HEADER    METAL BINDING PROTEIN                   18-AUG-00   1FMY              
TITLE     HIGH RESOLUTION SOLUTION STRUCTURE OF THE PROTEIN PART OF             
TITLE    2 CU7 METALLOTHIONEIN                                                  
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: METALLOTHIONEIN;                                           
COMPND   3 CHAIN: A;                                                            
COMPND   4 FRAGMENT: RESIDUES 9 TO 48                                           
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;                       
SOURCE   3 ORGANISM_COMMON: BAKER'S YEAST;                                      
SOURCE   4 ORGANISM_TAXID: 4932;                                                
SOURCE   5 STRAIN: X-2180-1AA                                                   
KEYWDS    METALLOTHIONEIN, NMR, COPPER, SACCHAROMYCES CEREVISIAE,               
KEYWDS   2 METAL BINDING PROTEIN                                                
EXPDTA    SOLUTION NMR                                                          
MDLTYP    MINIMIZED AVERAGE                                                     
AUTHOR    I.BERTINI,H.J.HARTMANN,T.KLEIN,G.LIU,C.LUCHINAT,U.WESER               
REVDAT   2   24-FEB-09 1FMY    1       VERSN                                    
REVDAT   1   13-SEP-00 1FMY    0                                                
JRNL        AUTH   I.BERTINI,H.J.HARTMANN,T.KLEIN,G.LIU,C.LUCHINAT,             
JRNL        AUTH 2 U.WESER                                                      
JRNL        TITL   HIGH RESOLUTION SOLUTION STRUCTURE OF THE PROTEIN            
JRNL        TITL 2 PART OF CU7 METALLOTHIONEIN.                                 
JRNL        REF    EUR.J.BIOCHEM.                V. 267  1008 2000              
JRNL        REFN                   ISSN 0014-2956                               
JRNL        PMID   10672009                                                     
JRNL        DOI    10.1046/J.1432-1327.2000.01093.X                             
REMARK   1                                                                      
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : AMBER 5                                              
REMARK   3   AUTHORS     : PEARLMAN, D. A., ET. AL                              
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: A TOTAL OF 1192 NOES, OF WHICH 1048       
REMARK   3  ARE MEANINGFUL, WERE USED TO DETERMINE THE SOLUTION STRUCTURE.      
REMARK   4                                                                      
REMARK   4 1FMY COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 24-AUG-00.                  
REMARK 100 THE RCSB ID CODE IS RCSB011725.                                      
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 283; 298                           
REMARK 210  PH                             : 6.5; 6.5                           
REMARK 210  IONIC STRENGTH                 : 0.02; 0.02                         
REMARK 210  PRESSURE                       : NORMAL; NORMAL                     
REMARK 210  SAMPLE CONTENTS                : 5MM UNENRICH METALLOTHIONEIN;      
REMARK 210                                   18MM PHOSPHATE BUFFER; 90%         
REMARK 210                                   H2O, 10% D2O;PH=6.5; 0.03%         
REMARK 210                                   BETA-MERCAPTOETHANOL               
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D NOESY, 2D TOCSY                 
REMARK 210  SPECTROMETER FIELD STRENGTH    : 800 MHZ, 600 MHZ                   
REMARK 210  SPECTROMETER MODEL             : AVANCE                             
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : XWINNMR 3.1, DYANA 1.5, XEASY      
REMARK 210                                   3.1                                
REMARK 210   METHOD USED                   : DISTANCE GEOMETRY SIMULATED        
REMARK 210                                   ANNEALING TORSION ANGLE            
REMARK 210                                   DYNAMICS                           
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 30                                 
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 1                                  
REMARK 210 CONFORMERS, SELECTION CRITERIA  : MEAN STRUCTURE                     
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1                   
REMARK 210                                                                      
REMARK 210 REMARK: THIS STRUCTURE WAS DETERMINED USING STANDARD 2D              
REMARK 210  HOMONUCLEAR TECHNIQUES.                                             
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 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    HIS A   5     -171.32    177.56                                   
REMARK 500    GLN A   8       -0.75     53.91                                   
REMARK 500    CYS A   9      119.89    -37.49                                   
REMARK 500    LYS A  15       68.07    -69.67                                   
REMARK 500    ASN A  16      -35.99   -171.38                                   
REMARK 500    LYS A  35       52.85   -113.46                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
DBREF  1FMY A    1    40  UNP    P07215   MTCU_YEAST       9     48             
SEQRES   1 A   40  GLN ASN GLU GLY HIS GLU CYS GLN CYS GLN CYS GLY SER          
SEQRES   2 A   40  CYS LYS ASN ASN GLU GLN CYS GLN LYS SER CYS SER CYS          
SEQRES   3 A   40  PRO THR GLY CYS ASN SER ASP ASP LYS CYS PRO CYS GLY          
SEQRES   4 A   40  ASN                                                          
HELIX    1   1 ASN A   17  SER A   23  1                                   7    
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   GLN A   1      -1.233  -1.882  17.131  1.00  0.00           N  
ATOM      2  CA  GLN A   1      -0.384  -0.725  16.778  1.00  0.00           C  
ATOM      3  C   GLN A   1      -0.630  -0.393  15.304  1.00  0.00           C  
ATOM      4  O   GLN A   1      -1.742  -0.570  14.821  1.00  0.00           O  
ATOM      5  CB  GLN A   1       1.109  -0.954  17.116  1.00  0.00           C  
ATOM      6  CG  GLN A   1       1.946   0.348  17.191  1.00  0.00           C  
ATOM      7  CD  GLN A   1       3.424   0.137  16.842  1.00  0.00           C  
ATOM      8  OE1 GLN A   1       4.288   0.328  17.689  1.00  0.00           O  
ATOM      9  NE2 GLN A   1       3.750  -0.246  15.606  1.00  0.00           N  
ATOM     10  H1  GLN A   1      -1.026  -2.755  16.644  1.00  0.00           H  
ATOM     11  H2  GLN A   1      -1.300  -2.063  18.118  1.00  0.00           H  
ATOM     12  H3  GLN A   1      -2.159  -1.745  16.741  1.00  0.00           H  
ATOM     13  HA  GLN A   1      -0.742   0.117  17.371  1.00  0.00           H  
ATOM     14  HB2 GLN A   1       1.185  -1.427  18.096  1.00  0.00           H  
ATOM     15  HB3 GLN A   1       1.539  -1.643  16.388  1.00  0.00           H  
ATOM     16  HG2 GLN A   1       1.558   1.152  16.566  1.00  0.00           H  
ATOM     17  HG3 GLN A   1       1.899   0.722  18.215  1.00  0.00           H  
ATOM     18 HE21 GLN A   1       3.096  -0.428  14.865  1.00  0.00           H  
ATOM     19 HE22 GLN A   1       4.736  -0.356  15.415  1.00  0.00           H  
ATOM     20  N   ASN A   2       0.411   0.020  14.583  1.00  0.00           N  
ATOM     21  CA  ASN A   2       0.448   0.202  13.146  1.00  0.00           C  
ATOM     22  C   ASN A   2       1.056  -1.096  12.638  1.00  0.00           C  
ATOM     23  O   ASN A   2       2.199  -1.140  12.197  1.00  0.00           O  
ATOM     24  CB  ASN A   2       1.308   1.426  12.793  1.00  0.00           C  
ATOM     25  CG  ASN A   2       0.849   2.708  13.488  1.00  0.00           C  
ATOM     26  OD1 ASN A   2       1.660   3.427  14.057  1.00  0.00           O  
ATOM     27  ND2 ASN A   2      -0.448   3.008  13.481  1.00  0.00           N  
ATOM     28  H   ASN A   2       1.310  -0.035  15.012  1.00  0.00           H  
ATOM     29  HA  ASN A   2      -0.554   0.323  12.730  1.00  0.00           H  
ATOM     30  HB2 ASN A   2       2.340   1.242  13.094  1.00  0.00           H  
ATOM     31  HB3 ASN A   2       1.298   1.573  11.714  1.00  0.00           H  
ATOM     32 HD21 ASN A   2      -1.122   2.402  13.041  1.00  0.00           H  
ATOM     33 HD22 ASN A   2      -0.741   3.851  13.952  1.00  0.00           H  
ATOM     34  N   GLU A   3       0.300  -2.172  12.852  1.00  0.00           N  
ATOM     35  CA  GLU A   3       0.720  -3.565  12.734  1.00  0.00           C  
ATOM     36  C   GLU A   3       1.380  -3.932  11.404  1.00  0.00           C  
ATOM     37  O   GLU A   3       2.065  -4.950  11.337  1.00  0.00           O  
ATOM     38  CB  GLU A   3      -0.490  -4.451  13.058  1.00  0.00           C  
ATOM     39  CG  GLU A   3      -0.624  -4.486  14.586  1.00  0.00           C  
ATOM     40  CD  GLU A   3      -2.054  -4.583  15.076  1.00  0.00           C  
ATOM     41  OE1 GLU A   3      -2.805  -5.431  14.559  1.00  0.00           O  
ATOM     42  OE2 GLU A   3      -2.344  -3.775  15.987  1.00  0.00           O  
ATOM     43  H   GLU A   3      -0.571  -1.993  13.333  1.00  0.00           H  
ATOM     44  HA  GLU A   3       1.487  -3.751  13.488  1.00  0.00           H  
ATOM     45  HB2 GLU A   3      -1.394  -4.051  12.595  1.00  0.00           H  
ATOM     46  HB3 GLU A   3      -0.342  -5.469  12.691  1.00  0.00           H  
ATOM     47  HG2 GLU A   3      -0.065  -5.338  14.972  1.00  0.00           H  
ATOM     48  HG3 GLU A   3      -0.199  -3.580  15.006  1.00  0.00           H  
ATOM     49  N   GLY A   4       1.193  -3.123  10.362  1.00  0.00           N  
ATOM     50  CA  GLY A   4       1.960  -3.258   9.142  1.00  0.00           C  
ATOM     51  C   GLY A   4       3.224  -2.418   9.266  1.00  0.00           C  
ATOM     52  O   GLY A   4       4.233  -2.876   9.796  1.00  0.00           O  
ATOM     53  H   GLY A   4       0.700  -2.251  10.501  1.00  0.00           H  
ATOM     54  HA2 GLY A   4       2.223  -4.297   8.939  1.00  0.00           H  
ATOM     55  HA3 GLY A   4       1.347  -2.887   8.327  1.00  0.00           H  
ATOM     56  N   HIS A   5       3.145  -1.179   8.778  1.00  0.00           N  
ATOM     57  CA  HIS A   5       4.186  -0.162   8.777  1.00  0.00           C  
ATOM     58  C   HIS A   5       3.589   1.040   8.045  1.00  0.00           C  
ATOM     59  O   HIS A   5       2.418   0.995   7.662  1.00  0.00           O  
ATOM     60  CB  HIS A   5       5.463  -0.649   8.068  1.00  0.00           C  
ATOM     61  CG  HIS A   5       5.301  -0.893   6.588  1.00  0.00           C  
ATOM     62  ND1 HIS A   5       4.116  -0.947   5.885  1.00  0.00           N  
ATOM     63  CD2 HIS A   5       6.321  -1.047   5.690  1.00  0.00           C  
ATOM     64  CE1 HIS A   5       4.423  -1.162   4.601  1.00  0.00           C  
ATOM     65  NE2 HIS A   5       5.753  -1.212   4.426  1.00  0.00           N  
ATOM     66  H   HIS A   5       2.252  -0.851   8.427  1.00  0.00           H  
ATOM     67  HA  HIS A   5       4.418   0.112   9.807  1.00  0.00           H  
ATOM     68  HB2 HIS A   5       6.243   0.102   8.199  1.00  0.00           H  
ATOM     69  HB3 HIS A   5       5.836  -1.563   8.527  1.00  0.00           H  
ATOM     70  HD1 HIS A   5       3.180  -0.799   6.238  1.00  0.00           H  
ATOM     71  HD2 HIS A   5       7.378  -1.031   5.914  1.00  0.00           H  
ATOM     72  HE1 HIS A   5       3.675  -1.247   3.833  1.00  0.00           H  
ATOM     73  N   GLU A   6       4.404   2.053   7.750  1.00  0.00           N  
ATOM     74  CA  GLU A   6       3.991   3.141   6.887  1.00  0.00           C  
ATOM     75  C   GLU A   6       3.972   2.635   5.454  1.00  0.00           C  
ATOM     76  O   GLU A   6       5.004   2.543   4.797  1.00  0.00           O  
ATOM     77  CB  GLU A   6       4.901   4.357   7.049  1.00  0.00           C  
ATOM     78  CG  GLU A   6       4.796   4.890   8.483  1.00  0.00           C  
ATOM     79  CD  GLU A   6       4.515   6.382   8.554  1.00  0.00           C  
ATOM     80  OE1 GLU A   6       4.976   7.117   7.659  1.00  0.00           O  
ATOM     81  OE2 GLU A   6       3.733   6.748   9.460  1.00  0.00           O  
ATOM     82  H   GLU A   6       5.387   1.954   7.937  1.00  0.00           H  
ATOM     83  HA  GLU A   6       2.986   3.460   7.165  1.00  0.00           H  
ATOM     84  HB2 GLU A   6       5.936   4.102   6.816  1.00  0.00           H  
ATOM     85  HB3 GLU A   6       4.576   5.119   6.341  1.00  0.00           H  
ATOM     86  HG2 GLU A   6       4.005   4.373   9.027  1.00  0.00           H  
ATOM     87  HG3 GLU A   6       5.734   4.696   8.985  1.00  0.00           H  
ATOM     88  N   CYS A   7       2.770   2.321   4.986  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.512   1.814   3.653  1.00  0.00           C  
ATOM     90  C   CYS A   7       3.061   2.737   2.571  1.00  0.00           C  
ATOM     91  O   CYS A   7       3.927   2.359   1.791  1.00  0.00           O  
ATOM     92  CB  CYS A   7       1.005   1.697   3.509  1.00  0.00           C  
ATOM     93  SG  CYS A   7       0.459   1.126   1.910  1.00  0.00           S  
ATOM     94  H   CYS A   7       1.990   2.387   5.638  1.00  0.00           H  
ATOM     95  HA  CYS A   7       2.953   0.830   3.524  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       0.597   1.094   4.311  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       0.573   2.675   3.598  1.00  0.00           H  
ATOM     98  N   GLN A   8       2.466   3.927   2.479  1.00  0.00           N  
ATOM     99  CA  GLN A   8       2.728   5.005   1.528  1.00  0.00           C  
ATOM    100  C   GLN A   8       2.672   4.615   0.033  1.00  0.00           C  
ATOM    101  O   GLN A   8       2.815   5.484  -0.825  1.00  0.00           O  
ATOM    102  CB  GLN A   8       4.009   5.753   1.925  1.00  0.00           C  
ATOM    103  CG  GLN A   8       4.155   5.954   3.447  1.00  0.00           C  
ATOM    104  CD  GLN A   8       2.904   6.524   4.120  1.00  0.00           C  
ATOM    105  OE1 GLN A   8       2.587   7.696   3.951  1.00  0.00           O  
ATOM    106  NE2 GLN A   8       2.164   5.716   4.885  1.00  0.00           N  
ATOM    107  H   GLN A   8       1.791   4.127   3.198  1.00  0.00           H  
ATOM    108  HA  GLN A   8       1.904   5.708   1.661  1.00  0.00           H  
ATOM    109  HB2 GLN A   8       4.876   5.196   1.568  1.00  0.00           H  
ATOM    110  HB3 GLN A   8       4.003   6.730   1.437  1.00  0.00           H  
ATOM    111  HG2 GLN A   8       4.428   5.008   3.909  1.00  0.00           H  
ATOM    112  HG3 GLN A   8       4.977   6.649   3.623  1.00  0.00           H  
ATOM    113 HE21 GLN A   8       2.374   4.738   5.000  1.00  0.00           H  
ATOM    114 HE22 GLN A   8       1.360   6.114   5.336  1.00  0.00           H  
ATOM    115  N   CYS A   9       2.408   3.339  -0.274  1.00  0.00           N  
ATOM    116  CA  CYS A   9       2.187   2.740  -1.583  1.00  0.00           C  
ATOM    117  C   CYS A   9       1.405   3.672  -2.498  1.00  0.00           C  
ATOM    118  O   CYS A   9       0.244   3.953  -2.217  1.00  0.00           O  
ATOM    119  CB  CYS A   9       1.324   1.490  -1.375  1.00  0.00           C  
ATOM    120  SG  CYS A   9       2.196   0.087  -0.638  1.00  0.00           S  
ATOM    121  H   CYS A   9       2.393   2.685   0.490  1.00  0.00           H  
ATOM    122  HA  CYS A   9       3.147   2.450  -2.022  1.00  0.00           H  
ATOM    123  HB2 CYS A   9       0.503   1.774  -0.716  1.00  0.00           H  
ATOM    124  HB3 CYS A   9       0.878   1.166  -2.319  1.00  0.00           H  
ATOM    125  N   GLN A  10       1.961   4.074  -3.641  1.00  0.00           N  
ATOM    126  CA  GLN A  10       1.292   4.974  -4.582  1.00  0.00           C  
ATOM    127  C   GLN A  10       0.127   4.319  -5.343  1.00  0.00           C  
ATOM    128  O   GLN A  10      -0.382   4.900  -6.298  1.00  0.00           O  
ATOM    129  CB  GLN A  10       2.336   5.571  -5.533  1.00  0.00           C  
ATOM    130  CG  GLN A  10       3.113   6.679  -4.827  1.00  0.00           C  
ATOM    131  CD  GLN A  10       2.479   8.069  -4.891  1.00  0.00           C  
ATOM    132  OE1 GLN A  10       3.127   9.067  -4.596  1.00  0.00           O  
ATOM    133  NE2 GLN A  10       1.205   8.167  -5.258  1.00  0.00           N  
ATOM    134  H   GLN A  10       2.916   3.792  -3.840  1.00  0.00           H  
ATOM    135  HA  GLN A  10       0.878   5.805  -4.016  1.00  0.00           H  
ATOM    136  HB2 GLN A  10       3.013   4.784  -5.855  1.00  0.00           H  
ATOM    137  HB3 GLN A  10       1.894   6.004  -6.416  1.00  0.00           H  
ATOM    138  HG2 GLN A  10       3.176   6.399  -3.791  1.00  0.00           H  
ATOM    139  HG3 GLN A  10       4.111   6.725  -5.245  1.00  0.00           H  
ATOM    140 HE21 GLN A  10       0.702   7.333  -5.521  1.00  0.00           H  
ATOM    141 HE22 GLN A  10       0.814   9.083  -5.405  1.00  0.00           H  
ATOM    142  N   CYS A  11      -0.327   3.141  -4.910  1.00  0.00           N  
ATOM    143  CA  CYS A  11      -1.484   2.454  -5.454  1.00  0.00           C  
ATOM    144  C   CYS A  11      -2.727   3.161  -4.946  1.00  0.00           C  
ATOM    145  O   CYS A  11      -2.861   3.298  -3.737  1.00  0.00           O  
ATOM    146  CB  CYS A  11      -1.498   1.004  -4.940  1.00  0.00           C  
ATOM    147  SG  CYS A  11      -1.260  -0.209  -6.217  1.00  0.00           S  
ATOM    148  H   CYS A  11       0.004   2.817  -4.018  1.00  0.00           H  
ATOM    149  HA  CYS A  11      -1.455   2.468  -6.545  1.00  0.00           H  
ATOM    150  HB2 CYS A  11      -0.734   0.843  -4.177  1.00  0.00           H  
ATOM    151  HB3 CYS A  11      -2.469   0.727  -4.530  1.00  0.00           H  
ATOM    152  N   GLY A  12      -3.664   3.550  -5.812  1.00  0.00           N  
ATOM    153  CA  GLY A  12      -4.959   4.073  -5.377  1.00  0.00           C  
ATOM    154  C   GLY A  12      -5.596   3.173  -4.311  1.00  0.00           C  
ATOM    155  O   GLY A  12      -6.098   3.648  -3.292  1.00  0.00           O  
ATOM    156  H   GLY A  12      -3.491   3.449  -6.800  1.00  0.00           H  
ATOM    157  HA2 GLY A  12      -4.829   5.079  -4.977  1.00  0.00           H  
ATOM    158  HA3 GLY A  12      -5.626   4.122  -6.238  1.00  0.00           H  
ATOM    159  N   SER A  13      -5.509   1.857  -4.528  1.00  0.00           N  
ATOM    160  CA  SER A  13      -6.057   0.816  -3.675  1.00  0.00           C  
ATOM    161  C   SER A  13      -5.479   0.889  -2.263  1.00  0.00           C  
ATOM    162  O   SER A  13      -6.108   0.440  -1.310  1.00  0.00           O  
ATOM    163  CB  SER A  13      -5.758  -0.542  -4.321  1.00  0.00           C  
ATOM    164  OG  SER A  13      -5.716  -0.392  -5.732  1.00  0.00           O  
ATOM    165  H   SER A  13      -5.036   1.508  -5.347  1.00  0.00           H  
ATOM    166  HA  SER A  13      -7.139   0.953  -3.626  1.00  0.00           H  
ATOM    167  HB2 SER A  13      -4.790  -0.915  -3.980  1.00  0.00           H  
ATOM    168  HB3 SER A  13      -6.529  -1.257  -4.024  1.00  0.00           H  
ATOM    169  HG  SER A  13      -5.702  -1.262  -6.143  1.00  0.00           H  
ATOM    170  N   CYS A  14      -4.295   1.488  -2.123  1.00  0.00           N  
ATOM    171  CA  CYS A  14      -3.664   1.764  -0.853  1.00  0.00           C  
ATOM    172  C   CYS A  14      -4.000   3.194  -0.402  1.00  0.00           C  
ATOM    173  O   CYS A  14      -4.548   3.412   0.683  1.00  0.00           O  
ATOM    174  CB  CYS A  14      -2.164   1.532  -1.044  1.00  0.00           C  
ATOM    175  SG  CYS A  14      -1.670  -0.198  -0.863  1.00  0.00           S  
ATOM    176  H   CYS A  14      -3.808   1.847  -2.938  1.00  0.00           H  
ATOM    177  HA  CYS A  14      -4.020   1.068  -0.095  1.00  0.00           H  
ATOM    178  HB2 CYS A  14      -1.824   1.877  -2.019  1.00  0.00           H  
ATOM    179  HB3 CYS A  14      -1.637   2.122  -0.316  1.00  0.00           H  
ATOM    180  N   LYS A  15      -3.688   4.171  -1.255  1.00  0.00           N  
ATOM    181  CA  LYS A  15      -3.867   5.608  -1.074  1.00  0.00           C  
ATOM    182  C   LYS A  15      -5.346   5.999  -1.097  1.00  0.00           C  
ATOM    183  O   LYS A  15      -5.817   6.680  -2.004  1.00  0.00           O  
ATOM    184  CB  LYS A  15      -3.063   6.338  -2.159  1.00  0.00           C  
ATOM    185  CG  LYS A  15      -1.571   6.247  -1.826  1.00  0.00           C  
ATOM    186  CD  LYS A  15      -1.039   7.510  -1.132  1.00  0.00           C  
ATOM    187  CE  LYS A  15      -0.592   8.543  -2.178  1.00  0.00           C  
ATOM    188  NZ  LYS A  15      -0.163   9.816  -1.565  1.00  0.00           N  
ATOM    189  H   LYS A  15      -3.283   3.886  -2.134  1.00  0.00           H  
ATOM    190  HA  LYS A  15      -3.451   5.884  -0.106  1.00  0.00           H  
ATOM    191  HB2 LYS A  15      -3.250   5.853  -3.118  1.00  0.00           H  
ATOM    192  HB3 LYS A  15      -3.366   7.381  -2.244  1.00  0.00           H  
ATOM    193  HG2 LYS A  15      -1.414   5.391  -1.168  1.00  0.00           H  
ATOM    194  HG3 LYS A  15      -1.022   6.062  -2.747  1.00  0.00           H  
ATOM    195  HD2 LYS A  15      -1.811   7.913  -0.473  1.00  0.00           H  
ATOM    196  HD3 LYS A  15      -0.178   7.222  -0.524  1.00  0.00           H  
ATOM    197  HE2 LYS A  15       0.251   8.127  -2.733  1.00  0.00           H  
ATOM    198  HE3 LYS A  15      -1.406   8.737  -2.880  1.00  0.00           H  
ATOM    199  HZ1 LYS A  15       0.197  10.432  -2.281  1.00  0.00           H  
ATOM    200  HZ2 LYS A  15      -0.945  10.266  -1.110  1.00  0.00           H  
ATOM    201  HZ3 LYS A  15       0.568   9.649  -0.887  1.00  0.00           H  
ATOM    202  N   ASN A  16      -6.060   5.566  -0.062  1.00  0.00           N  
ATOM    203  CA  ASN A  16      -7.493   5.759   0.136  1.00  0.00           C  
ATOM    204  C   ASN A  16      -7.897   5.303   1.540  1.00  0.00           C  
ATOM    205  O   ASN A  16      -8.786   5.892   2.147  1.00  0.00           O  
ATOM    206  CB  ASN A  16      -8.315   4.985  -0.912  1.00  0.00           C  
ATOM    207  CG  ASN A  16      -8.323   3.489  -0.631  1.00  0.00           C  
ATOM    208  OD1 ASN A  16      -9.322   2.920  -0.206  1.00  0.00           O  
ATOM    209  ND2 ASN A  16      -7.169   2.873  -0.819  1.00  0.00           N  
ATOM    210  H   ASN A  16      -5.548   5.001   0.605  1.00  0.00           H  
ATOM    211  HA  ASN A  16      -7.716   6.822   0.033  1.00  0.00           H  
ATOM    212  HB2 ASN A  16      -9.344   5.321  -0.865  1.00  0.00           H  
ATOM    213  HB3 ASN A  16      -7.950   5.175  -1.922  1.00  0.00           H  
ATOM    214 HD21 ASN A  16      -6.489   3.387  -1.365  1.00  0.00           H  
ATOM    215 HD22 ASN A  16      -7.061   1.870  -0.687  1.00  0.00           H  
ATOM    216  N   ASN A  17      -7.262   4.234   2.039  1.00  0.00           N  
ATOM    217  CA  ASN A  17      -7.678   3.520   3.239  1.00  0.00           C  
ATOM    218  C   ASN A  17      -6.599   3.677   4.311  1.00  0.00           C  
ATOM    219  O   ASN A  17      -5.547   3.033   4.284  1.00  0.00           O  
ATOM    220  CB  ASN A  17      -8.034   2.052   2.925  1.00  0.00           C  
ATOM    221  CG  ASN A  17      -6.873   1.118   2.923  1.00  0.00           C  
ATOM    222  OD1 ASN A  17      -6.779   0.267   3.797  1.00  0.00           O  
ATOM    223  ND2 ASN A  17      -6.001   1.322   1.941  1.00  0.00           N  
ATOM    224  H   ASN A  17      -6.473   3.863   1.530  1.00  0.00           H  
ATOM    225  HA  ASN A  17      -8.601   3.963   3.617  1.00  0.00           H  
ATOM    226  HB2 ASN A  17      -8.818   1.682   3.587  1.00  0.00           H  
ATOM    227  HB3 ASN A  17      -8.287   1.890   1.898  1.00  0.00           H  
ATOM    228 HD21 ASN A  17      -6.210   1.968   1.200  1.00  0.00           H  
ATOM    229 HD22 ASN A  17      -5.076   0.963   1.977  1.00  0.00           H  
ATOM    230  N   GLU A  18      -6.846   4.554   5.282  1.00  0.00           N  
ATOM    231  CA  GLU A  18      -5.891   4.778   6.354  1.00  0.00           C  
ATOM    232  C   GLU A  18      -5.620   3.505   7.159  1.00  0.00           C  
ATOM    233  O   GLU A  18      -4.570   3.385   7.790  1.00  0.00           O  
ATOM    234  CB  GLU A  18      -6.345   5.939   7.232  1.00  0.00           C  
ATOM    235  CG  GLU A  18      -6.167   7.244   6.443  1.00  0.00           C  
ATOM    236  CD  GLU A  18      -6.678   8.460   7.205  1.00  0.00           C  
ATOM    237  OE1 GLU A  18      -7.489   8.255   8.134  1.00  0.00           O  
ATOM    238  OE2 GLU A  18      -6.234   9.570   6.846  1.00  0.00           O  
ATOM    239  H   GLU A  18      -7.679   5.124   5.254  1.00  0.00           H  
ATOM    240  HA  GLU A  18      -4.963   5.065   5.868  1.00  0.00           H  
ATOM    241  HB2 GLU A  18      -7.384   5.800   7.536  1.00  0.00           H  
ATOM    242  HB3 GLU A  18      -5.730   5.985   8.133  1.00  0.00           H  
ATOM    243  HG2 GLU A  18      -5.105   7.402   6.253  1.00  0.00           H  
ATOM    244  HG3 GLU A  18      -6.675   7.184   5.480  1.00  0.00           H  
ATOM    245  N   GLN A  19      -6.536   2.532   7.088  1.00  0.00           N  
ATOM    246  CA  GLN A  19      -6.260   1.185   7.545  1.00  0.00           C  
ATOM    247  C   GLN A  19      -4.942   0.678   6.971  1.00  0.00           C  
ATOM    248  O   GLN A  19      -4.004   0.445   7.731  1.00  0.00           O  
ATOM    249  CB  GLN A  19      -7.419   0.229   7.210  1.00  0.00           C  
ATOM    250  CG  GLN A  19      -8.310  -0.042   8.430  1.00  0.00           C  
ATOM    251  CD  GLN A  19      -7.499  -0.656   9.571  1.00  0.00           C  
ATOM    252  OE1 GLN A  19      -7.150  -1.829   9.535  1.00  0.00           O  
ATOM    253  NE2 GLN A  19      -7.135   0.148  10.567  1.00  0.00           N  
ATOM    254  H   GLN A  19      -7.391   2.705   6.585  1.00  0.00           H  
ATOM    255  HA  GLN A  19      -6.103   1.267   8.616  1.00  0.00           H  
ATOM    256  HB2 GLN A  19      -8.010   0.623   6.380  1.00  0.00           H  
ATOM    257  HB3 GLN A  19      -7.012  -0.733   6.887  1.00  0.00           H  
ATOM    258  HG2 GLN A  19      -8.784   0.885   8.754  1.00  0.00           H  
ATOM    259  HG3 GLN A  19      -9.089  -0.750   8.143  1.00  0.00           H  
ATOM    260 HE21 GLN A  19      -7.437   1.109  10.591  1.00  0.00           H  
ATOM    261 HE22 GLN A  19      -6.471  -0.202  11.239  1.00  0.00           H  
ATOM    262  N   CYS A  20      -4.837   0.520   5.649  1.00  0.00           N  
ATOM    263  CA  CYS A  20      -3.618  -0.040   5.096  1.00  0.00           C  
ATOM    264  C   CYS A  20      -2.473   0.912   5.351  1.00  0.00           C  
ATOM    265  O   CYS A  20      -1.369   0.457   5.618  1.00  0.00           O  
ATOM    266  CB  CYS A  20      -3.680  -0.417   3.614  1.00  0.00           C  
ATOM    267  SG  CYS A  20      -2.725   0.625   2.490  1.00  0.00           S  
ATOM    268  H   CYS A  20      -5.577   0.816   5.019  1.00  0.00           H  
ATOM    269  HA  CYS A  20      -3.428  -0.963   5.641  1.00  0.00           H  
ATOM    270  HB2 CYS A  20      -3.176  -1.381   3.561  1.00  0.00           H  
ATOM    271  HB3 CYS A  20      -4.703  -0.508   3.243  1.00  0.00           H  
ATOM    272  N   GLN A  21      -2.726   2.226   5.301  1.00  0.00           N  
ATOM    273  CA  GLN A  21      -1.663   3.195   5.464  1.00  0.00           C  
ATOM    274  C   GLN A  21      -0.708   2.868   6.599  1.00  0.00           C  
ATOM    275  O   GLN A  21       0.495   3.094   6.470  1.00  0.00           O  
ATOM    276  CB  GLN A  21      -2.217   4.602   5.610  1.00  0.00           C  
ATOM    277  CG  GLN A  21      -2.830   5.110   4.310  1.00  0.00           C  
ATOM    278  CD  GLN A  21      -1.880   5.019   3.124  1.00  0.00           C  
ATOM    279  OE1 GLN A  21      -0.908   5.757   3.011  1.00  0.00           O  
ATOM    280  NE2 GLN A  21      -2.149   4.055   2.255  1.00  0.00           N  
ATOM    281  H   GLN A  21      -3.659   2.561   5.076  1.00  0.00           H  
ATOM    282  HA  GLN A  21      -1.095   3.130   4.564  1.00  0.00           H  
ATOM    283  HB2 GLN A  21      -2.969   4.584   6.387  1.00  0.00           H  
ATOM    284  HB3 GLN A  21      -1.427   5.280   5.918  1.00  0.00           H  
ATOM    285  HG2 GLN A  21      -3.717   4.537   4.081  1.00  0.00           H  
ATOM    286  HG3 GLN A  21      -3.139   6.128   4.474  1.00  0.00           H  
ATOM    287 HE21 GLN A  21      -2.981   3.497   2.417  1.00  0.00           H  
ATOM    288 HE22 GLN A  21      -1.555   3.916   1.453  1.00  0.00           H  
ATOM    289  N   LYS A  22      -1.268   2.353   7.691  1.00  0.00           N  
ATOM    290  CA  LYS A  22      -0.540   1.962   8.874  1.00  0.00           C  
ATOM    291  C   LYS A  22      -0.531   0.425   9.050  1.00  0.00           C  
ATOM    292  O   LYS A  22       0.332  -0.118   9.742  1.00  0.00           O  
ATOM    293  CB  LYS A  22      -1.212   2.698  10.037  1.00  0.00           C  
ATOM    294  CG  LYS A  22      -1.518   4.188   9.799  1.00  0.00           C  
ATOM    295  CD  LYS A  22      -0.336   5.161   9.973  1.00  0.00           C  
ATOM    296  CE  LYS A  22       0.471   5.354   8.680  1.00  0.00           C  
ATOM    297  NZ  LYS A  22       1.336   6.552   8.720  1.00  0.00           N  
ATOM    298  H   LYS A  22      -2.279   2.286   7.725  1.00  0.00           H  
ATOM    299  HA  LYS A  22       0.496   2.288   8.788  1.00  0.00           H  
ATOM    300  HB2 LYS A  22      -2.159   2.197  10.244  1.00  0.00           H  
ATOM    301  HB3 LYS A  22      -0.589   2.637  10.910  1.00  0.00           H  
ATOM    302  HG2 LYS A  22      -1.999   4.340   8.841  1.00  0.00           H  
ATOM    303  HG3 LYS A  22      -2.276   4.459  10.527  1.00  0.00           H  
ATOM    304  HD2 LYS A  22      -0.764   6.124  10.259  1.00  0.00           H  
ATOM    305  HD3 LYS A  22       0.314   4.827  10.786  1.00  0.00           H  
ATOM    306  HE2 LYS A  22       1.095   4.477   8.507  1.00  0.00           H  
ATOM    307  HE3 LYS A  22      -0.219   5.472   7.843  1.00  0.00           H  
ATOM    308  HZ1 LYS A  22       1.827   6.678   7.846  1.00  0.00           H  
ATOM    309  HZ2 LYS A  22       0.825   7.394   8.931  1.00  0.00           H  
ATOM    310  HZ3 LYS A  22       2.099   6.464   9.396  1.00  0.00           H  
ATOM    311  N   SER A  23      -1.489  -0.287   8.442  1.00  0.00           N  
ATOM    312  CA  SER A  23      -1.656  -1.740   8.520  1.00  0.00           C  
ATOM    313  C   SER A  23      -1.594  -2.380   7.122  1.00  0.00           C  
ATOM    314  O   SER A  23      -2.509  -3.087   6.704  1.00  0.00           O  
ATOM    315  CB  SER A  23      -2.961  -2.068   9.266  1.00  0.00           C  
ATOM    316  OG  SER A  23      -2.927  -3.385   9.783  1.00  0.00           O  
ATOM    317  H   SER A  23      -2.187   0.214   7.899  1.00  0.00           H  
ATOM    318  HA  SER A  23      -0.845  -2.167   9.100  1.00  0.00           H  
ATOM    319  HB2 SER A  23      -3.097  -1.378  10.099  1.00  0.00           H  
ATOM    320  HB3 SER A  23      -3.816  -1.969   8.595  1.00  0.00           H  
ATOM    321  HG  SER A  23      -2.252  -3.452  10.462  1.00  0.00           H  
ATOM    322  N   CYS A  24      -0.503  -2.124   6.395  1.00  0.00           N  
ATOM    323  CA  CYS A  24      -0.218  -2.681   5.072  1.00  0.00           C  
ATOM    324  C   CYS A  24       0.966  -3.645   5.181  1.00  0.00           C  
ATOM    325  O   CYS A  24       1.853  -3.431   6.005  1.00  0.00           O  
ATOM    326  CB  CYS A  24       0.189  -1.563   4.121  1.00  0.00           C  
ATOM    327  SG  CYS A  24       0.910  -2.115   2.571  1.00  0.00           S  
ATOM    328  H   CYS A  24       0.186  -1.505   6.791  1.00  0.00           H  
ATOM    329  HA  CYS A  24      -1.107  -3.160   4.649  1.00  0.00           H  
ATOM    330  HB2 CYS A  24      -0.663  -0.944   3.863  1.00  0.00           H  
ATOM    331  HB3 CYS A  24       0.933  -0.963   4.628  1.00  0.00           H  
ATOM    332  N   SER A  25       1.008  -4.670   4.327  1.00  0.00           N  
ATOM    333  CA  SER A  25       2.022  -5.719   4.342  1.00  0.00           C  
ATOM    334  C   SER A  25       2.717  -5.817   2.981  1.00  0.00           C  
ATOM    335  O   SER A  25       2.857  -6.909   2.437  1.00  0.00           O  
ATOM    336  CB  SER A  25       1.349  -7.044   4.723  1.00  0.00           C  
ATOM    337  OG  SER A  25       0.554  -6.867   5.881  1.00  0.00           O  
ATOM    338  H   SER A  25       0.293  -4.724   3.622  1.00  0.00           H  
ATOM    339  HA  SER A  25       2.790  -5.504   5.086  1.00  0.00           H  
ATOM    340  HB2 SER A  25       0.710  -7.385   3.906  1.00  0.00           H  
ATOM    341  HB3 SER A  25       2.113  -7.803   4.903  1.00  0.00           H  
ATOM    342  HG  SER A  25       1.084  -6.456   6.570  1.00  0.00           H  
ATOM    343  N   CYS A  26       3.134  -4.676   2.424  1.00  0.00           N  
ATOM    344  CA  CYS A  26       3.803  -4.590   1.129  1.00  0.00           C  
ATOM    345  C   CYS A  26       5.182  -3.968   1.292  1.00  0.00           C  
ATOM    346  O   CYS A  26       5.387  -3.210   2.234  1.00  0.00           O  
ATOM    347  CB  CYS A  26       2.998  -3.706   0.175  1.00  0.00           C  
ATOM    348  SG  CYS A  26       1.272  -4.132  -0.053  1.00  0.00           S  
ATOM    349  H   CYS A  26       2.991  -3.811   2.922  1.00  0.00           H  
ATOM    350  HA  CYS A  26       3.915  -5.584   0.707  1.00  0.00           H  
ATOM    351  HB2 CYS A  26       3.036  -2.677   0.518  1.00  0.00           H  
ATOM    352  HB3 CYS A  26       3.459  -3.744  -0.805  1.00  0.00           H  
ATOM    353  N   PRO A  27       6.125  -4.240   0.377  1.00  0.00           N  
ATOM    354  CA  PRO A  27       7.402  -3.557   0.365  1.00  0.00           C  
ATOM    355  C   PRO A  27       7.245  -2.128  -0.166  1.00  0.00           C  
ATOM    356  O   PRO A  27       6.239  -1.772  -0.778  1.00  0.00           O  
ATOM    357  CB  PRO A  27       8.320  -4.388  -0.516  1.00  0.00           C  
ATOM    358  CG  PRO A  27       7.340  -4.985  -1.503  1.00  0.00           C  
ATOM    359  CD  PRO A  27       6.039  -5.180  -0.724  1.00  0.00           C  
ATOM    360  HA  PRO A  27       7.843  -3.578   1.351  1.00  0.00           H  
ATOM    361  HB2 PRO A  27       9.088  -3.804  -1.024  1.00  0.00           H  
ATOM    362  HB3 PRO A  27       8.774  -5.185   0.075  1.00  0.00           H  
ATOM    363  HG2 PRO A  27       7.198  -4.266  -2.309  1.00  0.00           H  
ATOM    364  HG3 PRO A  27       7.752  -5.920  -1.846  1.00  0.00           H  
ATOM    365  HD2 PRO A  27       5.195  -4.981  -1.382  1.00  0.00           H  
ATOM    366  HD3 PRO A  27       5.967  -6.198  -0.338  1.00  0.00           H  
ATOM    367  N   THR A  28       8.297  -1.329   0.011  1.00  0.00           N  
ATOM    368  CA  THR A  28       8.329   0.089  -0.356  1.00  0.00           C  
ATOM    369  C   THR A  28       8.063   0.293  -1.852  1.00  0.00           C  
ATOM    370  O   THR A  28       7.458   1.272  -2.293  1.00  0.00           O  
ATOM    371  CB  THR A  28       9.626   0.737   0.151  1.00  0.00           C  
ATOM    372  OG1 THR A  28       9.641   2.126  -0.094  1.00  0.00           O  
ATOM    373  CG2 THR A  28      10.850   0.119  -0.513  1.00  0.00           C  
ATOM    374  H   THR A  28       9.118  -1.756   0.404  1.00  0.00           H  
ATOM    375  HA  THR A  28       7.528   0.569   0.169  1.00  0.00           H  
ATOM    376  HB  THR A  28       9.699   0.582   1.230  1.00  0.00           H  
ATOM    377  HG1 THR A  28       8.887   2.533   0.343  1.00  0.00           H  
ATOM    378 HG21 THR A  28      11.750   0.566  -0.095  1.00  0.00           H  
ATOM    379 HG22 THR A  28      10.811   0.318  -1.582  1.00  0.00           H  
ATOM    380 HG23 THR A  28      10.864  -0.954  -0.338  1.00  0.00           H  
ATOM    381  N   GLY A  29       8.490  -0.699  -2.627  1.00  0.00           N  
ATOM    382  CA  GLY A  29       8.324  -0.759  -4.063  1.00  0.00           C  
ATOM    383  C   GLY A  29       6.861  -0.829  -4.507  1.00  0.00           C  
ATOM    384  O   GLY A  29       6.585  -0.557  -5.676  1.00  0.00           O  
ATOM    385  H   GLY A  29       8.933  -1.464  -2.150  1.00  0.00           H  
ATOM    386  HA2 GLY A  29       8.796   0.114  -4.517  1.00  0.00           H  
ATOM    387  HA3 GLY A  29       8.835  -1.655  -4.412  1.00  0.00           H  
ATOM    388  N   CYS A  30       5.914  -1.169  -3.622  1.00  0.00           N  
ATOM    389  CA  CYS A  30       4.532  -1.406  -4.021  1.00  0.00           C  
ATOM    390  C   CYS A  30       3.833  -0.110  -4.429  1.00  0.00           C  
ATOM    391  O   CYS A  30       3.166   0.550  -3.638  1.00  0.00           O  
ATOM    392  CB  CYS A  30       3.777  -2.132  -2.916  1.00  0.00           C  
ATOM    393  SG  CYS A  30       1.992  -2.163  -3.183  1.00  0.00           S  
ATOM    394  H   CYS A  30       6.124  -1.228  -2.629  1.00  0.00           H  
ATOM    395  HA  CYS A  30       4.522  -2.076  -4.884  1.00  0.00           H  
ATOM    396  HB2 CYS A  30       4.142  -3.157  -2.878  1.00  0.00           H  
ATOM    397  HB3 CYS A  30       3.969  -1.648  -1.961  1.00  0.00           H  
ATOM    398  N   ASN A  31       4.001   0.264  -5.694  1.00  0.00           N  
ATOM    399  CA  ASN A  31       3.440   1.471  -6.278  1.00  0.00           C  
ATOM    400  C   ASN A  31       2.765   1.083  -7.590  1.00  0.00           C  
ATOM    401  O   ASN A  31       2.916   1.762  -8.604  1.00  0.00           O  
ATOM    402  CB  ASN A  31       4.558   2.506  -6.448  1.00  0.00           C  
ATOM    403  CG  ASN A  31       5.155   2.874  -5.100  1.00  0.00           C  
ATOM    404  OD1 ASN A  31       4.687   3.767  -4.400  1.00  0.00           O  
ATOM    405  ND2 ASN A  31       6.174   2.129  -4.719  1.00  0.00           N  
ATOM    406  H   ASN A  31       4.679  -0.260  -6.236  1.00  0.00           H  
ATOM    407  HA  ASN A  31       2.694   1.903  -5.618  1.00  0.00           H  
ATOM    408  HB2 ASN A  31       5.339   2.108  -7.090  1.00  0.00           H  
ATOM    409  HB3 ASN A  31       4.199   3.409  -6.915  1.00  0.00           H  
ATOM    410 HD21 ASN A  31       6.408   1.342  -5.311  1.00  0.00           H  
ATOM    411 HD22 ASN A  31       6.564   2.238  -3.794  1.00  0.00           H  
ATOM    412  N   SER A  32       2.059  -0.052  -7.578  1.00  0.00           N  
ATOM    413  CA  SER A  32       1.473  -0.694  -8.747  1.00  0.00           C  
ATOM    414  C   SER A  32       0.512  -1.765  -8.245  1.00  0.00           C  
ATOM    415  O   SER A  32       0.871  -2.516  -7.340  1.00  0.00           O  
ATOM    416  CB  SER A  32       2.551  -1.359  -9.619  1.00  0.00           C  
ATOM    417  OG  SER A  32       3.549  -0.447 -10.035  1.00  0.00           O  
ATOM    418  H   SER A  32       1.890  -0.508  -6.687  1.00  0.00           H  
ATOM    419  HA  SER A  32       0.919   0.057  -9.314  1.00  0.00           H  
ATOM    420  HB2 SER A  32       3.028  -2.163  -9.056  1.00  0.00           H  
ATOM    421  HB3 SER A  32       2.076  -1.795 -10.500  1.00  0.00           H  
ATOM    422  HG  SER A  32       3.251   0.455  -9.857  1.00  0.00           H  
ATOM    423  N   ASP A  33      -0.703  -1.815  -8.792  1.00  0.00           N  
ATOM    424  CA  ASP A  33      -1.756  -2.737  -8.392  1.00  0.00           C  
ATOM    425  C   ASP A  33      -1.292  -4.164  -8.691  1.00  0.00           C  
ATOM    426  O   ASP A  33      -1.366  -5.042  -7.830  1.00  0.00           O  
ATOM    427  CB  ASP A  33      -3.061  -2.379  -9.124  1.00  0.00           C  
ATOM    428  CG  ASP A  33      -2.950  -2.394 -10.646  1.00  0.00           C  
ATOM    429  OD1 ASP A  33      -1.816  -2.170 -11.132  1.00  0.00           O  
ATOM    430  OD2 ASP A  33      -3.995  -2.616 -11.288  1.00  0.00           O  
ATOM    431  H   ASP A  33      -0.885  -1.341  -9.674  1.00  0.00           H  
ATOM    432  HA  ASP A  33      -1.945  -2.625  -7.321  1.00  0.00           H  
ATOM    433  HB2 ASP A  33      -3.831  -3.093  -8.831  1.00  0.00           H  
ATOM    434  HB3 ASP A  33      -3.382  -1.384  -8.820  1.00  0.00           H  
ATOM    435  N   ASP A  34      -0.744  -4.348  -9.898  1.00  0.00           N  
ATOM    436  CA  ASP A  34      -0.058  -5.550 -10.365  1.00  0.00           C  
ATOM    437  C   ASP A  34       0.751  -6.211  -9.244  1.00  0.00           C  
ATOM    438  O   ASP A  34       0.624  -7.409  -8.996  1.00  0.00           O  
ATOM    439  CB  ASP A  34       0.857  -5.169 -11.536  1.00  0.00           C  
ATOM    440  CG  ASP A  34       1.640  -6.370 -12.049  1.00  0.00           C  
ATOM    441  OD1 ASP A  34       2.731  -6.617 -11.490  1.00  0.00           O  
ATOM    442  OD2 ASP A  34       1.146  -7.008 -13.001  1.00  0.00           O  
ATOM    443  H   ASP A  34      -0.852  -3.562 -10.543  1.00  0.00           H  
ATOM    444  HA  ASP A  34      -0.805  -6.261 -10.721  1.00  0.00           H  
ATOM    445  HB2 ASP A  34       0.251  -4.770 -12.350  1.00  0.00           H  
ATOM    446  HB3 ASP A  34       1.567  -4.406 -11.223  1.00  0.00           H  
ATOM    447  N   LYS A  35       1.560  -5.408  -8.543  1.00  0.00           N  
ATOM    448  CA  LYS A  35       2.368  -5.854  -7.418  1.00  0.00           C  
ATOM    449  C   LYS A  35       1.893  -5.219  -6.114  1.00  0.00           C  
ATOM    450  O   LYS A  35       2.704  -4.673  -5.365  1.00  0.00           O  
ATOM    451  CB  LYS A  35       3.848  -5.561  -7.686  1.00  0.00           C  
ATOM    452  CG  LYS A  35       4.345  -6.307  -8.927  1.00  0.00           C  
ATOM    453  CD  LYS A  35       5.746  -6.869  -8.667  1.00  0.00           C  
ATOM    454  CE  LYS A  35       6.265  -7.607  -9.907  1.00  0.00           C  
ATOM    455  NZ  LYS A  35       7.492  -8.373  -9.607  1.00  0.00           N  
ATOM    456  H   LYS A  35       1.541  -4.423  -8.757  1.00  0.00           H  
ATOM    457  HA  LYS A  35       2.269  -6.932  -7.280  1.00  0.00           H  
ATOM    458  HB2 LYS A  35       4.012  -4.489  -7.804  1.00  0.00           H  
ATOM    459  HB3 LYS A  35       4.410  -5.909  -6.821  1.00  0.00           H  
ATOM    460  HG2 LYS A  35       3.670  -7.136  -9.142  1.00  0.00           H  
ATOM    461  HG3 LYS A  35       4.335  -5.632  -9.786  1.00  0.00           H  
ATOM    462  HD2 LYS A  35       6.416  -6.048  -8.401  1.00  0.00           H  
ATOM    463  HD3 LYS A  35       5.675  -7.562  -7.826  1.00  0.00           H  
ATOM    464  HE2 LYS A  35       5.496  -8.295 -10.266  1.00  0.00           H  
ATOM    465  HE3 LYS A  35       6.467  -6.879 -10.696  1.00  0.00           H  
ATOM    466  HZ1 LYS A  35       8.212  -7.757  -9.255  1.00  0.00           H  
ATOM    467  HZ2 LYS A  35       7.293  -9.082  -8.914  1.00  0.00           H  
ATOM    468  HZ3 LYS A  35       7.826  -8.825 -10.448  1.00  0.00           H  
ATOM    469  N   CYS A  36       0.597  -5.339  -5.811  1.00  0.00           N  
ATOM    470  CA  CYS A  36       0.041  -4.920  -4.532  1.00  0.00           C  
ATOM    471  C   CYS A  36      -0.354  -6.117  -3.665  1.00  0.00           C  
ATOM    472  O   CYS A  36      -1.486  -6.585  -3.755  1.00  0.00           O  
ATOM    473  CB  CYS A  36      -1.136  -3.973  -4.753  1.00  0.00           C  
ATOM    474  SG  CYS A  36      -1.737  -3.253  -3.214  1.00  0.00           S  
ATOM    475  H   CYS A  36      -0.047  -5.674  -6.525  1.00  0.00           H  
ATOM    476  HA  CYS A  36       0.769  -4.347  -3.976  1.00  0.00           H  
ATOM    477  HB2 CYS A  36      -0.814  -3.153  -5.391  1.00  0.00           H  
ATOM    478  HB3 CYS A  36      -1.957  -4.501  -5.238  1.00  0.00           H  
ATOM    479  N   PRO A  37       0.539  -6.611  -2.787  1.00  0.00           N  
ATOM    480  CA  PRO A  37       0.215  -7.697  -1.866  1.00  0.00           C  
ATOM    481  C   PRO A  37      -0.609  -7.258  -0.642  1.00  0.00           C  
ATOM    482  O   PRO A  37      -0.766  -8.022   0.307  1.00  0.00           O  
ATOM    483  CB  PRO A  37       1.551  -8.297  -1.457  1.00  0.00           C  
ATOM    484  CG  PRO A  37       2.549  -7.163  -1.632  1.00  0.00           C  
ATOM    485  CD  PRO A  37       1.944  -6.240  -2.683  1.00  0.00           C  
ATOM    486  HA  PRO A  37      -0.310  -8.482  -2.398  1.00  0.00           H  
ATOM    487  HB2 PRO A  37       1.564  -8.712  -0.448  1.00  0.00           H  
ATOM    488  HB3 PRO A  37       1.783  -9.073  -2.180  1.00  0.00           H  
ATOM    489  HG2 PRO A  37       2.679  -6.625  -0.700  1.00  0.00           H  
ATOM    490  HG3 PRO A  37       3.485  -7.585  -1.975  1.00  0.00           H  
ATOM    491  HD2 PRO A  37       2.083  -5.200  -2.404  1.00  0.00           H  
ATOM    492  HD3 PRO A  37       2.486  -6.403  -3.605  1.00  0.00           H  
ATOM    493  N   CYS A  38      -1.103  -6.019  -0.635  1.00  0.00           N  
ATOM    494  CA  CYS A  38      -1.820  -5.422   0.484  1.00  0.00           C  
ATOM    495  C   CYS A  38      -3.055  -6.231   0.877  1.00  0.00           C  
ATOM    496  O   CYS A  38      -3.898  -6.524   0.035  1.00  0.00           O  
ATOM    497  CB  CYS A  38      -2.248  -3.998   0.130  1.00  0.00           C  
ATOM    498  SG  CYS A  38      -3.052  -3.159   1.499  1.00  0.00           S  
ATOM    499  H   CYS A  38      -0.889  -5.437  -1.424  1.00  0.00           H  
ATOM    500  HA  CYS A  38      -1.138  -5.370   1.334  1.00  0.00           H  
ATOM    501  HB2 CYS A  38      -1.387  -3.399  -0.156  1.00  0.00           H  
ATOM    502  HB3 CYS A  38      -2.957  -4.023  -0.697  1.00  0.00           H  
ATOM    503  N   GLY A  39      -3.194  -6.552   2.166  1.00  0.00           N  
ATOM    504  CA  GLY A  39      -4.370  -7.236   2.688  1.00  0.00           C  
ATOM    505  C   GLY A  39      -5.472  -6.245   3.068  1.00  0.00           C  
ATOM    506  O   GLY A  39      -6.107  -6.406   4.107  1.00  0.00           O  
ATOM    507  H   GLY A  39      -2.481  -6.273   2.821  1.00  0.00           H  
ATOM    508  HA2 GLY A  39      -4.762  -7.943   1.956  1.00  0.00           H  
ATOM    509  HA3 GLY A  39      -4.077  -7.795   3.577  1.00  0.00           H  
ATOM    510  N   ASN A  40      -5.695  -5.224   2.239  1.00  0.00           N  
ATOM    511  CA  ASN A  40      -6.755  -4.235   2.352  1.00  0.00           C  
ATOM    512  C   ASN A  40      -6.938  -3.722   0.928  1.00  0.00           C  
ATOM    513  O   ASN A  40      -8.051  -3.250   0.617  1.00  0.00           O  
ATOM    514  CB  ASN A  40      -6.362  -3.045   3.238  1.00  0.00           C  
ATOM    515  CG  ASN A  40      -6.111  -3.371   4.705  1.00  0.00           C  
ATOM    516  OD1 ASN A  40      -7.029  -3.412   5.518  1.00  0.00           O  
ATOM    517  ND2 ASN A  40      -4.839  -3.531   5.058  1.00  0.00           N  
ATOM    518  OXT ASN A  40      -5.931  -3.810   0.186  1.00  0.00           O  
ATOM    519  H   ASN A  40      -5.235  -5.175   1.330  1.00  0.00           H  
ATOM    520  HA  ASN A  40      -7.680  -4.691   2.708  1.00  0.00           H  
ATOM    521  HB2 ASN A  40      -5.477  -2.578   2.815  1.00  0.00           H  
ATOM    522  HB3 ASN A  40      -7.162  -2.310   3.200  1.00  0.00           H  
ATOM    523 HD21 ASN A  40      -4.131  -3.483   4.347  1.00  0.00           H  
ATOM    524 HD22 ASN A  40      -4.577  -3.689   6.024  1.00  0.00           H  
TER     525      ASN A  40                                                      
MASTER       76    0    0    1    0    0    0    6  524    1    0    4          
END