1
   ATOM 525 N A ARG A 73 ? -2.26250 -21.55026 -17.89342 0.320 8.69022 N ? A ? 61 N 1
   ATOM 526 CA A ARG A 73 ? -1.69249 -22.68294 -18.61682 0.320 10.47297 C ? A ? 61 CA 1
   ATOM 527 C A ARG A 73 ? -1.79408 -23.97994 -17.83269 0.320 8.86468 C ? A ? 61 C 1
   ATOM 528 O A ARG A 73 ? -1.44894 -25.03772 -18.36468 0.320 8.96176 O ? A ? 61 O 1
   ATOM 529 CB A ARG A 73 ? -0.21711 -22.39898 -18.98281 0.320 11.72032 C ? A ? 61 CB 1
   ATOM 530 CG A ARG A 73 ? 0.01907 -21.31323 -20.05652 0.320 16.97191 C ? A ? 61 CG 1
   ATOM 531 CD A ARG A 73 ? 1.50241 -21.00346 -20.25367 0.320 17.07965 C ? A ? 61 CD 1
   ATOM 532 NE A ARG A 73 ? 1.98844 -20.23093 -19.12266 0.320 20.65371 N ? A ? 61 NE 1
   ATOM 533 CZ A ARG A 73 ? 3.23479 -19.81003 -18.96389 0.320 20.35141 C ? A ? 61 CZ 1
   ATOM 534 NH1 A ARG A 73 ? 4.17066 -20.06131 -19.86227 0.320 30.33058 N ? A ? 61 NH1 1
   ATOM 535 NH2 A ARG A 73 ? 3.55083 -19.13100 -17.86754 0.320 19.51469 N ? A ? 61 NH2 1
   ATOM 536 N B ARG A 73 ? -2.01076 -21.41015 -18.05088 0.680 10.61803 N ? A ? 61 N 1
   ATOM 537 CA B ARG A 73 ? -1.43369 -22.57347 -18.73729 0.680 10.89063 C ? A ? 61 CA 1
   ATOM 538 C B ARG A 73 ? -1.61502 -23.87651 -17.98412 0.680 9.06317 C ? A ? 61 C 1
   ATOM 539 O B ARG A 73 ? -1.24587 -24.93073 -18.52085 0.680 9.94158 O ? A ? 61 O 1
   ATOM 540 CB B ARG A 73 ? 0.06655 -22.37370 -18.98206 0.680 11.94724 C ? A ? 61 CB 1
   ATOM 541 CG B ARG A 73 ? 0.37478 -21.29304 -19.97662 0.680 12.34672 C ? A ? 61 CG 1
   ATOM 542 CD B ARG A 73 ? 1.81040 -21.34262 -20.38920 0.680 14.49553 C ? A ? 61 CD 1
   ATOM 543 NE B ARG A 73 ? 2.65080 -20.82734 -19.32463 0.680 12.25919 N ? A ? 61 NE 1
   ATOM 544 CZ B ARG A 73 ? 2.94749 -19.54654 -19.14338 0.680 13.72341 C ? A ? 61 CZ 1
   ATOM 545 NH1 B ARG A 73 ? 2.47518 -18.61252 -19.94648 0.680 15.69523 N ? A ? 61 NH1 1
   ATOM 546 NH2 B ARG A 73 ? 3.77134 -19.21548 -18.15318 0.680 16.74056 N ? A ? 61 NH2 1
   ATOM 547 N A ASN A 74 ? -2.25149 -23.94174 -16.58298 0.320 9.12863 N ? A ? 62 N 1
   ATOM 548 CA A ASN A 74 ? -2.34132 -25.15275 -15.77617 0.320 9.44739 C ? A ? 62 CA 1
   ATOM 549 C A ASN A 74 ? -0.97285 -25.83478 -15.67745 0.320 9.81262 C ? A ? 62 C 1
   ATOM 550 O A ASN A 74 ? -0.84855 -27.05488 -15.67769 0.320 8.12301 O ? A ? 62 O 1
   ATOM 551 CB A ASN A 74 ? -3.47420 -26.08000 -16.25655 0.320 7.77586 C ? A ? 62 CB 1
   ATOM 552 CG A ASN A 74 ? -4.80178 -25.34144 -16.41563 0.320 8.18630 C ? A ? 62 CG 1
   ATOM 553 OD1 A ASN A 74 ? -5.25876 -24.61827 -15.52496 0.320 6.85960 O ? A ? 62 OD1 1
   ATOM 554 ND2 A ASN A 74 ? -5.41762 -25.49900 -17.59054 0.320 10.55418 N ? A ? 62 ND2 1
   ATOM 555 N B ASN A 74 ? -2.09503 -23.84586 -16.73697 0.680 9.77336 N ? A ? 62 N 1
   ATOM 556 CA B ASN A 74 ? -2.30814 -25.06997 -15.94671 0.680 9.35968 C ? A ? 62 CA 1
   ATOM 557 C B ASN A 74 ? -1.03872 -25.83024 -15.62852 0.680 9.76646 C ? A ? 62 C 1
   ATOM 558 O B ASN A 74 ? -1.07120 -27.03829 -15.38378 0.680 10.50153 O ? A ? 62 O 1
   ATOM 559 CB B ASN A 74 ? -3.33676 -25.99447 -16.55626 0.680 9.31321 C ? A ? 62 CB 1
   ATOM 560 CG B ASN A 74 ? -4.68264 -25.38498 -16.53965 0.680 9.63021 C ? A ? 62 CG 1
   ATOM 561 OD1 B ASN A 74 ? -5.31546 -25.17135 -17.62831 0.680 9.22616 O ? A ? 62 OD1 1
   ATOM 562 ND2 B ASN A 74 ? -5.16526 -25.05707 -15.35284 0.680 9.29556 N ? A ? 62 ND2 1
   ATOM 563 N A GLU A 75 ? 0.09001 -25.01888 -15.58345 0.320 9.85889 N ? A ? 63 N 1
   ATOM 564 CA A GLU A 75 ? 1.40776 -25.60618 -15.32474 0.320 8.44907 C ? A ? 63 CA 1
   ATOM 565 C A GLU A 75 ? 2.32523 -24.56465 -14.71935 0.320 9.38153 C ? A ? 63 C 1
   ATOM 566 O A GLU A 75 ? 2.29444 -23.40563 -15.16060 0.320 10.30633 O ? A ? 63 O 1
   ATOM 567 CB A GLU A 75 ? 2.05249 -26.22236 -16.56749 0.320 13.08147 C ? A ? 63 CB 1
   ATOM 568 CG A GLU A 75 ? 2.41915 -25.26984 -17.65819 0.320 12.72560 C ? A ? 63 CG 1
   ATOM 569 CD A GLU A 75 ? 3.05200 -26.02511 -18.78854 0.320 8.25742 C ? A ? 63 CD 1
   ATOM 570 OE1 A GLU A 75 ? 2.62648 -27.19325 -19.05292 0.320 11.59558 O ? A ? 63 OE1 1
   ATOM 571 OE2 A GLU A 75 ? 3.99827 -25.48403 -19.36831 0.320 10.92005 O ? A ? 63 OE2 1
   ATOM 572 N B GLU A 75 ? 0.09297 -25.12358 -15.57799 0.680 10.04122 N ? A ? 63 N 1
   ATOM 573 CA B GLU A 75 ? 1.35615 -25.71879 -15.15534 0.680 10.48113 C ? A ? 63 CA 1
   ATOM 574 C B GLU A 75 ? 2.25523 -24.60804 -14.64584 0.680 9.74135 C ? A ? 63 C 1
   ATOM 575 O B GLU A 75 ? 2.14914 -23.46122 -15.08385 0.680 10.37183 O ? A ? 63 O 1
   ATOM 576 CB B GLU A 75 ? 2.05004 -26.50878 -16.27507 0.680 10.70753 C ? A ? 63 CB 1
   ATOM 577 CG B GLU A 75 ? 2.34507 -25.68119 -17.50729 0.680 14.35173 C ? A ? 63 CG 1
   ATOM 578 CD B GLU A 75 ? 3.17934 -26.42020 -18.52221 0.680 13.61484 C ? A ? 63 CD 1
   ATOM 579 OE1 B GLU A 75 ? 2.62186 -27.03080 -19.44204 0.680 13.31983 O ? A ? 63 OE1 1
   ATOM 580 OE2 B GLU A 75 ? 4.42589 -26.38839 -18.41092 0.680 35.37836 O ? A ? 63 OE2 1
   ATOM 581 N . PRO A 76 ? 3.12921 -24.91654 -13.71224 1.000 10.19826 N ? A ? 64 N 1
   ATOM 582 CA . PRO A 76 ? 4.02492 -23.91744 -13.13597 1.000 10.74323 C ? A ? 64 CA 1
   ATOM 583 C . PRO A 76 ? 5.14075 -23.59638 -14.11393 1.000 9.92514 C ? A ? 64 C 1
   ATOM 584 O . PRO A 76 ? 5.42151 -24.32377 -15.07978 1.000 11.17024 O ? A ? 64 O 1
   ATOM 585 CB . PRO A 76 ? 4.56582 -24.64354 -11.90623 1.000 12.54069 C ? A ? 64 CB 1
   ATOM 586 CG . PRO A 76 ? 4.66345 -26.06358 -12.34540 1.000 13.62909 C ? A ? 64 CG 1
   ATOM 587 CD . PRO A 76 ? 3.34348 -26.24797 -13.11350 1.000 12.08372 C ? A ? 64 CD 1
   ATOM 588 N . PHE A 77 ? 5.80639 -22.48008 -13.83882 1.000 10.57145 N ? A ? 65 N 1
   ATOM 589 CA . PHE A 77 ? 7.00307 -22.11484 -14.55418 1.000 10.40062 C ? A ? 65 CA 1
   ATOM 590 C . PHE A 77 ? 8.20396 -22.56385 -13.72383 1.000 9.93699 C ? A ? 65 C 1
   ATOM 591 O . PHE A 77 ? 8.24263 -22.32920 -12.50166 1.000 10.54072 O ? A ? 65 O 1
   ATOM 592 CB . PHE A 77 ? 7.01509 -20.60316 -14.77113 1.000 12.54332 C ? A ? 65 CB 1
   ATOM 593 CG . PHE A 77 ? 8.19706 -20.15742 -15.55055 1.000 12.32397 C ? A ? 65 CG 1
   ATOM 594 CD1 . PHE A 77 ? 8.22324 -20.28109 -16.93458 1.000 20.93078 C ? A ? 65 CD1 1
   ATOM 595 CD2 . PHE A 77 ? 9.31721 -19.64343 -14.91179 1.000 14.37449 C ? A ? 65 CD2 1
   ATOM 596 CE1 . PHE A 77 ? 9.35489 -19.87967 -17.64317 1.000 28.95062 C ? A ? 65 CE1 1
   ATOM 597 CE2 . PHE A 77 ? 10.43163 -19.25043 -15.61104 1.000 19.15734 C ? A ? 65 CE2 1
   ATOM 598 CZ . PHE A 77 ? 10.45802 -19.36010 -16.96137 1.000 22.31998 C ? A ? 65 CZ 1
   ATOM 599 N . VAL A 78 ? 9.15609 -23.21640 -14.36265 1.000 9.86147 N ? A ? 66 N 1
   ATOM 600 CA . VAL A 78 ? 10.26019 -23.85783 -13.67661 1.000 11.08636 C ? A ? 66 CA 1
   ATOM 601 C . VAL A 78 ? 11.56330 -23.29429 -14.20698 1.000 11.70014 C ? A ? 66 C 1
   ATOM 602 O . VAL A 78 ? 11.74620 -23.16761 -15.42903 1.000 13.78616 O ? A ? 66 O 1
   ATOM 603 CB . VAL A 78 ? 10.19068 -25.37509 -13.87823 1.000 14.33094 C ? A ? 66 CB 1
   ATOM 604 CG1 . VAL A 78 ? 11.31208 -26.04974 -13.11192 1.000 16.71318 C ? A ? 66 CG1 1
   ATOM 605 CG2 . VAL A 78 ? 8.81158 -25.90516 -13.46682 1.000 15.81248 C ? A ? 66 CG2 1
   ATOM 606 N . PHE A 79 ? 12.46951 -22.92348 -13.31143 1.000 11.03348 N ? A ? 67 N 1
   ATOM 607 CA . PHE A 79 ? 13.75640 -22.41560 -13.76053 1.000 10.65542 C ? A ? 67 CA 1
   ATOM 608 C . PHE A 79 ? 14.80223 -22.70141 -12.68708 1.000 9.89792 C ? A ? 67 C 1
   ATOM 609 O . PHE A 79 ? 14.46940 -23.06922 -11.56924 1.000 11.04127 O ? A ? 67 O 1
   ATOM 610 CB . PHE A 79 ? 13.73119 -20.92788 -14.13702 1.000 11.61406 C ? A ? 67 CB 1
   ATOM 611 CG . PHE A 79 ? 13.47659 -19.98215 -12.97732 1.000 11.07060 C ? A ? 67 CG 1
   ATOM 612 CD1 . PHE A 79 ? 12.18728 -19.74841 -12.52919 1.000 11.90956 C ? A ? 67 CD1 1
   ATOM 613 CD2 . PHE A 79 ? 14.52757 -19.27798 -12.39938 1.000 10.91138 C ? A ? 67 CD2 1
   ATOM 614 CE1 . PHE A 79 ? 11.93804 -18.84968 -11.51655 1.000 13.60358 C ? A ? 67 CE1 1
   ATOM 615 CE2 . PHE A 79 ? 14.32299 -18.38347 -11.41629 1.000 11.93118 C ? A ? 67 CE2 1
   ATOM 616 CZ . PHE A 79 ? 13.00906 -18.15135 -10.96515 1.000 13.19491 C ? A ? 67 CZ 1
   ATOM 617 N A SER A 80 ? 16.08230 -22.56745 -13.04117 0.642 10.32169 N ? A ? 68 N 1
   ATOM 618 CA A SER A 80 ? 17.14529 -22.73717 -12.05183 0.642 10.07405 C ? A ? 68 CA 1
   ATOM 619 C A SER A 80 ? 17.52802 -21.36009 -11.52315 0.642 10.00649 C ? A ? 68 C 1
   ATOM 620 O A SER A 80 ? 17.84458 -20.46254 -12.30295 0.642 11.28964 O ? A ? 68 O 1
   ATOM 621 CB A SER A 80 ? 18.38222 -23.39840 -12.65839 0.642 10.08890 C ? A ? 68 CB 1
   ATOM 622 OG A SER A 80 ? 18.04762 -24.62797 -13.24262 0.642 13.36020 O ? A ? 68 OG 1
   ATOM 623 N B SER A 80 ? 16.07655 -22.47880 -13.05790 0.358 10.44996 N ? A ? 68 N 1
   ATOM 624 CA B SER A 80 ? 17.21864 -22.63858 -12.15794 0.358 10.51551 C ? A ? 68 CA 1
   ATOM 625 C B SER A 80 ? 17.56105 -21.28950 -11.53798 0.358 10.21228 C ? A ? 68 C 1
   ATOM 626 O B SER A 80 ? 17.91426 -20.34836 -12.25750 0.358 11.10414 O ? A ? 68 O 1
   ATOM 627 CB B SER A 80 ? 18.44504 -23.15620 -12.91069 0.358 10.51248 C ? A ? 68 CB 1
   ATOM 628 OG B SER A 80 ? 19.42171 -23.56753 -11.97375 0.358 12.74585 O ? A ? 68 OG 1
   ATOM 629 N . LEU A 81 ? 17.47778 -21.19722 -10.21376 1.000 9.55304 N ? A ? 69 N 1
   ATOM 630 CA . LEU A 81 ? 17.62326 -19.90168 -9.56554 1.000 9.32683 C ? A ? 69 CA 1
   ATOM 631 C . LEU A 81 ? 19.03859 -19.35159 -9.69347 1.000 9.64376 C ? A ? 69 C 1
   ATOM 632 O . LEU A 81 ? 20.04095 -20.05746 -9.50129 1.000 9.95298 O ? A ? 69 O 1
   ATOM 633 CB . LEU A 81 ? 17.27905 -20.04076 -8.09180 1.000 10.55310 C ? A ? 69 CB 1
   ATOM 634 CG . LEU A 81 ? 17.28179 -18.73785 -7.30362 1.000 9.88361 C ? A ? 69 CG 1
   ATOM 635 CD1 . LEU A 81 ? 16.16974 -17.79063 -7.77122 1.000 11.35484 C ? A ? 69 CD1 1
   ATOM 636 CD2 . LEU A 81 ? 17.12689 -19.04361 -5.85492 1.000 12.58917 C ? A ? 69 CD2 1
   ATOM 637 N . GLY A 82 ? 19.12700 -18.06445 -9.99091 1.000 9.60466 N ? A ? 70 N 1
   ATOM 638 CA . GLY A 82 ? 20.39141 -17.36813 -9.90992 1.000 10.63205 C ? A ? 70 CA 1
   ATOM 639 C . GLY A 82 ? 21.28572 -17.55547 -11.10072 1.000 11.20996 C ? A ? 70 C 1
   ATOM 640 O . GLY A 82 ? 22.51851 -17.31562 -11.00156 1.000 14.63387 O ? A ? 70 O 1
   ATOM 641 N . LYS A 83 ? 20.73970 -17.99103 -12.22915 1.000 11.47105 N ? A ? 71 N 1
   ATOM 642 CA . LYS A 83 ? 21.48362 -18.32709 -13.43970 1.000 12.12188 C ? A ? 71 CA 1
   ATOM 643 C . LYS A 83 ? 21.15851 -17.40603 -14.59302 1.000 12.47211 C ? A ? 71 C 1
   ATOM 644 O . LYS A 83 ? 21.65751 -17.64215 -15.72009 1.000 15.34808 O ? A ? 71 O 1
   ATOM 645 CB . LYS A 83 ? 21.21589 -19.78475 -13.83406 1.000 15.74525 C ? A ? 71 CB 1
   ATOM 646 CG . LYS A 83 ? 21.62294 -20.70858 -12.72242 1.000 15.71539 C ? A ? 71 CG 1
   ATOM 647 CD . LYS A 83 ? 23.09549 -20.54125 -12.48095 1.000 21.51062 C ? A ? 71 CD 1
   ATOM 648 CE . LYS A 83 ? 23.56680 -21.54635 -11.49984 1.000 38.87613 C ? A ? 71 CE 1
   ATOM 649 NZ . LYS A 83 ? 24.98272 -21.31027 -11.11220 1.000 30.76922 N ? A ? 71 NZ 1
   ATOM 650 N . GLY A 84 ? 20.36821 -16.35763 -14.39399 1.000 12.44597 N ? A ? 72 N 1
   ATOM 651 CA . GLY A 84 ? 19.99456 -15.51155 -15.51539 1.000 13.21683 C ? A ? 72 CA 1
   ATOM 652 C . GLY A 84 ? 19.07498 -16.16004 -16.51702 1.000 12.27298 C ? A ? 72 C 1
   ATOM 653 O . GLY A 84 ? 19.04875 -15.73124 -17.68617 1.000 15.23529 O ? A ? 72 O 1
   ATOM 654 N . GLN A 85 ? 18.29515 -17.15657 -16.10674 1.000 11.97638 N ? A ? 73 N 1
   ATOM 655 CA . GLN A 85 ? 17.31492 -17.77672 -16.98771 1.000 12.46926 C ? A ? 73 CA 1
   ATOM 656 C . GLN A 85 ? 16.02160 -16.99858 -17.03416 1.000 12.20529 C ? A ? 73 C 1
   ATOM 657 O . GLN A 85 ? 15.12128 -17.32188 -17.82366 1.000 15.73529 O ? A ? 73 O 1
   ATOM 658 CB . GLN A 85 ? 17.02937 -19.18918 -16.52462 1.000 12.62415 C ? A ? 73 CB 1
   ATOM 659 CG . GLN A 85 ? 18.24804 -20.09886 -16.66360 1.000 14.47893 C ? A ? 73 CG 1
   ATOM 660 CD . GLN A 85 ? 17.98980 -21.52031 -16.20092 1.000 12.37160 C ? A ? 73 CD 1
   ATOM 661 OE1 . GLN A 85 ? 16.88864 -21.89242 -15.76438 1.000 13.64841 O ? A ? 73 OE1 1
   ATOM 662 NE2 . GLN A 85 ? 19.02948 -22.35959 -16.34378 1.000 15.68659 N ? A ? 73 NE2 1
   ATOM 663 N . VAL A 86 ? 15.88299 -16.01292 -16.14756 1.000 11.08691 N ? A ? 74 N 1
   ATOM 664 CA . VAL A 86 ? 14.73156 -15.12826 -15.99913 1.000 11.24717 C ? A ? 74 CA 1
   ATOM 665 C . VAL A 86 ? 15.28796 -13.71496 -15.80618 1.000 9.68519 C ? A ? 74 C 1
   ATOM 666 O . VAL A 86 ? 16.49348 -13.52524 -15.64416 1.000 10.99267 O ? A ? 74 O 1
   ATOM 667 CB . VAL A 86 ? 13.87683 -15.53548 -14.76594 1.000 10.56827 C ? A ? 74 CB 1
   ATOM 668 CG1 . VAL A 86 ? 13.19338 -16.88921 -14.95626 1.000 11.69364 C ? A ? 74 CG1 1
   ATOM 669 CG2 . VAL A 86 ? 14.76024 -15.55685 -13.51175 1.000 11.42297 C ? A ? 74 CG2 1
   ATOM 670 N . ILE A 87 ? 14.38529 -12.72696 -15.82752 1.000 10.29371 N ? A ? 75 N 1
   ATOM 671 CA . ILE A 87 ? 14.81327 -11.36633 -15.60168 1.000 9.60704 C ? A ? 75 CA 1
   ATOM 672 C . ILE A 87 ? 15.46126 -11.23255 -14.22425 1.000 9.03173 C ? A ? 75 C 1
   ATOM 673 O . ILE A 87 ? 15.18273 -11.98039 -13.27846 1.000 9.67173 O ? A ? 75 O 1
   ATOM 674 CB . ILE A 87 ? 13.65497 -10.36099 -15.77200 1.000 10.01594 C ? A ? 75 CB 1
   ATOM 675 CG1 . ILE A 87 ? 12.50584 -10.66574 -14.79665 1.000 11.22214 C ? A ? 75 CG1 1
   ATOM 676 CG2 . ILE A 87 ? 13.22246 -10.30874 -17.23249 1.000 11.35032 C ? A ? 75 CG2 1
   ATOM 677 CD1 . ILE A 87 ? 11.42252 -9.57186 -14.78808 1.000 12.03719 C ? A ? 75 CD1 1
   ATOM 678 N A LYS A 88 ? 16.30430 -10.21322 -14.11447 0.224 9.30374 N ? A ? 76 N 1
   ATOM 679 CA A LYS A 88 ? 17.06271 -9.97513 -12.89413 0.224 10.23147 C ? A ? 76 CA 1
   ATOM 680 C A LYS A 88 ? 16.15514 -9.88658 -11.68112 0.224 8.93132 C ? A ? 76 C 1
   ATOM 681 O A LYS A 88 ? 16.47530 -10.42678 -10.60747 0.224 9.35400 O ? A ? 76 O 1
   ATOM 682 CB A LYS A 88 ? 17.79814 -8.65145 -13.03783 0.224 11.31083 C ? A ? 76 CB 1
   ATOM 683 CG A LYS A 88 ? 19.00929 -8.56381 -12.19269 0.224 12.83558 C ? A ? 76 CG 1
   ATOM 684 CD A LYS A 88 ? 20.19354 -8.33011 -13.10098 0.224 21.45616 C ? A ? 76 CD 1
   ATOM 685 CE A LYS A 88 ? 20.11718 -6.95888 -13.72843 0.224 22.43121 C ? A ? 76 CE 1
   ATOM 686 NZ A LYS A 88 ? 21.48304 -6.52018 -14.13148 0.224 28.30632 N ? A ? 76 NZ 1
   ATOM 687 N B LYS A 88 ? 16.30427 -10.21515 -14.09700 0.268 9.29970 N ? A ? 76 N 1
   ATOM 688 CA B LYS A 88 ? 17.07572 -10.06365 -12.86548 0.268 10.17327 C ? A ? 76 CA 1
   ATOM 689 C B LYS A 88 ? 16.18387 -9.83995 -11.64764 0.268 8.80907 C ? A ? 76 C 1
   ATOM 690 O B LYS A 88 ? 16.53522 -10.27970 -10.53580 0.268 9.47395 O ? A ? 76 O 1
   ATOM 691 CB B LYS A 88 ? 18.07515 -8.91881 -13.00117 0.268 9.39830 C ? A ? 76 CB 1
   ATOM 692 CG B LYS A 88 ? 19.22462 -9.17464 -13.94021 0.268 14.98750 C ? A ? 76 CG 1
   ATOM 693 CD B LYS A 88 ? 19.97629 -7.88126 -14.18611 0.268 20.00914 C ? A ? 76 CD 1
   ATOM 694 CE B LYS A 88 ? 19.26225 -7.01823 -15.21637 0.268 19.24446 C ? A ? 76 CE 1
   ATOM 695 NZ B LYS A 88 ? 19.51398 -7.52787 -16.58662 0.268 21.32147 N ? A ? 76 NZ 1
   ATOM 696 N C LYS A 88 ? 16.31663 -10.22822 -14.10782 0.508 9.33330 N ? A ? 76 N 1
   ATOM 697 CA C LYS A 88 ? 17.06114 -10.05626 -12.86181 0.508 10.19418 C ? A ? 76 CA 1
   ATOM 698 C C LYS A 88 ? 16.11513 -9.93549 -11.67264 0.508 9.15632 C ? A ? 76 C 1
   ATOM 699 O C LYS A 88 ? 16.35999 -10.52751 -10.59970 0.508 8.84815 O ? A ? 76 O 1
   ATOM 700 CB C LYS A 88 ? 17.94607 -8.80729 -12.92959 0.508 10.25973 C ? A ? 76 CB 1
   ATOM 701 CG C LYS A 88 ? 19.09601 -8.84814 -13.89153 0.508 11.56939 C ? A ? 76 CG 1
   ATOM 702 CD C LYS A 88 ? 19.82202 -7.51456 -13.90585 0.508 15.82082 C ? A ? 76 CD 1
   ATOM 703 CE C LYS A 88 ? 21.16974 -7.62162 -14.61827 0.508 21.23331 C ? A ? 76 CE 1
   ATOM 704 NZ C LYS A 88 ? 21.03401 -7.88904 -16.06688 0.508 27.15098 N ? A ? 76 NZ 1
   ATOM 705 N . ALA A 89 ? 15.03006 -9.18867 -11.82732 1.000 8.91692 N ? A ? 77 N 1
   ATOM 706 CA . ALA A 89 ? 14.10873 -9.01687 -10.70833 1.000 9.05169 C ? A ? 77 CA 1
   ATOM 707 C . ALA A 89 ? 13.60921 -10.34482 -10.16919 1.000 9.10458 C ? A ? 77 C 1
   ATOM 708 O . ALA A 89 ? 13.31035 -10.44139 -8.97100 1.000 9.57246 O ? A ? 77 O 1
   ATOM 709 CB . ALA A 89 ? 12.91406 -8.16154 -11.11169 1.000 10.38056 C ? A ? 77 CB 1
   ATOM 710 N . TRP A 90 ? 13.41380 -11.33686 -11.03906 1.000 9.01369 N ? A ? 78 N 1
   ATOM 711 CA . TRP A 90 ? 12.98130 -12.65193 -10.57175 1.000 9.40546 C ? A ? 78 CA 1
   ATOM 712 C . TRP A 90 ? 14.08866 -13.42283 -9.87781 1.000 8.65319 C ? A ? 78 C 1
   ATOM 713 O . TRP A 90 ? 13.84969 -14.09133 -8.85075 1.000 9.53978 O ? A ? 78 O 1
   ATOM 714 CB . TRP A 90 ? 12.45035 -13.46607 -11.73418 1.000 10.24239 C ? A ? 78 CB 1
   ATOM 715 CG . TRP A 90 ? 11.02920 -13.21704 -12.05589 1.000 9.01919 C ? A ? 78 CG 1
   ATOM 716 CD1 . TRP A 90 ? 10.32570 -12.03743 -12.04833 1.000 9.52589 C ? A ? 78 CD1 1
   ATOM 717 CD2 . TRP A 90 ? 10.12479 -14.22114 -12.39579 1.000 11.54004 C ? A ? 78 CD2 1
   ATOM 718 NE1 . TRP A 90 ? 9.02386 -12.25810 -12.41796 1.000 10.31035 N ? A ? 78 NE1 1
   ATOM 719 CE2 . TRP A 90 ? 8.86189 -13.60731 -12.62653 1.000 12.16124 C ? A ? 78 CE2 1
   ATOM 720 CE3 . TRP A 90 ? 10.25499 -15.61421 -12.49557 1.000 13.10997 C ? A ? 78 CE3 1
   ATOM 721 CZ2 . TRP A 90 ? 7.73105 -14.35641 -12.95555 1.000 15.22960 C ? A ? 78 CZ2 1
   ATOM 722 CZ3 . TRP A 90 ? 9.15440 -16.35493 -12.85175 1.000 16.81607 C ? A ? 78 CZ3 1
   ATOM 723 CH2 . TRP A 90 ? 7.89653 -15.73237 -13.06760 1.000 18.96345 C ? A ? 78 CH2 1
   ATOM 724 N A ASP A 91 ? 15.32900 -13.34054 -10.37279 0.176 9.48781 N ? A ? 79 N 1
   ATOM 725 CA A ASP A 91 ? 16.42548 -14.02567 -9.68334 0.176 9.51423 C ? A ? 79 CA 1
   ATOM 726 C A ASP A 91 ? 16.68899 -13.40500 -8.30980 0.176 9.25191 C ? A ? 79 C 1
   ATOM 727 O A ASP A 91 ? 17.05685 -14.10105 -7.35654 0.176 9.16440 O ? A ? 79 O 1
   ATOM 728 CB A ASP A 91 ? 17.69460 -14.02053 -10.54173 0.176 10.45521 C ? A ? 79 CB 1
   ATOM 729 CG A ASP A 91 ? 17.78376 -15.21989 -11.50547 0.176 9.62481 C ? A ? 79 CG 1
   ATOM 730 OD1 A ASP A 91 ? 17.21797 -16.29640 -11.20651 0.176 10.25288 O ? A ? 79 OD1 1
   ATOM 731 OD2 A ASP A 91 ? 18.46481 -15.07623 -12.55762 0.176 10.85210 O ? A ? 79 OD2 1
   ATOM 732 N B ASP A 91 ? 15.29814 -13.40379 -10.41229 0.824 9.54016 N ? A ? 79 N 1
   ATOM 733 CA B ASP A 91 ? 16.37964 -14.04462 -9.67386 0.824 9.45872 C ? A ? 79 CA 1
   ATOM 734 C B ASP A 91 ? 16.49517 -13.43520 -8.28040 0.824 8.86364 C ? A ? 79 C 1
   ATOM 735 O B ASP A 91 ? 16.56253 -14.17085 -7.27311 0.824 9.25580 O ? A ? 79 O 1
   ATOM 736 CB B ASP A 91 ? 17.70857 -13.95896 -10.43133 0.824 10.54857 C ? A ? 79 CB 1
   ATOM 737 CG B ASP A 91 ? 17.95646 -15.15088 -11.39436 0.824 10.64671 C ? A ? 79 CG 1
   ATOM 738 OD1 B ASP A 91 ? 17.33369 -16.20529 -11.26407 0.824 10.30895 O ? A ? 79 OD1 1
   ATOM 739 OD2 B ASP A 91 ? 18.86242 -15.00281 -12.27456 0.824 11.27271 O ? A ? 79 OD2 1
   ATOM 740 N . ILE A 92 ? 16.48090 -12.10258 -8.17672 1.000 9.10717 N ? A ? 80 N 1
   ATOM 741 CA . ILE A 92 ? 16.60665 -11.45154 -6.87320 1.000 9.60019 C ? A ? 80 CA 1
   ATOM 742 C . ILE A 92 ? 15.39153 -11.72634 -6.00612 1.000 8.21220 C ? A ? 80 C 1
   ATOM 743 O . ILE A 92 ? 15.51533 -12.02799 -4.81341 1.000 9.27036 O ? A ? 80 O 1
   ATOM 744 CB . ILE A 92 ? 16.76722 -9.93200 -7.10941 1.000 12.63191 C ? A ? 80 CB 1
   ATOM 745 CG1 . ILE A 92 ? 18.06800 -9.57658 -7.84896 1.000 12.23611 C ? A ? 80 CG1 1
   ATOM 746 CG2 . ILE A 92 ? 16.58903 -9.16259 -5.79062 1.000 13.99580 C ? A ? 80 CG2 1
   ATOM 747 CD1 . ILE A 92 ? 18.11060 -8.16796 -8.43639 1.000 14.65373 C ? A ? 80 CD1 1
   ATOM 748 N . GLY A 93 ? 14.19548 -11.57447 -6.58237 1.000 8.72067 N ? A ? 81 N 1
   ATOM 749 CA . GLY A 93 ? 12.97202 -11.68222 -5.80559 1.000 8.89052 C ? A ? 81 CA 1
   ATOM 750 C . GLY A 93 ? 12.67032 -13.08801 -5.33715 1.000 8.24428 C ? A ? 81 C 1
   ATOM 751 O . GLY A 93 ? 12.31533 -13.29955 -4.17329 1.000 7.90564 O ? A ? 81 O 1
   ATOM 752 N . VAL A 94 ? 12.76603 -14.06050 -6.23103 1.000 7.63819 N ? A ? 82 N 1
   ATOM 753 CA . VAL A 94 ? 12.46470 -15.43106 -5.82176 1.000 8.50606 C ? A ? 82 CA 1
   ATOM 754 C . VAL A 94 ? 13.46090 -15.89750 -4.77232 1.000 7.77683 C ? A ? 82 C 1
   ATOM 755 O . VAL A 94 ? 13.11617 -16.68424 -3.87307 1.000 8.38981 O ? A ? 82 O 1
   ATOM 756 CB . VAL A 94 ? 12.35636 -16.35956 -7.04081 1.000 8.93191 C ? A ? 82 CB 1
   ATOM 757 CG1 . VAL A 94 ? 12.17931 -17.82512 -6.61859 1.000 10.83463 C ? A ? 82 CG1 1
   ATOM 758 CG2 . VAL A 94 ? 11.19449 -15.92733 -7.92021 1.000 9.97687 C ? A ? 82 CG2 1
   ATOM 759 N . ALA A 95 ? 14.70149 -15.42816 -4.83623 1.000 7.77380 N ? A ? 83 N 1
   ATOM 760 CA . ALA A 95 ? 15.68468 -15.81274 -3.83982 1.000 8.45672 C ? A ? 83 CA 1
   ATOM 761 C . ALA A 95 ? 15.29326 -15.38656 -2.43727 1.000 8.03760 C ? A ? 83 C 1
   ATOM 762 O . ALA A 95 ? 15.76021 -15.98377 -1.45092 1.000 9.74527 O ? A ? 83 O 1
   ATOM 763 CB . ALA A 95 ? 17.04449 -15.22534 -4.20287 1.000 9.29934 C ? A ? 83 CB 1
   ATOM 764 N . THR A 96 ? 14.45348 -14.35813 -2.28607 1.000 8.08005 N ? A ? 84 N 1
   ATOM 765 CA . THR A 96 ? 14.01036 -13.92393 -0.97322 1.000 8.19726 C ? A ? 84 CA 1
   ATOM 766 C . THR A 96 ? 12.83641 -14.71610 -0.43565 1.000 8.09882 C ? A ? 84 C 1
   ATOM 767 O . THR A 96 ? 12.46813 -14.47144 0.73408 1.000 9.28013 O ? A ? 84 O 1
   ATOM 768 CB . THR A 96 ? 13.60401 -12.43534 -0.96363 1.000 8.55790 C ? A ? 84 CB 1
   ATOM 769 OG1 . THR A 96 ? 12.36556 -12.25752 -1.67975 1.000 8.10116 O ? A ? 84 OG1 1
   ATOM 770 CG2 . THR A 96 ? 14.68336 -11.54803 -1.52331 1.000 9.20323 C ? A ? 84 CG2 1
   ATOM 771 N A MET A 97 ? 12.25467 -15.65112 -1.18670 0.349 7.91520 N ? A ? 85 N 1
   ATOM 772 CA A MET A 97 ? 10.96570 -16.24392 -0.84842 0.349 7.67433 C ? A ? 85 CA 1
   ATOM 773 C A MET A 97 ? 11.09172 -17.60066 -0.16254 0.349 8.15052 C ? A ? 85 C 1
   ATOM 774 O A MET A 97 ? 11.92634 -18.44239 -0.51293 0.349 8.05162 O ? A ? 85 O 1
   ATOM 775 CB A MET A 97 ? 10.12085 -16.40776 -2.11191 0.349 8.30146 C ? A ? 85 CB 1
   ATOM 776 CG A MET A 97 ? 9.59819 -15.10867 -2.63969 0.349 6.42823 C ? A ? 85 CG 1
   ATOM 777 SD A MET A 97 ? 8.72773 -15.30771 -4.21442 0.349 7.33251 S ? A ? 85 SD 1
   ATOM 778 CE A MET A 97 ? 7.16374 -16.07624 -3.65574 0.349 7.92678 C ? A ? 85 CE 1
   ATOM 779 N B MET A 97 ? 12.19278 -15.55134 -1.23575 0.651 7.68519 N ? A ? 85 N 1
   ATOM 780 CA B MET A 97 ? 10.92128 -16.16101 -0.87039 0.651 7.36903 C ? A ? 85 CA 1
   ATOM 781 C B MET A 97 ? 11.14121 -17.47468 -0.11500 0.651 7.47068 C ? A ? 85 C 1
   ATOM 782 O B MET A 97 ? 12.16055 -18.15918 -0.27279 0.651 8.25520 O ? A ? 85 O 1
   ATOM 783 CB B MET A 97 ? 10.10915 -16.42737 -2.14312 0.651 8.43728 C ? A ? 85 CB 1
   ATOM 784 CG B MET A 97 ? 9.82622 -15.17692 -2.96332 0.651 7.20225 C ? A ? 85 CG 1
   ATOM 785 SD B MET A 97 ? 8.73885 -15.53982 -4.38811 0.651 7.61298 S ? A ? 85 SD 1
   ATOM 786 CE B MET A 97 ? 7.16335 -15.79669 -3.50430 0.651 8.00188 C ? A ? 85 CE 1
   ATOM 787 N A LYS A 98 ? 10.17061 -17.83645 0.76079 0.349 8.67644 N ? A ? 86 N 1
   ATOM 788 CA A LYS A 98 ? 10.02597 -19.16150 1.33506 0.349 9.36263 C ? A ? 86 CA 1
   ATOM 789 C A LYS A 98 ? 9.04704 -20.00531 0.51691 0.349 7.73962 C ? A ? 86 C 1
   ATOM 790 O A LYS A 98 ? 8.24022 -19.50940 -0.29783 0.349 8.62912 O ? A ? 86 O 1
   ATOM 791 CB A LYS A 98 ? 9.58666 -19.08103 2.80493 0.349 11.49152 C ? A ? 86 CB 1
   ATOM 792 CG A LYS A 98 ? 10.67661 -18.57070 3.75561 0.349 15.45434 C ? A ? 86 CG 1
   ATOM 793 CD A LYS A 98 ? 10.72409 -17.04541 3.84313 0.349 11.24430 C ? A ? 86 CD 1
   ATOM 794 CE A LYS A 98 ? 11.64452 -16.55322 4.95002 0.349 24.11441 C ? A ? 86 CE 1
   ATOM 795 NZ A LYS A 98 ? 11.48532 -15.08144 5.11824 0.349 23.78399 N ? A ? 86 NZ 1
   ATOM 796 N B LYS A 98 ? 10.12063 -17.84147 0.67820 0.651 8.46969 N ? A ? 86 N 1
   ATOM 797 CA B LYS A 98 ? 10.00603 -19.12462 1.36954 0.651 9.33952 C ? A ? 86 CA 1
   ATOM 798 C B LYS A 98 ? 8.98451 -19.97413 0.62513 0.651 8.47452 C ? A ? 86 C 1
   ATOM 799 O B LYS A 98 ? 8.09314 -19.44560 -0.05315 0.651 8.17761 O ? A ? 86 O 1
   ATOM 800 CB B LYS A 98 ? 9.54331 -18.91919 2.82620 0.651 11.66556 C ? A ? 86 CB 1
   ATOM 801 CG B LYS A 98 ? 10.56088 -18.13922 3.64929 0.651 16.70556 C ? A ? 86 CG 1
   ATOM 802 CD B LYS A 98 ? 10.06762 -17.76569 5.04020 0.651 19.01506 C ? A ? 86 CD 1
   ATOM 803 CE B LYS A 98 ? 11.11659 -16.95798 5.80068 0.651 23.13511 C ? A ? 86 CE 1
   ATOM 804 NZ B LYS A 98 ? 11.24179 -15.57345 5.25860 0.651 23.60961 N ? A ? 86 NZ 1
   ATOM 805 N . LYS A 99 ? 9.09380 -21.30277 0.77709 1.000 9.37538 N ? A ? 87 N 1
   ATOM 806 CA . LYS A 99 ? 8.11818 -22.18068 0.14710 1.000 9.12496 C ? A ? 87 CA 1
   ATOM 807 C . LYS A 99 ? 6.71752 -21.81855 0.60884 1.000 9.16797 C ? A ? 87 C 1
   ATOM 808 O . LYS A 99 ? 6.47770 -21.68156 1.81214 1.000 10.58651 O ? A ? 87 O 1
   ATOM 809 CB . LYS A 99 ? 8.40702 -23.63003 0.49693 1.000 10.63900 C ? A ? 87 CB 1
   ATOM 810 CG . LYS A 99 ? 7.47980 -24.60013 -0.19382 1.000 13.99863 C ? A ? 87 CG 1
   ATOM 811 CD . LYS A 99 ? 7.93806 -26.03378 -0.00136 1.000 16.07949 C ? A ? 87 CD 1
   ATOM 812 CE . LYS A 99 ? 6.91845 -27.00103 -0.60940 1.000 17.04612 C ? A ? 87 CE 1
   ATOM 813 NZ . LYS A 99 ? 7.30436 -28.37250 -0.15574 1.000 46.24353 N ? A ? 87 NZ 1
   ATOM 814 N . GLY A 100 ? 5.78803 -21.72715 -0.31884 1.000 8.72694 N ? A ? 88 N 1
   ATOM 815 CA . GLY A 100 ? 4.42687 -21.36102 0.00127 1.000 10.10354 C ? A ? 88 CA 1
   ATOM 816 C . GLY A 100 ? 4.16466 -19.87497 0.04501 1.000 8.86970 C ? A ? 88 C 1
   ATOM 817 O . GLY A 100 ? 2.99056 -19.46831 0.18815 1.000 10.41322 O ? A ? 88 O 1
   ATOM 818 N . GLU A 101 ? 5.19529 -19.03505 -0.04387 1.000 8.38540 N ? A ? 89 N 1
   ATOM 819 CA . GLU A 101 ? 4.99475 -17.59309 -0.00672 1.000 7.74635 C ? A ? 89 CA 1
   ATOM 820 C . GLU A 101 ? 4.35139 -17.11321 -1.29413 1.000 7.35558 C ? A ? 89 C 1
   ATOM 821 O . GLU A 101 ? 4.63282 -17.61120 -2.37351 1.000 7.91188 O ? A ? 89 O 1
   ATOM 822 CB . GLU A 101 ? 6.35904 -16.91932 0.20520 1.000 8.35296 C ? A ? 89 CB 1
   ATOM 823 CG . GLU A 101 ? 6.33996 -15.41110 0.23353 1.000 8.48289 C ? A ? 89 CG 1
   ATOM 824 CD . GLU A 101 ? 7.68517 -14.82006 0.49500 1.000 8.26767 C ? A ? 89 CD 1
   ATOM 825 OE1 . GLU A 101 ? 8.42897 -15.39353 1.33560 1.000 9.08830 O ? A ? 89 OE1 1
   ATOM 826 OE2 . GLU A 101 ? 8.00430 -13.78580 -0.12989 1.000 8.83475 O ? A ? 89 OE2 1
   ATOM 827 N A ILE A 102 ? 3.48705 -16.09434 -1.20390 0.377 7.66338 N ? A ? 90 N 1
   ATOM 828 CA A ILE A 102 ? 3.05315 -15.32135 -2.37197 0.377 7.47509 C ? A ? 90 CA 1
   ATOM 829 C A ILE A 102 ? 3.49562 -13.88228 -2.12778 0.377 8.15470 C ? A ? 90 C 1
   ATOM 830 O A ILE A 102 ? 3.22887 -13.34395 -1.06204 0.377 7.28380 O ? A ? 90 O 1
   ATOM 831 CB A ILE A 102 ? 1.52152 -15.36367 -2.53237 0.377 8.76594 C ? A ? 90 CB 1
   ATOM 832 CG1 A ILE A 102 ? 1.01791 -16.74094 -3.00478 0.377 9.02749 C ? A ? 90 CG1 1
   ATOM 833 CG2 A ILE A 102 ? 1.03862 -14.22014 -3.38857 0.377 8.18043 C ? A ? 90 CG2 1
   ATOM 834 CD1 A ILE A 102 ? -0.50534 -16.87333 -2.98854 0.377 9.88047 C ? A ? 90 CD1 1
   ATOM 835 N B ILE A 102 ? 3.52451 -16.06382 -1.12867 0.623 7.31025 N ? A ? 90 N 1
   ATOM 836 CA B ILE A 102 ? 3.06272 -15.24657 -2.23770 0.623 7.61661 C ? A ? 90 CA 1
   ATOM 837 C B ILE A 102 ? 3.58652 -13.83759 -2.02956 0.623 7.05214 C ? A ? 90 C 1
   ATOM 838 O B ILE A 102 ? 3.47969 -13.29047 -0.92057 0.623 7.98688 O ? A ? 90 O 1
   ATOM 839 CB B ILE A 102 ? 1.53106 -15.25151 -2.37603 0.623 8.26087 C ? A ? 90 CB 1
   ATOM 840 CG1 B ILE A 102 ? 1.03248 -16.70299 -2.44894 0.623 7.70367 C ? A ? 90 CG1 1
   ATOM 841 CG2 B ILE A 102 ? 1.14779 -14.48526 -3.66849 0.623 10.27061 C ? A ? 90 CG2 1
   ATOM 842 CD1 B ILE A 102 ? -0.45057 -16.88788 -2.35729 0.623 10.11014 C ? A ? 90 CD1 1
   ATOM 843 N . CYS A 103 ? 4.15331 -13.25044 -3.10475 1.000 7.04334 N ? A ? 91 N 1
   ATOM 844 CA . CYS A 103 ? 4.59408 -11.86261 -3.01600 1.000 7.50706 C ? A ? 91 CA 1
   ATOM 845 C . CYS A 103 ? 4.15706 -11.10163 -4.23923 1.000 6.70911 C ? A ? 91 C 1
   ATOM 846 O . CYS A 103 ? 3.76414 -11.67637 -5.26155 1.000 7.31494 O ? A ? 91 O 1
   ATOM 847 CB . CYS A 103 ? 6.09703 -11.74104 -2.75992 1.000 7.51478 C ? A ? 91 CB 1
   ATOM 848 SG . CYS A 103 ? 7.14480 -11.93966 -4.24136 1.000 8.70873 S ? A ? 91 SG 1
   ATOM 849 N . HIS A 104 ? 4.23168 -9.76997 -4.11088 1.000 7.17824 N ? A ? 92 N 1
   ATOM 850 CA . HIS A 104 ? 4.14961 -8.83991 -5.22961 1.000 7.68190 C ? A ? 92 CA 1
   ATOM 851 C . HIS A 104 ? 5.50986 -8.21406 -5.45544 1.000 7.52012 C ? A ? 92 C 1
   ATOM 852 O . HIS A 104 ? 6.19922 -7.85368 -4.48613 1.000 7.96269 O ? A ? 92 O 1
   ATOM 853 CB . HIS A 104 ? 3.14000 -7.71651 -4.95167 1.000 8.04928 C ? A ? 92 CB 1
   ATOM 854 CG . HIS A 104 ? 1.74577 -8.18486 -4.95935 1.000 7.99661 C ? A ? 92 CG 1
   ATOM 855 ND1 . HIS A 104 ? 0.66529 -7.38498 -4.64804 1.000 8.43716 N ? A ? 92 ND1 1
   ATOM 856 CD2 . HIS A 104 ? 1.24722 -9.39567 -5.29595 1.000 8.23264 C ? A ? 92 CD2 1
   ATOM 857 CE1 . HIS A 104 ? -0.42537 -8.09521 -4.80393 1.000 9.00717 C ? A ? 92 CE1 1
   ATOM 858 NE2 . HIS A 104 ? -0.11442 -9.31547 -5.20084 1.000 9.37157 N ? A ? 92 NE2 1
   ATOM 859 N . LEU A 105 ? 5.90572 -8.10908 -6.73310 1.000 7.44795 N ? A ? 93 N 1
   ATOM 860 CA . LEU A 105 ? 7.16105 -7.48846 -7.11679 1.000 8.11685 C ? A ? 93 CA 1
   ATOM 861 C . LEU A 105 ? 6.88467 -6.39018 -8.11371 1.000 7.94348 C ? A ? 93 C 1
   ATOM 862 O . LEU A 105 ? 6.12462 -6.60068 -9.07243 1.000 10.50007 O ? A ? 93 O 1
   ATOM 863 CB . LEU A 105 ? 8.10589 -8.44752 -7.80215 1.000 10.54883 C ? A ? 93 CB 1
   ATOM 864 CG . LEU A 105 ? 8.70229 -9.55912 -6.97373 1.000 10.62524 C ? A ? 93 CG 1
   ATOM 865 CD1 . LEU A 105 ? 9.67176 -10.36867 -7.88271 1.000 13.63139 C ? A ? 93 CD1 1
   ATOM 866 CD2 . LEU A 105 ? 9.45684 -9.07355 -5.78416 1.000 10.88291 C ? A ? 93 CD2 1
   ATOM 867 N B LEU A 106 ? 7.53835 -5.26481 -7.94835 0.717 8.19824 N ? A ? 94 N 1
   ATOM 868 CA B LEU A 106 ? 7.44608 -4.15036 -8.87082 0.717 7.81505 C ? A ? 94 CA 1
   ATOM 869 C B LEU A 106 ? 8.84206 -3.87724 -9.40029 0.717 8.30478 C ? A ? 94 C 1
   ATOM 870 O B LEU A 106 ? 9.75162 -3.53405 -8.62092 0.717 8.56951 O ? A ? 94 O 1
   ATOM 871 CB B LEU A 106 ? 6.87991 -2.95102 -8.17208 0.717 9.07123 C ? A ? 94 CB 1
   ATOM 872 CG B LEU A 106 ? 6.71848 -2.05071 -9.39056 0.717 18.41960 C ? A ? 94 CG 1
   ATOM 873 CD1 B LEU A 106 ? 5.29738 -2.06769 -9.95999 0.717 9.27596 C ? A ? 94 CD1 1
   ATOM 874 CD2 B LEU A 106 ? 7.41294 -0.74204 -9.33784 0.717 11.27967 C ? A ? 94 CD2 1
   ATOM 875 N C LEU A 106 ? 7.43987 -5.21722 -7.86740 0.283 8.34030 N ? A ? 94 N 1
   ATOM 876 CA C LEU A 106 ? 7.51955 -4.17101 -8.86262 0.283 7.81455 C ? A ? 94 CA 1
   ATOM 877 C C LEU A 106 ? 8.92295 -4.21421 -9.43659 0.283 10.49124 C ? A ? 94 C 1
   ATOM 878 O C LEU A 106 ? 9.91119 -4.33668 -8.71833 0.283 7.03389 O ? A ? 94 O 1
   ATOM 879 CB C LEU A 106 ? 7.25397 -2.80263 -8.25106 0.283 10.83904 C ? A ? 94 CB 1
   ATOM 880 CG C LEU A 106 ? 7.04985 -1.66351 -9.26265 0.283 12.11031 C ? A ? 94 CG 1
   ATOM 881 CD1 C LEU A 106 ? 5.78477 -1.83427 -10.09590 0.283 7.09042 C ? A ? 94 CD1 1
   ATOM 882 CD2 C LEU A 106 ? 7.13336 -0.30300 -8.59532 0.283 12.88694 C ? A ? 94 CD2 1
   ATOM 883 N . CYS A 107 ? 9.02476 -4.12103 -10.73373 1.000 8.67085 N ? A ? 95 N 1
   ATOM 884 CA . CYS A 107 ? 10.32416 -4.30380 -11.37459 1.000 10.02991 C ? A ? 95 CA 1
   ATOM 885 C . CYS A 107 ? 10.57010 -3.17707 -12.36686 1.000 9.56587 C ? A ? 95 C 1
   ATOM 886 O . CYS A 107 ? 9.86042 -3.07468 -13.38874 1.000 9.78511 O ? A ? 95 O 1
   ATOM 887 CB . CYS A 107 ? 10.32083 -5.66443 -12.12733 1.000 11.81674 C ? A ? 95 CB 1
   ATOM 888 SG . CYS A 107 ? 9.75032 -7.07372 -11.14994 1.000 11.53241 S ? A ? 95 SG 1
   ATOM 889 N . LYS A 108 ? 11.56747 -2.33788 -12.09386 1.000 9.36158 N ? A ? 96 N 1
   ATOM 890 CA . LYS A 108 ? 11.92515 -1.30504 -13.06215 1.000 8.68737 C ? A ? 96 CA 1
   ATOM 891 C . LYS A 108 ? 12.60645 -1.95642 -14.25099 1.000 8.30589 C ? A ? 96 C 1
   ATOM 892 O . LYS A 108 ? 13.13634 -3.05889 -14.14160 1.000 8.70144 O ? A ? 96 O 1
   ATOM 893 CB . LYS A 108 ? 12.80127 -0.24645 -12.38617 1.000 10.54152 C ? A ? 96 CB 1
   ATOM 894 CG . LYS A 108 ? 12.16018 0.44815 -11.18400 1.000 12.26673 C ? A ? 96 CG 1
   ATOM 895 CD . LYS A 108 ? 10.76375 1.05644 -11.43744 1.000 12.70367 C ? A ? 96 CD 1
   ATOM 896 CE . LYS A 108 ? 10.84360 2.33542 -12.30032 1.000 12.71172 C ? A ? 96 CE 1
   ATOM 897 NZ . LYS A 108 ? 9.50117 2.84761 -12.62802 1.000 12.52540 N ? A ? 96 NZ 1
   ATOM 898 N . PRO A 109 ? 12.66406 -1.26878 -15.40665 1.000 8.76190 N ? A ? 97 N 1
   ATOM 899 CA . PRO A 109 ? 13.15409 -1.94390 -16.61313 1.000 9.13310 C ? A ? 97 CA 1
   ATOM 900 C . PRO A 109 ? 14.57033 -2.43520 -16.51886 1.000 8.72063 C ? A ? 97 C 1
   ATOM 901 O . PRO A 109 ? 14.91117 -3.40927 -17.18078 1.000 9.61569 O ? A ? 97 O 1
   ATOM 902 CB . PRO A 109 ? 12.91447 -0.92486 -17.74861 1.000 10.45142 C ? A ? 97 CB 1
   ATOM 903 CG . PRO A 109 ? 12.49300 0.33572 -17.11535 1.000 12.21478 C ? A ? 97 CG 1
   ATOM 904 CD . PRO A 109 ? 12.03445 0.01419 -15.69939 1.000 9.77449 C ? A ? 97 CD 1
   ATOM 905 N . GLU A 110 ? 15.41060 -1.77651 -15.75638 1.000 10.00022 N ? A ? 98 N 1
   ATOM 906 CA . GLU A 110 ? 16.79149 -2.20358 -15.58725 1.000 10.41706 C ? A ? 98 CA 1
   ATOM 907 C . GLU A 110 ? 16.89517 -3.57225 -14.95139 1.000 9.93023 C ? A ? 98 C 1
   ATOM 908 O . GLU A 110 ? 17.96201 -4.19611 -15.04111 1.000 11.91600 O ? A ? 98 O 1
   ATOM 909 CB . GLU A 110 ? 17.57177 -1.18681 -14.74890 1.000 11.58975 C ? A ? 98 CB 1
   ATOM 910 CG . GLU A 110 ? 17.73437 0.16611 -15.41522 1.000 13.54450 C ? A ? 98 CG 1
   ATOM 911 CD . GLU A 110 ? 16.52101 1.08412 -15.27873 1.000 12.42232 C ? A ? 98 CD 1
   ATOM 912 OE1 . GLU A 110 ? 15.53704 0.78600 -14.53531 1.000 12.42127 O ? A ? 98 OE1 1
   ATOM 913 OE2 . GLU A 110 ? 16.53206 2.16955 -15.95533 1.000 16.86358 O ? A ? 98 OE2 1
   ATOM 914 N . TYR A 111 ? 15.84525 -4.04140 -14.27891 1.000 9.37882 N ? A ? 99 N 1
   ATOM 915 CA . TYR A 111 ? 15.79758 -5.37316 -13.69391 1.000 8.97664 C ? A ? 99 CA 1
   ATOM 916 C . TYR A 111 ? 14.82953 -6.26318 -14.44739 1.000 8.73100 C ? A ? 99 C 1
   ATOM 917 O . TYR A 111 ? 14.43437 -7.33472 -13.94210 1.000 9.64801 O ? A ? 99 O 1
   ATOM 918 CB . TYR A 111 ? 15.43578 -5.29445 -12.19734 1.000 9.22773 C ? A ? 99 CB 1
   ATOM 919 CG . TYR A 111 ? 16.56697 -4.65900 -11.39273 1.000 9.90554 C ? A ? 99 CG 1
   ATOM 920 CD1 . TYR A 111 ? 16.67439 -3.28573 -11.23557 1.000 9.98539 C ? A ? 99 CD1 1
   ATOM 921 CD2 . TYR A 111 ? 17.49077 -5.46615 -10.74614 1.000 10.99042 C ? A ? 99 CD2 1
   ATOM 922 CE1 . TYR A 111 ? 17.73296 -2.72823 -10.48011 1.000 11.48086 C ? A ? 99 CE1 1
   ATOM 923 CE2 . TYR A 111 ? 18.52276 -4.91803 -9.97814 1.000 12.41507 C ? A ? 99 CE2 1
   ATOM 924 CZ . TYR A 111 ? 18.63388 -3.56285 -9.87770 1.000 11.83582 C ? A ? 99 CZ 1
   ATOM 925 OH . TYR A 111 ? 19.68668 -3.02824 -9.13307 1.000 14.65383 O ? A ? 99 OH 1
   ATOM 926 N . ALA A 112 ? 14.43591 -5.83698 -15.64597 1.000 8.97301 N ? A ? 100 N 1
   ATOM 927 CA . ALA A 112 ? 13.47584 -6.56448 -16.44477 1.000 9.44346 C ? A ? 100 CA 1
   ATOM 928 C . ALA A 112 ? 13.96869 -6.60578 -17.87314 1.000 9.29233 C ? A ? 100 C 1
   ATOM 929 O . ALA A 112 ? 15.05662 -7.11934 -18.09679 1.000 10.73668 O ? A ? 100 O 1
   ATOM 930 CB . ALA A 112 ? 12.05436 -6.03125 -16.27630 1.000 10.35002 C ? A ? 100 CB 1
   ATOM 931 N . TYR A 113 ? 13.25188 -6.02336 -18.83375 1.000 9.10996 N ? A ? 101 N 1
   ATOM 932 CA . TYR A 113 ? 13.59944 -6.15259 -20.25634 1.000 9.82970 C ? A ? 101 CA 1
   ATOM 933 C . TYR A 113 ? 14.23625 -4.88928 -20.81446 1.000 8.76436 C ? A ? 101 C 1
   ATOM 934 O . TYR A 113 ? 14.49110 -4.78953 -22.04396 1.000 10.29604 O ? A ? 101 O 1
   ATOM 935 CB . TYR A 113 ? 12.39970 -6.60257 -21.09763 1.000 10.28332 C ? A ? 101 CB 1
   ATOM 936 CG . TYR A 113 ? 11.93289 -7.96409 -20.69118 1.000 10.27729 C ? A ? 101 CG 1
   ATOM 937 CD1 . TYR A 113 ? 12.54150 -9.10313 -21.21418 1.000 12.47007 C ? A ? 101 CD1 1
   ATOM 938 CD2 . TYR A 113 ? 10.89142 -8.12176 -19.80886 1.000 12.34256 C ? A ? 101 CD2 1
   ATOM 939 CE1 . TYR A 113 ? 12.13397 -10.38112 -20.80588 1.000 13.99644 C ? A ? 101 CE1 1
   ATOM 940 CE2 . TYR A 113 ? 10.44746 -9.40639 -19.44090 1.000 13.91158 C ? A ? 101 CE2 1
   ATOM 941 CZ . TYR A 113 ? 11.07284 -10.47921 -19.94248 1.000 12.60583 C ? A ? 101 CZ 1
   ATOM 942 OH . TYR A 113 ? 10.63298 -11.74707 -19.53765 1.000 16.63026 O ? A ? 101 OH 1
   ATOM 943 N . GLY A 114 ? 14.49881 -3.89936 -20.00412 1.000 8.90360 N ? A ? 102 N 1
   ATOM 944 CA . GLY A 114 ? 15.32553 -2.79809 -20.45716 1.000 9.41023 C ? A ? 102 CA 1
   ATOM 945 C . GLY A 114 ? 14.69605 -2.01892 -21.60052 1.000 8.67188 C ? A ? 102 C 1
   ATOM 946 O . GLY A 114 ? 13.49110 -1.93313 -21.76563 1.000 9.39765 O ? A ? 102 O 1
   ATOM 947 N . SER A 115 ? 15.57505 -1.39655 -22.38400 1.000 9.46310 N ? A ? 103 N 1
   ATOM 948 CA . SER A 115 ? 15.12793 -0.69912 -23.58101 1.000 9.15756 C ? A ? 103 CA 1
   ATOM 949 C . SER A 115 ? 14.67666 -1.64987 -24.68409 1.000 9.11831 C ? A ? 103 C 1
   ATOM 950 O . SER A 115 ? 13.93746 -1.22902 -25.57945 1.000 10.36308 O ? A ? 103 O 1
   ATOM 951 CB . SER A 115 ? 16.20852 0.23806 -24.10199 1.000 9.97137 C ? A ? 103 CB 1
   ATOM 952 OG . SER A 115 ? 17.44928 -0.41203 -24.20837 1.000 11.49503 O ? A ? 103 OG 1
   ATOM 953 N . ALA A 116 ? 15.09414 -2.91077 -24.67092 1.000 10.21460 N ? A ? 104 N 1
   ATOM 954 CA . ALA A 116 ? 14.71209 -3.80196 -25.75452 1.000 10.67478 C ? A ? 104 CA 1
   ATOM 955 C . ALA A 116 ? 13.25127 -4.16719 -25.68532 1.000 10.76192 C ? A ? 104 C 1
   ATOM 956 O . ALA A 116 ? 12.60745 -4.34793 -26.73659 1.000 12.96343 O ? A ? 104 O 1
   ATOM 957 CB . ALA A 116 ? 15.54513 -5.07795 -25.68989 1.000 12.81607 C ? A ? 104 CB 1
   ATOM 958 N . GLY A 117 ? 12.68608 -4.31492 -24.46816 1.000 9.98914 N ? A ? 105 N 1
   ATOM 959 CA . GLY A 117 ? 11.37662 -4.92840 -24.35946 1.000 10.70045 C ? A ? 105 CA 1
   ATOM 960 C . GLY A 117 ? 11.43243 -6.40221 -24.70610 1.000 11.02933 C ? A ? 105 C 1
   ATOM 961 O . GLY A 117 ? 12.49660 -7.00353 -24.78692 1.000 11.92938 O ? A ? 105 O 1
   ATOM 962 N . SER A 118 ? 10.23971 -6.99283 -24.89176 1.000 11.26215 N ? A ? 106 N 1
   ATOM 963 CA . SER A 118 ? 10.16924 -8.39471 -25.26947 1.000 12.75099 C ? A ? 106 CA 1
   ATOM 964 C . SER A 118 ? 8.88037 -8.59072 -26.04347 1.000 12.22210 C ? A ? 106 C 1
   ATOM 965 O . SER A 118 ? 7.78035 -8.49965 -25.49598 1.000 14.56090 O ? A ? 106 O 1
   ATOM 966 CB . SER A 118 ? 10.19586 -9.25605 -24.01115 1.000 13.24067 C ? A ? 106 CB 1
   ATOM 967 OG . SER A 118 ? 10.25885 -10.63137 -24.38730 1.000 17.57800 O ? A ? 106 OG 1
   ATOM 968 N . LEU A 119 ? 9.03630 -8.87080 -27.33972 1.000 18.14453 N ? A ? 107 N 1
   ATOM 969 CA . LEU A 119 ? 7.88236 -9.14472 -28.17716 1.000 50.08399 C ? A ? 107 CA 1
   ATOM 970 C . LEU A 119 ? 7.12176 -10.36313 -27.65186 1.000 75.99594 C ? A ? 107 C 1
   ATOM 971 O . LEU A 119 ? 7.71214 -11.26837 -27.05452 1.000 76.02916 O ? A ? 107 O 1
   ATOM 972 CB . LEU A 119 ? 8.33476 -9.40040 -29.60761 1.000 47.56094 C ? A ? 107 CB 1
   ATOM 973 CG . LEU A 119 ? 8.97928 -8.18845 -30.26524 1.000 43.70995 C ? A ? 107 CG 1
   ATOM 974 CD1 . LEU A 119 ? 9.32485 -8.49414 -31.70978 1.000 47.77621 C ? A ? 107 CD1 1
   ATOM 975 CD2 . LEU A 119 ? 8.06106 -6.98906 -30.17509 1.000 45.11011 C ? A ? 107 CD2 1
   ATOM 976 N . PRO A 120 ? 5.80214 -10.41334 -27.86162 1.000 96.13425 N ? A ? 108 N 1
   ATOM 977 CA . PRO A 120 ? 4.97406 -9.44920 -28.58465 1.000 97.57258 C ? A ? 108 CA 1
   ATOM 978 C . PRO A 120 ? 4.33823 -8.42102 -27.67070 1.000 79.10256 C ? A ? 108 C 1
   ATOM 979 O . PRO A 120 ? 3.67901 -7.51170 -28.14739 1.000 78.66234 O ? A ? 108 O 1
   ATOM 980 CB . PRO A 120 ? 3.88663 -10.34615 -29.17173 1.000 114.71265 C ? A ? 108 CB 1
   ATOM 981 CG . PRO A 120 ? 3.65596 -11.35135 -28.07826 1.000 121.07863 C ? A ? 108 CG 1
   ATOM 982 CD . PRO A 120 ? 5.01798 -11.59473 -27.46048 1.000 112.74834 C ? A ? 108 CD 1
   ATOM 983 N . LYS A 121 ? 4.50642 -8.51993 -26.35481 1.000 60.17117 N ? A ? 109 N 1
   ATOM 984 CA . LYS A 121 ? 3.67745 -7.75250 -25.44068 1.000 43.40803 C ? A ? 109 CA 1
   ATOM 985 C . LYS A 121 ? 4.39848 -6.72170 -24.58384 1.000 15.74258 C ? A ? 109 C 1
   ATOM 986 O . LYS A 121 ? 3.72995 -5.82051 -24.07697 1.000 17.89238 O ? A ? 109 O 1
   ATOM 987 CB . LYS A 121 ? 2.87448 -8.67788 -24.51321 1.000 53.15221 C ? A ? 109 CB 1
   ATOM 988 CG . LYS A 121 ? 1.80953 -9.48201 -25.22612 1.000 65.91516 C ? A ? 109 CG 1
   ATOM 989 CD . LYS A 121 ? 0.99784 -10.32382 -24.25841 1.000 69.88822 C ? A ? 109 CD 1
   ATOM 990 CE . LYS A 121 ? 1.26024 -11.80800 -24.45899 1.000 78.54705 C ? A ? 109 CE 1
   ATOM 991 NZ . LYS A 121 ? 0.01832 -12.59943 -24.22790 1.000 78.80946 N ? A ? 109 NZ 1
   ATOM 992 N . ILE A 122 ? 5.70241 -6.82525 -24.36787 1.000 12.71874 N ? A ? 110 N 1
   ATOM 993 CA . ILE A 122 ? 6.36046 -5.96786 -23.39047 1.000 11.11575 C ? A ? 110 CA 1
   ATOM 994 C . ILE A 122 ? 7.07677 -4.83717 -24.11597 1.000 10.39561 C ? A ? 110 C 1
   ATOM 995 O . ILE A 122 ? 8.01745 -5.11497 -24.88144 1.000 10.35546 O ? A ? 110 O 1
   ATOM 996 CB . ILE A 122 ? 7.30731 -6.75108 -22.48158 1.000 11.50989 C ? A ? 110 CB 1
   ATOM 997 CG1 . ILE A 122 ? 6.49450 -7.83831 -21.75930 1.000 13.81633 C ? A ? 110 CG1 1
   ATOM 998 CG2 . ILE A 122 ? 8.02992 -5.78964 -21.47944 1.000 11.66246 C ? A ? 110 CG2 1
   ATOM 999 CD1 . ILE A 122 ? 7.31786 -8.78965 -20.95894 1.000 16.67799 C ? A ? 110 CD1 1
   ATOM 1000 N . PRO A 123 ? 6.67547 -3.59742 -23.92066 1.000 10.00456 N ? A ? 111 N 1
   ATOM 1001 CA . PRO A 123 ? 7.29491 -2.48460 -24.65655 1.000 10.38758 C ? A ? 111 CA 1
   ATOM 1002 C . PRO A 123 ? 8.66131 -2.15071 -24.08258 1.000 9.13773 C ? A ? 111 C 1
   ATOM 1003 O . PRO A 123 ? 9.08984 -2.64141 -23.01880 1.000 9.62050 O ? A ? 111 O 1
   ATOM 1004 CB . PRO A 123 ? 6.31492 -1.30731 -24.44574 1.000 11.56841 C ? A ? 111 CB 1
   ATOM 1005 CG . PRO A 123 ? 5.73305 -1.60016 -23.12715 1.000 15.24836 C ? A ? 111 CG 1
   ATOM 1006 CD . PRO A 123 ? 5.59024 -3.13286 -23.04185 1.000 11.07305 C ? A ? 111 CD 1
   ATOM 1007 N . SER A 124 ? 9.38112 -1.28896 -24.82185 1.000 9.36769 N ? A ? 112 N 1
   ATOM 1008 CA . SER A 124 ? 10.61863 -0.71914 -24.31056 1.000 9.04782 C ? A ? 112 CA 1
   ATOM 1009 C . SER A 124 ? 10.40110 0.03655 -22.99736 1.000 8.51407 C ? A ? 112 C 1
   ATOM 1010 O . SER A 124 ? 9.37818 0.69562 -22.82048 1.000 10.33348 O ? A ? 112 O 1
   ATOM 1011 CB . SER A 124 ? 11.09711 0.27139 -25.36836 1.000 10.07160 C ? A ? 112 CB 1
   ATOM 1012 OG . SER A 124 ? 12.34630 0.82218 -25.05321 1.000 10.35070 O ? A ? 112 OG 1
   ATOM 1013 N . ASN A 125 ? 11.38454 -0.04591 -22.11286 1.000 8.72213 N ? A ? 113 N 1
   ATOM 1014 CA . ASN A 125 ? 11.42749 0.77606 -20.91177 1.000 9.48606 C ? A ? 113 CA 1
   ATOM 1015 C . ASN A 125 ? 10.24335 0.50809 -19.98360 1.000 8.84643 C ? A ? 113 C 1
   ATOM 1016 O . ASN A 125 ? 9.71330 1.42813 -19.33718 1.000 10.27659 O ? A ? 113 O 1
   ATOM 1017 CB . ASN A 125 ? 11.54222 2.26531 -21.22737 1.000 10.32780 C ? A ? 113 CB 1
   ATOM 1018 CG . ASN A 125 ? 12.75468 2.61203 -22.05333 1.000 11.89201 C ? A ? 113 CG 1
   ATOM 1019 OD1 . ASN A 125 ? 13.78985 2.00657 -21.93191 1.000 11.84663 O ? A ? 113 OD1 1
   ATOM 1020 ND2 . ASN A 125 ? 12.61264 3.63237 -22.91233 1.000 15.72600 N ? A ? 113 ND2 1
   ATOM 1021 N . ALA A 126 ? 9.81286 -0.74806 -19.88782 1.000 9.00035 N ? A ? 114 N 1
   ATOM 1022 CA . ALA A 126 ? 8.58663 -1.08467 -19.15552 1.000 9.04510 C ? A ? 114 CA 1
   ATOM 1023 C . ALA A 126 ? 8.84491 -1.44478 -17.68781 1.000 8.52065 C ? A ? 114 C 1
   ATOM 1024 O . ALA A 126 ? 9.67272 -2.30279 -17.39254 1.000 9.90676 O ? A ? 114 O 1
   ATOM 1025 CB . ALA A 126 ? 7.90433 -2.27478 -19.81427 1.000 10.93119 C ? A ? 114 CB 1
   ATOM 1026 N . THR A 127 ? 8.11419 -0.80858 -16.79163 1.000 8.36500 N ? A ? 115 N 1
   ATOM 1027 CA . THR A 127 ? 8.03781 -1.25364 -15.40546 1.000 8.48292 C ? A ? 115 CA 1
   ATOM 1028 C . THR A 127 ? 6.96926 -2.34486 -15.31474 1.000 10.06975 C ? A ? 115 C 1
   ATOM 1029 O . THR A 127 ? 5.86689 -2.17893 -15.84459 1.000 10.61048 O ? A ? 115 O 1
   ATOM 1030 CB . THR A 127 ? 7.70270 -0.06603 -14.49297 1.000 10.03994 C ? A ? 115 CB 1
   ATOM 1031 OG1 . THR A 127 ? 8.81146 0.82459 -14.50087 1.000 10.07728 O ? A ? 115 OG1 1
   ATOM 1032 CG2 . THR A 127 ? 7.41428 -0.49450 -13.08723 1.000 10.15241 C ? A ? 115 CG2 1
   ATOM 1033 N . LEU A 128 ? 7.29143 -3.46160 -14.66657 1.000 9.11466 N ? A ? 116 N 1
   ATOM 1034 CA . LEU A 128 ? 6.40983 -4.63068 -14.60615 1.000 9.72829 C ? A ? 116 CA 1
   ATOM 1035 C . LEU A 128 ? 5.96053 -4.95094 -13.19560 1.000 8.22767 C ? A ? 116 C 1
   ATOM 1036 O . LEU A 128 ? 6.71776 -4.76563 -12.23698 1.000 9.41526 O ? A ? 116 O 1
   ATOM 1037 CB . LEU A 128 ? 7.12445 -5.87350 -15.14527 1.000 9.78029 C ? A ? 116 CB 1
   ATOM 1038 CG . LEU A 128 ? 7.78188 -5.74140 -16.52295 1.000 10.82234 C ? A ? 116 CG 1
   ATOM 1039 CD1 . LEU A 128 ? 8.46386 -7.07650 -16.88382 1.000 12.70712 C ? A ? 116 CD1 1
   ATOM 1040 CD2 . LEU A 128 ? 6.79757 -5.33784 -17.58492 1.000 12.13425 C ? A ? 116 CD2 1
   ATOM 1041 N . PHE A 129 ? 4.72551 -5.42232 -13.07797 1.000 8.57079 N ? A ? 117 N 1
   ATOM 1042 CA . PHE A 129 ? 4.17960 -5.90013 -11.80922 1.000 7.88149 C ? A ? 117 CA 1
   ATOM 1043 C . PHE A 129 ? 3.98216 -7.40834 -11.89869 1.000 7.38020 C ? A ? 117 C 1
   ATOM 1044 O . PHE A 129 ? 3.41028 -7.90116 -12.87441 1.000 8.90223 O ? A ? 117 O 1
   ATOM 1045 CB . PHE A 129 ? 2.82154 -5.24357 -11.55444 1.000 8.43981 C ? A ? 117 CB 1
   ATOM 1046 CG . PHE A 129 ? 2.06938 -5.84650 -10.40298 1.000 8.72424 C ? A ? 117 CG 1
   ATOM 1047 CD1 . PHE A 129 ? 2.28412 -5.43947 -9.10791 1.000 8.45446 C ? A ? 117 CD1 1
   ATOM 1048 CD2 . PHE A 129 ? 1.12964 -6.84806 -10.61861 1.000 9.40246 C ? A ? 117 CD2 1
   ATOM 1049 CE1 . PHE A 129 ? 1.57888 -5.97724 -8.05139 1.000 9.17310 C ? A ? 117 CE1 1
   ATOM 1050 CE2 . PHE A 129 ? 0.44276 -7.42266 -9.55803 1.000 10.85151 C ? A ? 117 CE2 1
   ATOM 1051 CZ . PHE A 129 ? 0.68842 -6.99649 -8.25320 1.000 10.28763 C ? A ? 117 CZ 1
   ATOM 1052 N . PHE A 130 ? 4.39986 -8.13743 -10.87048 1.000 7.78649 N ? A ? 118 N 1
   ATOM 1053 CA . PHE A 130 ? 4.13887 -9.56188 -10.78707 1.000 8.45414 C ? A ? 118 CA 1
   ATOM 1054 C . PHE A 130 ? 3.54082 -9.93390 -9.44300 1.000 7.77032 C ? A ? 118 C 1
   ATOM 1055 O . PHE A 130 ? 3.93584 -9.39522 -8.40615 1.000 8.15664 O ? A ? 118 O 1
   ATOM 1056 CB . PHE A 130 ? 5.39453 -10.41106 -10.92047 1.000 8.67469 C ? A ? 118 CB 1
   ATOM 1057 CG . PHE A 130 ? 6.05179 -10.31448 -12.26725 1.000 9.13028 C ? A ? 118 CG 1
   ATOM 1058 CD1 . PHE A 130 ? 5.69403 -11.18399 -13.29032 1.000 10.74033 C ? A ? 118 CD1 1
   ATOM 1059 CD2 . PHE A 130 ? 7.07542 -9.41043 -12.50804 1.000 10.22139 C ? A ? 118 CD2 1
   ATOM 1060 CE1 . PHE A 130 ? 6.33195 -11.12215 -14.52846 1.000 13.43826 C ? A ? 118 CE1 1
   ATOM 1061 CE2 . PHE A 130 ? 7.71068 -9.37805 -13.74585 1.000 11.57070 C ? A ? 118 CE2 1
   ATOM 1062 CZ . PHE A 130 ? 7.36804 -10.22610 -14.73056 1.000 12.59914 C ? A ? 118 CZ 1
   ATOM 1063 N A GLU A 131 ? 2.68076 -10.94643 -9.46890 0.370 8.15342 N ? A ? 119 N 1
   ATOM 1064 CA A GLU A 131 ? 2.28247 -11.66962 -8.27467 0.370 7.77110 C ? A ? 119 CA 1
   ATOM 1065 C A GLU A 131 ? 2.80931 -13.09206 -8.42333 0.370 8.09399 C ? A ? 119 C 1
   ATOM 1066 O A GLU A 131 ? 2.40443 -13.77816 -9.35797 0.370 7.60590 O ? A ? 119 O 1
   ATOM 1067 CB A GLU A 131 ? 0.76240 -11.68752 -8.16306 0.370 9.41466 C ? A ? 119 CB 1
   ATOM 1068 CG A GLU A 131 ? 0.28044 -12.64053 -7.10447 0.370 11.60503 C ? A ? 119 CG 1
   ATOM 1069 CD A GLU A 131 ? -1.18758 -12.45699 -6.76341 0.370 10.38423 C ? A ? 119 CD 1
   ATOM 1070 OE1 A GLU A 131 ? -1.52454 -11.59133 -5.92918 0.370 12.28450 O ? A ? 119 OE1 1
   ATOM 1071 OE2 A GLU A 131 ? -2.03014 -13.22537 -7.28077 0.370 12.80216 O ? A ? 119 OE2 1
   ATOM 1072 N B GLU A 131 ? 2.59315 -10.88523 -9.46785 0.630 7.80330 N ? A ? 119 N 1
   ATOM 1073 CA B GLU A 131 ? 2.28637 -11.69483 -8.30504 0.630 7.78431 C ? A ? 119 CA 1
   ATOM 1074 C B GLU A 131 ? 2.95009 -13.05313 -8.51433 0.630 7.31636 C ? A ? 119 C 1
   ATOM 1075 O B GLU A 131 ? 2.80663 -13.64065 -9.58864 0.630 7.88457 O ? A ? 119 O 1
   ATOM 1076 CB B GLU A 131 ? 0.78080 -11.86081 -8.08710 0.630 9.38793 C ? A ? 119 CB 1
   ATOM 1077 CG B GLU A 131 ? 0.44068 -12.62221 -6.77615 0.630 9.24932 C ? A ? 119 CG 1
   ATOM 1078 CD B GLU A 131 ? -1.03466 -12.58731 -6.43185 0.630 13.24916 C ? A ? 119 CD 1
   ATOM 1079 OE1 B GLU A 131 ? -1.63477 -11.48251 -6.30182 0.630 12.22212 O ? A ? 119 OE1 1
   ATOM 1080 OE2 B GLU A 131 ? -1.61022 -13.70292 -6.32046 0.630 16.87174 O ? A ? 119 OE2 1
   ATOM 1081 N . ILE A 132 ? 3.69252 -13.52372 -7.50834 1.000 7.65991 N ? A ? 120 N 1
   ATOM 1082 CA . ILE A 132 ? 4.45624 -14.76680 -7.62001 1.000 7.27401 C ? A ? 120 CA 1
   ATOM 1083 C . ILE A 132 ? 4.19080 -15.61701 -6.41210 1.000 7.10579 C ? A ? 120 C 1
   ATOM 1084 O . ILE A 132 ? 4.27730 -15.14324 -5.28461 1.000 7.74284 O ? A ? 120 O 1
   ATOM 1085 CB . ILE A 132 ? 5.96847 -14.51151 -7.73421 1.000 8.70686 C ? A ? 120 CB 1
   ATOM 1086 CG1 . ILE A 132 ? 6.30689 -13.64834 -8.92232 1.000 10.35804 C ? A ? 120 CG1 1
   ATOM 1087 CG2 . ILE A 132 ? 6.75298 -15.83530 -7.76926 1.000 10.52230 C ? A ? 120 CG2 1
   ATOM 1088 CD1 . ILE A 132 ? 7.76149 -13.21269 -8.96293 1.000 14.50177 C ? A ? 120 CD1 1
   ATOM 1089 N A GLU A 133 ? 3.91694 -16.90713 -6.62313 0.431 8.02773 N ? A ? 121 N 1
   ATOM 1090 CA A GLU A 133 ? 3.83789 -17.86677 -5.52410 0.431 8.12647 C ? A ? 121 CA 1
   ATOM 1091 C A GLU A 133 ? 4.93373 -18.90597 -5.70676 0.431 7.52056 C ? A ? 121 C 1
   ATOM 1092 O A GLU A 133 ? 4.99181 -19.55499 -6.74486 0.431 7.77990 O ? A ? 121 O 1
   ATOM 1093 CB A GLU A 133 ? 2.46045 -18.55732 -5.48580 0.431 8.20069 C ? A ? 121 CB 1
   ATOM 1094 CG A GLU A 133 ? 2.33565 -19.61616 -4.39138 0.431 9.41643 C ? A ? 121 CG 1
   ATOM 1095 CD A GLU A 133 ? 0.96710 -20.28339 -4.36476 0.431 9.64417 C ? A ? 121 CD 1
   ATOM 1096 OE1 A GLU A 133 ? 0.07248 -19.91428 -5.15567 0.431 12.36052 O ? A ? 121 OE1 1
   ATOM 1097 OE2 A GLU A 133 ? 0.79275 -21.20483 -3.52834 0.431 10.49271 O ? A ? 121 OE2 1
   ATOM 1098 N B GLU A 133 ? 3.93892 -16.90914 -6.67153 0.569 7.87960 N ? A ? 121 N 1
   ATOM 1099 CA B GLU A 133 ? 3.82989 -17.94465 -5.65800 0.569 7.95408 C ? A ? 121 CA 1
   ATOM 1100 C B GLU A 133 ? 5.01414 -18.88926 -5.80323 0.569 7.33113 C ? A ? 121 C 1
   ATOM 1101 O B GLU A 133 ? 5.21904 -19.44328 -6.90037 0.569 7.78060 O ? A ? 121 O 1
   ATOM 1102 CB B GLU A 133 ? 2.52349 -18.73882 -5.85261 0.569 7.18976 C ? A ? 121 CB 1
   ATOM 1103 CG B GLU A 133 ? 2.35377 -19.82663 -4.85087 0.569 8.67816 C ? A ? 121 CG 1
   ATOM 1104 CD B GLU A 133 ? 1.04420 -20.61619 -5.01845 0.569 12.37321 C ? A ? 121 CD 1
   ATOM 1105 OE1 B GLU A 133 ? 0.34299 -20.46315 -6.03879 0.569 14.00539 O ? A ? 121 OE1 1
   ATOM 1106 OE2 B GLU A 133 ? 0.73175 -21.43440 -4.13208 0.569 12.05852 O ? A ? 121 OE2 1
   ATOM 1107 N . LEU A 134 ? 5.78598 -19.07383 -4.70403 1.000 7.78626 N ? A ? 122 N 1
   ATOM 1108 CA . LEU A 134 ? 6.87782 -20.05550 -4.73045 1.000 8.05354 C ? A ? 122 CA 1
   ATOM 1109 C . LEU A 134 ? 6.28657 -21.39602 -4.29499 1.000 8.42323 C ? A ? 122 C 1
   ATOM 1110 O . LEU A 134 ? 5.96409 -21.59287 -3.12491 1.000 10.39695 O ? A ? 122 O 1
   ATOM 1111 CB . LEU A 134 ? 8.03639 -19.62628 -3.84553 1.000 8.11831 C ? A ? 122 CB 1
   ATOM 1112 CG . LEU A 134 ? 9.18678 -20.63932 -3.82656 1.000 9.01781 C ? A ? 122 CG 1
   ATOM 1113 CD1 . LEU A 134 ? 9.73431 -20.97281 -5.22682 1.000 9.70624 C ? A ? 122 CD1 1
   ATOM 1114 CD2 . LEU A 134 ? 10.32751 -20.13395 -2.93631 1.000 9.68123 C ? A ? 122 CD2 1
   ATOM 1115 N . LEU A 135 ? 6.10579 -22.30759 -5.24520 1.000 8.33393 N ? A ? 123 N 1
   ATOM 1116 CA . LEU A 135 ? 5.46912 -23.58037 -4.97278 1.000 9.24743 C ? A ? 123 CA 1
   ATOM 1117 C . LEU A 135 ? 6.42685 -24.55894 -4.33218 1.000 10.14484 C ? A ? 123 C 1
   ATOM 1118 O . LEU A 135 ? 6.02635 -25.32526 -3.42963 1.000 12.34600 O ? A ? 123 O 1
   ATOM 1119 CB . LEU A 135 ? 4.94638 -24.19129 -6.28017 1.000 10.35055 C ? A ? 123 CB 1
   ATOM 1120 CG . LEU A 135 ? 3.94755 -23.32366 -7.03944 1.000 10.13353 C ? A ? 123 CG 1
   ATOM 1121 CD1 . LEU A 135 ? 3.79648 -23.86546 -8.44752 1.000 11.61461 C ? A ? 123 CD1 1
   ATOM 1122 CD2 . LEU A 135 ? 2.60563 -23.32789 -6.35047 1.000 13.38521 C ? A ? 123 CD2 1
   ATOM 1123 N . ASP A 136 ? 7.65614 -24.59204 -4.78923 1.000 9.88218 N ? A ? 124 N 1
   ATOM 1124 CA . ASP A 136 ? 8.60056 -25.59754 -4.33625 1.000 10.83573 C ? A ? 124 CA 1
   ATOM 1125 C . ASP A 136 ? 9.97650 -25.19699 -4.82221 1.000 10.54531 C ? A ? 124 C 1
   ATOM 1126 O . ASP A 136 ? 10.10925 -24.41444 -5.77645 1.000 10.58144 O ? A ? 124 O 1
   ATOM 1127 CB . ASP A 136 ? 8.23552 -26.97184 -4.92784 1.000 12.79042 C ? A ? 124 CB 1
   ATOM 1128 CG . ASP A 136 ? 8.83329 -28.13299 -4.15346 1.000 14.83052 C ? A ? 124 CG 1
   ATOM 1129 OD1 . ASP A 136 ? 9.44094 -27.90292 -3.08398 1.000 16.27317 O ? A ? 124 OD1 1
   ATOM 1130 OD2 . ASP A 136 ? 8.63775 -29.28236 -4.66105 1.000 25.04052 O ? A ? 124 OD2 1
   ATOM 1131 N . PHE A 137 ? 11.00285 -25.74885 -4.17610 1.000 11.42781 N ? A ? 125 N 1
   ATOM 1132 CA . PHE A 137 ? 12.36819 -25.62034 -4.66085 1.000 12.09046 C ? A ? 125 CA 1
   ATOM 1133 C . PHE A 137 ? 13.09469 -26.89554 -4.27278 1.000 11.81987 C ? A ? 125 C 1
   ATOM 1134 O . PHE A 137 ? 12.80004 -27.48935 -3.21729 1.000 12.74974 O ? A ? 125 O 1
   ATOM 1135 CB . PHE A 137 ? 13.08729 -24.36757 -4.13887 1.000 13.44715 C ? A ? 125 CB 1
   ATOM 1136 CG . PHE A 137 ? 13.20622 -24.23417 -2.63624 1.000 11.40412 C ? A ? 125 CG 1
   ATOM 1137 CD1 . PHE A 137 ? 14.30317 -24.73470 -1.95538 1.000 12.52340 C ? A ? 125 CD1 1
   ATOM 1138 CD2 . PHE A 137 ? 12.26785 -23.46412 -1.91427 1.000 14.68114 C ? A ? 125 CD2 1
   ATOM 1139 CE1 . PHE A 137 ? 14.44073 -24.53323 -0.59065 1.000 14.11769 C ? A ? 125 CE1 1
   ATOM 1140 CE2 . PHE A 137 ? 12.41762 -23.26349 -0.53230 1.000 17.37547 C ? A ? 125 CE2 1
   ATOM 1141 CZ . PHE A 137 ? 13.50447 -23.77652 0.11520 1.000 16.28980 C ? A ? 125 CZ 1
   ATOM 1142 N . LYS A 138 ? 13.98562 -27.35229 -5.14752 1.000 12.33748 N ? A ? 126 N 1
   ATOM 1143 CA . LYS A 138 ? 14.73022 -28.57997 -4.88415 1.000 15.94886 C ? A ? 126 CA 1
   ATOM 1144 C . LYS A 138 ? 16.11826 -28.47916 -5.50855 1.000 18.84461 C ? A ? 126 C 1
   ATOM 1145 O . LYS A 138 ? 16.30331 -27.89774 -6.57050 1.000 14.53390 O ? A ? 126 O 1
   ATOM 1146 CB . LYS A 138 ? 13.98198 -29.78712 -5.45213 1.000 23.89415 C ? A ? 126 CB 1
   ATOM 1147 CG . LYS A 138 ? 14.02130 -29.91150 -6.94224 1.000 36.35935 C ? A ? 126 CG 1
   ATOM 1148 CD . LYS A 138 ? 13.53110 -31.28266 -7.39447 1.000 57.21995 C ? A ? 126 CD 1
   ATOM 1149 CE . LYS A 138 ? 12.05511 -31.27247 -7.75346 1.000 63.58188 C ? A ? 126 CE 1
   ATOM 1150 NZ . LYS A 138 ? 11.47215 -32.64941 -7.76910 1.000 69.34754 N ? A ? 126 NZ 1
   ATOM 1151 N . GLY A 139 ? 17.09780 -29.10609 -4.86405 1.000 51.81486 N ? A ? 127 N 1
   ATOM 1152 CA . GLY A 139 ? 18.43284 -29.19067 -5.42854 1.000 79.88897 C ? A ? 127 CA 1
   ATOM 1153 C . GLY A 139 ? 18.65229 -30.46459 -6.22922 1.000 105.47274 C ? A ? 127 C 1
   ATOM 1154 O . GLY A 139 ? 17.99746 -31.47840 -6.00742 1.000 108.46377 O ? A ? 127 O 1
   ATOM 1155 N . GLU A 140 ? 19.59707 -30.40049 -7.16618 1.000 130.83075 N ? A ? 128 N 1
   ATOM 1156 CA . GLU A 140 ? 19.93891 -31.55070 -8.01023 1.000 150.55398 C ? A ? 128 CA 1
   ATOM 1157 C . GLU A 140 ? 21.37890 -32.01418 -7.79831 1.000 152.10140 C ? A ? 128 C 1
   ATOM 1158 O . GLU A 140 ? 21.64302 -33.21007 -7.66650 1.000 156.56191 O ? A ? 128 O 1
   ATOM 1159 CB . GLU A 140 ? 19.70263 -31.22874 -9.49023 1.000 159.76225 C ? A ? 128 CB 1
   ATOM 1160 CG . GLU A 140 ? 20.27245 -32.25490 -10.45931 1.000 164.89609 C ? A ? 128 CG 1
   ATOM 1161 CD . GLU A 140 ? 19.89490 -31.97183 -11.90195 1.000 167.36591 C ? A ? 128 CD 1
   ATOM 1162 OE1 . GLU A 140 ? 18.82563 -32.43332 -12.34326 1.000 168.76601 O ? A ? 128 OE1 1
   ATOM 1163 OE2 . GLU A 140 ? 20.66824 -31.28775 -12.60203 1.000 167.10747 O ? A ? 128 OE2 1
   HETATM 1164 CL . CL A 201 ? -5.31547 -4.38835 -7.78336 1.000 42.81110 Cl ? B ? . CL 1
   HETATM 1165 NA . NA A 202 ? -2.94837 -3.67936 -0.53764 1.000 15.20465 Na 1+ C ? . NA 1
   HETATM 1166 NA . NA A 203 ? 10.40344 -14.03009 2.50391 1.000 20.08885 Na 1+ D ? . NA 1
   HETATM 1167 C2 . HRZ A 204 ? 10.78877 -14.18501 -16.74996 1.000 41.14337 C ? E ? . C2 1
   HETATM 1168 C3 . HRZ A 204 ? 9.67188 -13.60495 -16.06150 1.000 28.39237 C ? E ? . C3 1
   HETATM 1169 C4 . HRZ A 204 ? 8.44222 -14.19183 -16.11146 1.000 38.61266 C ? E ? . C4 1
   HETATM 1170 C5 . HRZ A 204 ? 8.21072 -15.39233 -16.83866 1.000 33.19687 C ? E ? . C5 1
   HETATM 1171 C6 . HRZ A 204 ? 9.26238 -15.94658 -17.49021 1.000 37.05490 C ? E ? . C6 1
   HETATM 1172 N7 . HRZ A 204 ? 10.48465 -15.35616 -17.43490 1.000 42.22745 N ? E ? . N7 1
   HETATM 1173 O1 . HRZ A 204 ? 11.92409 -13.72945 -16.76272 1.000 17.61864 O ? E ? . O1 1
   HETATM 1174 C2 . HRZ A 205 ? 18.01079 -14.71482 1.34264 0.785 12.11827 C ? F ? . C2 1
   HETATM 1175 C3 . HRZ A 205 ? 17.78822 -13.48242 2.04767 0.785 12.24195 C ? F ? . C3 1
   HETATM 1176 C4 . HRZ A 205 ? 17.78718 -12.27547 1.39130 0.785 13.11770 C ? F ? . C4 1
   HETATM 1177 C5 . HRZ A 205 ? 18.01257 -12.21909 0.03377 0.785 12.61757 C ? F ? . C5 1
   HETATM 1178 C6 . HRZ A 205 ? 18.21615 -13.37659 -0.65671 0.785 13.24601 C ? F ? . C6 1
   HETATM 1179 N7 . HRZ A 205 ? 18.24042 -14.56668 -0.00041 0.785 13.53134 N ? F ? . N7 1
   HETATM 1180 O1 . HRZ A 205 ? 18.02602 -15.82193 1.88340 0.785 13.83602 O ? F ? . O1 1
   HETATM 1181 O . HOH A 302 ? 4.44413 -28.82846 -17.51823 0.816 21.40642 O ? G ? . O 1
   HETATM 1183 O . HOH A 304 ? 19.46898 0.15263 -23.40797 0.744 8.16901 O ? G ? . O 1
   HETATM 1184 O . HOH A 306 ? 4.20747 -23.23122 -21.36944 0.999 38.09342 O ? G ? . O 1
   HETATM 1185 O . HOH A 307 ? 17.97489 -17.51504 -1.72665 0.939 11.89261 O ? G ? . O 1
   HETATM 1186 O . HOH A 310 ? 2.39656 -22.72563 -2.22051 0.714 17.39688 O ? G ? . O 1
   HETATM 1187 O . HOH A 311 ? 18.43113 -26.31079 -11.39025 0.701 22.77418 O ? G ? . O 1
   HETATM 1189 O . HOH A 315 ? -3.76442 -15.62422 -13.95819 0.744 25.91011 O ? G ? . O 1
   HETATM 1191 O . HOH A 317 ? -0.02081 3.84540 -0.99890 0.812 14.19012 O ? G ? . O 1
   HETATM 1192 O . HOH A 318 ? -3.59296 -10.67919 -4.42136 0.999 17.80335 O ? G ? . O 1
   HETATM 1193 O . HOH A 319 ? 17.35289 -9.29619 -1.69791 0.989 17.66341 O ? G ? . O 1
   HETATM 1194 O . HOH A 320 ? 7.72141 -18.56748 7.60779 0.755 23.80153 O ? G ? . O 1
   HETATM 1195 O . HOH A 321 ? 17.85957 -25.63615 -1.22759 0.900 12.92205 O ? G ? . O 1
   HETATM 1197 O . HOH A 323 ? -7.03926 -23.13978 -14.75456 0.849 18.04672 O ? G ? . O 1
   HETATM 1198 O . HOH A 324 ? -5.61265 -24.49832 -12.78934 0.472 16.44623 O ? G ? . O 1
   HETATM 1199 O . HOH A 325 ? 10.71191 -22.41079 2.89770 0.850 10.42255 O ? G ? . O 1
   HETATM 1200 O . HOH A 326 ? 13.12609 -25.90191 4.51060 0.678 16.38228 O ? G ? . O 1
   HETATM 1201 O . HOH A 327 ? 16.23648 1.92457 -1.18954 0.838 14.44988 O ? G ? . O 1
   HETATM 1202 O . HOH A 328 ? 15.98487 -28.02334 2.42934 0.827 16.59108 O ? G ? . O 1
   HETATM 1203 O . HOH A 329 ? -3.04079 -15.77794 -20.30688 0.907 37.88070 O ? G ? . O 1
   HETATM 1204 O . HOH A 330 ? 6.24451 1.24694 -17.52552 0.947 11.40573 O ? G ? . O 1
   HETATM 1205 O . HOH A 331 ? 15.33066 -5.71897 1.75844 0.948 25.35946 O ? G ? . O 1
   HETATM 1206 O . HOH A 332 ? 13.76148 -28.25445 -0.75249 0.991 25.86492 O ? G ? . O 1
   HETATM 1207 O . HOH A 333 ? 17.89501 -17.92568 -13.37914 1.000 11.82096 O ? G ? . O 1
   HETATM 1208 O . HOH A 334 ? 7.03606 1.49359 -21.82459 0.732 20.34568 O ? G ? . O 1
   HETATM 1209 O . HOH A 335 ? 4.75232 -1.78181 -18.30625 0.909 13.09214 O ? G ? . O 1
   HETATM 1210 O . HOH A 336 ? 3.61003 -25.05167 -2.19522 0.841 23.20904 O ? G ? . O 1
   HETATM 1211 O . HOH A 337 ? 8.62257 2.12085 -0.47295 0.790 13.24808 O ? G ? . O 1
   HETATM 1212 O . HOH A 338 ? 7.15638 -2.93604 2.46532 0.943 10.39994 O ? G ? . O 1
   HETATM 1213 O . HOH A 339 ? 18.47720 2.55355 -17.80485 0.773 14.91784 O ? G ? . O 1
   HETATM 1214 O . HOH A 340 ? 5.81719 -26.91151 -15.85330 0.793 16.20551 O ? G ? . O 1
   HETATM 1215 O . HOH A 341 ? 7.19782 -15.87315 3.73639 0.941 13.33300 O ? G ? . O 1
   HETATM 1216 O . HOH A 342 ? -3.68492 -23.31088 -13.16431 0.496 13.33743 O ? G ? . O 1
   HETATM 1217 O . HOH A 343 ? 11.12165 -3.19975 -21.25554 0.980 9.18182 O ? G ? . O 1
   HETATM 1218 O . HOH A 344 ? 10.60370 -0.59272 -8.33373 0.403 6.49814 O ? G ? . O 1
   HETATM 1219 O . HOH A 345 ? 21.22125 -25.93041 -6.01076 0.790 14.10893 O ? G ? . O 1
   HETATM 1220 O . HOH A 346 ? 9.48615 2.30677 -16.69876 0.931 11.35639 O ? G ? . O 1
   HETATM 1221 O . HOH A 347 ? 8.62435 3.42214 -5.90546 0.812 9.79948 O ? G ? . O 1
   HETATM 1222 O . HOH A 348 ? 7.96740 -4.79575 -27.59906 0.713 12.85556 O ? G ? . O 1
   HETATM 1223 O . HOH A 349 ? -1.09962 -9.88938 3.36531 0.890 9.83621 O ? G ? . O 1
   HETATM 1224 O . HOH A 350 ? 14.33222 -13.40032 2.47932 0.841 17.10848 O ? G ? . O 1
   HETATM 1225 O . HOH A 351 ? 12.89466 -11.52128 -24.34064 0.624 26.71590 O ? G ? . O 1
   HETATM 1226 O . HOH A 352 ? 3.33563 6.40096 -6.66516 0.923 23.21255 O ? G ? . O 1
   HETATM 1227 O . HOH A 353 ? 5.41973 -10.46214 -24.46741 1.000 33.17656 O ? G ? . O 1
   HETATM 1228 O . HOH A 354 ? 13.72708 2.84683 -14.24965 0.851 17.17674 O ? G ? . O 1
   HETATM 1229 O . HOH A 355 ? 23.65472 -15.60280 -9.10362 0.997 15.04192 O ? G ? . O 1
   HETATM 1230 O . HOH A 357 ? 18.52341 -12.79425 -14.04314 0.855 16.76068 O ? G ? . O 1
   HETATM 1231 O . HOH A 358 ? 3.83028 -21.98816 -16.96245 0.944 16.67527 O ? G ? . O 1
   HETATM 1233 O . HOH A 360 ? 16.11759 3.49440 -22.32251 0.695 11.29135 O ? G ? . O 1
   HETATM 1234 O . HOH A 361 ? -0.83159 -17.49239 -20.22151 0.868 24.98835 O ? G ? . O 1
   HETATM 1235 O . HOH A 362 ? 14.99841 0.82463 -19.75822 0.863 13.89660 O ? G ? . O 1
   HETATM 1236 O . HOH A 363 ? 20.21489 -7.10001 -5.98991 0.751 13.15511 O ? G ? . O 1
   HETATM 1237 O . HOH A 364 ? 17.56217 4.41702 -8.63850 0.692 26.79201 O ? G ? . O 1
   HETATM 1238 O . HOH A 365 ? 24.02623 -25.14257 -6.19138 0.720 12.03642 O ? G ? . O 1
   HETATM 1239 O . HOH A 366 ? 21.55837 -25.74491 -11.31330 0.710 18.85426 O ? G ? . O 1
   HETATM 1240 O . HOH A 367 ? 19.05464 -15.58104 -7.65493 0.799 12.43189 O ? G ? . O 1
   HETATM 1241 O . HOH A 368 ? 6.27585 -21.80034 9.13272 0.826 30.47277 O ? G ? . O 1
   HETATM 1242 O . HOH A 369 ? 10.92530 -10.44974 1.97303 0.980 16.94575 O ? G ? . O 1
   HETATM 1243 O . HOH A 370 ? 15.35575 1.96383 -9.95147 0.803 20.11079 O ? G ? . O 1
   HETATM 1245 O . HOH A 372 ? 13.68014 2.24120 -0.21286 0.943 12.12701 O ? G ? . O 1
   HETATM 1246 O . HOH A 373 ? -1.67917 1.72309 -1.00664 0.949 21.16026 O ? G ? . O 1
   HETATM 1248 O . HOH A 376 ? 0.62736 -16.32951 -8.64885 0.895 19.24340 O ? G ? . O 1
   HETATM 1249 O . HOH A 377 ? -0.55581 -5.12501 -1.12605 0.647 11.61855 O ? G ? . O 1
   HETATM 1250 O . HOH A 378 ? -1.18214 -22.60836 -6.74119 0.725 27.72341 O ? G ? . O 1
   HETATM 1251 O . HOH A 379 ? 21.37676 -21.36044 -17.71822 0.984 27.79197 O ? G ? . O 1
   HETATM 1252 O . HOH A 380 ? 8.04309 3.11629 -10.23715 0.977 10.79946 O ? G ? . O 1
   HETATM 1253 O . HOH A 381 ? 12.61241 -16.55432 -18.78997 0.809 27.78911 O ? G ? . O 1
   HETATM 1254 O . HOH A 382 ? 0.64696 -4.71540 -3.71015 0.996 10.50676 O ? G ? . O 1
   HETATM 1255 O . HOH A 383 ? 16.77105 -8.55556 -16.40742 1.000 13.49558 O ? G ? . O 1
   HETATM 1256 O . HOH A 384 ? 10.52167 -5.60996 -28.19574 0.747 15.35221 O ? G ? . O 1
   HETATM 1258 O . HOH A 386 ? 10.84933 -4.48015 -18.81679 1.000 10.11278 O ? G ? . O 1
   HETATM 1259 O . HOH A 387 ? -0.70191 -1.92948 -13.74620 0.946 13.31161 O ? G ? . O 1
   HETATM 1260 O . HOH A 388 ? 21.01056 -28.00965 -7.90327 0.895 19.30316 O ? G ? . O 1
   HETATM 1261 O . HOH A 389 ? 17.87732 -11.51950 -3.44065 1.000 12.76396 O ? G ? . O 1
   HETATM 1262 O . HOH A 390 ? 15.05057 -1.66357 1.74420 0.798 11.52966 O ? G ? . O 1
   HETATM 1263 O . HOH A 391 ? 3.16279 -19.58221 7.28368 0.692 22.45675 O ? G ? . O 1
   HETATM 1264 O . HOH A 392 ? 21.09389 -4.47193 -7.11780 0.936 14.48929 O ? G ? . O 1
   HETATM 1265 O . HOH A 393 ? 20.44052 -13.50429 -18.80895 1.000 42.39398 O ? G ? . O 1
   HETATM 1266 O . HOH A 394 ? 16.89730 -29.92340 -2.09169 0.989 29.74868 O ? G ? . O 1
   HETATM 1267 O . HOH A 395 ? 19.33479 -25.15632 -15.69886 0.828 26.36893 O ? G ? . O 1
   HETATM 1268 O . HOH A 396 ? 21.83388 -19.27985 -2.56597 0.915 9.68086 O ? G ? . O 1
   HETATM 1270 O . HOH A 400 ? 3.57989 3.72573 5.01173 0.933 13.84343 O ? G ? . O 1
   HETATM 1271 O . HOH A 401 ? 0.52257 -17.71243 5.84065 0.812 14.88442 O ? G ? . O 1
   HETATM 1272 O . HOH A 402 ? 10.31029 5.30296 -13.86457 0.663 17.96317 O ? G ? . O 1
   HETATM 1273 O . HOH A 403 ? 16.33282 0.35468 -11.79580 0.801 14.74230 O ? G ? . O 1
   HETATM 1275 O . HOH A 405 ? 3.26039 -10.58362 4.94331 0.854 14.62487 O ? G ? . O 1
   HETATM 1276 O . HOH A 406 ? 6.37265 -7.41598 2.97745 0.943 12.01487 O ? G ? . O 1
   HETATM 1277 O . HOH A 407 ? 14.80261 2.98360 -18.11772 0.922 18.95688 O ? G ? . O 1
   HETATM 1278 O . HOH A 408 ? 11.90336 5.07767 -6.14573 0.524 12.33105 O ? G ? . O 1
   HETATM 1279 O . HOH A 410 ? 5.84384 -23.49956 -18.11760 0.922 21.79025 O ? G ? . O 1
   HETATM 1280 O . HOH A 411 ? 8.72054 -7.17525 1.49192 0.653 15.64134 O ? G ? . O 1
   HETATM 1281 O . HOH A 412 ? 8.27717 0.02153 -27.18792 0.915 9.41025 O ? G ? . O 1
   HETATM 1283 O . HOH A 414 ? -3.29976 1.57846 -4.25997 0.784 14.22073 O ? G ? . O 1
   HETATM 1285 O . HOH A 417 ? -1.57158 -13.95440 4.21106 0.498 11.66762 O ? G ? . O 1
   HETATM 1286 O . HOH A 418 ? 11.80838 -9.42785 -28.30511 0.889 31.99572 O ? G ? . O 1
   HETATM 1287 O . HOH A 419 ? 17.20654 4.22421 -2.55769 0.984 32.72199 O ? G ? . O 1
   HETATM 1288 O . HOH A 420 ? -3.33136 -22.31864 -10.69430 0.915 24.60643 O ? G ? . O 1
   HETATM 1289 O . HOH A 421 ? 12.16178 -23.70857 6.07996 1.000 31.33788 O ? G ? . O 1
   HETATM 1290 O . HOH A 422 ? 1.96526 5.94612 3.17700 0.843 23.06860 O ? G ? . O 1
   HETATM 1291 O . HOH A 423 ? 18.48609 -1.53775 -21.76655 0.852 19.28841 O ? G ? . O 1
   HETATM 1292 O . HOH A 424 ? 8.53561 -23.98749 -17.17925 0.817 18.11559 O ? G ? . O 1
   HETATM 1293 O . HOH A 425 ? 19.04664 0.57062 -11.63661 0.883 24.70589 O ? G ? . O 1
   HETATM 1296 O . HOH A 429 ? 3.59377 -25.30444 0.73383 0.793 25.40594 O ? G ? . O 1
   HETATM 1297 O . HOH A 430 ? -2.33800 4.27326 -4.09331 0.838 26.35812 O ? G ? . O 1
   HETATM 1298 O . HOH A 432 ? 26.46975 -22.25600 -8.45403 0.912 17.68107 O ? G ? . O 1
   HETATM 1299 O . HOH A 433 ? -1.91149 -24.59454 -9.30545 0.834 20.06865 O ? G ? . O 1
   HETATM 1301 O . HOH A 435 ? 15.35258 -14.76305 4.69271 0.803 25.96314 O ? G ? . O 1
   HETATM 1304 O . HOH A 441 ? 5.35961 0.42007 -20.05740 0.762 17.96311 O ? G ? . O 1
   HETATM 1306 O . HOH A 445 ? 2.64638 0.06126 -20.25099 0.839 29.74060 O ? G ? . O 1
   HETATM 1308 O . HOH A 447 ? 19.99149 -27.18698 -2.44787 1.000 22.27724 O ? G ? . O 1
   HETATM 1312 O . HOH A 451 ? 0.53955 1.71958 4.20947 0.613 16.14047 O ? G ? . O 1
   HETATM 1314 O . HOH A 453 ? 0.91305 -23.72584 -0.25627 0.678 21.41686 O ? G ? . O 1
   HETATM 1315 O . HOH A 455 ? 10.06369 -12.14423 4.28310 0.765 17.07808 O ? G ? . O 1
   HETATM 1320 O . HOH A 462 ? 20.34403 -17.45094 -6.18854 0.857 11.54827 O ? G ? . O 1
   HETATM 1321 O . HOH A 464 ? 0.02467 4.36624 4.63382 0.883 38.25624 O ? G ? . O 1
   HETATM 1322 O . HOH A 466 ? 9.54479 2.10634 -8.17128 0.748 11.40158 O ? G ? . O 1
   HETATM 1324 O . HOH A 468 ? 11.57498 3.67438 -15.78664 0.592 15.58843 O ? G ? . O 1
   HETATM 1326 O . HOH A 472 ? 8.24294 -26.76061 -17.10236 0.948 28.56869 O ? G ? . O 1
   HETATM 1327 O . HOH A 473 ? 17.71160 0.83184 -19.72027 0.724 15.60259 O ? G ? . O 1
   HETATM 1328 O . HOH A 474 ? -3.20697 -2.63837 -13.03098 0.794 17.21206 O ? G ? . O 1
   HETATM 1329 O . HOH A 475 ? 8.98097 -26.31664 4.13068 0.628 25.81642 O ? G ? . O 1
   HETATM 1332 O . HOH A 479 ? 7.73883 5.85078 -6.79309 0.589 14.92211 O ? G ? . O 1
   HETATM 1334 O . HOH A 482 ? 11.90062 -6.50372 -30.58863 0.837 26.86972 O ? G ? . O 1
   HETATM 1335 O . HOH A 483 ? 17.41578 -13.04663 4.91839 0.726 22.54455 O ? G ? . O 1
   HETATM 1336 O . HOH A 484 ? 7.40852 -13.09046 5.29714 1.000 28.01402 O ? G ? . O 1
   HETATM 1337 O . HOH A 485 ? -7.42089 -23.21672 -12.03514 0.703 18.61157 O ? G ? . O 1
   HETATM 1339 O . HOH A 487 ? 16.35815 -27.76174 -0.32902 0.787 16.63875 O ? G ? . O 1
   HETATM 1340 O . HOH A 489 ? 11.05855 -25.17554 2.75592 0.713 16.16513 O ? G ? . O 1
   HETATM 1342 O . HOH A 493 ? 15.84773 -8.89114 0.93523 0.999 26.38267 O ? G ? . O 1
   HETATM 1343 O . HOH A 494 ? 14.24283 6.54288 -6.25137 0.846 23.77443 O ? G ? . O 1
   HETATM 1344 O . HOH A 495 ? 5.78698 -4.79901 3.71519 0.808 15.91011 O ? G ? . O 1
   HETATM 1346 O . HOH A 497 ? 27.62939 -18.07035 -9.58396 0.717 20.92978 O ? G ? . O 1
   HETATM 1347 O . HOH A 499 ? 6.01597 -28.92174 -13.88736 1.000 32.93673 O ? G ? . O 1
   HETATM 1348 O . HOH A 500 ? 22.53251 -15.83717 -6.54442 0.922 14.75220 O ? G ? . O 1
   HETATM 1349 O . HOH A 501 ? 26.34012 -15.88066 -8.64864 0.877 14.78102 O ? G ? . O 1
   HETATM 1350 O . HOH A 502 ? 28.06380 -20.18300 -7.75590 0.876 21.44843 O ? G ? . O 1
   HETATM 1352 O . HOH A 504 ? 6.91526 5.52693 -9.52904 0.916 16.15169 O ? G ? . O 1
   HETATM 1353 O . HOH A 505 ? 5.75940 -10.95777 5.92680 0.872 14.39914 O ? G ? . O 1
   HETATM 1354 O . HOH A 506 ? 6.94978 -8.53597 5.40163 0.940 18.16622 O ? G ? . O 1
   HETATM 1355 O . HOH A 509 ? 3.76733 6.23579 6.08008 0.610 24.72730 O ? G ? . O 1
   HETATM 1357 O . HOH A 514 ? -2.68940 -26.73615 -5.11703 0.785 28.20507 O ? G ? . O 1
   HETATM 1358 O . HOH A 516 ? 27.53619 -13.54682 -9.63107 0.812 22.65357 O ? G ? . O 1
   HETATM 1359 O . HOH A 518 ? 3.98313 5.87151 8.89772 0.966 25.88274 O ? G ? . O 1
   HETATM 1847 O . HOH S 519 ? -3.81852 -7.83441 -4.34128 0.955 18.75252 O ? H ? . O 1
   HETATM 1848 O . HOH S 520 ? 0.69017 -14.44460 5.74156 0.808 23.30541 O ? H ? . O 1
   HETATM 1849 O . HOH S 521 ? 19.67963 -10.89562 -10.58053 0.751 21.53770 O ? H ? . O 1
   HETATM 1850 O . HOH S 522 ? -1.40469 -15.96707 5.50154 0.519 28.25948 O ? H ? . O 1
   HETATM 1851 O . HOH S 523 ? 12.79117 -13.74171 -19.61331 0.889 27.79307 O ? H ? . O 1
   HETATM 1854 O . HOH S 526 ? 12.04500 2.93384 -8.34674 0.604 22.64952 O ? H ? . O 1
   HETATM 1855 O . HOH S 527 ? 6.08607 7.68426 4.96295 0.553 19.05203 O ? H ? . O 1
   HETATM 1856 O . HOH S 528 ? 21.47276 1.64602 -9.80290 0.780 27.80911 O ? H ? . O 1
   HETATM 1857 O . HOH S 529 ? -0.90868 -18.27374 -6.94951 0.516 20.58366 O ? H ? . O 1
   HETATM 1858 O . HOH S 530 ? 13.71446 4.01553 -9.84377 0.862 30.09519 O ? H ? . O 1
   HETATM 1861 O . HOH S 533 ? -3.67904 -6.09080 -9.16967 0.485 21.51912 O ? H ? . O 1
   HETATM 1862 O . HOH S 534 ? 12.31658 4.04931 -18.35378 0.686 30.03603 O ? H ? . O 1
   HETATM 1867 O . HOH S 539 ? 8.69744 -15.00214 5.78565 0.486 20.78816 O ? H ? . O 1
   HETATM 1868 O . HOH S 540 ? 16.12819 4.82333 -15.16187 0.997 41.17947 O ? H ? . O 1
   HETATM 1874 O . HOH S 546 ? 9.48044 -9.54034 4.76873 0.839 34.69037 O ? H ? . O 1
   HETATM 1876 O . HOH S 548 ? 6.71701 -20.14995 -20.81563 1.000 37.41725 O ? H ? . O 1
   HETATM 1878 O . HOH S 550 ? -0.55532 8.20769 -5.96099 0.615 29.18266 O ? H ? . O 1
   HETATM 1880 O . HOH S 552 ? 10.78263 -5.87197 6.43695 0.777 30.05863 O ? H ? . O 1
   HETATM 1884 O . HOH S 556 ? 9.17629 4.44254 -19.80181 0.663 26.12598 O ? H ? . O 1
   HETATM 1886 O . HOH S 558 ? -4.82155 -25.11005 -4.56177 0.660 27.97848 O ? H ? . O 1
   HETATM 1887 O . HOH S 559 ? -5.07678 -13.20506 -14.25923 0.975 42.22574 O ? H ? . O 1
   HETATM 1891 O . HOH S 563 ? 18.26555 -1.87441 -19.03690 0.679 39.33908 O ? H ? . O 1
   HETATM 1893 O . HOH S 565 ? -5.08525 -0.60592 -20.96134 0.605 26.59257 O ? H ? . O 1
   HETATM 1894 O . HOH S 566 ? 6.94120 5.70110 -0.94023 0.776 26.41082 O ? H ? . O 1
   HETATM 1910 O . HOH S 582 ? 10.26012 7.18698 -6.50419 0.559 24.83717 O ? H ? . O 1
   HETATM 1966 O . HOH S 610 ? 13.80280 -10.57289 2.16351 0.707 21.66081 O ? I ? . O 1
   HETATM 1970 O . HOH S 614 ? 21.54664 -14.28051 -11.52724 0.819 33.47308 O ? I ? . O 1
   HETATM 1975 O . HOH S 619 ? 14.81626 3.94552 -12.03976 0.708 35.72888 O ? I ? . O 1
   HETATM 1980 O . HOH S 624 ? -5.52372 -7.74336 -19.83020 0.667 30.27556 O ? I ? . O 1
   HETATM 1988 O . HOH S 632 ? 1.55196 -17.98737 8.45330 0.713 29.57990 O ? I ? . O 1
   HETATM 1992 O . HOH S 636 ? 8.33063 -12.16026 -18.22743 0.575 30.05923 O ? I ? . O 1
   HETATM 1998 O . HOH S 642 ? 26.27850 -11.58588 -10.73321 0.497 27.62394 O ? I ? . O 1
   HETATM 2012 O . HOH S 656 ? 11.99662 -18.55667 -20.59096 0.915 36.56912 O ? I ? . O 1
   HETATM 2016 O . HOH S 660 ? 11.51240 -26.66844 -0.03624 0.735 36.23899 O ? I ? . O 1
   HETATM 2024 O . HOH S 668 ? -7.33996 -2.40747 -20.76168 0.780 36.03601 O ? I ? . O 1
   HETATM 2043 O . HOH S 687 ? 10.17629 -11.69773 -28.16389 0.423 29.13991 O ? I ? . O 1
   HETATM 2056 O . HOH S 688 ? 15.14122 5.95579 -8.79109 0.560 19.63562 O ? J ? . O 1
   HETATM 2057 O . HOH S 689 ? 20.21921 -12.60827 -12.56438 0.496 19.37295 O ? J ? . O 1
   HETATM 2059 O . HOH S 691 ? 15.13364 -16.72256 6.20161 0.596 26.98449 O ? J ? . O 1
   HETATM 2061 O . HOH S 693 ? -0.25328 -16.00151 -6.33913 0.331 16.88802 O ? J ? . O 1
   HETATM 2062 O . HOH S 694 ? -3.13413 -8.42720 -7.88140 0.922 36.84788 O ? J ? . O 1
   HETATM 2063 O . HOH S 695 ? -1.50295 5.65757 0.17487 0.653 25.61381 O ? J ? . O 1
   HETATM 2066 O . HOH S 698 ? 23.46769 -15.18573 -13.28495 0.691 27.38104 O ? J ? . O 1
   HETATM 2067 O . HOH S 699 ? 0.18224 -3.02439 -24.18623 0.441 19.10352 O ? J ? . O 1
   HETATM 2070 O . HOH S 702 ? 21.72964 -24.13068 -13.20717 0.734 35.80020 O ? J ? . O 1
   HETATM 2071 O . HOH S 703 ? 13.68218 -7.58723 -27.50153 0.387 15.76808 O ? J ? . O 1
   HETATM 2081 O . HOH S 713 ? 5.25893 -16.76461 -21.53706 0.564 27.83391 O ? J ? . O 1
   HETATM 2084 O . HOH S 716 ? 7.86316 -11.77531 -24.15365 0.467 22.08285 O ? J ? . O 1
   HETATM 2086 O . HOH S 718 ? 15.88226 -25.08324 -15.39490 0.568 32.09024 O ? J ? . O 1
   HETATM 2091 O . HOH S 723 ? 21.95839 -28.38555 -10.42107 0.596 33.47662 O ? J ? . O 1
   HETATM 2094 O . HOH S 726 ? -6.36343 -19.76614 -14.48285 0.510 23.26099 O ? J ? . O 1
   HETATM 2098 O . HOH S 730 ? -4.90625 -4.11121 -14.63801 0.440 28.68452 O ? J ? . O 1
   HETATM 2100 O . HOH S 732 ? -0.81730 -23.41441 -3.93485 0.347 20.99155 O ? J ? . O 1
   HETATM 2113 O . HOH S 745 ? -3.90176 -0.62752 -23.41535 0.630 37.45844 O ? J ? . O 1
   HETATM 2150 O . HOH S 769 ? -1.25216 -14.71077 -9.31434 0.457 16.47593 O ? K ? . O 1
   HETATM 2157 O . HOH S 776 ? 15.92543 -26.26000 -13.35410 0.530 30.50036 O ? K ? . O 1
   HETATM 2158 O . HOH S 777 ? 15.65073 -13.23228 -19.85329 1.000 44.56478 O ? K ? . O 1
   HETATM 2174 O . HOH S 793 ? 21.10511 -28.36472 -12.79818 0.344 23.93569 O ? K ? . O 1
   HETATM 2188 O . HOH S 807 ? 23.53550 -23.48383 -14.81157 0.708 41.76801 O ? K ? . O 1
   HETATM 2190 O . HOH S 809 ? 0.54749 -15.80630 8.23004 0.346 20.40706 O ? K ? . O 1
   HETATM 2197 O . HOH S 816 ? 9.85590 -29.06113 0.88291 0.679 34.85914 O ? K ? . O 1
   HETATM 2200 O . HOH S 819 ? 8.90364 -29.67314 -14.57704 0.703 32.94321 O ? K ? . O 1
   HETATM 2212 O . HOH S 825 ? 6.30344 -13.06654 -19.67203 0.542 25.77326 O ? L ? . O 1
   HETATM 2213 O . HOH S 826 ? -0.40062 -25.36316 -5.31340 0.365 17.51491 O ? L ? . O 1
   HETATM 2222 O . HOH S 835 ? 17.73634 1.76021 1.17012 0.486 27.62025 O ? L ? . O 1
   HETATM 2224 O . HOH S 837 ? 25.25757 -17.07277 -12.87018 0.894 40.12121 O ? L ? . O 1
   HETATM 2234 O . HOH S 847 ? 21.56210 -28.67815 -15.55109 0.486 24.82898 O ? L ? . O 1
   HETATM 2237 O . HOH S 850 ? 7.53516 -27.31852 -19.85421 0.787 38.05560 O ? L ? . O 1
   HETATM 2238 O . HOH S 851 ? 26.18483 -18.97341 -11.44580 0.516 28.73250 O ? L ? . O 1
   HETATM 2245 O . HOH S 858 ? 18.78256 -9.94700 -17.73004 0.467 29.01670 O ? L ? . O 1
   HETATM 2246 O . HOH S 859 ? -1.62231 0.89852 -24.39453 0.381 25.69539 O ? L ? . O 1
   HETATM 2261 O . HOH S 874 ? 21.55391 -26.33688 -14.59281 0.288 22.54392 O ? L ? . O 1
   HETATM 2267 O . HOH S 880 ? 16.88281 -11.04421 -19.06614 0.814 46.19096 O ? L ? . O 1

data_comp_CL
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
   CL CL CL CL 0.000

loop_
  _chem_comp_tree.comp_id
  _chem_comp_tree.atom_id
  _chem_comp_tree.atom_back
  _chem_comp_tree.atom_forward
  _chem_comp_tree.connect_type
   CL CL n/a . END

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
   CL . 'chlorine                            ' non-polymer 1 1 .

data_comp_NA
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
   NA NA NA NA 0.000

loop_
  _chem_comp_tree.comp_id
  _chem_comp_tree.atom_id
  _chem_comp_tree.atom_back
  _chem_comp_tree.atom_forward
  _chem_comp_tree.connect_type
   NA NA n/a . END

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
   NA . 'sodium                              ' non-polymer 1 1 .

data_comp_HRZ
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
   HRZ C2 C CR6 0 0.532 -1.0047 -0.0181 0.0164
   HRZ C3 C CR16 0 -0.461 -0.2300 -1.2313 0.0037
   HRZ C5 C CR16 0 -0.399 1.8404 0.0200 -0.0318
   HRZ C6 C CR16 0 0.057 1.1162 1.1670 -0.0186
   HRZ O1 O O 0 -0.516 -2.2316 0.0521 0.0355
   HRZ C4 C CR16 0 -0.119 1.1301 -1.2047 -0.0196
   HRZ N7 N NR16 0 -0.653 -0.2354 1.1311 0.0047
   HRZ H8 H HCR6 0 0.272 -0.7696 -2.1686 0.0134
   HRZ H10 H HCR6 0 0.276 2.9186 0.0527 -0.0508
   HRZ H11 H HCR6 0 0.310 1.5608 2.1513 -0.0259
   HRZ H9 H HCR6 0 0.278 1.6816 -2.1365 -0.0292
   HRZ H12 H HNR6 0 0.422 -0.7363 2.0097 0.0152

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
   HRZ O1 C2 double 1.229 0.020 1.229
   HRZ C2 C3 single 1.440 0.020 1.440
   HRZ C2 N7 single 1.383 0.020 1.383
   HRZ C3 C4 double 1.361 0.020 1.361
   HRZ N7 C6 single 1.352 0.020 1.352
   HRZ C4 C5 single 1.416 0.020 1.416
   HRZ C6 C5 double 1.357 0.020 1.357
   HRZ C3 H8 single 0.930 0.020 1.080
   HRZ C5 H10 single 0.930 0.020 1.080
   HRZ C6 H11 single 0.930 0.020 1.080
   HRZ C4 H9 single 0.930 0.020 1.080
   HRZ N7 H12 single 0.860 0.020 1.020

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
   HRZ N7 C2 O1 120.53 3.000
   HRZ N7 C2 C3 113.63 3.000
   HRZ O1 C2 C3 125.84 3.000
   HRZ H8 C3 C4 121.06 3.000
   HRZ H8 C3 C2 117.50 3.000
   HRZ C4 C3 C2 121.44 3.000
   HRZ H10 C5 C4 121.86 3.000
   HRZ H10 C5 C6 120.53 3.000
   HRZ C4 C5 C6 117.61 3.000
   HRZ H11 C6 N7 115.83 3.000
   HRZ H11 C6 C5 123.42 3.000
   HRZ N7 C6 C5 120.75 3.000
   HRZ H9 C4 C5 119.26 3.000
   HRZ H9 C4 C3 119.50 3.000
   HRZ C5 C4 C3 121.24 3.000
   HRZ H12 N7 C6 118.17 3.000
   HRZ H12 N7 C2 116.50 3.000
   HRZ C6 N7 C2 125.32 3.000

loop_
  _chem_comp_tor.comp_id
  _chem_comp_tor.id
  _chem_comp_tor.atom_id_1
  _chem_comp_tor.atom_id_2
  _chem_comp_tor.atom_id_3
  _chem_comp_tor.atom_id_4
  _chem_comp_tor.value_angle
  _chem_comp_tor.value_angle_esd
  _chem_comp_tor.period
   HRZ CONST_01 C6 N7 C2 C3 0.00 0.0 0
   HRZ CONST_02 O1 C2 N7 C6 180.00 0.0 0
   HRZ CONST_03 H12 N7 C2 C3 180.00 0.0 0
   HRZ Var_01 C5 C4 C3 C2 0.03 30.0 1
   HRZ Var_02 C5 C6 N7 C2 -0.04 30.0 1
   HRZ Var_03 C6 C5 C4 C3 0.04 30.0 1
   HRZ Var_04 N7 C2 C3 C4 -0.09 30.0 1
   HRZ Var_05 N7 C6 C5 C4 -0.03 30.0 1
   HRZ Var_06 C4 C3 C2 O1 179.89 30.0 1
   HRZ Var_07 H9 C4 C3 C2 -179.96 30.0 1
   HRZ Var_08 H11 C6 N7 C2 179.94 30.0 1
   HRZ Var_09 H10 C5 C4 C3 -179.97 30.0 1
   HRZ Var_10 H8 C3 C4 C5 -179.97 30.0 1

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
   HRZ plan-1 C2 0.020
   HRZ plan-1 C3 0.020
   HRZ plan-1 C5 0.020
   HRZ plan-1 C6 0.020
   HRZ plan-1 O1 0.020
   HRZ plan-1 C4 0.020
   HRZ plan-1 N7 0.020
   HRZ plan-1 H8 0.020
   HRZ plan-1 H10 0.020
   HRZ plan-1 H11 0.020
   HRZ plan-1 H9 0.020
   HRZ plan-1 H12 0.020

loop_
  _chem_comp_plane.comp_id
  _chem_comp_plane.id
   HRZ plan-1

loop_
  _chem_comp.id
  _chem_comp.three_letter_code
  _chem_comp.name
  _chem_comp.group
  _chem_comp.number_atoms_all
  _chem_comp.number_atoms_nh
  _chem_comp.desc_level
   HRZ HRZ '1~{H}-pyridin-2-one      ' ligand 12 7 .

