HEADER    BLOOD CLOTTING                          19-FEB-99   1FFM              
TITLE     THE FIRST EGF-LIKE DOMAIN FROM HUMAN BLOOD COAGULATION FVII           
TITLE    2 (FUCOSYLATED AT SER-60), NMR, MINIMIZED AVERAGE STRUCTURE            
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: PROTEIN (BLOOD COAGULATION FACTOR VII);                    
COMPND   3 CHAIN: A;                                                            
COMPND   4 FRAGMENT: FIRST EGF-LIKE DOMAIN (RESIDUES 45-87; FUCOSYLATED AT SER- 
COMPND   5 60);                                                                 
COMPND   6 ENGINEERED: YES;                                                     
COMPND   7 OTHER_DETAILS: CALCIUM BOUND FORM                                    
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
SOURCE   4 ORGANISM_TAXID: 9606;                                                
SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562                                         
KEYWDS    FACTOR VII, BLOOD COAGULATION, EGF-LIKE DOMAIN, GLYCOPROTEIN,         
KEYWDS   2 FUCOSYLATION, O- LINKED FUCOSE, BLOOD CLOTTING                       
EXPDTA    SOLUTION NMR                                                          
AUTHOR    Y.-H.KAO,G.F.LEE,Y.WANG,M.A.STAROVASNIK,R.F.KELLEY,M.W.SPELLMAN,      
AUTHOR   2 L.LERNER                                                             
REVDAT   5   27-DEC-23 1FFM    1       HETSYN                                   
REVDAT   4   29-JUL-20 1FFM    1       COMPND REMARK HETNAM LINK                
REVDAT   4 2                   1       SITE                                     
REVDAT   3   24-FEB-09 1FFM    1       VERSN                                    
REVDAT   2   01-APR-03 1FFM    1       JRNL                                     
REVDAT   1   16-JUN-99 1FFM    0                                                
JRNL        AUTH   Y.H.KAO,G.F.LEE,Y.WANG,M.A.STAROVASNIK,R.F.KELLEY,           
JRNL        AUTH 2 M.W.SPELLMAN,L.LERNER                                        
JRNL        TITL   THE EFFECT OF O-FUCOSYLATION ON THE FIRST EGF-LIKE DOMAIN    
JRNL        TITL 2 FROM HUMAN BLOOD COAGULATION FACTOR VII.                     
JRNL        REF    BIOCHEMISTRY                  V.  38  7097 1999              
JRNL        REFN                   ISSN 0006-2960                               
JRNL        PMID   10353820                                                     
JRNL        DOI    10.1021/BI990234Z                                            
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : X-PLOR 3.851                                         
REMARK   3   AUTHORS     : BRUNGER                                              
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: REFINEMENT DETAILS CAN BE FOUND IN THE    
REMARK   3  JRNL CITATION ABOVE.                                                
REMARK   4                                                                      
REMARK   4 1FFM COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 22-FEB-99.                  
REMARK 100 THE DEPOSITION ID IS D_1000000511.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 298                                
REMARK 210  PH                             : 5.5                                
REMARK 210  IONIC STRENGTH                 : 400MM                              
REMARK 210  PRESSURE                       : 1 ATM                              
REMARK 210  SAMPLE CONTENTS                : NULL                               
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : DQF-COSY; 2Q; TOCSY; NOESY; 1H     
REMARK 210                                   -15N HSQC; 3D 1H-15N NOESY-HSQC;   
REMARK 210                                   3D 1H-15N TOCSY-HSQC               
REMARK 210  SPECTROMETER FIELD STRENGTH    : 500 MHZ                            
REMARK 210  SPECTROMETER MODEL             : INOVA 500                          
REMARK 210  SPECTROMETER MANUFACTURER      : VARIAN                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : FELIX, X-PLOR                      
REMARK 210   METHOD USED                   : HYBRID DISTANCE GEOMETRY -         
REMARK 210                                   SIMULATED ANNEALING                
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 100                                
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 1                                  
REMARK 210 CONFORMERS, SELECTION CRITERIA  : NULL                               
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL                
REMARK 210                                                                      
REMARK 210 REMARK: DETAILS ARE INCLUDED IN THE PUBLICATION.                     
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    SER A  53       83.38     50.51                                   
REMARK 500    GLN A  66      -85.67     56.68                                   
REMARK 500    SER A  67     -157.42    -96.10                                   
REMARK 500    TYR A  68     -170.00   -128.71                                   
REMARK 500    CYS A  72     -168.94   -126.77                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
DBREF  1FFM A   45    87  UNP    P08709   FA7_HUMAN       83    125             
SEQADV 1FFM GLY A   88  UNP  P08709              SEE REMARK 999                 
SEQADV 1FFM SER A   89  UNP  P08709              SEE REMARK 999                 
SEQADV 1FFM ALA A   90  UNP  P08709              SEE REMARK 999                 
SEQRES   1 A   46  SER ASP GLY ASP GLN CYS ALA SER SER PRO CYS GLN ASN          
SEQRES   2 A   46  GLY GLY SER CYS LYS ASP GLN LEU GLN SER TYR ILE CYS          
SEQRES   3 A   46  PHE CYS LEU PRO ALA PHE GLU GLY ARG ASN CYS GLU THR          
SEQRES   4 A   46  HIS LYS ASP ASP GLY SER ALA                                  
MODRES 1FFM SER A   60  SER  GLYCOSYLATION SITE                                 
HET    FUC  A  91      21                                                       
HETNAM     FUC ALPHA-L-FUCOPYRANOSE                                             
HETSYN     FUC ALPHA-L-FUCOSE; 6-DEOXY-ALPHA-L-GALACTOPYRANOSE; L-              
HETSYN   2 FUC  FUCOSE; FUCOSE                                                  
FORMUL   2  FUC    C6 H12 O5                                                    
SHEET    1  S1 2 SER A  60  ASP A  63  0                                        
SHEET    2  S1 2 TYR A  68  PHE A  71 -1                                        
SHEET    1  S2 2 PHE A  76  GLU A  77  0                                        
SHEET    2  S2 2 THR A  83  HIS A  84 -1                                        
SSBOND   1 CYS A   50    CYS A   61                          1555   1555  2.02  
SSBOND   2 CYS A   55    CYS A   70                          1555   1555  2.02  
SSBOND   3 CYS A   72    CYS A   81                          1555   1555  2.02  
LINK         OG  SER A  60                 C1  FUC A  91     1555   1555  1.40  
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   SER A  45      -0.909 -18.409  -6.406  1.00  5.16           N  
ATOM      2  CA  SER A  45      -1.723 -19.272  -7.310  1.00  4.55           C  
ATOM      3  C   SER A  45      -3.107 -18.656  -7.527  1.00  3.53           C  
ATOM      4  O   SER A  45      -4.106 -19.350  -7.558  1.00  3.69           O  
ATOM      5  CB  SER A  45      -1.840 -20.609  -6.578  1.00  5.31           C  
ATOM      6  OG  SER A  45      -0.554 -21.011  -6.124  1.00  5.93           O  
ATOM      7  H1  SER A  45      -1.472 -18.158  -5.567  1.00  5.27           H  
ATOM      8  H2  SER A  45      -0.055 -18.921  -6.111  1.00  5.51           H  
ATOM      9  H3  SER A  45      -0.634 -17.542  -6.911  1.00  5.50           H  
ATOM     10  HA  SER A  45      -1.219 -19.412  -8.253  1.00  4.74           H  
ATOM     11  HB2 SER A  45      -2.497 -20.502  -5.731  1.00  5.37           H  
ATOM     12  HB3 SER A  45      -2.244 -21.352  -7.252  1.00  5.70           H  
ATOM     13  HG  SER A  45      -0.436 -20.677  -5.232  1.00  6.17           H  
ATOM     14  N   ASP A  46      -3.169 -17.358  -7.678  1.00  2.93           N  
ATOM     15  CA  ASP A  46      -4.485 -16.685  -7.894  1.00  2.22           C  
ATOM     16  C   ASP A  46      -4.488 -15.945  -9.235  1.00  1.99           C  
ATOM     17  O   ASP A  46      -4.877 -14.795  -9.317  1.00  2.64           O  
ATOM     18  CB  ASP A  46      -4.620 -15.697  -6.735  1.00  2.07           C  
ATOM     19  CG  ASP A  46      -4.659 -16.463  -5.412  1.00  2.91           C  
ATOM     20  OD1 ASP A  46      -5.637 -17.156  -5.180  1.00  3.32           O  
ATOM     21  OD2 ASP A  46      -3.712 -16.344  -4.652  1.00  3.64           O  
ATOM     22  H   ASP A  46      -2.349 -16.824  -7.649  1.00  3.32           H  
ATOM     23  HA  ASP A  46      -5.287 -17.405  -7.860  1.00  2.65           H  
ATOM     24  HB2 ASP A  46      -3.775 -15.023  -6.738  1.00  2.30           H  
ATOM     25  HB3 ASP A  46      -5.533 -15.131  -6.849  1.00  1.96           H  
ATOM     26  N   GLY A  47      -4.054 -16.598 -10.283  1.00  1.80           N  
ATOM     27  CA  GLY A  47      -4.026 -15.942 -11.623  1.00  2.05           C  
ATOM     28  C   GLY A  47      -2.773 -15.072 -11.741  1.00  1.72           C  
ATOM     29  O   GLY A  47      -2.415 -14.359 -10.823  1.00  2.05           O  
ATOM     30  H   GLY A  47      -3.746 -17.524 -10.186  1.00  2.09           H  
ATOM     31  HA2 GLY A  47      -4.015 -16.699 -12.394  1.00  2.44           H  
ATOM     32  HA3 GLY A  47      -4.902 -15.322 -11.739  1.00  2.62           H  
ATOM     33  N   ASP A  48      -2.107 -15.127 -12.866  1.00  1.49           N  
ATOM     34  CA  ASP A  48      -0.874 -14.307 -13.055  1.00  1.52           C  
ATOM     35  C   ASP A  48      -1.104 -13.246 -14.134  1.00  1.19           C  
ATOM     36  O   ASP A  48      -0.964 -13.510 -15.314  1.00  1.51           O  
ATOM     37  CB  ASP A  48       0.200 -15.300 -13.499  1.00  1.94           C  
ATOM     38  CG  ASP A  48       0.811 -15.975 -12.270  1.00  2.61           C  
ATOM     39  OD1 ASP A  48       0.073 -16.245 -11.337  1.00  3.21           O  
ATOM     40  OD2 ASP A  48       2.008 -16.212 -12.282  1.00  3.04           O  
ATOM     41  H   ASP A  48      -2.420 -15.711 -13.589  1.00  1.65           H  
ATOM     42  HA  ASP A  48      -0.584 -13.843 -12.125  1.00  1.88           H  
ATOM     43  HB2 ASP A  48      -0.246 -16.049 -14.138  1.00  1.94           H  
ATOM     44  HB3 ASP A  48       0.972 -14.778 -14.042  1.00  2.36           H  
ATOM     45  N   GLN A  49      -1.456 -12.049 -13.736  1.00  0.90           N  
ATOM     46  CA  GLN A  49      -1.698 -10.963 -14.733  1.00  0.76           C  
ATOM     47  C   GLN A  49      -0.450 -10.086 -14.877  1.00  0.72           C  
ATOM     48  O   GLN A  49      -0.538  -8.919 -15.211  1.00  0.89           O  
ATOM     49  CB  GLN A  49      -2.860 -10.153 -14.159  1.00  0.96           C  
ATOM     50  CG  GLN A  49      -4.119 -11.022 -14.121  1.00  1.28           C  
ATOM     51  CD  GLN A  49      -4.144 -11.829 -12.822  1.00  2.04           C  
ATOM     52  OE1 GLN A  49      -4.299 -13.034 -12.844  1.00  2.81           O  
ATOM     53  NE2 GLN A  49      -3.999 -11.211 -11.681  1.00  2.59           N  
ATOM     54  H   GLN A  49      -1.561 -11.865 -12.780  1.00  1.12           H  
ATOM     55  HA  GLN A  49      -1.976 -11.382 -15.687  1.00  0.87           H  
ATOM     56  HB2 GLN A  49      -2.613  -9.831 -13.158  1.00  1.36           H  
ATOM     57  HB3 GLN A  49      -3.039  -9.290 -14.782  1.00  1.10           H  
ATOM     58  HG2 GLN A  49      -4.994 -10.389 -14.171  1.00  1.65           H  
ATOM     59  HG3 GLN A  49      -4.116 -11.698 -14.963  1.00  1.76           H  
ATOM     60 HE21 GLN A  49      -3.873 -10.239 -11.662  1.00  2.66           H  
ATOM     61 HE22 GLN A  49      -4.013 -11.720 -10.843  1.00  3.31           H  
ATOM     62  N   CYS A  50       0.708 -10.642 -14.628  1.00  0.74           N  
ATOM     63  CA  CYS A  50       1.969  -9.851 -14.749  1.00  0.83           C  
ATOM     64  C   CYS A  50       2.989 -10.618 -15.597  1.00  0.87           C  
ATOM     65  O   CYS A  50       4.162 -10.671 -15.277  1.00  1.13           O  
ATOM     66  CB  CYS A  50       2.471  -9.692 -13.313  1.00  1.00           C  
ATOM     67  SG  CYS A  50       3.878  -8.552 -13.287  1.00  1.28           S  
ATOM     68  H   CYS A  50       0.750 -11.584 -14.363  1.00  0.87           H  
ATOM     69  HA  CYS A  50       1.768  -8.884 -15.181  1.00  0.91           H  
ATOM     70  HB2 CYS A  50       1.678  -9.298 -12.696  1.00  1.29           H  
ATOM     71  HB3 CYS A  50       2.781 -10.653 -12.932  1.00  1.24           H  
ATOM     72  N   ALA A  51       2.545 -11.214 -16.674  1.00  0.84           N  
ATOM     73  CA  ALA A  51       3.477 -11.985 -17.549  1.00  0.96           C  
ATOM     74  C   ALA A  51       4.073 -11.077 -18.630  1.00  1.05           C  
ATOM     75  O   ALA A  51       5.266 -11.082 -18.864  1.00  1.33           O  
ATOM     76  CB  ALA A  51       2.612 -13.075 -18.183  1.00  1.07           C  
ATOM     77  H   ALA A  51       1.594 -11.158 -16.904  1.00  0.91           H  
ATOM     78  HA  ALA A  51       4.261 -12.434 -16.961  1.00  1.16           H  
ATOM     79  HB1 ALA A  51       1.752 -12.623 -18.656  1.00  1.68           H  
ATOM     80  HB2 ALA A  51       3.190 -13.610 -18.923  1.00  1.48           H  
ATOM     81  HB3 ALA A  51       2.282 -13.763 -17.419  1.00  1.37           H  
ATOM     82  N   SER A  52       3.249 -10.305 -19.292  1.00  1.05           N  
ATOM     83  CA  SER A  52       3.763  -9.398 -20.364  1.00  1.34           C  
ATOM     84  C   SER A  52       3.937  -7.970 -19.835  1.00  1.26           C  
ATOM     85  O   SER A  52       3.981  -7.022 -20.596  1.00  1.77           O  
ATOM     86  CB  SER A  52       2.694  -9.435 -21.456  1.00  1.57           C  
ATOM     87  OG  SER A  52       2.417 -10.788 -21.796  1.00  2.21           O  
ATOM     88  H   SER A  52       2.290 -10.323 -19.088  1.00  1.04           H  
ATOM     89  HA  SER A  52       4.696  -9.771 -20.754  1.00  1.57           H  
ATOM     90  HB2 SER A  52       1.792  -8.968 -21.095  1.00  1.82           H  
ATOM     91  HB3 SER A  52       3.051  -8.900 -22.325  1.00  1.89           H  
ATOM     92  HG  SER A  52       1.468 -10.917 -21.747  1.00  2.42           H  
ATOM     93  N   SER A  53       4.042  -7.803 -18.535  1.00  0.82           N  
ATOM     94  CA  SER A  53       4.219  -6.432 -17.947  1.00  0.84           C  
ATOM     95  C   SER A  53       3.162  -5.455 -18.495  1.00  0.71           C  
ATOM     96  O   SER A  53       3.431  -4.725 -19.428  1.00  0.74           O  
ATOM     97  CB  SER A  53       5.623  -5.995 -18.370  1.00  1.09           C  
ATOM     98  OG  SER A  53       6.564  -6.979 -17.963  1.00  1.75           O  
ATOM     99  H   SER A  53       4.007  -8.581 -17.942  1.00  0.80           H  
ATOM    100  HA  SER A  53       4.161  -6.479 -16.871  1.00  0.88           H  
ATOM    101  HB2 SER A  53       5.661  -5.888 -19.441  1.00  1.64           H  
ATOM    102  HB3 SER A  53       5.856  -5.045 -17.907  1.00  1.40           H  
ATOM    103  HG  SER A  53       7.434  -6.696 -18.254  1.00  1.94           H  
ATOM    104  N   PRO A  54       1.988  -5.467 -17.900  1.00  0.61           N  
ATOM    105  CA  PRO A  54       0.905  -4.559 -18.357  1.00  0.57           C  
ATOM    106  C   PRO A  54       1.205  -3.111 -17.947  1.00  0.54           C  
ATOM    107  O   PRO A  54       0.731  -2.176 -18.564  1.00  0.58           O  
ATOM    108  CB  PRO A  54      -0.333  -5.081 -17.634  1.00  0.57           C  
ATOM    109  CG  PRO A  54       0.188  -5.779 -16.420  1.00  0.56           C  
ATOM    110  CD  PRO A  54       1.557  -6.306 -16.768  1.00  0.62           C  
ATOM    111  HA  PRO A  54       0.770  -4.634 -19.424  1.00  0.65           H  
ATOM    112  HB2 PRO A  54      -0.976  -4.258 -17.351  1.00  0.58           H  
ATOM    113  HB3 PRO A  54      -0.868  -5.779 -18.260  1.00  0.64           H  
ATOM    114  HG2 PRO A  54       0.257  -5.082 -15.597  1.00  0.56           H  
ATOM    115  HG3 PRO A  54      -0.460  -6.599 -16.158  1.00  0.60           H  
ATOM    116  HD2 PRO A  54       2.230  -6.191 -15.929  1.00  0.65           H  
ATOM    117  HD3 PRO A  54       1.499  -7.339 -17.072  1.00  0.68           H  
ATOM    118  N   CYS A  55       1.985  -2.922 -16.911  1.00  0.54           N  
ATOM    119  CA  CYS A  55       2.316  -1.533 -16.456  1.00  0.56           C  
ATOM    120  C   CYS A  55       3.039  -0.774 -17.573  1.00  0.43           C  
ATOM    121  O   CYS A  55       3.493  -1.361 -18.537  1.00  0.56           O  
ATOM    122  CB  CYS A  55       3.242  -1.702 -15.245  1.00  0.74           C  
ATOM    123  SG  CYS A  55       2.420  -2.677 -13.953  1.00  1.19           S  
ATOM    124  H   CYS A  55       2.352  -3.694 -16.431  1.00  0.57           H  
ATOM    125  HA  CYS A  55       1.418  -1.010 -16.165  1.00  0.73           H  
ATOM    126  HB2 CYS A  55       4.144  -2.209 -15.554  1.00  0.79           H  
ATOM    127  HB3 CYS A  55       3.497  -0.729 -14.852  1.00  0.72           H  
ATOM    128  N   GLN A  56       3.145   0.526 -17.450  1.00  0.43           N  
ATOM    129  CA  GLN A  56       3.838   1.327 -18.505  1.00  0.62           C  
ATOM    130  C   GLN A  56       4.689   2.432 -17.867  1.00  0.47           C  
ATOM    131  O   GLN A  56       4.692   2.610 -16.664  1.00  0.38           O  
ATOM    132  CB  GLN A  56       2.713   1.935 -19.342  1.00  0.96           C  
ATOM    133  CG  GLN A  56       3.147   2.005 -20.807  1.00  0.96           C  
ATOM    134  CD  GLN A  56       1.929   1.811 -21.712  1.00  1.30           C  
ATOM    135  OE1 GLN A  56       1.677   2.608 -22.592  1.00  2.17           O  
ATOM    136  NE2 GLN A  56       1.154   0.776 -21.528  1.00  1.07           N  
ATOM    137  H   GLN A  56       2.769   0.974 -16.665  1.00  0.48           H  
ATOM    138  HA  GLN A  56       4.452   0.689 -19.121  1.00  0.80           H  
ATOM    139  HB2 GLN A  56       1.829   1.320 -19.256  1.00  1.70           H  
ATOM    140  HB3 GLN A  56       2.496   2.931 -18.985  1.00  1.60           H  
ATOM    141  HG2 GLN A  56       3.593   2.970 -21.004  1.00  1.61           H  
ATOM    142  HG3 GLN A  56       3.868   1.228 -21.007  1.00  1.41           H  
ATOM    143 HE21 GLN A  56       1.357   0.132 -20.817  1.00  0.92           H  
ATOM    144 HE22 GLN A  56       0.372   0.642 -22.102  1.00  1.50           H  
ATOM    145  N   ASN A  57       5.411   3.175 -18.673  1.00  0.52           N  
ATOM    146  CA  ASN A  57       6.273   4.282 -18.139  1.00  0.48           C  
ATOM    147  C   ASN A  57       7.210   3.768 -17.038  1.00  0.54           C  
ATOM    148  O   ASN A  57       7.335   4.372 -15.990  1.00  0.58           O  
ATOM    149  CB  ASN A  57       5.300   5.321 -17.572  1.00  0.46           C  
ATOM    150  CG  ASN A  57       4.719   6.158 -18.716  1.00  0.56           C  
ATOM    151  OD1 ASN A  57       5.316   6.267 -19.769  1.00  0.77           O  
ATOM    152  ND2 ASN A  57       3.572   6.755 -18.552  1.00  0.63           N  
ATOM    153  H   ASN A  57       5.385   3.006 -19.637  1.00  0.63           H  
ATOM    154  HA  ASN A  57       6.848   4.722 -18.939  1.00  0.56           H  
ATOM    155  HB2 ASN A  57       4.500   4.817 -17.051  1.00  0.43           H  
ATOM    156  HB3 ASN A  57       5.825   5.969 -16.887  1.00  0.51           H  
ATOM    157 HD21 ASN A  57       3.090   6.668 -17.702  1.00  0.75           H  
ATOM    158 HD22 ASN A  57       3.191   7.294 -19.277  1.00  0.72           H  
ATOM    159  N   GLY A  58       7.867   2.660 -17.274  1.00  0.69           N  
ATOM    160  CA  GLY A  58       8.801   2.103 -16.249  1.00  0.82           C  
ATOM    161  C   GLY A  58       8.031   1.785 -14.965  1.00  0.67           C  
ATOM    162  O   GLY A  58       8.565   1.868 -13.875  1.00  0.76           O  
ATOM    163  H   GLY A  58       7.749   2.196 -18.128  1.00  0.78           H  
ATOM    164  HA2 GLY A  58       9.255   1.199 -16.630  1.00  0.97           H  
ATOM    165  HA3 GLY A  58       9.572   2.827 -16.032  1.00  0.94           H  
ATOM    166  N   GLY A  59       6.779   1.425 -15.090  1.00  0.51           N  
ATOM    167  CA  GLY A  59       5.963   1.103 -13.882  1.00  0.44           C  
ATOM    168  C   GLY A  59       6.355  -0.275 -13.349  1.00  0.45           C  
ATOM    169  O   GLY A  59       6.718  -1.160 -14.101  1.00  0.50           O  
ATOM    170  H   GLY A  59       6.375   1.369 -15.981  1.00  0.52           H  
ATOM    171  HA2 GLY A  59       6.139   1.850 -13.120  1.00  0.48           H  
ATOM    172  HA3 GLY A  59       4.917   1.098 -14.148  1.00  0.45           H  
ATOM    173  N   SER A  60       6.279  -0.461 -12.056  1.00  0.44           N  
ATOM    174  CA  SER A  60       6.641  -1.783 -11.463  1.00  0.48           C  
ATOM    175  C   SER A  60       5.403  -2.681 -11.401  1.00  0.47           C  
ATOM    176  O   SER A  60       4.389  -2.315 -10.834  1.00  0.61           O  
ATOM    177  CB  SER A  60       7.147  -1.463 -10.057  1.00  0.51           C  
ATOM    178  OG  SER A  60       8.471  -0.951 -10.140  1.00  0.50           O  
ATOM    179  H   SER A  60       5.981   0.268 -11.475  1.00  0.44           H  
ATOM    180  HA  SER A  60       7.422  -2.255 -12.038  1.00  0.51           H  
ATOM    181  HB2 SER A  60       6.510  -0.723  -9.602  1.00  0.51           H  
ATOM    182  HB3 SER A  60       7.134  -2.363  -9.457  1.00  0.63           H  
ATOM    183  N   CYS A  61       5.476  -3.847 -11.988  1.00  0.47           N  
ATOM    184  CA  CYS A  61       4.305  -4.773 -11.978  1.00  0.48           C  
ATOM    185  C   CYS A  61       4.355  -5.689 -10.752  1.00  0.42           C  
ATOM    186  O   CYS A  61       5.392  -6.221 -10.403  1.00  0.55           O  
ATOM    187  CB  CYS A  61       4.439  -5.583 -13.269  1.00  0.59           C  
ATOM    188  SG  CYS A  61       3.039  -6.721 -13.432  1.00  1.03           S  
ATOM    189  H   CYS A  61       6.303  -4.112 -12.442  1.00  0.56           H  
ATOM    190  HA  CYS A  61       3.384  -4.213 -11.990  1.00  0.54           H  
ATOM    191  HB2 CYS A  61       4.455  -4.911 -14.114  1.00  0.89           H  
ATOM    192  HB3 CYS A  61       5.360  -6.149 -13.243  1.00  0.85           H  
ATOM    193  N   LYS A  62       3.234  -5.877 -10.103  1.00  0.39           N  
ATOM    194  CA  LYS A  62       3.194  -6.761  -8.903  1.00  0.46           C  
ATOM    195  C   LYS A  62       1.941  -7.642  -8.949  1.00  0.43           C  
ATOM    196  O   LYS A  62       0.828  -7.150  -9.015  1.00  0.45           O  
ATOM    197  CB  LYS A  62       3.141  -5.807  -7.704  1.00  0.61           C  
ATOM    198  CG  LYS A  62       4.136  -6.267  -6.634  1.00  0.81           C  
ATOM    199  CD  LYS A  62       3.582  -5.939  -5.247  1.00  1.31           C  
ATOM    200  CE  LYS A  62       4.531  -6.485  -4.176  1.00  1.84           C  
ATOM    201  NZ  LYS A  62       4.371  -5.565  -3.015  1.00  2.25           N  
ATOM    202  H   LYS A  62       2.415  -5.437 -10.412  1.00  0.45           H  
ATOM    203  HA  LYS A  62       4.082  -7.371  -8.854  1.00  0.50           H  
ATOM    204  HB2 LYS A  62       3.398  -4.808  -8.027  1.00  0.67           H  
ATOM    205  HB3 LYS A  62       2.146  -5.805  -7.287  1.00  0.62           H  
ATOM    206  HG2 LYS A  62       4.290  -7.333  -6.720  1.00  1.14           H  
ATOM    207  HG3 LYS A  62       5.077  -5.755  -6.774  1.00  1.27           H  
ATOM    208  HD2 LYS A  62       3.494  -4.869  -5.138  1.00  1.71           H  
ATOM    209  HD3 LYS A  62       2.612  -6.396  -5.130  1.00  1.86           H  
ATOM    210  HE2 LYS A  62       4.248  -7.493  -3.903  1.00  2.39           H  
ATOM    211  HE3 LYS A  62       5.551  -6.461  -4.529  1.00  2.19           H  
ATOM    212  HZ1 LYS A  62       3.360  -5.448  -2.802  1.00  2.62           H  
ATOM    213  HZ2 LYS A  62       4.858  -5.965  -2.187  1.00  2.42           H  
ATOM    214  HZ3 LYS A  62       4.783  -4.639  -3.247  1.00  2.78           H  
ATOM    215  N   ASP A  63       2.118  -8.939  -8.919  1.00  0.51           N  
ATOM    216  CA  ASP A  63       0.942  -9.862  -8.965  1.00  0.52           C  
ATOM    217  C   ASP A  63       0.179  -9.815  -7.637  1.00  0.58           C  
ATOM    218  O   ASP A  63       0.721 -10.120  -6.591  1.00  0.81           O  
ATOM    219  CB  ASP A  63       1.529 -11.260  -9.204  1.00  0.63           C  
ATOM    220  CG  ASP A  63       2.511 -11.617  -8.082  1.00  1.55           C  
ATOM    221  OD1 ASP A  63       3.544 -10.973  -7.999  1.00  2.35           O  
ATOM    222  OD2 ASP A  63       2.211 -12.528  -7.328  1.00  2.24           O  
ATOM    223  H   ASP A  63       3.026  -9.305  -8.870  1.00  0.61           H  
ATOM    224  HA  ASP A  63       0.289  -9.596  -9.781  1.00  0.46           H  
ATOM    225  HB2 ASP A  63       0.729 -11.985  -9.226  1.00  1.20           H  
ATOM    226  HB3 ASP A  63       2.049 -11.272 -10.150  1.00  1.24           H  
ATOM    227  N   GLN A  64      -1.073  -9.435  -7.674  1.00  0.55           N  
ATOM    228  CA  GLN A  64      -1.878  -9.365  -6.419  1.00  0.63           C  
ATOM    229  C   GLN A  64      -3.087 -10.300  -6.514  1.00  0.64           C  
ATOM    230  O   GLN A  64      -3.262 -11.004  -7.491  1.00  0.66           O  
ATOM    231  CB  GLN A  64      -2.333  -7.908  -6.321  1.00  0.65           C  
ATOM    232  CG  GLN A  64      -1.193  -7.053  -5.767  1.00  0.74           C  
ATOM    233  CD  GLN A  64      -1.224  -7.089  -4.237  1.00  1.14           C  
ATOM    234  OE1 GLN A  64      -1.565  -8.095  -3.648  1.00  1.89           O  
ATOM    235  NE2 GLN A  64      -0.879  -6.025  -3.565  1.00  1.62           N  
ATOM    236  H   GLN A  64      -1.484  -9.195  -8.531  1.00  0.62           H  
ATOM    237  HA  GLN A  64      -1.271  -9.619  -5.566  1.00  0.73           H  
ATOM    238  HB2 GLN A  64      -2.609  -7.550  -7.303  1.00  0.60           H  
ATOM    239  HB3 GLN A  64      -3.185  -7.840  -5.661  1.00  0.73           H  
ATOM    240  HG2 GLN A  64      -0.248  -7.442  -6.117  1.00  1.00           H  
ATOM    241  HG3 GLN A  64      -1.310  -6.034  -6.103  1.00  0.94           H  
ATOM    242 HE21 GLN A  64      -0.604  -5.213  -4.039  1.00  2.06           H  
ATOM    243 HE22 GLN A  64      -0.896  -6.038  -2.584  1.00  2.00           H  
ATOM    244  N   LEU A  65      -3.920 -10.310  -5.504  1.00  0.71           N  
ATOM    245  CA  LEU A  65      -5.124 -11.199  -5.527  1.00  0.78           C  
ATOM    246  C   LEU A  65      -6.033 -10.825  -6.702  1.00  0.75           C  
ATOM    247  O   LEU A  65      -6.168  -9.668  -7.044  1.00  1.27           O  
ATOM    248  CB  LEU A  65      -5.838 -10.949  -4.197  1.00  0.93           C  
ATOM    249  CG  LEU A  65      -6.435 -12.260  -3.684  1.00  1.12           C  
ATOM    250  CD1 LEU A  65      -5.312 -13.174  -3.188  1.00  1.80           C  
ATOM    251  CD2 LEU A  65      -7.397 -11.965  -2.531  1.00  1.62           C  
ATOM    252  H   LEU A  65      -3.754  -9.731  -4.730  1.00  0.76           H  
ATOM    253  HA  LEU A  65      -4.825 -12.234  -5.597  1.00  0.86           H  
ATOM    254  HB2 LEU A  65      -5.130 -10.567  -3.475  1.00  1.07           H  
ATOM    255  HB3 LEU A  65      -6.629 -10.228  -4.342  1.00  1.12           H  
ATOM    256  HG  LEU A  65      -6.970 -12.750  -4.485  1.00  1.82           H  
ATOM    257 HD11 LEU A  65      -4.400 -12.940  -3.716  1.00  2.24           H  
ATOM    258 HD12 LEU A  65      -5.165 -13.021  -2.130  1.00  2.29           H  
ATOM    259 HD13 LEU A  65      -5.580 -14.204  -3.370  1.00  2.33           H  
ATOM    260 HD21 LEU A  65      -7.883 -11.015  -2.701  1.00  1.98           H  
ATOM    261 HD22 LEU A  65      -8.141 -12.744  -2.473  1.00  2.19           H  
ATOM    262 HD23 LEU A  65      -6.845 -11.924  -1.603  1.00  2.12           H  
ATOM    263  N   GLN A  66      -6.657 -11.803  -7.315  1.00  0.80           N  
ATOM    264  CA  GLN A  66      -7.568 -11.535  -8.477  1.00  0.80           C  
ATOM    265  C   GLN A  66      -6.821 -10.782  -9.594  1.00  0.65           C  
ATOM    266  O   GLN A  66      -6.309 -11.392 -10.514  1.00  0.71           O  
ATOM    267  CB  GLN A  66      -8.730 -10.700  -7.918  1.00  0.90           C  
ATOM    268  CG  GLN A  66      -9.820 -11.634  -7.387  1.00  1.08           C  
ATOM    269  CD  GLN A  66     -11.028 -10.808  -6.943  1.00  1.54           C  
ATOM    270  OE1 GLN A  66     -11.276  -9.741  -7.469  1.00  2.21           O  
ATOM    271  NE2 GLN A  66     -11.797 -11.260  -5.989  1.00  2.16           N  
ATOM    272  H   GLN A  66      -6.525 -12.725  -7.009  1.00  1.25           H  
ATOM    273  HA  GLN A  66      -7.950 -12.468  -8.862  1.00  0.94           H  
ATOM    274  HB2 GLN A  66      -8.370 -10.073  -7.114  1.00  0.92           H  
ATOM    275  HB3 GLN A  66      -9.139 -10.082  -8.702  1.00  1.05           H  
ATOM    276  HG2 GLN A  66     -10.117 -12.318  -8.168  1.00  1.41           H  
ATOM    277  HG3 GLN A  66      -9.438 -12.191  -6.545  1.00  1.55           H  
ATOM    278 HE21 GLN A  66     -11.596 -12.120  -5.565  1.00  2.45           H  
ATOM    279 HE22 GLN A  66     -12.573 -10.738  -5.697  1.00  2.73           H  
ATOM    280  N   SER A  67      -6.753  -9.472  -9.525  1.00  0.57           N  
ATOM    281  CA  SER A  67      -6.040  -8.698 -10.583  1.00  0.49           C  
ATOM    282  C   SER A  67      -4.604  -8.396 -10.140  1.00  0.41           C  
ATOM    283  O   SER A  67      -4.052  -9.077  -9.295  1.00  0.45           O  
ATOM    284  CB  SER A  67      -6.839  -7.404 -10.733  1.00  0.58           C  
ATOM    285  OG  SER A  67      -8.226  -7.714 -10.789  1.00  1.44           O  
ATOM    286  H   SER A  67      -7.170  -8.999  -8.775  1.00  0.67           H  
ATOM    287  HA  SER A  67      -6.040  -9.242 -11.514  1.00  0.52           H  
ATOM    288  HB2 SER A  67      -6.654  -6.764  -9.887  1.00  1.21           H  
ATOM    289  HB3 SER A  67      -6.537  -6.897 -11.639  1.00  1.17           H  
ATOM    290  HG  SER A  67      -8.665  -7.019 -11.286  1.00  1.68           H  
ATOM    291  N   TYR A  68      -3.999  -7.381 -10.703  1.00  0.38           N  
ATOM    292  CA  TYR A  68      -2.599  -7.027 -10.318  1.00  0.34           C  
ATOM    293  C   TYR A  68      -2.507  -5.543  -9.964  1.00  0.42           C  
ATOM    294  O   TYR A  68      -3.510  -4.867  -9.828  1.00  0.50           O  
ATOM    295  CB  TYR A  68      -1.744  -7.353 -11.551  1.00  0.30           C  
ATOM    296  CG  TYR A  68      -2.214  -6.546 -12.743  1.00  0.38           C  
ATOM    297  CD1 TYR A  68      -3.253  -7.028 -13.547  1.00  1.34           C  
ATOM    298  CD2 TYR A  68      -1.609  -5.320 -13.040  1.00  1.18           C  
ATOM    299  CE1 TYR A  68      -3.687  -6.282 -14.650  1.00  1.40           C  
ATOM    300  CE2 TYR A  68      -2.043  -4.574 -14.142  1.00  1.21           C  
ATOM    301  CZ  TYR A  68      -3.082  -5.055 -14.948  1.00  0.61           C  
ATOM    302  OH  TYR A  68      -3.510  -4.320 -16.035  1.00  0.75           O  
ATOM    303  H   TYR A  68      -4.468  -6.849 -11.379  1.00  0.45           H  
ATOM    304  HA  TYR A  68      -2.278  -7.624  -9.480  1.00  0.36           H  
ATOM    305  HB2 TYR A  68      -0.711  -7.113 -11.342  1.00  0.30           H  
ATOM    306  HB3 TYR A  68      -1.828  -8.406 -11.776  1.00  0.31           H  
ATOM    307  HD1 TYR A  68      -3.721  -7.973 -13.319  1.00  2.21           H  
ATOM    308  HD2 TYR A  68      -0.806  -4.949 -12.419  1.00  2.06           H  
ATOM    309  HE1 TYR A  68      -4.489  -6.653 -15.271  1.00  2.30           H  
ATOM    310  HE2 TYR A  68      -1.576  -3.628 -14.372  1.00  2.07           H  
ATOM    311  HH  TYR A  68      -4.377  -3.964 -15.829  1.00  1.14           H  
ATOM    312  N   ILE A  69      -1.312  -5.037  -9.801  1.00  0.42           N  
ATOM    313  CA  ILE A  69      -1.153  -3.598  -9.440  1.00  0.52           C  
ATOM    314  C   ILE A  69       0.141  -3.028 -10.035  1.00  0.51           C  
ATOM    315  O   ILE A  69       1.184  -3.653  -9.990  1.00  0.49           O  
ATOM    316  CB  ILE A  69      -1.115  -3.596  -7.909  1.00  0.62           C  
ATOM    317  CG1 ILE A  69      -1.030  -2.157  -7.395  1.00  0.73           C  
ATOM    318  CG2 ILE A  69       0.096  -4.393  -7.410  1.00  0.60           C  
ATOM    319  CD1 ILE A  69      -1.869  -2.023  -6.123  1.00  0.85           C  
ATOM    320  H   ILE A  69      -0.520  -5.607  -9.906  1.00  0.37           H  
ATOM    321  HA  ILE A  69      -2.004  -3.032  -9.784  1.00  0.57           H  
ATOM    322  HB  ILE A  69      -2.018  -4.058  -7.534  1.00  0.63           H  
ATOM    323 HG12 ILE A  69       0.000  -1.913  -7.176  1.00  0.75           H  
ATOM    324 HG13 ILE A  69      -1.409  -1.481  -8.147  1.00  0.74           H  
ATOM    325 HG21 ILE A  69       0.061  -5.393  -7.816  1.00  1.23           H  
ATOM    326 HG22 ILE A  69       1.004  -3.905  -7.731  1.00  1.17           H  
ATOM    327 HG23 ILE A  69       0.074  -4.441  -6.330  1.00  1.15           H  
ATOM    328 HD11 ILE A  69      -2.008  -2.999  -5.677  1.00  1.38           H  
ATOM    329 HD12 ILE A  69      -1.362  -1.376  -5.423  1.00  1.14           H  
ATOM    330 HD13 ILE A  69      -2.832  -1.602  -6.371  1.00  1.43           H  
ATOM    331  N   CYS A  70       0.073  -1.843 -10.590  1.00  0.59           N  
ATOM    332  CA  CYS A  70       1.291  -1.219 -11.189  1.00  0.60           C  
ATOM    333  C   CYS A  70       1.855  -0.154 -10.246  1.00  0.60           C  
ATOM    334  O   CYS A  70       1.245   0.875 -10.024  1.00  0.68           O  
ATOM    335  CB  CYS A  70       0.809  -0.571 -12.489  1.00  0.62           C  
ATOM    336  SG  CYS A  70       0.591  -1.840 -13.763  1.00  0.70           S  
ATOM    337  H   CYS A  70      -0.780  -1.364 -10.611  1.00  0.68           H  
ATOM    338  HA  CYS A  70       2.034  -1.969 -11.403  1.00  0.63           H  
ATOM    339  HB2 CYS A  70      -0.134  -0.074 -12.314  1.00  0.63           H  
ATOM    340  HB3 CYS A  70       1.539   0.152 -12.823  1.00  0.62           H  
ATOM    341  N   PHE A  71       3.018  -0.393  -9.694  1.00  0.57           N  
ATOM    342  CA  PHE A  71       3.631   0.605  -8.767  1.00  0.62           C  
ATOM    343  C   PHE A  71       4.500   1.582  -9.562  1.00  0.69           C  
ATOM    344  O   PHE A  71       5.499   1.204 -10.143  1.00  0.74           O  
ATOM    345  CB  PHE A  71       4.487  -0.219  -7.804  1.00  0.69           C  
ATOM    346  CG  PHE A  71       3.606  -0.826  -6.740  1.00  0.58           C  
ATOM    347  CD1 PHE A  71       3.209  -0.058  -5.638  1.00  1.33           C  
ATOM    348  CD2 PHE A  71       3.185  -2.156  -6.852  1.00  1.24           C  
ATOM    349  CE1 PHE A  71       2.392  -0.620  -4.649  1.00  1.33           C  
ATOM    350  CE2 PHE A  71       2.369  -2.719  -5.865  1.00  1.24           C  
ATOM    351  CZ  PHE A  71       1.972  -1.951  -4.763  1.00  0.58           C  
ATOM    352  H   PHE A  71       3.490  -1.228  -9.892  1.00  0.58           H  
ATOM    353  HA  PHE A  71       2.866   1.135  -8.222  1.00  0.61           H  
ATOM    354  HB2 PHE A  71       4.985  -1.006  -8.351  1.00  0.77           H  
ATOM    355  HB3 PHE A  71       5.223   0.420  -7.341  1.00  0.82           H  
ATOM    356  HD1 PHE A  71       3.533   0.969  -5.550  1.00  2.18           H  
ATOM    357  HD2 PHE A  71       3.492  -2.749  -7.702  1.00  2.08           H  
ATOM    358  HE1 PHE A  71       2.086  -0.028  -3.801  1.00  2.18           H  
ATOM    359  HE2 PHE A  71       2.045  -3.745  -5.952  1.00  2.09           H  
ATOM    360  HZ  PHE A  71       1.342  -2.385  -4.002  1.00  0.65           H  
ATOM    361  N   CYS A  72       4.120   2.835  -9.598  1.00  0.74           N  
ATOM    362  CA  CYS A  72       4.916   3.840 -10.363  1.00  0.84           C  
ATOM    363  C   CYS A  72       5.276   5.033  -9.475  1.00  0.63           C  
ATOM    364  O   CYS A  72       5.100   4.999  -8.272  1.00  0.59           O  
ATOM    365  CB  CYS A  72       4.000   4.282 -11.504  1.00  0.92           C  
ATOM    366  SG  CYS A  72       3.660   2.872 -12.587  1.00  1.43           S  
ATOM    367  H   CYS A  72       3.307   3.112  -9.127  1.00  0.76           H  
ATOM    368  HA  CYS A  72       5.809   3.387 -10.765  1.00  1.10           H  
ATOM    369  HB2 CYS A  72       3.072   4.654 -11.098  1.00  0.80           H  
ATOM    370  HB3 CYS A  72       4.483   5.064 -12.072  1.00  0.97           H  
ATOM    371  N   LEU A  73       5.777   6.085 -10.068  1.00  0.61           N  
ATOM    372  CA  LEU A  73       6.156   7.293  -9.278  1.00  0.63           C  
ATOM    373  C   LEU A  73       4.919   8.171  -9.027  1.00  0.50           C  
ATOM    374  O   LEU A  73       3.917   8.023  -9.700  1.00  0.36           O  
ATOM    375  CB  LEU A  73       7.173   8.030 -10.152  1.00  0.77           C  
ATOM    376  CG  LEU A  73       8.406   7.144 -10.360  1.00  0.89           C  
ATOM    377  CD1 LEU A  73       8.944   7.339 -11.779  1.00  1.02           C  
ATOM    378  CD2 LEU A  73       9.488   7.529  -9.348  1.00  1.15           C  
ATOM    379  H   LEU A  73       5.904   6.079 -11.040  1.00  0.69           H  
ATOM    380  HA  LEU A  73       6.611   7.005  -8.343  1.00  0.80           H  
ATOM    381  HB2 LEU A  73       6.725   8.256 -11.109  1.00  0.76           H  
ATOM    382  HB3 LEU A  73       7.467   8.948  -9.667  1.00  0.86           H  
ATOM    383  HG  LEU A  73       8.133   6.108 -10.220  1.00  0.97           H  
ATOM    384 HD11 LEU A  73       8.670   8.321 -12.137  1.00  1.47           H  
ATOM    385 HD12 LEU A  73      10.020   7.247 -11.771  1.00  1.47           H  
ATOM    386 HD13 LEU A  73       8.523   6.588 -12.430  1.00  1.51           H  
ATOM    387 HD21 LEU A  73       9.443   8.592  -9.159  1.00  1.41           H  
ATOM    388 HD22 LEU A  73       9.325   6.993  -8.425  1.00  1.59           H  
ATOM    389 HD23 LEU A  73      10.460   7.276  -9.746  1.00  1.76           H  
ATOM    390  N   PRO A  74       5.019   9.065  -8.066  1.00  0.76           N  
ATOM    391  CA  PRO A  74       3.874   9.958  -7.751  1.00  0.91           C  
ATOM    392  C   PRO A  74       3.603  10.931  -8.905  1.00  0.82           C  
ATOM    393  O   PRO A  74       2.543  11.522  -8.986  1.00  0.94           O  
ATOM    394  CB  PRO A  74       4.330  10.701  -6.496  1.00  1.26           C  
ATOM    395  CG  PRO A  74       5.821  10.647  -6.543  1.00  1.30           C  
ATOM    396  CD  PRO A  74       6.177   9.341  -7.199  1.00  1.06           C  
ATOM    397  HA  PRO A  74       2.992   9.378  -7.532  1.00  0.94           H  
ATOM    398  HB2 PRO A  74       3.985  11.726  -6.520  1.00  1.39           H  
ATOM    399  HB3 PRO A  74       3.970  10.202  -5.610  1.00  1.38           H  
ATOM    400  HG2 PRO A  74       6.203  11.475  -7.125  1.00  1.31           H  
ATOM    401  HG3 PRO A  74       6.226  10.676  -5.544  1.00  1.53           H  
ATOM    402  HD2 PRO A  74       7.081   9.445  -7.783  1.00  1.10           H  
ATOM    403  HD3 PRO A  74       6.285   8.561  -6.461  1.00  1.12           H  
ATOM    404  N   ALA A  75       4.547  11.097  -9.802  1.00  0.67           N  
ATOM    405  CA  ALA A  75       4.335  12.027 -10.951  1.00  0.60           C  
ATOM    406  C   ALA A  75       3.711  11.285 -12.143  1.00  0.50           C  
ATOM    407  O   ALA A  75       3.682  11.797 -13.247  1.00  0.59           O  
ATOM    408  CB  ALA A  75       5.732  12.535 -11.309  1.00  0.62           C  
ATOM    409  H   ALA A  75       5.393  10.610  -9.723  1.00  0.67           H  
ATOM    410  HA  ALA A  75       3.710  12.853 -10.655  1.00  0.65           H  
ATOM    411  HB1 ALA A  75       6.360  12.511 -10.431  1.00  1.26           H  
ATOM    412  HB2 ALA A  75       6.160  11.903 -12.074  1.00  1.17           H  
ATOM    413  HB3 ALA A  75       5.663  13.548 -11.676  1.00  1.16           H  
ATOM    414  N   PHE A  76       3.211  10.087 -11.936  1.00  0.43           N  
ATOM    415  CA  PHE A  76       2.591   9.326 -13.062  1.00  0.36           C  
ATOM    416  C   PHE A  76       1.149   8.946 -12.713  1.00  0.41           C  
ATOM    417  O   PHE A  76       0.793   8.826 -11.556  1.00  0.55           O  
ATOM    418  CB  PHE A  76       3.453   8.072 -13.217  1.00  0.32           C  
ATOM    419  CG  PHE A  76       4.701   8.412 -13.992  1.00  0.36           C  
ATOM    420  CD1 PHE A  76       5.740   9.113 -13.371  1.00  1.28           C  
ATOM    421  CD2 PHE A  76       4.819   8.029 -15.334  1.00  1.26           C  
ATOM    422  CE1 PHE A  76       6.899   9.430 -14.089  1.00  1.31           C  
ATOM    423  CE2 PHE A  76       5.978   8.345 -16.052  1.00  1.30           C  
ATOM    424  CZ  PHE A  76       7.017   9.046 -15.430  1.00  0.54           C  
ATOM    425  H   PHE A  76       3.240   9.688 -11.040  1.00  0.51           H  
ATOM    426  HA  PHE A  76       2.619   9.906 -13.970  1.00  0.37           H  
ATOM    427  HB2 PHE A  76       3.726   7.700 -12.241  1.00  0.35           H  
ATOM    428  HB3 PHE A  76       2.896   7.314 -13.748  1.00  0.30           H  
ATOM    429  HD1 PHE A  76       5.649   9.410 -12.336  1.00  2.18           H  
ATOM    430  HD2 PHE A  76       4.017   7.488 -15.813  1.00  2.15           H  
ATOM    431  HE1 PHE A  76       7.700   9.970 -13.609  1.00  2.20           H  
ATOM    432  HE2 PHE A  76       6.069   8.049 -17.087  1.00  2.20           H  
ATOM    433  HZ  PHE A  76       7.912   9.291 -15.985  1.00  0.63           H  
ATOM    434  N   GLU A  77       0.319   8.760 -13.708  1.00  0.37           N  
ATOM    435  CA  GLU A  77      -1.104   8.390 -13.444  1.00  0.46           C  
ATOM    436  C   GLU A  77      -1.621   7.451 -14.538  1.00  0.45           C  
ATOM    437  O   GLU A  77      -0.949   7.202 -15.522  1.00  0.38           O  
ATOM    438  CB  GLU A  77      -1.868   9.713 -13.470  1.00  0.55           C  
ATOM    439  CG  GLU A  77      -2.975   9.686 -12.413  1.00  1.22           C  
ATOM    440  CD  GLU A  77      -3.519  11.100 -12.205  1.00  1.85           C  
ATOM    441  OE1 GLU A  77      -4.035  11.662 -13.157  1.00  2.54           O  
ATOM    442  OE2 GLU A  77      -3.409  11.599 -11.097  1.00  2.30           O  
ATOM    443  H   GLU A  77       0.632   8.865 -14.630  1.00  0.33           H  
ATOM    444  HA  GLU A  77      -1.200   7.928 -12.474  1.00  0.53           H  
ATOM    445  HB2 GLU A  77      -1.188  10.526 -13.258  1.00  0.94           H  
ATOM    446  HB3 GLU A  77      -2.310   9.857 -14.444  1.00  0.85           H  
ATOM    447  HG2 GLU A  77      -3.773   9.037 -12.744  1.00  1.80           H  
ATOM    448  HG3 GLU A  77      -2.574   9.316 -11.482  1.00  1.71           H  
ATOM    449  N   GLY A  78      -2.810   6.929 -14.368  1.00  0.58           N  
ATOM    450  CA  GLY A  78      -3.382   6.004 -15.391  1.00  0.63           C  
ATOM    451  C   GLY A  78      -3.432   4.585 -14.825  1.00  0.69           C  
ATOM    452  O   GLY A  78      -2.668   4.231 -13.947  1.00  0.70           O  
ATOM    453  H   GLY A  78      -3.328   7.148 -13.566  1.00  0.67           H  
ATOM    454  HA2 GLY A  78      -4.381   6.327 -15.649  1.00  0.75           H  
ATOM    455  HA3 GLY A  78      -2.760   6.014 -16.274  1.00  0.55           H  
ATOM    456  N   ARG A  79      -4.327   3.769 -15.323  1.00  0.83           N  
ATOM    457  CA  ARG A  79      -4.432   2.364 -14.817  1.00  0.94           C  
ATOM    458  C   ARG A  79      -3.118   1.616 -15.062  1.00  0.78           C  
ATOM    459  O   ARG A  79      -2.645   0.883 -14.214  1.00  0.91           O  
ATOM    460  CB  ARG A  79      -5.568   1.728 -15.623  1.00  1.11           C  
ATOM    461  CG  ARG A  79      -6.365   0.781 -14.723  1.00  1.58           C  
ATOM    462  CD  ARG A  79      -7.390   1.582 -13.917  1.00  2.16           C  
ATOM    463  NE  ARG A  79      -8.588   0.691 -13.816  1.00  2.72           N  
ATOM    464  CZ  ARG A  79      -9.328   0.414 -14.871  1.00  3.45           C  
ATOM    465  NH1 ARG A  79      -9.181   1.061 -16.003  1.00  3.85           N  
ATOM    466  NH2 ARG A  79     -10.236  -0.522 -14.786  1.00  4.21           N  
ATOM    467  H   ARG A  79      -4.929   4.081 -16.031  1.00  0.91           H  
ATOM    468  HA  ARG A  79      -4.678   2.360 -13.767  1.00  1.06           H  
ATOM    469  HB2 ARG A  79      -6.220   2.503 -15.998  1.00  1.40           H  
ATOM    470  HB3 ARG A  79      -5.154   1.172 -16.451  1.00  1.46           H  
ATOM    471  HG2 ARG A  79      -6.875   0.050 -15.334  1.00  2.11           H  
ATOM    472  HG3 ARG A  79      -5.691   0.276 -14.046  1.00  1.89           H  
ATOM    473  HD2 ARG A  79      -7.001   1.804 -12.933  1.00  2.53           H  
ATOM    474  HD3 ARG A  79      -7.649   2.492 -14.435  1.00  2.58           H  
ATOM    475  HE  ARG A  79      -8.827   0.306 -12.948  1.00  2.94           H  
ATOM    476 HH11 ARG A  79      -8.498   1.786 -16.086  1.00  3.70           H  
ATOM    477 HH12 ARG A  79      -9.757   0.829 -16.787  1.00  4.57           H  
ATOM    478 HH21 ARG A  79     -10.362  -1.018 -13.927  1.00  4.39           H  
ATOM    479 HH22 ARG A  79     -10.803  -0.741 -15.579  1.00  4.82           H  
ATOM    480  N   ASN A  80      -2.529   1.803 -16.214  1.00  0.59           N  
ATOM    481  CA  ASN A  80      -1.242   1.113 -16.526  1.00  0.50           C  
ATOM    482  C   ASN A  80      -0.095   2.126 -16.534  1.00  0.41           C  
ATOM    483  O   ASN A  80       0.878   1.970 -17.246  1.00  0.44           O  
ATOM    484  CB  ASN A  80      -1.440   0.514 -17.919  1.00  0.54           C  
ATOM    485  CG  ASN A  80      -2.237  -0.787 -17.807  1.00  0.60           C  
ATOM    486  OD1 ASN A  80      -3.232  -0.963 -18.481  1.00  0.84           O  
ATOM    487  ND2 ASN A  80      -1.838  -1.713 -16.979  1.00  0.53           N  
ATOM    488  H   ASN A  80      -2.933   2.402 -16.877  1.00  0.60           H  
ATOM    489  HA  ASN A  80      -1.050   0.329 -15.810  1.00  0.56           H  
ATOM    490  HB2 ASN A  80      -1.979   1.216 -18.539  1.00  0.59           H  
ATOM    491  HB3 ASN A  80      -0.478   0.308 -18.362  1.00  0.57           H  
ATOM    492 HD21 ASN A  80      -1.034  -1.571 -16.436  1.00  0.52           H  
ATOM    493 HD22 ASN A  80      -2.341  -2.550 -16.901  1.00  0.59           H  
ATOM    494  N   CYS A  81      -0.209   3.169 -15.744  1.00  0.35           N  
ATOM    495  CA  CYS A  81       0.865   4.215 -15.689  1.00  0.30           C  
ATOM    496  C   CYS A  81       1.179   4.744 -17.094  1.00  0.35           C  
ATOM    497  O   CYS A  81       2.313   4.728 -17.534  1.00  0.46           O  
ATOM    498  CB  CYS A  81       2.089   3.518 -15.086  1.00  0.36           C  
ATOM    499  SG  CYS A  81       1.816   3.242 -13.319  1.00  0.44           S  
ATOM    500  H   CYS A  81      -1.006   3.266 -15.185  1.00  0.38           H  
ATOM    501  HA  CYS A  81       0.559   5.027 -15.048  1.00  0.28           H  
ATOM    502  HB2 CYS A  81       2.242   2.569 -15.578  1.00  0.49           H  
ATOM    503  HB3 CYS A  81       2.962   4.139 -15.224  1.00  0.43           H  
ATOM    504  N   GLU A  82       0.179   5.213 -17.796  1.00  0.42           N  
ATOM    505  CA  GLU A  82       0.406   5.748 -19.172  1.00  0.53           C  
ATOM    506  C   GLU A  82      -0.004   7.224 -19.246  1.00  0.62           C  
ATOM    507  O   GLU A  82      -0.355   7.724 -20.298  1.00  0.92           O  
ATOM    508  CB  GLU A  82      -0.476   4.892 -20.088  1.00  0.59           C  
ATOM    509  CG  GLU A  82      -1.943   4.997 -19.655  1.00  0.63           C  
ATOM    510  CD  GLU A  82      -2.839   4.375 -20.727  1.00  0.98           C  
ATOM    511  OE1 GLU A  82      -2.614   4.653 -21.893  1.00  1.61           O  
ATOM    512  OE2 GLU A  82      -3.735   3.630 -20.364  1.00  1.61           O  
ATOM    513  H   GLU A  82      -0.724   5.214 -17.415  1.00  0.48           H  
ATOM    514  HA  GLU A  82       1.442   5.633 -19.450  1.00  0.57           H  
ATOM    515  HB2 GLU A  82      -0.378   5.239 -21.106  1.00  0.69           H  
ATOM    516  HB3 GLU A  82      -0.160   3.861 -20.029  1.00  0.57           H  
ATOM    517  HG2 GLU A  82      -2.080   4.472 -18.721  1.00  0.88           H  
ATOM    518  HG3 GLU A  82      -2.207   6.036 -19.526  1.00  0.80           H  
ATOM    519  N   THR A  83       0.039   7.919 -18.136  1.00  0.49           N  
ATOM    520  CA  THR A  83      -0.345   9.363 -18.136  1.00  0.59           C  
ATOM    521  C   THR A  83       0.664  10.179 -17.324  1.00  0.52           C  
ATOM    522  O   THR A  83       0.492  10.391 -16.139  1.00  0.73           O  
ATOM    523  CB  THR A  83      -1.724   9.404 -17.475  1.00  0.68           C  
ATOM    524  OG1 THR A  83      -2.588   8.484 -18.128  1.00  1.01           O  
ATOM    525  CG2 THR A  83      -2.302  10.816 -17.583  1.00  0.81           C  
ATOM    526  H   THR A  83       0.326   7.493 -17.303  1.00  0.50           H  
ATOM    527  HA  THR A  83      -0.409   9.736 -19.146  1.00  0.71           H  
ATOM    528  HB  THR A  83      -1.633   9.136 -16.433  1.00  0.85           H  
ATOM    529  HG1 THR A  83      -3.286   8.245 -17.513  1.00  1.38           H  
ATOM    530 HG21 THR A  83      -1.496  11.535 -17.599  1.00  1.23           H  
ATOM    531 HG22 THR A  83      -2.877  10.900 -18.494  1.00  1.48           H  
ATOM    532 HG23 THR A  83      -2.942  11.009 -16.735  1.00  1.32           H  
ATOM    533  N   HIS A  84       1.715  10.635 -17.958  1.00  0.56           N  
ATOM    534  CA  HIS A  84       2.745  11.440 -17.229  1.00  0.58           C  
ATOM    535  C   HIS A  84       2.115  12.721 -16.671  1.00  0.66           C  
ATOM    536  O   HIS A  84       1.607  13.544 -17.409  1.00  0.99           O  
ATOM    537  CB  HIS A  84       3.809  11.780 -18.275  1.00  0.77           C  
ATOM    538  CG  HIS A  84       5.160  11.826 -17.618  1.00  0.79           C  
ATOM    539  ND1 HIS A  84       6.305  11.362 -18.249  1.00  1.37           N  
ATOM    540  CD2 HIS A  84       5.568  12.277 -16.387  1.00  1.11           C  
ATOM    541  CE1 HIS A  84       7.335  11.544 -17.403  1.00  1.75           C  
ATOM    542  NE2 HIS A  84       6.942  12.098 -16.253  1.00  1.66           N  
ATOM    543  H   HIS A  84       1.827  10.447 -18.913  1.00  0.78           H  
ATOM    544  HA  HIS A  84       3.182  10.859 -16.433  1.00  0.49           H  
ATOM    545  HB2 HIS A  84       3.808  11.024 -19.047  1.00  1.20           H  
ATOM    546  HB3 HIS A  84       3.589  12.742 -18.712  1.00  1.04           H  
ATOM    547  HD1 HIS A  84       6.354  10.974 -19.147  1.00  1.67           H  
ATOM    548  HD2 HIS A  84       4.920  12.705 -15.636  1.00  1.29           H  
ATOM    549  HE1 HIS A  84       8.357  11.274 -17.626  1.00  2.28           H  
ATOM    550  N   LYS A  85       2.148  12.890 -15.373  1.00  0.58           N  
ATOM    551  CA  LYS A  85       1.554  14.115 -14.757  1.00  0.70           C  
ATOM    552  C   LYS A  85       2.557  15.269 -14.802  1.00  0.88           C  
ATOM    553  O   LYS A  85       3.227  15.558 -13.828  1.00  1.58           O  
ATOM    554  CB  LYS A  85       1.251  13.723 -13.310  1.00  0.85           C  
ATOM    555  CG  LYS A  85       0.225  12.589 -13.292  1.00  1.12           C  
ATOM    556  CD  LYS A  85      -1.185  13.172 -13.415  1.00  1.83           C  
ATOM    557  CE  LYS A  85      -1.601  13.786 -12.077  1.00  2.57           C  
ATOM    558  NZ  LYS A  85      -2.943  14.381 -12.329  1.00  3.28           N  
ATOM    559  H   LYS A  85       2.564  12.210 -14.803  1.00  0.68           H  
ATOM    560  HA  LYS A  85       0.641  14.387 -15.264  1.00  0.85           H  
ATOM    561  HB2 LYS A  85       2.160  13.395 -12.828  1.00  0.97           H  
ATOM    562  HB3 LYS A  85       0.851  14.575 -12.783  1.00  0.93           H  
ATOM    563  HG2 LYS A  85       0.412  11.921 -14.121  1.00  1.09           H  
ATOM    564  HG3 LYS A  85       0.307  12.043 -12.364  1.00  1.45           H  
ATOM    565  HD2 LYS A  85      -1.193  13.935 -14.181  1.00  2.22           H  
ATOM    566  HD3 LYS A  85      -1.878  12.387 -13.680  1.00  2.31           H  
ATOM    567  HE2 LYS A  85      -1.663  13.020 -11.316  1.00  2.92           H  
ATOM    568  HE3 LYS A  85      -0.905  14.556 -11.782  1.00  2.93           H  
ATOM    569  HZ1 LYS A  85      -3.553  13.676 -12.793  1.00  3.58           H  
ATOM    570  HZ2 LYS A  85      -3.371  14.669 -11.426  1.00  3.70           H  
ATOM    571  HZ3 LYS A  85      -2.844  15.213 -12.943  1.00  3.61           H  
ATOM    572  N   ASP A  86       2.664  15.930 -15.928  1.00  1.30           N  
ATOM    573  CA  ASP A  86       3.622  17.068 -16.046  1.00  1.52           C  
ATOM    574  C   ASP A  86       2.881  18.401 -15.901  1.00  1.84           C  
ATOM    575  O   ASP A  86       2.380  18.949 -16.864  1.00  2.26           O  
ATOM    576  CB  ASP A  86       4.221  16.938 -17.447  1.00  2.09           C  
ATOM    577  CG  ASP A  86       5.696  17.342 -17.412  1.00  2.73           C  
ATOM    578  OD1 ASP A  86       6.499  16.540 -16.965  1.00  3.39           O  
ATOM    579  OD2 ASP A  86       5.998  18.446 -17.836  1.00  3.15           O  
ATOM    580  H   ASP A  86       2.112  15.675 -16.696  1.00  1.91           H  
ATOM    581  HA  ASP A  86       4.400  16.986 -15.304  1.00  1.71           H  
ATOM    582  HB2 ASP A  86       4.134  15.914 -17.781  1.00  2.54           H  
ATOM    583  HB3 ASP A  86       3.689  17.585 -18.128  1.00  2.42           H  
ATOM    584  N   ASP A  87       2.811  18.921 -14.702  1.00  2.27           N  
ATOM    585  CA  ASP A  87       2.105  20.219 -14.483  1.00  3.07           C  
ATOM    586  C   ASP A  87       3.075  21.261 -13.920  1.00  3.79           C  
ATOM    587  O   ASP A  87       3.343  22.271 -14.544  1.00  4.30           O  
ATOM    588  CB  ASP A  87       1.007  19.905 -13.466  1.00  3.50           C  
ATOM    589  CG  ASP A  87      -0.155  19.200 -14.170  1.00  4.09           C  
ATOM    590  OD1 ASP A  87       0.087  18.178 -14.790  1.00  4.64           O  
ATOM    591  OD2 ASP A  87      -1.266  19.695 -14.077  1.00  4.39           O  
ATOM    592  H   ASP A  87       3.225  18.458 -13.944  1.00  2.38           H  
ATOM    593  HA  ASP A  87       1.666  20.569 -15.402  1.00  3.38           H  
ATOM    594  HB2 ASP A  87       1.404  19.261 -12.694  1.00  3.67           H  
ATOM    595  HB3 ASP A  87       0.652  20.823 -13.023  1.00  3.84           H  
ATOM    596  N   GLY A  88       3.601  21.021 -12.746  1.00  4.36           N  
ATOM    597  CA  GLY A  88       4.555  21.991 -12.133  1.00  5.43           C  
ATOM    598  C   GLY A  88       3.809  23.269 -11.748  1.00  6.08           C  
ATOM    599  O   GLY A  88       3.500  23.494 -10.593  1.00  6.25           O  
ATOM    600  H   GLY A  88       3.366  20.199 -12.266  1.00  4.35           H  
ATOM    601  HA2 GLY A  88       4.998  21.551 -11.251  1.00  5.71           H  
ATOM    602  HA3 GLY A  88       5.331  22.232 -12.844  1.00  5.81           H  
ATOM    603  N   SER A  89       3.517  24.108 -12.710  1.00  6.79           N  
ATOM    604  CA  SER A  89       2.789  25.377 -12.412  1.00  7.73           C  
ATOM    605  C   SER A  89       1.279  25.126 -12.379  1.00  8.27           C  
ATOM    606  O   SER A  89       0.544  25.801 -11.685  1.00  8.47           O  
ATOM    607  CB  SER A  89       3.152  26.321 -13.557  1.00  8.23           C  
ATOM    608  OG  SER A  89       4.543  26.215 -13.831  1.00  8.70           O  
ATOM    609  H   SER A  89       3.778  23.901 -13.633  1.00  6.88           H  
ATOM    610  HA  SER A  89       3.123  25.791 -11.473  1.00  7.96           H  
ATOM    611  HB2 SER A  89       2.595  26.050 -14.439  1.00  8.44           H  
ATOM    612  HB3 SER A  89       2.905  27.337 -13.277  1.00  8.32           H  
ATOM    613  HG  SER A  89       4.669  25.494 -14.452  1.00  9.06           H  
ATOM    614  N   ALA A  90       0.811  24.155 -13.130  1.00  8.78           N  
ATOM    615  CA  ALA A  90      -0.656  23.841 -13.158  1.00  9.60           C  
ATOM    616  C   ALA A  90      -1.476  25.100 -13.465  1.00  9.96           C  
ATOM    617  O   ALA A  90      -0.985  25.937 -14.205  1.00 10.10           O  
ATOM    618  CB  ALA A  90      -0.987  23.313 -11.759  1.00 10.11           C  
ATOM    619  OXT ALA A  90      -2.580  25.204 -12.955  1.00 10.31           O  
ATOM    620  H   ALA A  90       1.429  23.628 -13.678  1.00  8.78           H  
ATOM    621  HA  ALA A  90      -0.858  23.078 -13.893  1.00  9.81           H  
ATOM    622  HB1 ALA A  90      -0.125  22.807 -11.351  1.00 10.30           H  
ATOM    623  HB2 ALA A  90      -1.257  24.139 -11.116  1.00 10.14           H  
ATOM    624  HB3 ALA A  90      -1.814  22.622 -11.822  1.00 10.48           H  
TER     625      ALA A  90                                                      
HETATM  626  C1  FUC A  91       9.068  -0.594  -8.927  1.00  0.56           C  
HETATM  627  C2  FUC A  91      10.492  -0.101  -9.196  1.00  0.61           C  
HETATM  628  C3  FUC A  91      10.418   1.173 -10.040  1.00  0.53           C  
HETATM  629  C4  FUC A  91       9.613   2.224  -9.273  1.00  0.54           C  
HETATM  630  C5  FUC A  91       8.210   1.666  -9.007  1.00  0.52           C  
HETATM  631  C6  FUC A  91       7.332   2.615  -8.214  1.00  0.69           C  
HETATM  632  O2  FUC A  91      11.231  -1.102  -9.882  1.00  0.75           O  
HETATM  633  O3  FUC A  91      11.727   1.656 -10.306  1.00  0.61           O  
HETATM  634  O4  FUC A  91      10.260   2.531  -8.047  1.00  0.66           O  
HETATM  635  O5  FUC A  91       8.317   0.427  -8.251  1.00  0.55           O  
HETATM  636  H1  FUC A  91       9.092  -1.473  -8.261  1.00  0.68           H  
HETATM  637  H2  FUC A  91      10.975   0.134  -8.237  1.00  0.70           H  
HETATM  638  H3  FUC A  91       9.901   0.946 -10.983  1.00  0.53           H  
HETATM  639  H4  FUC A  91       9.525   3.128  -9.891  1.00  0.59           H  
HETATM  640  H5  FUC A  91       7.723   1.434  -9.964  1.00  0.47           H  
HETATM  641  H61 FUC A  91       7.825   2.879  -7.269  1.00  1.09           H  
HETATM  642  H62 FUC A  91       6.367   2.137  -7.995  1.00  1.32           H  
HETATM  643  H63 FUC A  91       7.155   3.532  -8.794  1.00  1.31           H  
HETATM  644  HO2 FUC A  91      10.761  -1.354 -10.679  1.00  1.24           H  
HETATM  645  HO3 FUC A  91      11.670   2.476 -10.802  1.00  0.97           H  
HETATM  646  HO4 FUC A  91      10.089   3.448  -7.818  1.00  1.16           H  
CONECT   67  188                                                                
CONECT  123  336                                                                
CONECT  178  626                                                                
CONECT  188   67                                                                
CONECT  336  123                                                                
CONECT  366  499                                                                
CONECT  499  366                                                                
CONECT  626  178  627  635  636                                                 
CONECT  627  626  628  632  637                                                 
CONECT  628  627  629  633  638                                                 
CONECT  629  628  630  634  639                                                 
CONECT  630  629  631  635  640                                                 
CONECT  631  630  641  642  643                                                 
CONECT  632  627  644                                                           
CONECT  633  628  645                                                           
CONECT  634  629  646                                                           
CONECT  635  626  630                                                           
CONECT  636  626                                                                
CONECT  637  627                                                                
CONECT  638  628                                                                
CONECT  639  629                                                                
CONECT  640  630                                                                
CONECT  641  631                                                                
CONECT  642  631                                                                
CONECT  643  631                                                                
CONECT  644  632                                                                
CONECT  645  633                                                                
CONECT  646  634                                                                
MASTER       89    0    1    0    4    0    0    6  346    1   28    4          
END