data_4pdv_qFit
_cell.length_a                    68.065
_cell.length_b                    68.065
_cell.length_c                    89.614
_cell.angle_alpha                 90.000
_cell.angle_beta                  90.000
_cell.angle_gamma                 90.000
_cell.volume                      415167.725
_space_group.crystal_system       tetragonal
_space_group.IT_number            79
_space_group.name_H-M_alt         'I 4'
_space_group.name_Hall            ' I 4'
_symmetry.space_group_name_H-M    'I 4'
_symmetry.space_group_name_Hall   ' I 4'
_symmetry.Int_Tables_number       79
_reflns.B_iso_Wilson_estimate     31.26
_refine.pdbx_refine_id            'X-RAY DIFFRACTION'
_refine.ls_d_res_low              32.79
_refine.ls_d_res_high             1.82
_refine.pdbx_ls_sigma_F           1.37
_refine.ls_percent_reflns_obs     99.52
_refine.ls_number_reflns_obs      18203
_refine.ls_number_reflns_R_work   16316
_refine.ls_number_reflns_R_free   1887
_refine.ls_R_factor_obs           0.2108
_refine.ls_R_factor_R_work        0.2056
_refine.ls_R_factor_R_free        0.2545
_refine.ls_percent_reflns_R_free  10.37
_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             0.2259
_refine.pdbx_overall_phase_error  28.3111
_refine.pdbx_stereochemistry_target_values 'GeoStd + Monomer Library + CDL v1.2'
_refine.B_iso_mean                41.04
_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 -y,x,z
   3 y,-x,z
   4 -x,-y,z
   5 x+1/2,y+1/2,z+1/2
   6 -y+1/2,x+1/2,z+1/2
   7 y+1/2,-x+1/2,z+1/2
   8 -x+1/2,-y+1/2,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 1665 0.0130 ? ?
   'X-RAY DIFFRACTION' f_angle_d 2295 1.3093 ? ?
   'X-RAY DIFFRACTION' f_chiral_restr 284 0.0787 ? ?
   'X-RAY DIFFRACTION' f_plane_restr 280 0.0090 ? ?
   'X-RAY DIFFRACTION' f_dihedral_angle_d 581 14.4236 ? ?

loop_
  _refine_ls_shell.pdbx_refine_id
  _refine_ls_shell.d_res_high
  _refine_ls_shell.d_res_low
  _refine_ls_shell.number_reflns_R_work
  _refine_ls_shell.R_factor_R_work
  _refine_ls_shell.percent_reflns_obs
  _refine_ls_shell.R_factor_R_free
  _refine_ls_shell.number_reflns_R_free
   'X-RAY DIFFRACTION' 4.28 32.79 1221 0.1998 95.49 0.2605 154
   'X-RAY DIFFRACTION' 3.40 4.28 1258 0.1936 99.01 0.2507 145
   'X-RAY DIFFRACTION' 2.97 3.40 1248 0.2142 99.93 0.2176 154
   'X-RAY DIFFRACTION' 2.70 2.97 1269 0.2152 99.93 0.2198 145
   'X-RAY DIFFRACTION' 2.50 2.70 1261 0.1955 99.93 0.2672 143
   'X-RAY DIFFRACTION' 2.36 2.50 1246 0.2126 99.93 0.2813 148
   'X-RAY DIFFRACTION' 2.24 2.36 1246 0.1963 100.00 0.2889 150
   'X-RAY DIFFRACTION' 2.14 2.24 1280 0.2092 99.93 0.2356 136
   'X-RAY DIFFRACTION' 2.06 2.14 1232 0.2248 99.86 0.2659 154
   'X-RAY DIFFRACTION' 1.99 2.06 1284 0.2079 100.00 0.2867 139
   'X-RAY DIFFRACTION' 1.93 1.99 1252 0.2263 100.00 0.2815 136
   'X-RAY DIFFRACTION' 1.87 1.93 1256 0.2296 100.00 0.2927 148
   'X-RAY DIFFRACTION' 1.82 1.87 1263 0.2458 100.00 0.2860 135

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

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
   Ba . . 46.69444 9.00985 . . 2.07616 47.04031 . . 0.0 
;
2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD:
Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
 .
   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.
;
 .
   K . . 16.37977 2.54835 . . 4.54127 84.28225 . . 0.0 
;
2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD:
Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
 .
   N . . 4.01032 2.96436 . . 19.97189 1.75589 . . 0.0 
;
2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD:
Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
 .
   O . . 4.49882 3.47563 . . 15.80542 1.70748 . . 0.0 
;
2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD:
Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
 .

loop_
  _chem_comp.id
   ALA
   ARG
   ASN
   ASP
   BA
   GLN
   GLU
   GLY
   HIS
   HOH
   ILE
   K
   LEU
   LYS
   MPD
   PHE
   PRO
   SER
   THR
   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 . ASP A 21 ? 5.99111 -18.51658 41.65432 1.000 86.99225 N ? A ? 1 N 1
   ATOM 2 CA . ASP A 21 ? 6.01000 -19.96437 41.47199 1.000 91.72242 C ? A ? 1 CA 1
   ATOM 3 C . ASP A 21 ? 4.58959 -20.49487 41.40420 1.000 89.42086 C ? A ? 1 C 1
   ATOM 4 O . ASP A 21 ? 4.11177 -20.85312 40.33329 1.000 87.16435 O ? A ? 1 O 1
   ATOM 5 CB . ASP A 21 ? 6.78665 -20.65578 42.59999 1.000 99.77083 C ? A ? 1 CB 1
   ATOM 6 CG . ASP A 21 ? 6.98560 -22.14963 42.35437 1.000 98.77763 C ? A ? 1 CG 1
   ATOM 7 OD1 . ASP A 21 ? 5.98690 -22.90650 42.33948 1.000 97.38596 O ? A ? 1 OD1 1
   ATOM 8 OD2 . ASP A 21 ? 8.15118 -22.56622 42.17648 1.000 98.50538 O ? A ? 1 OD2 1
   ATOM 9 N . LYS A 22 ? 3.90951 -20.55932 42.54981 1.000 96.47564 N ? A ? 2 N 1
   ATOM 10 CA . LYS A 22 ? 2.52256 -21.00774 42.52920 1.000 96.72242 C ? A ? 2 CA 1
   ATOM 11 C . LYS A 22 ? 1.60436 -20.00774 41.83686 1.000 94.95526 C ? A ? 2 C 1
   ATOM 12 O . LYS A 22 ? 0.49289 -20.37657 41.43847 1.000 94.41364 O ? A ? 2 O 1
   ATOM 13 CB . LYS A 22 ? 2.03232 -21.29534 43.95295 1.000 98.89449 C ? A ? 2 CB 1
   ATOM 14 CG . LYS A 22 ? 1.91417 -20.07849 44.86682 1.000 97.90785 C ? A ? 2 CG 1
   ATOM 15 CD . LYS A 22 ? 1.34442 -20.47106 46.23110 1.000 87.87335 C ? A ? 2 CD 1
   ATOM 16 CE . LYS A 22 ? 2.32846 -21.30942 47.03558 1.000 81.94180 C ? A ? 2 CE 1
   ATOM 17 NZ . LYS A 22 ? 1.79467 -21.64319 48.39373 1.000 77.12331 N ? A ? 2 NZ 1
   ATOM 18 N . GLU A 23 ? 2.04917 -18.76386 41.67649 1.000 91.53617 N ? A ? 3 N 1
   ATOM 19 CA . GLU A 23 ? 1.33130 -17.75950 40.90522 1.000 86.25783 C ? A ? 3 CA 1
   ATOM 20 C . GLU A 23 ? 1.70750 -17.80016 39.43387 1.000 78.18690 C ? A ? 3 C 1
   ATOM 21 O . GLU A 23 ? 0.84744 -17.58801 38.56865 1.000 68.16973 O ? A ? 3 O 1
   ATOM 22 CB . GLU A 23 ? 1.63878 -16.37381 41.47055 1.000 84.98598 C ? A ? 3 CB 1
   ATOM 23 CG . GLU A 23 ? 0.63438 -15.30054 41.14379 1.000 85.21540 C ? A ? 3 CG 1
   ATOM 24 CD . GLU A 23 ? 0.93096 -14.02067 41.89299 1.000 83.22165 C ? A ? 3 CD 1
   ATOM 25 OE1 . GLU A 23 ? 2.12129 -13.77235 42.19949 1.000 83.09772 O ? A ? 3 OE1 1
   ATOM 26 OE2 . GLU A 23 ? -0.02499 -13.27432 42.18800 1.000 90.06892 O ? A ? 3 OE2 1
   ATOM 27 N . PHE A 24 ? 2.98078 -18.09280 39.15635 1.000 73.36089 N ? A ? 4 N 1
   ATOM 28 CA . PHE A 24 ? 3.50478 -18.05480 37.79936 1.000 67.93504 C ? A ? 4 CA 1
   ATOM 29 C . PHE A 24 ? 2.96658 -19.19860 36.95958 1.000 63.76565 C ? A ? 4 C 1
   ATOM 30 O . PHE A 24 ? 2.77507 -19.04633 35.74646 1.000 55.60774 O ? A ? 4 O 1
   ATOM 31 CB . PHE A 24 ? 5.03275 -18.06828 37.84538 1.000 66.26815 C ? A ? 4 CB 1
   ATOM 32 CG . PHE A 24 ? 5.70253 -18.16903 36.48729 1.000 66.36934 C ? A ? 4 CG 1
   ATOM 33 CD1 . PHE A 24 ? 6.14654 -19.37884 36.01501 1.000 64.45304 C ? A ? 4 CD1 1
   ATOM 34 CD2 . PHE A 24 ? 5.90983 -17.04697 35.69190 1.000 66.75480 C ? A ? 4 CD2 1
   ATOM 35 CE1 . PHE A 24 ? 6.76598 -19.46425 34.79307 1.000 61.77372 C ? A ? 4 CE1 1
   ATOM 36 CE2 . PHE A 24 ? 6.53953 -17.15225 34.45827 1.000 56.66883 C ? A ? 4 CE2 1
   ATOM 37 CZ . PHE A 24 ? 6.96389 -18.34743 34.03101 1.000 60.72427 C ? A ? 4 CZ 1
   ATOM 38 N . GLN A 25 ? 2.70652 -20.34480 37.58467 1.000 60.12807 N ? A ? 5 N 1
   ATOM 39 CA . GLN A 25 ? 2.22375 -21.49006 36.82667 1.000 67.14748 C ? A ? 5 CA 1
   ATOM 40 C . GLN A 25 ? 0.82900 -21.24706 36.26365 1.000 59.90912 C ? A ? 5 C 1
   ATOM 41 O . GLN A 25 ? 0.55917 -21.60353 35.11153 1.000 53.00153 O ? A ? 5 O 1
   ATOM 42 CB . GLN A 25 ? 2.24981 -22.74771 37.69198 1.000 71.47242 C ? A ? 5 CB 1
   ATOM 43 CG . GLN A 25 ? 1.65205 -22.56563 39.07526 1.000 81.94701 C ? A ? 5 CG 1
   ATOM 44 CD . GLN A 25 ? 2.22405 -23.55042 40.07805 1.000 90.00559 C ? A ? 5 CD 1
   ATOM 45 OE1 . GLN A 25 ? 3.30787 -24.10158 39.87461 1.000 93.67176 O ? A ? 5 OE1 1
   ATOM 46 NE2 . GLN A 25 ? 1.49883 -23.77670 41.16670 1.000 98.08746 N ? A ? 5 NE2 1
   ATOM 47 N . VAL A 26 ? -0.07589 -20.64409 37.04330 1.000 54.16940 N ? A ? 6 N 1
   ATOM 48 CA . VAL A 26 ? -1.44056 -20.51812 36.53585 1.000 57.60174 C ? A ? 6 CA 1
   ATOM 49 C . VAL A 26 ? -1.51668 -19.46495 35.43762 1.000 52.07587 C ? A ? 6 C 1
   ATOM 50 O . VAL A 26 ? -2.23221 -19.64371 34.45419 1.000 45.67826 O ? A ? 6 O 1
   ATOM 51 CB . VAL A 26 ? -2.44558 -20.22029 37.65961 1.000 52.37456 C ? A ? 6 CB 1
   ATOM 52 CG1 . VAL A 26 ? -2.15256 -18.88887 38.32376 1.000 67.60586 C ? A ? 6 CG1 1
   ATOM 53 CG2 . VAL A 26 ? -3.85720 -20.23593 37.09900 1.000 49.36798 C ? A ? 6 CG2 1
   ATOM 54 N . LEU A 27 ? -0.82249 -18.33987 35.59287 1.000 51.78298 N ? A ? 7 N 1
   ATOM 55 CA . LEU A 27 ? -0.93082 -17.31511 34.55481 1.000 46.32850 C ? A ? 7 CA 1
   ATOM 56 C . LEU A 27 ? -0.23385 -17.76278 33.27971 1.000 47.92304 C ? A ? 7 C 1
   ATOM 57 O . LEU A 27 ? -0.62525 -17.36044 32.17549 1.000 39.06315 O ? A ? 7 O 1
   ATOM 58 CB . LEU A 27 ? -0.36036 -15.98683 35.05333 1.000 48.49987 C ? A ? 7 CB 1
   ATOM 59 CG . LEU A 27 ? -1.11666 -15.25981 36.18203 1.000 56.31279 C ? A ? 7 CG 1
   ATOM 60 CD1 . LEU A 27 ? -0.35195 -14.03293 36.69354 1.000 52.10589 C ? A ? 7 CD1 1
   ATOM 61 CD2 . LEU A 27 ? -2.50857 -14.84870 35.74266 1.000 52.00926 C ? A ? 7 CD2 1
   ATOM 62 N . PHE A 28 ? 0.79893 -18.59097 33.40628 1.000 44.28503 N ? A ? 8 N 1
   ATOM 63 CA . PHE A 28 ? 1.35608 -19.23097 32.22131 1.000 53.06554 C ? A ? 8 CA 1
   ATOM 64 C . PHE A 28 ? 0.28810 -20.02907 31.49305 1.000 58.18133 C ? A ? 8 C 1
   ATOM 65 O . PHE A 28 ? 0.13252 -19.90685 30.26926 1.000 50.57009 O ? A ? 8 O 1
   ATOM 66 CB . PHE A 28 ? 2.52504 -20.12701 32.60668 1.000 56.61905 C ? A ? 8 CB 1
   ATOM 67 CG . PHE A 28 ? 3.24277 -20.72446 31.43336 1.000 64.89106 C ? A ? 8 CG 1
   ATOM 68 CD1 . PHE A 28 ? 3.53308 -19.95323 30.31929 1.000 60.52039 C ? A ? 8 CD1 1
   ATOM 69 CD2 . PHE A 28 ? 3.64860 -22.05120 31.45062 1.000 68.91925 C ? A ? 8 CD2 1
   ATOM 70 CE1 . PHE A 28 ? 4.19607 -20.49231 29.24104 1.000 69.19018 C ? A ? 8 CE1 1
   ATOM 71 CE2 . PHE A 28 ? 4.32458 -22.59233 30.37705 1.000 72.39871 C ? A ? 8 CE2 1
   ATOM 72 CZ . PHE A 28 ? 4.59333 -21.81189 29.26776 1.000 71.34756 C ? A ? 8 CZ 1
   ATOM 73 N . VAL A 29 ? -0.49384 -20.82084 32.23331 1.000 53.15542 N ? A ? 9 N 1
   ATOM 74 CA . VAL A 29 ? -1.43113 -21.71748 31.56380 1.000 49.15617 C ? A ? 9 CA 1
   ATOM 75 C . VAL A 29 ? -2.59599 -20.93982 30.98872 1.000 42.58835 C ? A ? 9 C 1
   ATOM 76 O . VAL A 29 ? -3.06294 -21.22662 29.88328 1.000 44.49046 O ? A ? 9 O 1
   ATOM 77 CB . VAL A 29 ? -1.91308 -22.82470 32.51483 1.000 45.31416 C ? A ? 9 CB 1
   ATOM 78 CG1 . VAL A 29 ? -3.01352 -23.63924 31.82545 1.000 46.78051 C ? A ? 9 CG1 1
   ATOM 79 CG2 . VAL A 29 ? -0.73534 -23.70578 32.91017 1.000 45.30919 C ? A ? 9 CG2 1
   ATOM 80 N . LEU A 30 ? -3.11152 -19.96399 31.73759 1.000 42.09180 N ? A ? 10 N 1
   ATOM 81 CA . LEU A 30 ? -4.22444 -19.18629 31.22213 1.000 38.48145 C ? A ? 10 CA 1
   ATOM 82 C . LEU A 30 ? -3.81167 -18.42184 29.95842 1.000 35.70469 C ? A ? 10 C 1
   ATOM 83 O . LEU A 30 ? -4.59145 -18.30405 29.00667 1.000 39.71681 O ? A ? 10 O 1
   ATOM 84 CB . LEU A 30 ? -4.70958 -18.22464 32.29233 1.000 37.87076 C ? A ? 10 CB 1
   ATOM 85 CG . LEU A 30 ? -5.48305 -18.80890 33.47803 1.000 42.97385 C ? A ? 10 CG 1
   ATOM 86 CD1 . LEU A 30 ? -5.34621 -17.85475 34.60486 1.000 40.50814 C ? A ? 10 CD1 1
   ATOM 87 CD2 . LEU A 30 ? -6.92186 -18.89902 33.08356 1.000 40.37774 C ? A ? 10 CD2 1
   ATOM 88 N . THR A 31 ? -2.57447 -17.92679 29.92896 1.000 45.46562 N ? A ? 11 N 1
   ATOM 89 CA . THR A 31 ? -2.12039 -17.20935 28.73972 1.000 42.56202 C ? A ? 11 CA 1
   ATOM 90 C . THR A 31 ? -2.00433 -18.15301 27.55395 1.000 39.27038 C ? A ? 11 C 1
   ATOM 91 O . THR A 31 ? -2.41876 -17.82403 26.44296 1.000 35.01973 O ? A ? 11 O 1
   ATOM 92 CB . THR A 31 ? -0.79407 -16.52302 29.03176 1.000 43.63740 C ? A ? 11 CB 1
   ATOM 93 OG1 . THR A 31 ? -1.00333 -15.49395 30.01359 1.000 45.36062 O ? A ? 11 OG1 1
   ATOM 94 CG2 . THR A 31 ? -0.20744 -15.89877 27.74571 1.000 39.86514 C ? A ? 11 CG2 1
   ATOM 95 N . ILE A 32 ? -1.45450 -19.34611 27.76222 1.000 39.77159 N ? A ? 12 N 1
   ATOM 96 CA . ILE A 32 ? -1.35152 -20.26870 26.63714 1.000 40.30160 C ? A ? 12 CA 1
   ATOM 97 C . ILE A 32 ? -2.73030 -20.59693 26.09983 1.000 32.54920 C ? A ? 12 C 1
   ATOM 98 O . ILE A 32 ? -2.94819 -20.64496 24.88478 1.000 35.65171 O ? A ? 12 O 1
   ATOM 99 CB . ILE A 32 ? -0.58574 -21.54225 27.04696 1.000 41.61665 C ? A ? 12 CB 1
   ATOM 100 CG1 . ILE A 32 ? 0.88310 -21.22455 27.34777 1.000 40.78902 C ? A ? 12 CG1 1
   ATOM 101 CG2 . ILE A 32 ? -0.78035 -22.64432 26.00502 1.000 40.08427 C ? A ? 12 CG2 1
   ATOM 102 CD1 . ILE A 32 ? 1.55484 -20.22203 26.47350 1.000 50.08512 C ? A ? 12 CD1 1
   ATOM 103 N . LEU A 33 ? -3.69953 -20.81432 26.98767 1.000 38.96301 N ? A ? 13 N 1
   ATOM 104 CA . LEU A 33 ? -5.03054 -21.16880 26.51694 1.000 35.61242 C ? A ? 13 CA 1
   ATOM 105 C . LEU A 33 ? -5.65127 -20.04155 25.69015 1.000 31.80585 C ? A ? 13 C 1
   ATOM 106 O . LEU A 33 ? -6.30906 -20.29268 24.66909 1.000 32.38491 O ? A ? 13 O 1
   ATOM 107 CB . LEU A 33 ? -5.93497 -21.50393 27.70761 1.000 43.13540 C ? A ? 13 CB 1
   ATOM 108 CG . LEU A 33 ? -5.74740 -22.91363 28.28546 1.000 40.91590 C ? A ? 13 CG 1
   ATOM 109 CD1 . LEU A 33 ? -6.70285 -23.09921 29.45194 1.000 55.94160 C ? A ? 13 CD1 1
   ATOM 110 CD2 . LEU A 33 ? -5.98958 -23.98840 27.21270 1.000 42.29512 C ? A ? 13 CD2 1
   ATOM 111 N A THR A 34 ? -5.47546 -18.78867 26.11709 0.113 32.19769 N ? A ? 14 N 1
   ATOM 112 CA A THR A 34 ? -6.04452 -17.70826 25.32177 0.113 31.94681 C ? A ? 14 CA 1
   ATOM 113 C A THR A 34 ? -5.29475 -17.55050 24.00385 0.113 26.01581 C ? A ? 14 C 1
   ATOM 114 O A THR A 34 ? -5.91775 -17.25749 22.97829 0.113 29.49095 O ? A ? 14 O 1
   ATOM 115 CB A THR A 34 ? -6.07714 -16.39256 26.11828 0.113 32.32724 C ? A ? 14 CB 1
   ATOM 116 OG1 A THR A 34 ? -6.88523 -15.42669 25.42636 0.113 30.19463 O ? A ? 14 OG1 1
   ATOM 117 CG2 A THR A 34 ? -4.69396 -15.81506 26.32018 0.113 31.78666 C ? A ? 14 CG2 1
   ATOM 118 N B THR A 34 ? -5.46460 -18.79749 26.13254 0.887 32.18315 N ? A ? 14 N 1
   ATOM 119 CA B THR A 34 ? -5.96006 -17.65766 25.38682 0.887 32.09571 C ? A ? 14 CA 1
   ATOM 120 C B THR A 34 ? -5.30522 -17.60661 24.01845 0.887 25.45714 C ? A ? 14 C 1
   ATOM 121 O B THR A 34 ? -5.96760 -17.36291 22.99924 0.887 29.58990 O ? A ? 14 O 1
   ATOM 122 CB B THR A 34 ? -5.66521 -16.37864 26.18626 0.887 30.93083 C ? A ? 14 CB 1
   ATOM 123 OG1 B THR A 34 ? -6.34059 -16.45766 27.44897 0.887 37.83025 O ? A ? 14 OG1 1
   ATOM 124 CG2 B THR A 34 ? -6.20219 -15.13829 25.44916 0.887 29.21719 C ? A ? 14 CG2 1
   ATOM 125 N . LEU A 35 ? -3.97610 -17.79112 23.99380 1.000 30.87063 N ? A ? 15 N 1
   ATOM 126 CA . LEU A 35 ? -3.23258 -17.73359 22.73016 1.000 25.15670 C ? A ? 15 CA 1
   ATOM 127 C . LEU A 35 ? -3.61724 -18.87930 21.81523 1.000 32.20650 C ? A ? 15 C 1
   ATOM 128 O . LEU A 35 ? -3.73804 -18.69109 20.60838 1.000 29.82612 O ? A ? 15 O 1
   ATOM 129 CB . LEU A 35 ? -1.71141 -17.68221 22.97541 1.000 31.35468 C ? A ? 15 CB 1
   ATOM 130 CG . LEU A 35 ? -1.24673 -16.42562 23.75642 1.000 28.39002 C ? A ? 15 CG 1
   ATOM 131 CD1 . LEU A 35 ? 0.28377 -16.35181 24.12966 1.000 29.89830 C ? A ? 15 CD1 1
   ATOM 132 CD2 . LEU A 35 ? -1.61976 -15.24065 22.87270 1.000 30.55843 C ? A ? 15 CD2 1
   ATOM 133 N . ILE A 36 ? -3.87599 -20.05939 22.36554 1.000 31.21775 N ? A ? 16 N 1
   ATOM 134 CA . ILE A 36 ? -4.40522 -21.14720 21.55172 1.000 29.82020 C ? A ? 16 CA 1
   ATOM 135 C . ILE A 36 ? -5.78823 -20.80756 20.96904 1.000 26.46980 C ? A ? 16 C 1
   ATOM 136 O . ILE A 36 ? -6.08456 -21.11904 19.81274 1.000 27.53721 O ? A ? 16 O 1
   ATOM 137 CB . ILE A 36 ? -4.43004 -22.43074 22.40010 1.000 32.75318 C ? A ? 16 CB 1
   ATOM 138 CG1 . ILE A 36 ? -2.98911 -22.87390 22.72104 1.000 35.04578 C ? A ? 16 CG1 1
   ATOM 139 CG2 . ILE A 36 ? -5.24712 -23.46266 21.68606 1.000 34.25256 C ? A ? 16 CG2 1
   ATOM 140 CD1 . ILE A 36 ? -2.93549 -24.20876 23.50426 1.000 35.01013 C ? A ? 16 CD1 1
   ATOM 141 N B SER A 37 ? -6.65185 -20.18357 21.77197 0.235 28.99382 N ? A ? 17 N 1
   ATOM 142 CA B SER A 37 ? -7.94944 -19.75992 21.26301 0.235 28.01450 C ? A ? 17 CA 1
   ATOM 143 C B SER A 37 ? -7.80416 -18.70474 20.17872 0.235 27.85426 C ? A ? 17 C 1
   ATOM 144 O B SER A 37 ? -8.65243 -18.61116 19.28652 0.235 26.81632 O ? A ? 17 O 1
   ATOM 145 CB B SER A 37 ? -8.81459 -19.22795 22.40593 0.235 32.31788 C ? A ? 17 CB 1
   ATOM 146 OG B SER A 37 ? -9.24936 -20.29502 23.21768 0.235 28.04599 O ? A ? 17 OG 1
   ATOM 147 N C SER A 37 ? -6.65454 -20.14760 21.73784 0.765 29.00010 N ? A ? 17 N 1
   ATOM 148 CA C SER A 37 ? -7.96264 -19.78840 21.19679 0.765 27.95751 C ? A ? 17 CA 1
   ATOM 149 C C SER A 37 ? -7.83907 -18.80937 20.02489 0.765 28.04492 C ? A ? 17 C 1
   ATOM 150 O C SER A 37 ? -8.43906 -19.00923 18.95699 0.765 25.55317 O ? A ? 17 O 1
   ATOM 151 CB C SER A 37 ? -8.85966 -19.19142 22.29650 0.765 32.67733 C ? A ? 17 CB 1
   ATOM 152 OG C SER A 37 ? -10.08836 -18.81637 21.68907 0.765 38.99323 O ? A ? 17 OG 1
   ATOM 153 N B GLY A 38 ? -6.74438 -17.91048 20.23554 0.235 25.93197 N ? A ? 18 N 1
   ATOM 154 CA B GLY A 38 ? -6.48934 -16.96644 19.16922 0.235 26.10944 C ? A ? 18 CA 1
   ATOM 155 C B GLY A 38 ? -5.96252 -17.66068 17.93520 0.235 24.21895 C ? A ? 18 C 1
   ATOM 156 O B GLY A 38 ? -6.36313 -17.32609 16.81838 0.235 28.41773 O ? A ? 18 O 1
   ATOM 157 N C GLY A 38 ? -7.04592 -17.75965 20.19255 0.765 26.06651 N ? A ? 18 N 1
   ATOM 158 CA C GLY A 38 ? -6.85641 -16.84200 19.07572 0.765 25.01638 C ? A ? 18 CA 1
   ATOM 159 C C GLY A 38 ? -6.23970 -17.54089 17.88563 0.765 22.77403 C ? A ? 18 C 1
   ATOM 160 O C GLY A 38 ? -6.63713 -17.29630 16.74726 0.765 29.95778 O ? A ? 18 O 1
   ATOM 161 N B THR A 39 ? -5.06614 -18.63649 18.11197 0.235 25.46527 N ? A ? 19 N 1
   ATOM 162 CA B THR A 39 ? -4.46161 -19.25246 16.93644 0.235 24.88180 C ? A ? 19 CA 1
   ATOM 163 C B THR A 39 ? -5.44151 -20.15650 16.20138 0.235 25.96017 C ? A ? 19 C 1
   ATOM 164 O B THR A 39 ? -5.26263 -20.38163 15.00124 0.235 28.01903 O ? A ? 19 O 1
   ATOM 165 CB B THR A 39 ? -3.18297 -20.01747 17.31477 0.235 26.55720 C ? A ? 19 CB 1
   ATOM 166 OG1 B THR A 39 ? -2.44696 -20.36885 16.12787 0.235 26.37423 O ? A ? 19 OG1 1
   ATOM 167 CG2 B THR A 39 ? -3.50783 -21.28073 18.07452 0.235 26.96621 C ? A ? 19 CG2 1
   ATOM 168 N C THR A 39 ? -5.27117 -18.43917 18.12988 0.765 25.22586 N ? A ? 19 N 1
   ATOM 169 CA C THR A 39 ? -4.62864 -19.12344 17.00784 0.765 24.75382 C ? A ? 19 CA 1
   ATOM 170 C C THR A 39 ? -5.66532 -19.86167 16.19466 0.765 25.25391 C ? A ? 19 C 1
   ATOM 171 O C THR A 39 ? -5.75307 -19.71895 14.97107 0.765 24.87214 O ? A ? 19 O 1
   ATOM 172 CB C THR A 39 ? -3.56343 -20.10548 17.49517 0.765 26.31354 C ? A ? 19 CB 1
   ATOM 173 OG1 C THR A 39 ? -2.52673 -19.41291 18.19666 0.765 25.54978 O ? A ? 19 OG1 1
   ATOM 174 CG2 C THR A 39 ? -2.95747 -20.92231 16.27685 0.765 26.72795 C ? A ? 19 CG2 1
   ATOM 175 N . ILE A 40 ? -6.48718 -20.65426 16.87513 1.000 27.00325 N ? A ? 20 N 1
   ATOM 176 CA . ILE A 40 ? -7.49933 -21.43160 16.17439 1.000 24.74334 C ? A ? 20 CA 1
   ATOM 177 C . ILE A 40 ? -8.48510 -20.51406 15.48152 1.000 27.41651 C ? A ? 20 C 1
   ATOM 178 O . ILE A 40 ? -8.83649 -20.73190 14.33911 1.000 26.00222 O ? A ? 20 O 1
   ATOM 179 CB . ILE A 40 ? -8.18139 -22.39490 17.15871 1.000 28.32803 C ? A ? 20 CB 1
   ATOM 180 CG1 . ILE A 40 ? -7.12042 -23.36759 17.69353 1.000 34.08379 C ? A ? 20 CG1 1
   ATOM 181 CG2 . ILE A 40 ? -9.41632 -23.01480 16.49971 1.000 32.57036 C ? A ? 20 CG2 1
   ATOM 182 CD1 . ILE A 40 ? -7.56945 -24.18197 18.93935 1.000 32.31785 C ? A ? 20 CD1 1
   ATOM 183 N . PHE A 41 ? -8.89692 -19.42811 16.14674 1.000 28.36252 N ? A ? 21 N 1
   ATOM 184 CA . PHE A 41 ? -9.91206 -18.55871 15.56313 1.000 27.95191 C ? A ? 21 CA 1
   ATOM 185 C . PHE A 41 ? -9.41309 -17.86770 14.31494 1.000 25.67091 C ? A ? 21 C 1
   ATOM 186 O . PHE A 41 ? -10.06913 -17.91964 13.26823 1.000 26.00884 O ? A ? 21 O 1
   ATOM 187 CB . PHE A 41 ? -10.38609 -17.50114 16.57147 1.000 26.09596 C ? A ? 21 CB 1
   ATOM 188 CG . PHE A 41 ? -11.36953 -16.54789 15.95722 1.000 27.85600 C ? A ? 21 CG 1
   ATOM 189 CD1 . PHE A 41 ? -12.71557 -16.88880 15.86449 1.000 28.53216 C ? A ? 21 CD1 1
   ATOM 190 CD2 . PHE A 41 ? -10.94572 -15.38368 15.33788 1.000 28.50914 C ? A ? 21 CD2 1
   ATOM 191 CE1 . PHE A 41 ? -13.62500 -16.04784 15.24972 1.000 22.75829 C ? A ? 21 CE1 1
   ATOM 192 CE2 . PHE A 41 ? -11.83655 -14.55239 14.70995 1.000 27.47494 C ? A ? 21 CE2 1
   ATOM 193 CZ . PHE A 41 ? -13.19386 -14.88399 14.67752 1.000 27.16435 C ? A ? 21 CZ 1
   ATOM 194 N . TYR A 42 ? -8.28045 -17.14322 14.40861 1.000 24.45357 N ? A ? 22 N 1
   ATOM 195 CA . TYR A 42 ? -7.83564 -16.41321 13.22996 1.000 23.55468 C ? A ? 22 CA 1
   ATOM 196 C . TYR A 42 ? -7.33706 -17.33032 12.12794 1.000 24.51867 C ? A ? 22 C 1
   ATOM 197 O . TYR A 42 ? -7.45982 -16.98007 10.96246 1.000 27.21766 O ? A ? 22 O 1
   ATOM 198 CB . TYR A 42 ? -6.73889 -15.43256 13.63106 1.000 26.08445 C ? A ? 22 CB 1
   ATOM 199 CG . TYR A 42 ? -7.24452 -14.40876 14.63763 1.000 23.38887 C ? A ? 22 CG 1
   ATOM 200 CD1 . TYR A 42 ? -8.13975 -13.46131 14.24769 1.000 26.60729 C ? A ? 22 CD1 1
   ATOM 201 CD2 . TYR A 42 ? -6.78678 -14.38996 15.94856 1.000 20.99605 C ? A ? 22 CD2 1
   ATOM 202 CE1 . TYR A 42 ? -8.63211 -12.48809 15.17590 1.000 20.80565 C ? A ? 22 CE1 1
   ATOM 203 CE2 . TYR A 42 ? -7.25508 -13.38569 16.86554 1.000 30.50701 C ? A ? 22 CE2 1
   ATOM 204 CZ . TYR A 42 ? -8.14934 -12.44574 16.42394 1.000 24.38886 C ? A ? 22 CZ 1
   ATOM 205 OH . TYR A 42 ? -8.67736 -11.43708 17.21177 1.000 26.53904 O ? A ? 22 OH 1
   ATOM 206 N . SER A 43 ? -6.82619 -18.52168 12.46211 1.000 27.37255 N ? A ? 23 N 1
   ATOM 207 CA . SER A 43 ? -6.50567 -19.45367 11.37519 1.000 24.85041 C ? A ? 23 CA 1
   ATOM 208 C . SER A 43 ? -7.77475 -19.88852 10.63284 1.000 32.77178 C ? A ? 23 C 1
   ATOM 209 O . SER A 43 ? -7.79514 -20.00551 9.40274 1.000 29.90932 O ? A ? 23 O 1
   ATOM 210 CB . SER A 43 ? -5.75655 -20.67600 11.91899 1.000 28.60052 C ? A ? 23 CB 1
   ATOM 211 OG . SER A 43 ? -5.38219 -21.49361 10.82202 1.000 52.28146 O ? A ? 23 OG 1
   ATOM 212 N . THR A 44 ? -8.85431 -20.13414 11.35894 1.000 26.75504 N ? A ? 24 N 1
   ATOM 213 CA . THR A 44 ? -10.06155 -20.63405 10.68993 1.000 31.34190 C ? A ? 24 CA 1
   ATOM 214 C . THR A 44 ? -10.82628 -19.54109 9.97340 1.000 30.39228 C ? A ? 24 C 1
   ATOM 215 O . THR A 44 ? -11.11087 -19.62282 8.77369 1.000 36.87211 O ? A ? 24 O 1
   ATOM 216 CB . THR A 44 ? -10.95216 -21.27457 11.75223 1.000 31.58753 C ? A ? 24 CB 1
   ATOM 217 OG1 . THR A 44 ? -10.24497 -22.36589 12.31096 1.000 33.82266 O ? A ? 24 OG1 1
   ATOM 218 CG2 . THR A 44 ? -12.28385 -21.71883 11.14403 1.000 42.24952 C ? A ? 24 CG2 1
   ATOM 219 N . VAL A 45 ? -11.20768 -18.50705 10.72237 1.000 28.76230 N ? A ? 25 N 1
   ATOM 220 CA . VAL A 45 ? -12.12306 -17.50233 10.22303 1.000 24.10772 C ? A ? 25 CA 1
   ATOM 221 C . VAL A 45 ? -11.42505 -16.48850 9.33508 1.000 31.32060 C ? A ? 25 C 1
   ATOM 222 O . VAL A 45 ? -12.01203 -16.00970 8.35777 1.000 28.24539 O ? A ? 25 O 1
   ATOM 223 CB . VAL A 45 ? -12.82419 -16.85329 11.42580 1.000 32.03457 C ? A ? 25 CB 1
   ATOM 224 CG1 . VAL A 45 ? -13.58670 -15.59937 11.01851 1.000 31.49658 C ? A ? 25 CG1 1
   ATOM 225 CG2 . VAL A 45 ? -13.72387 -17.87911 12.08515 1.000 30.39905 C ? A ? 25 CG2 1
   ATOM 226 N . GLU A 46 ? -10.18063 -16.10022 9.67045 1.000 26.78251 N ? A ? 26 N 1
   ATOM 227 CA . GLU A 46 ? -9.45532 -15.09607 8.88411 1.000 30.00358 C ? A ? 26 CA 1
   ATOM 228 C . GLU A 46 ? -8.48587 -15.72680 7.89399 1.000 32.44690 C ? A ? 26 C 1
   ATOM 229 O . GLU A 46 ? -7.87100 -15.02278 7.08255 1.000 30.77361 O ? A ? 26 O 1
   ATOM 230 CB . GLU A 46 ? -8.70806 -14.14438 9.83919 1.000 28.02948 C ? A ? 26 CB 1
   ATOM 231 CG . GLU A 46 ? -9.66718 -13.17098 10.59181 1.000 28.00779 C ? A ? 26 CG 1
   ATOM 232 CD . GLU A 46 ? -10.36292 -12.15497 9.67863 1.000 28.88822 C ? A ? 26 CD 1
   ATOM 233 OE1 . GLU A 46 ? -9.83335 -11.74969 8.61725 1.000 26.84266 O ? A ? 26 OE1 1
   ATOM 234 OE2 . GLU A 46 ? -11.45082 -11.68899 10.04290 1.000 25.39017 O ? A ? 26 OE2 1
   ATOM 235 N . GLY A 47 ? -8.35255 -17.04322 7.94768 1.000 26.96600 N ? A ? 27 N 1
   ATOM 236 CA . GLY A 47 ? -7.54846 -17.74561 6.97000 1.000 38.67168 C ? A ? 27 CA 1
   ATOM 237 C . GLY A 47 ? -6.06603 -17.56942 7.15868 1.000 41.65699 C ? A ? 27 C 1
   ATOM 238 O . GLY A 47 ? -5.31691 -17.72855 6.18554 1.000 32.48333 O ? A ? 27 O 1
   ATOM 239 N . LEU A 48 ? -5.60514 -17.19870 8.36898 1.000 29.68106 N ? A ? 28 N 1
   ATOM 240 CA . LEU A 48 ? -4.16345 -17.06725 8.55141 1.000 20.67316 C ? A ? 28 CA 1
   ATOM 241 C . LEU A 48 ? -3.52212 -18.46101 8.71604 1.000 25.66954 C ? A ? 28 C 1
   ATOM 242 O . LEU A 48 ? -4.13412 -19.39939 9.24540 1.000 27.99060 O ? A ? 28 O 1
   ATOM 243 CB . LEU A 48 ? -3.83706 -16.22947 9.81685 1.000 20.68369 C ? A ? 28 CB 1
   ATOM 244 CG . LEU A 48 ? -4.50866 -14.86249 9.90086 1.000 28.12666 C ? A ? 28 CG 1
   ATOM 245 CD1 . LEU A 48 ? -3.93695 -14.08602 11.08478 1.000 21.44181 C ? A ? 28 CD1 1
   ATOM 246 CD2 . LEU A 48 ? -4.25409 -14.11683 8.64318 1.000 32.05489 C ? A ? 28 CD2 1
   ATOM 247 N . ARG A 49 ? -2.24990 -18.56451 8.34481 1.000 27.32770 N ? A ? 29 N 1
   ATOM 248 CA . ARG A 49 ? -1.46395 -19.71070 8.76393 1.000 29.79393 C ? A ? 29 CA 1
   ATOM 249 C . ARG A 49 ? -1.40600 -19.75813 10.28911 1.000 32.02887 C ? A ? 29 C 1
   ATOM 250 O . ARG A 49 ? -1.38689 -18.71792 10.95773 1.000 28.37758 O ? A ? 29 O 1
   ATOM 251 CB . ARG A 49 ? -0.03719 -19.62280 8.19455 1.000 26.22949 C ? A ? 29 CB 1
   ATOM 252 CG . ARG A 49 ? 0.08344 -19.71570 6.65792 1.000 26.14753 C ? A ? 29 CG 1
   ATOM 253 CD . ARG A 49 ? 1.56929 -19.86117 6.32651 1.000 29.20046 C ? A ? 29 CD 1
   ATOM 254 NE . ARG A 49 ? 2.27707 -18.70908 6.86966 1.000 33.85186 N ? A ? 29 NE 1
   ATOM 255 CZ . ARG A 49 ? 3.51019 -18.70399 7.35518 1.000 32.58870 C ? A ? 29 CZ 1
   ATOM 256 NH1 . ARG A 49 ? 4.28130 -19.79585 7.34948 1.000 29.16718 N ? A ? 29 NH1 1
   ATOM 257 NH2 . ARG A 49 ? 3.97206 -17.58855 7.90630 1.000 30.56264 N ? A ? 29 NH2 1
   ATOM 258 N A PRO A 50 ? -1.38842 -20.95273 10.87529 0.464 29.53513 N ? A ? 30 N 1
   ATOM 259 CA A PRO A 50 ? -1.36337 -21.03290 12.33929 0.464 28.74254 C ? A ? 30 CA 1
   ATOM 260 C A PRO A 50 ? -0.23700 -20.22164 12.98393 0.464 30.71349 C ? A ? 30 C 1
   ATOM 261 O A PRO A 50 ? -0.46438 -19.58754 14.02420 0.464 26.87218 O ? A ? 30 O 1
   ATOM 262 CB A PRO A 50 ? -1.22682 -22.53948 12.59032 0.464 33.69581 C ? A ? 30 CB 1
   ATOM 263 CG A PRO A 50 ? -1.92473 -23.14388 11.41737 0.464 30.66920 C ? A ? 30 CG 1
   ATOM 264 CD A PRO A 50 ? -1.57245 -22.27875 10.24753 0.464 30.84101 C ? A ? 30 CD 1
   ATOM 265 N B PRO A 50 ? -1.39064 -20.95146 10.87633 0.536 29.53406 N ? A ? 30 N 1
   ATOM 266 CA B PRO A 50 ? -1.36756 -21.02732 12.33983 0.536 28.75163 C ? A ? 30 CA 1
   ATOM 267 C B PRO A 50 ? -0.23852 -20.21576 12.98235 0.536 30.68491 C ? A ? 30 C 1
   ATOM 268 O B PRO A 50 ? -0.46675 -19.57305 14.01755 0.536 26.86300 O ? A ? 30 O 1
   ATOM 269 CB B PRO A 50 ? -1.23827 -22.53382 12.59543 0.536 33.71372 C ? A ? 30 CB 1
   ATOM 270 CG B PRO A 50 ? -1.94394 -23.13553 11.42526 0.536 30.66011 C ? A ? 30 CG 1
   ATOM 271 CD B PRO A 50 ? -1.58312 -22.27863 10.25222 0.536 30.84704 C ? A ? 30 CD 1
   ATOM 272 N . ILE A 51 ? 0.95926 -20.17685 12.39027 1.000 26.08284 N ? A ? 31 N 1
   ATOM 273 CA . ILE A 51 ? 2.00005 -19.39822 13.04169 1.000 24.11895 C ? A ? 31 CA 1
   ATOM 274 C . ILE A 51 ? 1.64357 -17.91172 12.96694 1.000 23.96215 C ? A ? 31 C 1
   ATOM 275 O . ILE A 51 ? 1.89343 -17.15363 13.90499 1.000 21.91981 O ? A ? 31 O 1
   ATOM 276 CB . ILE A 51 ? 3.39071 -19.68576 12.44894 1.000 30.54872 C ? A ? 31 CB 1
   ATOM 277 CG1 . ILE A 51 ? 4.46217 -18.83349 13.13916 1.000 30.93671 C ? A ? 31 CG1 1
   ATOM 278 CG2 . ILE A 51 ? 3.43656 -19.28222 11.02989 1.000 27.53145 C ? A ? 31 CG2 1
   ATOM 279 CD1 . ILE A 51 ? 4.62778 -19.19095 14.62856 1.000 37.91708 C ? A ? 31 CD1 1
   ATOM 280 N . ASP A 52 ? 1.10860 -17.47578 11.83813 1.000 25.15863 N ? A ? 32 N 1
   ATOM 281 CA . ASP A 52 ? 0.70546 -16.07015 11.71620 1.000 22.21813 C ? A ? 32 CA 1
   ATOM 282 C . ASP A 52 ? -0.44938 -15.76688 12.68336 1.000 26.36296 C ? A ? 32 C 1
   ATOM 283 O . ASP A 52 ? -0.48765 -14.70479 13.30085 1.000 22.56298 O ? A ? 32 O 1
   ATOM 284 CB . ASP A 52 ? 0.32053 -15.78424 10.26292 1.000 21.45397 C ? A ? 32 CB 1
   ATOM 285 CG . ASP A 52 ? 1.53034 -15.73000 9.31800 1.000 25.86695 C ? A ? 32 CG 1
   ATOM 286 OD1 . ASP A 52 ? 2.63962 -15.43586 9.76647 1.000 29.64904 O ? A ? 32 OD1 1
   ATOM 287 OD2 . ASP A 52 ? 1.31186 -15.93183 8.10633 1.000 28.83296 O ? A ? 32 OD2 1
   ATOM 288 N . ALA A 53 ? -1.33571 -16.73387 12.92651 1.000 23.17432 N ? A ? 33 N 1
   ATOM 289 CA . ALA A 53 ? -2.44491 -16.49174 13.85580 1.000 28.12158 C ? A ? 33 CA 1
   ATOM 290 C . ALA A 53 ? -1.95889 -16.37512 15.27953 1.000 21.93300 C ? A ? 33 C 1
   ATOM 291 O . ALA A 53 ? -2.45493 -15.54512 16.05675 1.000 25.45245 O ? A ? 33 O 1
   ATOM 292 CB . ALA A 53 ? -3.49480 -17.61174 13.71122 1.000 29.47496 C ? A ? 33 CB 1
   ATOM 293 N . LEU A 54 ? -0.98858 -17.18740 15.66626 1.000 22.54263 N ? A ? 34 N 1
   ATOM 294 CA . LEU A 54 ? -0.39330 -17.06285 16.98027 1.000 21.41835 C ? A ? 34 CA 1
   ATOM 295 C . LEU A 54 ? 0.34132 -15.72850 17.10494 1.000 22.97893 C ? A ? 34 C 1
   ATOM 296 O . LEU A 54 ? 0.15296 -14.97811 18.06505 1.000 23.70771 O ? A ? 34 O 1
   ATOM 297 CB . LEU A 54 ? 0.59754 -18.21690 17.21010 1.000 24.25011 C ? A ? 34 CB 1
   ATOM 298 CG . LEU A 54 ? 1.44199 -17.99842 18.41639 1.000 21.69899 C ? A ? 34 CG 1
   ATOM 299 CD1 . LEU A 54 ? 0.51332 -18.02961 19.63275 1.000 25.03673 C ? A ? 34 CD1 1
   ATOM 300 CD2 . LEU A 54 ? 2.49132 -19.10967 18.60039 1.000 29.39944 C ? A ? 34 CD2 1
   ATOM 301 N . TYR A 55 ? 1.21277 -15.43653 16.14816 1.000 21.72003 N ? A ? 35 N 1
   ATOM 302 CA . TYR A 55 ? 1.90651 -14.14736 16.15772 1.000 25.43363 C ? A ? 35 CA 1
   ATOM 303 C . TYR A 55 ? 0.91282 -12.97333 16.24554 1.000 24.22210 C ? A ? 35 C 1
   ATOM 304 O . TYR A 55 ? 1.05634 -12.09259 17.08928 1.000 21.31269 O ? A ? 35 O 1
   ATOM 305 CB . TYR A 55 ? 2.79681 -14.10988 14.90860 1.000 22.68044 C ? A ? 35 CB 1
   ATOM 306 CG . TYR A 55 ? 3.28282 -12.73074 14.46574 1.000 22.63162 C ? A ? 35 CG 1
   ATOM 307 CD1 . TYR A 55 ? 4.34604 -12.11257 15.09924 1.000 22.32642 C ? A ? 35 CD1 1
   ATOM 308 CD2 . TYR A 55 ? 2.70034 -12.10693 13.38727 1.000 20.22183 C ? A ? 35 CD2 1
   ATOM 309 CE1 . TYR A 55 ? 4.79356 -10.85473 14.67355 1.000 21.63942 C ? A ? 35 CE1 1
   ATOM 310 CE2 . TYR A 55 ? 3.17041 -10.82972 12.93949 1.000 21.50071 C ? A ? 35 CE2 1
   ATOM 311 CZ . TYR A 55 ? 4.17968 -10.23676 13.59043 1.000 24.71606 C ? A ? 35 CZ 1
   ATOM 312 OH . TYR A 55 ? 4.63541 -9.01437 13.15357 1.000 22.12183 O ? A ? 35 OH 1
   ATOM 313 N . PHE A 56 ? -0.10715 -12.96381 15.39460 1.000 21.45887 N ? A ? 36 N 1
   ATOM 314 CA . PHE A 56 ? -1.11756 -11.90131 15.43940 1.000 23.81618 C ? A ? 36 CA 1
   ATOM 315 C . PHE A 56 ? -1.81401 -11.83129 16.80343 1.000 23.84288 C ? A ? 36 C 1
   ATOM 316 O . PHE A 56 ? -2.07278 -10.73889 17.34508 1.000 23.67461 O ? A ? 36 O 1
   ATOM 317 CB . PHE A 56 ? -2.14354 -12.12066 14.32191 1.000 23.10866 C ? A ? 36 CB 1
   ATOM 318 CG . PHE A 56 ? -3.29733 -11.12337 14.37366 1.000 24.57092 C ? A ? 36 CG 1
   ATOM 319 CD1 . PHE A 56 ? -3.07507 -9.78466 14.14990 1.000 24.28048 C ? A ? 36 CD1 1
   ATOM 320 CD2 . PHE A 56 ? -4.56982 -11.52022 14.74657 1.000 27.69666 C ? A ? 36 CD2 1
   ATOM 321 CE1 . PHE A 56 ? -4.14176 -8.82116 14.21549 1.000 22.11495 C ? A ? 36 CE1 1
   ATOM 322 CE2 . PHE A 56 ? -5.63566 -10.58965 14.84068 1.000 26.03989 C ? A ? 36 CE2 1
   ATOM 323 CZ . PHE A 56 ? -5.42278 -9.24875 14.56497 1.000 27.61978 C ? A ? 36 CZ 1
   ATOM 324 N . SER A 57 ? -2.16317 -12.98350 17.37095 1.000 21.68445 N ? A ? 37 N 1
   ATOM 325 CA . SER A 57 ? -2.81555 -12.95779 18.67181 1.000 18.12457 C ? A ? 37 CA 1
   ATOM 326 C . SER A 57 ? -1.91410 -12.30686 19.72252 1.000 23.53531 C ? A ? 37 C 1
   ATOM 327 O . SER A 57 ? -2.38964 -11.53656 20.54652 1.000 24.21682 O ? A ? 37 O 1
   ATOM 328 CB . SER A 57 ? -3.24795 -14.38342 19.11934 1.000 21.75626 C ? A ? 37 CB 1
   ATOM 329 OG . SER A 57 ? -4.18000 -14.93828 18.19449 1.000 24.02395 O ? A ? 37 OG 1
   ATOM 330 N . VAL A 58 ? -0.60651 -12.59235 19.71428 1.000 22.87768 N ? A ? 38 N 1
   ATOM 331 CA . VAL A 58 ? 0.26958 -11.99556 20.72023 1.000 17.84962 C ? A ? 38 CA 1
   ATOM 332 C . VAL A 58 ? 0.41645 -10.49251 20.46886 1.000 19.62444 C ? A ? 38 C 1
   ATOM 333 O . VAL A 58 ? 0.36030 -9.70694 21.41079 1.000 21.60638 O ? A ? 38 O 1
   ATOM 334 CB . VAL A 58 ? 1.65619 -12.66325 20.71584 1.000 21.12158 C ? A ? 38 CB 1
   ATOM 335 CG1 . VAL A 58 ? 2.68722 -11.83733 21.41574 1.000 20.57737 C ? A ? 38 CG1 1
   ATOM 336 CG2 . VAL A 58 ? 1.63008 -14.10920 21.20272 1.000 27.11954 C ? A ? 38 CG2 1
   ATOM 337 N . VAL A 59 ? 0.64040 -10.09819 19.20356 1.000 17.02473 N ? A ? 39 N 1
   ATOM 338 CA . VAL A 59 ? 0.81278 -8.68904 18.83052 1.000 17.74412 C ? A ? 39 CA 1
   ATOM 339 C . VAL A 59 ? -0.43886 -7.89876 19.20521 1.000 22.99014 C ? A ? 39 C 1
   ATOM 340 O . VAL A 59 ? -0.36602 -6.72149 19.58362 1.000 23.67955 O ? A ? 39 O 1
   ATOM 341 CB . VAL A 59 ? 1.07501 -8.59788 17.30391 1.000 16.94901 C ? A ? 39 CB 1
   ATOM 342 CG1 . VAL A 59 ? 0.99134 -7.15970 16.82502 1.000 17.95284 C ? A ? 39 CG1 1
   ATOM 343 CG2 . VAL A 59 ? 2.49345 -9.10560 16.97414 1.000 18.60490 C ? A ? 39 CG2 1
   ATOM 344 N . THR A 60 ? -1.59888 -8.53290 19.06625 1.000 21.72026 N ? A ? 40 N 1
   ATOM 345 CA . THR A 60 ? -2.86283 -7.91787 19.51514 1.000 20.94352 C ? A ? 40 CA 1
   ATOM 346 C . THR A 60 ? -2.93690 -7.77879 21.03672 1.000 21.09677 C ? A ? 40 C 1
   ATOM 347 O . THR A 60 ? -3.18769 -6.68046 21.55439 1.000 18.94672 O ? A ? 40 O 1
   ATOM 348 CB . THR A 60 ? -4.01517 -8.77431 18.97835 1.000 19.92653 C ? A ? 40 CB 1
   ATOM 349 OG1 . THR A 60 ? -4.00434 -8.65881 17.56597 1.000 21.34637 O ? A ? 40 OG1 1
   ATOM 350 CG2 . THR A 60 ? -5.38545 -8.36452 19.56588 1.000 22.62428 C ? A ? 40 CG2 1
   ATOM 351 N . LEU A 61 ? -2.80511 -8.89780 21.79184 1.000 22.51973 N ? A ? 41 N 1
   ATOM 352 CA . LEU A 61 ? -3.06119 -8.83466 23.23005 1.000 21.17461 C ? A ? 41 CA 1
   ATOM 353 C . LEU A 61 ? -1.99333 -8.05935 24.01179 1.000 25.76610 C ? A ? 41 C 1
   ATOM 354 O . LEU A 61 ? -2.26679 -7.61911 25.12388 1.000 25.71917 O ? A ? 41 O 1
   ATOM 355 CB . LEU A 61 ? -3.19175 -10.26223 23.80664 1.000 20.17604 C ? A ? 41 CB 1
   ATOM 356 CG . LEU A 61 ? -4.42292 -10.98165 23.25716 1.000 22.90939 C ? A ? 41 CG 1
   ATOM 357 CD1 . LEU A 61 ? -4.58361 -12.36376 23.97104 1.000 22.03300 C ? A ? 41 CD1 1
   ATOM 358 CD2 . LEU A 61 ? -5.72558 -10.16888 23.45200 1.000 29.09325 C ? A ? 41 CD2 1
   ATOM 359 N . THR A 62 ? -0.78015 -7.90767 23.48243 1.000 21.91080 N ? A ? 42 N 1
   ATOM 360 CA . THR A 62 ? 0.21494 -7.04628 24.09963 1.000 20.90493 C ? A ? 42 CA 1
   ATOM 361 C . THR A 62 ? 0.06364 -5.57694 23.68844 1.000 24.21531 C ? A ? 42 C 1
   ATOM 362 O . THR A 62 ? 0.83180 -4.74785 24.16994 1.000 22.19649 O ? A ? 42 O 1
   ATOM 363 CB . THR A 62 ? 1.62969 -7.52441 23.73344 1.000 22.87131 C ? A ? 42 CB 1
   ATOM 364 OG1 . THR A 62 ? 1.81259 -7.52866 22.29525 1.000 22.92496 O ? A ? 42 OG1 1
   ATOM 365 CG2 . THR A 62 ? 1.83787 -8.98095 24.29068 1.000 26.57539 C ? A ? 42 CG2 1
   ATOM 366 N . THR A 63 ? -0.87541 -5.26953 22.80039 1.000 20.45036 N ? A ? 43 N 1
   ATOM 367 CA . THR A 63 ? -1.25132 -3.94620 22.28551 1.000 22.87772 C ? A ? 43 CA 1
   ATOM 368 C . THR A 63 ? -0.21231 -3.41656 21.30246 1.000 22.85677 C ? A ? 43 C 1
   ATOM 369 O . THR A 63 ? -0.33623 -2.24823 20.80870 1.000 20.91101 O ? A ? 43 O 1
   ATOM 370 CB . THR A 63 ? -1.54784 -2.89297 23.36837 1.000 23.22878 C ? A ? 43 CB 1
   ATOM 371 OG1 . THR A 63 ? -0.36767 -2.40290 24.02329 1.000 20.78458 O ? A ? 43 OG1 1
   ATOM 372 CG2 . THR A 63 ? -2.50134 -3.45799 24.44308 1.000 21.50238 C ? A ? 43 CG2 1
   ATOM 373 N . VAL A 64 ? 0.75421 -4.24572 20.90009 1.000 21.64447 N ? A ? 44 N 1
   ATOM 374 CA . VAL A 64 ? 1.72480 -3.79186 19.89624 1.000 21.94971 C ? A ? 44 CA 1
   ATOM 375 C . VAL A 64 ? 1.00659 -3.38063 18.62367 1.000 20.29426 C ? A ? 44 C 1
   ATOM 376 O . VAL A 64 ? 1.17341 -2.25877 18.15715 1.000 20.59922 O ? A ? 44 O 1
   ATOM 377 CB . VAL A 64 ? 2.79422 -4.86264 19.59970 1.000 18.25715 C ? A ? 44 CB 1
   ATOM 378 CG1 . VAL A 64 ? 3.75904 -4.29234 18.48907 1.000 22.02742 C ? A ? 44 CG1 1
   ATOM 379 CG2 . VAL A 64 ? 3.67464 -5.06682 20.86105 1.000 21.30050 C ? A ? 44 CG2 1
   ATOM 380 N . GLY A 65 ? 0.18907 -4.28579 18.03955 1.000 18.03735 N ? A ? 45 N 1
   ATOM 381 CA . GLY A 65 ? -0.72005 -3.93307 16.95688 1.000 22.05915 C ? A ? 45 CA 1
   ATOM 382 C . GLY A 65 ? -0.06280 -3.42250 15.68505 1.000 20.74800 C ? A ? 45 C 1
   ATOM 383 O . GLY A 65 ? -0.52861 -2.41702 15.15130 1.000 20.13233 O ? A ? 45 O 1
   ATOM 384 N . TYR A 66 ? 0.98032 -4.08489 15.15697 1.000 22.29670 N ? A ? 46 N 1
   ATOM 385 CA . TYR A 66 ? 1.60812 -3.56485 13.91610 1.000 21.61047 C ? A ? 46 CA 1
   ATOM 386 C . TYR A 66 ? 0.60411 -3.32305 12.81616 1.000 25.09053 C ? A ? 46 C 1
   ATOM 387 O . TYR A 66 ? 0.73090 -2.36896 12.04057 1.000 20.01617 O ? A ? 46 O 1
   ATOM 388 CB . TYR A 66 ? 2.61465 -4.56093 13.34031 1.000 19.27796 C ? A ? 46 CB 1
   ATOM 389 CG . TYR A 66 ? 3.76801 -4.87969 14.24096 1.000 17.43923 C ? A ? 46 CG 1
   ATOM 390 CD1 . TYR A 66 ? 4.63042 -3.89826 14.72988 1.000 23.83423 C ? A ? 46 CD1 1
   ATOM 391 CD2 . TYR A 66 ? 4.02919 -6.19972 14.58248 1.000 25.51634 C ? A ? 46 CD2 1
   ATOM 392 CE1 . TYR A 66 ? 5.71405 -4.25104 15.62099 1.000 17.95496 C ? A ? 46 CE1 1
   ATOM 393 CE2 . TYR A 66 ? 5.06443 -6.52012 15.42444 1.000 23.50821 C ? A ? 46 CE2 1
   ATOM 394 CZ . TYR A 66 ? 5.93517 -5.56597 15.89075 1.000 18.00841 C ? A ? 46 CZ 1
   ATOM 395 OH . TYR A 66 ? 7.00321 -5.98941 16.73081 1.000 25.07588 O ? A ? 46 OH 1
   ATOM 396 N . GLY A 67 ? -0.35916 -4.22703 12.67000 1.000 19.60321 N ? A ? 47 N 1
   ATOM 397 CA . GLY A 67 ? -1.29335 -4.08632 11.56856 1.000 19.51421 C ? A ? 47 CA 1
   ATOM 398 C . GLY A 67 ? -0.86328 -4.77275 10.30789 1.000 28.52252 C ? A ? 47 C 1
   ATOM 399 O . GLY A 67 ? -1.51238 -4.60128 9.27095 1.000 24.25038 O ? A ? 47 O 1
   ATOM 400 N . ASP A 68 ? 0.19933 -5.56556 10.37006 1.000 23.65922 N ? A ? 48 N 1
   ATOM 401 CA . ASP A 68 ? 0.52258 -6.37803 9.20159 1.000 22.46281 C ? A ? 48 CA 1
   ATOM 402 C . ASP A 68 ? -0.52073 -7.47454 9.00411 1.000 24.54754 C ? A ? 48 C 1
   ATOM 403 O . ASP A 68 ? -0.71945 -7.94252 7.87459 1.000 28.86292 O ? A ? 48 O 1
   ATOM 404 CB . ASP A 68 ? 1.90071 -7.00039 9.32837 1.000 24.93004 C ? A ? 48 CB 1
   ATOM 405 CG . ASP A 68 ? 2.15570 -7.66782 10.68001 1.000 31.54852 C ? A ? 48 CG 1
   ATOM 406 OD1 . ASP A 68 ? 1.42210 -7.43976 11.66935 1.000 24.88182 O ? A ? 48 OD1 1
   ATOM 407 OD2 . ASP A 68 ? 3.19703 -8.35971 10.78701 1.000 27.59776 O ? A ? 48 OD2 1
   ATOM 408 N . PHE A 69 ? -1.13317 -7.91983 10.08377 1.000 24.07269 N ? A ? 49 N 1
   ATOM 409 CA . PHE A 69 ? -2.36916 -8.68142 10.04790 1.000 26.51793 C ? A ? 49 CA 1
   ATOM 410 C . PHE A 69 ? -3.42469 -7.91294 10.83433 1.000 26.52903 C ? A ? 49 C 1
   ATOM 411 O . PHE A 69 ? -3.13084 -7.31507 11.87834 1.000 24.17577 O ? A ? 49 O 1
   ATOM 412 CB . PHE A 69 ? -2.20908 -10.08502 10.66097 1.000 23.12287 C ? A ? 49 CB 1
   ATOM 413 CG . PHE A 69 ? -1.15741 -10.90310 9.96116 1.000 25.16744 C ? A ? 49 CG 1
   ATOM 414 CD1 . PHE A 69 ? 0.17012 -10.76519 10.32748 1.000 27.28014 C ? A ? 49 CD1 1
   ATOM 415 CD2 . PHE A 69 ? -1.48876 -11.77708 8.96557 1.000 28.08151 C ? A ? 49 CD2 1
   ATOM 416 CE1 . PHE A 69 ? 1.17986 -11.53026 9.66458 1.000 26.05941 C ? A ? 49 CE1 1
   ATOM 417 CE2 . PHE A 69 ? -0.47231 -12.49717 8.30605 1.000 26.87719 C ? A ? 49 CE2 1
   ATOM 418 CZ . PHE A 69 ? 0.81666 -12.36579 8.68572 1.000 23.93542 C ? A ? 49 CZ 1
   ATOM 419 N . SER A 70 ? -4.66767 -8.02675 10.36720 1.000 25.00262 N ? A ? 50 N 1
   ATOM 420 CA . SER A 70 ? -5.81795 -7.49644 11.08740 1.000 25.19337 C ? A ? 50 CA 1
   ATOM 421 C . SER A 70 ? -7.07646 -8.14808 10.50939 1.000 24.01694 C ? A ? 50 C 1
   ATOM 422 O . SER A 70 ? -7.06266 -8.58127 9.35250 1.000 23.99386 O ? A ? 50 O 1
   ATOM 423 CB . SER A 70 ? -5.87741 -5.96432 10.98962 1.000 24.09638 C ? A ? 50 CB 1
   ATOM 424 OG . SER A 70 ? -5.98239 -5.50788 9.64805 1.000 29.72608 O ? A ? 50 OG 1
   ATOM 425 N . PRO A 71 ? -8.13796 -8.28650 11.28953 1.000 23.55771 N ? A ? 51 N 1
   ATOM 426 CA . PRO A 71 ? -9.33197 -9.01572 10.78599 1.000 23.68942 C ? A ? 51 CA 1
   ATOM 427 C . PRO A 71 ? -9.99651 -8.25965 9.64463 1.000 27.20571 C ? A ? 51 C 1
   ATOM 428 O . PRO A 71 ? -10.13556 -7.04061 9.66028 1.000 25.96421 O ? A ? 51 O 1
   ATOM 429 CB . PRO A 71 ? -10.25949 -9.10150 12.02282 1.000 27.42804 C ? A ? 51 CB 1
   ATOM 430 CG . PRO A 71 ? -9.82672 -7.88905 12.88847 1.000 22.35688 C ? A ? 51 CG 1
   ATOM 431 CD . PRO A 71 ? -8.28557 -7.83676 12.68925 1.000 20.02321 C ? A ? 51 CD 1
   ATOM 432 N . GLN A 72 ? -10.41422 -9.00430 8.62671 1.000 21.24582 N ? A ? 52 N 1
   ATOM 433 CA . GLN A 72 ? -11.08025 -8.41707 7.49556 1.000 23.82731 C ? A ? 52 CA 1
   ATOM 434 C . GLN A 72 ? -12.57211 -8.75100 7.45823 1.000 22.98897 C ? A ? 52 C 1
   ATOM 435 O . GLN A 72 ? -13.30899 -8.08545 6.73637 1.000 26.22404 O ? A ? 52 O 1
   ATOM 436 CB . GLN A 72 ? -10.44249 -8.91626 6.20785 1.000 33.66726 C ? A ? 52 CB 1
   ATOM 437 CG . GLN A 72 ? -8.92774 -8.69674 6.13845 1.000 37.41734 C ? A ? 52 CG 1
   ATOM 438 CD . GLN A 72 ? -8.42055 -9.20635 4.80717 1.000 41.11822 C ? A ? 52 CD 1
   ATOM 439 OE1 . GLN A 72 ? -8.15887 -10.40333 4.65546 1.000 50.62573 O ? A ? 52 OE1 1
   ATOM 440 NE2 . GLN A 72 ? -8.34535 -8.32053 3.80990 1.000 40.97769 N ? A ? 52 NE2 1
   ATOM 441 N . THR A 73 ? -12.99424 -9.77378 8.16772 1.000 24.78287 N ? A ? 53 N 1
   ATOM 442 CA . THR A 73 ? -14.41678 -10.12332 8.26651 1.000 25.04728 C ? A ? 53 CA 1
   ATOM 443 C . THR A 73 ? -15.05595 -9.49269 9.50264 1.000 24.85506 C ? A ? 53 C 1
   ATOM 444 O . THR A 73 ? -14.40286 -9.18483 10.48405 1.000 24.45266 O ? A ? 53 O 1
   ATOM 445 CB . THR A 73 ? -14.60805 -11.63388 8.36750 1.000 22.99889 C ? A ? 53 CB 1
   ATOM 446 OG1 . THR A 73 ? -14.19712 -12.10382 9.64330 1.000 27.27158 O ? A ? 53 OG1 1
   ATOM 447 CG2 . THR A 73 ? -13.81655 -12.35914 7.27065 1.000 26.98362 C ? A ? 53 CG2 1
   ATOM 448 N . ASP A 74 ? -16.37495 -9.33390 9.45576 1.000 26.19246 N ? A ? 54 N 1
   ATOM 449 CA . ASP A 74 ? -17.07454 -8.81001 10.62870 1.000 23.57646 C ? A ? 54 CA 1
   ATOM 450 C . ASP A 74 ? -17.03671 -9.76728 11.80661 1.000 31.10916 C ? A ? 54 C 1
   ATOM 451 O . ASP A 74 ? -16.96094 -9.33808 12.96018 1.000 26.13557 O ? A ? 54 O 1
   ATOM 452 CB . ASP A 74 ? -18.52174 -8.46536 10.23351 1.000 26.94080 C ? A ? 54 CB 1
   ATOM 453 CG . ASP A 74 ? -18.60361 -7.23128 9.39725 1.000 30.39137 C ? A ? 54 CG 1
   ATOM 454 OD1 . ASP A 74 ? -17.57700 -6.59689 9.13643 1.000 32.28168 O ? A ? 54 OD1 1
   ATOM 455 OD2 . ASP A 74 ? -19.71623 -6.84415 8.97427 1.000 30.83575 O ? A ? 54 OD2 1
   ATOM 456 N . PHE A 75 ? -17.11897 -11.07545 11.55752 1.000 26.45349 N ? A ? 55 N 1
   ATOM 457 CA . PHE A 75 ? -16.92177 -12.05228 12.62407 1.000 25.06113 C ? A ? 55 CA 1
   ATOM 458 C . PHE A 75 ? -15.57415 -11.81376 13.30834 1.000 26.40836 C ? A ? 55 C 1
   ATOM 459 O . PHE A 75 ? -15.45751 -11.77830 14.53505 1.000 28.81246 O ? A ? 55 O 1
   ATOM 460 CB . PHE A 75 ? -16.94548 -13.41273 11.94905 1.000 31.58273 C ? A ? 55 CB 1
   ATOM 461 CG . PHE A 75 ? -17.10530 -14.55648 12.83805 1.000 35.16191 C ? A ? 55 CG 1
   ATOM 462 CD1 . PHE A 75 ? -17.12409 -14.43151 14.22029 1.000 40.45415 C ? A ? 55 CD1 1
   ATOM 463 CD2 . PHE A 75 ? -17.21899 -15.81954 12.26597 1.000 36.25589 C ? A ? 55 CD2 1
   ATOM 464 CE1 . PHE A 75 ? -17.27538 -15.57029 15.03283 1.000 43.73746 C ? A ? 55 CE1 1
   ATOM 465 CE2 . PHE A 75 ? -17.34830 -16.94970 13.06952 1.000 40.85440 C ? A ? 55 CE2 1
   ATOM 466 CZ . PHE A 75 ? -17.37503 -16.81950 14.44605 1.000 44.89181 C ? A ? 55 CZ 1
   ATOM 467 N . GLY A 76 ? -14.54109 -11.63137 12.50082 1.000 23.79770 N ? A ? 56 N 1
   ATOM 468 CA . GLY A 76 ? -13.20899 -11.41739 13.05421 1.000 22.62926 C ? A ? 56 CA 1
   ATOM 469 C . GLY A 76 ? -13.10742 -10.12624 13.85428 1.000 19.07644 C ? A ? 56 C 1
   ATOM 470 O . GLY A 76 ? -12.48041 -10.08957 14.92531 1.000 25.83725 O ? A ? 56 O 1
   ATOM 471 N . LYS A 77 ? -13.77010 -9.08493 13.39346 1.000 23.73279 N ? A ? 57 N 1
   ATOM 472 CA . LYS A 77 ? -13.66659 -7.82109 14.12638 1.000 23.92483 C ? A ? 57 CA 1
   ATOM 473 C . LYS A 77 ? -14.40281 -7.91924 15.42714 1.000 24.77014 C ? A ? 57 C 1
   ATOM 474 O . LYS A 77 ? -13.92370 -7.44780 16.46709 1.000 26.84133 O ? A ? 57 O 1
   ATOM 475 CB . LYS A 77 ? -14.21211 -6.67994 13.27286 1.000 24.85650 C ? A ? 57 CB 1
   ATOM 476 CG . LYS A 77 ? -13.36307 -6.34948 12.06279 1.000 25.17937 C ? A ? 57 CG 1
   ATOM 477 CD . LYS A 77 ? -14.15481 -5.48513 11.04120 1.000 21.56528 C ? A ? 57 CD 1
   ATOM 478 CE . LYS A 77 ? -13.15766 -5.14991 9.88773 1.000 29.72309 C ? A ? 57 CE 1
   ATOM 479 NZ . LYS A 77 ? -13.75926 -4.56093 8.70197 1.000 28.17681 N ? A ? 57 NZ 1
   ATOM 480 N . ILE A 78 ? -15.57118 -8.59075 15.41678 1.000 26.36445 N ? A ? 58 N 1
   ATOM 481 CA . ILE A 78 ? -16.30389 -8.74382 16.66445 1.000 21.96262 C ? A ? 58 CA 1
   ATOM 482 C . ILE A 78 ? -15.52368 -9.60749 17.63049 1.000 27.32372 C ? A ? 58 C 1
   ATOM 483 O . ILE A 78 ? -15.38028 -9.25832 18.80304 1.000 24.63407 O ? A ? 58 O 1
   ATOM 484 CB . ILE A 78 ? -17.71699 -9.31198 16.40764 1.000 26.84213 C ? A ? 58 CB 1
   ATOM 485 CG1 . ILE A 78 ? -18.52050 -8.34751 15.56697 1.000 25.30388 C ? A ? 58 CG1 1
   ATOM 486 CG2 . ILE A 78 ? -18.47905 -9.50729 17.68407 1.000 30.90870 C ? A ? 58 CG2 1
   ATOM 487 CD1 . ILE A 78 ? -19.75896 -9.01705 14.93041 1.000 36.91756 C ? A ? 58 CD1 1
   ATOM 488 N . PHE A 79 ? -14.98029 -10.74750 17.16237 1.000 24.73762 N ? A ? 59 N 1
   ATOM 489 CA . PHE A 79 ? -14.20271 -11.57455 18.07391 1.000 24.71330 C ? A ? 59 CA 1
   ATOM 490 C . PHE A 79 ? -13.05312 -10.74688 18.63334 1.000 23.96313 C ? A ? 59 C 1
   ATOM 491 O . PHE A 79 ? -12.71706 -10.82498 19.81233 1.000 26.83676 O ? A ? 59 O 1
   ATOM 492 CB . PHE A 79 ? -13.64716 -12.79572 17.33927 1.000 21.99494 C ? A ? 59 CB 1
   ATOM 493 CG . PHE A 79 ? -12.70825 -13.65507 18.16181 1.000 26.22937 C ? A ? 59 CG 1
   ATOM 494 CD1 . PHE A 79 ? -13.19693 -14.69111 18.94075 1.000 27.62444 C ? A ? 59 CD1 1
   ATOM 495 CD2 . PHE A 79 ? -11.31937 -13.45316 18.13057 1.000 25.55975 C ? A ? 59 CD2 1
   ATOM 496 CE1 . PHE A 79 ? -12.34518 -15.49742 19.63364 1.000 27.37769 C ? A ? 59 CE1 1
   ATOM 497 CE2 . PHE A 79 ? -10.47266 -14.26129 18.84997 1.000 27.91816 C ? A ? 59 CE2 1
   ATOM 498 CZ . PHE A 79 ? -10.96641 -15.26803 19.59434 1.000 26.92087 C ? A ? 59 CZ 1
   ATOM 499 N . THR A 80 ? -12.40860 -9.97615 17.75678 1.000 22.34513 N ? A ? 60 N 1
   ATOM 500 CA . THR A 80 ? -11.23006 -9.21103 18.19808 1.000 19.01782 C ? A ? 60 CA 1
   ATOM 501 C . THR A 80 ? -11.57876 -8.25360 19.33730 1.000 22.39907 C ? A ? 60 C 1
   ATOM 502 O . THR A 80 ? -10.80504 -8.10349 20.28813 1.000 23.82319 O ? A ? 60 O 1
   ATOM 503 CB . THR A 80 ? -10.66681 -8.49322 16.98307 1.000 22.41782 C ? A ? 60 CB 1
   ATOM 504 OG1 . THR A 80 ? -10.13474 -9.49599 16.12706 1.000 22.67055 O ? A ? 60 OG1 1
   ATOM 505 CG2 . THR A 80 ? -9.46275 -7.65265 17.32199 1.000 28.99278 C ? A ? 60 CG2 1
   ATOM 506 N . ILE A 81 ? -12.70220 -7.56492 19.22551 1.000 25.55568 N ? A ? 61 N 1
   ATOM 507 CA . ILE A 81 ? -13.18304 -6.68134 20.29596 1.000 22.29664 C ? A ? 61 CA 1
   ATOM 508 C . ILE A 81 ? -13.25303 -7.43710 21.61482 1.000 22.99686 C ? A ? 61 C 1
   ATOM 509 O . ILE A 81 ? -12.68645 -7.01183 22.64104 1.000 24.98375 O ? A ? 61 O 1
   ATOM 510 CB . ILE A 81 ? -14.56023 -6.11765 19.92075 1.000 24.05275 C ? A ? 61 CB 1
   ATOM 511 CG1 . ILE A 81 ? -14.43450 -5.07923 18.83504 1.000 27.04164 C ? A ? 61 CG1 1
   ATOM 512 CG2 . ILE A 81 ? -15.20859 -5.41417 21.14556 1.000 29.95700 C ? A ? 61 CG2 1
   ATOM 513 CD1 . ILE A 81 ? -15.82996 -4.66878 18.30081 1.000 27.13976 C ? A ? 61 CD1 1
   ATOM 514 N . LEU A 82 ? -13.90225 -8.60453 21.59859 1.000 22.53124 N ? A ? 62 N 1
   ATOM 515 CA . LEU A 82 ? -14.05206 -9.37496 22.83087 1.000 26.30989 C ? A ? 62 CA 1
   ATOM 516 C . LEU A 82 ? -12.72528 -9.96591 23.28212 1.000 28.29450 C ? A ? 62 C 1
   ATOM 517 O . LEU A 82 ? -12.40942 -9.98008 24.47732 1.000 29.43270 O ? A ? 62 O 1
   ATOM 518 CB . LEU A 82 ? -15.09092 -10.48766 22.62165 1.000 25.41231 C ? A ? 62 CB 1
   ATOM 519 CG . LEU A 82 ? -16.44837 -9.90335 22.21719 1.000 31.96646 C ? A ? 62 CG 1
   ATOM 520 CD1 . LEU A 82 ? -17.49157 -10.97226 21.83293 1.000 35.70561 C ? A ? 62 CD1 1
   ATOM 521 CD2 . LEU A 82 ? -16.93180 -9.03932 23.37408 1.000 33.46522 C ? A ? 62 CD2 1
   ATOM 522 N . TYR A 83 ? -11.95494 -10.50051 22.33094 1.000 25.18300 N ? A ? 63 N 1
   ATOM 523 CA . TYR A 83 ? -10.64725 -11.08240 22.63315 1.000 29.02350 C ? A ? 63 CA 1
   ATOM 524 C . TYR A 83 ? -9.73073 -10.08093 23.34168 1.000 26.78294 C ? A ? 63 C 1
   ATOM 525 O . TYR A 83 ? -9.07092 -10.41846 24.33278 1.000 28.85358 O ? A ? 63 O 1
   ATOM 526 CB . TYR A 83 ? -10.00499 -11.53413 21.31400 1.000 25.27562 C ? A ? 63 CB 1
   ATOM 527 CG . TYR A 83 ? -8.83446 -12.45471 21.45455 1.000 24.72562 C ? A ? 63 CG 1
   ATOM 528 CD1 . TYR A 83 ? -8.89002 -13.60973 22.25368 1.000 25.29683 C ? A ? 63 CD1 1
   ATOM 529 CD2 . TYR A 83 ? -7.65899 -12.21728 20.73628 1.000 24.83634 C ? A ? 63 CD2 1
   ATOM 530 CE1 . TYR A 83 ? -7.78933 -14.49635 22.34211 1.000 26.18153 C ? A ? 63 CE1 1
   ATOM 531 CE2 . TYR A 83 ? -6.59356 -13.10392 20.77941 1.000 24.48485 C ? A ? 63 CE2 1
   ATOM 532 CZ . TYR A 83 ? -6.63342 -14.21315 21.58647 1.000 26.97723 C ? A ? 63 CZ 1
   ATOM 533 OH . TYR A 83 ? -5.52564 -15.04828 21.65311 1.000 21.88769 O ? A ? 63 OH 1
   ATOM 534 N . ILE A 84 ? -9.66694 -8.84804 22.83321 1.000 24.19185 N ? A ? 64 N 1
   ATOM 535 CA . ILE A 84 ? -8.85351 -7.79929 23.47263 1.000 25.44071 C ? A ? 64 CA 1
   ATOM 536 C . ILE A 84 ? -9.33057 -7.55500 24.89429 1.000 29.17690 C ? A ? 64 C 1
   ATOM 537 O . ILE A 84 ? -8.54452 -7.58062 25.85748 1.000 26.74850 O ? A ? 64 O 1
   ATOM 538 CB . ILE A 84 ? -8.90503 -6.50635 22.64863 1.000 27.32612 C ? A ? 64 CB 1
   ATOM 539 CG1 . ILE A 84 ? -8.16083 -6.67595 21.31841 1.000 24.33354 C ? A ? 64 CG1 1
   ATOM 540 CG2 . ILE A 84 ? -8.35673 -5.30209 23.50640 1.000 27.67298 C ? A ? 64 CG2 1
   ATOM 541 CD1 . ILE A 84 ? -8.34720 -5.51998 20.45183 1.000 20.99057 C ? A ? 64 CD1 1
   ATOM 542 N . PHE A 85 ? -10.63114 -7.30863 25.05909 1.000 30.69818 N ? A ? 65 N 1
   ATOM 543 CA . PHE A 85 ? -11.11076 -7.00796 26.41428 1.000 29.67637 C ? A ? 65 CA 1
   ATOM 544 C . PHE A 85 ? -10.86246 -8.16308 27.36841 1.000 31.54383 C ? A ? 65 C 1
   ATOM 545 O . PHE A 85 ? -10.45328 -7.95512 28.51588 1.000 33.78179 O ? A ? 65 O 1
   ATOM 546 CB . PHE A 85 ? -12.58100 -6.63672 26.38211 1.000 27.74333 C ? A ? 65 CB 1
   ATOM 547 CG . PHE A 85 ? -12.79873 -5.18188 26.14486 1.000 29.08600 C ? A ? 65 CG 1
   ATOM 548 CD1 . PHE A 85 ? -12.51499 -4.26518 27.14901 1.000 34.19233 C ? A ? 65 CD1 1
   ATOM 549 CD2 . PHE A 85 ? -13.29891 -4.72894 24.94812 1.000 31.86139 C ? A ? 65 CD2 1
   ATOM 550 CE1 . PHE A 85 ? -12.72949 -2.90941 26.93234 1.000 36.77918 C ? A ? 65 CE1 1
   ATOM 551 CE2 . PHE A 85 ? -13.50578 -3.39707 24.72890 1.000 29.53575 C ? A ? 65 CE2 1
   ATOM 552 CZ . PHE A 85 ? -13.23249 -2.48570 25.71049 1.000 37.18819 C ? A ? 65 CZ 1
   ATOM 553 N . ILE A 86 ? -11.04527 -9.38715 26.91282 1.000 28.88575 N ? A ? 66 N 1
   ATOM 554 CA . ILE A 86 ? -10.87379 -10.47218 27.86688 1.000 33.01385 C ? A ? 66 CA 1
   ATOM 555 C . ILE A 86 ? -9.40091 -10.78629 28.08554 1.000 36.23648 C ? A ? 66 C 1
   ATOM 556 O . ILE A 86 ? -9.00277 -11.09432 29.20055 1.000 38.59279 O ? A ? 66 O 1
   ATOM 557 CB . ILE A 86 ? -11.65243 -11.71345 27.42768 1.000 37.09584 C ? A ? 66 CB 1
   ATOM 558 CG1 . ILE A 86 ? -13.13241 -11.35403 27.32231 1.000 45.34269 C ? A ? 66 CG1 1
   ATOM 559 CG2 . ILE A 86 ? -11.42236 -12.85814 28.43051 1.000 46.52696 C ? A ? 66 CG2 1
   ATOM 560 CD1 . ILE A 86 ? -13.97500 -12.40110 26.68165 1.000 46.39340 C ? A ? 66 CD1 1
   ATOM 561 N A GLY A 87 ? -8.56813 -10.67569 27.05084 0.134 32.32297 N ? A ? 67 N 1
   ATOM 562 CA A GLY A 87 ? -7.20750 -11.18662 27.10482 0.134 30.95539 C ? A ? 67 CA 1
   ATOM 563 C A GLY A 87 ? -6.09150 -10.24002 27.50864 0.134 30.82837 C ? A ? 67 C 1
   ATOM 564 O A GLY A 87 ? -5.03647 -10.69711 27.95662 0.134 34.95018 O ? A ? 67 O 1
   ATOM 565 N B GLY A 87 ? -8.57970 -10.72416 27.03917 0.866 32.29121 N ? A ? 67 N 1
   ATOM 566 CA B GLY A 87 ? -7.20263 -11.19441 27.13016 0.866 30.85586 C ? A ? 67 CA 1
   ATOM 567 C B GLY A 87 ? -6.10454 -10.23588 27.55195 0.866 30.67271 C ? A ? 67 C 1
   ATOM 568 O B GLY A 87 ? -5.05653 -10.68799 28.02707 0.866 35.18107 O ? A ? 67 O 1
   ATOM 569 N . ILE A 88 ? -6.28582 -8.93130 27.33445 1.000 30.46038 N ? A ? 68 N 1
   ATOM 570 CA . ILE A 88 ? -5.24464 -7.95984 27.70537 1.000 27.53104 C ? A ? 68 CA 1
   ATOM 571 C . ILE A 88 ? -4.93330 -8.06703 29.18748 1.000 34.04184 C ? A ? 68 C 1
   ATOM 572 O . ILE A 88 ? -3.77155 -8.11282 29.59463 1.000 33.26149 O ? A ? 68 O 1
   ATOM 573 CB . ILE A 88 ? -5.65568 -6.52540 27.34334 1.000 29.73072 C ? A ? 68 CB 1
   ATOM 574 CG1 . ILE A 88 ? -5.52795 -6.22241 25.86843 1.000 38.48358 C ? A ? 68 CG1 1
   ATOM 575 CG2 . ILE A 88 ? -4.63694 -5.52285 27.91469 1.000 29.98019 C ? A ? 68 CG2 1
   ATOM 576 CD1 . ILE A 88 ? -5.60141 -4.70057 25.62412 1.000 35.34730 C ? A ? 68 CD1 1
   ATOM 577 N . GLY A 89 ? -5.96429 -8.14828 30.01610 1.000 36.80572 N ? A ? 69 N 1
   ATOM 578 CA . GLY A 89 ? -5.71517 -8.22102 31.44963 1.000 33.75790 C ? A ? 69 CA 1
   ATOM 579 C . GLY A 89 ? -4.94990 -9.46939 31.83822 1.000 36.92900 C ? A ? 69 C 1
   ATOM 580 O . GLY A 89 ? -4.04917 -9.41865 32.67750 1.000 43.00471 O ? A ? 69 O 1
   ATOM 581 N A LEU A 90 ? -5.30005 -10.61027 31.22906 0.809 39.11736 N ? A ? 70 N 1
   ATOM 582 CA A LEU A 90 ? -4.59921 -11.86232 31.48790 0.809 36.88156 C ? A ? 70 CA 1
   ATOM 583 C A LEU A 90 ? -3.14936 -11.79500 31.01314 0.809 39.99509 C ? A ? 70 C 1
   ATOM 584 O A LEU A 90 ? -2.21534 -12.18399 31.72625 0.809 33.43950 O ? A ? 70 O 1
   ATOM 585 CB A LEU A 90 ? -5.32933 -13.00062 30.79336 0.809 39.48222 C ? A ? 70 CB 1
   ATOM 586 CG A LEU A 90 ? -4.61152 -14.32574 31.01940 0.809 45.52378 C ? A ? 70 CG 1
   ATOM 587 CD1 A LEU A 90 ? -4.70798 -14.73230 32.50331 0.809 44.02324 C ? A ? 70 CD1 1
   ATOM 588 CD2 A LEU A 90 ? -5.19161 -15.38226 30.14273 0.809 42.95331 C ? A ? 70 CD2 1
   ATOM 589 N B LEU A 90 ? -5.27082 -10.59419 31.19686 0.191 38.96123 N ? A ? 70 N 1
   ATOM 590 CA B LEU A 90 ? -4.61090 -11.85858 31.49044 0.191 36.99145 C ? A ? 70 CA 1
   ATOM 591 C B LEU A 90 ? -3.17158 -11.85913 30.98701 0.191 39.72830 C ? A ? 70 C 1
   ATOM 592 O B LEU A 90 ? -2.26449 -12.34970 31.67053 0.191 34.27001 O ? A ? 70 O 1
   ATOM 593 CB B LEU A 90 ? -5.41380 -12.99212 30.85879 0.191 39.45523 C ? A ? 70 CB 1
   ATOM 594 CG B LEU A 90 ? -5.35595 -14.38430 31.47698 0.191 43.56411 C ? A ? 70 CG 1
   ATOM 595 CD1 B LEU A 90 ? -6.50069 -15.22052 30.93516 0.191 40.63147 C ? A ? 70 CD1 1
   ATOM 596 CD2 B LEU A 90 ? -4.01913 -15.04012 31.17328 0.191 42.37394 C ? A ? 70 CD2 1
   ATOM 597 N . VAL A 91 ? -2.94684 -11.32189 29.78736 1.000 33.94298 N ? A ? 71 N 1
   ATOM 598 CA . VAL A 91 ? -1.59697 -11.27680 29.22954 1.000 29.03106 C ? A ? 71 CA 1
   ATOM 599 C . VAL A 91 ? -0.70449 -10.37890 30.07052 1.000 31.08638 C ? A ? 71 C 1
   ATOM 600 O . VAL A 91 ? 0.44322 -10.71707 30.38111 1.000 39.39034 O ? A ? 71 O 1
   ATOM 601 CB . VAL A 91 ? -1.65260 -10.81719 27.76664 1.000 30.82961 C ? A ? 71 CB 1
   ATOM 602 CG1 . VAL A 91 ? -0.26114 -10.33814 27.30621 1.000 29.73723 C ? A ? 71 CG1 1
   ATOM 603 CG2 . VAL A 91 ? -2.17113 -11.95154 26.92894 1.000 35.11476 C ? A ? 71 CG2 1
   ATOM 604 N . PHE A 92 ? -1.19259 -9.18582 30.41071 1.000 32.95458 N ? A ? 72 N 1
   ATOM 605 CA . PHE A 92 ? -0.32172 -8.28439 31.14135 1.000 36.20018 C ? A ? 72 CA 1
   ATOM 606 C . PHE A 92 ? -0.13359 -8.72328 32.58518 1.000 41.77560 C ? A ? 72 C 1
   ATOM 607 O . PHE A 92 ? 0.93693 -8.48983 33.16461 1.000 43.73071 O ? A ? 72 O 1
   ATOM 608 CB . PHE A 92 ? -0.86377 -6.87640 31.04509 1.000 39.58742 C ? A ? 72 CB 1
   ATOM 609 CG . PHE A 92 ? -0.40597 -6.21335 29.81649 1.000 34.80802 C ? A ? 72 CG 1
   ATOM 610 CD1 . PHE A 92 ? -1.11208 -6.36748 28.64149 1.000 29.96805 C ? A ? 72 CD1 1
   ATOM 611 CD2 . PHE A 92 ? 0.78597 -5.52743 29.80780 1.000 35.98363 C ? A ? 72 CD2 1
   ATOM 612 CE1 . PHE A 92 ? -0.67452 -5.74956 27.50956 1.000 31.86377 C ? A ? 72 CE1 1
   ATOM 613 CE2 . PHE A 92 ? 1.25731 -4.96145 28.65192 1.000 40.96930 C ? A ? 72 CE2 1
   ATOM 614 CZ . PHE A 92 ? 0.52864 -5.08352 27.50463 1.000 29.96453 C ? A ? 72 CZ 1
   ATOM 615 N . GLY A 93 ? -1.12765 -9.40572 33.14720 1.000 37.86426 N ? A ? 73 N 1
   ATOM 616 CA . GLY A 93 ? -0.92582 -10.02338 34.45294 1.000 44.51160 C ? A ? 73 CA 1
   ATOM 617 C . GLY A 93 ? 0.24534 -10.98145 34.42281 1.000 49.83717 C ? A ? 73 C 1
   ATOM 618 O . GLY A 93 ? 1.11114 -10.95190 35.30169 1.000 51.73971 O ? A ? 73 O 1
   ATOM 619 N . PHE A 94 ? 0.31717 -11.80820 33.37417 1.000 42.05217 N ? A ? 74 N 1
   ATOM 620 CA . PHE A 94 ? 1.41601 -12.76220 33.23935 1.000 42.10315 C ? A ? 74 CA 1
   ATOM 621 C . PHE A 94 ? 2.73961 -12.04492 33.06532 1.000 50.86183 C ? A ? 74 C 1
   ATOM 622 O . PHE A 94 ? 3.73171 -12.38813 33.71768 1.000 48.53281 O ? A ? 74 O 1
   ATOM 623 CB . PHE A 94 ? 1.16133 -13.70068 32.05171 1.000 44.22022 C ? A ? 74 CB 1
   ATOM 624 CG . PHE A 94 ? 2.32627 -14.61343 31.73027 1.000 46.62450 C ? A ? 74 CG 1
   ATOM 625 CD1 . PHE A 94 ? 2.55635 -15.75473 32.48078 1.000 50.39302 C ? A ? 74 CD1 1
   ATOM 626 CD2 . PHE A 94 ? 3.17001 -14.34645 30.66068 1.000 44.11710 C ? A ? 74 CD2 1
   ATOM 627 CE1 . PHE A 94 ? 3.61602 -16.60014 32.19881 1.000 40.90631 C ? A ? 74 CE1 1
   ATOM 628 CE2 . PHE A 94 ? 4.22758 -15.19369 30.36309 1.000 46.82473 C ? A ? 74 CE2 1
   ATOM 629 CZ . PHE A 94 ? 4.44348 -16.33017 31.12930 1.000 54.98281 C ? A ? 74 CZ 1
   ATOM 630 N . ILE A 95 ? 2.76018 -11.02528 32.21149 1.000 41.97178 N ? A ? 75 N 1
   ATOM 631 CA . ILE A 95 ? 3.97153 -10.25379 31.98816 1.000 39.41055 C ? A ? 75 CA 1
   ATOM 632 C . ILE A 95 ? 4.47623 -9.67758 33.29753 1.000 56.06042 C ? A ? 75 C 1
   ATOM 633 O . ILE A 95 ? 5.66169 -9.78030 33.62575 1.000 56.51792 O ? A ? 75 O 1
   ATOM 634 CB . ILE A 95 ? 3.70885 -9.14647 30.95928 1.000 41.79800 C ? A ? 75 CB 1
   ATOM 635 CG1 . ILE A 95 ? 3.55965 -9.76662 29.57241 1.000 39.73527 C ? A ? 75 CG1 1
   ATOM 636 CG2 . ILE A 95 ? 4.84196 -8.11623 30.99012 1.000 47.12721 C ? A ? 75 CG2 1
   ATOM 637 CD1 . ILE A 95 ? 3.13404 -8.76702 28.52598 1.000 33.98210 C ? A ? 75 CD1 1
   ATOM 638 N . HIS A 96 ? 3.58488 -9.06166 34.06388 1.000 47.14787 N ? A ? 76 N 1
   ATOM 639 CA . HIS A 96 ? 4.03333 -8.34453 35.24681 1.000 56.25321 C ? A ? 76 CA 1
   ATOM 640 C . HIS A 96 ? 4.36979 -9.29559 36.38931 1.000 59.29093 C ? A ? 76 C 1
   ATOM 641 O . HIS A 96 ? 5.18410 -8.96487 37.25707 1.000 66.96052 O ? A ? 76 O 1
   ATOM 642 CB . HIS A 96 ? 2.97008 -7.34960 35.67154 1.000 58.27947 C ? A ? 76 CB 1
   ATOM 643 CG . HIS A 96 ? 3.37660 -6.51428 36.83633 1.000 74.56891 C ? A ? 76 CG 1
   ATOM 644 ND1 . HIS A 96 ? 3.14427 -6.89788 38.13827 1.000 72.95851 N ? A ? 76 ND1 1
   ATOM 645 CD2 . HIS A 96 ? 4.01099 -5.32127 36.89894 1.000 84.23143 C ? A ? 76 CD2 1
   ATOM 646 CE1 . HIS A 96 ? 3.61049 -5.97156 38.95538 1.000 85.97442 C ? A ? 76 CE1 1
   ATOM 647 NE2 . HIS A 96 ? 4.14275 -5.00467 38.22857 1.000 96.63213 N ? A ? 76 NE2 1
   ATOM 648 N . LYS A 97 ? 3.74977 -10.46779 36.41171 1.000 57.65141 N ? A ? 77 N 1
   ATOM 649 CA . LYS A 97 ? 4.08492 -11.46743 37.41313 1.000 60.89493 C ? A ? 77 CA 1
   ATOM 650 C . LYS A 97 ? 5.31066 -12.27669 37.00006 1.000 64.20130 C ? A ? 77 C 1
   ATOM 651 O . LYS A 97 ? 6.08585 -12.69909 37.86457 1.000 68.05362 O ? A ? 77 O 1
   ATOM 652 CB . LYS A 97 ? 2.85775 -12.34612 37.66808 1.000 65.78860 C ? A ? 77 CB 1
   ATOM 653 CG . LYS A 97 ? 3.02339 -13.42014 38.72201 1.000 77.28873 C ? A ? 77 CG 1
   ATOM 654 CD . LYS A 97 ? 3.59044 -14.68178 38.11538 1.000 73.18329 C ? A ? 77 CD 1
   ATOM 655 CE . LYS A 97 ? 2.89218 -14.99696 36.79060 1.000 73.26144 C ? A ? 77 CE 1
   ATOM 656 NZ . LYS A 97 ? 3.64545 -14.62610 35.56593 1.000 71.03170 N ? A ? 77 NZ 1
   ATOM 657 N . LEU A 98 ? 5.50951 -12.49104 35.69754 1.000 53.78513 N ? A ? 78 N 1
   ATOM 658 CA . LEU A 98 ? 6.77987 -13.01000 35.20834 1.000 58.53380 C ? A ? 78 CA 1
   ATOM 659 C . LEU A 98 ? 7.90191 -12.03240 35.51204 1.000 65.03176 C ? A ? 78 C 1
   ATOM 660 O . LEU A 98 ? 8.94285 -12.40938 36.06671 1.000 66.79656 O ? A ? 78 O 1
   ATOM 661 CB . LEU A 98 ? 6.71079 -13.28099 33.70139 1.000 54.99114 C ? A ? 78 CB 1
   ATOM 662 CG . LEU A 98 ? 8.06285 -13.21624 32.97007 1.000 60.78578 C ? A ? 78 CG 1
   ATOM 663 CD1 . LEU A 98 ? 8.90710 -14.45872 33.21163 1.000 63.28540 C ? A ? 78 CD1 1
   ATOM 664 CD2 . LEU A 98 ? 7.93686 -12.95040 31.46407 1.000 45.95599 C ? A ? 78 CD2 1
   ATOM 665 N . ALA A 99 ? 7.69902 -10.75837 35.16650 1.000 68.21086 N ? A ? 79 N 1
   ATOM 666 CA . ALA A 99 ? 8.71684 -9.75260 35.43356 1.000 68.20764 C ? A ? 79 CA 1
   ATOM 667 C . ALA A 99 ? 9.02944 -9.63348 36.92456 1.000 62.44872 C ? A ? 79 C 1
   ATOM 668 O . ALA A 99 ? 10.10537 -9.14444 37.27481 1.000 67.50611 O ? A ? 79 O 1
   ATOM 669 CB . ALA A 99 ? 8.30824 -8.39381 34.86190 1.000 58.75578 C ? A ? 79 CB 1
   ATOM 670 N . VAL A 100 ? 8.15130 -10.10421 37.81032 1.000 65.02765 N ? A ? 80 N 1
   ATOM 671 CA . VAL A 100 ? 8.38013 -9.96607 39.24508 1.000 68.20608 C ? A ? 80 CA 1
   ATOM 672 C . VAL A 100 ? 8.74282 -11.27954 39.94321 1.000 68.16942 C ? A ? 80 C 1
   ATOM 673 O . VAL A 100 ? 9.45733 -11.24084 40.95685 1.000 69.67650 O ? A ? 80 O 1
   ATOM 674 CB . VAL A 100 ? 7.17567 -9.30613 39.94625 1.000 75.66371 C ? A ? 80 CB 1
   ATOM 675 CG1 . VAL A 100 ? 6.06352 -10.31633 40.19334 1.000 72.39259 C ? A ? 80 CG1 1
   ATOM 676 CG2 . VAL A 100 ? 7.62357 -8.65603 41.24386 1.000 81.48952 C ? A ? 80 CG2 1
   ATOM 677 N . ASN A 101 ? 8.34082 -12.43047 39.41237 1.000 65.73991 N ? A ? 81 N 1
   ATOM 678 CA . ASN A 101 ? 8.55923 -13.71040 40.06878 1.000 69.34265 C ? A ? 81 CA 1
   ATOM 679 C . ASN A 101 ? 9.57068 -14.60255 39.34444 1.000 72.36366 C ? A ? 81 C 1
   ATOM 680 O . ASN A 101 ? 9.74927 -15.75212 39.76034 1.000 75.60618 O ? A ? 81 O 1
   ATOM 681 CB . ASN A 101 ? 7.22637 -14.45929 40.22634 1.000 67.06143 C ? A ? 81 CB 1
   ATOM 682 CG . ASN A 101 ? 6.29759 -13.81332 41.24671 1.000 78.52775 C ? A ? 81 CG 1
   ATOM 683 OD1 . ASN A 101 ? 6.64297 -12.81394 41.87889 1.000 78.52214 O ? A ? 81 OD1 1
   ATOM 684 ND2 . ASN A 101 ? 5.10908 -14.39097 41.41201 1.000 76.98027 N ? A ? 81 ND2 1
   ATOM 685 N . VAL A 102 ? 10.23646 -14.12591 38.27797 1.000 63.39479 N ? A ? 82 N 1
   ATOM 686 CA . VAL A 102 ? 11.21221 -14.96384 37.57759 1.000 56.67838 C ? A ? 82 CA 1
   ATOM 687 C . VAL A 102 ? 12.54639 -14.25973 37.29733 1.000 68.65599 C ? A ? 82 C 1
   ATOM 688 O . VAL A 102 ? 13.59999 -14.75996 37.69492 1.000 71.19766 O ? A ? 82 O 1
   ATOM 689 CB . VAL A 102 ? 10.61026 -15.53896 36.28875 1.000 55.42835 C ? A ? 82 CB 1
   ATOM 690 CG1 . VAL A 102 ? 11.67994 -16.28416 35.51063 1.000 66.84848 C ? A ? 82 CG1 1
   ATOM 691 CG2 . VAL A 102 ? 9.45045 -16.48139 36.63938 1.000 62.22693 C ? A ? 82 CG2 1
   ATOM 692 N . GLN A 103 ? 12.55873 -13.11448 36.61667 1.000 67.91247 N ? A ? 83 N 1
   ATOM 693 CA . GLN A 103 ? 13.86109 -12.48186 36.40536 1.000 69.56469 C ? A ? 83 CA 1
   ATOM 694 C . GLN A 103 ? 14.17976 -11.36979 37.39099 1.000 65.53046 C ? A ? 83 C 1
   ATOM 695 O . GLN A 103 ? 15.35456 -11.00423 37.51013 1.000 56.52112 O ? A ? 83 O 1
   ATOM 696 CB . GLN A 103 ? 13.98993 -11.91944 34.98451 1.000 62.75963 C ? A ? 83 CB 1
   ATOM 697 CG . GLN A 103 ? 13.44826 -10.51647 34.79644 1.000 66.26570 C ? A ? 83 CG 1
   ATOM 698 CD . GLN A 103 ? 11.97441 -10.49314 34.69316 1.000 69.20479 C ? A ? 83 CD 1
   ATOM 699 OE1 . GLN A 103 ? 11.31229 -10.88307 35.63642 1.000 62.26438 O ? A ? 83 OE1 1
   ATOM 700 NE2 . GLN A 103 ? 11.43055 -9.99789 33.55798 1.000 62.15113 N ? A ? 83 NE2 1
   ATOM 701 N . LEU A 104 ? 13.18043 -10.76889 38.03322 1.000 62.29020 N ? A ? 84 N 1
   ATOM 702 CA . LEU A 104 ? 13.48855 -9.85971 39.12939 1.000 66.81442 C ? A ? 84 CA 1
   ATOM 703 C . LEU A 104 ? 14.40650 -10.52982 40.14100 1.000 67.88445 C ? A ? 84 C 1
   ATOM 704 O . LEU A 104 ? 15.40873 -9.90653 40.52831 1.000 66.00664 O ? A ? 84 O 1
   ATOM 705 CB . LEU A 104 ? 12.20105 -9.34750 39.79298 1.000 65.59614 C ? A ? 84 CB 1
   ATOM 706 CG . LEU A 104 ? 12.46299 -8.50306 41.04433 1.000 72.73448 C ? A ? 84 CG 1
   ATOM 707 CD1 . LEU A 104 ? 13.25832 -7.25896 40.70188 1.000 68.42316 C ? A ? 84 CD1 1
   ATOM 708 CD2 . LEU A 104 ? 11.17732 -8.12022 41.76335 1.000 67.99592 C ? A ? 84 CD2 1
   ATOM 709 N . PRO A 105 ? 14.17577 -11.78252 40.56107 1.000 66.44977 N ? A ? 85 N 1
   ATOM 710 CA . PRO A 105 ? 15.22031 -12.45794 41.35214 1.000 60.30445 C ? A ? 85 CA 1
   ATOM 711 C . PRO A 105 ? 16.47548 -12.75092 40.54459 1.000 65.97827 C ? A ? 85 C 1
   ATOM 712 O . PRO A 105 ? 17.59241 -12.50313 41.02074 1.000 51.38548 O ? A ? 85 O 1
   ATOM 713 CB . PRO A 105 ? 14.53131 -13.74283 41.82749 1.000 60.00787 C ? A ? 85 CB 1
   ATOM 714 CG . PRO A 105 ? 13.05119 -13.44373 41.76102 1.000 65.72645 C ? A ? 85 CG 1
   ATOM 715 CD . PRO A 105 ? 12.90368 -12.53938 40.57487 1.000 66.19880 C ? A ? 85 CD 1
   ATOM 716 N . SER A 106 ? 16.32497 -13.26270 39.32400 1.000 56.91528 N ? A ? 86 N 1
   ATOM 717 CA . SER A 106 ? 17.49465 -13.65876 38.55307 1.000 56.09898 C ? A ? 86 CA 1
   ATOM 718 C . SER A 106 ? 18.45643 -12.49183 38.34337 1.000 63.05773 C ? A ? 86 C 1
   ATOM 719 O . SER A 106 ? 19.67566 -12.65458 38.47360 1.000 56.22802 O ? A ? 86 O 1
   ATOM 720 CB . SER A 106 ? 17.04871 -14.26034 37.22740 1.000 60.71979 C ? A ? 86 CB 1
   ATOM 721 OG . SER A 106 ? 16.86533 -15.65694 37.38967 1.000 65.34954 O ? A ? 86 OG 1
   ATOM 722 N . ILE A 107 ? 17.93234 -11.29896 38.04598 1.000 62.89920 N ? A ? 87 N 1
   ATOM 723 CA . ILE A 107 ? 18.80972 -10.13628 37.93260 1.000 68.66639 C ? A ? 87 CA 1
   ATOM 724 C . ILE A 107 ? 19.50998 -9.87048 39.26072 1.000 58.62274 C ? A ? 87 C 1
   ATOM 725 O . ILE A 107 ? 20.71248 -9.58833 39.29637 1.000 65.80051 O ? A ? 87 O 1
   ATOM 726 CB . ILE A 107 ? 18.02869 -8.90782 37.41961 1.000 65.25412 C ? A ? 87 CB 1
   ATOM 727 CG1 . ILE A 107 ? 16.86062 -8.54368 38.32813 1.000 68.03581 C ? A ? 87 CG1 1
   ATOM 728 CG2 . ILE A 107 ? 17.48888 -9.16952 36.01935 1.000 68.90601 C ? A ? 87 CG2 1
   ATOM 729 CD1 . ILE A 107 ? 17.14601 -7.46527 39.33831 1.000 65.62967 C ? A ? 87 CD1 1
   ATOM 730 N . LEU A 108 ? 18.78517 -10.00419 40.37388 1.000 63.73391 N ? A ? 88 N 1
   ATOM 731 CA . LEU A 108 ? 19.39975 -9.85993 41.69102 1.000 64.10509 C ? A ? 88 CA 1
   ATOM 732 C . LEU A 108 ? 20.41880 -10.96235 41.98025 1.000 70.55453 C ? A ? 88 C 1
   ATOM 733 O . LEU A 108 ? 21.37607 -10.73593 42.72800 1.000 76.97689 O ? A ? 88 O 1
   ATOM 734 CB . LEU A 108 ? 18.32159 -9.84821 42.77243 1.000 71.16775 C ? A ? 88 CB 1
   ATOM 735 CG . LEU A 108 ? 17.30525 -8.70993 42.69906 1.000 58.97960 C ? A ? 88 CG 1
   ATOM 736 CD1 . LEU A 108 ? 16.30054 -8.82249 43.81816 1.000 64.88717 C ? A ? 88 CD1 1
   ATOM 737 CD2 . LEU A 108 ? 18.00796 -7.37719 42.74813 1.000 61.39980 C ? A ? 88 CD2 1
   ATOM 738 N . SER A 109 ? 20.24567 -12.15368 41.40089 1.000 68.90095 N ? A ? 89 N 1
   ATOM 739 CA . SER A 109 ? 21.24659 -13.19692 41.59207 1.000 70.04985 C ? A ? 89 CA 1
   ATOM 740 C . SER A 109 ? 22.54926 -12.84445 40.87987 1.000 77.32996 C ? A ? 89 C 1
   ATOM 741 O . SER A 109 ? 23.63864 -13.08774 41.41208 1.000 74.98130 O ? A ? 89 O 1
   ATOM 742 CB . SER A 109 ? 20.71466 -14.55250 41.11894 1.000 69.32640 C ? A ? 89 CB 1
   ATOM 743 OG . SER A 109 ? 20.62492 -14.62228 39.71218 1.000 64.12022 O ? A ? 89 OG 1
   ATOM 744 N . ASN A 110 ? 22.46534 -12.26126 39.68132 1.000 74.48383 N ? A ? 90 N 1
   ATOM 745 CA . ASN A 110 ? 23.67796 -11.81301 39.00423 1.000 77.17471 C ? A ? 90 CA 1
   ATOM 746 C . ASN A 110 ? 24.34593 -10.63029 39.70469 1.000 83.18741 C ? A ? 90 C 1
   ATOM 747 O . ASN A 110 ? 25.46525 -10.26767 39.32610 1.000 90.38695 O ? A ? 90 O 1
   ATOM 748 CB . ASN A 110 ? 23.36395 -11.43064 37.54920 1.000 74.71889 C ? A ? 90 CB 1
   ATOM 749 CG . ASN A 110 ? 24.48630 -11.81621 36.57033 1.000 80.21262 C ? A ? 90 CG 1
   ATOM 750 OD1 . ASN A 110 ? 25.22104 -12.79693 36.77903 1.000 64.36623 O ? A ? 90 OD1 1
   ATOM 751 ND2 . ASN A 110 ? 24.60124 -11.05161 35.48163 1.000 74.86301 N ? A ? 90 ND2 1
   ATOM 752 N . LEU A 111 ? 23.69893 -10.02060 40.70268 1.000 74.85861 N ? A ? 91 N 1
   ATOM 753 CA . LEU A 111 ? 24.20289 -8.80164 41.32831 1.000 79.08497 C ? A ? 91 CA 1
   ATOM 754 C . LEU A 111 ? 24.95352 -9.07821 42.62649 1.000 90.22012 C ? A ? 91 C 1
   ATOM 755 O . LEU A 111 ? 26.11341 -8.67857 42.76628 1.000 94.01031 O ? A ? 91 O 1
   ATOM 756 CB . LEU A 111 ? 23.05325 -7.82220 41.59347 1.000 79.37593 C ? A ? 91 CB 1
   ATOM 757 CG . LEU A 111 ? 22.69268 -6.82270 40.49292 1.000 74.39181 C ? A ? 91 CG 1
   ATOM 758 CD1 . LEU A 111 ? 21.51648 -5.95808 40.93301 1.000 65.67215 C ? A ? 91 CD1 1
   ATOM 759 CD2 . LEU A 111 ? 23.88757 -5.95807 40.16114 1.000 76.49329 C ? A ? 91 CD2 1
   ATOM 760 N . VAL A 112 ? 24.30407 -9.73333 43.58648 1.000 93.07801 N ? A ? 92 N 1
   ATOM 761 CA . VAL A 112 ? 24.91714 -9.94412 44.90738 1.000 88.80434 C ? A ? 92 CA 1
   ATOM 762 C . VAL A 112 ? 26.19202 -10.76919 44.75013 1.000 87.28634 C ? A ? 92 C 1
   ATOM 763 O . VAL A 112 ? 26.15781 -11.84857 44.12578 1.000 86.19800 O ? A ? 92 O 1
   ATOM 764 CB . VAL A 112 ? 23.92565 -10.64041 45.85905 1.000 86.22913 C ? A ? 92 CB 1
   ATOM 765 CG1 . VAL A 112 ? 24.53443 -10.79552 47.25793 1.000 69.97514 C ? A ? 92 CG1 1
   ATOM 766 CG2 . VAL A 112 ? 22.60074 -9.88216 45.90998 1.000 89.10467 C ? A ? 92 CG2 1
   ATOM 767 N . PRO A 113 ? 27.34389 -10.31320 45.28070 1.000 88.85599 N ? A ? 93 N 1
   ATOM 768 CA . PRO A 113 ? 28.65537 -10.98079 45.23151 1.000 87.26580 C ? A ? 93 CA 1
   ATOM 769 C . PRO A 113 ? 28.63546 -12.43344 45.70585 1.000 82.55401 C ? A ? 93 C 1
   ATOM 770 O . PRO A 113 ? 29.69955 -13.02850 45.88749 1.000 74.73386 O ? A ? 93 O 1
   ATOM 771 CB . PRO A 113 ? 29.52005 -10.12985 46.17136 1.000 90.67037 C ? A ? 93 CB 1
   ATOM 772 CG . PRO A 113 ? 28.55179 -9.27135 46.94811 1.000 92.11141 C ? A ? 93 CG 1
   ATOM 773 CD . PRO A 113 ? 27.41610 -9.03916 46.01316 1.000 87.63852 C ? A ? 93 CD 1
   ATOM 774 N . ALA B 19 ? -20.09436 -7.56786 -43.81596 1.000 85.12966 N ? B ? 1 N 1
   ATOM 775 CA . ALA B 19 ? -18.92758 -8.22645 -43.23959 1.000 79.04716 C ? B ? 1 CA 1
   ATOM 776 C . ALA B 19 ? -18.18811 -7.30277 -42.26751 1.000 73.87709 C ? B ? 1 C 1
   ATOM 777 O . ALA B 19 ? -17.53816 -7.77036 -41.32898 1.000 56.46691 O ? B ? 1 O 1
   ATOM 778 CB . ALA B 19 ? -17.97977 -8.71411 -44.34872 1.000 79.98627 C ? B ? 1 CB 1
   ATOM 779 N . LYS B 20 ? -18.27254 -5.98545 -42.47689 1.000 69.87383 N ? B ? 2 N 1
   ATOM 780 CA . LYS B 20 ? -17.59282 -5.09250 -41.54385 1.000 66.93475 C ? B ? 2 CA 1
   ATOM 781 C . LYS B 20 ? -18.32621 -5.04061 -40.20805 1.000 60.31934 C ? B ? 2 C 1
   ATOM 782 O . LYS B 20 ? -17.69077 -5.08589 -39.14736 1.000 47.92158 O ? B ? 2 O 1
   ATOM 783 CB . LYS B 20 ? -17.42822 -3.69579 -42.14826 1.000 75.43836 C ? B ? 2 CB 1
   ATOM 784 CG . LYS B 20 ? -15.96711 -3.31735 -42.44975 1.000 68.47673 C ? B ? 2 CG 1
   ATOM 785 CD . LYS B 20 ? -15.33589 -4.27025 -43.46334 1.000 78.62559 C ? B ? 2 CD 1
   ATOM 786 CE . LYS B 20 ? -13.94297 -3.81949 -43.88376 1.000 85.32803 C ? B ? 2 CE 1
   ATOM 787 NZ . LYS B 20 ? -13.53807 -4.43748 -45.18101 1.000 86.81284 N ? B ? 2 NZ 1
   ATOM 788 N . ASP B 21 ? -19.66303 -4.98535 -40.22271 1.000 60.71699 N ? B ? 3 N 1
   ATOM 789 CA . ASP B 21 ? -20.34816 -5.01658 -38.93418 1.000 56.92891 C ? B ? 3 CA 1
   ATOM 790 C . ASP B 21 ? -20.35047 -6.42102 -38.33188 1.000 53.64085 C ? B ? 3 C 1
   ATOM 791 O . ASP B 21 ? -20.38231 -6.55790 -37.10550 1.000 50.43032 O ? B ? 3 O 1
   ATOM 792 CB . ASP B 21 ? -21.76992 -4.41196 -39.03546 1.000 67.90349 C ? B ? 3 CB 1
   ATOM 793 CG . ASP B 21 ? -22.78331 -5.28917 -39.78173 1.000 72.30587 C ? B ? 3 CG 1
   ATOM 794 OD1 . ASP B 21 ? -22.51352 -6.46196 -40.09934 1.000 77.78805 O ? B ? 3 OD1 1
   ATOM 795 OD2 . ASP B 21 ? -23.89723 -4.78030 -40.04755 1.000 79.58488 O ? B ? 3 OD2 1
   ATOM 796 N . LYS B 22 ? -20.27508 -7.47388 -39.15556 1.000 58.90976 N ? B ? 4 N 1
   ATOM 797 CA . LYS B 22 ? -20.21077 -8.80660 -38.57010 1.000 51.21641 C ? B ? 4 CA 1
   ATOM 798 C . LYS B 22 ? -18.82804 -9.08174 -37.99485 1.000 46.64791 C ? B ? 4 C 1
   ATOM 799 O . LYS B 22 ? -18.72072 -9.70097 -36.93672 1.000 40.58372 O ? B ? 4 O 1
   ATOM 800 CB . LYS B 22 ? -20.60199 -9.87148 -39.59229 1.000 58.22961 C ? B ? 4 CB 1
   ATOM 801 CG . LYS B 22 ? -21.48067 -10.97746 -39.00885 1.000 64.39349 C ? B ? 4 CG 1
   ATOM 802 CD . LYS B 22 ? -22.90738 -10.49660 -38.67523 1.000 56.34428 C ? B ? 4 CD 1
   ATOM 803 CE . LYS B 22 ? -23.66834 -11.55925 -37.84952 1.000 58.98752 C ? B ? 4 CE 1
   ATOM 804 NZ . LYS B 22 ? -24.88694 -11.04447 -37.09391 1.000 59.63090 N ? B ? 4 NZ 1
   ATOM 805 N . GLU B 23 ? -17.75863 -8.62887 -38.66595 1.000 46.56416 N ? B ? 5 N 1
   ATOM 806 CA . GLU B 23 ? -16.44927 -8.65860 -38.03418 1.000 46.89567 C ? B ? 5 CA 1
   ATOM 807 C . GLU B 23 ? -16.50704 -7.99526 -36.67200 1.000 40.68730 C ? B ? 5 C 1
   ATOM 808 O . GLU B 23 ? -15.97644 -8.51776 -35.68401 1.000 34.68838 O ? B ? 5 O 1
   ATOM 809 CB . GLU B 23 ? -15.39459 -7.96249 -38.89757 1.000 44.55508 C ? B ? 5 CB 1
   ATOM 810 CG . GLU B 23 ? -14.08642 -7.84017 -38.14980 1.000 43.26534 C ? B ? 5 CG 1
   ATOM 811 CD . GLU B 23 ? -13.06558 -6.94281 -38.83487 1.000 51.66332 C ? B ? 5 CD 1
   ATOM 812 OE1 . GLU B 23 ? -13.37580 -5.76796 -39.11754 1.000 47.43797 O ? B ? 5 OE1 1
   ATOM 813 OE2 . GLU B 23 ? -11.93763 -7.42031 -39.06843 1.000 56.49758 O ? B ? 5 OE2 1
   ATOM 814 N . PHE B 24 ? -17.16329 -6.83370 -36.59880 1.000 36.16122 N ? B ? 6 N 1
   ATOM 815 CA . PHE B 24 ? -17.26127 -6.15050 -35.32534 1.000 36.44978 C ? B ? 6 CA 1
   ATOM 816 C . PHE B 24 ? -18.04617 -6.98353 -34.32839 1.000 32.32102 C ? B ? 6 C 1
   ATOM 817 O . PHE B 24 ? -17.64084 -7.10618 -33.17827 1.000 30.14243 O ? B ? 6 O 1
   ATOM 818 CB . PHE B 24 ? -17.91855 -4.77200 -35.47323 1.000 37.14227 C ? B ? 6 CB 1
   ATOM 819 CG . PHE B 24 ? -18.09959 -4.08554 -34.17632 1.000 29.39644 C ? B ? 6 CG 1
   ATOM 820 CD1 . PHE B 24 ? -16.99484 -3.55474 -33.49857 1.000 33.33150 C ? B ? 6 CD1 1
   ATOM 821 CD2 . PHE B 24 ? -19.34047 -3.97502 -33.57960 1.000 35.29579 C ? B ? 6 CD2 1
   ATOM 822 CE1 . PHE B 24 ? -17.13965 -2.91057 -32.27347 1.000 30.22138 C ? B ? 6 CE1 1
   ATOM 823 CE2 . PHE B 24 ? -19.48359 -3.32708 -32.32065 1.000 33.40986 C ? B ? 6 CE2 1
   ATOM 824 CZ . PHE B 24 ? -18.37339 -2.81233 -31.67865 1.000 35.89608 C ? B ? 6 CZ 1
   ATOM 825 N . GLN B 25 ? -19.20315 -7.52480 -34.73795 1.000 29.49288 N ? B ? 7 N 1
   ATOM 826 CA . GLN B 25 ? -20.03461 -8.27386 -33.78908 1.000 30.63067 C ? B ? 7 CA 1
   ATOM 827 C . GLN B 25 ? -19.30740 -9.50357 -33.25462 1.000 27.17637 C ? B ? 7 C 1
   ATOM 828 O . GLN B 25 ? -19.36002 -9.79932 -32.04603 1.000 31.39583 O ? B ? 7 O 1
   ATOM 829 CB . GLN B 25 ? -21.35006 -8.68521 -34.47386 1.000 36.09230 C ? B ? 7 CB 1
   ATOM 830 CG . GLN B 25 ? -22.24685 -7.46415 -34.72425 1.000 51.96870 C ? B ? 7 CG 1
   ATOM 831 CD . GLN B 25 ? -23.39883 -7.74577 -35.66528 1.000 57.80612 C ? B ? 7 CD 1
   ATOM 832 OE1 . GLN B 25 ? -23.53369 -8.84967 -36.19059 1.000 57.12423 O ? B ? 7 OE1 1
   ATOM 833 NE2 . GLN B 25 ? -24.23301 -6.73785 -35.89282 1.000 64.76937 N ? B ? 7 NE2 1
   ATOM 834 N . VAL B 26 ? -18.59187 -10.19440 -34.13171 1.000 29.88511 N ? B ? 8 N 1
   ATOM 835 CA . VAL B 26 ? -17.84262 -11.36818 -33.73229 1.000 35.45149 C ? B ? 8 CA 1
   ATOM 836 C . VAL B 26 ? -16.73398 -10.97344 -32.77902 1.000 33.67925 C ? B ? 8 C 1
   ATOM 837 O . VAL B 26 ? -16.54529 -11.60979 -31.75259 1.000 29.14767 O ? B ? 8 O 1
   ATOM 838 CB . VAL B 26 ? -17.29319 -12.10629 -34.96801 1.000 28.36594 C ? B ? 8 CB 1
   ATOM 839 CG1 . VAL B 26 ? -16.40126 -13.23082 -34.52847 1.000 35.60928 C ? B ? 8 CG1 1
   ATOM 840 CG2 . VAL B 26 ? -18.43652 -12.61978 -35.81869 1.000 32.96843 C ? B ? 8 CG2 1
   ATOM 841 N . LEU B 27 ? -16.00366 -9.88325 -33.07419 1.000 28.59678 N ? B ? 9 N 1
   ATOM 842 CA . LEU B 27 ? -14.98231 -9.45463 -32.13668 1.000 22.94246 C ? B ? 9 CA 1
   ATOM 843 C . LEU B 27 ? -15.58534 -9.08346 -30.80254 1.000 27.05708 C ? B ? 9 C 1
   ATOM 844 O . LEU B 27 ? -15.00389 -9.35521 -29.75536 1.000 24.46318 O ? B ? 9 O 1
   ATOM 845 CB . LEU B 27 ? -14.17765 -8.27074 -32.70313 1.000 23.94530 C ? B ? 9 CB 1
   ATOM 846 CG . LEU B 27 ? -13.08753 -8.69783 -33.68485 1.000 40.80812 C ? B ? 9 CG 1
   ATOM 847 CD1 . LEU B 27 ? -12.42687 -7.49374 -34.37158 1.000 41.25893 C ? B ? 9 CD1 1
   ATOM 848 CD2 . LEU B 27 ? -12.01886 -9.57488 -32.99691 1.000 35.94577 C ? B ? 9 CD2 1
   ATOM 849 N . PHE B 28 ? -16.74603 -8.43210 -30.82599 1.000 26.64740 N ? B ? 10 N 1
   ATOM 850 CA . PHE B 28 ? -17.42963 -8.07222 -29.59485 1.000 24.06235 C ? B ? 10 CA 1
   ATOM 851 C . PHE B 28 ? -17.76898 -9.31959 -28.79339 1.000 28.77510 C ? B ? 10 C 1
   ATOM 852 O . PHE B 28 ? -17.50408 -9.39731 -27.58644 1.000 26.55070 O ? B ? 10 O 1
   ATOM 853 CB . PHE B 28 ? -18.70306 -7.26567 -29.96041 1.000 29.30776 C ? B ? 10 CB 1
   ATOM 854 CG . PHE B 28 ? -19.50440 -6.85097 -28.76052 1.000 33.52675 C ? B ? 10 CG 1
   ATOM 855 CD1 . PHE B 28 ? -19.05755 -5.84440 -27.92969 1.000 40.85398 C ? B ? 10 CD1 1
   ATOM 856 CD2 . PHE B 28 ? -20.68458 -7.52589 -28.43501 1.000 46.98810 C ? B ? 10 CD2 1
   ATOM 857 CE1 . PHE B 28 ? -19.79272 -5.44493 -26.79334 1.000 44.39181 C ? B ? 10 CE1 1
   ATOM 858 CE2 . PHE B 28 ? -21.41307 -7.15340 -27.31677 1.000 51.53435 C ? B ? 10 CE2 1
   ATOM 859 CZ . PHE B 28 ? -20.96955 -6.10860 -26.49208 1.000 54.65495 C ? B ? 10 CZ 1
   ATOM 860 N A VAL B 29 ? -18.33631 -10.31838 -29.47328 0.552 26.46539 N ? B ? 11 N 1
   ATOM 861 CA A VAL B 29 ? -18.68630 -11.57642 -28.81405 0.552 27.72139 C ? B ? 11 CA 1
   ATOM 862 C A VAL B 29 ? -17.45446 -12.21087 -28.19011 0.552 26.48263 C ? B ? 11 C 1
   ATOM 863 O A VAL B 29 ? -17.45642 -12.57020 -27.00766 0.552 28.83418 O ? B ? 11 O 1
   ATOM 864 CB A VAL B 29 ? -19.37289 -12.53298 -29.80754 0.552 31.79300 C ? B ? 11 CB 1
   ATOM 865 CG1 A VAL B 29 ? -19.59595 -13.88051 -29.14528 0.552 29.68149 C ? B ? 11 CG1 1
   ATOM 866 CG2 A VAL B 29 ? -20.68898 -11.96475 -30.25853 0.552 29.37996 C ? B ? 11 CG2 1
   ATOM 867 N B VAL B 29 ? -18.31640 -10.34030 -29.44279 0.448 26.53183 N ? B ? 11 N 1
   ATOM 868 CA B VAL B 29 ? -18.67325 -11.48235 -28.60725 0.448 27.59100 C ? B ? 11 CA 1
   ATOM 869 C B VAL B 29 ? -17.43550 -12.24997 -28.15495 0.448 26.52772 C ? B ? 11 C 1
   ATOM 870 O B VAL B 29 ? -17.40456 -12.73550 -27.02131 0.448 28.96568 O ? B ? 11 O 1
   ATOM 871 CB B VAL B 29 ? -19.71276 -12.37993 -29.29944 0.448 31.64063 C ? B ? 11 CB 1
   ATOM 872 CG1 B VAL B 29 ? -21.02149 -11.64052 -29.38801 0.448 30.77888 C ? B ? 11 CG1 1
   ATOM 873 CG2 B VAL B 29 ? -19.22927 -12.81322 -30.66386 0.448 28.61294 C ? B ? 11 CG2 1
   ATOM 874 N . LEU B 30 ? -16.35657 -12.30458 -28.95740 1.000 25.05239 N ? B ? 12 N 1
   ATOM 875 CA . LEU B 30 ? -15.13396 -12.93014 -28.42545 1.000 25.73072 C ? B ? 12 CA 1
   ATOM 876 C . LEU B 30 ? -14.58505 -12.15998 -27.24623 1.000 29.68351 C ? B ? 12 C 1
   ATOM 877 O . LEU B 30 ? -14.11590 -12.74726 -26.25615 1.000 28.44297 O ? B ? 12 O 1
   ATOM 878 CB . LEU B 30 ? -14.03370 -13.01399 -29.49214 1.000 28.60949 C ? B ? 12 CB 1
   ATOM 879 CG . LEU B 30 ? -14.22244 -14.00748 -30.61862 1.000 39.19125 C ? B ? 12 CG 1
   ATOM 880 CD1 . LEU B 30 ? -13.48289 -13.53640 -31.86294 1.000 35.08627 C ? B ? 12 CD1 1
   ATOM 881 CD2 . LEU B 30 ? -13.70723 -15.35377 -30.14771 1.000 34.99157 C ? B ? 12 CD2 1
   ATOM 882 N . THR B 31 ? -14.58367 -10.83728 -27.33318 1.000 21.67283 N ? B ? 13 N 1
   ATOM 883 CA . THR B 31 ? -14.12174 -10.05659 -26.18999 1.000 24.09811 C ? B ? 13 CA 1
   ATOM 884 C . THR B 31 ? -14.98656 -10.30532 -24.96047 1.000 29.36160 C ? B ? 13 C 1
   ATOM 885 O . THR B 31 ? -14.47489 -10.50807 -23.84599 1.000 30.56503 O ? B ? 13 O 1
   ATOM 886 CB . THR B 31 ? -14.13923 -8.57479 -26.57046 1.000 25.79201 C ? B ? 13 CB 1
   ATOM 887 OG1 . THR B 31 ? -13.21923 -8.38692 -27.66056 1.000 30.25379 O ? B ? 13 OG1 1
   ATOM 888 CG2 . THR B 31 ? -13.80743 -7.68382 -25.37707 1.000 34.67971 C ? B ? 13 CG2 1
   ATOM 889 N . ILE B 32 ? -16.30652 -10.30864 -25.15579 1.000 30.54144 N ? B ? 14 N 1
   ATOM 890 CA . ILE B 32 ? -17.22377 -10.56597 -24.04519 1.000 28.00465 C ? B ? 14 CA 1
   ATOM 891 C . ILE B 32 ? -16.96712 -11.95125 -23.46615 1.000 25.63011 C ? B ? 14 C 1
   ATOM 892 O . ILE B 32 ? -16.74246 -12.10418 -22.26110 1.000 38.13345 O ? B ? 14 O 1
   ATOM 893 CB . ILE B 32 ? -18.67638 -10.40233 -24.50402 1.000 34.21919 C ? B ? 14 CB 1
   ATOM 894 CG1 . ILE B 32 ? -18.97228 -8.91508 -24.77949 1.000 38.74455 C ? B ? 14 CG1 1
   ATOM 895 CG2 . ILE B 32 ? -19.63299 -10.91077 -23.41246 1.000 49.30632 C ? B ? 14 CG2 1
   ATOM 896 CD1 . ILE B 32 ? -18.52829 -8.03339 -23.66262 1.000 41.11790 C ? B ? 14 CD1 1
   ATOM 897 N . LEU B 33 ? -16.88937 -12.96302 -24.33173 1.000 33.32266 N ? B ? 15 N 1
   ATOM 898 CA . LEU B 33 ? -16.59482 -14.30222 -23.82933 1.000 33.05088 C ? B ? 15 CA 1
   ATOM 899 C . LEU B 33 ? -15.25979 -14.34242 -23.10147 1.000 34.14582 C ? B ? 15 C 1
   ATOM 900 O . LEU B 33 ? -15.14028 -14.97145 -22.04421 1.000 35.77603 O ? B ? 15 O 1
   ATOM 901 CB . LEU B 33 ? -16.63141 -15.32441 -24.96201 1.000 31.05276 C ? B ? 15 CB 1
   ATOM 902 CG . LEU B 33 ? -17.91319 -15.54669 -25.75900 1.000 32.28209 C ? B ? 15 CG 1
   ATOM 903 CD1 . LEU B 33 ? -17.66376 -16.56428 -26.87231 1.000 35.66066 C ? B ? 15 CD1 1
   ATOM 904 CD2 . LEU B 33 ? -19.07008 -16.03206 -24.87870 1.000 36.88618 C ? B ? 15 CD2 1
   ATOM 905 N . THR B 34 ? -14.24228 -13.64339 -23.61620 1.000 28.75972 N ? B ? 16 N 1
   ATOM 906 CA . THR B 34 ? -12.95854 -13.65163 -22.92089 1.000 28.26424 C ? B ? 16 CA 1
   ATOM 907 C . THR B 34 ? -13.05528 -12.99805 -21.56798 1.000 34.76199 C ? B ? 16 C 1
   ATOM 908 O . THR B 34 ? -12.42690 -13.45006 -20.58678 1.000 35.80685 O ? B ? 16 O 1
   ATOM 909 CB . THR B 34 ? -11.91735 -12.93382 -23.79749 1.000 31.88907 C ? B ? 16 CB 1
   ATOM 910 OG1 . THR B 34 ? -11.87349 -13.66216 -25.01416 1.000 29.82081 O ? B ? 16 OG1 1
   ATOM 911 CG2 . THR B 34 ? -10.52721 -12.96215 -23.15199 1.000 34.39306 C ? B ? 16 CG2 1
   ATOM 912 N . LEU B 35 ? -13.81110 -11.90987 -21.49314 1.000 30.46696 N ? B ? 17 N 1
   ATOM 913 CA . LEU B 35 ? -14.02494 -11.28192 -20.20428 1.000 34.18911 C ? B ? 17 CA 1
   ATOM 914 C . LEU B 35 ? -14.85727 -12.16806 -19.29307 1.000 36.02172 C ? B ? 17 C 1
   ATOM 915 O . LEU B 35 ? -14.60852 -12.19230 -18.08778 1.000 42.04547 O ? B ? 17 O 1
   ATOM 916 CB . LEU B 35 ? -14.70412 -9.93424 -20.39125 1.000 34.60846 C ? B ? 17 CB 1
   ATOM 917 CG . LEU B 35 ? -13.86772 -8.86841 -21.10910 1.000 35.73146 C ? B ? 17 CG 1
   ATOM 918 CD1 . LEU B 35 ? -14.70105 -7.61603 -21.33740 1.000 30.01713 C ? B ? 17 CD1 1
   ATOM 919 CD2 . LEU B 35 ? -12.67631 -8.56400 -20.27547 1.000 33.19968 C ? B ? 17 CD2 1
   ATOM 920 N . ILE B 36 ? -15.84164 -12.89195 -19.83903 1.000 36.99589 N ? B ? 18 N 1
   ATOM 921 CA . ILE B 36 ? -16.63367 -13.80141 -19.00280 1.000 35.34041 C ? B ? 18 CA 1
   ATOM 922 C . ILE B 36 ? -15.74740 -14.90911 -18.45425 1.000 44.06798 C ? B ? 18 C 1
   ATOM 923 O . ILE B 36 ? -15.86595 -15.30725 -17.28595 1.000 49.52733 O ? B ? 18 O 1
   ATOM 924 CB . ILE B 36 ? -17.82819 -14.35402 -19.79665 1.000 38.83147 C ? B ? 18 CB 1
   ATOM 925 CG1 . ILE B 36 ? -18.88717 -13.25956 -19.99637 1.000 33.97586 C ? B ? 18 CG1 1
   ATOM 926 CG2 . ILE B 36 ? -18.46091 -15.56128 -19.08296 1.000 41.92294 C ? B ? 18 CG2 1
   ATOM 927 CD1 . ILE B 36 ? -20.00663 -13.69982 -20.82723 1.000 32.23007 C ? B ? 18 CD1 1
   ATOM 928 N . SER B 37 ? -14.80933 -15.39126 -19.25702 1.000 45.76351 N ? B ? 19 N 1
   ATOM 929 CA . SER B 37 ? -13.92831 -16.43141 -18.74122 1.000 46.08840 C ? B ? 19 CA 1
   ATOM 930 C . SER B 37 ? -13.03622 -15.90909 -17.62258 1.000 41.73467 C ? B ? 19 C 1
   ATOM 931 O . SER B 37 ? -12.71817 -16.63734 -16.67239 1.000 45.92429 O ? B ? 19 O 1
   ATOM 932 CB . SER B 37 ? -13.06921 -16.96993 -19.87747 1.000 42.66635 C ? B ? 19 CB 1
   ATOM 933 OG . SER B 37 ? -13.88733 -17.65873 -20.79553 1.000 51.02271 O ? B ? 19 OG 1
   ATOM 934 N . GLY B 38 ? -12.62350 -14.64525 -17.70554 1.000 38.12461 N ? B ? 20 N 1
   ATOM 935 CA . GLY B 38 ? -11.81362 -14.06756 -16.64881 1.000 33.14734 C ? B ? 20 CA 1
   ATOM 936 C . GLY B 38 ? -12.63215 -13.80414 -15.39720 1.000 41.70126 C ? B ? 20 C 1
   ATOM 937 O . GLY B 38 ? -12.16166 -14.02609 -14.27514 1.000 43.96580 O ? B ? 20 O 1
   ATOM 938 N A THR B 39 ? -13.87418 -13.33216 -15.56330 0.000 39.03760 N ? B ? 21 N 1
   ATOM 939 CA A THR B 39 ? -14.73572 -13.13069 -14.39753 0.000 45.54684 C ? B ? 21 CA 1
   ATOM 940 C A THR B 39 ? -14.96501 -14.44494 -13.67164 0.000 48.31792 C ? B ? 21 C 1
   ATOM 941 O A THR B 39 ? -14.87701 -14.51633 -12.43993 0.000 48.14277 O ? B ? 21 O 1
   ATOM 942 CB A THR B 39 ? -16.09212 -12.52468 -14.78364 0.000 47.14880 C ? B ? 21 CB 1
   ATOM 943 OG1 A THR B 39 ? -16.86021 -13.47865 -15.52658 0.000 44.60168 O ? B ? 21 OG1 1
   ATOM 944 CG2 A THR B 39 ? -15.92128 -11.28913 -15.60582 0.000 44.23850 C ? B ? 21 CG2 1
   ATOM 945 N B THR B 39 ? -13.85192 -13.31574 -15.56696 1.000 38.38675 N ? B ? 21 N 1
   ATOM 946 CA B THR B 39 ? -14.72911 -13.11447 -14.41427 1.000 45.61208 C ? B ? 21 CA 1
   ATOM 947 C B THR B 39 ? -14.98612 -14.43107 -13.68005 1.000 48.59329 C ? B ? 21 C 1
   ATOM 948 O B THR B 39 ? -14.89499 -14.49806 -12.44292 1.000 48.19639 O ? B ? 21 O 1
   ATOM 949 CB B THR B 39 ? -16.02714 -12.45754 -14.88017 1.000 47.67044 C ? B ? 21 CB 1
   ATOM 950 OG1 B THR B 39 ? -15.67180 -11.25120 -15.55299 1.000 44.27940 O ? B ? 21 OG1 1
   ATOM 951 CG2 B THR B 39 ? -16.95742 -12.09080 -13.68583 1.000 42.78357 C ? B ? 21 CG2 1
   ATOM 952 N . ILE B 40 ? -15.26527 -15.50184 -14.42829 1.000 47.07796 N ? B ? 22 N 1
   ATOM 953 CA . ILE B 40 ? -15.51875 -16.79841 -13.80777 1.000 47.67667 C ? B ? 22 CA 1
   ATOM 954 C . ILE B 40 ? -14.27065 -17.32457 -13.11353 1.000 57.23303 C ? B ? 22 C 1
   ATOM 955 O . ILE B 40 ? -14.35427 -17.93351 -12.03426 1.000 48.40818 O ? B ? 22 O 1
   ATOM 956 CB . ILE B 40 ? -16.03972 -17.79807 -14.84652 1.000 52.23146 C ? B ? 22 CB 1
   ATOM 957 CG1 . ILE B 40 ? -17.44299 -17.41860 -15.29257 1.000 43.47861 C ? B ? 22 CG1 1
   ATOM 958 CG2 . ILE B 40 ? -16.01882 -19.20549 -14.25797 1.000 56.25088 C ? B ? 22 CG2 1
   ATOM 959 CD1 . ILE B 40 ? -17.89557 -18.22158 -16.45866 1.000 48.30862 C ? B ? 22 CD1 1
   ATOM 960 N . PHE B 41 ? -13.09186 -17.08553 -13.69024 1.000 46.22129 N ? B ? 23 N 1
   ATOM 961 CA . PHE B 41 ? -11.87075 -17.55605 -13.05009 1.000 45.20242 C ? B ? 23 CA 1
   ATOM 962 C . PHE B 41 ? -11.55266 -16.76945 -11.78738 1.000 51.27291 C ? B ? 23 C 1
   ATOM 963 O . PHE B 41 ? -11.28935 -17.35904 -10.72547 1.000 53.40598 O ? B ? 23 O 1
   ATOM 964 CB . PHE B 41 ? -10.68331 -17.48137 -14.00672 1.000 51.82345 C ? B ? 23 CB 1
   ATOM 965 CG . PHE B 41 ? -9.41717 -18.00647 -13.40437 1.000 52.06992 C ? B ? 23 CG 1
   ATOM 966 CD1 . PHE B 41 ? -8.63276 -17.20382 -12.58477 1.000 45.23589 C ? B ? 23 CD1 1
   ATOM 967 CD2 . PHE B 41 ? -9.02176 -19.31019 -13.63697 1.000 49.41976 C ? B ? 23 CD2 1
   ATOM 968 CE1 . PHE B 41 ? -7.48425 -17.69456 -12.01591 1.000 52.92575 C ? B ? 23 CE1 1
   ATOM 969 CE2 . PHE B 41 ? -7.86051 -19.80716 -13.06425 1.000 51.88498 C ? B ? 23 CE2 1
   ATOM 970 CZ . PHE B 41 ? -7.09550 -18.99596 -12.25974 1.000 49.37798 C ? B ? 23 CZ 1
   ATOM 971 N . TYR B 42 ? -11.49884 -15.43942 -11.89060 1.000 43.79896 N ? B ? 24 N 1
   ATOM 972 CA . TYR B 42 ? -11.02551 -14.64595 -10.76215 1.000 49.30887 C ? B ? 24 CA 1
   ATOM 973 C . TYR B 42 ? -12.04478 -14.56222 -9.63824 1.000 51.78700 C ? B ? 24 C 1
   ATOM 974 O . TYR B 42 ? -11.67695 -14.21663 -8.51286 1.000 55.60924 O ? B ? 24 O 1
   ATOM 975 CB . TYR B 42 ? -10.65065 -13.23126 -11.19316 1.000 44.56496 C ? B ? 24 CB 1
   ATOM 976 CG . TYR B 42 ? -9.41686 -13.22486 -12.09359 1.000 52.62386 C ? B ? 24 CG 1
   ATOM 977 CD1 . TYR B 42 ? -8.15193 -13.48377 -11.58403 1.000 40.11811 C ? B ? 24 CD1 1
   ATOM 978 CD2 . TYR B 42 ? -9.53464 -12.98329 -13.45248 1.000 49.81227 C ? B ? 24 CD2 1
   ATOM 979 CE1 . TYR B 42 ? -7.02120 -13.49153 -12.41474 1.000 45.47107 C ? B ? 24 CE1 1
   ATOM 980 CE2 . TYR B 42 ? -8.41928 -12.99981 -14.30345 1.000 43.60037 C ? B ? 24 CE2 1
   ATOM 981 CZ . TYR B 42 ? -7.17183 -13.24050 -13.78780 1.000 46.17637 C ? B ? 24 CZ 1
   ATOM 982 OH . TYR B 42 ? -6.08179 -13.24592 -14.64056 1.000 45.87044 O ? B ? 24 OH 1
   ATOM 983 N . SER B 43 ? -13.31173 -14.81715 -9.91464 1.000 53.38577 N ? B ? 25 N 1
   ATOM 984 CA . SER B 43 ? -14.27308 -14.77955 -8.82758 1.000 54.39608 C ? B ? 25 CA 1
   ATOM 985 C . SER B 43 ? -14.33214 -16.10508 -8.08081 1.000 55.79245 C ? B ? 25 C 1
   ATOM 986 O . SER B 43 ? -14.96657 -16.17804 -7.02004 1.000 59.98393 O ? B ? 25 O 1
   ATOM 987 CB . SER B 43 ? -15.65521 -14.36727 -9.34403 1.000 48.60802 C ? B ? 25 CB 1
   ATOM 988 OG . SER B 43 ? -16.26627 -15.36788 -10.14048 1.000 48.13970 O ? B ? 25 OG 1
   ATOM 989 N A THR B 44 ? -13.66167 -17.13997 -8.59751 0.049 56.70238 N ? B ? 26 N 1
   ATOM 990 CA A THR B 44 ? -13.61773 -18.46229 -7.97934 0.049 58.18795 C ? B ? 26 CA 1
   ATOM 991 C A THR B 44 ? -12.22462 -18.80950 -7.47106 0.049 58.79306 C ? B ? 26 C 1
   ATOM 992 O A THR B 44 ? -12.05774 -19.06402 -6.27380 0.049 58.02939 O ? B ? 26 O 1
   ATOM 993 CB A THR B 44 ? -14.09616 -19.52734 -8.97638 0.049 59.69768 C ? B ? 26 CB 1
   ATOM 994 OG1 A THR B 44 ? -15.47287 -19.30068 -9.30252 0.049 59.95022 O ? B ? 26 OG1 1
   ATOM 995 CG2 A THR B 44 ? -13.93714 -20.92423 -8.38570 0.049 58.57586 C ? B ? 26 CG2 1
   ATOM 996 N B THR B 44 ? -13.67483 -17.13827 -8.59474 0.951 56.80219 N ? B ? 26 N 1
   ATOM 997 CA B THR B 44 ? -13.59978 -18.42766 -7.92429 0.951 58.28510 C ? B ? 26 CA 1
   ATOM 998 C B THR B 44 ? -12.18748 -18.72065 -7.44116 0.951 59.03507 C ? B ? 26 C 1
   ATOM 999 O B THR B 44 ? -11.96499 -18.82892 -6.23035 0.951 58.20129 O ? B ? 26 O 1
   ATOM 1000 CB B THR B 44 ? -14.09519 -19.53683 -8.85952 0.951 59.93004 C ? B ? 26 CB 1
   ATOM 1001 OG1 B THR B 44 ? -13.26500 -19.59665 -10.01753 0.951 58.50204 O ? B ? 26 OG1 1
   ATOM 1002 CG2 B THR B 44 ? -15.53873 -19.28564 -9.28686 0.951 60.05216 C ? B ? 26 CG2 1
   ATOM 1003 N . VAL B 45 ? -11.21495 -18.83703 -8.34650 1.000 52.43606 N ? B ? 27 N 1
   ATOM 1004 CA . VAL B 45 ? -9.86795 -19.17083 -7.91563 1.000 52.99023 C ? B ? 27 CA 1
   ATOM 1005 C . VAL B 45 ? -9.26437 -18.05603 -7.07689 1.000 54.86430 C ? B ? 27 C 1
   ATOM 1006 O . VAL B 45 ? -8.31535 -18.29651 -6.32330 1.000 59.67182 O ? B ? 27 O 1
   ATOM 1007 CB . VAL B 45 ? -8.99245 -19.51295 -9.13492 1.000 48.04097 C ? B ? 27 CB 1
   ATOM 1008 CG1 . VAL B 45 ? -7.59064 -19.88594 -8.72340 1.000 51.57208 C ? B ? 27 CG1 1
   ATOM 1009 CG2 . VAL B 45 ? -9.62630 -20.65798 -9.91114 1.000 59.96048 C ? B ? 27 CG2 1
   ATOM 1010 N . GLU B 46 ? -9.81657 -16.84821 -7.14132 1.000 53.87008 N ? B ? 28 N 1
   ATOM 1011 CA . GLU B 46 ? -9.27057 -15.71361 -6.41463 1.000 57.45134 C ? B ? 28 CA 1
   ATOM 1012 C . GLU B 46 ? -10.27666 -15.04623 -5.48975 1.000 45.61010 C ? B ? 28 C 1
   ATOM 1013 O . GLU B 46 ? -9.95350 -14.01372 -4.90377 1.000 49.26797 O ? B ? 28 O 1
   ATOM 1014 CB . GLU B 46 ? -8.70973 -14.67696 -7.39670 1.000 46.91311 C ? B ? 28 CB 1
   ATOM 1015 CG . GLU B 46 ? -7.54589 -15.19694 -8.21955 1.000 50.01536 C ? B ? 28 CG 1
   ATOM 1016 CD . GLU B 46 ? -6.25903 -15.38824 -7.40824 1.000 48.86985 C ? B ? 28 CD 1
   ATOM 1017 OE1 . GLU B 46 ? -5.94932 -14.55590 -6.53367 1.000 51.45565 O ? B ? 28 OE1 1
   ATOM 1018 OE2 . GLU B 46 ? -5.54931 -16.37515 -7.65750 1.000 56.63886 O ? B ? 28 OE2 1
   ATOM 1019 N . GLY B 47 ? -11.49263 -15.57189 -5.38231 1.000 62.02248 N ? B ? 29 N 1
   ATOM 1020 CA . GLY B 47 ? -12.44012 -15.10651 -4.38733 1.000 50.23499 C ? B ? 29 CA 1
   ATOM 1021 C . GLY B 47 ? -13.04197 -13.74310 -4.61965 1.000 65.32752 C ? B ? 29 C 1
   ATOM 1022 O . GLY B 47 ? -13.70676 -13.22508 -3.71997 1.000 58.88596 O ? B ? 29 O 1
   ATOM 1023 N . LEU B 48 ? -12.85202 -13.13548 -5.79160 1.000 50.83360 N ? B ? 30 N 1
   ATOM 1024 CA . LEU B 48 ? -13.36917 -11.79327 -5.98131 1.000 47.84510 C ? B ? 30 CA 1
   ATOM 1025 C . LEU B 48 ? -14.86341 -11.84027 -6.26232 1.000 43.12390 C ? B ? 30 C 1
   ATOM 1026 O . LEU B 48 ? -15.37478 -12.80621 -6.81731 1.000 53.29675 O ? B ? 30 O 1
   ATOM 1027 CB . LEU B 48 ? -12.63763 -11.10042 -7.13602 1.000 55.33721 C ? B ? 30 CB 1
   ATOM 1028 CG . LEU B 48 ? -11.10837 -11.06104 -7.11236 1.000 46.91651 C ? B ? 30 CG 1
   ATOM 1029 CD1 . LEU B 48 ? -10.54485 -10.27117 -8.33230 1.000 47.43948 C ? B ? 30 CD1 1
   ATOM 1030 CD2 . LEU B 48 ? -10.61634 -10.44127 -5.83150 1.000 51.52766 C ? B ? 30 CD2 1
   ATOM 1031 N . ARG B 49 ? -15.57016 -10.78403 -5.88657 1.000 46.88773 N ? B ? 31 N 1
   ATOM 1032 CA . ARG B 49 ? -16.93203 -10.63983 -6.37739 1.000 56.26173 C ? B ? 31 CA 1
   ATOM 1033 C . ARG B 49 ? -16.90728 -10.63209 -7.90592 1.000 60.75941 C ? B ? 31 C 1
   ATOM 1034 O . ARG B 49 ? -15.90482 -10.24611 -8.50245 1.000 54.72793 O ? B ? 31 O 1
   ATOM 1035 CB . ARG B 49 ? -17.55670 -9.35009 -5.87496 1.000 52.40270 C ? B ? 31 CB 1
   ATOM 1036 CG . ARG B 49 ? -17.39141 -9.11821 -4.39987 1.000 66.63396 C ? B ? 31 CG 1
   ATOM 1037 CD . ARG B 49 ? -18.49903 -8.21723 -3.89429 1.000 66.44166 C ? B ? 31 CD 1
   ATOM 1038 NE . ARG B 49 ? -18.31431 -6.81493 -4.25209 1.000 62.00615 N ? B ? 31 NE 1
   ATOM 1039 CZ . ARG B 49 ? -17.46957 -5.99484 -3.64048 1.000 69.72006 C ? B ? 31 CZ 1
   ATOM 1040 NH1 . ARG B 49 ? -16.66410 -6.42168 -2.67676 1.000 75.23312 N ? B ? 31 NH1 1
   ATOM 1041 NH2 . ARG B 49 ? -17.43162 -4.71231 -3.99949 1.000 74.24749 N ? B ? 31 NH2 1
   ATOM 1042 N . PRO B 50 ? -17.98211 -11.06834 -8.56432 1.000 60.10517 N ? B ? 32 N 1
   ATOM 1043 CA . PRO B 50 ? -17.94862 -11.07910 -10.03653 1.000 56.38290 C ? B ? 32 CA 1
   ATOM 1044 C . PRO B 50 ? -17.71848 -9.70511 -10.64057 1.000 59.47294 C ? B ? 32 C 1
   ATOM 1045 O . PRO B 50 ? -16.97869 -9.60446 -11.62224 1.000 52.30531 O ? B ? 32 O 1
   ATOM 1046 CB . PRO B 50 ? -19.30833 -11.66895 -10.42960 1.000 60.69427 C ? B ? 32 CB 1
   ATOM 1047 CG . PRO B 50 ? -20.09279 -11.75231 -9.20175 1.000 68.35646 C ? B ? 32 CG 1
   ATOM 1048 CD . PRO B 50 ? -19.17460 -11.73921 -8.02825 1.000 62.30071 C ? B ? 32 CD 1
   ATOM 1049 N . ILE B 51 ? -18.28436 -8.64287 -10.06078 1.000 58.75330 N ? B ? 33 N 1
   ATOM 1050 CA . ILE B 51 ? -18.03570 -7.29575 -10.57406 1.000 62.86213 C ? B ? 33 CA 1
   ATOM 1051 C . ILE B 51 ? -16.55978 -6.93405 -10.46164 1.000 60.66432 C ? B ? 33 C 1
   ATOM 1052 O . ILE B 51 ? -15.98707 -6.29606 -11.35759 1.000 51.76916 O ? B ? 33 O 1
   ATOM 1053 CB . ILE B 51 ? -18.91511 -6.27233 -9.84123 1.000 58.00447 C ? B ? 33 CB 1
   ATOM 1054 CG1 . ILE B 51 ? -18.50019 -4.85946 -10.23087 1.000 47.44463 C ? B ? 33 CG1 1
   ATOM 1055 CG2 . ILE B 51 ? -18.77626 -6.43043 -8.34853 1.000 60.80471 C ? B ? 33 CG2 1
   ATOM 1056 CD1 . ILE B 51 ? -19.46805 -3.83066 -9.74775 1.000 69.21513 C ? B ? 33 CD1 1
   ATOM 1057 N . ASP B 52 ? -15.92664 -7.31342 -9.35277 1.000 56.03120 N ? B ? 34 N 1
   ATOM 1058 CA . ASP B 52 ? -14.50225 -7.05654 -9.18929 1.000 54.24180 C ? B ? 34 CA 1
   ATOM 1059 C . ASP B 52 ? -13.66277 -7.95115 -10.09156 1.000 52.39835 C ? B ? 34 C 1
   ATOM 1060 O . ASP B 52 ? -12.60233 -7.52962 -10.56437 1.000 45.75642 O ? B ? 34 O 1
   ATOM 1061 CB . ASP B 52 ? -14.10892 -7.24469 -7.72552 1.000 56.39663 C ? B ? 34 CB 1
   ATOM 1062 CG . ASP B 52 ? -14.62286 -6.12003 -6.84278 1.000 57.51648 C ? B ? 34 CG 1
   ATOM 1063 OD1 . ASP B 52 ? -14.28465 -4.94658 -7.10696 1.000 63.13156 O ? B ? 34 OD1 1
   ATOM 1064 OD2 . ASP B 52 ? -15.37937 -6.40973 -5.88900 1.000 59.76478 O ? B ? 34 OD2 1
   ATOM 1065 N . ALA B 53 ? -14.12794 -9.17562 -10.35798 1.000 48.21260 N ? B ? 35 N 1
   ATOM 1066 CA . ALA B 53 ? -13.41801 -10.04267 -11.29251 1.000 54.81779 C ? B ? 35 CA 1
   ATOM 1067 C . ALA B 53 ? -13.60081 -9.58312 -12.74083 1.000 42.52509 C ? B ? 35 C 1
   ATOM 1068 O . ALA B 53 ? -12.74035 -9.85530 -13.58438 1.000 44.55227 O ? B ? 35 O 1
   ATOM 1069 CB . ALA B 53 ? -13.89838 -11.48286 -11.12795 1.000 46.25812 C ? B ? 35 CB 1
   ATOM 1070 N . LEU B 54 ? -14.73578 -8.94959 -13.04167 1.000 43.89206 N ? B ? 36 N 1
   ATOM 1071 CA . LEU B 54 ? -14.94913 -8.30771 -14.32915 1.000 50.46738 C ? B ? 36 CA 1
   ATOM 1072 C . LEU B 54 ? -14.05400 -7.09206 -14.48856 1.000 48.74232 C ? B ? 36 C 1
   ATOM 1073 O . LEU B 54 ? -13.19441 -7.04526 -15.38430 1.000 44.20110 O ? B ? 36 O 1
   ATOM 1074 CB . LEU B 54 ? -16.40947 -7.91278 -14.46917 1.000 42.40167 C ? B ? 36 CB 1
   ATOM 1075 CG . LEU B 54 ? -16.71005 -7.16878 -15.75897 1.000 42.48467 C ? B ? 36 CG 1
   ATOM 1076 CD1 . LEU B 54 ? -16.09993 -7.94293 -16.89549 1.000 40.88542 C ? B ? 36 CD1 1
   ATOM 1077 CD2 . LEU B 54 ? -18.21466 -6.97186 -15.97121 1.000 32.02157 C ? B ? 36 CD2 1
   ATOM 1078 N . TYR B 55 ? -14.25403 -6.09268 -13.63045 1.000 43.37643 N ? B ? 37 N 1
   ATOM 1079 CA . TYR B 55 ? -13.35756 -4.94433 -13.54825 1.000 46.73708 C ? B ? 37 CA 1
   ATOM 1080 C . TYR B 55 ? -11.88252 -5.32298 -13.67980 1.000 51.19146 C ? B ? 37 C 1
   ATOM 1081 O . TYR B 55 ? -11.15157 -4.70560 -14.46722 1.000 45.60488 O ? B ? 37 O 1
   ATOM 1082 CB . TYR B 55 ? -13.62188 -4.23273 -12.22556 1.000 41.78756 C ? B ? 37 CB 1
   ATOM 1083 CG . TYR B 55 ? -12.70995 -3.10487 -11.85574 1.000 41.52475 C ? B ? 37 CG 1
   ATOM 1084 CD1 . TYR B 55 ? -12.84602 -1.82641 -12.40800 1.000 42.16419 C ? B ? 37 CD1 1
   ATOM 1085 CD2 . TYR B 55 ? -11.76603 -3.28513 -10.85422 1.000 45.70341 C ? B ? 37 CD2 1
   ATOM 1086 CE1 . TYR B 55 ? -12.01559 -0.76638 -11.98612 1.000 39.44270 C ? B ? 37 CE1 1
   ATOM 1087 CE2 . TYR B 55 ? -10.94465 -2.26305 -10.45352 1.000 46.64949 C ? B ? 37 CE2 1
   ATOM 1088 CZ . TYR B 55 ? -11.04673 -1.02491 -11.00890 1.000 43.46826 C ? B ? 37 CZ 1
   ATOM 1089 OH . TYR B 55 ? -10.18107 -0.06780 -10.52493 1.000 47.98825 O ? B ? 37 OH 1
   ATOM 1090 N . PHE B 56 ? -11.42258 -6.34685 -12.93093 1.000 44.67368 N ? B ? 38 N 1
   ATOM 1091 CA . PHE B 56 ? -10.00229 -6.72006 -12.96304 1.000 45.55927 C ? B ? 38 CA 1
   ATOM 1092 C . PHE B 56 ? -9.59341 -7.34021 -14.30213 1.000 42.01820 C ? B ? 38 C 1
   ATOM 1093 O . PHE B 56 ? -8.45681 -7.12861 -14.74944 1.000 42.06686 O ? B ? 38 O 1
   ATOM 1094 CB . PHE B 56 ? -9.65332 -7.70134 -11.83189 1.000 39.81114 C ? B ? 38 CB 1
   ATOM 1095 CG . PHE B 56 ? -8.25238 -8.27995 -11.92646 1.000 39.67959 C ? B ? 38 CG 1
   ATOM 1096 CD1 . PHE B 56 ? -7.14241 -7.47151 -11.78546 1.000 41.20121 C ? B ? 38 CD1 1
   ATOM 1097 CD2 . PHE B 56 ? -8.04781 -9.62865 -12.14869 1.000 40.05682 C ? B ? 38 CD2 1
   ATOM 1098 CE1 . PHE B 56 ? -5.85978 -7.99983 -11.86312 1.000 40.15213 C ? B ? 38 CE1 1
   ATOM 1099 CE2 . PHE B 56 ? -6.75444 -10.15367 -12.21864 1.000 42.25628 C ? B ? 38 CE2 1
   ATOM 1100 CZ . PHE B 56 ? -5.67679 -9.33690 -12.08899 1.000 38.37501 C ? B ? 38 CZ 1
   ATOM 1101 N . SER B 57 ? -10.46835 -8.17417 -14.90338 1.000 39.36701 N ? B ? 39 N 1
   ATOM 1102 CA . SER B 57 ? -10.20709 -8.72397 -16.23501 1.000 37.45650 C ? B ? 39 CA 1
   ATOM 1103 C . SER B 57 ? -10.00758 -7.60395 -17.25009 1.000 39.92616 C ? B ? 39 C 1
   ATOM 1104 O . SER B 57 ? -9.05083 -7.63152 -18.04096 1.000 36.18984 O ? B ? 39 O 1
   ATOM 1105 CB . SER B 57 ? -11.34535 -9.65714 -16.66742 1.000 41.53517 C ? B ? 39 CB 1
   ATOM 1106 OG . SER B 57 ? -11.47388 -10.79462 -15.80567 1.000 48.59771 O ? B ? 39 OG 1
   ATOM 1107 N . VAL B 58 ? -10.86602 -6.58881 -17.19759 1.000 40.09756 N ? B ? 40 N 1
   ATOM 1108 CA . VAL B 58 ? -10.77993 -5.44518 -18.10423 1.000 43.39600 C ? B ? 40 CA 1
   ATOM 1109 C . VAL B 58 ? -9.52051 -4.62697 -17.83994 1.000 40.42888 C ? B ? 40 C 1
   ATOM 1110 O . VAL B 58 ? -8.74745 -4.31824 -18.76258 1.000 31.88096 O ? B ? 40 O 1
   ATOM 1111 CB . VAL B 58 ? -12.04933 -4.57749 -17.98479 1.000 34.38240 C ? B ? 40 CB 1
   ATOM 1112 CG1 . VAL B 58 ? -11.88153 -3.23178 -18.76769 1.000 32.65540 C ? B ? 40 CG1 1
   ATOM 1113 CG2 . VAL B 58 ? -13.24270 -5.35715 -18.47103 1.000 32.10880 C ? B ? 40 CG2 1
   ATOM 1114 N . VAL B 59 ? -9.29494 -4.24074 -16.58112 1.000 32.15790 N ? B ? 41 N 1
   ATOM 1115 CA . VAL B 59 ? -8.15447 -3.41051 -16.26066 1.000 29.35759 C ? B ? 41 CA 1
   ATOM 1116 C . VAL B 59 ? -6.88598 -4.15010 -16.63543 1.000 32.37179 C ? B ? 41 C 1
   ATOM 1117 O . VAL B 59 ? -5.87518 -3.52879 -16.95538 1.000 34.22061 O ? B ? 41 O 1
   ATOM 1118 CB . VAL B 59 ? -8.17929 -2.99866 -14.75323 1.000 42.03829 C ? B ? 41 CB 1
   ATOM 1119 CG1 . VAL B 59 ? -6.80979 -2.69169 -14.23030 1.000 39.55708 C ? B ? 41 CG1 1
   ATOM 1120 CG2 . VAL B 59 ? -9.03670 -1.78058 -14.53742 1.000 37.65586 C ? B ? 41 CG2 1
   ATOM 1121 N . THR B 60 ? -6.91582 -5.48321 -16.62094 1.000 29.59891 N ? B ? 42 N 1
   ATOM 1122 CA . THR B 60 ? -5.72077 -6.25183 -16.94851 1.000 32.13367 C ? B ? 42 CA 1
   ATOM 1123 C . THR B 60 ? -5.49481 -6.33057 -18.46315 1.000 30.14392 C ? B ? 42 C 1
   ATOM 1124 O . THR B 60 ? -4.38585 -6.05731 -18.93595 1.000 31.52132 O ? B ? 42 O 1
   ATOM 1125 CB . THR B 60 ? -5.80248 -7.67015 -16.37986 1.000 38.25150 C ? B ? 42 CB 1
   ATOM 1126 OG1 . THR B 60 ? -5.79966 -7.62344 -14.93578 1.000 40.61002 O ? B ? 42 OG1 1
   ATOM 1127 CG2 . THR B 60 ? -4.63485 -8.52191 -16.86929 1.000 36.14030 C ? B ? 42 CG2 1
   ATOM 1128 N . LEU B 61 ? -6.49934 -6.78356 -19.21364 1.000 29.13768 N ? B ? 43 N 1
   ATOM 1129 CA . LEU B 61 ? -6.27677 -7.01569 -20.64972 1.000 31.18069 C ? B ? 43 CA 1
   ATOM 1130 C . LEU B 61 ? -6.07225 -5.70595 -21.42141 1.000 32.95525 C ? B ? 43 C 1
   ATOM 1131 O . LEU B 61 ? -5.56328 -5.75077 -22.54680 1.000 33.44450 O ? B ? 43 O 1
   ATOM 1132 CB . LEU B 61 ? -7.43843 -7.80257 -21.24769 1.000 28.83251 C ? B ? 43 CB 1
   ATOM 1133 CG . LEU B 61 ? -7.46972 -9.24596 -20.75161 1.000 30.07917 C ? B ? 43 CG 1
   ATOM 1134 CD1 . LEU B 61 ? -8.57547 -10.01282 -21.44115 1.000 36.33076 C ? B ? 43 CD1 1
   ATOM 1135 CD2 . LEU B 61 ? -6.07394 -9.91269 -21.01480 1.000 30.48657 C ? B ? 43 CD2 1
   ATOM 1136 N . THR B 62 ? -6.51813 -4.56554 -20.88019 1.000 30.48019 N ? B ? 44 N 1
   ATOM 1137 CA . THR B 62 ? -6.27286 -3.24165 -21.49612 1.000 28.06735 C ? B ? 44 CA 1
   ATOM 1138 C . THR B 62 ? -4.93382 -2.64451 -21.07529 1.000 30.17239 C ? B ? 44 C 1
   ATOM 1139 O . THR B 62 ? -4.58192 -1.53422 -21.53320 1.000 29.52246 O ? B ? 44 O 1
   ATOM 1140 CB . THR B 62 ? -7.39703 -2.24226 -21.16233 1.000 30.67677 C ? B ? 44 CB 1
   ATOM 1141 OG1 . THR B 62 ? -7.42211 -1.97092 -19.73278 1.000 35.51329 O ? B ? 44 OG1 1
   ATOM 1142 CG2 . THR B 62 ? -8.77298 -2.77973 -21.60060 1.000 29.01703 C ? B ? 44 CG2 1
   ATOM 1143 N . THR B 63 ? -4.16559 -3.38106 -20.26794 1.000 29.70930 N ? B ? 45 N 1
   ATOM 1144 CA . THR B 63 ? -2.85311 -3.02013 -19.73622 1.000 30.78479 C ? B ? 45 CA 1
   ATOM 1145 C . THR B 63 ? -2.89994 -1.81131 -18.81818 1.000 34.44673 C ? B ? 45 C 1
   ATOM 1146 O . THR B 63 ? -1.87127 -1.19920 -18.56740 1.000 34.40180 O ? B ? 45 O 1
   ATOM 1147 CB . THR B 63 ? -1.78766 -2.76056 -20.81369 1.000 35.11803 C ? B ? 45 CB 1
   ATOM 1148 OG1 . THR B 63 ? -2.02743 -1.50334 -21.45600 1.000 34.65331 O ? B ? 45 OG1 1
   ATOM 1149 CG2 . THR B 63 ? -1.82206 -3.86049 -21.81032 1.000 28.36887 C ? B ? 45 CG2 1
   ATOM 1150 N A VAL B 64 ? -4.06886 -1.44101 -18.30036 0.897 34.71227 N ? B ? 46 N 1
   ATOM 1151 CA A VAL B 64 ? -4.08703 -0.33061 -17.35258 0.897 30.48931 C ? B ? 46 CA 1
   ATOM 1152 C A VAL B 64 ? -3.43144 -0.75254 -16.03530 0.897 30.82836 C ? B ? 46 C 1
   ATOM 1153 O A VAL B 64 ? -2.53848 -0.07699 -15.51608 0.897 32.15446 O ? B ? 46 O 1
   ATOM 1154 CB A VAL B 64 ? -5.52491 0.18005 -17.14794 0.897 34.25333 C ? B ? 46 CB 1
   ATOM 1155 CG1 A VAL B 64 ? -5.52814 1.17581 -15.99175 0.897 34.66534 C ? B ? 46 CG1 1
   ATOM 1156 CG2 A VAL B 64 ? -6.08638 0.85868 -18.43779 0.897 30.90889 C ? B ? 46 CG2 1
   ATOM 1157 N B VAL B 64 ? -4.07748 -1.44691 -18.30770 0.103 34.50462 N ? B ? 46 N 1
   ATOM 1158 CA B VAL B 64 ? -4.14418 -0.34280 -17.35422 0.103 30.72801 C ? B ? 46 CA 1
   ATOM 1159 C B VAL B 64 ? -3.46573 -0.73755 -16.04668 0.103 31.05593 C ? B ? 46 C 1
   ATOM 1160 O B VAL B 64 ? -2.59047 -0.02653 -15.54330 0.103 32.24719 O ? B ? 46 O 1
   ATOM 1161 CB B VAL B 64 ? -5.60316 0.09796 -17.13599 0.103 34.01674 C ? B ? 46 CB 1
   ATOM 1162 CG1 B VAL B 64 ? -5.67718 1.11306 -16.00611 0.103 34.60127 C ? B ? 46 CG1 1
   ATOM 1163 CG2 B VAL B 64 ? -6.17611 0.69905 -18.41843 0.103 31.19791 C ? B ? 46 CG2 1
   ATOM 1164 N . GLY B 65 ? -3.85520 -1.87828 -15.48437 1.000 38.24033 N ? B ? 47 N 1
   ATOM 1165 CA . GLY B 65 ? -3.13123 -2.49623 -14.38902 1.000 32.30222 C ? B ? 47 CA 1
   ATOM 1166 C . GLY B 65 ? -3.02250 -1.71818 -13.08202 1.000 38.72582 C ? B ? 47 C 1
   ATOM 1167 O . GLY B 65 ? -1.93597 -1.62301 -12.52250 1.000 37.67690 O ? B ? 47 O 1
   ATOM 1168 N . TYR B 66 ? -4.13797 -1.18898 -12.57771 1.000 35.39623 N ? B ? 48 N 1
   ATOM 1169 CA . TYR B 66 ? -4.10886 -0.42959 -11.33008 1.000 43.74647 C ? B ? 48 CA 1
   ATOM 1170 C . TYR B 66 ? -3.30009 -1.15624 -10.25063 1.000 36.98345 C ? B ? 48 C 1
   ATOM 1171 O . TYR B 66 ? -2.40229 -0.57588 -9.63571 1.000 42.65704 O ? B ? 48 O 1
   ATOM 1172 CB . TYR B 66 ? -5.53970 -0.17561 -10.86499 1.000 37.48114 C ? B ? 48 CB 1
   ATOM 1173 CG . TYR B 66 ? -6.35505 0.78936 -11.73113 1.000 38.71853 C ? B ? 48 CG 1
   ATOM 1174 CD1 . TYR B 66 ? -5.85068 2.04614 -12.09175 1.000 32.75744 C ? B ? 48 CD1 1
   ATOM 1175 CD2 . TYR B 66 ? -7.58341 0.41333 -12.22572 1.000 40.92116 C ? B ? 48 CD2 1
   ATOM 1176 CE1 . TYR B 66 ? -6.60405 2.91331 -12.87544 1.000 37.58660 C ? B ? 48 CE1 1
   ATOM 1177 CE2 . TYR B 66 ? -8.34944 1.28555 -13.00813 1.000 39.35983 C ? B ? 48 CE2 1
   ATOM 1178 CZ . TYR B 66 ? -7.84515 2.53941 -13.31563 1.000 33.98999 C ? B ? 48 CZ 1
   ATOM 1179 OH . TYR B 66 ? -8.58435 3.39389 -14.11010 1.000 42.37822 O ? B ? 48 OH 1
   ATOM 1180 N . GLY B 67 ? -3.53903 -2.43841 -10.08343 1.000 37.43511 N ? B ? 49 N 1
   ATOM 1181 CA . GLY B 67 ? -2.95551 -3.19738 -9.00278 1.000 48.11416 C ? B ? 49 CA 1
   ATOM 1182 C . GLY B 67 ? -3.78083 -3.14996 -7.73883 1.000 58.36403 C ? B ? 49 C 1
   ATOM 1183 O . GLY B 67 ? -3.38256 -3.75653 -6.72745 1.000 55.82560 O ? B ? 49 O 1
   ATOM 1184 N . ASP B 68 ? -4.91416 -2.43745 -7.76871 1.000 51.83772 N ? B ? 50 N 1
   ATOM 1185 CA . ASP B 68 ? -5.88076 -2.50757 -6.67674 1.000 52.89134 C ? B ? 50 CA 1
   ATOM 1186 C . ASP B 68 ? -6.30715 -3.94903 -6.42483 1.000 56.09072 C ? B ? 50 C 1
   ATOM 1187 O . ASP B 68 ? -6.50055 -4.36093 -5.27377 1.000 54.21180 O ? B ? 50 O 1
   ATOM 1188 CB . ASP B 68 ? -7.07102 -1.56463 -6.96569 1.000 43.91910 C ? B ? 50 CB 1
   ATOM 1189 CG . ASP B 68 ? -7.87345 -1.91798 -8.25787 1.000 53.88292 C ? B ? 50 CG 1
   ATOM 1190 OD1 . ASP B 68 ? -9.01021 -1.39596 -8.37884 1.000 46.87436 O ? B ? 50 OD1 1
   ATOM 1191 OD2 . ASP B 68 ? -7.41347 -2.70250 -9.13277 1.000 45.05842 O ? B ? 50 OD2 1
   ATOM 1192 N . PHE B 69 ? -6.40600 -4.74171 -7.47981 1.000 54.48442 N ? B ? 51 N 1
   ATOM 1193 CA . PHE B 69 ? -6.48311 -6.18774 -7.37877 1.000 48.07329 C ? B ? 51 CA 1
   ATOM 1194 C . PHE B 69 ? -5.29978 -6.77335 -8.14144 1.000 57.75947 C ? B ? 51 C 1
   ATOM 1195 O . PHE B 69 ? -4.74899 -6.12606 -9.03933 1.000 56.85174 O ? B ? 51 O 1
   ATOM 1196 CB . PHE B 69 ? -7.81114 -6.72185 -7.93627 1.000 51.64522 C ? B ? 51 CB 1
   ATOM 1197 CG . PHE B 69 ? -9.05005 -6.08717 -7.31401 1.000 54.46683 C ? B ? 51 CG 1
   ATOM 1198 CD1 . PHE B 69 ? -9.41227 -4.77889 -7.61220 1.000 49.95140 C ? B ? 51 CD1 1
   ATOM 1199 CD2 . PHE B 69 ? -9.85964 -6.81045 -6.44485 1.000 61.73289 C ? B ? 51 CD2 1
   ATOM 1200 CE1 . PHE B 69 ? -10.55903 -4.18370 -7.04971 1.000 60.78897 C ? B ? 51 CE1 1
   ATOM 1201 CE2 . PHE B 69 ? -11.01196 -6.22448 -5.86896 1.000 54.89582 C ? B ? 51 CE2 1
   ATOM 1202 CZ . PHE B 69 ? -11.36022 -4.90960 -6.17515 1.000 62.74241 C ? B ? 51 CZ 1
   ATOM 1203 N . SER B 70 ? -4.89453 -7.97844 -7.76272 1.000 52.47868 N ? B ? 52 N 1
   ATOM 1204 CA . SER B 70 ? -3.88237 -8.75531 -8.46828 1.000 58.93908 C ? B ? 52 CA 1
   ATOM 1205 C . SER B 70 ? -3.95959 -10.19640 -7.96815 1.000 64.49026 C ? B ? 52 C 1
   ATOM 1206 O . SER B 70 ? -4.52194 -10.44774 -6.89919 1.000 67.88763 O ? B ? 52 O 1
   ATOM 1207 CB . SER B 70 ? -2.47337 -8.18773 -8.23882 1.000 50.54336 C ? B ? 52 CB 1
   ATOM 1208 OG . SER B 70 ? -2.22987 -8.04805 -6.85377 1.000 65.94445 O ? B ? 52 OG 1
   ATOM 1209 N . PRO B 71 ? -3.41323 -11.15328 -8.71934 1.000 58.83724 N ? B ? 53 N 1
   ATOM 1210 CA . PRO B 71 ? -3.46493 -12.55047 -8.26236 1.000 59.86213 C ? B ? 53 CA 1
   ATOM 1211 C . PRO B 71 ? -2.47594 -12.81016 -7.12866 1.000 55.86182 C ? B ? 53 C 1
   ATOM 1212 O . PRO B 71 ? -1.33978 -12.32899 -7.14734 1.000 50.18072 O ? B ? 53 O 1
   ATOM 1213 CB . PRO B 71 ? -3.11717 -13.35335 -9.52210 1.000 53.93003 C ? B ? 53 CB 1
   ATOM 1214 CG . PRO B 71 ? -2.39447 -12.40542 -10.39737 1.000 49.56893 C ? B ? 53 CG 1
   ATOM 1215 CD . PRO B 71 ? -2.98072 -11.05626 -10.12733 1.000 54.95219 C ? B ? 53 CD 1
   ATOM 1216 N . GLN B 72 ? -2.94126 -13.54816 -6.11653 1.000 63.34228 N ? B ? 54 N 1
   ATOM 1217 CA . GLN B 72 ? -2.11810 -13.94334 -4.97950 1.000 60.35016 C ? B ? 54 CA 1
   ATOM 1218 C . GLN B 72 ? -1.80856 -15.42695 -4.94743 1.000 55.95835 C ? B ? 54 C 1
   ATOM 1219 O . GLN B 72 ? -0.78352 -15.81304 -4.38130 1.000 57.31502 O ? B ? 54 O 1
   ATOM 1220 CB . GLN B 72 ? -2.79911 -13.55980 -3.65624 1.000 60.62957 C ? B ? 54 CB 1
   ATOM 1221 CG . GLN B 72 ? -3.19308 -12.09198 -3.52450 1.000 59.57858 C ? B ? 54 CG 1
   ATOM 1222 CD . GLN B 72 ? -2.01658 -11.15555 -3.22204 1.000 77.08364 C ? B ? 54 CD 1
   ATOM 1223 OE1 . GLN B 72 ? -0.90424 -11.33025 -3.73590 1.000 63.62488 O ? B ? 54 OE1 1
   ATOM 1224 NE2 . GLN B 72 ? -2.26796 -10.14971 -2.38034 1.000 78.92664 N ? B ? 54 NE2 1
   ATOM 1225 N . THR B 73 ? -2.67063 -16.26736 -5.52421 1.000 53.89556 N ? B ? 55 N 1
   ATOM 1226 CA . THR B 73 ? -2.36958 -17.68701 -5.62047 1.000 48.92134 C ? B ? 55 CA 1
   ATOM 1227 C . THR B 73 ? -1.49331 -17.95596 -6.83325 1.000 60.25325 C ? B ? 55 C 1
   ATOM 1228 O . THR B 73 ? -1.37059 -17.12445 -7.74056 1.000 59.42806 O ? B ? 55 O 1
   ATOM 1229 CB . THR B 73 ? -3.63921 -18.53568 -5.71677 1.000 56.73236 C ? B ? 55 CB 1
   ATOM 1230 OG1 . THR B 73 ? -4.07630 -18.60994 -7.07830 1.000 54.31669 O ? B ? 55 OG1 1
   ATOM 1231 CG2 . THR B 73 ? -4.74334 -17.94615 -4.87322 1.000 59.55591 C ? B ? 55 CG2 1
   ATOM 1232 N . ASP B 74 ? -0.87906 -19.13769 -6.84427 1.000 50.81788 N ? B ? 56 N 1
   ATOM 1233 CA . ASP B 74 ? 0.03307 -19.46676 -7.93353 1.000 58.86442 C ? B ? 56 CA 1
   ATOM 1234 C . ASP B 74 ? -0.72843 -19.83405 -9.18824 1.000 62.34144 C ? B ? 56 C 1
   ATOM 1235 O . ASP B 74 ? -0.29654 -19.51754 -10.30843 1.000 57.87039 O ? B ? 56 O 1
   ATOM 1236 CB . ASP B 74 ? 0.93905 -20.62678 -7.54604 1.000 62.97382 C ? B ? 56 CB 1
   ATOM 1237 CG . ASP B 74 ? 2.01283 -20.23092 -6.56672 1.000 47.56584 C ? B ? 56 CG 1
   ATOM 1238 OD1 . ASP B 74 ? 1.93994 -19.11209 -6.01365 1.000 56.24825 O ? B ? 56 OD1 1
   ATOM 1239 OD2 . ASP B 74 ? 2.90951 -21.06815 -6.36272 1.000 66.03381 O ? B ? 56 OD2 1
   ATOM 1240 N . PHE B 75 ? -1.83800 -20.54425 -9.01131 1.000 57.19103 N ? B ? 57 N 1
   ATOM 1241 CA . PHE B 75 ? -2.68991 -20.85454 -10.14373 1.000 61.12703 C ? B ? 57 CA 1
   ATOM 1242 C . PHE B 75 ? -3.14085 -19.57910 -10.83689 1.000 57.43574 C ? B ? 57 C 1
   ATOM 1243 O . PHE B 75 ? -3.18924 -19.51149 -12.07163 1.000 51.01066 O ? B ? 57 O 1
   ATOM 1244 CB . PHE B 75 ? -3.89616 -21.65238 -9.66520 1.000 58.48371 C ? B ? 57 CB 1
   ATOM 1245 CG . PHE B 75 ? -4.60411 -22.34402 -10.75198 1.000 56.15570 C ? B ? 57 CG 1
   ATOM 1246 CD1 . PHE B 75 ? -3.90882 -22.76622 -11.87100 1.000 61.94703 C ? B ? 57 CD1 1
   ATOM 1247 CD2 . PHE B 75 ? -5.96281 -22.56534 -10.67660 1.000 64.23060 C ? B ? 57 CD2 1
   ATOM 1248 CE1 . PHE B 75 ? -4.55659 -23.40759 -12.89224 1.000 55.95586 C ? B ? 57 CE1 1
   ATOM 1249 CE2 . PHE B 75 ? -6.62121 -23.20814 -11.69759 1.000 50.48508 C ? B ? 57 CE2 1
   ATOM 1250 CZ . PHE B 75 ? -5.91691 -23.62872 -12.80719 1.000 65.05044 C ? B ? 57 CZ 1
   ATOM 1251 N . GLY B 76 ? -3.47706 -18.56468 -10.04048 1.000 51.57550 N ? B ? 58 N 1
   ATOM 1252 CA . GLY B 76 ? -3.86785 -17.28669 -10.58771 1.000 57.42530 C ? B ? 58 CA 1
   ATOM 1253 C . GLY B 76 ? -2.76463 -16.64969 -11.40404 1.000 56.77019 C ? B ? 58 C 1
   ATOM 1254 O . GLY B 76 ? -3.01179 -16.13712 -12.48953 1.000 52.84906 O ? B ? 58 O 1
   ATOM 1255 N . LYS B 77 ? -1.53465 -16.67132 -10.89497 1.000 53.38944 N ? B ? 59 N 1
   ATOM 1256 CA . LYS B 77 ? -0.44237 -15.99657 -11.59334 1.000 54.76889 C ? B ? 59 CA 1
   ATOM 1257 C . LYS B 77 ? -0.07802 -16.70799 -12.88803 1.000 58.12598 C ? B ? 59 C 1
   ATOM 1258 O . LYS B 77 ? 0.26246 -16.06124 -13.88957 1.000 42.66163 O ? B ? 59 O 1
   ATOM 1259 CB . LYS B 77 ? 0.77350 -15.89289 -10.67514 1.000 55.25011 C ? B ? 59 CB 1
   ATOM 1260 CG . LYS B 77 ? 0.55473 -14.98251 -9.50674 1.000 42.71465 C ? B ? 59 CG 1
   ATOM 1261 CD . LYS B 77 ? 1.83486 -14.88900 -8.68247 1.000 48.71065 C ? B ? 59 CD 1
   ATOM 1262 CE . LYS B 77 ? 1.59182 -14.23723 -7.34063 1.000 49.77185 C ? B ? 59 CE 1
   ATOM 1263 NZ . LYS B 77 ? 2.40550 -14.96153 -6.30074 1.000 58.24518 N ? B ? 59 NZ 1
   ATOM 1264 N . ILE B 78 ? -0.11410 -18.03947 -12.87967 1.000 50.38420 N ? B ? 60 N 1
   ATOM 1265 CA . ILE B 78 ? 0.10058 -18.78771 -14.10571 1.000 47.43791 C ? B ? 60 CA 1
   ATOM 1266 C . ILE B 78 ? -1.01253 -18.48047 -15.09556 1.000 54.96912 C ? B ? 60 C 1
   ATOM 1267 O . ILE B 78 ? -0.75558 -18.22214 -16.28075 1.000 44.60226 O ? B ? 60 O 1
   ATOM 1268 CB . ILE B 78 ? 0.20084 -20.29308 -13.79336 1.000 47.13857 C ? B ? 60 CB 1
   ATOM 1269 CG1 . ILE B 78 ? 1.50915 -20.58309 -13.05740 1.000 47.53587 C ? B ? 60 CG1 1
   ATOM 1270 CG2 . ILE B 78 ? 0.11604 -21.12978 -15.08060 1.000 40.74938 C ? B ? 60 CG2 1
   ATOM 1271 CD1 . ILE B 78 ? 2.74736 -20.41496 -13.91425 1.000 53.37381 C ? B ? 60 CD1 1
   ATOM 1272 N . PHE B 79 ? -2.26258 -18.46401 -14.61030 1.000 48.55001 N ? B ? 61 N 1
   ATOM 1273 CA . PHE B 79 ? -3.40467 -18.16016 -15.47111 1.000 51.79361 C ? B ? 61 CA 1
   ATOM 1274 C . PHE B 79 ? -3.32426 -16.74216 -16.01365 1.000 49.65684 C ? B ? 61 C 1
   ATOM 1275 O . PHE B 79 ? -3.73932 -16.48477 -17.14475 1.000 40.40868 O ? B ? 61 O 1
   ATOM 1276 CB . PHE B 79 ? -4.71935 -18.33185 -14.71119 1.000 50.87065 C ? B ? 61 CB 1
   ATOM 1277 CG . PHE B 79 ? -5.91229 -17.76732 -15.43584 1.000 48.87859 C ? B ? 61 CG 1
   ATOM 1278 CD1 . PHE B 79 ? -6.54426 -18.50154 -16.41840 1.000 45.10293 C ? B ? 61 CD1 1
   ATOM 1279 CD2 . PHE B 79 ? -6.38361 -16.49804 -15.14935 1.000 50.58675 C ? B ? 61 CD2 1
   ATOM 1280 CE1 . PHE B 79 ? -7.63025 -17.99315 -17.09056 1.000 51.52954 C ? B ? 61 CE1 1
   ATOM 1281 CE2 . PHE B 79 ? -7.47291 -15.98187 -15.82477 1.000 49.13926 C ? B ? 61 CE2 1
   ATOM 1282 CZ . PHE B 79 ? -8.08848 -16.72400 -16.80242 1.000 44.50449 C ? B ? 61 CZ 1
   ATOM 1283 N . THR B 80 ? -2.84979 -15.80374 -15.19541 1.000 40.18686 N ? B ? 62 N 1
   ATOM 1284 CA . THR B 80 ? -2.77955 -14.40498 -15.60530 1.000 46.67157 C ? B ? 62 CA 1
   ATOM 1285 C . THR B 80 ? -1.71220 -14.20463 -16.67422 1.000 44.45413 C ? B ? 62 C 1
   ATOM 1286 O . THR B 80 ? -1.89280 -13.38644 -17.58556 1.000 42.97400 O ? B ? 62 O 1
   ATOM 1287 CB . THR B 80 ? -2.52197 -13.52817 -14.37521 1.000 44.05340 C ? B ? 62 CB 1
   ATOM 1288 OG1 . THR B 80 ? -3.66882 -13.59328 -13.51719 1.000 43.08066 O ? B ? 62 OG1 1
   ATOM 1289 CG2 . THR B 80 ? -2.25384 -12.06933 -14.73964 1.000 37.04703 C ? B ? 62 CG2 1
   ATOM 1290 N . ILE B 81 ? -0.60551 -14.95772 -16.59243 1.000 37.63017 N ? B ? 63 N 1
   ATOM 1291 CA . ILE B 81 ? 0.39119 -14.95421 -17.66435 1.000 39.85283 C ? B ? 63 CA 1
   ATOM 1292 C . ILE B 81 ? -0.25111 -15.36520 -18.97170 1.000 47.52298 C ? B ? 63 C 1
   ATOM 1293 O . ILE B 81 ? -0.09002 -14.71047 -20.01353 1.000 35.70452 O ? B ? 63 O 1
   ATOM 1294 CB . ILE B 81 ? 1.55707 -15.89846 -17.33940 1.000 40.98046 C ? B ? 63 CB 1
   ATOM 1295 CG1 . ILE B 81 ? 2.39442 -15.35892 -16.17916 1.000 42.78503 C ? B ? 63 CG1 1
   ATOM 1296 CG2 . ILE B 81 ? 2.41583 -16.09621 -18.60841 1.000 45.57108 C ? B ? 63 CG2 1
   ATOM 1297 CD1 . ILE B 81 ? 3.60126 -16.27098 -15.76083 1.000 38.57995 C ? B ? 63 CD1 1
   ATOM 1298 N . LEU B 82 ? -0.97451 -16.47499 -18.94124 1.000 36.90147 N ? B ? 64 N 1
   ATOM 1299 CA . LEU B 82 ? -1.56373 -16.95924 -20.16776 1.000 33.14883 C ? B ? 64 CA 1
   ATOM 1300 C . LEU B 82 ? -2.70155 -16.05035 -20.61344 1.000 35.94993 C ? B ? 64 C 1
   ATOM 1301 O . LEU B 82 ? -2.86507 -15.82266 -21.81079 1.000 37.79589 O ? B ? 64 O 1
   ATOM 1302 CB . LEU B 82 ? -2.05785 -18.39077 -19.98522 1.000 50.29788 C ? B ? 64 CB 1
   ATOM 1303 CG . LEU B 82 ? -0.96144 -19.42348 -19.66829 1.000 52.08695 C ? B ? 64 CG 1
   ATOM 1304 CD1 . LEU B 82 ? -1.58539 -20.76844 -19.28762 1.000 51.43993 C ? B ? 64 CD1 1
   ATOM 1305 CD2 . LEU B 82 ? 0.01813 -19.57743 -20.82719 1.000 43.97280 C ? B ? 64 CD2 1
   ATOM 1306 N . TYR B 83 ? -3.52329 -15.58196 -19.67299 1.000 33.29773 N ? B ? 65 N 1
   ATOM 1307 CA . TYR B 83 ? -4.67658 -14.74154 -20.00002 1.000 35.46026 C ? B ? 65 CA 1
   ATOM 1308 C . TYR B 83 ? -4.20163 -13.45599 -20.68243 1.000 30.95786 C ? B ? 65 C 1
   ATOM 1309 O . TYR B 83 ? -4.79623 -13.00760 -21.66608 1.000 32.52811 O ? B ? 65 O 1
   ATOM 1310 CB . TYR B 83 ? -5.45574 -14.42384 -18.71013 1.000 38.79415 C ? B ? 65 CB 1
   ATOM 1311 CG . TYR B 83 ? -6.81817 -13.75160 -18.80782 1.000 33.74487 C ? B ? 65 CG 1
   ATOM 1312 CD1 . TYR B 83 ? -7.86868 -14.29810 -19.56978 1.000 38.23499 C ? B ? 65 CD1 1
   ATOM 1313 CD2 . TYR B 83 ? -7.09207 -12.60386 -18.07803 1.000 28.95150 C ? B ? 65 CD2 1
   ATOM 1314 CE1 . TYR B 83 ? -9.12434 -13.67052 -19.62294 1.000 32.05652 C ? B ? 65 CE1 1
   ATOM 1315 CE2 . TYR B 83 ? -8.32658 -11.99091 -18.14875 1.000 28.54509 C ? B ? 65 CE2 1
   ATOM 1316 CZ . TYR B 83 ? -9.33023 -12.51770 -18.90057 1.000 32.64638 C ? B ? 65 CZ 1
   ATOM 1317 OH . TYR B 83 ? -10.55417 -11.85774 -18.90770 1.000 36.25904 O ? B ? 65 OH 1
   ATOM 1318 N . ILE B 84 ? -3.10967 -12.87675 -20.18522 1.000 31.83922 N ? B ? 66 N 1
   ATOM 1319 CA . ILE B 84 ? -2.59311 -11.63803 -20.76686 1.000 36.53136 C ? B ? 66 CA 1
   ATOM 1320 C . ILE B 84 ? -2.11962 -11.87217 -22.19858 1.000 33.65414 C ? B ? 66 C 1
   ATOM 1321 O . ILE B 84 ? -2.47236 -11.11641 -23.10940 1.000 32.80215 O ? B ? 66 O 1
   ATOM 1322 CB . ILE B 84 ? -1.47774 -11.04727 -19.88447 1.000 31.54183 C ? B ? 66 CB 1
   ATOM 1323 CG1 . ILE B 84 ? -2.06182 -10.42381 -18.60776 1.000 31.25785 C ? B ? 66 CG1 1
   ATOM 1324 CG2 . ILE B 84 ? -0.67142 -10.01390 -20.66430 1.000 35.08078 C ? B ? 66 CG2 1
   ATOM 1325 CD1 . ILE B 84 ? -0.97035 -9.96234 -17.60537 1.000 29.41930 C ? B ? 66 CD1 1
   ATOM 1326 N . PHE B 85 ? -1.30945 -12.92607 -22.43242 1.000 30.00404 N ? B ? 67 N 1
   ATOM 1327 CA . PHE B 85 ? -0.79705 -13.14155 -23.79007 1.000 32.66706 C ? B ? 67 CA 1
   ATOM 1328 C . PHE B 85 ? -1.90710 -13.55137 -24.74463 1.000 33.31198 C ? B ? 67 C 1
   ATOM 1329 O . PHE B 85 ? -1.84593 -13.23737 -25.95129 1.000 32.16793 O ? B ? 67 O 1
   ATOM 1330 CB . PHE B 85 ? 0.28483 -14.21084 -23.79558 1.000 29.48314 C ? B ? 67 CB 1
   ATOM 1331 CG . PHE B 85 ? 1.65484 -13.70448 -23.53294 1.000 41.65902 C ? B ? 67 CG 1
   ATOM 1332 CD1 . PHE B 85 ? 2.39107 -13.09362 -24.54575 1.000 31.36030 C ? B ? 67 CD1 1
   ATOM 1333 CD2 . PHE B 85 ? 2.25065 -13.88507 -22.29575 1.000 45.31392 C ? B ? 67 CD2 1
   ATOM 1334 CE1 . PHE B 85 ? 3.68006 -12.62933 -24.30608 1.000 31.42756 C ? B ? 67 CE1 1
   ATOM 1335 CE2 . PHE B 85 ? 3.53827 -13.43420 -22.05287 1.000 37.88613 C ? B ? 67 CE2 1
   ATOM 1336 CZ . PHE B 85 ? 4.25075 -12.78967 -23.05075 1.000 40.11045 C ? B ? 67 CZ 1
   ATOM 1337 N . ILE B 86 ? -2.92913 -14.23652 -24.23293 1.000 29.82933 N ? B ? 68 N 1
   ATOM 1338 CA . ILE B 86 ? -4.00824 -14.67087 -25.10643 1.000 32.92012 C ? B ? 68 CA 1
   ATOM 1339 C . ILE B 86 ? -4.98750 -13.54698 -25.34235 1.000 37.35441 C ? B ? 68 C 1
   ATOM 1340 O . ILE B 86 ? -5.65501 -13.50420 -26.38093 1.000 42.52896 O ? B ? 68 O 1
   ATOM 1341 CB . ILE B 86 ? -4.71248 -15.88623 -24.47622 1.000 41.08666 C ? B ? 68 CB 1
   ATOM 1342 CG1 . ILE B 86 ? -3.75829 -17.07619 -24.43069 1.000 44.08529 C ? B ? 68 CG1 1
   ATOM 1343 CG2 . ILE B 86 ? -5.95045 -16.26342 -25.24530 1.000 46.01633 C ? B ? 68 CG2 1
   ATOM 1344 CD1 . ILE B 86 ? -3.19332 -17.40387 -25.77080 1.000 48.25324 C ? B ? 68 CD1 1
   ATOM 1345 N . GLY B 87 ? -5.17797 -12.68646 -24.36565 1.000 29.94005 N ? B ? 69 N 1
   ATOM 1346 CA . GLY B 87 ? -6.28893 -11.76769 -24.49096 1.000 27.03246 C ? B ? 69 CA 1
   ATOM 1347 C . GLY B 87 ? -5.91932 -10.37008 -24.92939 1.000 29.03035 C ? B ? 69 C 1
   ATOM 1348 O . GLY B 87 ? -6.81445 -9.64529 -25.37094 1.000 27.51986 O ? B ? 69 O 1
   ATOM 1349 N . ILE B 88 ? -4.66145 -9.94755 -24.77179 1.000 24.77472 N ? B ? 70 N 1
   ATOM 1350 CA . ILE B 88 ? -4.34657 -8.55060 -25.10806 1.000 25.30779 C ? B ? 70 CA 1
   ATOM 1351 C . ILE B 88 ? -4.57229 -8.33616 -26.60515 1.000 28.70548 C ? B ? 70 C 1
   ATOM 1352 O . ILE B 88 ? -5.12412 -7.30549 -27.02572 1.000 28.36552 O ? B ? 70 O 1
   ATOM 1353 CB . ILE B 88 ? -2.90355 -8.17698 -24.69785 1.000 31.19761 C ? B ? 70 CB 1
   ATOM 1354 CG1 . ILE B 88 ? -2.79665 -7.71524 -23.24261 1.000 39.58351 C ? B ? 70 CG1 1
   ATOM 1355 CG2 . ILE B 88 ? -2.35184 -7.02884 -25.57918 1.000 43.45305 C ? B ? 70 CG2 1
   ATOM 1356 CD1 . ILE B 88 ? -1.36991 -7.24160 -22.82625 1.000 38.08696 C ? B ? 70 CD1 1
   ATOM 1357 N A GLY B 89 ? -4.19632 -9.31624 -27.42981 0.042 28.68783 N ? B ? 71 N 1
   ATOM 1358 CA A GLY B 89 ? -4.38827 -9.17309 -28.86799 0.042 35.15057 C ? B ? 71 CA 1
   ATOM 1359 C A GLY B 89 ? -5.84787 -9.01925 -29.25604 0.042 32.91810 C ? B ? 71 C 1
   ATOM 1360 O A GLY B 89 ? -6.20830 -8.13162 -30.03147 0.042 31.14995 O ? B ? 71 O 1
   ATOM 1361 N B GLY B 89 ? -4.21103 -9.33568 -27.42083 0.958 28.28323 N ? B ? 71 N 1
   ATOM 1362 CA B GLY B 89 ? -4.38894 -9.19740 -28.87313 0.958 35.40430 C ? B ? 71 CA 1
   ATOM 1363 C B GLY B 89 ? -5.84622 -9.04265 -29.27390 0.958 32.98102 C ? B ? 71 C 1
   ATOM 1364 O B GLY B 89 ? -6.21092 -8.13620 -30.02060 0.958 30.97347 O ? B ? 71 O 1
   ATOM 1365 N . LEU B 90 ? -6.70756 -9.88646 -28.71866 1.000 32.30122 N ? B ? 72 N 1
   ATOM 1366 CA . LEU B 90 ? -8.14355 -9.78862 -28.97606 1.000 31.00288 C ? B ? 72 CA 1
   ATOM 1367 C . LEU B 90 ? -8.72395 -8.46493 -28.50692 1.000 32.62489 C ? B ? 72 C 1
   ATOM 1368 O . LEU B 90 ? -9.49432 -7.81213 -29.22754 1.000 28.02878 O ? B ? 72 O 1
   ATOM 1369 CB . LEU B 90 ? -8.83454 -10.91974 -28.22863 1.000 28.25318 C ? B ? 72 CB 1
   ATOM 1370 CG . LEU B 90 ? -10.35435 -10.80661 -28.25294 1.000 30.76017 C ? B ? 72 CG 1
   ATOM 1371 CD1 . LEU B 90 ? -10.81174 -10.93763 -29.72001 1.000 36.97627 C ? B ? 72 CD1 1
   ATOM 1372 CD2 . LEU B 90 ? -10.90281 -11.94305 -27.43360 1.000 38.50674 C ? B ? 72 CD2 1
   ATOM 1373 N . VAL B 91 ? -8.40980 -8.08025 -27.26328 1.000 25.84268 N ? B ? 73 N 1
   ATOM 1374 CA . VAL B 91 ? -8.97076 -6.84890 -26.70492 1.000 28.76246 C ? B ? 73 CA 1
   ATOM 1375 C . VAL B 91 ? -8.50522 -5.64245 -27.52225 1.000 28.83951 C ? B ? 73 C 1
   ATOM 1376 O . VAL B 91 ? -9.27952 -4.71574 -27.79492 1.000 27.57845 O ? B ? 73 O 1
   ATOM 1377 CB . VAL B 91 ? -8.58715 -6.72880 -25.21702 1.000 23.85945 C ? B ? 73 CB 1
   ATOM 1378 CG1 . VAL B 91 ? -8.80553 -5.31058 -24.67462 1.000 27.41768 C ? B ? 73 CG1 1
   ATOM 1379 CG2 . VAL B 91 ? -9.43777 -7.80272 -24.37798 1.000 31.73597 C ? B ? 73 CG2 1
   ATOM 1380 N . PHE B 92 ? -7.23847 -5.61447 -27.91257 1.000 26.47700 N ? B ? 74 N 1
   ATOM 1381 CA . PHE B 92 ? -6.85607 -4.41854 -28.68366 1.000 24.20922 C ? B ? 74 CA 1
   ATOM 1382 C . PHE B 92 ? -7.31621 -4.48671 -30.10996 1.000 24.51996 C ? B ? 74 C 1
   ATOM 1383 O . PHE B 92 ? -7.55842 -3.42910 -30.69989 1.000 25.82848 O ? B ? 74 O 1
   ATOM 1384 CB . PHE B 92 ? -5.35926 -4.16782 -28.58615 1.000 25.00670 C ? B ? 74 CB 1
   ATOM 1385 CG . PHE B 92 ? -5.02180 -3.48248 -27.29983 1.000 35.23446 C ? B ? 74 CG 1
   ATOM 1386 CD1 . PHE B 92 ? -5.06290 -2.09408 -27.22491 1.000 36.34384 C ? B ? 74 CD1 1
   ATOM 1387 CD2 . PHE B 92 ? -4.83023 -4.20283 -26.14814 1.000 34.20068 C ? B ? 74 CD2 1
   ATOM 1388 CE1 . PHE B 92 ? -4.83109 -1.44643 -26.02692 1.000 38.38244 C ? B ? 74 CE1 1
   ATOM 1389 CE2 . PHE B 92 ? -4.59290 -3.56659 -24.96601 1.000 31.88657 C ? B ? 74 CE2 1
   ATOM 1390 CZ . PHE B 92 ? -4.56639 -2.19378 -24.90770 1.000 39.11029 C ? B ? 74 CZ 1
   ATOM 1391 N . GLY B 93 ? -7.53257 -5.68019 -30.65398 1.000 24.36938 N ? B ? 75 N 1
   ATOM 1392 CA . GLY B 93 ? -8.19113 -5.74005 -31.96162 1.000 27.89888 C ? B ? 75 CA 1
   ATOM 1393 C . GLY B 93 ? -9.61191 -5.21558 -31.89301 1.000 28.18189 C ? B ? 75 C 1
   ATOM 1394 O . GLY B 93 ? -10.10209 -4.57105 -32.82850 1.000 27.44896 O ? B ? 75 O 1
   ATOM 1395 N . PHE B 94 ? -10.31830 -5.56645 -30.82866 1.000 25.25291 N ? B ? 76 N 1
   ATOM 1396 CA . PHE B 94 ? -11.68629 -5.08164 -30.67162 1.000 29.24185 C ? B ? 76 CA 1
   ATOM 1397 C . PHE B 94 ? -11.70133 -3.56263 -30.51064 1.000 27.85034 C ? B ? 76 C 1
   ATOM 1398 O . PHE B 94 ? -12.46397 -2.84832 -31.18109 1.000 26.99640 O ? B ? 76 O 1
   ATOM 1399 CB . PHE B 94 ? -12.32877 -5.72901 -29.44793 1.000 27.13204 C ? B ? 76 CB 1
   ATOM 1400 CG . PHE B 94 ? -13.63037 -5.04063 -29.04455 1.000 28.25797 C ? B ? 76 CG 1
   ATOM 1401 CD1 . PHE B 94 ? -14.77489 -5.22891 -29.82644 1.000 32.91914 C ? B ? 76 CD1 1
   ATOM 1402 CD2 . PHE B 94 ? -13.68438 -4.19491 -27.94462 1.000 30.09928 C ? B ? 76 CD2 1
   ATOM 1403 CE1 . PHE B 94 ? -15.97901 -4.58708 -29.51139 1.000 29.41027 C ? B ? 76 CE1 1
   ATOM 1404 CE2 . PHE B 94 ? -14.93117 -3.54484 -27.60376 1.000 28.67346 C ? B ? 76 CE2 1
   ATOM 1405 CZ . PHE B 94 ? -16.05404 -3.77014 -28.40748 1.000 27.34407 C ? B ? 76 CZ 1
   ATOM 1406 N . ILE B 95 ? -10.83641 -3.05144 -29.64869 1.000 24.27234 N ? B ? 77 N 1
   ATOM 1407 CA . ILE B 95 ? -10.74905 -1.60233 -29.45402 1.000 26.74401 C ? B ? 77 CA 1
   ATOM 1408 C . ILE B 95 ? -10.44912 -0.90082 -30.76389 1.000 28.66838 C ? B ? 77 C 1
   ATOM 1409 O . ILE B 95 ? -11.03841 0.14514 -31.08642 1.000 26.66988 O ? B ? 77 O 1
   ATOM 1410 CB . ILE B 95 ? -9.70219 -1.26975 -28.38801 1.000 26.75427 C ? B ? 77 CB 1
   ATOM 1411 CG1 . ILE B 95 ? -10.22674 -1.65393 -27.00671 1.000 28.01071 C ? B ? 77 CG1 1
   ATOM 1412 CG2 . ILE B 95 ? -9.34126 0.21784 -28.45131 1.000 31.10331 C ? B ? 77 CG2 1
   ATOM 1413 CD1 . ILE B 95 ? -9.18061 -1.54831 -25.85545 1.000 31.17244 C ? B ? 77 CD1 1
   ATOM 1414 N . HIS B 96 ? -9.52362 -1.44861 -31.53967 1.000 23.80446 N ? B ? 78 N 1
   ATOM 1415 CA . HIS B 96 ? -9.23425 -0.87986 -32.87331 1.000 27.26901 C ? B ? 78 CA 1
   ATOM 1416 C . HIS B 96 ? -10.46061 -0.86391 -33.78491 1.000 34.33478 C ? B ? 78 C 1
   ATOM 1417 O . HIS B 96 ? -10.78672 0.16813 -34.40224 1.000 28.56387 O ? B ? 78 O 1
   ATOM 1418 CB . HIS B 96 ? -8.11845 -1.67133 -33.54745 1.000 24.39412 C ? B ? 78 CB 1
   ATOM 1419 CG . HIS B 96 ? -7.78724 -1.14635 -34.91309 1.000 33.27575 C ? B ? 78 CG 1
   ATOM 1420 ND1 . HIS B 96 ? -7.07892 0.02099 -35.10638 1.000 39.70290 N ? B ? 78 ND1 1
   ATOM 1421 CD2 . HIS B 96 ? -8.10852 -1.60236 -36.14903 1.000 35.00481 C ? B ? 78 CD2 1
   ATOM 1422 CE1 . HIS B 96 ? -6.94778 0.24964 -36.40480 1.000 40.45541 C ? B ? 78 CE1 1
   ATOM 1423 NE2 . HIS B 96 ? -7.55578 -0.72348 -37.05968 1.000 35.75578 N ? B ? 78 NE2 1
   ATOM 1424 N . LYS B 97 ? -11.14940 -2.00270 -33.89525 1.000 29.04871 N ? B ? 79 N 1
   ATOM 1425 CA . LYS B 97 ? -12.33928 -2.06849 -34.73238 1.000 25.24591 C ? B ? 79 CA 1
   ATOM 1426 C . LYS B 97 ? -13.43133 -1.15564 -34.18250 1.000 29.82511 C ? B ? 79 C 1
   ATOM 1427 O . LYS B 97 ? -14.16994 -0.53675 -34.94762 1.000 30.74575 O ? B ? 79 O 1
   ATOM 1428 CB . LYS B 97 ? -12.84669 -3.51492 -34.81130 1.000 25.70961 C ? B ? 79 CB 1
   ATOM 1429 CG . LYS B 97 ? -11.98674 -4.35795 -35.78694 1.000 33.32621 C ? B ? 79 CG 1
   ATOM 1430 CD . LYS B 97 ? -11.80585 -3.66613 -37.14571 1.000 45.81021 C ? B ? 79 CD 1
   ATOM 1431 CE . LYS B 97 ? -10.32813 -3.62888 -37.55221 1.000 42.94406 C ? B ? 79 CE 1
   ATOM 1432 NZ . LYS B 97 ? -10.10012 -3.67300 -39.03383 1.000 62.87944 N ? B ? 79 NZ 1
   ATOM 1433 N . LEU B 98 ? -13.56715 -1.08623 -32.86316 1.000 27.07435 N ? B ? 80 N 1
   ATOM 1434 CA . LEU B 98 ? -14.52919 -0.14433 -32.29614 1.000 23.38997 C ? B ? 80 CA 1
   ATOM 1435 C . LEU B 98 ? -14.19336 1.27515 -32.73802 1.000 29.00750 C ? B ? 80 C 1
   ATOM 1436 O . LEU B 98 ? -15.08207 2.05549 -33.12837 1.000 27.52209 O ? B ? 80 O 1
   ATOM 1437 CB . LEU B 98 ? -14.52873 -0.25748 -30.78741 1.000 25.71823 C ? B ? 80 CB 1
   ATOM 1438 CG . LEU B 98 ? -15.38659 0.74392 -30.01730 1.000 23.87037 C ? B ? 80 CG 1
   ATOM 1439 CD1 . LEU B 98 ? -16.87232 0.51584 -30.24637 1.000 30.83639 C ? B ? 80 CD1 1
   ATOM 1440 CD2 . LEU B 98 ? -15.04795 0.67570 -28.50620 1.000 24.21755 C ? B ? 80 CD2 1
   ATOM 1441 N . ALA B 99 ? -12.90369 1.59805 -32.75051 1.000 24.13468 N ? B ? 81 N 1
   ATOM 1442 CA . ALA B 99 ? -12.48315 2.96272 -33.06408 1.000 33.28326 C ? B ? 81 CA 1
   ATOM 1443 C . ALA B 99 ? -12.76108 3.30990 -34.50843 1.000 31.29692 C ? B ? 81 C 1
   ATOM 1444 O . ALA B 99 ? -13.33716 4.37156 -34.81175 1.000 33.88028 O ? B ? 81 O 1
   ATOM 1445 CB . ALA B 99 ? -11.00019 3.13932 -32.74927 1.000 31.81056 C ? B ? 81 CB 1
   ATOM 1446 N . VAL B 100 ? -12.37147 2.43839 -35.43525 1.000 33.24015 N ? B ? 82 N 1
   ATOM 1447 CA . VAL B 100 ? -12.36390 2.86410 -36.82983 1.000 30.32490 C ? B ? 82 CA 1
   ATOM 1448 C . VAL B 100 ? -13.65719 2.46544 -37.53226 1.000 34.13589 C ? B ? 82 C 1
   ATOM 1449 O . VAL B 100 ? -14.09760 3.15619 -38.45604 1.000 34.46842 O ? B ? 82 O 1
   ATOM 1450 CB . VAL B 100 ? -11.11422 2.33068 -37.56670 1.000 41.30346 C ? B ? 82 CB 1
   ATOM 1451 CG1 . VAL B 100 ? -9.83565 2.57818 -36.73079 1.000 40.57680 C ? B ? 82 CG1 1
   ATOM 1452 CG2 . VAL B 100 ? -11.25738 0.87975 -37.86664 1.000 35.53650 C ? B ? 82 CG2 1
   ATOM 1453 N . ASN B 101 ? -14.34224 1.42881 -37.06469 1.000 29.63475 N ? B ? 83 N 1
   ATOM 1454 CA . ASN B 101 ? -15.57756 1.02954 -37.70053 1.000 29.31043 C ? B ? 83 CA 1
   ATOM 1455 C . ASN B 101 ? -16.85375 1.40366 -36.94178 1.000 37.32061 C ? B ? 83 C 1
   ATOM 1456 O . ASN B 101 ? -17.94523 1.25472 -37.50592 1.000 35.68922 O ? B ? 83 O 1
   ATOM 1457 CB . ASN B 101 ? -15.52924 -0.46893 -38.00153 1.000 45.37901 C ? B ? 83 CB 1
   ATOM 1458 CG . ASN B 101 ? -14.39756 -0.80419 -38.96575 1.000 42.15846 C ? B ? 83 CG 1
   ATOM 1459 OD1 . ASN B 101 ? -13.89043 0.07608 -39.68224 1.000 42.87912 O ? B ? 83 OD1 1
   ATOM 1460 ND2 . ASN B 101 ? -13.98671 -2.04601 -38.98200 1.000 45.09460 N ? B ? 83 ND2 1
   ATOM 1461 N . VAL B 102 ? -16.76734 1.94741 -35.72424 1.000 31.40849 N ? B ? 84 N 1
   ATOM 1462 CA . VAL B 102 ? -17.98550 2.43643 -35.06150 1.000 31.43370 C ? B ? 84 CA 1
   ATOM 1463 C . VAL B 102 ? -17.85265 3.89201 -34.64154 1.000 35.11760 C ? B ? 84 C 1
   ATOM 1464 O . VAL B 102 ? -18.73397 4.71727 -34.93370 1.000 29.97395 O ? B ? 84 O 1
   ATOM 1465 CB . VAL B 102 ? -18.36429 1.63210 -33.81032 1.000 29.75596 C ? B ? 84 CB 1
   ATOM 1466 CG1 . VAL B 102 ? -19.59276 2.23305 -33.20716 1.000 41.57504 C ? B ? 84 CG1 1
   ATOM 1467 CG2 . VAL B 102 ? -18.61957 0.12454 -34.14435 1.000 30.14661 C ? B ? 84 CG2 1
   ATOM 1468 N . GLN B 103 ? -16.79423 4.20563 -33.89541 1.000 28.59568 N ? B ? 85 N 1
   ATOM 1469 CA . GLN B 103 ? -16.65887 5.58175 -33.39235 1.000 28.97081 C ? B ? 85 CA 1
   ATOM 1470 C . GLN B 103 ? -16.35559 6.56316 -34.51338 1.000 29.39693 C ? B ? 85 C 1
   ATOM 1471 O . GLN B 103 ? -16.96185 7.65200 -34.59635 1.000 27.62096 O ? B ? 85 O 1
   ATOM 1472 CB . GLN B 103 ? -15.57191 5.63547 -32.32247 1.000 29.07018 C ? B ? 85 CB 1
   ATOM 1473 CG . GLN B 103 ? -15.92454 4.77843 -31.10809 1.000 30.63577 C ? B ? 85 CG 1
   ATOM 1474 CD . GLN B 103 ? -14.88473 4.91754 -30.03284 1.000 40.70508 C ? B ? 85 CD 1
   ATOM 1475 OE1 . GLN B 103 ? -13.72100 4.61065 -30.24398 1.000 38.38033 O ? B ? 85 OE1 1
   ATOM 1476 NE2 . GLN B 103 ? -15.29104 5.40433 -28.87558 1.000 41.66238 N ? B ? 85 NE2 1
   ATOM 1477 N . LEU B 104 ? -15.40689 6.22683 -35.38235 1.000 27.03132 N ? B ? 86 N 1
   ATOM 1478 CA . LEU B 104 ? -15.13332 7.13706 -36.49774 1.000 30.06544 C ? B ? 86 CA 1
   ATOM 1479 C . LEU B 104 ? -16.37176 7.44840 -37.33839 1.000 31.93002 C ? B ? 86 C 1
   ATOM 1480 O . LEU B 104 ? -16.67507 8.64665 -37.52099 1.000 30.75688 O ? B ? 86 O 1
   ATOM 1481 CB . LEU B 104 ? -13.98344 6.58156 -37.34714 1.000 30.17231 C ? B ? 86 CB 1
   ATOM 1482 CG . LEU B 104 ? -13.59824 7.45936 -38.55287 1.000 31.37946 C ? B ? 86 CG 1
   ATOM 1483 CD1 . LEU B 104 ? -13.29117 8.90631 -38.14552 1.000 33.73866 C ? B ? 86 CD1 1
   ATOM 1484 CD2 . LEU B 104 ? -12.36449 6.79771 -39.14032 1.000 36.23544 C ? B ? 86 CD2 1
   ATOM 1485 N A PRO B 105 ? -17.10035 6.48119 -37.88820 0.662 28.32426 N ? B ? 87 N 1
   ATOM 1486 CA A PRO B 105 ? -18.32499 6.81609 -38.64011 0.662 29.90891 C ? B ? 87 CA 1
   ATOM 1487 C A PRO B 105 ? -19.29784 7.66393 -37.84397 0.662 29.89342 C ? B ? 87 C 1
   ATOM 1488 O A PRO B 105 ? -19.86940 8.61700 -38.39181 0.662 27.17137 O ? B ? 87 O 1
   ATOM 1489 CB A PRO B 105 ? -18.94856 5.44805 -38.93966 0.662 29.84888 C ? B ? 87 CB 1
   ATOM 1490 CG A PRO B 105 ? -17.81463 4.46518 -38.79549 0.662 31.81830 C ? B ? 87 CG 1
   ATOM 1491 CD A PRO B 105 ? -16.84965 5.02168 -37.83885 0.662 33.50522 C ? B ? 87 CD 1
   ATOM 1492 N B PRO B 105 ? -17.13734 6.47825 -37.83966 0.338 28.45036 N ? B ? 87 N 1
   ATOM 1493 CA B PRO B 105 ? -18.35394 6.82003 -38.59883 0.338 29.93188 C ? B ? 87 CA 1
   ATOM 1494 C B PRO B 105 ? -19.40174 7.54836 -37.77335 0.338 29.84277 C ? B ? 87 C 1
   ATOM 1495 O B PRO B 105 ? -20.19908 8.30881 -38.34088 0.338 28.06194 O ? B ? 87 O 1
   ATOM 1496 CB B PRO B 105 ? -18.87739 5.45463 -39.06184 0.338 30.02414 C ? B ? 87 CB 1
   ATOM 1497 CG B PRO B 105 ? -17.69666 4.52928 -38.95228 0.338 31.83431 C ? B ? 87 CG 1
   ATOM 1498 CD B PRO B 105 ? -16.91548 5.01737 -37.79775 0.338 33.36748 C ? B ? 87 CD 1
   ATOM 1499 N A SER B 106 ? -19.51873 7.30514 -36.57264 0.662 28.38927 N ? B ? 88 N 1
   ATOM 1500 CA A SER B 106 ? -20.43468 8.05035 -35.72264 0.662 28.40766 C ? B ? 88 CA 1
   ATOM 1501 C A SER B 106 ? -19.97155 9.49314 -35.58660 0.662 31.73627 C ? B ? 88 C 1
   ATOM 1502 O A SER B 106 ? -20.78801 10.43340 -35.62828 0.662 33.55725 O ? B ? 88 O 1
   ATOM 1503 CB A SER B 106 ? -20.53847 7.36316 -34.35298 0.662 33.94588 C ? B ? 88 CB 1
   ATOM 1504 OG A SER B 106 ? -21.27870 8.14318 -33.43030 0.662 32.18559 O ? B ? 88 OG 1
   ATOM 1505 N B SER B 106 ? -19.45317 7.30056 -36.45960 0.338 28.53394 N ? B ? 88 N 1
   ATOM 1506 CA B SER B 106 ? -20.31204 8.09411 -35.59016 0.338 28.64539 C ? B ? 88 CA 1
   ATOM 1507 C B SER B 106 ? -19.86756 9.54809 -35.59120 0.338 31.65318 C ? B ? 88 C 1
   ATOM 1508 O B SER B 106 ? -20.69349 10.46907 -35.69610 0.338 33.47433 O ? B ? 88 O 1
   ATOM 1509 CB B SER B 106 ? -20.28477 7.53434 -34.16083 0.338 33.34915 C ? B ? 88 CB 1
   ATOM 1510 OG B SER B 106 ? -21.11417 6.39834 -34.01715 0.338 29.60334 O ? B ? 88 OG 1
   ATOM 1511 N A ILE B 107 ? -18.65878 9.69353 -35.45467 0.662 28.17575 N ? B ? 89 N 1
   ATOM 1512 CA A ILE B 107 ? -18.10852 11.05137 -35.39490 0.662 31.88283 C ? B ? 89 CA 1
   ATOM 1513 C A ILE B 107 ? -18.38473 11.78065 -36.69739 0.662 32.50550 C ? B ? 89 C 1
   ATOM 1514 O A ILE B 107 ? -18.94144 12.88644 -36.70210 0.662 30.42232 O ? B ? 89 O 1
   ATOM 1515 CB A ILE B 107 ? -16.60414 11.00631 -35.08149 0.662 31.34777 C ? B ? 89 CB 1
   ATOM 1516 CG1 A ILE B 107 ? -16.41618 10.69680 -33.59830 0.662 35.21668 C ? B ? 89 CG1 1
   ATOM 1517 CG2 A ILE B 107 ? -15.89801 12.30952 -35.58686 0.662 37.38511 C ? B ? 89 CG2 1
   ATOM 1518 CD1 A ILE B 107 ? -14.99688 10.47886 -33.18815 0.662 40.12257 C ? B ? 89 CD1 1
   ATOM 1519 N B ILE B 107 ? -18.55653 9.76943 -35.49519 0.338 28.45407 N ? B ? 89 N 1
   ATOM 1520 CA B ILE B 107 ? -18.01788 11.12223 -35.37711 0.338 31.75472 C ? B ? 89 CA 1
   ATOM 1521 C B ILE B 107 ? -18.14088 11.86554 -36.70142 0.338 31.89391 C ? B ? 89 C 1
   ATOM 1522 O B ILE B 107 ? -18.35226 13.08350 -36.71942 0.338 29.78992 O ? B ? 89 O 1
   ATOM 1523 CB B ILE B 107 ? -16.56403 11.05856 -34.86964 0.338 31.47661 C ? B ? 89 CB 1
   ATOM 1524 CG1 B ILE B 107 ? -16.53853 10.50921 -33.44242 0.338 34.62701 C ? B ? 89 CG1 1
   ATOM 1525 CG2 B ILE B 107 ? -15.88536 12.42702 -34.93422 0.338 37.40202 C ? B ? 89 CG2 1
   ATOM 1526 CD1 B ILE B 107 ? -15.15026 10.37599 -32.86911 0.338 38.97931 C ? B ? 89 CD1 1
   ATOM 1527 N . LEU B 108 ? -18.04130 11.14775 -37.83383 1.000 23.60588 N ? B ? 90 N 1
   ATOM 1528 CA . LEU B 108 ? -18.27893 11.78981 -39.12646 1.000 31.13404 C ? B ? 90 CA 1
   ATOM 1529 C . LEU B 108 ? -19.73261 12.17254 -39.28892 1.000 27.66724 C ? B ? 90 C 1
   ATOM 1530 O . LEU B 108 ? -20.05190 13.25457 -39.85014 1.000 29.04421 O ? B ? 90 O 1
   ATOM 1531 CB . LEU B 108 ? -17.89106 10.86640 -40.30259 1.000 24.91285 C ? B ? 90 CB 1
   ATOM 1532 CG . LEU B 108 ? -16.43214 10.51127 -40.25836 1.000 35.60993 C ? B ? 90 CG 1
   ATOM 1533 CD1 . LEU B 108 ? -16.18572 9.49197 -41.37527 1.000 33.73046 C ? B ? 90 CD1 1
   ATOM 1534 CD2 . LEU B 108 ? -15.69135 11.82207 -40.48708 1.000 34.03365 C ? B ? 90 CD2 1
   ATOM 1535 N A SER B 109 ? -20.63126 11.27602 -38.89831 0.578 27.34489 N ? B ? 91 N 1
   ATOM 1536 CA A SER B 109 ? -22.05364 11.55266 -39.02106 0.578 32.24350 C ? B ? 91 CA 1
   ATOM 1537 C A SER B 109 ? -22.46242 12.71142 -38.11507 0.578 32.32588 C ? B ? 91 C 1
   ATOM 1538 O A SER B 109 ? -23.32114 13.52400 -38.48733 0.578 32.52568 O ? B ? 91 O 1
   ATOM 1539 CB A SER B 109 ? -22.84829 10.28770 -38.67659 0.578 34.95437 C ? B ? 91 CB 1
   ATOM 1540 OG A SER B 109 ? -23.04628 10.20007 -37.27590 0.578 34.18481 O ? B ? 91 OG 1
   ATOM 1541 N B SER B 109 ? -20.64738 11.27322 -38.91396 0.422 27.44798 N ? B ? 91 N 1
   ATOM 1542 CA B SER B 109 ? -22.06795 11.59071 -39.03878 0.422 32.21020 C ? B ? 91 CA 1
   ATOM 1543 C B SER B 109 ? -22.45184 12.74497 -38.12305 0.422 32.31196 C ? B ? 91 C 1
   ATOM 1544 O B SER B 109 ? -23.29526 13.57514 -38.48655 0.422 32.49824 O ? B ? 91 O 1
   ATOM 1545 CB B SER B 109 ? -22.93404 10.35991 -38.72155 0.422 35.03061 C ? B ? 91 CB 1
   ATOM 1546 OG B SER B 109 ? -24.30552 10.72966 -38.53534 0.422 31.67855 O ? B ? 91 OG 1
   ATOM 1547 N . ASN B 110 ? -21.82475 12.83191 -36.95763 1.000 30.51239 N ? B ? 92 N 1
   ATOM 1548 CA . ASN B 110 ? -22.12253 13.92038 -36.01764 1.000 30.26970 C ? B ? 92 CA 1
   ATOM 1549 C . ASN B 110 ? -21.44737 15.24828 -36.40728 1.000 32.34839 C ? B ? 92 C 1
   ATOM 1550 O . ASN B 110 ? -21.74576 16.27933 -35.79076 1.000 32.40636 O ? B ? 92 O 1
   ATOM 1551 CB . ASN B 110 ? -21.70728 13.49712 -34.62635 1.000 25.95781 C ? B ? 92 CB 1
   ATOM 1552 CG . ASN B 110 ? -22.61846 12.41550 -34.06416 1.000 35.46979 C ? B ? 92 CG 1
   ATOM 1553 OD1 . ASN B 110 ? -23.79498 12.44772 -34.28829 1.000 39.02808 O ? B ? 92 OD1 1
   ATOM 1554 ND2 . ASN B 110 ? -22.06011 11.47124 -33.30838 1.000 49.43141 N ? B ? 92 ND2 1
   ATOM 1555 N . LEU B 111 ? -20.55224 15.26446 -37.40822 1.000 26.88176 N ? B ? 93 N 1
   ATOM 1556 CA . LEU B 111 ? -19.96553 16.53274 -37.88304 1.000 26.54751 C ? B ? 93 CA 1
   ATOM 1557 C . LEU B 111 ? -20.66356 17.10393 -39.11814 1.000 28.91891 C ? B ? 93 C 1
   ATOM 1558 O . LEU B 111 ? -20.31452 18.19968 -39.57530 1.000 31.61022 O ? B ? 93 O 1
   ATOM 1559 CB . LEU B 111 ? -18.45044 16.34690 -38.14663 1.000 23.44394 C ? B ? 93 CB 1
   ATOM 1560 CG . LEU B 111 ? -17.58675 16.12262 -36.92643 1.000 28.62545 C ? B ? 93 CG 1
   ATOM 1561 CD1 . LEU B 111 ? -16.21332 15.61258 -37.40212 1.000 32.09652 C ? B ? 93 CD1 1
   ATOM 1562 CD2 . LEU B 111 ? -17.42991 17.40632 -36.12771 1.000 31.75527 C ? B ? 93 CD2 1
   ATOM 1563 N . VAL B 112 ? -21.64865 16.41690 -39.66572 1.000 30.85218 N ? B ? 94 N 1
   ATOM 1564 CA . VAL B 112 ? -22.32838 16.84971 -40.87536 1.000 33.71987 C ? B ? 94 CA 1
   ATOM 1565 C . VAL B 112 ? -23.17201 18.07059 -40.52164 1.000 32.55337 C ? B ? 94 C 1
   ATOM 1566 O . VAL B 112 ? -24.05546 17.93137 -39.67713 1.000 25.54525 O ? B ? 94 O 1
   ATOM 1567 CB . VAL B 112 ? -23.25419 15.74616 -41.40339 1.000 32.44594 C ? B ? 94 CB 1
   ATOM 1568 CG1 . VAL B 112 ? -24.03892 16.22425 -42.60373 1.000 41.58641 C ? B ? 94 CG1 1
   ATOM 1569 CG2 . VAL B 112 ? -22.44397 14.43215 -41.76296 1.000 37.16371 C ? B ? 94 CG2 1
   ATOM 1570 N . PRO B 113 ? -23.00412 19.22632 -41.16240 1.000 32.15477 N ? B ? 95 N 1
   ATOM 1571 CA . PRO B 113 ? -23.95236 20.33472 -40.91897 1.000 28.03191 C ? B ? 95 CA 1
   ATOM 1572 C . PRO B 113 ? -25.31625 20.13272 -41.55328 1.000 37.02386 C ? B ? 95 C 1
   ATOM 1573 O . PRO B 113 ? -25.46647 19.58673 -42.65428 1.000 37.73733 O ? B ? 95 O 1
   ATOM 1574 CB . PRO B 113 ? -23.23921 21.55300 -41.51799 1.000 34.26445 C ? B ? 95 CB 1
   ATOM 1575 CG . PRO B 113 ? -22.35004 20.94639 -42.67662 1.000 35.49570 C ? B ? 95 CG 1
   ATOM 1576 CD . PRO B 113 ? -21.84509 19.64241 -41.98453 1.000 39.06069 C ? B ? 95 CD 1
   ATOM 1577 N . ARG B 114 ? -26.31856 20.63096 -40.84620 1.000 35.03966 N ? B ? 96 N 1
   ATOM 1578 CA . ARG B 114 ? -27.68480 20.73801 -41.33856 1.000 39.64022 C ? B ? 96 CA 1
   ATOM 1579 C . ARG B 114 ? -28.25605 22.08237 -40.89926 1.000 41.76259 C ? B ? 96 C 1
   ATOM 1580 O . ARG B 114 ? -29.10724 22.63122 -41.59625 1.000 60.66496 O ? B ? 96 O 1
   ATOM 1581 CB . ARG B 114 ? -28.58379 19.64422 -40.79088 1.000 43.62814 C ? B ? 96 CB 1
   ATOM 1582 CG . ARG B 114 ? -28.13846 18.22531 -40.99612 1.000 40.88882 C ? B ? 96 CG 1
   ATOM 1583 CD . ARG B 114 ? -29.20384 17.34939 -40.40107 1.000 42.93066 C ? B ? 96 CD 1
   ATOM 1584 NE . ARG B 114 ? -28.94910 15.94565 -40.66118 1.000 40.69849 N ? B ? 96 NE 1
   ATOM 1585 CZ . ARG B 114 ? -27.96813 15.25943 -40.09419 1.000 42.63025 C ? B ? 96 CZ 1
   ATOM 1586 NH1 . ARG B 114 ? -27.17050 15.80604 -39.19388 1.000 37.02521 N ? B ? 96 NH1 1
   ATOM 1587 NH2 . ARG B 114 ? -27.79582 13.99220 -40.42714 1.000 36.74911 N ? B ? 96 NH2 1
   HETATM 1588 K . K A 201 ? 0.00000 0.00000 16.46150 0.096 19.74816 K ? C ? . K 1
   HETATM 1589 K . K A 202 ? 0.00000 0.00000 23.54377 0.255 38.68165 K ? D ? . K 1
   HETATM 1590 K . K A 203 ? 0.00000 0.00000 13.61445 0.199 16.30544 K ? E ? . K 1
   HETATM 1591 BA . BA A 204 ? 0.00000 0.00000 7.69761 0.094 38.25020 Ba ? F ? . BA 1
   HETATM 1592 BA . BA A 205 ? -0.00000 -0.00000 19.34021 0.206 20.03797 Ba ? G ? . BA 1
   HETATM 1593 C1 . MPD A 206 ? -13.10974 -14.18956 23.07292 1.000 35.31353 C ? H ? . C1 1
   HETATM 1594 C2 . MPD A 206 ? -14.33403 -15.07466 23.31497 1.000 35.89128 C ? H ? . C2 1
   HETATM 1595 C3 . MPD A 206 ? -15.58904 -14.51354 22.59210 1.000 42.41547 C ? H ? . C3 1
   HETATM 1596 C4 . MPD A 206 ? -16.91741 -15.26213 22.79954 1.000 41.00765 C ? H ? . C4 1
   HETATM 1597 C5 . MPD A 206 ? -16.75886 -16.75038 22.64340 1.000 37.80759 C ? H ? . C5 1
   HETATM 1598 CM . MPD A 206 ? -14.53738 -15.18425 24.82588 1.000 49.52919 C ? H ? . CM 1
   HETATM 1599 O2 . MPD A 206 ? -13.97690 -16.37308 22.82341 1.000 34.94285 O ? H ? . O2 1
   HETATM 1600 O4 . MPD A 206 ? -17.89667 -14.90136 21.81090 1.000 50.89875 O ? H ? . O4 1
   HETATM 1601 C1 . MPD A 207 ? 5.94363 -16.77675 25.27274 1.000 55.63764 C ? I ? . C1 1
   HETATM 1602 C2 . MPD A 207 ? 4.83428 -17.53586 25.98667 1.000 61.64431 C ? I ? . C2 1
   HETATM 1603 C3 . MPD A 207 ? 3.80426 -17.90087 24.90574 1.000 53.31114 C ? I ? . C3 1
   HETATM 1604 C4 . MPD A 207 ? 4.35436 -18.91568 23.92419 1.000 62.13478 C ? I ? . C4 1
   HETATM 1605 C5 . MPD A 207 ? 3.62141 -18.87927 22.58694 1.000 54.83135 C ? I ? . C5 1
   HETATM 1606 CM . MPD A 207 ? 4.25119 -16.69237 27.11003 1.000 47.64734 C ? I ? . CM 1
   HETATM 1607 O2 . MPD A 207 ? 5.45674 -18.67733 26.56090 1.000 66.62609 O ? I ? . O2 1
   HETATM 1608 O4 . MPD A 207 ? 4.25018 -20.18996 24.55634 1.000 63.41553 O ? I ? . O4 1
   HETATM 1609 O . HOH A 302 ? -4.02621 -3.57603 9.15207 0.741 29.82851 O ? J ? . O 1
   HETATM 1610 O . HOH A 303 ? -8.85743 -4.89925 8.86331 0.823 30.39129 O ? J ? . O 1
   HETATM 1611 O . HOH A 304 ? -11.83551 -4.12873 6.97146 0.988 30.50823 O ? J ? . O 1
   HETATM 1612 O . HOH A 305 ? -15.40235 -6.72476 7.66591 0.797 25.58480 O ? J ? . O 1
   HETATM 1613 O . HOH A 306 ? -8.99488 -8.42620 30.84725 1.000 43.46458 O ? J ? . O 1
   HETATM 1615 O . HOH A 309 ? -5.26514 -21.60116 7.94185 0.955 34.31081 O ? J ? . O 1
   HETATM 1617 O . HOH A 311 ? 0.69114 -2.07691 9.34893 0.799 33.87493 O ? J ? . O 1
   HETATM 1618 O . HOH A 312 ? -1.23342 -6.70084 13.86193 0.983 24.37630 O ? J ? . O 1
   HETATM 1619 O . HOH A 313 ? -9.80684 -12.58146 6.02460 0.922 41.47038 O ? J ? . O 1
   HETATM 1620 O . HOH A 314 ? -0.85498 -2.38905 7.30636 0.965 38.46006 O ? J ? . O 1
   HETATM 1622 O . HOH A 316 ? -11.42315 -14.58770 5.28339 0.990 45.44197 O ? J ? . O 1
   HETATM 1625 O . HOH A 319 ? 0.55837 -9.02161 13.69295 0.997 24.80354 O ? J ? . O 1
   HETATM 1626 O . HOH A 320 ? 1.78405 -22.57112 10.63240 1.000 31.28251 O ? J ? . O 1
   HETATM 1627 O . HOH A 321 ? -1.31194 -16.30136 7.06631 1.000 27.63971 O ? J ? . O 1
   HETATM 1628 O . HOH A 322 ? -7.33996 -11.90696 7.60568 1.000 42.50055 O ? J ? . O 1
   HETATM 1630 O . HOH A 324 ? -2.55460 -14.09092 5.38943 0.947 45.95987 O ? J ? . O 1
   HETATM 1631 O . HOH A 326 ? -7.38007 -12.81827 5.21673 1.000 30.60160 O ? J ? . O 1
   HETATM 1634 O . HOH A 329 ? -5.65538 -14.84039 4.91681 1.000 51.46366 O ? J ? . O 1
   HETATM 1641 K . K B 201 ? -0.00000 -0.00000 -20.86801 0.406 54.78455 K ? K ? . K 1
   HETATM 1642 K . K B 202 ? -0.65532 0.28417 -11.07002 0.240 27.19835 K ? L ? . K 1
   HETATM 1643 K . K B 203 ? -0.53587 0.44287 -14.20888 0.135 21.48429 K ? M ? . K 1
   HETATM 1644 BA . BA B 204 ? 0.00000 0.00000 -16.77535 0.264 41.42080 Ba ? N ? . BA 1
   HETATM 1645 C1 . MPD B 205 ? -10.08572 8.45489 -32.86349 1.000 48.16640 C ? O ? . C1 1
   HETATM 1646 C2 . MPD B 205 ? -11.12343 7.58983 -33.53610 1.000 44.93942 C ? O ? . C2 1
   HETATM 1647 C3 . MPD B 205 ? -10.42287 6.87631 -34.66456 1.000 51.78743 C ? O ? . C3 1
   HETATM 1648 C4 . MPD B 205 ? -9.75594 7.66987 -35.79809 1.000 59.26011 C ? O ? . C4 1
   HETATM 1649 C5 . MPD B 205 ? -8.29740 7.29217 -35.82535 1.000 62.58873 C ? O ? . C5 1
   HETATM 1650 CM . MPD B 205 ? -12.40929 8.31439 -33.92412 1.000 44.89141 C ? O ? . CM 1
   HETATM 1651 O2 . MPD B 205 ? -11.46347 6.73841 -32.47925 1.000 55.98205 O ? O ? . O2 1
   HETATM 1652 O4 . MPD B 205 ? -9.89058 9.09429 -35.73960 1.000 66.81508 O ? O ? . O4 1
   HETATM 1653 C1 . MPD B 206 ? -6.10976 1.33470 -32.73229 1.000 40.21139 C ? P ? . C1 1
   HETATM 1654 C2 . MPD B 206 ? -6.30203 2.72126 -32.18070 1.000 52.04564 C ? P ? . C2 1
   HETATM 1655 C3 . MPD B 206 ? -5.51664 2.70380 -30.85332 1.000 52.86047 C ? P ? . C3 1
   HETATM 1656 C4 . MPD B 206 ? -5.33943 1.30832 -30.26358 1.000 50.53579 C ? P ? . C4 1
   HETATM 1657 C5 . MPD B 206 ? -6.04843 1.20449 -28.93572 1.000 57.06761 C ? P ? . C5 1
   HETATM 1658 CM . MPD B 206 ? -7.76665 2.99495 -31.96110 1.000 50.16925 C ? P ? . CM 1
   HETATM 1659 O2 . MPD B 206 ? -5.85487 3.60825 -33.18845 1.000 54.49698 O ? P ? . O2 1
   HETATM 1660 O4 . MPD B 206 ? -3.95778 0.94802 -30.16296 1.000 62.29864 O ? P ? . O4 1
   HETATM 1661 O . HOH B 304 ? -31.04262 15.33433 -42.25309 0.701 49.28909 O ? Q ? . O 1
   HETATM 1662 O . HOH B 305 ? -24.60647 16.06152 -37.82396 1.000 27.88455 O ? Q ? . O 1
   HETATM 1663 O . HOH B 306 ? -18.46701 20.06208 -40.09605 0.441 32.51231 O ? Q ? . O 1
   HETATM 1664 O . HOH B 307 ? -3.07140 -11.91786 -27.87520 1.000 36.42218 O ? Q ? . O 1
   HETATM 1665 O . HOH B 309 ? -28.99914 25.36491 -40.80264 1.000 37.83624 O ? Q ? . O 1
   HETATM 1670 O . HOH B 315 ? -19.24946 -1.79193 -25.25637 1.000 64.58537 O ? Q ? . O 1
   HETATM 1674 O . HOH B 320 ? -9.29973 -17.98208 -22.24330 1.000 59.89351 O ? Q ? . O 1
   HETATM 1675 O . HOH B 321 ? -7.34256 -19.65908 -21.54770 1.000 67.60866 O ? Q ? . O 1
   HETATM 1678 O . HOH B 325 ? -18.04597 -3.64463 -23.72993 1.000 54.34850 O ? Q ? . O 1
   HETATM 1994 O . HOH S 334 ? 2.48522 -14.81126 6.10020 0.921 32.65791 O ? R ? . O 1
   HETATM 1998 O . HOH S 338 ? -11.38665 -16.98874 23.07929 0.832 39.84050 O ? R ? . O 1
   HETATM 2001 O . HOH S 341 ? -8.60067 -1.46612 -39.53910 0.832 50.63567 O ? R ? . O 1
   HETATM 2003 O . HOH S 343 ? -12.35518 -3.57735 -40.64392 1.000 57.10214 O ? R ? . O 1
   HETATM 2005 O . HOH S 345 ? -5.66780 -12.19729 -28.32305 0.663 34.48190 O ? R ? . O 1
   HETATM 2014 O . HOH S 354 ? 13.45898 -17.46249 38.47546 1.000 64.18756 O ? R ? . O 1
   HETATM 2020 O . HOH S 360 ? -8.19740 -3.94750 -11.38643 0.670 34.08047 O ? R ? . O 1
   HETATM 2027 O . HOH S 367 ? -23.00214 4.74589 -32.73659 1.000 51.78669 O ? R ? . O 1
   HETATM 2030 O . HOH S 370 ? -32.20400 17.44432 -40.68938 0.581 35.68006 O ? R ? . O 1
   HETATM 2031 O . HOH S 371 ? -3.46677 4.26784 -32.65677 0.779 45.14714 O ? R ? . O 1
   HETATM 2049 O . HOH S 376 ? -2.33172 -11.99438 -30.11091 0.434 33.30326 O ? S ? . O 1
   HETATM 2064 O . HOH S 391 ? -5.97544 -19.47594 4.04076 0.791 44.32834 O ? S ? . O 1
   HETATM 2066 O . HOH S 393 ? 1.29655 -23.08127 7.72938 0.610 36.58163 O ? S ? . O 1
   HETATM 2067 O . HOH S 394 ? -11.13435 -20.20476 19.05868 0.836 45.43797 O ? S ? . O 1
   HETATM 2076 O . HOH S 398 ? -7.92171 -10.77130 31.43591 0.715 41.76292 O ? T ? . O 1
   HETATM 2087 O . HOH S 409 ? -5.16190 -4.20017 -11.18735 0.673 36.83523 O ? T ? . O 1
   HETATM 2088 O . HOH S 410 ? -29.75306 26.19577 -38.49112 0.612 33.54701 O ? T ? . O 1
   HETATM 2090 O . HOH S 412 ? -26.05702 12.93874 -38.91519 0.400 36.51723 O ? T ? . O 1
   HETATM 2091 O . HOH S 414 ? -25.61715 9.98551 -35.87724 0.569 37.13726 O ? U ? . O 1
   HETATM 2095 O . HOH S 418 ? -14.15505 -8.92260 -4.71704 0.759 45.92920 O ? U ? . O 1
   HETATM 2097 O . HOH S 420 ? -1.75731 5.18376 -30.98168 0.513 41.04525 O ? U ? . O 1
   HETATM 2098 O . HOH S 421 ? -15.27830 -4.11945 -37.75120 0.624 42.03966 O ? U ? . O 1
   HETATM 2103 O . HOH S 426 ? -9.39987 -15.31732 3.68996 0.775 52.49079 O ? U ? . O 1
   HETATM 2118 O . HOH S 441 ? -3.64003 2.19065 -27.39470 0.365 47.93318 O ? U ? . O 1
   HETATM 2133 O . HOH S 451 ? -7.14511 -21.33290 6.32724 0.484 40.74584 O ? V ? . O 1
   HETATM 2146 O . HOH S 464 ? -0.53742 -9.86732 -6.03263 0.591 46.27548 O ? V ? . O 1

data_comp_K
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
   K K K K 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
   K K 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
   K . 'POTASSIUM ION                       ' non-polymer 1 1 .

data_comp_BA
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
   BA BA BA BA 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
   BA BA 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
   BA . 'BARIUM ION                          ' non-polymer 1 1 .

data_comp_MPD
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
   MPD C1 C CH3 0 -0.653 -2.5669 -3.3055 8.5397
   MPD C2 C CT 0 0.207 -2.9214 -4.0790 9.8049
   MPD O2 O OH1 0 -0.696 -2.5097 -5.4207 9.5854
   MPD CM C CH3 0 -0.675 -4.4346 -4.0245 10.0264
   MPD C3 C CH2 0 -0.447 -2.1576 -3.4630 10.9905
   MPD C4 C CH1 0 0.034 -2.4722 -4.0328 12.3678
   MPD O4 O OH1 0 -0.680 -2.2574 -5.4404 12.3218
   MPD C5 C CH3 0 -0.674 -1.6159 -3.3868 13.4458
   MPD H11 H HCH3 0 0.220 -2.9005 -2.2703 8.6143
   MPD H12 H HCH3 0 0.225 -1.4885 -3.3003 8.3697
   MPD H13 H HCH3 0 0.227 -3.0473 -3.7484 7.6651
   MPD HO2 H HOH1 0 0.439 -2.4951 -5.8456 10.4543
   MPD HM1 H HCH3 0 0.228 -4.7470 -4.6441 10.8689
   MPD HM2 H HCH3 0 0.216 -4.7730 -3.0050 10.2204
   MPD HM3 H HCH3 0 0.228 -4.9598 -4.3856 9.1402
   MPD H31 H HCH2 0 0.226 -1.0819 -3.5558 10.7990
   MPD H32 H HCH2 0 0.228 -2.3693 -2.3910 11.0276
   MPD H4 H HCH1 0 0.210 -3.5253 -3.8291 12.6001
   MPD HO4 H HOH1 0 0.457 -2.6221 -5.8374 13.1192
   MPD H51 H HCH3 0 0.232 -1.8537 -3.7908 14.4317
   MPD H52 H HCH3 0 0.223 -0.5541 -3.5533 13.2554
   MPD H53 H HCH3 0 0.225 -1.7886 -2.3105 13.4817

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
   MPD C1 C2 single 1.525 0.020 1.525
   MPD C1 H11 single 0.970 0.020 1.090
   MPD C1 H12 single 0.970 0.020 1.090
   MPD C1 H13 single 0.970 0.020 1.090
   MPD C2 O2 single 1.421 0.020 1.421
   MPD C2 CM single 1.530 0.020 1.530
   MPD C2 C3 single 1.539 0.020 1.539
   MPD O2 HO2 single 0.850 0.020 0.980
   MPD CM HM1 single 0.970 0.020 1.090
   MPD CM HM2 single 0.970 0.020 1.090
   MPD CM HM3 single 0.970 0.020 1.090
   MPD C3 C4 single 1.523 0.020 1.523
   MPD C3 H31 single 0.970 0.020 1.090
   MPD C3 H32 single 0.970 0.020 1.090
   MPD C4 O4 single 1.425 0.020 1.425
   MPD C4 C5 single 1.521 0.020 1.521
   MPD C4 H4 single 0.970 0.020 1.090
   MPD O4 HO4 single 0.850 0.020 0.980
   MPD C5 H51 single 0.970 0.020 1.090
   MPD C5 H52 single 0.970 0.020 1.090
   MPD C5 H53 single 0.970 0.020 1.090

loop_
  _chem_comp_angle.comp_id
  _chem_comp_angle.atom_id_1
  _chem_comp_angle.atom_id_2
  _chem_comp_angle.atom_id_3
  _chem_comp_angle.value_angle
  _chem_comp_angle.value_angle_esd
   MPD H13 C1 H12 108.17 3.000
   MPD H13 C1 H11 107.78 3.000
   MPD H12 C1 H11 107.96 3.000
   MPD H13 C1 C2 110.90 3.000
   MPD H12 C1 C2 111.18 3.000
   MPD H11 C1 C2 110.72 3.000
   MPD C3 C2 CM 111.41 3.000
   MPD C3 C2 O2 110.69 3.000
   MPD CM C2 O2 110.04 3.000
   MPD C3 C2 C1 108.71 3.000
   MPD CM C2 C1 109.39 3.000
   MPD O2 C2 C1 106.47 3.000
   MPD HO2 O2 C2 106.29 3.000
   MPD HM3 CM HM2 107.70 3.000
   MPD HM3 CM HM1 107.53 3.000
   MPD HM2 CM HM1 107.71 3.000
   MPD HM3 CM C2 110.27 3.000
   MPD HM2 CM C2 111.44 3.000
   MPD HM1 CM C2 112.00 3.000
   MPD H32 C3 H31 106.19 3.000
   MPD H32 C3 C4 107.23 3.000
   MPD H31 C3 C4 109.20 3.000
   MPD H32 C3 C2 108.81 3.000
   MPD H31 C3 C2 108.57 3.000
   MPD C4 C3 C2 116.38 3.000
   MPD H4 C4 C5 108.15 3.000
   MPD H4 C4 O4 109.56 3.000
   MPD C5 C4 O4 110.96 3.000
   MPD H4 C4 C3 108.67 3.000
   MPD C5 C4 C3 111.45 3.000
   MPD O4 C4 C3 108.01 3.000
   MPD HO4 O4 C4 108.89 3.000
   MPD H53 C5 H52 108.08 3.000
   MPD H53 C5 H51 107.52 3.000
   MPD H52 C5 H51 108.24 3.000
   MPD H53 C5 C4 110.69 3.000
   MPD H52 C5 C4 111.06 3.000
   MPD H51 C5 C4 111.12 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
   MPD Var_01 C4 C3 C2 C1 175.15 30.0 3
   MPD Var_02 HM1 CM C2 C1 174.58 30.0 3
   MPD Var_03 H11 C1 C2 O2 177.16 30.0 3
   MPD Var_04 O4 C4 C3 C2 55.47 30.0 3
   MPD Var_05 C5 C4 C3 C2 177.61 30.0 3
   MPD Var_06 HO2 O2 C2 C1 164.08 30.0 3
   MPD Var_07 H4 C4 C3 C2 -63.32 30.0 3
   MPD Var_08 HO4 O4 C4 C3 -168.41 30.0 3
   MPD Var_09 H51 C5 C4 C3 179.35 30.0 3
   MPD Var_10 H52 C5 C4 C3 -60.10 30.0 3
   MPD Var_11 H53 C5 C4 C3 59.96 30.0 3

loop_
  _chem_comp_chir.comp_id
  _chem_comp_chir.id
  _chem_comp_chir.atom_id_centre
  _chem_comp_chir.atom_id_1
  _chem_comp_chir.atom_id_2
  _chem_comp_chir.atom_id_3
  _chem_comp_chir.volume_sign
   MPD chir_01 C4 C3 O4 C5 negativ

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
   MPD MPD (4S)-2-methylpentane-2,4-diol ligand 22 8 .

