HEADER    STRUCTURAL PROTEIN                      08-JUN-99   1QQV              
TITLE     SOLUTION STRUCTURE OF THE HEADPIECE DOMAIN OF CHICKEN VILLIN          
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: VILLIN HEADPIECE DOMAIN;                                   
COMPND   3 CHAIN: A;                                                            
COMPND   4 FRAGMENT: HP67                                                       
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: GALLUS GALLUS;                                  
SOURCE   3 ORGANISM_COMMON: CHICKEN;                                            
SOURCE   4 ORGANISM_TAXID: 9031                                                 
KEYWDS    F-ACTIN BINDING DOMAIN, SALT-BRIDGE, STRUCTURAL PROTEIN               
EXPDTA    SOLUTION NMR                                                          
MDLTYP    MINIMIZED AVERAGE                                                     
AUTHOR    D.VARDAR,D.A.BUCKLEY,B.S.FRANK,C.J.MCKNIGHT                           
REVDAT   4   02-MAR-22 1QQV    1       REMARK                                   
REVDAT   3   24-FEB-09 1QQV    1       VERSN                                    
REVDAT   2   09-FEB-00 1QQV    1       HEADER REMARK                            
REVDAT   1   29-DEC-99 1QQV    0                                                
JRNL        AUTH   D.VARDAR,D.A.BUCKLEY,B.S.FRANK,C.J.MCKNIGHT                  
JRNL        TITL   NMR STRUCTURE OF AN F-ACTIN-BINDING "HEADPIECE" MOTIF FROM   
JRNL        TITL 2 VILLIN.                                                      
JRNL        REF    J.MOL.BIOL.                   V. 294  1299 1999              
JRNL        REFN                   ISSN 0022-2836                               
JRNL        PMID   10600386                                                     
JRNL        DOI    10.1006/JMBI.1999.3321                                       
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : X-PLOR                                               
REMARK   3   AUTHORS     : BRUNGER                                              
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS:                                           
REMARK   3  THIS MINIMIZED AVERAGE STRUCTURE BASED ON A TOTAL OF 1219 DISTANCE  
REMARK   3  RESTRAINTS,                                                         
REMARK   3  1201 ARE NOE-DERIVED DISTANCE CONSTRAINTS, 18 ARE FROM HYDROGEN     
REMARK   3  BONDS. THERE                                                        
REMARK   3  ARE 61 DIHEDRAL ANGLE RESTRAINTS.                                   
REMARK   4                                                                      
REMARK   4 1QQV COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 24-JUN-99.                  
REMARK 100 THE DEPOSITION ID IS D_1000009159.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 293; 293; 293; 293                 
REMARK 210  PH                             : 7.0; 7.0; 7.0; 7.0                 
REMARK 210  IONIC STRENGTH                 : LOW; LOW; LOW; LOW                 
REMARK 210  PRESSURE                       : AMBIENT; AMBIENT; AMBIENT;         
REMARK 210                                   AMBIENT                            
REMARK 210  SAMPLE CONTENTS                : 1 MM HP67, 10 MM PHOSPHATE         
REMARK 210                                   BUFFER, PH 7.0; 1 MM HP67 U-15N ,  
REMARK 210                                   10 MM PHOSPHATE BUFFER, PH 7.0;    
REMARK 210                                   1 MM HP67 U-15N,10% 13C, 10 MM     
REMARK 210                                   PHOSPHATE BUFFER, PH 7.0; 1 MM     
REMARK 210                                   HP67                               
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D NOESY; 3D_15N                   
REMARK 210                                   -SEPARATED_NOESY; HNHA; E-COSY;    
REMARK 210                                   HNHB                               
REMARK 210  SPECTROMETER FIELD STRENGTH    : 500 MHZ                            
REMARK 210  SPECTROMETER MODEL             : DMX                                
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : X-PLOR                             
REMARK 210   METHOD USED                   : DISTANCE GEOMETRY SIMULATED        
REMARK 210                                   ANNEALING                          
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 31                                 
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 1                                  
REMARK 210 CONFORMERS, SELECTION CRITERIA  : NO NOE VIOLATION > 0.3, NO ANGLE   
REMARK 210                                   VIOLATIONS GREATER THAN 5 DEGREES  
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 10                  
REMARK 210                                                                      
REMARK 210 REMARK: THE COORDINATES ARE THE AVERAGE OF THE 10 LOWEST ENERGY      
REMARK 210  STRUCTURES OF THE 31 CALCULATED.                                    
REMARK 215                                                                      
REMARK 215 NMR STUDY                                                            
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: TORSION ANGLES                                             
REMARK 500                                                                      
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:            
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)                    
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-           
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400            
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        PSI       PHI                                   
REMARK 500    THR A  11      178.05     64.93                                   
REMARK 500    LYS A  12      136.23     74.21                                   
REMARK 500    LEU A  21      -78.69    -87.90                                   
REMARK 500    ASN A  23      -46.43    172.64                                   
REMARK 500    THR A  24     -133.62   -143.97                                   
REMARK 500    ALA A  25     -158.11   -104.78                                   
REMARK 500    SER A  43      171.09    -52.60                                   
REMARK 500    PRO A  62      -80.46    -77.23                                   
REMARK 500    LEU A  63      -36.43    168.51                                   
REMARK 500    LEU A  75      -45.96   -136.65                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: PLANAR GROUPS                                              
REMARK 500                                                                      
REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL                 
REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE                    
REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN                    
REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS                        
REMARK 500 AN RMSD GREATER THAN THIS VALUE                                      
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        RMS     TYPE                                    
REMARK 500    ARG A  31         0.31    SIDE CHAIN                              
REMARK 500    ARG A  37         0.32    SIDE CHAIN                              
REMARK 500    ARG A  55         0.28    SIDE CHAIN                              
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
DBREF  1QQV A   10    76  UNP    P02640   VILI_CHICK     760    826             
SEQRES   1 A   67  PRO THR LYS LEU GLU THR PHE PRO LEU ASP VAL LEU VAL          
SEQRES   2 A   67  ASN THR ALA ALA GLU ASP LEU PRO ARG GLY VAL ASP PRO          
SEQRES   3 A   67  SER ARG LYS GLU ASN HIS LEU SER ASP GLU ASP PHE LYS          
SEQRES   4 A   67  ALA VAL PHE GLY MET THR ARG SER ALA PHE ALA ASN LEU          
SEQRES   5 A   67  PRO LEU TRP LYS GLN GLN ASN LEU LYS LYS GLU LYS GLY          
SEQRES   6 A   67  LEU PHE                                                      
HELIX    1   1 PRO A   17  VAL A   22  1                                   6    
HELIX    2   2 LYS A   38  HIS A   41  5                                   4    
HELIX    3   3 SER A   43  PHE A   51  1                                   9    
HELIX    4   4 THR A   54  ASN A   60  1                                   7    
HELIX    5   5 LEU A   63  GLY A   74  1                                  12    
CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1          
ORIGX1      1.000000  0.000000  0.000000        0.00000                         
ORIGX2      0.000000  1.000000  0.000000        0.00000                         
ORIGX3      0.000000  0.000000  1.000000        0.00000                         
SCALE1      1.000000  0.000000  0.000000        0.00000                         
SCALE2      0.000000  1.000000  0.000000        0.00000                         
SCALE3      0.000000  0.000000  1.000000        0.00000                         
ATOM      1  N   PRO A  10       1.536  -5.915  20.952  1.00  7.36           N  
ATOM      2  CA  PRO A  10       1.090  -4.485  21.022  1.00  6.55           C  
ATOM      3  C   PRO A  10       1.796  -3.658  19.940  1.00  5.73           C  
ATOM      4  O   PRO A  10       3.004  -3.726  19.786  1.00  5.80           O  
ATOM      5  CB  PRO A  10       1.448  -3.942  22.406  1.00  6.65           C  
ATOM      6  CG  PRO A  10       2.122  -5.070  23.176  1.00  7.47           C  
ATOM      7  CD  PRO A  10       2.170  -6.287  22.254  1.00  7.85           C  
ATOM      8  H2  PRO A  10       2.228  -6.033  20.184  1.00  7.25           H  
ATOM      9  H3  PRO A  10       0.713  -6.528  20.776  1.00  7.94           H  
ATOM     10  HA  PRO A  10       0.021  -4.432  20.880  1.00  6.82           H  
ATOM     11  HB2 PRO A  10       2.126  -3.105  22.308  1.00  6.14           H  
ATOM     12  HB3 PRO A  10       0.553  -3.634  22.924  1.00  6.98           H  
ATOM     13  HG2 PRO A  10       3.125  -4.777  23.454  1.00  7.42           H  
ATOM     14  HG3 PRO A  10       1.549  -5.307  24.059  1.00  8.09           H  
ATOM     15  HD2 PRO A  10       3.197  -6.579  22.090  1.00  7.97           H  
ATOM     16  HD3 PRO A  10       1.626  -7.106  22.700  1.00  8.59           H  
ATOM     17  N   THR A  11       1.044  -2.877  19.191  1.00  5.27           N  
ATOM     18  CA  THR A  11       1.645  -2.028  18.105  1.00  4.79           C  
ATOM     19  C   THR A  11       2.248  -2.929  17.009  1.00  4.04           C  
ATOM     20  O   THR A  11       2.224  -4.144  17.110  1.00  4.32           O  
ATOM     21  CB  THR A  11       2.742  -1.112  18.691  1.00  5.60           C  
ATOM     22  OG1 THR A  11       2.435  -0.783  20.043  1.00  6.29           O  
ATOM     23  CG2 THR A  11       2.833   0.177  17.868  1.00  6.04           C  
ATOM     24  H   THR A  11       0.077  -2.848  19.344  1.00  5.51           H  
ATOM     25  HA  THR A  11       0.869  -1.416  17.668  1.00  4.77           H  
ATOM     26  HB  THR A  11       3.692  -1.621  18.654  1.00  5.65           H  
ATOM     27  HG1 THR A  11       1.586  -0.333  20.057  1.00  6.65           H  
ATOM     28 HG21 THR A  11       3.622   0.082  17.137  1.00  6.11           H  
ATOM     29 HG22 THR A  11       3.049   1.009  18.523  1.00  6.27           H  
ATOM     30 HG23 THR A  11       1.894   0.351  17.364  1.00  6.38           H  
ATOM     31  N   LYS A  12       2.782  -2.332  15.961  1.00  3.42           N  
ATOM     32  CA  LYS A  12       3.392  -3.120  14.838  1.00  2.80           C  
ATOM     33  C   LYS A  12       2.289  -3.764  13.984  1.00  2.29           C  
ATOM     34  O   LYS A  12       1.329  -4.312  14.497  1.00  2.80           O  
ATOM     35  CB  LYS A  12       4.318  -4.210  15.397  1.00  3.26           C  
ATOM     36  CG  LYS A  12       5.425  -4.515  14.383  1.00  3.56           C  
ATOM     37  CD  LYS A  12       5.223  -5.920  13.811  1.00  3.91           C  
ATOM     38  CE  LYS A  12       6.053  -6.077  12.535  1.00  4.67           C  
ATOM     39  NZ  LYS A  12       5.701  -7.362  11.865  1.00  5.08           N  
ATOM     40  H   LYS A  12       2.778  -1.354  15.910  1.00  3.64           H  
ATOM     41  HA  LYS A  12       3.970  -2.451  14.216  1.00  2.69           H  
ATOM     42  HB2 LYS A  12       4.762  -3.864  16.320  1.00  3.76           H  
ATOM     43  HB3 LYS A  12       3.748  -5.107  15.586  1.00  3.29           H  
ATOM     44  HG2 LYS A  12       5.389  -3.790  13.582  1.00  3.70           H  
ATOM     45  HG3 LYS A  12       6.385  -4.463  14.873  1.00  3.88           H  
ATOM     46  HD2 LYS A  12       5.538  -6.654  14.539  1.00  3.88           H  
ATOM     47  HD3 LYS A  12       4.179  -6.068  13.579  1.00  4.18           H  
ATOM     48  HE2 LYS A  12       5.845  -5.255  11.866  1.00  5.15           H  
ATOM     49  HE3 LYS A  12       7.103  -6.079  12.787  1.00  4.85           H  
ATOM     50  HZ1 LYS A  12       5.976  -8.159  12.474  1.00  5.29           H  
ATOM     51  HZ2 LYS A  12       6.206  -7.431  10.959  1.00  5.07           H  
ATOM     52  HZ3 LYS A  12       4.674  -7.393  11.694  1.00  5.50           H  
ATOM     53  N   LEU A  13       2.430  -3.699  12.680  1.00  1.63           N  
ATOM     54  CA  LEU A  13       1.404  -4.299  11.768  1.00  1.22           C  
ATOM     55  C   LEU A  13       1.897  -5.654  11.242  1.00  0.84           C  
ATOM     56  O   LEU A  13       3.076  -5.961  11.290  1.00  0.98           O  
ATOM     57  CB  LEU A  13       1.144  -3.354  10.585  1.00  1.10           C  
ATOM     58  CG  LEU A  13       2.463  -3.020   9.874  1.00  1.23           C  
ATOM     59  CD1 LEU A  13       2.347  -3.357   8.385  1.00  1.27           C  
ATOM     60  CD2 LEU A  13       2.765  -1.528  10.035  1.00  1.77           C  
ATOM     61  H   LEU A  13       3.216  -3.252  12.300  1.00  1.78           H  
ATOM     62  HA  LEU A  13       0.484  -4.445  12.315  1.00  1.66           H  
ATOM     63  HB2 LEU A  13       0.471  -3.832   9.888  1.00  1.27           H  
ATOM     64  HB3 LEU A  13       0.693  -2.443  10.948  1.00  1.61           H  
ATOM     65  HG  LEU A  13       3.264  -3.600  10.309  1.00  1.53           H  
ATOM     66 HD11 LEU A  13       3.325  -3.599   7.994  1.00  1.66           H  
ATOM     67 HD12 LEU A  13       1.948  -2.506   7.852  1.00  1.54           H  
ATOM     68 HD13 LEU A  13       1.689  -4.204   8.257  1.00  1.70           H  
ATOM     69 HD21 LEU A  13       2.876  -1.294  11.084  1.00  2.08           H  
ATOM     70 HD22 LEU A  13       1.952  -0.949   9.621  1.00  2.17           H  
ATOM     71 HD23 LEU A  13       3.680  -1.287   9.514  1.00  2.24           H  
ATOM     72  N   GLU A  14       0.998  -6.463  10.732  1.00  1.00           N  
ATOM     73  CA  GLU A  14       1.391  -7.798  10.191  1.00  0.90           C  
ATOM     74  C   GLU A  14       1.821  -7.643   8.724  1.00  0.71           C  
ATOM     75  O   GLU A  14       2.146  -6.557   8.277  1.00  0.91           O  
ATOM     76  CB  GLU A  14       0.197  -8.757  10.294  1.00  1.49           C  
ATOM     77  CG  GLU A  14      -0.198  -8.934  11.765  1.00  2.32           C  
ATOM     78  CD  GLU A  14      -1.549  -8.254  12.026  1.00  3.01           C  
ATOM     79  OE1 GLU A  14      -1.558  -7.048  12.218  1.00  3.61           O  
ATOM     80  OE2 GLU A  14      -2.550  -8.952  12.030  1.00  3.37           O  
ATOM     81  H   GLU A  14       0.059  -6.189  10.698  1.00  1.46           H  
ATOM     82  HA  GLU A  14       2.217  -8.191  10.764  1.00  0.88           H  
ATOM     83  HB2 GLU A  14      -0.636  -8.350   9.743  1.00  1.67           H  
ATOM     84  HB3 GLU A  14       0.468  -9.716   9.880  1.00  1.70           H  
ATOM     85  HG2 GLU A  14      -0.276  -9.988  11.990  1.00  2.67           H  
ATOM     86  HG3 GLU A  14       0.554  -8.487  12.398  1.00  2.79           H  
ATOM     87  N   THR A  15       1.837  -8.720   7.978  1.00  0.59           N  
ATOM     88  CA  THR A  15       2.258  -8.638   6.544  1.00  0.50           C  
ATOM     89  C   THR A  15       1.300  -9.446   5.655  1.00  0.43           C  
ATOM     90  O   THR A  15       1.425 -10.652   5.521  1.00  0.52           O  
ATOM     91  CB  THR A  15       3.691  -9.175   6.387  1.00  0.58           C  
ATOM     92  OG1 THR A  15       3.827 -10.413   7.082  1.00  1.30           O  
ATOM     93  CG2 THR A  15       4.686  -8.155   6.950  1.00  1.01           C  
ATOM     94  H   THR A  15       1.580  -9.581   8.364  1.00  0.79           H  
ATOM     95  HA  THR A  15       2.235  -7.604   6.230  1.00  0.64           H  
ATOM     96  HB  THR A  15       3.901  -9.330   5.340  1.00  0.72           H  
ATOM     97  HG1 THR A  15       3.861 -10.228   8.024  1.00  1.90           H  
ATOM     98 HG21 THR A  15       5.694  -8.488   6.753  1.00  1.50           H  
ATOM     99 HG22 THR A  15       4.540  -8.059   8.016  1.00  1.61           H  
ATOM    100 HG23 THR A  15       4.525  -7.197   6.477  1.00  1.54           H  
ATOM    101  N   PHE A  16       0.357  -8.777   5.035  1.00  0.31           N  
ATOM    102  CA  PHE A  16      -0.611  -9.475   4.124  1.00  0.28           C  
ATOM    103  C   PHE A  16      -0.334  -9.046   2.682  1.00  0.26           C  
ATOM    104  O   PHE A  16       0.393  -8.097   2.444  1.00  0.25           O  
ATOM    105  CB  PHE A  16      -2.065  -9.086   4.448  1.00  0.26           C  
ATOM    106  CG  PHE A  16      -2.275  -8.863   5.925  1.00  0.28           C  
ATOM    107  CD1 PHE A  16      -1.783  -7.708   6.541  1.00  1.20           C  
ATOM    108  CD2 PHE A  16      -2.990  -9.804   6.671  1.00  1.25           C  
ATOM    109  CE1 PHE A  16      -2.003  -7.494   7.902  1.00  1.20           C  
ATOM    110  CE2 PHE A  16      -3.210  -9.594   8.033  1.00  1.27           C  
ATOM    111  CZ  PHE A  16      -2.718  -8.437   8.651  1.00  0.38           C  
ATOM    112  H   PHE A  16       0.294  -7.805   5.155  1.00  0.28           H  
ATOM    113  HA  PHE A  16      -0.492 -10.546   4.208  1.00  0.33           H  
ATOM    114  HB2 PHE A  16      -2.311  -8.178   3.920  1.00  0.22           H  
ATOM    115  HB3 PHE A  16      -2.723  -9.877   4.115  1.00  0.29           H  
ATOM    116  HD1 PHE A  16      -1.232  -6.980   5.964  1.00  2.10           H  
ATOM    117  HD2 PHE A  16      -3.369 -10.696   6.194  1.00  2.14           H  
ATOM    118  HE1 PHE A  16      -1.621  -6.603   8.373  1.00  2.10           H  
ATOM    119  HE2 PHE A  16      -3.767 -10.320   8.604  1.00  2.18           H  
ATOM    120  HZ  PHE A  16      -2.890  -8.273   9.704  1.00  0.43           H  
ATOM    121  N   PRO A  17      -0.952  -9.739   1.755  1.00  0.28           N  
ATOM    122  CA  PRO A  17      -0.821  -9.426   0.327  1.00  0.30           C  
ATOM    123  C   PRO A  17      -1.702  -8.215  -0.012  1.00  0.28           C  
ATOM    124  O   PRO A  17      -2.278  -7.594   0.865  1.00  0.25           O  
ATOM    125  CB  PRO A  17      -1.317 -10.695  -0.368  1.00  0.37           C  
ATOM    126  CG  PRO A  17      -2.220 -11.427   0.651  1.00  0.38           C  
ATOM    127  CD  PRO A  17      -1.830 -10.895   2.042  1.00  0.34           C  
ATOM    128  HA  PRO A  17       0.206  -9.238   0.071  1.00  0.32           H  
ATOM    129  HB2 PRO A  17      -1.882 -10.438  -1.255  1.00  0.40           H  
ATOM    130  HB3 PRO A  17      -0.480 -11.321  -0.623  1.00  0.41           H  
ATOM    131  HG2 PRO A  17      -3.259 -11.211   0.445  1.00  0.39           H  
ATOM    132  HG3 PRO A  17      -2.045 -12.490   0.605  1.00  0.44           H  
ATOM    133  HD2 PRO A  17      -2.710 -10.582   2.583  1.00  0.32           H  
ATOM    134  HD3 PRO A  17      -1.288 -11.646   2.597  1.00  0.38           H  
ATOM    135  N   LEU A  18      -1.811  -7.869  -1.267  1.00  0.34           N  
ATOM    136  CA  LEU A  18      -2.653  -6.696  -1.643  1.00  0.36           C  
ATOM    137  C   LEU A  18      -4.121  -7.116  -1.831  1.00  0.38           C  
ATOM    138  O   LEU A  18      -4.984  -6.279  -1.997  1.00  0.43           O  
ATOM    139  CB  LEU A  18      -2.131  -6.061  -2.933  1.00  0.43           C  
ATOM    140  CG  LEU A  18      -2.110  -7.098  -4.060  1.00  0.58           C  
ATOM    141  CD1 LEU A  18      -2.779  -6.513  -5.304  1.00  0.92           C  
ATOM    142  CD2 LEU A  18      -0.660  -7.466  -4.384  1.00  0.83           C  
ATOM    143  H   LEU A  18      -1.340  -8.375  -1.956  1.00  0.38           H  
ATOM    144  HA  LEU A  18      -2.595  -5.972  -0.853  1.00  0.32           H  
ATOM    145  HB2 LEU A  18      -2.778  -5.240  -3.207  1.00  0.53           H  
ATOM    146  HB3 LEU A  18      -1.132  -5.689  -2.767  1.00  0.41           H  
ATOM    147  HG  LEU A  18      -2.646  -7.983  -3.747  1.00  0.61           H  
ATOM    148 HD11 LEU A  18      -3.750  -6.122  -5.039  1.00  1.51           H  
ATOM    149 HD12 LEU A  18      -2.894  -7.287  -6.049  1.00  1.35           H  
ATOM    150 HD13 LEU A  18      -2.167  -5.717  -5.702  1.00  1.26           H  
ATOM    151 HD21 LEU A  18      -0.293  -6.826  -5.172  1.00  1.10           H  
ATOM    152 HD22 LEU A  18      -0.613  -8.496  -4.704  1.00  1.49           H  
ATOM    153 HD23 LEU A  18      -0.051  -7.335  -3.501  1.00  1.25           H  
ATOM    154  N   ASP A  19      -4.416  -8.397  -1.806  1.00  0.40           N  
ATOM    155  CA  ASP A  19      -5.828  -8.844  -1.983  1.00  0.45           C  
ATOM    156  C   ASP A  19      -6.594  -8.633  -0.673  1.00  0.40           C  
ATOM    157  O   ASP A  19      -7.668  -8.057  -0.662  1.00  0.41           O  
ATOM    158  CB  ASP A  19      -5.860 -10.327  -2.372  1.00  0.50           C  
ATOM    159  CG  ASP A  19      -5.204 -10.515  -3.744  1.00  0.83           C  
ATOM    160  OD1 ASP A  19      -5.912 -10.431  -4.735  1.00  1.50           O  
ATOM    161  OD2 ASP A  19      -4.004 -10.738  -3.781  1.00  1.39           O  
ATOM    162  H   ASP A  19      -3.714  -9.059  -1.670  1.00  0.40           H  
ATOM    163  HA  ASP A  19      -6.283  -8.255  -2.762  1.00  0.49           H  
ATOM    164  HB2 ASP A  19      -5.322 -10.903  -1.633  1.00  0.64           H  
ATOM    165  HB3 ASP A  19      -6.884 -10.665  -2.415  1.00  0.61           H  
ATOM    166  N   VAL A  20      -6.032  -9.075   0.431  1.00  0.37           N  
ATOM    167  CA  VAL A  20      -6.697  -8.886   1.764  1.00  0.34           C  
ATOM    168  C   VAL A  20      -6.916  -7.384   1.990  1.00  0.30           C  
ATOM    169  O   VAL A  20      -7.881  -6.966   2.600  1.00  0.30           O  
ATOM    170  CB  VAL A  20      -5.783  -9.432   2.876  1.00  0.33           C  
ATOM    171  CG1 VAL A  20      -6.555  -9.526   4.197  1.00  0.36           C  
ATOM    172  CG2 VAL A  20      -5.270 -10.823   2.495  1.00  0.38           C  
ATOM    173  H   VAL A  20      -5.158  -9.517   0.384  1.00  0.37           H  
ATOM    174  HA  VAL A  20      -7.646  -9.403   1.779  1.00  0.38           H  
ATOM    175  HB  VAL A  20      -4.943  -8.765   3.002  1.00  0.29           H  
ATOM    176 HG11 VAL A  20      -7.301 -10.304   4.125  1.00  0.99           H  
ATOM    177 HG12 VAL A  20      -7.038  -8.582   4.401  1.00  0.97           H  
ATOM    178 HG13 VAL A  20      -5.868  -9.760   5.002  1.00  1.04           H  
ATOM    179 HG21 VAL A  20      -4.431 -10.721   1.824  1.00  1.12           H  
ATOM    180 HG22 VAL A  20      -6.058 -11.377   2.008  1.00  1.15           H  
ATOM    181 HG23 VAL A  20      -4.956 -11.347   3.386  1.00  0.95           H  
ATOM    182  N   LEU A  21      -5.990  -6.587   1.517  1.00  0.28           N  
ATOM    183  CA  LEU A  21      -6.044  -5.123   1.685  1.00  0.28           C  
ATOM    184  C   LEU A  21      -6.832  -4.469   0.550  1.00  0.35           C  
ATOM    185  O   LEU A  21      -7.973  -4.074   0.710  1.00  0.36           O  
ATOM    186  CB  LEU A  21      -4.608  -4.624   1.591  1.00  0.27           C  
ATOM    187  CG  LEU A  21      -3.832  -4.964   2.848  1.00  0.23           C  
ATOM    188  CD1 LEU A  21      -4.009  -6.431   3.244  1.00  0.20           C  
ATOM    189  CD2 LEU A  21      -2.352  -4.680   2.610  1.00  0.26           C  
ATOM    190  H   LEU A  21      -5.213  -6.962   1.069  1.00  0.29           H  
ATOM    191  HA  LEU A  21      -6.463  -4.862   2.643  1.00  0.26           H  
ATOM    192  HB2 LEU A  21      -4.126  -5.094   0.752  1.00  0.29           H  
ATOM    193  HB3 LEU A  21      -4.618  -3.555   1.445  1.00  0.30           H  
ATOM    194  HG  LEU A  21      -4.196  -4.360   3.623  1.00  0.24           H  
ATOM    195 HD11 LEU A  21      -5.030  -6.597   3.552  1.00  1.09           H  
ATOM    196 HD12 LEU A  21      -3.347  -6.662   4.064  1.00  0.98           H  
ATOM    197 HD13 LEU A  21      -3.778  -7.065   2.402  1.00  1.03           H  
ATOM    198 HD21 LEU A  21      -1.756  -5.315   3.250  1.00  0.95           H  
ATOM    199 HD22 LEU A  21      -2.143  -3.645   2.831  1.00  1.03           H  
ATOM    200 HD23 LEU A  21      -2.113  -4.885   1.575  1.00  1.10           H  
ATOM    201  N   VAL A  22      -6.192  -4.325  -0.584  1.00  0.41           N  
ATOM    202  CA  VAL A  22      -6.824  -3.666  -1.758  1.00  0.49           C  
ATOM    203  C   VAL A  22      -8.063  -4.443  -2.220  1.00  0.51           C  
ATOM    204  O   VAL A  22      -7.974  -5.589  -2.624  1.00  1.02           O  
ATOM    205  CB  VAL A  22      -5.808  -3.602  -2.895  1.00  0.62           C  
ATOM    206  CG1 VAL A  22      -6.419  -2.890  -4.106  1.00  1.32           C  
ATOM    207  CG2 VAL A  22      -4.561  -2.847  -2.431  1.00  1.21           C  
ATOM    208  H   VAL A  22      -5.265  -4.634  -0.651  1.00  0.41           H  
ATOM    209  HA  VAL A  22      -7.102  -2.669  -1.486  1.00  0.50           H  
ATOM    210  HB  VAL A  22      -5.535  -4.603  -3.163  1.00  0.55           H  
ATOM    211 HG11 VAL A  22      -6.527  -3.592  -4.919  1.00  1.87           H  
ATOM    212 HG12 VAL A  22      -5.773  -2.080  -4.412  1.00  1.90           H  
ATOM    213 HG13 VAL A  22      -7.389  -2.495  -3.841  1.00  1.55           H  
ATOM    214 HG21 VAL A  22      -4.094  -2.368  -3.277  1.00  1.84           H  
ATOM    215 HG22 VAL A  22      -3.868  -3.545  -1.984  1.00  1.58           H  
ATOM    216 HG23 VAL A  22      -4.841  -2.101  -1.702  1.00  1.62           H  
ATOM    217  N   ASN A  23      -9.213  -3.807  -2.173  1.00  0.64           N  
ATOM    218  CA  ASN A  23     -10.487  -4.462  -2.616  1.00  0.69           C  
ATOM    219  C   ASN A  23     -11.666  -3.550  -2.274  1.00  0.77           C  
ATOM    220  O   ASN A  23     -12.540  -3.314  -3.088  1.00  1.01           O  
ATOM    221  CB  ASN A  23     -10.669  -5.815  -1.916  1.00  0.79           C  
ATOM    222  CG  ASN A  23     -10.786  -6.927  -2.962  1.00  1.06           C  
ATOM    223  OD1 ASN A  23     -11.791  -7.039  -3.637  1.00  1.68           O  
ATOM    224  ND2 ASN A  23      -9.796  -7.763  -3.126  1.00  1.35           N  
ATOM    225  H   ASN A  23      -9.235  -2.881  -1.853  1.00  1.06           H  
ATOM    226  HA  ASN A  23     -10.457  -4.607  -3.676  1.00  0.84           H  
ATOM    227  HB2 ASN A  23      -9.819  -6.008  -1.279  1.00  1.02           H  
ATOM    228  HB3 ASN A  23     -11.567  -5.792  -1.320  1.00  0.86           H  
ATOM    229 HD21 ASN A  23      -8.985  -7.676  -2.582  1.00  1.67           H  
ATOM    230 HD22 ASN A  23      -9.863  -8.477  -3.794  1.00  1.62           H  
ATOM    231  N   THR A  24     -11.680  -3.036  -1.074  1.00  0.88           N  
ATOM    232  CA  THR A  24     -12.783  -2.122  -0.638  1.00  1.15           C  
ATOM    233  C   THR A  24     -12.195  -1.030   0.285  1.00  1.24           C  
ATOM    234  O   THR A  24     -11.178  -0.438  -0.035  1.00  1.78           O  
ATOM    235  CB  THR A  24     -13.877  -2.931   0.091  1.00  1.62           C  
ATOM    236  OG1 THR A  24     -13.967  -4.238  -0.464  1.00  2.17           O  
ATOM    237  CG2 THR A  24     -15.226  -2.224  -0.065  1.00  1.18           C  
ATOM    238  H   THR A  24     -10.953  -3.251  -0.459  1.00  0.97           H  
ATOM    239  HA  THR A  24     -13.212  -1.648  -1.510  1.00  1.21           H  
ATOM    240  HB  THR A  24     -13.635  -3.002   1.139  1.00  2.32           H  
ATOM    241  HG1 THR A  24     -13.916  -4.871   0.256  1.00  2.51           H  
ATOM    242 HG21 THR A  24     -15.895  -2.550   0.717  1.00  1.77           H  
ATOM    243 HG22 THR A  24     -15.651  -2.468  -1.028  1.00  1.21           H  
ATOM    244 HG23 THR A  24     -15.084  -1.156   0.005  1.00  1.39           H  
ATOM    245  N   ALA A  25     -12.819  -0.747   1.412  1.00  1.08           N  
ATOM    246  CA  ALA A  25     -12.294   0.308   2.328  1.00  1.35           C  
ATOM    247  C   ALA A  25     -11.621  -0.329   3.549  1.00  1.14           C  
ATOM    248  O   ALA A  25     -11.208  -1.474   3.511  1.00  0.97           O  
ATOM    249  CB  ALA A  25     -13.456   1.201   2.777  1.00  1.78           C  
ATOM    250  H   ALA A  25     -13.633  -1.218   1.652  1.00  1.14           H  
ATOM    251  HA  ALA A  25     -11.576   0.896   1.808  1.00  1.76           H  
ATOM    252  HB1 ALA A  25     -14.128   1.361   1.947  1.00  2.02           H  
ATOM    253  HB2 ALA A  25     -13.070   2.151   3.116  1.00  2.20           H  
ATOM    254  HB3 ALA A  25     -13.989   0.720   3.584  1.00  2.28           H  
ATOM    255  N   ALA A  26     -11.508   0.414   4.630  1.00  1.34           N  
ATOM    256  CA  ALA A  26     -10.872  -0.128   5.872  1.00  1.52           C  
ATOM    257  C   ALA A  26     -11.567  -1.437   6.273  1.00  1.23           C  
ATOM    258  O   ALA A  26     -10.968  -2.305   6.883  1.00  1.48           O  
ATOM    259  CB  ALA A  26     -11.010   0.893   7.005  1.00  1.91           C  
ATOM    260  H   ALA A  26     -11.847   1.333   4.623  1.00  1.49           H  
ATOM    261  HA  ALA A  26      -9.828  -0.318   5.686  1.00  1.72           H  
ATOM    262  HB1 ALA A  26     -12.056   1.086   7.190  1.00  1.74           H  
ATOM    263  HB2 ALA A  26     -10.519   1.812   6.722  1.00  2.42           H  
ATOM    264  HB3 ALA A  26     -10.552   0.501   7.901  1.00  2.41           H  
ATOM    265  N   GLU A  27     -12.827  -1.582   5.919  1.00  0.88           N  
ATOM    266  CA  GLU A  27     -13.581  -2.828   6.252  1.00  0.98           C  
ATOM    267  C   GLU A  27     -13.022  -4.021   5.457  1.00  0.81           C  
ATOM    268  O   GLU A  27     -13.273  -5.163   5.797  1.00  0.89           O  
ATOM    269  CB  GLU A  27     -15.066  -2.639   5.909  1.00  1.16           C  
ATOM    270  CG  GLU A  27     -15.225  -2.282   4.422  1.00  1.34           C  
ATOM    271  CD  GLU A  27     -15.748  -3.496   3.645  1.00  2.25           C  
ATOM    272  OE1 GLU A  27     -16.942  -3.744   3.704  1.00  2.80           O  
ATOM    273  OE2 GLU A  27     -14.948  -4.154   3.000  1.00  2.96           O  
ATOM    274  H   GLU A  27     -13.275  -0.869   5.422  1.00  0.76           H  
ATOM    275  HA  GLU A  27     -13.484  -3.025   7.307  1.00  1.35           H  
ATOM    276  HB2 GLU A  27     -15.600  -3.555   6.117  1.00  1.60           H  
ATOM    277  HB3 GLU A  27     -15.474  -1.842   6.512  1.00  1.69           H  
ATOM    278  HG2 GLU A  27     -15.923  -1.463   4.324  1.00  1.59           H  
ATOM    279  HG3 GLU A  27     -14.268  -1.985   4.019  1.00  1.77           H  
ATOM    280  N   ASP A  28     -12.277  -3.768   4.399  1.00  0.62           N  
ATOM    281  CA  ASP A  28     -11.720  -4.891   3.585  1.00  0.56           C  
ATOM    282  C   ASP A  28     -10.359  -5.326   4.136  1.00  0.42           C  
ATOM    283  O   ASP A  28     -10.098  -6.507   4.276  1.00  0.44           O  
ATOM    284  CB  ASP A  28     -11.543  -4.435   2.137  1.00  0.57           C  
ATOM    285  CG  ASP A  28     -11.278  -5.655   1.251  1.00  1.13           C  
ATOM    286  OD1 ASP A  28     -12.240  -6.265   0.813  1.00  1.79           O  
ATOM    287  OD2 ASP A  28     -10.118  -5.963   1.033  1.00  1.67           O  
ATOM    288  H   ASP A  28     -12.094  -2.837   4.134  1.00  0.60           H  
ATOM    289  HA  ASP A  28     -12.402  -5.727   3.614  1.00  0.72           H  
ATOM    290  HB2 ASP A  28     -12.440  -3.935   1.807  1.00  0.77           H  
ATOM    291  HB3 ASP A  28     -10.706  -3.754   2.073  1.00  0.70           H  
ATOM    292  N   LEU A  29      -9.493  -4.387   4.443  1.00  0.33           N  
ATOM    293  CA  LEU A  29      -8.149  -4.736   4.979  1.00  0.24           C  
ATOM    294  C   LEU A  29      -8.307  -5.606   6.241  1.00  0.24           C  
ATOM    295  O   LEU A  29      -9.320  -5.538   6.917  1.00  0.28           O  
ATOM    296  CB  LEU A  29      -7.404  -3.451   5.332  1.00  0.23           C  
ATOM    297  CG  LEU A  29      -7.452  -2.467   4.156  1.00  0.28           C  
ATOM    298  CD1 LEU A  29      -7.764  -1.066   4.677  1.00  0.39           C  
ATOM    299  CD2 LEU A  29      -6.097  -2.452   3.445  1.00  0.34           C  
ATOM    300  H   LEU A  29      -9.724  -3.447   4.319  1.00  0.39           H  
ATOM    301  HA  LEU A  29      -7.589  -5.277   4.226  1.00  0.28           H  
ATOM    302  HB2 LEU A  29      -7.859  -3.001   6.200  1.00  0.29           H  
ATOM    303  HB3 LEU A  29      -6.386  -3.691   5.548  1.00  0.26           H  
ATOM    304  HG  LEU A  29      -8.220  -2.770   3.460  1.00  0.30           H  
ATOM    305 HD11 LEU A  29      -7.950  -1.111   5.740  1.00  1.08           H  
ATOM    306 HD12 LEU A  29      -8.640  -0.684   4.173  1.00  1.15           H  
ATOM    307 HD13 LEU A  29      -6.925  -0.414   4.486  1.00  1.04           H  
ATOM    308 HD21 LEU A  29      -6.249  -2.314   2.385  1.00  1.03           H  
ATOM    309 HD22 LEU A  29      -5.593  -3.389   3.617  1.00  0.98           H  
ATOM    310 HD23 LEU A  29      -5.495  -1.643   3.831  1.00  1.02           H  
ATOM    311  N   PRO A  30      -7.302  -6.404   6.514  1.00  0.25           N  
ATOM    312  CA  PRO A  30      -7.293  -7.318   7.679  1.00  0.31           C  
ATOM    313  C   PRO A  30      -7.039  -6.559   8.993  1.00  0.34           C  
ATOM    314  O   PRO A  30      -6.945  -5.343   9.016  1.00  0.34           O  
ATOM    315  CB  PRO A  30      -6.142  -8.278   7.370  1.00  0.35           C  
ATOM    316  CG  PRO A  30      -5.218  -7.544   6.372  1.00  0.32           C  
ATOM    317  CD  PRO A  30      -6.079  -6.467   5.690  1.00  0.26           C  
ATOM    318  HA  PRO A  30      -8.219  -7.867   7.734  1.00  0.33           H  
ATOM    319  HB2 PRO A  30      -5.601  -8.514   8.278  1.00  0.39           H  
ATOM    320  HB3 PRO A  30      -6.522  -9.181   6.916  1.00  0.38           H  
ATOM    321  HG2 PRO A  30      -4.395  -7.084   6.901  1.00  0.35           H  
ATOM    322  HG3 PRO A  30      -4.846  -8.234   5.632  1.00  0.37           H  
ATOM    323  HD2 PRO A  30      -5.567  -5.515   5.694  1.00  0.24           H  
ATOM    324  HD3 PRO A  30      -6.326  -6.762   4.683  1.00  0.28           H  
ATOM    325  N   ARG A  31      -6.936  -7.282  10.086  1.00  0.41           N  
ATOM    326  CA  ARG A  31      -6.696  -6.639  11.416  1.00  0.48           C  
ATOM    327  C   ARG A  31      -5.306  -6.007  11.452  1.00  0.49           C  
ATOM    328  O   ARG A  31      -4.318  -6.622  11.089  1.00  0.52           O  
ATOM    329  CB  ARG A  31      -6.807  -7.692  12.524  1.00  0.57           C  
ATOM    330  CG  ARG A  31      -8.240  -7.723  13.063  1.00  1.40           C  
ATOM    331  CD  ARG A  31      -8.217  -8.022  14.564  1.00  1.99           C  
ATOM    332  NE  ARG A  31      -8.158  -6.743  15.329  1.00  2.68           N  
ATOM    333  CZ  ARG A  31      -7.016  -6.128  15.491  1.00  3.40           C  
ATOM    334  NH1 ARG A  31      -6.188  -6.521  16.424  1.00  3.95           N  
ATOM    335  NH2 ARG A  31      -6.702  -5.120  14.719  1.00  3.95           N  
ATOM    336  H   ARG A  31      -7.022  -8.258  10.030  1.00  0.43           H  
ATOM    337  HA  ARG A  31      -7.430  -5.867  11.582  1.00  0.49           H  
ATOM    338  HB2 ARG A  31      -6.550  -8.662  12.125  1.00  0.88           H  
ATOM    339  HB3 ARG A  31      -6.128  -7.443  13.326  1.00  1.09           H  
ATOM    340  HG2 ARG A  31      -8.710  -6.764  12.893  1.00  1.93           H  
ATOM    341  HG3 ARG A  31      -8.799  -8.493  12.553  1.00  1.82           H  
ATOM    342  HD2 ARG A  31      -9.113  -8.562  14.836  1.00  2.15           H  
ATOM    343  HD3 ARG A  31      -7.351  -8.623  14.799  1.00  2.47           H  
ATOM    344  HE  ARG A  31      -8.977  -6.362  15.710  1.00  2.98           H  
ATOM    345 HH11 ARG A  31      -6.429  -7.292  17.014  1.00  3.86           H  
ATOM    346 HH12 ARG A  31      -5.314  -6.052  16.549  1.00  4.68           H  
ATOM    347 HH21 ARG A  31      -7.335  -4.820  14.005  1.00  3.88           H  
ATOM    348 HH22 ARG A  31      -5.827  -4.649  14.840  1.00  4.66           H  
ATOM    349  N   GLY A  32      -5.236  -4.777  11.895  1.00  0.52           N  
ATOM    350  CA  GLY A  32      -3.928  -4.072  11.975  1.00  0.56           C  
ATOM    351  C   GLY A  32      -3.552  -3.517  10.599  1.00  0.52           C  
ATOM    352  O   GLY A  32      -2.436  -3.687  10.142  1.00  0.66           O  
ATOM    353  H   GLY A  32      -6.052  -4.316  12.180  1.00  0.54           H  
ATOM    354  HA2 GLY A  32      -4.007  -3.262  12.683  1.00  0.61           H  
ATOM    355  HA3 GLY A  32      -3.171  -4.765  12.301  1.00  0.60           H  
ATOM    356  N   VAL A  33      -4.474  -2.852   9.939  1.00  0.44           N  
ATOM    357  CA  VAL A  33      -4.180  -2.277   8.592  1.00  0.39           C  
ATOM    358  C   VAL A  33      -4.841  -0.901   8.461  1.00  0.36           C  
ATOM    359  O   VAL A  33      -5.978  -0.705   8.857  1.00  0.42           O  
ATOM    360  CB  VAL A  33      -4.714  -3.206   7.496  1.00  0.38           C  
ATOM    361  CG1 VAL A  33      -4.386  -2.615   6.122  1.00  0.42           C  
ATOM    362  CG2 VAL A  33      -4.058  -4.582   7.619  1.00  0.52           C  
ATOM    363  H   VAL A  33      -5.363  -2.729  10.334  1.00  0.51           H  
ATOM    364  HA  VAL A  33      -3.113  -2.170   8.478  1.00  0.42           H  
ATOM    365  HB  VAL A  33      -5.786  -3.304   7.598  1.00  0.37           H  
ATOM    366 HG11 VAL A  33      -5.116  -1.860   5.871  1.00  0.95           H  
ATOM    367 HG12 VAL A  33      -4.407  -3.398   5.379  1.00  1.18           H  
ATOM    368 HG13 VAL A  33      -3.403  -2.170   6.147  1.00  1.15           H  
ATOM    369 HG21 VAL A  33      -4.601  -5.176   8.338  1.00  0.83           H  
ATOM    370 HG22 VAL A  33      -3.035  -4.466   7.945  1.00  1.02           H  
ATOM    371 HG23 VAL A  33      -4.075  -5.074   6.658  1.00  1.07           H  
ATOM    372  N   ASP A  34      -4.132   0.046   7.899  1.00  0.35           N  
ATOM    373  CA  ASP A  34      -4.694   1.419   7.722  1.00  0.35           C  
ATOM    374  C   ASP A  34      -5.028   1.647   6.240  1.00  0.30           C  
ATOM    375  O   ASP A  34      -4.326   1.164   5.369  1.00  0.33           O  
ATOM    376  CB  ASP A  34      -3.661   2.458   8.177  1.00  0.45           C  
ATOM    377  CG  ASP A  34      -3.234   2.169   9.621  1.00  0.93           C  
ATOM    378  OD1 ASP A  34      -3.915   2.629  10.524  1.00  1.74           O  
ATOM    379  OD2 ASP A  34      -2.233   1.493   9.799  1.00  1.39           O  
ATOM    380  H   ASP A  34      -3.224  -0.149   7.589  1.00  0.39           H  
ATOM    381  HA  ASP A  34      -5.591   1.520   8.315  1.00  0.40           H  
ATOM    382  HB2 ASP A  34      -2.796   2.411   7.530  1.00  0.66           H  
ATOM    383  HB3 ASP A  34      -4.096   3.445   8.123  1.00  0.75           H  
ATOM    384  N   PRO A  35      -6.090   2.385   5.999  1.00  0.32           N  
ATOM    385  CA  PRO A  35      -6.548   2.706   4.631  1.00  0.38           C  
ATOM    386  C   PRO A  35      -5.662   3.792   3.996  1.00  0.42           C  
ATOM    387  O   PRO A  35      -5.553   3.876   2.786  1.00  0.51           O  
ATOM    388  CB  PRO A  35      -7.980   3.209   4.838  1.00  0.46           C  
ATOM    389  CG  PRO A  35      -8.070   3.677   6.309  1.00  0.43           C  
ATOM    390  CD  PRO A  35      -6.931   2.970   7.067  1.00  0.37           C  
ATOM    391  HA  PRO A  35      -6.557   1.820   4.018  1.00  0.42           H  
ATOM    392  HB2 PRO A  35      -8.182   4.035   4.168  1.00  0.51           H  
ATOM    393  HB3 PRO A  35      -8.683   2.409   4.667  1.00  0.52           H  
ATOM    394  HG2 PRO A  35      -7.947   4.750   6.363  1.00  0.44           H  
ATOM    395  HG3 PRO A  35      -9.021   3.390   6.730  1.00  0.51           H  
ATOM    396  HD2 PRO A  35      -6.366   3.685   7.649  1.00  0.38           H  
ATOM    397  HD3 PRO A  35      -7.325   2.190   7.700  1.00  0.42           H  
ATOM    398  N   SER A  36      -5.025   4.615   4.801  1.00  0.39           N  
ATOM    399  CA  SER A  36      -4.141   5.685   4.246  1.00  0.48           C  
ATOM    400  C   SER A  36      -2.788   5.073   3.862  1.00  0.56           C  
ATOM    401  O   SER A  36      -2.346   5.193   2.733  1.00  0.69           O  
ATOM    402  CB  SER A  36      -3.933   6.778   5.300  1.00  0.51           C  
ATOM    403  OG  SER A  36      -3.453   7.958   4.666  1.00  0.83           O  
ATOM    404  H   SER A  36      -5.124   4.524   5.771  1.00  0.36           H  
ATOM    405  HA  SER A  36      -4.603   6.114   3.369  1.00  0.56           H  
ATOM    406  HB2 SER A  36      -4.870   6.994   5.787  1.00  0.69           H  
ATOM    407  HB3 SER A  36      -3.216   6.434   6.036  1.00  0.66           H  
ATOM    408  HG  SER A  36      -2.500   7.991   4.782  1.00  1.31           H  
ATOM    409  N   ARG A  37      -2.137   4.410   4.791  1.00  0.54           N  
ATOM    410  CA  ARG A  37      -0.817   3.777   4.489  1.00  0.65           C  
ATOM    411  C   ARG A  37      -1.026   2.280   4.220  1.00  0.72           C  
ATOM    412  O   ARG A  37      -0.628   1.432   5.000  1.00  1.34           O  
ATOM    413  CB  ARG A  37       0.131   3.971   5.680  1.00  0.73           C  
ATOM    414  CG  ARG A  37       0.718   5.384   5.642  1.00  0.76           C  
ATOM    415  CD  ARG A  37       1.969   5.442   6.520  1.00  1.24           C  
ATOM    416  NE  ARG A  37       2.441   6.853   6.619  1.00  1.57           N  
ATOM    417  CZ  ARG A  37       2.077   7.596   7.631  1.00  2.17           C  
ATOM    418  NH1 ARG A  37       0.984   8.311   7.556  1.00  2.85           N  
ATOM    419  NH2 ARG A  37       2.806   7.624   8.717  1.00  2.74           N  
ATOM    420  H   ARG A  37      -2.522   4.324   5.689  1.00  0.50           H  
ATOM    421  HA  ARG A  37      -0.391   4.240   3.612  1.00  0.71           H  
ATOM    422  HB2 ARG A  37      -0.415   3.831   6.601  1.00  0.78           H  
ATOM    423  HB3 ARG A  37       0.933   3.250   5.623  1.00  0.85           H  
ATOM    424  HG2 ARG A  37       0.979   5.638   4.625  1.00  0.99           H  
ATOM    425  HG3 ARG A  37      -0.013   6.087   6.013  1.00  1.02           H  
ATOM    426  HD2 ARG A  37       1.735   5.070   7.507  1.00  1.83           H  
ATOM    427  HD3 ARG A  37       2.746   4.833   6.081  1.00  1.66           H  
ATOM    428  HE  ARG A  37       3.024   7.224   5.925  1.00  1.93           H  
ATOM    429 HH11 ARG A  37       0.428   8.289   6.725  1.00  3.07           H  
ATOM    430 HH12 ARG A  37       0.704   8.880   8.330  1.00  3.47           H  
ATOM    431 HH21 ARG A  37       3.642   7.078   8.773  1.00  2.92           H  
ATOM    432 HH22 ARG A  37       2.529   8.193   9.492  1.00  3.36           H  
ATOM    433  N   LYS A  38      -1.654   1.955   3.114  1.00  0.42           N  
ATOM    434  CA  LYS A  38      -1.906   0.520   2.770  1.00  0.45           C  
ATOM    435  C   LYS A  38      -0.616  -0.122   2.241  1.00  0.42           C  
ATOM    436  O   LYS A  38      -0.381  -1.301   2.436  1.00  0.44           O  
ATOM    437  CB  LYS A  38      -2.993   0.429   1.692  1.00  0.58           C  
ATOM    438  CG  LYS A  38      -4.235   1.212   2.134  1.00  0.97           C  
ATOM    439  CD  LYS A  38      -5.477   0.326   2.010  1.00  0.72           C  
ATOM    440  CE  LYS A  38      -6.587   1.091   1.283  1.00  0.75           C  
ATOM    441  NZ  LYS A  38      -7.918   0.624   1.768  1.00  1.01           N  
ATOM    442  H   LYS A  38      -1.963   2.661   2.507  1.00  0.75           H  
ATOM    443  HA  LYS A  38      -2.232  -0.009   3.653  1.00  0.45           H  
ATOM    444  HB2 LYS A  38      -2.616   0.844   0.769  1.00  0.62           H  
ATOM    445  HB3 LYS A  38      -3.259  -0.606   1.537  1.00  0.90           H  
ATOM    446  HG2 LYS A  38      -4.117   1.524   3.161  1.00  1.61           H  
ATOM    447  HG3 LYS A  38      -4.352   2.082   1.507  1.00  1.82           H  
ATOM    448  HD2 LYS A  38      -5.230  -0.566   1.453  1.00  1.33           H  
ATOM    449  HD3 LYS A  38      -5.820   0.050   2.996  1.00  1.20           H  
ATOM    450  HE2 LYS A  38      -6.484   2.148   1.477  1.00  1.05           H  
ATOM    451  HE3 LYS A  38      -6.509   0.912   0.221  1.00  1.12           H  
ATOM    452  HZ1 LYS A  38      -7.963  -0.413   1.716  1.00  1.34           H  
ATOM    453  HZ2 LYS A  38      -8.666   1.031   1.174  1.00  1.47           H  
ATOM    454  HZ3 LYS A  38      -8.053   0.929   2.754  1.00  1.68           H  
ATOM    455  N   GLU A  39       0.216   0.647   1.570  1.00  0.46           N  
ATOM    456  CA  GLU A  39       1.496   0.100   1.013  1.00  0.48           C  
ATOM    457  C   GLU A  39       2.386  -0.462   2.135  1.00  0.45           C  
ATOM    458  O   GLU A  39       3.200  -1.339   1.902  1.00  0.56           O  
ATOM    459  CB  GLU A  39       2.249   1.219   0.279  1.00  0.57           C  
ATOM    460  CG  GLU A  39       2.637   2.332   1.263  1.00  0.61           C  
ATOM    461  CD  GLU A  39       4.161   2.371   1.434  1.00  0.95           C  
ATOM    462  OE1 GLU A  39       4.688   1.508   2.119  1.00  1.76           O  
ATOM    463  OE2 GLU A  39       4.775   3.266   0.880  1.00  1.27           O  
ATOM    464  H   GLU A  39      -0.007   1.591   1.427  1.00  0.52           H  
ATOM    465  HA  GLU A  39       1.269  -0.689   0.313  1.00  0.47           H  
ATOM    466  HB2 GLU A  39       3.140   0.811  -0.173  1.00  0.62           H  
ATOM    467  HB3 GLU A  39       1.614   1.630  -0.491  1.00  0.61           H  
ATOM    468  HG2 GLU A  39       2.295   3.281   0.880  1.00  0.88           H  
ATOM    469  HG3 GLU A  39       2.175   2.146   2.221  1.00  0.89           H  
ATOM    470  N   ASN A  40       2.245   0.040   3.343  1.00  0.39           N  
ATOM    471  CA  ASN A  40       3.085  -0.452   4.478  1.00  0.40           C  
ATOM    472  C   ASN A  40       2.658  -1.869   4.896  1.00  0.34           C  
ATOM    473  O   ASN A  40       3.414  -2.580   5.533  1.00  0.40           O  
ATOM    474  CB  ASN A  40       2.920   0.499   5.667  1.00  0.47           C  
ATOM    475  CG  ASN A  40       4.219   1.278   5.886  1.00  0.57           C  
ATOM    476  OD1 ASN A  40       5.053   0.883   6.677  1.00  0.60           O  
ATOM    477  ND2 ASN A  40       4.429   2.378   5.212  1.00  0.68           N  
ATOM    478  H   ASN A  40       1.589   0.749   3.502  1.00  0.40           H  
ATOM    479  HA  ASN A  40       4.121  -0.466   4.175  1.00  0.44           H  
ATOM    480  HB2 ASN A  40       2.114   1.193   5.464  1.00  0.47           H  
ATOM    481  HB3 ASN A  40       2.689  -0.071   6.554  1.00  0.46           H  
ATOM    482 HD21 ASN A  40       3.757   2.698   4.574  1.00  0.70           H  
ATOM    483 HD22 ASN A  40       5.258   2.882   5.345  1.00  0.75           H  
ATOM    484  N   HIS A  41       1.457  -2.279   4.554  1.00  0.27           N  
ATOM    485  CA  HIS A  41       0.982  -3.645   4.944  1.00  0.22           C  
ATOM    486  C   HIS A  41       1.295  -4.672   3.839  1.00  0.21           C  
ATOM    487  O   HIS A  41       1.006  -5.847   3.987  1.00  0.24           O  
ATOM    488  CB  HIS A  41      -0.526  -3.592   5.210  1.00  0.22           C  
ATOM    489  CG  HIS A  41      -0.792  -2.565   6.278  1.00  0.34           C  
ATOM    490  ND1 HIS A  41      -0.634  -2.842   7.626  1.00  0.88           N  
ATOM    491  CD2 HIS A  41      -1.168  -1.248   6.207  1.00  0.66           C  
ATOM    492  CE1 HIS A  41      -0.907  -1.714   8.306  1.00  0.86           C  
ATOM    493  NE2 HIS A  41      -1.240  -0.712   7.489  1.00  0.62           N  
ATOM    494  H   HIS A  41       0.863  -1.687   4.048  1.00  0.28           H  
ATOM    495  HA  HIS A  41       1.486  -3.945   5.851  1.00  0.26           H  
ATOM    496  HB2 HIS A  41      -1.044  -3.314   4.303  1.00  0.22           H  
ATOM    497  HB3 HIS A  41      -0.870  -4.560   5.545  1.00  0.28           H  
ATOM    498  HD1 HIS A  41      -0.374  -3.704   8.014  1.00  1.35           H  
ATOM    499  HD2 HIS A  41      -1.378  -0.711   5.296  1.00  1.19           H  
ATOM    500  HE1 HIS A  41      -0.863  -1.629   9.382  1.00  1.27           H  
ATOM    501  N   LEU A  42       1.906  -4.250   2.751  1.00  0.20           N  
ATOM    502  CA  LEU A  42       2.265  -5.172   1.666  1.00  0.20           C  
ATOM    503  C   LEU A  42       3.663  -5.715   1.964  1.00  0.21           C  
ATOM    504  O   LEU A  42       4.591  -4.953   2.185  1.00  0.21           O  
ATOM    505  CB  LEU A  42       2.284  -4.371   0.360  1.00  0.20           C  
ATOM    506  CG  LEU A  42       0.901  -4.414  -0.295  1.00  0.23           C  
ATOM    507  CD1 LEU A  42       0.078  -3.224   0.190  1.00  0.83           C  
ATOM    508  CD2 LEU A  42       1.048  -4.335  -1.817  1.00  0.72           C  
ATOM    509  H   LEU A  42       2.150  -3.324   2.648  1.00  0.19           H  
ATOM    510  HA  LEU A  42       1.550  -5.979   1.601  1.00  0.22           H  
ATOM    511  HB2 LEU A  42       2.545  -3.344   0.577  1.00  0.19           H  
ATOM    512  HB3 LEU A  42       3.013  -4.789  -0.306  1.00  0.20           H  
ATOM    513  HG  LEU A  42       0.402  -5.333  -0.026  1.00  0.70           H  
ATOM    514 HD11 LEU A  42      -0.008  -3.263   1.265  1.00  1.33           H  
ATOM    515 HD12 LEU A  42      -0.905  -3.261  -0.253  1.00  1.48           H  
ATOM    516 HD13 LEU A  42       0.572  -2.308  -0.099  1.00  1.44           H  
ATOM    517 HD21 LEU A  42       1.225  -5.323  -2.213  1.00  1.28           H  
ATOM    518 HD22 LEU A  42       1.880  -3.693  -2.066  1.00  1.43           H  
ATOM    519 HD23 LEU A  42       0.143  -3.932  -2.245  1.00  1.22           H  
ATOM    520  N   SER A  43       3.821  -7.018   1.982  1.00  0.24           N  
ATOM    521  CA  SER A  43       5.162  -7.618   2.267  1.00  0.27           C  
ATOM    522  C   SER A  43       6.222  -7.011   1.330  1.00  0.26           C  
ATOM    523  O   SER A  43       5.903  -6.288   0.402  1.00  0.27           O  
ATOM    524  CB  SER A  43       5.100  -9.133   2.057  1.00  0.31           C  
ATOM    525  OG  SER A  43       6.095  -9.761   2.855  1.00  1.00           O  
ATOM    526  H   SER A  43       3.053  -7.602   1.807  1.00  0.26           H  
ATOM    527  HA  SER A  43       5.429  -7.408   3.288  1.00  0.27           H  
ATOM    528  HB2 SER A  43       4.129  -9.500   2.349  1.00  0.97           H  
ATOM    529  HB3 SER A  43       5.267  -9.358   1.011  1.00  0.81           H  
ATOM    530  HG  SER A  43       6.793 -10.068   2.272  1.00  1.09           H  
ATOM    531  N   ASP A  44       7.481  -7.299   1.571  1.00  0.28           N  
ATOM    532  CA  ASP A  44       8.572  -6.743   0.705  1.00  0.29           C  
ATOM    533  C   ASP A  44       8.219  -6.927  -0.777  1.00  0.27           C  
ATOM    534  O   ASP A  44       8.435  -6.041  -1.584  1.00  0.29           O  
ATOM    535  CB  ASP A  44       9.887  -7.469   1.005  1.00  0.34           C  
ATOM    536  CG  ASP A  44      11.015  -6.445   1.176  1.00  0.62           C  
ATOM    537  OD1 ASP A  44      11.445  -5.890   0.176  1.00  1.10           O  
ATOM    538  OD2 ASP A  44      11.432  -6.235   2.304  1.00  1.41           O  
ATOM    539  H   ASP A  44       7.710  -7.881   2.326  1.00  0.32           H  
ATOM    540  HA  ASP A  44       8.690  -5.690   0.915  1.00  0.29           H  
ATOM    541  HB2 ASP A  44       9.779  -8.044   1.913  1.00  0.62           H  
ATOM    542  HB3 ASP A  44      10.125  -8.131   0.187  1.00  0.48           H  
ATOM    543  N   GLU A  45       7.670  -8.066  -1.135  1.00  0.29           N  
ATOM    544  CA  GLU A  45       7.292  -8.311  -2.560  1.00  0.28           C  
ATOM    545  C   GLU A  45       5.985  -7.585  -2.886  1.00  0.25           C  
ATOM    546  O   GLU A  45       5.802  -7.091  -3.980  1.00  0.25           O  
ATOM    547  CB  GLU A  45       7.118  -9.814  -2.798  1.00  0.32           C  
ATOM    548  CG  GLU A  45       8.493 -10.490  -2.839  1.00  1.15           C  
ATOM    549  CD  GLU A  45       8.441 -11.814  -2.070  1.00  1.65           C  
ATOM    550  OE1 GLU A  45       8.655 -11.788  -0.868  1.00  2.28           O  
ATOM    551  OE2 GLU A  45       8.190 -12.832  -2.696  1.00  2.21           O  
ATOM    552  H   GLU A  45       7.503  -8.759  -0.462  1.00  0.36           H  
ATOM    553  HA  GLU A  45       8.065  -7.935  -3.198  1.00  0.29           H  
ATOM    554  HB2 GLU A  45       6.531 -10.239  -1.996  1.00  0.88           H  
ATOM    555  HB3 GLU A  45       6.613  -9.975  -3.738  1.00  0.92           H  
ATOM    556  HG2 GLU A  45       8.768 -10.680  -3.867  1.00  1.82           H  
ATOM    557  HG3 GLU A  45       9.227  -9.841  -2.385  1.00  1.77           H  
ATOM    558  N   ASP A  46       5.088  -7.513  -1.938  1.00  0.24           N  
ATOM    559  CA  ASP A  46       3.788  -6.821  -2.155  1.00  0.22           C  
ATOM    560  C   ASP A  46       4.039  -5.349  -2.477  1.00  0.20           C  
ATOM    561  O   ASP A  46       3.569  -4.837  -3.477  1.00  0.22           O  
ATOM    562  CB  ASP A  46       2.955  -6.935  -0.875  1.00  0.25           C  
ATOM    563  CG  ASP A  46       2.293  -8.315  -0.810  1.00  0.36           C  
ATOM    564  OD1 ASP A  46       1.458  -8.592  -1.659  1.00  1.26           O  
ATOM    565  OD2 ASP A  46       2.630  -9.072   0.086  1.00  1.01           O  
ATOM    566  H   ASP A  46       5.274  -7.912  -1.071  1.00  0.26           H  
ATOM    567  HA  ASP A  46       3.263  -7.284  -2.976  1.00  0.24           H  
ATOM    568  HB2 ASP A  46       3.595  -6.791  -0.015  1.00  0.26           H  
ATOM    569  HB3 ASP A  46       2.203  -6.178  -0.867  1.00  0.24           H  
ATOM    570  N   PHE A  47       4.784  -4.673  -1.638  1.00  0.19           N  
ATOM    571  CA  PHE A  47       5.087  -3.233  -1.882  1.00  0.19           C  
ATOM    572  C   PHE A  47       5.912  -3.090  -3.170  1.00  0.19           C  
ATOM    573  O   PHE A  47       5.861  -2.072  -3.833  1.00  0.20           O  
ATOM    574  CB  PHE A  47       5.890  -2.683  -0.699  1.00  0.21           C  
ATOM    575  CG  PHE A  47       6.088  -1.192  -0.854  1.00  0.22           C  
ATOM    576  CD1 PHE A  47       5.015  -0.368  -1.218  1.00  1.28           C  
ATOM    577  CD2 PHE A  47       7.351  -0.635  -0.631  1.00  1.19           C  
ATOM    578  CE1 PHE A  47       5.209   1.011  -1.359  1.00  1.27           C  
ATOM    579  CE2 PHE A  47       7.543   0.742  -0.772  1.00  1.21           C  
ATOM    580  CZ  PHE A  47       6.474   1.564  -1.136  1.00  0.29           C  
ATOM    581  H   PHE A  47       5.150  -5.120  -0.845  1.00  0.20           H  
ATOM    582  HA  PHE A  47       4.161  -2.682  -1.978  1.00  0.20           H  
ATOM    583  HB2 PHE A  47       5.357  -2.881   0.221  1.00  0.23           H  
ATOM    584  HB3 PHE A  47       6.855  -3.170  -0.670  1.00  0.22           H  
ATOM    585  HD1 PHE A  47       4.038  -0.796  -1.390  1.00  2.21           H  
ATOM    586  HD2 PHE A  47       8.178  -1.268  -0.350  1.00  2.10           H  
ATOM    587  HE1 PHE A  47       4.383   1.647  -1.639  1.00  2.19           H  
ATOM    588  HE2 PHE A  47       8.516   1.171  -0.600  1.00  2.14           H  
ATOM    589  HZ  PHE A  47       6.627   2.626  -1.243  1.00  0.33           H  
ATOM    590  N   LYS A  48       6.673  -4.104  -3.526  1.00  0.20           N  
ATOM    591  CA  LYS A  48       7.505  -4.026  -4.765  1.00  0.23           C  
ATOM    592  C   LYS A  48       6.689  -4.467  -5.994  1.00  0.24           C  
ATOM    593  O   LYS A  48       7.058  -4.172  -7.115  1.00  0.26           O  
ATOM    594  CB  LYS A  48       8.724  -4.943  -4.614  1.00  0.27           C  
ATOM    595  CG  LYS A  48       9.858  -4.181  -3.921  1.00  0.37           C  
ATOM    596  CD  LYS A  48      10.671  -3.408  -4.963  1.00  0.64           C  
ATOM    597  CE  LYS A  48      11.813  -4.285  -5.481  1.00  0.98           C  
ATOM    598  NZ  LYS A  48      12.759  -3.454  -6.279  1.00  1.66           N  
ATOM    599  H   LYS A  48       6.698  -4.917  -2.976  1.00  0.21           H  
ATOM    600  HA  LYS A  48       7.841  -3.008  -4.902  1.00  0.25           H  
ATOM    601  HB2 LYS A  48       8.454  -5.805  -4.022  1.00  0.36           H  
ATOM    602  HB3 LYS A  48       9.054  -5.266  -5.590  1.00  0.32           H  
ATOM    603  HG2 LYS A  48       9.440  -3.489  -3.204  1.00  0.77           H  
ATOM    604  HG3 LYS A  48      10.502  -4.881  -3.411  1.00  0.70           H  
ATOM    605  HD2 LYS A  48      10.029  -3.129  -5.787  1.00  1.43           H  
ATOM    606  HD3 LYS A  48      11.081  -2.519  -4.511  1.00  1.26           H  
ATOM    607  HE2 LYS A  48      12.337  -4.724  -4.645  1.00  1.50           H  
ATOM    608  HE3 LYS A  48      11.410  -5.070  -6.105  1.00  1.70           H  
ATOM    609  HZ1 LYS A  48      12.259  -3.038  -7.089  1.00  2.31           H  
ATOM    610  HZ2 LYS A  48      13.538  -4.049  -6.624  1.00  1.97           H  
ATOM    611  HZ3 LYS A  48      13.143  -2.693  -5.679  1.00  2.11           H  
ATOM    612  N   ALA A  49       5.592  -5.171  -5.800  1.00  0.24           N  
ATOM    613  CA  ALA A  49       4.771  -5.626  -6.957  1.00  0.26           C  
ATOM    614  C   ALA A  49       3.697  -4.584  -7.261  1.00  0.27           C  
ATOM    615  O   ALA A  49       3.502  -4.190  -8.397  1.00  0.33           O  
ATOM    616  CB  ALA A  49       4.107  -6.964  -6.621  1.00  0.28           C  
ATOM    617  H   ALA A  49       5.307  -5.399  -4.894  1.00  0.24           H  
ATOM    618  HA  ALA A  49       5.409  -5.748  -7.814  1.00  0.28           H  
ATOM    619  HB1 ALA A  49       3.463  -7.261  -7.436  1.00  0.93           H  
ATOM    620  HB2 ALA A  49       3.521  -6.859  -5.719  1.00  1.01           H  
ATOM    621  HB3 ALA A  49       4.867  -7.717  -6.471  1.00  0.98           H  
ATOM    622  N   VAL A  50       2.998  -4.144  -6.244  1.00  0.25           N  
ATOM    623  CA  VAL A  50       1.920  -3.131  -6.432  1.00  0.27           C  
ATOM    624  C   VAL A  50       2.531  -1.783  -6.845  1.00  0.25           C  
ATOM    625  O   VAL A  50       2.062  -1.142  -7.769  1.00  0.29           O  
ATOM    626  CB  VAL A  50       1.151  -2.978  -5.111  1.00  0.28           C  
ATOM    627  CG1 VAL A  50       0.366  -1.668  -5.110  1.00  0.29           C  
ATOM    628  CG2 VAL A  50       0.181  -4.151  -4.950  1.00  0.35           C  
ATOM    629  H   VAL A  50       3.183  -4.489  -5.345  1.00  0.25           H  
ATOM    630  HA  VAL A  50       1.242  -3.467  -7.203  1.00  0.30           H  
ATOM    631  HB  VAL A  50       1.851  -2.972  -4.287  1.00  0.25           H  
ATOM    632 HG11 VAL A  50      -0.305  -1.653  -4.266  1.00  1.00           H  
ATOM    633 HG12 VAL A  50      -0.199  -1.588  -6.025  1.00  1.08           H  
ATOM    634 HG13 VAL A  50       1.056  -0.841  -5.038  1.00  1.06           H  
ATOM    635 HG21 VAL A  50       0.729  -5.031  -4.645  1.00  0.99           H  
ATOM    636 HG22 VAL A  50      -0.312  -4.343  -5.891  1.00  1.08           H  
ATOM    637 HG23 VAL A  50      -0.556  -3.909  -4.199  1.00  0.96           H  
ATOM    638  N   PHE A  51       3.561  -1.345  -6.159  1.00  0.21           N  
ATOM    639  CA  PHE A  51       4.195  -0.040  -6.486  1.00  0.22           C  
ATOM    640  C   PHE A  51       5.323  -0.220  -7.509  1.00  0.23           C  
ATOM    641  O   PHE A  51       5.709   0.723  -8.176  1.00  0.24           O  
ATOM    642  CB  PHE A  51       4.764   0.547  -5.199  1.00  0.20           C  
ATOM    643  CG  PHE A  51       3.651   1.178  -4.402  1.00  0.22           C  
ATOM    644  CD1 PHE A  51       2.725   0.367  -3.735  1.00  1.12           C  
ATOM    645  CD2 PHE A  51       3.539   2.569  -4.335  1.00  1.16           C  
ATOM    646  CE1 PHE A  51       1.688   0.948  -3.002  1.00  1.11           C  
ATOM    647  CE2 PHE A  51       2.501   3.152  -3.601  1.00  1.17           C  
ATOM    648  CZ  PHE A  51       1.575   2.342  -2.935  1.00  0.30           C  
ATOM    649  H   PHE A  51       3.914  -1.868  -5.412  1.00  0.20           H  
ATOM    650  HA  PHE A  51       3.454   0.631  -6.886  1.00  0.25           H  
ATOM    651  HB2 PHE A  51       5.222  -0.239  -4.617  1.00  0.18           H  
ATOM    652  HB3 PHE A  51       5.499   1.287  -5.441  1.00  0.21           H  
ATOM    653  HD1 PHE A  51       2.813  -0.708  -3.787  1.00  1.97           H  
ATOM    654  HD2 PHE A  51       4.254   3.194  -4.849  1.00  2.00           H  
ATOM    655  HE1 PHE A  51       0.974   0.321  -2.488  1.00  1.96           H  
ATOM    656  HE2 PHE A  51       2.413   4.227  -3.549  1.00  2.03           H  
ATOM    657  HZ  PHE A  51       0.775   2.792  -2.370  1.00  0.33           H  
ATOM    658  N   GLY A  52       5.870  -1.410  -7.626  1.00  0.24           N  
ATOM    659  CA  GLY A  52       6.988  -1.630  -8.593  1.00  0.27           C  
ATOM    660  C   GLY A  52       8.270  -0.984  -8.044  1.00  0.26           C  
ATOM    661  O   GLY A  52       9.225  -0.778  -8.770  1.00  0.30           O  
ATOM    662  H   GLY A  52       5.556  -2.153  -7.070  1.00  0.26           H  
ATOM    663  HA2 GLY A  52       7.145  -2.690  -8.728  1.00  0.28           H  
ATOM    664  HA3 GLY A  52       6.740  -1.178  -9.541  1.00  0.31           H  
ATOM    665  N   MET A  53       8.290  -0.660  -6.767  1.00  0.23           N  
ATOM    666  CA  MET A  53       9.492  -0.025  -6.157  1.00  0.25           C  
ATOM    667  C   MET A  53       9.567  -0.368  -4.662  1.00  0.21           C  
ATOM    668  O   MET A  53       8.599  -0.807  -4.063  1.00  0.19           O  
ATOM    669  CB  MET A  53       9.415   1.494  -6.335  1.00  0.30           C  
ATOM    670  CG  MET A  53       8.158   2.042  -5.649  1.00  0.28           C  
ATOM    671  SD  MET A  53       7.838   3.725  -6.235  1.00  0.76           S  
ATOM    672  CE  MET A  53       9.507   4.375  -5.977  1.00  0.51           C  
ATOM    673  H   MET A  53       7.510  -0.834  -6.208  1.00  0.22           H  
ATOM    674  HA  MET A  53      10.372  -0.393  -6.650  1.00  0.29           H  
ATOM    675  HB2 MET A  53      10.290   1.949  -5.896  1.00  0.39           H  
ATOM    676  HB3 MET A  53       9.378   1.730  -7.388  1.00  0.38           H  
ATOM    677  HG2 MET A  53       7.314   1.412  -5.886  1.00  0.43           H  
ATOM    678  HG3 MET A  53       8.308   2.056  -4.580  1.00  0.48           H  
ATOM    679  HE1 MET A  53       9.686   4.491  -4.918  1.00  1.19           H  
ATOM    680  HE2 MET A  53       9.601   5.332  -6.472  1.00  1.02           H  
ATOM    681  HE3 MET A  53      10.230   3.687  -6.389  1.00  1.13           H  
ATOM    682  N   THR A  54      10.714  -0.167  -4.059  1.00  0.23           N  
ATOM    683  CA  THR A  54      10.883  -0.469  -2.612  1.00  0.23           C  
ATOM    684  C   THR A  54      10.629   0.799  -1.790  1.00  0.24           C  
ATOM    685  O   THR A  54      10.285   1.844  -2.317  1.00  0.32           O  
ATOM    686  CB  THR A  54      12.318  -0.965  -2.349  1.00  0.26           C  
ATOM    687  OG1 THR A  54      13.165  -0.641  -3.447  1.00  0.29           O  
ATOM    688  CG2 THR A  54      12.309  -2.480  -2.142  1.00  0.25           C  
ATOM    689  H   THR A  54      11.471   0.185  -4.556  1.00  0.27           H  
ATOM    690  HA  THR A  54      10.179  -1.234  -2.319  1.00  0.22           H  
ATOM    691  HB  THR A  54      12.697  -0.491  -1.461  1.00  0.29           H  
ATOM    692  HG1 THR A  54      13.541   0.228  -3.286  1.00  0.78           H  
ATOM    693 HG21 THR A  54      11.302  -2.810  -1.936  1.00  0.98           H  
ATOM    694 HG22 THR A  54      12.948  -2.732  -1.309  1.00  1.11           H  
ATOM    695 HG23 THR A  54      12.672  -2.967  -3.035  1.00  0.99           H  
ATOM    696  N   ARG A  55      10.803   0.703  -0.499  1.00  0.31           N  
ATOM    697  CA  ARG A  55      10.589   1.868   0.400  1.00  0.33           C  
ATOM    698  C   ARG A  55      11.739   2.873   0.238  1.00  0.32           C  
ATOM    699  O   ARG A  55      11.549   4.066   0.394  1.00  0.33           O  
ATOM    700  CB  ARG A  55      10.525   1.371   1.847  1.00  0.42           C  
ATOM    701  CG  ARG A  55      11.754   0.512   2.180  1.00  0.59           C  
ATOM    702  CD  ARG A  55      11.302  -0.825   2.775  1.00  1.10           C  
ATOM    703  NE  ARG A  55      11.409  -1.896   1.741  1.00  1.65           N  
ATOM    704  CZ  ARG A  55      10.421  -2.733   1.557  1.00  2.08           C  
ATOM    705  NH1 ARG A  55      10.036  -3.518   2.530  1.00  2.22           N  
ATOM    706  NH2 ARG A  55       9.819  -2.787   0.397  1.00  3.02           N  
ATOM    707  H   ARG A  55      11.079  -0.146  -0.115  1.00  0.43           H  
ATOM    708  HA  ARG A  55       9.654   2.350   0.145  1.00  0.32           H  
ATOM    709  HB2 ARG A  55      10.500   2.214   2.502  1.00  0.55           H  
ATOM    710  HB3 ARG A  55       9.630   0.783   1.985  1.00  0.50           H  
ATOM    711  HG2 ARG A  55      12.325   0.332   1.281  1.00  0.98           H  
ATOM    712  HG3 ARG A  55      12.370   1.031   2.898  1.00  1.17           H  
ATOM    713  HD2 ARG A  55      11.931  -1.075   3.616  1.00  1.68           H  
ATOM    714  HD3 ARG A  55      10.276  -0.745   3.105  1.00  1.72           H  
ATOM    715  HE  ARG A  55      12.223  -1.973   1.199  1.00  2.29           H  
ATOM    716 HH11 ARG A  55      10.498  -3.479   3.417  1.00  2.12           H  
ATOM    717 HH12 ARG A  55       9.280  -4.157   2.389  1.00  2.87           H  
ATOM    718 HH21 ARG A  55      10.114  -2.188  -0.348  1.00  3.37           H  
ATOM    719 HH22 ARG A  55       9.062  -3.425   0.254  1.00  3.60           H  
ATOM    720  N   SER A  56      12.926   2.400  -0.084  1.00  0.35           N  
ATOM    721  CA  SER A  56      14.090   3.323  -0.270  1.00  0.38           C  
ATOM    722  C   SER A  56      13.808   4.264  -1.448  1.00  0.32           C  
ATOM    723  O   SER A  56      14.181   5.424  -1.427  1.00  0.39           O  
ATOM    724  CB  SER A  56      15.353   2.506  -0.561  1.00  0.44           C  
ATOM    725  OG  SER A  56      15.803   1.892   0.640  1.00  1.33           O  
ATOM    726  H   SER A  56      13.048   1.436  -0.211  1.00  0.37           H  
ATOM    727  HA  SER A  56      14.235   3.905   0.628  1.00  0.43           H  
ATOM    728  HB2 SER A  56      15.132   1.743  -1.288  1.00  0.92           H  
ATOM    729  HB3 SER A  56      16.121   3.161  -0.952  1.00  1.10           H  
ATOM    730  HG  SER A  56      15.386   1.030   0.708  1.00  1.81           H  
ATOM    731  N   ALA A  57      13.133   3.774  -2.465  1.00  0.28           N  
ATOM    732  CA  ALA A  57      12.800   4.631  -3.643  1.00  0.30           C  
ATOM    733  C   ALA A  57      11.542   5.445  -3.320  1.00  0.25           C  
ATOM    734  O   ALA A  57      11.404   6.582  -3.735  1.00  0.34           O  
ATOM    735  CB  ALA A  57      12.541   3.747  -4.866  1.00  0.42           C  
ATOM    736  H   ALA A  57      12.831   2.841  -2.445  1.00  0.30           H  
ATOM    737  HA  ALA A  57      13.622   5.302  -3.847  1.00  0.35           H  
ATOM    738  HB1 ALA A  57      12.319   4.370  -5.720  1.00  0.87           H  
ATOM    739  HB2 ALA A  57      11.703   3.095  -4.669  1.00  1.31           H  
ATOM    740  HB3 ALA A  57      13.419   3.152  -5.072  1.00  1.11           H  
ATOM    741  N   PHE A  58      10.631   4.862  -2.571  1.00  0.22           N  
ATOM    742  CA  PHE A  58       9.375   5.566  -2.189  1.00  0.23           C  
ATOM    743  C   PHE A  58       9.696   6.837  -1.392  1.00  0.22           C  
ATOM    744  O   PHE A  58       8.964   7.809  -1.437  1.00  0.31           O  
ATOM    745  CB  PHE A  58       8.536   4.621  -1.329  1.00  0.29           C  
ATOM    746  CG  PHE A  58       7.083   5.006  -1.427  1.00  0.27           C  
ATOM    747  CD1 PHE A  58       6.367   4.698  -2.585  1.00  1.08           C  
ATOM    748  CD2 PHE A  58       6.455   5.667  -0.366  1.00  1.38           C  
ATOM    749  CE1 PHE A  58       5.017   5.051  -2.687  1.00  1.04           C  
ATOM    750  CE2 PHE A  58       5.104   6.020  -0.466  1.00  1.57           C  
ATOM    751  CZ  PHE A  58       4.385   5.712  -1.627  1.00  0.74           C  
ATOM    752  H   PHE A  58      10.775   3.948  -2.254  1.00  0.28           H  
ATOM    753  HA  PHE A  58       8.832   5.828  -3.072  1.00  0.29           H  
ATOM    754  HB2 PHE A  58       8.662   3.607  -1.686  1.00  0.39           H  
ATOM    755  HB3 PHE A  58       8.863   4.684  -0.302  1.00  0.48           H  
ATOM    756  HD1 PHE A  58       6.860   4.189  -3.401  1.00  2.01           H  
ATOM    757  HD2 PHE A  58       7.012   5.903   0.528  1.00  2.22           H  
ATOM    758  HE1 PHE A  58       4.464   4.815  -3.583  1.00  1.87           H  
ATOM    759  HE2 PHE A  58       4.617   6.530   0.352  1.00  2.52           H  
ATOM    760  HZ  PHE A  58       3.343   5.984  -1.705  1.00  0.95           H  
ATOM    761  N   ALA A  59      10.784   6.826  -0.668  1.00  0.21           N  
ATOM    762  CA  ALA A  59      11.180   8.020   0.144  1.00  0.29           C  
ATOM    763  C   ALA A  59      11.680   9.144  -0.776  1.00  0.29           C  
ATOM    764  O   ALA A  59      11.559  10.312  -0.453  1.00  0.35           O  
ATOM    765  CB  ALA A  59      12.295   7.625   1.116  1.00  0.35           C  
ATOM    766  H   ALA A  59      11.344   6.026  -0.661  1.00  0.22           H  
ATOM    767  HA  ALA A  59      10.326   8.370   0.704  1.00  0.33           H  
ATOM    768  HB1 ALA A  59      12.574   8.482   1.711  1.00  0.95           H  
ATOM    769  HB2 ALA A  59      13.153   7.279   0.559  1.00  0.95           H  
ATOM    770  HB3 ALA A  59      11.944   6.836   1.764  1.00  0.94           H  
ATOM    771  N   ASN A  60      12.242   8.801  -1.916  1.00  0.27           N  
ATOM    772  CA  ASN A  60      12.754   9.846  -2.857  1.00  0.31           C  
ATOM    773  C   ASN A  60      11.652  10.275  -3.847  1.00  0.31           C  
ATOM    774  O   ASN A  60      11.915  10.997  -4.793  1.00  0.35           O  
ATOM    775  CB  ASN A  60      13.947   9.276  -3.634  1.00  0.32           C  
ATOM    776  CG  ASN A  60      15.227  10.003  -3.216  1.00  0.36           C  
ATOM    777  OD1 ASN A  60      15.678  10.903  -3.896  1.00  0.94           O  
ATOM    778  ND2 ASN A  60      15.836   9.650  -2.116  1.00  1.17           N  
ATOM    779  H   ASN A  60      12.329   7.854  -2.152  1.00  0.24           H  
ATOM    780  HA  ASN A  60      13.078  10.707  -2.292  1.00  0.34           H  
ATOM    781  HB2 ASN A  60      14.045   8.220  -3.418  1.00  0.30           H  
ATOM    782  HB3 ASN A  60      13.786   9.413  -4.694  1.00  0.33           H  
ATOM    783 HD21 ASN A  60      15.474   8.924  -1.565  1.00  1.91           H  
ATOM    784 HD22 ASN A  60      16.656  10.110  -1.841  1.00  1.20           H  
ATOM    785  N   LEU A  61      10.424   9.843  -3.639  1.00  0.32           N  
ATOM    786  CA  LEU A  61       9.317  10.221  -4.557  1.00  0.34           C  
ATOM    787  C   LEU A  61       8.942  11.703  -4.360  1.00  0.42           C  
ATOM    788  O   LEU A  61       9.302  12.309  -3.366  1.00  0.51           O  
ATOM    789  CB  LEU A  61       8.109   9.339  -4.242  1.00  0.37           C  
ATOM    790  CG  LEU A  61       8.240   8.000  -4.974  1.00  0.36           C  
ATOM    791  CD1 LEU A  61       7.181   7.029  -4.457  1.00  0.44           C  
ATOM    792  CD2 LEU A  61       8.038   8.214  -6.474  1.00  0.37           C  
ATOM    793  H   LEU A  61      10.226   9.267  -2.879  1.00  0.35           H  
ATOM    794  HA  LEU A  61       9.624  10.059  -5.579  1.00  0.33           H  
ATOM    795  HB2 LEU A  61       8.064   9.162  -3.176  1.00  0.40           H  
ATOM    796  HB3 LEU A  61       7.214   9.835  -4.559  1.00  0.41           H  
ATOM    797  HG  LEU A  61       9.223   7.587  -4.797  1.00  0.36           H  
ATOM    798 HD11 LEU A  61       7.278   6.927  -3.387  1.00  0.87           H  
ATOM    799 HD12 LEU A  61       7.317   6.064  -4.924  1.00  1.29           H  
ATOM    800 HD13 LEU A  61       6.198   7.408  -4.695  1.00  1.13           H  
ATOM    801 HD21 LEU A  61       8.773   8.914  -6.839  1.00  1.18           H  
ATOM    802 HD22 LEU A  61       7.047   8.606  -6.650  1.00  1.11           H  
ATOM    803 HD23 LEU A  61       8.149   7.272  -6.990  1.00  0.93           H  
ATOM    804  N   PRO A  62       8.223  12.235  -5.325  1.00  0.42           N  
ATOM    805  CA  PRO A  62       7.768  13.642  -5.314  1.00  0.50           C  
ATOM    806  C   PRO A  62       6.573  13.827  -4.372  1.00  0.62           C  
ATOM    807  O   PRO A  62       6.708  14.286  -3.253  1.00  1.13           O  
ATOM    808  CB  PRO A  62       7.359  13.894  -6.771  1.00  0.46           C  
ATOM    809  CG  PRO A  62       7.064  12.512  -7.388  1.00  0.42           C  
ATOM    810  CD  PRO A  62       7.795  11.475  -6.520  1.00  0.38           C  
ATOM    811  HA  PRO A  62       8.558  14.306  -5.050  1.00  0.55           H  
ATOM    812  HB2 PRO A  62       6.472  14.513  -6.802  1.00  0.51           H  
ATOM    813  HB3 PRO A  62       8.157  14.364  -7.310  1.00  0.48           H  
ATOM    814  HG2 PRO A  62       6.001  12.329  -7.375  1.00  0.46           H  
ATOM    815  HG3 PRO A  62       7.436  12.471  -8.399  1.00  0.43           H  
ATOM    816  HD2 PRO A  62       7.121  10.676  -6.243  1.00  0.42           H  
ATOM    817  HD3 PRO A  62       8.655  11.084  -7.041  1.00  0.36           H  
ATOM    818  N   LEU A  63       5.414  13.479  -4.853  1.00  0.45           N  
ATOM    819  CA  LEU A  63       4.139  13.613  -4.083  1.00  0.46           C  
ATOM    820  C   LEU A  63       2.994  13.381  -5.073  1.00  0.44           C  
ATOM    821  O   LEU A  63       1.988  12.773  -4.754  1.00  0.44           O  
ATOM    822  CB  LEU A  63       4.011  15.019  -3.463  1.00  0.58           C  
ATOM    823  CG  LEU A  63       4.514  16.092  -4.442  1.00  1.00           C  
ATOM    824  CD1 LEU A  63       3.401  16.467  -5.422  1.00  1.32           C  
ATOM    825  CD2 LEU A  63       4.940  17.335  -3.657  1.00  1.43           C  
ATOM    826  H   LEU A  63       5.379  13.126  -5.760  1.00  0.71           H  
ATOM    827  HA  LEU A  63       4.104  12.862  -3.306  1.00  0.43           H  
ATOM    828  HB2 LEU A  63       2.974  15.210  -3.227  1.00  0.88           H  
ATOM    829  HB3 LEU A  63       4.595  15.062  -2.556  1.00  0.70           H  
ATOM    830  HG  LEU A  63       5.360  15.710  -4.993  1.00  1.74           H  
ATOM    831 HD11 LEU A  63       2.503  15.919  -5.174  1.00  1.78           H  
ATOM    832 HD12 LEU A  63       3.711  16.211  -6.426  1.00  1.93           H  
ATOM    833 HD13 LEU A  63       3.207  17.527  -5.363  1.00  1.64           H  
ATOM    834 HD21 LEU A  63       4.099  17.709  -3.091  1.00  1.95           H  
ATOM    835 HD22 LEU A  63       5.280  18.095  -4.344  1.00  1.96           H  
ATOM    836 HD23 LEU A  63       5.741  17.076  -2.981  1.00  1.84           H  
ATOM    837  N   TRP A  64       3.176  13.847  -6.292  1.00  0.45           N  
ATOM    838  CA  TRP A  64       2.178  13.667  -7.352  1.00  0.48           C  
ATOM    839  C   TRP A  64       2.261  12.214  -7.830  1.00  0.43           C  
ATOM    840  O   TRP A  64       1.260  11.590  -8.129  1.00  0.43           O  
ATOM    841  CB  TRP A  64       2.515  14.647  -8.483  1.00  0.54           C  
ATOM    842  CG  TRP A  64       3.847  14.315  -9.097  1.00  0.53           C  
ATOM    843  CD1 TRP A  64       5.056  14.792  -8.694  1.00  0.53           C  
ATOM    844  CD2 TRP A  64       4.114  13.437 -10.220  1.00  0.53           C  
ATOM    845  NE1 TRP A  64       6.036  14.265  -9.517  1.00  0.52           N  
ATOM    846  CE2 TRP A  64       5.504  13.422 -10.472  1.00  0.53           C  
ATOM    847  CE3 TRP A  64       3.283  12.663 -11.036  1.00  0.54           C  
ATOM    848  CZ2 TRP A  64       6.050  12.660 -11.505  1.00  0.54           C  
ATOM    849  CZ3 TRP A  64       3.823  11.892 -12.078  1.00  0.55           C  
ATOM    850  CH2 TRP A  64       5.206  11.892 -12.313  1.00  0.56           C  
ATOM    851  H   TRP A  64       3.998  14.306  -6.519  1.00  0.47           H  
ATOM    852  HA  TRP A  64       1.194  13.875  -6.966  1.00  0.51           H  
ATOM    853  HB2 TRP A  64       1.756  14.584  -9.235  1.00  0.56           H  
ATOM    854  HB3 TRP A  64       2.544  15.653  -8.087  1.00  0.57           H  
ATOM    855  HD1 TRP A  64       5.231  15.470  -7.866  1.00  0.54           H  
ATOM    856  HE1 TRP A  64       6.995  14.453  -9.446  1.00  0.52           H  
ATOM    857  HE3 TRP A  64       2.220  12.659 -10.853  1.00  0.54           H  
ATOM    858  HZ2 TRP A  64       7.116  12.665 -11.681  1.00  0.54           H  
ATOM    859  HZ3 TRP A  64       3.172  11.298 -12.701  1.00  0.57           H  
ATOM    860  HH2 TRP A  64       5.618  11.297 -13.115  1.00  0.58           H  
ATOM    861  N   LYS A  65       3.460  11.667  -7.865  1.00  0.40           N  
ATOM    862  CA  LYS A  65       3.636  10.245  -8.276  1.00  0.37           C  
ATOM    863  C   LYS A  65       3.275   9.361  -7.077  1.00  0.30           C  
ATOM    864  O   LYS A  65       2.583   8.376  -7.218  1.00  0.29           O  
ATOM    865  CB  LYS A  65       5.094  10.007  -8.691  1.00  0.37           C  
ATOM    866  CG  LYS A  65       5.370   8.504  -8.797  1.00  0.37           C  
ATOM    867  CD  LYS A  65       6.576   8.268  -9.709  1.00  0.61           C  
ATOM    868  CE  LYS A  65       6.968   6.789  -9.669  1.00  1.14           C  
ATOM    869  NZ  LYS A  65       8.269   6.597 -10.372  1.00  1.44           N  
ATOM    870  H   LYS A  65       4.246  12.195  -7.592  1.00  0.40           H  
ATOM    871  HA  LYS A  65       2.977  10.021  -9.103  1.00  0.40           H  
ATOM    872  HB2 LYS A  65       5.275  10.474  -9.648  1.00  0.41           H  
ATOM    873  HB3 LYS A  65       5.752  10.438  -7.952  1.00  0.39           H  
ATOM    874  HG2 LYS A  65       5.579   8.108  -7.812  1.00  0.39           H  
ATOM    875  HG3 LYS A  65       4.506   8.006  -9.210  1.00  0.41           H  
ATOM    876  HD2 LYS A  65       6.321   8.546 -10.722  1.00  1.24           H  
ATOM    877  HD3 LYS A  65       7.407   8.868  -9.370  1.00  1.25           H  
ATOM    878  HE2 LYS A  65       7.065   6.471  -8.641  1.00  1.84           H  
ATOM    879  HE3 LYS A  65       6.205   6.201 -10.157  1.00  1.74           H  
ATOM    880  HZ1 LYS A  65       9.009   7.145  -9.889  1.00  2.00           H  
ATOM    881  HZ2 LYS A  65       8.185   6.922 -11.355  1.00  1.98           H  
ATOM    882  HZ3 LYS A  65       8.522   5.587 -10.360  1.00  1.47           H  
ATOM    883  N   GLN A  66       3.729   9.733  -5.897  1.00  0.28           N  
ATOM    884  CA  GLN A  66       3.413   8.953  -4.656  1.00  0.24           C  
ATOM    885  C   GLN A  66       1.916   8.669  -4.595  1.00  0.23           C  
ATOM    886  O   GLN A  66       1.484   7.537  -4.481  1.00  0.21           O  
ATOM    887  CB  GLN A  66       3.781   9.798  -3.437  1.00  0.26           C  
ATOM    888  CG  GLN A  66       3.633   8.961  -2.163  1.00  0.25           C  
ATOM    889  CD  GLN A  66       4.880   9.128  -1.290  1.00  0.34           C  
ATOM    890  OE1 GLN A  66       4.789   9.549  -0.154  1.00  0.47           O  
ATOM    891  NE2 GLN A  66       6.049   8.813  -1.778  1.00  0.48           N  
ATOM    892  H   GLN A  66       4.275  10.546  -5.825  1.00  0.31           H  
ATOM    893  HA  GLN A  66       3.970   8.028  -4.645  1.00  0.22           H  
ATOM    894  HB2 GLN A  66       4.791  10.144  -3.535  1.00  0.28           H  
ATOM    895  HB3 GLN A  66       3.118  10.648  -3.380  1.00  0.28           H  
ATOM    896  HG2 GLN A  66       2.760   9.291  -1.616  1.00  0.30           H  
ATOM    897  HG3 GLN A  66       3.517   7.921  -2.427  1.00  0.28           H  
ATOM    898 HE21 GLN A  66       6.121   8.473  -2.694  1.00  0.58           H  
ATOM    899 HE22 GLN A  66       6.853   8.914  -1.227  1.00  0.59           H  
ATOM    900  N   GLN A  67       1.134   9.712  -4.651  1.00  0.25           N  
ATOM    901  CA  GLN A  67      -0.351   9.568  -4.583  1.00  0.26           C  
ATOM    902  C   GLN A  67      -0.860   8.741  -5.767  1.00  0.24           C  
ATOM    903  O   GLN A  67      -1.725   7.900  -5.609  1.00  0.24           O  
ATOM    904  CB  GLN A  67      -0.970  10.964  -4.585  1.00  0.30           C  
ATOM    905  CG  GLN A  67      -1.281  11.433  -6.010  1.00  0.32           C  
ATOM    906  CD  GLN A  67      -1.797  12.874  -5.976  1.00  0.37           C  
ATOM    907  OE1 GLN A  67      -2.945  13.127  -6.284  1.00  1.03           O  
ATOM    908  NE2 GLN A  67      -0.993  13.836  -5.611  1.00  0.90           N  
ATOM    909  H   GLN A  67       1.537  10.608  -4.724  1.00  0.28           H  
ATOM    910  HA  GLN A  67      -0.613   9.066  -3.664  1.00  0.26           H  
ATOM    911  HB2 GLN A  67      -1.876  10.962  -3.998  1.00  0.32           H  
ATOM    912  HB3 GLN A  67      -0.259  11.633  -4.147  1.00  0.33           H  
ATOM    913  HG2 GLN A  67      -0.383  11.387  -6.605  1.00  0.32           H  
ATOM    914  HG3 GLN A  67      -2.035  10.793  -6.443  1.00  0.30           H  
ATOM    915 HE21 GLN A  67      -0.067  13.635  -5.362  1.00  1.55           H  
ATOM    916 HE22 GLN A  67      -1.316  14.761  -5.588  1.00  0.91           H  
ATOM    917  N   ASN A  68      -0.318   8.958  -6.943  1.00  0.26           N  
ATOM    918  CA  ASN A  68      -0.757   8.165  -8.128  1.00  0.28           C  
ATOM    919  C   ASN A  68      -0.259   6.727  -7.978  1.00  0.26           C  
ATOM    920  O   ASN A  68      -0.751   5.821  -8.624  1.00  0.29           O  
ATOM    921  CB  ASN A  68      -0.178   8.778  -9.403  1.00  0.32           C  
ATOM    922  CG  ASN A  68      -1.177   9.776  -9.994  1.00  0.82           C  
ATOM    923  OD1 ASN A  68      -1.941   9.438 -10.877  1.00  1.30           O  
ATOM    924  ND2 ASN A  68      -1.206  11.001  -9.542  1.00  1.32           N  
ATOM    925  H   ASN A  68       0.390   9.630  -7.042  1.00  0.28           H  
ATOM    926  HA  ASN A  68      -1.831   8.164  -8.177  1.00  0.28           H  
ATOM    927  HB2 ASN A  68       0.746   9.286  -9.168  1.00  0.58           H  
ATOM    928  HB3 ASN A  68       0.015   7.995 -10.121  1.00  0.56           H  
ATOM    929 HD21 ASN A  68      -0.591  11.276  -8.830  1.00  1.58           H  
ATOM    930 HD22 ASN A  68      -1.843  11.645  -9.915  1.00  1.68           H  
ATOM    931  N   LEU A  69       0.702   6.517  -7.110  1.00  0.23           N  
ATOM    932  CA  LEU A  69       1.233   5.141  -6.885  1.00  0.23           C  
ATOM    933  C   LEU A  69       0.283   4.404  -5.947  1.00  0.23           C  
ATOM    934  O   LEU A  69       0.026   3.224  -6.102  1.00  0.27           O  
ATOM    935  CB  LEU A  69       2.624   5.209  -6.249  1.00  0.23           C  
ATOM    936  CG  LEU A  69       3.640   5.614  -7.302  1.00  0.28           C  
ATOM    937  CD1 LEU A  69       4.955   6.003  -6.625  1.00  0.32           C  
ATOM    938  CD2 LEU A  69       3.882   4.445  -8.260  1.00  0.35           C  
ATOM    939  H   LEU A  69       1.060   7.272  -6.591  1.00  0.22           H  
ATOM    940  HA  LEU A  69       1.288   4.624  -7.826  1.00  0.26           H  
ATOM    941  HB2 LEU A  69       2.626   5.936  -5.450  1.00  0.21           H  
ATOM    942  HB3 LEU A  69       2.886   4.244  -5.861  1.00  0.24           H  
ATOM    943  HG  LEU A  69       3.252   6.450  -7.845  1.00  0.29           H  
ATOM    944 HD11 LEU A  69       5.166   5.312  -5.822  1.00  1.07           H  
ATOM    945 HD12 LEU A  69       4.872   7.003  -6.225  1.00  0.92           H  
ATOM    946 HD13 LEU A  69       5.757   5.970  -7.347  1.00  1.08           H  
ATOM    947 HD21 LEU A  69       4.182   3.574  -7.697  1.00  0.99           H  
ATOM    948 HD22 LEU A  69       4.660   4.708  -8.960  1.00  0.94           H  
ATOM    949 HD23 LEU A  69       2.971   4.230  -8.798  1.00  1.14           H  
ATOM    950  N   LYS A  70      -0.249   5.112  -4.985  1.00  0.23           N  
ATOM    951  CA  LYS A  70      -1.207   4.496  -4.021  1.00  0.26           C  
ATOM    952  C   LYS A  70      -2.585   4.400  -4.688  1.00  0.29           C  
ATOM    953  O   LYS A  70      -3.280   3.410  -4.552  1.00  0.34           O  
ATOM    954  CB  LYS A  70      -1.300   5.365  -2.766  1.00  0.30           C  
ATOM    955  CG  LYS A  70       0.064   5.421  -2.070  1.00  0.48           C  
ATOM    956  CD  LYS A  70      -0.027   4.749  -0.698  1.00  0.60           C  
ATOM    957  CE  LYS A  70       1.007   5.369   0.245  1.00  0.78           C  
ATOM    958  NZ  LYS A  70       0.679   5.007   1.654  1.00  1.06           N  
ATOM    959  H   LYS A  70      -0.021   6.065  -4.907  1.00  0.22           H  
ATOM    960  HA  LYS A  70      -0.865   3.507  -3.754  1.00  0.28           H  
ATOM    961  HB2 LYS A  70      -1.601   6.364  -3.045  1.00  0.38           H  
ATOM    962  HB3 LYS A  70      -2.030   4.945  -2.091  1.00  0.36           H  
ATOM    963  HG2 LYS A  70       0.798   4.908  -2.675  1.00  1.00           H  
ATOM    964  HG3 LYS A  70       0.361   6.452  -1.945  1.00  0.94           H  
ATOM    965  HD2 LYS A  70      -1.018   4.893  -0.292  1.00  1.13           H  
ATOM    966  HD3 LYS A  70       0.170   3.693  -0.800  1.00  1.16           H  
ATOM    967  HE2 LYS A  70       1.989   4.996  -0.003  1.00  1.31           H  
ATOM    968  HE3 LYS A  70       0.993   6.444   0.138  1.00  1.43           H  
ATOM    969  HZ1 LYS A  70      -0.127   5.575   1.981  1.00  1.47           H  
ATOM    970  HZ2 LYS A  70       1.501   5.196   2.261  1.00  1.82           H  
ATOM    971  HZ3 LYS A  70       0.435   3.996   1.706  1.00  1.30           H  
ATOM    972  N   LYS A  71      -2.971   5.420  -5.425  1.00  0.31           N  
ATOM    973  CA  LYS A  71      -4.290   5.403  -6.129  1.00  0.35           C  
ATOM    974  C   LYS A  71      -4.247   4.397  -7.293  1.00  0.36           C  
ATOM    975  O   LYS A  71      -5.272   4.027  -7.837  1.00  0.42           O  
ATOM    976  CB  LYS A  71      -4.580   6.804  -6.680  1.00  0.38           C  
ATOM    977  CG  LYS A  71      -6.088   7.057  -6.685  1.00  0.68           C  
ATOM    978  CD  LYS A  71      -6.477   7.823  -7.951  1.00  1.39           C  
ATOM    979  CE  LYS A  71      -7.853   8.467  -7.758  1.00  1.74           C  
ATOM    980  NZ  LYS A  71      -7.849   9.839  -8.343  1.00  2.33           N  
ATOM    981  H   LYS A  71      -2.382   6.197  -5.527  1.00  0.32           H  
ATOM    982  HA  LYS A  71      -5.068   5.120  -5.434  1.00  0.38           H  
ATOM    983  HB2 LYS A  71      -4.094   7.542  -6.058  1.00  0.68           H  
ATOM    984  HB3 LYS A  71      -4.201   6.878  -7.689  1.00  0.59           H  
ATOM    985  HG2 LYS A  71      -6.611   6.113  -6.658  1.00  0.83           H  
ATOM    986  HG3 LYS A  71      -6.354   7.642  -5.818  1.00  0.97           H  
ATOM    987  HD2 LYS A  71      -5.742   8.592  -8.146  1.00  1.73           H  
ATOM    988  HD3 LYS A  71      -6.515   7.141  -8.787  1.00  1.81           H  
ATOM    989  HE2 LYS A  71      -8.602   7.868  -8.253  1.00  1.95           H  
ATOM    990  HE3 LYS A  71      -8.078   8.527  -6.704  1.00  2.07           H  
ATOM    991  HZ1 LYS A  71      -8.781  10.279  -8.202  1.00  2.59           H  
ATOM    992  HZ2 LYS A  71      -7.647   9.783  -9.361  1.00  2.78           H  
ATOM    993  HZ3 LYS A  71      -7.119  10.414  -7.875  1.00  2.71           H  
ATOM    994  N   GLU A  72      -3.064   3.959  -7.676  1.00  0.35           N  
ATOM    995  CA  GLU A  72      -2.930   2.984  -8.801  1.00  0.40           C  
ATOM    996  C   GLU A  72      -3.626   1.666  -8.439  1.00  0.42           C  
ATOM    997  O   GLU A  72      -4.505   1.209  -9.148  1.00  0.46           O  
ATOM    998  CB  GLU A  72      -1.443   2.719  -9.067  1.00  0.51           C  
ATOM    999  CG  GLU A  72      -1.073   3.203 -10.472  1.00  0.64           C  
ATOM   1000  CD  GLU A  72       0.452   3.293 -10.600  1.00  1.25           C  
ATOM   1001  OE1 GLU A  72       1.066   2.275 -10.878  1.00  1.98           O  
ATOM   1002  OE2 GLU A  72       0.981   4.379 -10.418  1.00  1.82           O  
ATOM   1003  H   GLU A  72      -2.260   4.277  -7.222  1.00  0.32           H  
ATOM   1004  HA  GLU A  72      -3.384   3.399  -9.687  1.00  0.43           H  
ATOM   1005  HB2 GLU A  72      -0.848   3.248  -8.337  1.00  0.55           H  
ATOM   1006  HB3 GLU A  72      -1.246   1.661  -8.990  1.00  0.57           H  
ATOM   1007  HG2 GLU A  72      -1.456   2.507 -11.205  1.00  0.90           H  
ATOM   1008  HG3 GLU A  72      -1.505   4.178 -10.643  1.00  1.01           H  
ATOM   1009  N   LYS A  73      -3.238   1.054  -7.343  1.00  0.47           N  
ATOM   1010  CA  LYS A  73      -3.872  -0.237  -6.930  1.00  0.58           C  
ATOM   1011  C   LYS A  73      -5.197   0.046  -6.214  1.00  0.53           C  
ATOM   1012  O   LYS A  73      -6.234  -0.469  -6.593  1.00  0.65           O  
ATOM   1013  CB  LYS A  73      -2.929  -0.997  -5.989  1.00  0.70           C  
ATOM   1014  CG  LYS A  73      -2.703  -2.415  -6.524  1.00  0.85           C  
ATOM   1015  CD  LYS A  73      -3.915  -3.290  -6.192  1.00  1.33           C  
ATOM   1016  CE  LYS A  73      -4.192  -4.246  -7.355  1.00  1.55           C  
ATOM   1017  NZ  LYS A  73      -5.466  -4.980  -7.105  1.00  2.07           N  
ATOM   1018  H   LYS A  73      -2.528   1.445  -6.792  1.00  0.48           H  
ATOM   1019  HA  LYS A  73      -4.062  -0.837  -7.808  1.00  0.72           H  
ATOM   1020  HB2 LYS A  73      -1.983  -0.479  -5.932  1.00  0.90           H  
ATOM   1021  HB3 LYS A  73      -3.369  -1.053  -5.005  1.00  1.05           H  
ATOM   1022  HG2 LYS A  73      -2.568  -2.377  -7.596  1.00  1.44           H  
ATOM   1023  HG3 LYS A  73      -1.822  -2.836  -6.065  1.00  1.43           H  
ATOM   1024  HD2 LYS A  73      -3.712  -3.859  -5.297  1.00  1.99           H  
ATOM   1025  HD3 LYS A  73      -4.779  -2.663  -6.032  1.00  1.94           H  
ATOM   1026  HE2 LYS A  73      -4.277  -3.682  -8.272  1.00  1.91           H  
ATOM   1027  HE3 LYS A  73      -3.380  -4.953  -7.441  1.00  2.02           H  
ATOM   1028  HZ1 LYS A  73      -6.261  -4.310  -7.114  1.00  2.30           H  
ATOM   1029  HZ2 LYS A  73      -5.421  -5.449  -6.178  1.00  2.44           H  
ATOM   1030  HZ3 LYS A  73      -5.605  -5.694  -7.849  1.00  2.64           H  
ATOM   1031  N   GLY A  74      -5.169   0.861  -5.184  1.00  0.46           N  
ATOM   1032  CA  GLY A  74      -6.424   1.184  -4.439  1.00  0.55           C  
ATOM   1033  C   GLY A  74      -6.091   1.507  -2.980  1.00  0.54           C  
ATOM   1034  O   GLY A  74      -6.427   0.758  -2.082  1.00  0.67           O  
ATOM   1035  H   GLY A  74      -4.320   1.262  -4.903  1.00  0.45           H  
ATOM   1036  HA2 GLY A  74      -6.904   2.037  -4.897  1.00  0.59           H  
ATOM   1037  HA3 GLY A  74      -7.091   0.335  -4.472  1.00  0.65           H  
ATOM   1038  N   LEU A  75      -5.446   2.627  -2.744  1.00  0.46           N  
ATOM   1039  CA  LEU A  75      -5.092   3.031  -1.350  1.00  0.53           C  
ATOM   1040  C   LEU A  75      -5.396   4.518  -1.207  1.00  0.53           C  
ATOM   1041  O   LEU A  75      -5.998   4.947  -0.240  1.00  0.67           O  
ATOM   1042  CB  LEU A  75      -3.596   2.792  -1.064  1.00  0.51           C  
ATOM   1043  CG  LEU A  75      -3.043   1.666  -1.946  1.00  0.70           C  
ATOM   1044  CD1 LEU A  75      -1.516   1.652  -1.852  1.00  0.70           C  
ATOM   1045  CD2 LEU A  75      -3.591   0.316  -1.472  1.00  1.48           C  
ATOM   1046  H   LEU A  75      -5.204   3.218  -3.488  1.00  0.43           H  
ATOM   1047  HA  LEU A  75      -5.692   2.471  -0.647  1.00  0.68           H  
ATOM   1048  HB2 LEU A  75      -3.048   3.700  -1.263  1.00  0.75           H  
ATOM   1049  HB3 LEU A  75      -3.472   2.524  -0.026  1.00  0.90           H  
ATOM   1050  HG  LEU A  75      -3.335   1.839  -2.969  1.00  1.31           H  
ATOM   1051 HD11 LEU A  75      -1.138   2.654  -1.989  1.00  1.23           H  
ATOM   1052 HD12 LEU A  75      -1.114   1.008  -2.620  1.00  1.32           H  
ATOM   1053 HD13 LEU A  75      -1.218   1.285  -0.881  1.00  1.19           H  
ATOM   1054 HD21 LEU A  75      -4.361   0.478  -0.733  1.00  1.98           H  
ATOM   1055 HD22 LEU A  75      -2.791  -0.266  -1.036  1.00  1.89           H  
ATOM   1056 HD23 LEU A  75      -4.006  -0.218  -2.313  1.00  2.04           H  
ATOM   1057  N   PHE A  76      -4.986   5.305  -2.178  1.00  0.42           N  
ATOM   1058  CA  PHE A  76      -5.247   6.761  -2.127  1.00  0.48           C  
ATOM   1059  C   PHE A  76      -6.574   7.088  -2.832  1.00  0.62           C  
ATOM   1060  O   PHE A  76      -6.876   6.450  -3.830  1.00  1.22           O  
ATOM   1061  CB  PHE A  76      -4.092   7.494  -2.813  1.00  0.41           C  
ATOM   1062  CG  PHE A  76      -3.024   7.853  -1.801  1.00  0.35           C  
ATOM   1063  CD1 PHE A  76      -2.783   7.025  -0.694  1.00  1.30           C  
ATOM   1064  CD2 PHE A  76      -2.270   9.020  -1.973  1.00  1.16           C  
ATOM   1065  CE1 PHE A  76      -1.793   7.367   0.234  1.00  1.31           C  
ATOM   1066  CE2 PHE A  76      -1.280   9.361  -1.046  1.00  1.17           C  
ATOM   1067  CZ  PHE A  76      -1.042   8.535   0.058  1.00  0.40           C  
ATOM   1068  OXT PHE A  76      -7.266   7.974  -2.359  1.00  1.05           O  
ATOM   1069  H   PHE A  76      -4.506   4.935  -2.948  1.00  0.37           H  
ATOM   1070  HA  PHE A  76      -5.304   7.063  -1.100  1.00  0.54           H  
ATOM   1071  HB2 PHE A  76      -3.663   6.851  -3.570  1.00  0.37           H  
ATOM   1072  HB3 PHE A  76      -4.467   8.388  -3.276  1.00  0.50           H  
ATOM   1073  HD1 PHE A  76      -3.360   6.120  -0.560  1.00  2.20           H  
ATOM   1074  HD2 PHE A  76      -2.450   9.657  -2.824  1.00  2.05           H  
ATOM   1075  HE1 PHE A  76      -1.609   6.730   1.086  1.00  2.20           H  
ATOM   1076  HE2 PHE A  76      -0.700  10.262  -1.185  1.00  2.07           H  
ATOM   1077  HZ  PHE A  76      -0.278   8.799   0.775  1.00  0.47           H  
TER    1078      PHE A  76                                                      
MASTER      124    0    0    5    0    0    0    6  537    1    0    6          
END