HEADER    ELECTRON TRANSPORT                      10-JAN-98   1A2S              
TITLE     THE SOLUTION NMR STRUCTURE OF OXIDIZED CYTOCHROME C6 FROM             
TITLE    2 THE GREEN ALGA MONORAPHIDIUM BRAUNII, MINIMIZED AVERAGE              
TITLE    3 STRUCTURE                                                            
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: CYTOCHROME C6;                                             
COMPND   3 CHAIN: A;                                                            
COMPND   4 SYNONYM: CYTOCHROME C552;                                            
COMPND   5 OTHER_DETAILS: OXIDIZED FORM                                         
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: MONORAPHIDIUM BRAUNII;                          
SOURCE   3 ORGANISM_TAXID: 34112                                                
KEYWDS    CYTOCHROME C6, PHOTOSYSTEM I, ELECTRON TRANSPORT,                     
KEYWDS   2 PARAMAGNETIC NMR, SOLUTION STRUCTURE, HEME PROTEIN                   
EXPDTA    SOLUTION NMR                                                          
AUTHOR    L.BANCI,I.BERTINI,M.A.DE LA ROSA,D.KOULOUGLIOTIS,                     
AUTHOR   2 J.A.NAVARRO,O.WALTER                                                 
REVDAT   2   24-FEB-09 1A2S    1       VERSN                                    
REVDAT   1   29-APR-98 1A2S    0                                                
JRNL        AUTH   L.BANCI,I.BERTINI,M.A.DE LA ROSA,D.KOULOUGLIOTIS,            
JRNL        AUTH 2 J.A.NAVARRO,O.WALTER                                         
JRNL        TITL   SOLUTION STRUCTURE OF OXIDIZED CYTOCHROME C6 FROM            
JRNL        TITL 2 THE GREEN ALGA MONORAPHIDIUM BRAUNII.                        
JRNL        REF    BIOCHEMISTRY                  V.  37  4831 1998              
JRNL        REFN                   ISSN 0006-2960                               
JRNL        PMID   9538000                                                      
JRNL        DOI    10.1021/BI972765Y                                            
REMARK   1                                                                      
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : AMBER                                                
REMARK   3   AUTHORS     : PEARLMAN,CASE,CALDWELL,ROSS,CHEATHAM, FERGUSON,      
REMARK   3                 SEIBEL,SINGH,WEINER,KOLLMAN                          
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 1A2S COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL.                                
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 300                                
REMARK 210  PH                             : 5.0                                
REMARK 210  IONIC STRENGTH                 : NULL                               
REMARK 210  PRESSURE                       : NULL                               
REMARK 210  SAMPLE CONTENTS                : NULL                               
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : NOESY, TOCSY, COSY, 1D NOE         
REMARK 210  SPECTROMETER FIELD STRENGTH    : 500 MHZ, 600 MHZ, 800 MHZ          
REMARK 210  SPECTROMETER MODEL             : DRX 500, AMX 600, AVANCE 800       
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : DYANA, PSEUDYANA, AMBER            
REMARK 210   METHOD USED                   : TORSION ANGLE DYNAMICS             
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 40                                 
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 1                                  
REMARK 210 CONFORMERS, SELECTION CRITERIA  : MINIMIZED AVERAGE STRUCTURE        
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL                
REMARK 210                                                                      
REMARK 210 REMARK: NULL                                                         
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    ALA A   2      152.86    123.98                                   
REMARK 500    ALA A  20      122.08    -39.39                                   
REMARK 500    ASN A  25      -55.82   -120.08                                   
REMARK 500    ASP A  29      -45.97   -160.50                                   
REMARK 500    HIS A  30       94.15    -66.87                                   
REMARK 500    THR A  31     -131.04    -87.24                                   
REMARK 500    LEU A  32       39.34   -145.00                                   
REMARK 500    PHE A  45       84.65    -63.66                                   
REMARK 500    GLN A  53      -50.85   -123.88                                   
REMARK 500    ASP A  69      165.69     47.60                                   
REMARK 500    ASP A  71      -72.88    -78.97                                   
REMARK 500    ASN A  87       17.24     82.97                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS                                         
REMARK 500                                                                      
REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH          
REMARK 500 CIS AND TRANS CONFORMATION.  CIS BONDS, IF ANY, ARE LISTED           
REMARK 500 ON CISPEP RECORDS.  TRANS IS DEFINED AS 180 +/- 30 AND               
REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES.                                  
REMARK 500                                 MODEL     OMEGA                      
REMARK 500 ARG A   67     LEU A   68                 -145.95                    
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: CHIRAL CENTERS                                             
REMARK 500                                                                      
REMARK 500 UNEXPECTED CONFIGURATION OF THE FOLLOWING CHIRAL                     
REMARK 500 CENTER(S) USING IMPROPER CA--C--CB--N CHIRALITY                      
REMARK 500 M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN                            
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE                   
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (11X,I3,1X,A3,1X,A1,I4,A1,6X,F5.1,6X,A1,10X,A1,3X,A16)       
REMARK 500                                                                      
REMARK 500   M RES CSSEQI    IMPROPER   EXPECTED   FOUND DETAILS                
REMARK 500     GLU A   1       121.0                     ALPHA-CARBON           
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 620                                                                      
REMARK 620 METAL COORDINATION                                                   
REMARK 620  (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;              
REMARK 620  SSEQ=SEQUENCE NUMBER; I=INSERTION CODE):                            
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                             HEC A  90  FE                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 HIS A  19   NE2                                                    
REMARK 620 2 MET A  61   SD  167.1                                              
REMARK 620 N                    1                                               
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: NUL                                                 
REMARK 800 EVIDENCE_CODE: UNKNOWN                                               
REMARK 800 SITE_DESCRIPTION: HEC SITE                                           
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HEC A 90                  
DBREF  1A2S A    1    89  UNP    Q09099   CYC6_MONBR       1     89             
SEQRES   1 A   89  GLU ALA ASP LEU ALA LEU GLY LYS ALA VAL PHE ASP GLY          
SEQRES   2 A   89  ASN CYS ALA ALA CYS HIS ALA GLY GLY GLY ASN ASN VAL          
SEQRES   3 A   89  ILE PRO ASP HIS THR LEU GLN LYS ALA ALA ILE GLU GLN          
SEQRES   4 A   89  PHE LEU ASP GLY GLY PHE ASN ILE GLU ALA ILE VAL TYR          
SEQRES   5 A   89  GLN ILE GLU ASN GLY LYS GLY ALA MET PRO ALA TRP ASP          
SEQRES   6 A   89  GLY ARG LEU ASP GLU ASP GLU ILE ALA GLY VAL ALA ALA          
SEQRES   7 A   89  TYR VAL TYR ASP GLN ALA ALA GLY ASN LYS TRP                  
HET    HEC  A  90      75                                                       
HETNAM     HEC HEME C                                                           
FORMUL   2  HEC    C34 H34 FE N4 O4                                             
HELIX    1   1 LEU A    4  ASN A   14  1                                  11    
HELIX    2   2 ALA A   16  HIS A   19  1                                   4    
HELIX    3   3 LYS A   34  PHE A   40  1                                   7    
HELIX    4   4 ILE A   47  ILE A   54  1                                   8    
HELIX    5   5 GLU A   72  GLY A   86  1                                  15    
LINK        FE   HEC A  90                 NE2 HIS A  19     1555   1555  1.98  
LINK         CAB HEC A  90                 SG  CYS A  15     1555   1555  1.82  
LINK         CAC HEC A  90                 SG  CYS A  18     1555   1555  1.83  
LINK        FE   HEC A  90                 SD  MET A  61     1555   1555  2.44  
SITE     1 NUL  1 HEC A  90                                                     
SITE     1 AC1 19 ASN A  14  CYS A  15  CYS A  18  HIS A  19                    
SITE     2 AC1 19 ASN A  24  ILE A  27  HIS A  30  THR A  31                    
SITE     3 AC1 19 LEU A  32  PHE A  40  LEU A  41  ILE A  50                    
SITE     4 AC1 19 GLN A  53  ILE A  54  LYS A  58  GLY A  59                    
SITE     5 AC1 19 ALA A  60  MET A  61  TRP A  64                               
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   GLU A   1       3.529  -3.067 -13.384  1.00  0.00           N  
ATOM      2  CA  GLU A   1       3.979  -1.890 -14.136  1.00  0.00           C  
ATOM      3  C   GLU A   1       3.946  -0.732 -13.150  1.00  0.00           C  
ATOM      4  O   GLU A   1       4.335  -0.984 -12.011  1.00  0.00           O  
ATOM      5  CB  GLU A   1       5.395  -2.126 -14.694  1.00  0.00           C  
ATOM      6  CG  GLU A   1       5.746  -1.192 -15.857  1.00  0.00           C  
ATOM      7  CD  GLU A   1       5.010  -1.597 -17.126  1.00  0.00           C  
ATOM      8  OE1 GLU A   1       3.800  -1.294 -17.186  1.00  0.00           O  
ATOM      9  OE2 GLU A   1       5.654  -2.247 -17.972  1.00  0.00           O  
ATOM     10  H1  GLU A   1       4.090  -3.082 -12.540  1.00  0.00           H  
ATOM     11  H2  GLU A   1       2.564  -2.933 -13.123  1.00  0.00           H  
ATOM     12  H3  GLU A   1       3.638  -3.908 -13.930  1.00  0.00           H  
ATOM     13  HA  GLU A   1       3.253  -1.727 -14.930  1.00  0.00           H  
ATOM     14  HB2 GLU A   1       6.131  -1.990 -13.899  1.00  0.00           H  
ATOM     15  HB3 GLU A   1       5.485  -3.145 -15.076  1.00  0.00           H  
ATOM     16  HG2 GLU A   1       5.511  -0.156 -15.612  1.00  0.00           H  
ATOM     17  HG3 GLU A   1       6.816  -1.265 -16.055  1.00  0.00           H  
ATOM     18  N   ALA A   2       3.414   0.428 -13.554  1.00  0.00           N  
ATOM     19  CA  ALA A   2       3.133   1.629 -12.760  1.00  0.00           C  
ATOM     20  C   ALA A   2       3.827   2.847 -13.357  1.00  0.00           C  
ATOM     21  O   ALA A   2       4.898   2.725 -13.948  1.00  0.00           O  
ATOM     22  CB  ALA A   2       3.563   1.524 -11.294  1.00  0.00           C  
ATOM     23  H   ALA A   2       3.178   0.498 -14.536  1.00  0.00           H  
ATOM     24  HA  ALA A   2       2.055   1.794 -12.788  1.00  0.00           H  
ATOM     25  HB1 ALA A   2       4.633   1.331 -11.229  1.00  0.00           H  
ATOM     26  HB2 ALA A   2       3.380   2.472 -10.791  1.00  0.00           H  
ATOM     27  HB3 ALA A   2       2.999   0.741 -10.791  1.00  0.00           H  
ATOM     28  N   ASP A   3       3.243   4.024 -13.113  1.00  0.00           N  
ATOM     29  CA  ASP A   3       3.940   5.295 -13.166  1.00  0.00           C  
ATOM     30  C   ASP A   3       3.592   6.041 -11.876  1.00  0.00           C  
ATOM     31  O   ASP A   3       2.413   6.202 -11.535  1.00  0.00           O  
ATOM     32  CB  ASP A   3       3.565   6.088 -14.420  1.00  0.00           C  
ATOM     33  CG  ASP A   3       4.463   7.309 -14.564  1.00  0.00           C  
ATOM     34  OD1 ASP A   3       4.606   8.035 -13.553  1.00  0.00           O  
ATOM     35  OD2 ASP A   3       5.002   7.490 -15.673  1.00  0.00           O  
ATOM     36  H   ASP A   3       2.356   4.043 -12.629  1.00  0.00           H  
ATOM     37  HA  ASP A   3       5.018   5.115 -13.198  1.00  0.00           H  
ATOM     38  HB2 ASP A   3       3.698   5.449 -15.294  1.00  0.00           H  
ATOM     39  HB3 ASP A   3       2.527   6.409 -14.372  1.00  0.00           H  
ATOM     40  N   LEU A   4       4.630   6.453 -11.143  1.00  0.00           N  
ATOM     41  CA  LEU A   4       4.536   7.211  -9.904  1.00  0.00           C  
ATOM     42  C   LEU A   4       3.572   8.388 -10.047  1.00  0.00           C  
ATOM     43  O   LEU A   4       2.829   8.679  -9.105  1.00  0.00           O  
ATOM     44  CB  LEU A   4       5.937   7.707  -9.509  1.00  0.00           C  
ATOM     45  CG  LEU A   4       6.716   6.758  -8.583  1.00  0.00           C  
ATOM     46  CD1 LEU A   4       6.260   6.954  -7.137  1.00  0.00           C  
ATOM     47  CD2 LEU A   4       6.614   5.275  -8.968  1.00  0.00           C  
ATOM     48  H   LEU A   4       5.546   6.333 -11.549  1.00  0.00           H  
ATOM     49  HA  LEU A   4       4.128   6.567  -9.125  1.00  0.00           H  
ATOM     50  HB2 LEU A   4       6.524   7.884 -10.412  1.00  0.00           H  
ATOM     51  HB3 LEU A   4       5.846   8.666  -8.997  1.00  0.00           H  
ATOM     52  HG  LEU A   4       7.768   7.043  -8.629  1.00  0.00           H  
ATOM     53 HD11 LEU A   4       6.410   7.990  -6.830  1.00  0.00           H  
ATOM     54 HD12 LEU A   4       5.204   6.705  -7.039  1.00  0.00           H  
ATOM     55 HD13 LEU A   4       6.860   6.312  -6.494  1.00  0.00           H  
ATOM     56 HD21 LEU A   4       6.897   5.140 -10.011  1.00  0.00           H  
ATOM     57 HD22 LEU A   4       7.294   4.694  -8.343  1.00  0.00           H  
ATOM     58 HD23 LEU A   4       5.604   4.895  -8.814  1.00  0.00           H  
ATOM     59  N   ALA A   5       3.582   9.048 -11.212  1.00  0.00           N  
ATOM     60  CA  ALA A   5       2.697  10.163 -11.507  1.00  0.00           C  
ATOM     61  C   ALA A   5       1.260   9.823 -11.123  1.00  0.00           C  
ATOM     62  O   ALA A   5       0.622  10.557 -10.368  1.00  0.00           O  
ATOM     63  CB  ALA A   5       2.786  10.500 -12.998  1.00  0.00           C  
ATOM     64  H   ALA A   5       4.153   8.691 -11.987  1.00  0.00           H  
ATOM     65  HA  ALA A   5       3.018  11.029 -10.929  1.00  0.00           H  
ATOM     66  HB1 ALA A   5       2.530   9.625 -13.597  1.00  0.00           H  
ATOM     67  HB2 ALA A   5       2.090  11.305 -13.237  1.00  0.00           H  
ATOM     68  HB3 ALA A   5       3.800  10.815 -13.246  1.00  0.00           H  
ATOM     69  N   LEU A   6       0.760   8.694 -11.630  1.00  0.00           N  
ATOM     70  CA  LEU A   6      -0.595   8.267 -11.343  1.00  0.00           C  
ATOM     71  C   LEU A   6      -0.650   7.756  -9.908  1.00  0.00           C  
ATOM     72  O   LEU A   6      -1.449   8.243  -9.111  1.00  0.00           O  
ATOM     73  CB  LEU A   6      -1.044   7.209 -12.362  1.00  0.00           C  
ATOM     74  CG  LEU A   6      -2.515   6.792 -12.192  1.00  0.00           C  
ATOM     75  CD1 LEU A   6      -3.486   7.946 -12.477  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -2.824   5.633 -13.148  1.00  0.00           C  
ATOM     77  H   LEU A   6       1.377   8.068 -12.136  1.00  0.00           H  
ATOM     78  HA  LEU A   6      -1.246   9.136 -11.433  1.00  0.00           H  
ATOM     79  HB2 LEU A   6      -0.907   7.607 -13.368  1.00  0.00           H  
ATOM     80  HB3 LEU A   6      -0.412   6.325 -12.256  1.00  0.00           H  
ATOM     81  HG  LEU A   6      -2.682   6.446 -11.172  1.00  0.00           H  
ATOM     82 HD11 LEU A   6      -3.282   8.378 -13.457  1.00  0.00           H  
ATOM     83 HD12 LEU A   6      -4.511   7.573 -12.463  1.00  0.00           H  
ATOM     84 HD13 LEU A   6      -3.403   8.718 -11.713  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -2.642   5.937 -14.179  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -2.193   4.776 -12.909  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -3.869   5.336 -13.047  1.00  0.00           H  
ATOM     88  N   GLY A   7       0.217   6.794  -9.570  1.00  0.00           N  
ATOM     89  CA  GLY A   7       0.168   6.081  -8.298  1.00  0.00           C  
ATOM     90  C   GLY A   7       0.014   7.020  -7.101  1.00  0.00           C  
ATOM     91  O   GLY A   7      -0.826   6.801  -6.222  1.00  0.00           O  
ATOM     92  H   GLY A   7       0.930   6.529 -10.246  1.00  0.00           H  
ATOM     93  HA2 GLY A   7      -0.670   5.383  -8.316  1.00  0.00           H  
ATOM     94  HA3 GLY A   7       1.092   5.517  -8.179  1.00  0.00           H  
ATOM     95  N   LYS A   8       0.816   8.087  -7.059  1.00  0.00           N  
ATOM     96  CA  LYS A   8       0.786   8.986  -5.925  1.00  0.00           C  
ATOM     97  C   LYS A   8      -0.511   9.797  -5.929  1.00  0.00           C  
ATOM     98  O   LYS A   8      -1.041  10.109  -4.862  1.00  0.00           O  
ATOM     99  CB  LYS A   8       2.085   9.807  -5.854  1.00  0.00           C  
ATOM    100  CG  LYS A   8       2.123  11.085  -6.707  1.00  0.00           C  
ATOM    101  CD  LYS A   8       2.075  12.359  -5.842  1.00  0.00           C  
ATOM    102  CE  LYS A   8       0.819  12.466  -4.956  1.00  0.00           C  
ATOM    103  NZ  LYS A   8       0.809  13.698  -4.143  1.00  0.00           N  
ATOM    104  H   LYS A   8       1.417   8.315  -7.846  1.00  0.00           H  
ATOM    105  HA  LYS A   8       0.772   8.371  -5.028  1.00  0.00           H  
ATOM    106  HB2 LYS A   8       2.283  10.061  -4.813  1.00  0.00           H  
ATOM    107  HB3 LYS A   8       2.904   9.157  -6.170  1.00  0.00           H  
ATOM    108  HG2 LYS A   8       3.073  11.090  -7.246  1.00  0.00           H  
ATOM    109  HG3 LYS A   8       1.341  11.091  -7.467  1.00  0.00           H  
ATOM    110  HD2 LYS A   8       2.967  12.371  -5.212  1.00  0.00           H  
ATOM    111  HD3 LYS A   8       2.120  13.217  -6.516  1.00  0.00           H  
ATOM    112  HE2 LYS A   8      -0.073  12.461  -5.583  1.00  0.00           H  
ATOM    113  HE3 LYS A   8       0.760  11.620  -4.268  1.00  0.00           H  
ATOM    114  HZ1 LYS A   8       0.833  14.527  -4.715  1.00  0.00           H  
ATOM    115  HZ2 LYS A   8      -0.053  13.748  -3.601  1.00  0.00           H  
ATOM    116  HZ3 LYS A   8       1.567  13.713  -3.479  1.00  0.00           H  
ATOM    117  N   ALA A   9      -1.031  10.135  -7.116  1.00  0.00           N  
ATOM    118  CA  ALA A   9      -2.246  10.924  -7.235  1.00  0.00           C  
ATOM    119  C   ALA A   9      -3.384  10.217  -6.505  1.00  0.00           C  
ATOM    120  O   ALA A   9      -4.134  10.832  -5.751  1.00  0.00           O  
ATOM    121  CB  ALA A   9      -2.594  11.182  -8.705  1.00  0.00           C  
ATOM    122  H   ALA A   9      -0.654   9.727  -7.965  1.00  0.00           H  
ATOM    123  HA  ALA A   9      -2.042  11.878  -6.759  1.00  0.00           H  
ATOM    124  HB1 ALA A   9      -1.734  11.601  -9.227  1.00  0.00           H  
ATOM    125  HB2 ALA A   9      -2.903  10.262  -9.199  1.00  0.00           H  
ATOM    126  HB3 ALA A   9      -3.420  11.893  -8.758  1.00  0.00           H  
ATOM    127  N   VAL A  10      -3.467   8.900  -6.701  1.00  0.00           N  
ATOM    128  CA  VAL A  10      -4.404   8.063  -5.969  1.00  0.00           C  
ATOM    129  C   VAL A  10      -4.066   8.129  -4.480  1.00  0.00           C  
ATOM    130  O   VAL A  10      -4.932   8.461  -3.669  1.00  0.00           O  
ATOM    131  CB  VAL A  10      -4.384   6.610  -6.477  1.00  0.00           C  
ATOM    132  CG1 VAL A  10      -5.716   5.894  -6.245  1.00  0.00           C  
ATOM    133  CG2 VAL A  10      -4.017   6.519  -7.958  1.00  0.00           C  
ATOM    134  H   VAL A  10      -2.813   8.477  -7.349  1.00  0.00           H  
ATOM    135  HA  VAL A  10      -5.402   8.474  -6.132  1.00  0.00           H  
ATOM    136  HB  VAL A  10      -3.653   6.045  -5.911  1.00  0.00           H  
ATOM    137 HG11 VAL A  10      -6.539   6.449  -6.697  1.00  0.00           H  
ATOM    138 HG12 VAL A  10      -5.677   4.902  -6.691  1.00  0.00           H  
ATOM    139 HG13 VAL A  10      -5.876   5.770  -5.178  1.00  0.00           H  
ATOM    140 HG21 VAL A  10      -4.614   7.211  -8.554  1.00  0.00           H  
ATOM    141 HG22 VAL A  10      -2.959   6.705  -8.092  1.00  0.00           H  
ATOM    142 HG23 VAL A  10      -4.188   5.511  -8.301  1.00  0.00           H  
ATOM    143  N   PHE A  11      -2.811   7.819  -4.119  1.00  0.00           N  
ATOM    144  CA  PHE A  11      -2.383   7.712  -2.726  1.00  0.00           C  
ATOM    145  C   PHE A  11      -2.903   8.883  -1.900  1.00  0.00           C  
ATOM    146  O   PHE A  11      -3.541   8.687  -0.865  1.00  0.00           O  
ATOM    147  CB  PHE A  11      -0.856   7.664  -2.643  1.00  0.00           C  
ATOM    148  CG  PHE A  11      -0.315   7.439  -1.246  1.00  0.00           C  
ATOM    149  CD1 PHE A  11      -0.086   8.536  -0.393  1.00  0.00           C  
ATOM    150  CD2 PHE A  11      -0.018   6.137  -0.804  1.00  0.00           C  
ATOM    151  CE1 PHE A  11       0.384   8.326   0.914  1.00  0.00           C  
ATOM    152  CE2 PHE A  11       0.403   5.926   0.519  1.00  0.00           C  
ATOM    153  CZ  PHE A  11       0.612   7.019   1.376  1.00  0.00           C  
ATOM    154  H   PHE A  11      -2.123   7.645  -4.849  1.00  0.00           H  
ATOM    155  HA  PHE A  11      -2.787   6.787  -2.319  1.00  0.00           H  
ATOM    156  HB2 PHE A  11      -0.491   6.877  -3.295  1.00  0.00           H  
ATOM    157  HB3 PHE A  11      -0.453   8.606  -3.008  1.00  0.00           H  
ATOM    158  HD1 PHE A  11      -0.274   9.545  -0.732  1.00  0.00           H  
ATOM    159  HD2 PHE A  11      -0.203   5.286  -1.442  1.00  0.00           H  
ATOM    160  HE1 PHE A  11       0.556   9.171   1.563  1.00  0.00           H  
ATOM    161  HE2 PHE A  11       0.551   4.921   0.882  1.00  0.00           H  
ATOM    162  HZ  PHE A  11       0.970   6.852   2.379  1.00  0.00           H  
ATOM    163  N   ASP A  12      -2.638  10.089  -2.409  1.00  0.00           N  
ATOM    164  CA  ASP A  12      -2.976  11.364  -1.793  1.00  0.00           C  
ATOM    165  C   ASP A  12      -4.423  11.384  -1.282  1.00  0.00           C  
ATOM    166  O   ASP A  12      -4.692  11.818  -0.165  1.00  0.00           O  
ATOM    167  CB  ASP A  12      -2.723  12.476  -2.824  1.00  0.00           C  
ATOM    168  CG  ASP A  12      -2.280  13.776  -2.175  1.00  0.00           C  
ATOM    169  OD1 ASP A  12      -2.958  14.226  -1.233  1.00  0.00           O  
ATOM    170  OD2 ASP A  12      -1.238  14.290  -2.642  1.00  0.00           O  
ATOM    171  H   ASP A  12      -2.156  10.117  -3.303  1.00  0.00           H  
ATOM    172  HA  ASP A  12      -2.303  11.507  -0.946  1.00  0.00           H  
ATOM    173  HB2 ASP A  12      -1.935  12.173  -3.509  1.00  0.00           H  
ATOM    174  HB3 ASP A  12      -3.625  12.661  -3.408  1.00  0.00           H  
ATOM    175  N   GLY A  13      -5.359  10.872  -2.088  1.00  0.00           N  
ATOM    176  CA  GLY A  13      -6.775  10.904  -1.771  1.00  0.00           C  
ATOM    177  C   GLY A  13      -7.216   9.620  -1.077  1.00  0.00           C  
ATOM    178  O   GLY A  13      -8.158   9.639  -0.289  1.00  0.00           O  
ATOM    179  H   GLY A  13      -5.081  10.348  -2.909  1.00  0.00           H  
ATOM    180  HA2 GLY A  13      -7.020  11.765  -1.147  1.00  0.00           H  
ATOM    181  HA3 GLY A  13      -7.328  10.993  -2.706  1.00  0.00           H  
ATOM    182  N   ASN A  14      -6.581   8.492  -1.414  1.00  0.00           N  
ATOM    183  CA  ASN A  14      -7.113   7.173  -1.114  1.00  0.00           C  
ATOM    184  C   ASN A  14      -6.433   6.563   0.105  1.00  0.00           C  
ATOM    185  O   ASN A  14      -7.100   6.032   0.990  1.00  0.00           O  
ATOM    186  CB  ASN A  14      -6.946   6.228  -2.310  1.00  0.00           C  
ATOM    187  CG  ASN A  14      -7.856   6.572  -3.486  1.00  0.00           C  
ATOM    188  OD1 ASN A  14      -8.869   5.920  -3.714  1.00  0.00           O  
ATOM    189  ND2 ASN A  14      -7.472   7.568  -4.277  1.00  0.00           N  
ATOM    190  H   ASN A  14      -5.756   8.548  -1.999  1.00  0.00           H  
ATOM    191  HA  ASN A  14      -8.177   7.269  -0.920  1.00  0.00           H  
ATOM    192  HB2 ASN A  14      -5.905   6.218  -2.636  1.00  0.00           H  
ATOM    193  HB3 ASN A  14      -7.195   5.217  -1.989  1.00  0.00           H  
ATOM    194 HD21 ASN A  14      -6.639   8.091  -4.038  1.00  0.00           H  
ATOM    195 HD22 ASN A  14      -7.895   7.675  -5.183  1.00  0.00           H  
ATOM    196  N   CYS A  15      -5.099   6.574   0.113  1.00  0.00           N  
ATOM    197  CA  CYS A  15      -4.298   5.810   1.058  1.00  0.00           C  
ATOM    198  C   CYS A  15      -3.843   6.706   2.206  1.00  0.00           C  
ATOM    199  O   CYS A  15      -3.803   6.271   3.358  1.00  0.00           O  
ATOM    200  CB  CYS A  15      -3.085   5.218   0.385  1.00  0.00           C  
ATOM    201  SG  CYS A  15      -3.395   4.266  -1.131  1.00  0.00           S  
ATOM    202  H   CYS A  15      -4.607   7.118  -0.586  1.00  0.00           H  
ATOM    203  HA  CYS A  15      -4.891   4.998   1.463  1.00  0.00           H  
ATOM    204  HB2 CYS A  15      -2.450   6.053   0.104  1.00  0.00           H  
ATOM    205  HB3 CYS A  15      -2.539   4.594   1.094  1.00  0.00           H  
ATOM    206  N   ALA A  16      -3.489   7.958   1.887  1.00  0.00           N  
ATOM    207  CA  ALA A  16      -2.823   8.886   2.783  1.00  0.00           C  
ATOM    208  C   ALA A  16      -3.654   9.073   4.040  1.00  0.00           C  
ATOM    209  O   ALA A  16      -3.109   9.213   5.132  1.00  0.00           O  
ATOM    210  CB  ALA A  16      -2.623  10.229   2.077  1.00  0.00           C  
ATOM    211  H   ALA A  16      -3.691   8.303   0.959  1.00  0.00           H  
ATOM    212  HA  ALA A  16      -1.849   8.475   3.046  1.00  0.00           H  
ATOM    213  HB1 ALA A  16      -2.058  10.089   1.156  1.00  0.00           H  
ATOM    214  HB2 ALA A  16      -3.591  10.668   1.840  1.00  0.00           H  
ATOM    215  HB3 ALA A  16      -2.078  10.910   2.730  1.00  0.00           H  
ATOM    216  N   ALA A  17      -4.979   9.040   3.868  1.00  0.00           N  
ATOM    217  CA  ALA A  17      -5.929   9.187   4.949  1.00  0.00           C  
ATOM    218  C   ALA A  17      -5.586   8.294   6.147  1.00  0.00           C  
ATOM    219  O   ALA A  17      -5.830   8.679   7.291  1.00  0.00           O  
ATOM    220  CB  ALA A  17      -7.348   8.916   4.447  1.00  0.00           C  
ATOM    221  H   ALA A  17      -5.336   8.925   2.932  1.00  0.00           H  
ATOM    222  HA  ALA A  17      -5.840  10.232   5.221  1.00  0.00           H  
ATOM    223  HB1 ALA A  17      -7.585   9.587   3.620  1.00  0.00           H  
ATOM    224  HB2 ALA A  17      -7.436   7.882   4.112  1.00  0.00           H  
ATOM    225  HB3 ALA A  17      -8.056   9.090   5.258  1.00  0.00           H  
ATOM    226  N   CYS A  18      -5.015   7.114   5.876  1.00  0.00           N  
ATOM    227  CA  CYS A  18      -4.423   6.265   6.897  1.00  0.00           C  
ATOM    228  C   CYS A  18      -2.901   6.418   6.838  1.00  0.00           C  
ATOM    229  O   CYS A  18      -2.287   6.791   7.833  1.00  0.00           O  
ATOM    230  CB  CYS A  18      -4.923   4.842   6.762  1.00  0.00           C  
ATOM    231  SG  CYS A  18      -6.705   4.837   7.166  1.00  0.00           S  
ATOM    232  H   CYS A  18      -4.823   6.871   4.910  1.00  0.00           H  
ATOM    233  HA  CYS A  18      -4.726   6.600   7.885  1.00  0.00           H  
ATOM    234  HB2 CYS A  18      -4.752   4.502   5.741  1.00  0.00           H  
ATOM    235  HB3 CYS A  18      -4.394   4.187   7.456  1.00  0.00           H  
ATOM    236  N   HIS A  19      -2.274   6.143   5.690  1.00  0.00           N  
ATOM    237  CA  HIS A  19      -0.833   5.920   5.623  1.00  0.00           C  
ATOM    238  C   HIS A  19       0.025   7.138   5.256  1.00  0.00           C  
ATOM    239  O   HIS A  19       1.172   6.946   4.847  1.00  0.00           O  
ATOM    240  CB  HIS A  19      -0.543   4.751   4.681  1.00  0.00           C  
ATOM    241  CG  HIS A  19      -1.141   3.444   5.126  1.00  0.00           C  
ATOM    242  ND1 HIS A  19      -0.619   2.605   6.086  1.00  0.00           N  
ATOM    243  CD2 HIS A  19      -2.112   2.761   4.452  1.00  0.00           C  
ATOM    244  CE1 HIS A  19      -1.252   1.422   5.964  1.00  0.00           C  
ATOM    245  NE2 HIS A  19      -2.177   1.468   4.982  1.00  0.00           N  
ATOM    246  H   HIS A  19      -2.834   5.908   4.878  1.00  0.00           H  
ATOM    247  HA  HIS A  19      -0.501   5.612   6.606  1.00  0.00           H  
ATOM    248  HB2 HIS A  19      -0.894   5.002   3.679  1.00  0.00           H  
ATOM    249  HB3 HIS A  19       0.535   4.594   4.634  1.00  0.00           H  
ATOM    250  HD1 HIS A  19       0.139   2.835   6.730  1.00  0.00           H  
ATOM    251  HD2 HIS A  19      -2.651   3.143   3.598  1.00  0.00           H  
ATOM    252  HE1 HIS A  19      -0.995   0.543   6.542  1.00  0.00           H  
ATOM    253  N   ALA A  20      -0.472   8.371   5.408  1.00  0.00           N  
ATOM    254  CA  ALA A  20       0.275   9.592   5.097  1.00  0.00           C  
ATOM    255  C   ALA A  20       1.752   9.507   5.508  1.00  0.00           C  
ATOM    256  O   ALA A  20       2.063   9.269   6.673  1.00  0.00           O  
ATOM    257  CB  ALA A  20      -0.379  10.800   5.774  1.00  0.00           C  
ATOM    258  H   ALA A  20      -1.438   8.474   5.707  1.00  0.00           H  
ATOM    259  HA  ALA A  20       0.216   9.747   4.020  1.00  0.00           H  
ATOM    260  HB1 ALA A  20      -0.452  10.630   6.849  1.00  0.00           H  
ATOM    261  HB2 ALA A  20       0.227  11.689   5.595  1.00  0.00           H  
ATOM    262  HB3 ALA A  20      -1.373  10.976   5.367  1.00  0.00           H  
ATOM    263  N   GLY A  21       2.658   9.688   4.540  1.00  0.00           N  
ATOM    264  CA  GLY A  21       4.097   9.673   4.770  1.00  0.00           C  
ATOM    265  C   GLY A  21       4.603   8.325   5.287  1.00  0.00           C  
ATOM    266  O   GLY A  21       5.573   8.279   6.037  1.00  0.00           O  
ATOM    267  H   GLY A  21       2.339   9.863   3.601  1.00  0.00           H  
ATOM    268  HA2 GLY A  21       4.603   9.891   3.829  1.00  0.00           H  
ATOM    269  HA3 GLY A  21       4.355  10.452   5.489  1.00  0.00           H  
ATOM    270  N   GLY A  22       3.960   7.223   4.890  1.00  0.00           N  
ATOM    271  CA  GLY A  22       4.337   5.902   5.362  1.00  0.00           C  
ATOM    272  C   GLY A  22       3.973   5.771   6.836  1.00  0.00           C  
ATOM    273  O   GLY A  22       4.803   5.379   7.652  1.00  0.00           O  
ATOM    274  H   GLY A  22       3.086   7.311   4.384  1.00  0.00           H  
ATOM    275  HA2 GLY A  22       3.801   5.146   4.790  1.00  0.00           H  
ATOM    276  HA3 GLY A  22       5.410   5.747   5.239  1.00  0.00           H  
ATOM    277  N   GLY A  23       2.725   6.100   7.164  1.00  0.00           N  
ATOM    278  CA  GLY A  23       2.197   6.056   8.519  1.00  0.00           C  
ATOM    279  C   GLY A  23       1.034   5.074   8.618  1.00  0.00           C  
ATOM    280  O   GLY A  23       0.961   4.093   7.872  1.00  0.00           O  
ATOM    281  H   GLY A  23       2.121   6.434   6.422  1.00  0.00           H  
ATOM    282  HA2 GLY A  23       2.958   5.768   9.245  1.00  0.00           H  
ATOM    283  HA3 GLY A  23       1.848   7.059   8.767  1.00  0.00           H  
ATOM    284  N   ASN A  24       0.098   5.369   9.520  1.00  0.00           N  
ATOM    285  CA  ASN A  24      -1.174   4.682   9.663  1.00  0.00           C  
ATOM    286  C   ASN A  24      -2.083   5.607  10.469  1.00  0.00           C  
ATOM    287  O   ASN A  24      -1.616   6.620  10.991  1.00  0.00           O  
ATOM    288  CB  ASN A  24      -0.993   3.360  10.411  1.00  0.00           C  
ATOM    289  CG  ASN A  24      -2.059   2.330  10.033  1.00  0.00           C  
ATOM    290  OD1 ASN A  24      -3.233   2.487  10.366  1.00  0.00           O  
ATOM    291  ND2 ASN A  24      -1.678   1.266   9.336  1.00  0.00           N  
ATOM    292  H   ASN A  24       0.171   6.220  10.067  1.00  0.00           H  
ATOM    293  HA  ASN A  24      -1.596   4.491   8.675  1.00  0.00           H  
ATOM    294  HB2 ASN A  24      -0.002   2.960  10.216  1.00  0.00           H  
ATOM    295  HB3 ASN A  24      -1.060   3.571  11.476  1.00  0.00           H  
ATOM    296 HD21 ASN A  24      -0.682   1.130   9.175  1.00  0.00           H  
ATOM    297 HD22 ASN A  24      -2.340   0.549   9.086  1.00  0.00           H  
ATOM    298  N   ASN A  25      -3.348   5.221  10.623  1.00  0.00           N  
ATOM    299  CA  ASN A  25      -4.303   5.853  11.522  1.00  0.00           C  
ATOM    300  C   ASN A  25      -4.774   4.802  12.527  1.00  0.00           C  
ATOM    301  O   ASN A  25      -4.628   4.975  13.733  1.00  0.00           O  
ATOM    302  CB  ASN A  25      -5.446   6.449  10.690  1.00  0.00           C  
ATOM    303  CG  ASN A  25      -6.482   7.203  11.518  1.00  0.00           C  
ATOM    304  OD1 ASN A  25      -6.880   6.772  12.593  1.00  0.00           O  
ATOM    305  ND2 ASN A  25      -6.948   8.341  11.010  1.00  0.00           N  
ATOM    306  H   ASN A  25      -3.611   4.336  10.206  1.00  0.00           H  
ATOM    307  HA  ASN A  25      -3.832   6.665  12.079  1.00  0.00           H  
ATOM    308  HB2 ASN A  25      -4.999   7.158   9.993  1.00  0.00           H  
ATOM    309  HB3 ASN A  25      -5.951   5.667  10.122  1.00  0.00           H  
ATOM    310 HD21 ASN A  25      -6.625   8.668  10.109  1.00  0.00           H  
ATOM    311 HD22 ASN A  25      -7.630   8.861  11.539  1.00  0.00           H  
ATOM    312  N   VAL A  26      -5.300   3.685  12.018  1.00  0.00           N  
ATOM    313  CA  VAL A  26      -5.885   2.631  12.832  1.00  0.00           C  
ATOM    314  C   VAL A  26      -4.815   1.925  13.675  1.00  0.00           C  
ATOM    315  O   VAL A  26      -4.997   1.759  14.878  1.00  0.00           O  
ATOM    316  CB  VAL A  26      -6.660   1.650  11.933  1.00  0.00           C  
ATOM    317  CG1 VAL A  26      -7.382   0.592  12.778  1.00  0.00           C  
ATOM    318  CG2 VAL A  26      -7.699   2.373  11.063  1.00  0.00           C  
ATOM    319  H   VAL A  26      -5.298   3.561  11.017  1.00  0.00           H  
ATOM    320  HA  VAL A  26      -6.598   3.095  13.516  1.00  0.00           H  
ATOM    321  HB  VAL A  26      -5.959   1.146  11.271  1.00  0.00           H  
ATOM    322 HG11 VAL A  26      -8.068   1.075  13.474  1.00  0.00           H  
ATOM    323 HG12 VAL A  26      -7.948  -0.072  12.127  1.00  0.00           H  
ATOM    324 HG13 VAL A  26      -6.667  -0.008  13.341  1.00  0.00           H  
ATOM    325 HG21 VAL A  26      -8.389   2.934  11.694  1.00  0.00           H  
ATOM    326 HG22 VAL A  26      -7.217   3.058  10.365  1.00  0.00           H  
ATOM    327 HG23 VAL A  26      -8.263   1.643  10.481  1.00  0.00           H  
ATOM    328  N   ILE A  27      -3.716   1.485  13.049  1.00  0.00           N  
ATOM    329  CA  ILE A  27      -2.634   0.766  13.725  1.00  0.00           C  
ATOM    330  C   ILE A  27      -1.350   1.589  13.595  1.00  0.00           C  
ATOM    331  O   ILE A  27      -0.652   1.438  12.593  1.00  0.00           O  
ATOM    332  CB  ILE A  27      -2.441  -0.639  13.119  1.00  0.00           C  
ATOM    333  CG1 ILE A  27      -3.718  -1.491  13.114  1.00  0.00           C  
ATOM    334  CG2 ILE A  27      -1.330  -1.397  13.860  1.00  0.00           C  
ATOM    335  CD1 ILE A  27      -4.204  -1.936  14.497  1.00  0.00           C  
ATOM    336  H   ILE A  27      -3.605   1.702  12.064  1.00  0.00           H  
ATOM    337  HA  ILE A  27      -2.865   0.616  14.777  1.00  0.00           H  
ATOM    338  HB  ILE A  27      -2.148  -0.533  12.073  1.00  0.00           H  
ATOM    339 HG12 ILE A  27      -4.511  -0.936  12.621  1.00  0.00           H  
ATOM    340 HG13 ILE A  27      -3.509  -2.383  12.524  1.00  0.00           H  
ATOM    341 HG21 ILE A  27      -1.494  -1.364  14.937  1.00  0.00           H  
ATOM    342 HG22 ILE A  27      -1.319  -2.437  13.537  1.00  0.00           H  
ATOM    343 HG23 ILE A  27      -0.357  -0.957  13.648  1.00  0.00           H  
ATOM    344 HD11 ILE A  27      -4.389  -1.074  15.137  1.00  0.00           H  
ATOM    345 HD12 ILE A  27      -5.134  -2.493  14.381  1.00  0.00           H  
ATOM    346 HD13 ILE A  27      -3.471  -2.591  14.967  1.00  0.00           H  
ATOM    347  N   PRO A  28      -1.015   2.459  14.561  1.00  0.00           N  
ATOM    348  CA  PRO A  28       0.115   3.377  14.457  1.00  0.00           C  
ATOM    349  C   PRO A  28       1.450   2.654  14.701  1.00  0.00           C  
ATOM    350  O   PRO A  28       2.185   2.993  15.625  1.00  0.00           O  
ATOM    351  CB  PRO A  28      -0.185   4.469  15.492  1.00  0.00           C  
ATOM    352  CG  PRO A  28      -0.923   3.702  16.588  1.00  0.00           C  
ATOM    353  CD  PRO A  28      -1.757   2.700  15.790  1.00  0.00           C  
ATOM    354  HA  PRO A  28       0.154   3.839  13.471  1.00  0.00           H  
ATOM    355  HB2 PRO A  28       0.705   4.981  15.862  1.00  0.00           H  
ATOM    356  HB3 PRO A  28      -0.870   5.196  15.053  1.00  0.00           H  
ATOM    357  HG2 PRO A  28      -0.197   3.166  17.203  1.00  0.00           H  
ATOM    358  HG3 PRO A  28      -1.539   4.351  17.211  1.00  0.00           H  
ATOM    359  HD2 PRO A  28      -1.888   1.791  16.379  1.00  0.00           H  
ATOM    360  HD3 PRO A  28      -2.728   3.138  15.550  1.00  0.00           H  
ATOM    361  N   ASP A  29       1.757   1.667  13.852  1.00  0.00           N  
ATOM    362  CA  ASP A  29       2.970   0.850  13.895  1.00  0.00           C  
ATOM    363  C   ASP A  29       3.185   0.192  12.524  1.00  0.00           C  
ATOM    364  O   ASP A  29       4.265   0.244  11.940  1.00  0.00           O  
ATOM    365  CB  ASP A  29       2.841  -0.201  15.003  1.00  0.00           C  
ATOM    366  CG  ASP A  29       4.085  -1.072  15.067  1.00  0.00           C  
ATOM    367  OD1 ASP A  29       4.105  -2.074  14.324  1.00  0.00           O  
ATOM    368  OD2 ASP A  29       4.989  -0.721  15.855  1.00  0.00           O  
ATOM    369  H   ASP A  29       1.080   1.470  13.122  1.00  0.00           H  
ATOM    370  HA  ASP A  29       3.830   1.486  14.114  1.00  0.00           H  
ATOM    371  HB2 ASP A  29       2.721   0.297  15.966  1.00  0.00           H  
ATOM    372  HB3 ASP A  29       1.976  -0.839  14.827  1.00  0.00           H  
ATOM    373  N   HIS A  30       2.106  -0.367  11.976  1.00  0.00           N  
ATOM    374  CA  HIS A  30       2.009  -0.845  10.606  1.00  0.00           C  
ATOM    375  C   HIS A  30       2.087   0.340   9.631  1.00  0.00           C  
ATOM    376  O   HIS A  30       1.077   0.983   9.360  1.00  0.00           O  
ATOM    377  CB  HIS A  30       0.662  -1.560  10.466  1.00  0.00           C  
ATOM    378  CG  HIS A  30       0.581  -2.943  11.058  1.00  0.00           C  
ATOM    379  ND1 HIS A  30      -0.082  -3.994  10.477  1.00  0.00           N  
ATOM    380  CD2 HIS A  30       0.939  -3.335  12.320  1.00  0.00           C  
ATOM    381  CE1 HIS A  30      -0.198  -4.964  11.400  1.00  0.00           C  
ATOM    382  NE2 HIS A  30       0.415  -4.611  12.540  1.00  0.00           N  
ATOM    383  H   HIS A  30       1.274  -0.416  12.542  1.00  0.00           H  
ATOM    384  HA  HIS A  30       2.815  -1.548  10.393  1.00  0.00           H  
ATOM    385  HB2 HIS A  30      -0.115  -0.945  10.921  1.00  0.00           H  
ATOM    386  HB3 HIS A  30       0.409  -1.645   9.416  1.00  0.00           H  
ATOM    387  HD1 HIS A  30      -0.300  -4.060   9.486  1.00  0.00           H  
ATOM    388  HD2 HIS A  30       1.490  -2.752  13.036  1.00  0.00           H  
ATOM    389  HE1 HIS A  30      -0.663  -5.923  11.229  1.00  0.00           H  
ATOM    390  N   THR A  31       3.280   0.656   9.125  1.00  0.00           N  
ATOM    391  CA  THR A  31       3.526   1.802   8.253  1.00  0.00           C  
ATOM    392  C   THR A  31       3.275   1.413   6.785  1.00  0.00           C  
ATOM    393  O   THR A  31       2.260   0.793   6.480  1.00  0.00           O  
ATOM    394  CB  THR A  31       4.974   2.242   8.476  1.00  0.00           C  
ATOM    395  OG1 THR A  31       5.794   1.129   8.202  1.00  0.00           O  
ATOM    396  CG2 THR A  31       5.307   2.763   9.860  1.00  0.00           C  
ATOM    397  H   THR A  31       4.071   0.091   9.388  1.00  0.00           H  
ATOM    398  HA  THR A  31       2.869   2.629   8.515  1.00  0.00           H  
ATOM    399  HB  THR A  31       5.238   3.082   7.843  1.00  0.00           H  
ATOM    400  HG1 THR A  31       6.013   0.706   9.038  1.00  0.00           H  
ATOM    401 HG21 THR A  31       5.059   2.049  10.636  1.00  0.00           H  
ATOM    402 HG22 THR A  31       6.384   2.927   9.836  1.00  0.00           H  
ATOM    403 HG23 THR A  31       4.782   3.701  10.044  1.00  0.00           H  
ATOM    404  N   LEU A  32       4.216   1.731   5.878  1.00  0.00           N  
ATOM    405  CA  LEU A  32       4.413   1.050   4.615  1.00  0.00           C  
ATOM    406  C   LEU A  32       5.897   1.009   4.272  1.00  0.00           C  
ATOM    407  O   LEU A  32       6.266   1.184   3.116  1.00  0.00           O  
ATOM    408  CB  LEU A  32       3.668   1.773   3.474  1.00  0.00           C  
ATOM    409  CG  LEU A  32       2.165   2.008   3.640  1.00  0.00           C  
ATOM    410  CD1 LEU A  32       1.671   2.992   2.577  1.00  0.00           C  
ATOM    411  CD2 LEU A  32       1.405   0.696   3.472  1.00  0.00           C  
ATOM    412  H   LEU A  32       5.010   2.277   6.152  1.00  0.00           H  
ATOM    413  HA  LEU A  32       4.190   0.001   4.786  1.00  0.00           H  
ATOM    414  HB2 LEU A  32       4.129   2.756   3.396  1.00  0.00           H  
ATOM    415  HB3 LEU A  32       3.829   1.239   2.536  1.00  0.00           H  
ATOM    416  HG  LEU A  32       1.962   2.462   4.604  1.00  0.00           H  
ATOM    417 HD11 LEU A  32       1.949   2.628   1.592  1.00  0.00           H  
ATOM    418 HD12 LEU A  32       0.586   3.082   2.629  1.00  0.00           H  
ATOM    419 HD13 LEU A  32       2.117   3.973   2.743  1.00  0.00           H  
ATOM    420 HD21 LEU A  32       1.778  -0.067   4.154  1.00  0.00           H  
ATOM    421 HD22 LEU A  32       0.354   0.880   3.680  1.00  0.00           H  
ATOM    422 HD23 LEU A  32       1.521   0.343   2.448  1.00  0.00           H  
ATOM    423  N   GLN A  33       6.756   0.789   5.263  1.00  0.00           N  
ATOM    424  CA  GLN A  33       8.175   0.482   5.028  1.00  0.00           C  
ATOM    425  C   GLN A  33       8.460  -1.004   5.288  1.00  0.00           C  
ATOM    426  O   GLN A  33       7.635  -1.710   5.871  1.00  0.00           O  
ATOM    427  CB  GLN A  33       9.076   1.391   5.870  1.00  0.00           C  
ATOM    428  CG  GLN A  33       8.469   1.495   7.261  1.00  0.00           C  
ATOM    429  CD  GLN A  33       9.507   1.649   8.361  1.00  0.00           C  
ATOM    430  OE1 GLN A  33       9.602   0.814   9.251  1.00  0.00           O  
ATOM    431  NE2 GLN A  33      10.304   2.711   8.306  1.00  0.00           N  
ATOM    432  H   GLN A  33       6.379   0.740   6.211  1.00  0.00           H  
ATOM    433  HA  GLN A  33       8.436   0.665   3.990  1.00  0.00           H  
ATOM    434  HB2 GLN A  33      10.083   0.974   5.919  1.00  0.00           H  
ATOM    435  HB3 GLN A  33       9.130   2.386   5.432  1.00  0.00           H  
ATOM    436  HG2 GLN A  33       7.798   2.351   7.293  1.00  0.00           H  
ATOM    437  HG3 GLN A  33       7.887   0.584   7.400  1.00  0.00           H  
ATOM    438 HE21 GLN A  33      10.198   3.397   7.574  1.00  0.00           H  
ATOM    439 HE22 GLN A  33      10.984   2.836   9.040  1.00  0.00           H  
ATOM    440  N   LYS A  34       9.629  -1.489   4.842  1.00  0.00           N  
ATOM    441  CA  LYS A  34       9.874  -2.925   4.789  1.00  0.00           C  
ATOM    442  C   LYS A  34       9.749  -3.611   6.151  1.00  0.00           C  
ATOM    443  O   LYS A  34       9.132  -4.666   6.239  1.00  0.00           O  
ATOM    444  CB  LYS A  34      11.095  -3.327   3.933  1.00  0.00           C  
ATOM    445  CG  LYS A  34      12.495  -3.220   4.560  1.00  0.00           C  
ATOM    446  CD  LYS A  34      13.480  -2.307   3.808  1.00  0.00           C  
ATOM    447  CE  LYS A  34      12.953  -0.871   3.741  1.00  0.00           C  
ATOM    448  NZ  LYS A  34      13.921   0.114   3.198  1.00  0.00           N  
ATOM    449  H   LYS A  34      10.276  -0.866   4.389  1.00  0.00           H  
ATOM    450  HA  LYS A  34       9.025  -3.302   4.233  1.00  0.00           H  
ATOM    451  HB2 LYS A  34      10.959  -4.386   3.708  1.00  0.00           H  
ATOM    452  HB3 LYS A  34      11.062  -2.808   2.977  1.00  0.00           H  
ATOM    453  HG2 LYS A  34      12.429  -2.940   5.609  1.00  0.00           H  
ATOM    454  HG3 LYS A  34      12.914  -4.229   4.516  1.00  0.00           H  
ATOM    455  HD2 LYS A  34      14.436  -2.338   4.335  1.00  0.00           H  
ATOM    456  HD3 LYS A  34      13.626  -2.701   2.799  1.00  0.00           H  
ATOM    457  HE2 LYS A  34      12.083  -0.875   3.090  1.00  0.00           H  
ATOM    458  HE3 LYS A  34      12.624  -0.563   4.735  1.00  0.00           H  
ATOM    459  HZ1 LYS A  34      14.293  -0.110   2.279  1.00  0.00           H  
ATOM    460  HZ2 LYS A  34      13.412   0.983   3.035  1.00  0.00           H  
ATOM    461  HZ3 LYS A  34      14.680   0.348   3.824  1.00  0.00           H  
ATOM    462  N   ALA A  35      10.209  -2.959   7.225  1.00  0.00           N  
ATOM    463  CA  ALA A  35      10.089  -3.502   8.576  1.00  0.00           C  
ATOM    464  C   ALA A  35       8.636  -3.823   8.951  1.00  0.00           C  
ATOM    465  O   ALA A  35       8.399  -4.713   9.765  1.00  0.00           O  
ATOM    466  CB  ALA A  35      10.692  -2.526   9.588  1.00  0.00           C  
ATOM    467  H   ALA A  35      10.616  -2.045   7.108  1.00  0.00           H  
ATOM    468  HA  ALA A  35      10.662  -4.430   8.620  1.00  0.00           H  
ATOM    469  HB1 ALA A  35      11.726  -2.299   9.326  1.00  0.00           H  
ATOM    470  HB2 ALA A  35      10.111  -1.606   9.605  1.00  0.00           H  
ATOM    471  HB3 ALA A  35      10.668  -2.973  10.583  1.00  0.00           H  
ATOM    472  N   ALA A  36       7.668  -3.104   8.372  1.00  0.00           N  
ATOM    473  CA  ALA A  36       6.259  -3.392   8.554  1.00  0.00           C  
ATOM    474  C   ALA A  36       5.861  -4.474   7.560  1.00  0.00           C  
ATOM    475  O   ALA A  36       5.489  -5.574   7.963  1.00  0.00           O  
ATOM    476  CB  ALA A  36       5.423  -2.120   8.371  1.00  0.00           C  
ATOM    477  H   ALA A  36       7.912  -2.478   7.617  1.00  0.00           H  
ATOM    478  HA  ALA A  36       6.086  -3.764   9.565  1.00  0.00           H  
ATOM    479  HB1 ALA A  36       5.637  -1.639   7.417  1.00  0.00           H  
ATOM    480  HB2 ALA A  36       4.361  -2.363   8.397  1.00  0.00           H  
ATOM    481  HB3 ALA A  36       5.650  -1.430   9.182  1.00  0.00           H  
ATOM    482  N   ILE A  37       5.947  -4.162   6.261  1.00  0.00           N  
ATOM    483  CA  ILE A  37       5.447  -5.033   5.202  1.00  0.00           C  
ATOM    484  C   ILE A  37       5.980  -6.465   5.389  1.00  0.00           C  
ATOM    485  O   ILE A  37       5.178  -7.392   5.446  1.00  0.00           O  
ATOM    486  CB  ILE A  37       5.736  -4.427   3.813  1.00  0.00           C  
ATOM    487  CG1 ILE A  37       5.159  -3.004   3.696  1.00  0.00           C  
ATOM    488  CG2 ILE A  37       5.191  -5.325   2.690  1.00  0.00           C  
ATOM    489  CD1 ILE A  37       5.083  -2.454   2.269  1.00  0.00           C  
ATOM    490  H   ILE A  37       6.365  -3.270   6.014  1.00  0.00           H  
ATOM    491  HA  ILE A  37       4.356  -5.078   5.286  1.00  0.00           H  
ATOM    492  HB  ILE A  37       6.808  -4.336   3.709  1.00  0.00           H  
ATOM    493 HG12 ILE A  37       4.160  -2.986   4.129  1.00  0.00           H  
ATOM    494 HG13 ILE A  37       5.805  -2.322   4.245  1.00  0.00           H  
ATOM    495 HG21 ILE A  37       5.502  -6.360   2.824  1.00  0.00           H  
ATOM    496 HG22 ILE A  37       4.104  -5.278   2.683  1.00  0.00           H  
ATOM    497 HG23 ILE A  37       5.566  -4.992   1.722  1.00  0.00           H  
ATOM    498 HD11 ILE A  37       6.056  -2.519   1.785  1.00  0.00           H  
ATOM    499 HD12 ILE A  37       4.349  -3.009   1.688  1.00  0.00           H  
ATOM    500 HD13 ILE A  37       4.776  -1.409   2.305  1.00  0.00           H  
ATOM    501  N   GLU A  38       7.298  -6.657   5.546  1.00  0.00           N  
ATOM    502  CA  GLU A  38       7.921  -7.971   5.722  1.00  0.00           C  
ATOM    503  C   GLU A  38       7.146  -8.900   6.662  1.00  0.00           C  
ATOM    504  O   GLU A  38       7.073 -10.096   6.387  1.00  0.00           O  
ATOM    505  CB  GLU A  38       9.366  -7.833   6.226  1.00  0.00           C  
ATOM    506  CG  GLU A  38      10.344  -7.423   5.121  1.00  0.00           C  
ATOM    507  CD  GLU A  38      11.751  -7.262   5.677  1.00  0.00           C  
ATOM    508  OE1 GLU A  38      12.379  -8.312   5.928  1.00  0.00           O  
ATOM    509  OE2 GLU A  38      12.169  -6.095   5.840  1.00  0.00           O  
ATOM    510  H   GLU A  38       7.911  -5.851   5.603  1.00  0.00           H  
ATOM    511  HA  GLU A  38       7.948  -8.461   4.749  1.00  0.00           H  
ATOM    512  HB2 GLU A  38       9.415  -7.121   7.051  1.00  0.00           H  
ATOM    513  HB3 GLU A  38       9.705  -8.801   6.602  1.00  0.00           H  
ATOM    514  HG2 GLU A  38      10.381  -8.207   4.365  1.00  0.00           H  
ATOM    515  HG3 GLU A  38      10.036  -6.485   4.665  1.00  0.00           H  
ATOM    516  N   GLN A  39       6.606  -8.370   7.766  1.00  0.00           N  
ATOM    517  CA  GLN A  39       5.898  -9.186   8.749  1.00  0.00           C  
ATOM    518  C   GLN A  39       4.382  -9.010   8.653  1.00  0.00           C  
ATOM    519  O   GLN A  39       3.640  -9.989   8.667  1.00  0.00           O  
ATOM    520  CB  GLN A  39       6.460  -8.945  10.158  1.00  0.00           C  
ATOM    521  CG  GLN A  39       6.394  -7.489  10.633  1.00  0.00           C  
ATOM    522  CD  GLN A  39       7.120  -7.306  11.961  1.00  0.00           C  
ATOM    523  OE1 GLN A  39       6.920  -8.073  12.898  1.00  0.00           O  
ATOM    524  NE2 GLN A  39       7.990  -6.306  12.054  1.00  0.00           N  
ATOM    525  H   GLN A  39       6.620  -7.359   7.874  1.00  0.00           H  
ATOM    526  HA  GLN A  39       6.082 -10.244   8.557  1.00  0.00           H  
ATOM    527  HB2 GLN A  39       5.917  -9.575  10.864  1.00  0.00           H  
ATOM    528  HB3 GLN A  39       7.506  -9.257  10.158  1.00  0.00           H  
ATOM    529  HG2 GLN A  39       6.847  -6.840   9.887  1.00  0.00           H  
ATOM    530  HG3 GLN A  39       5.358  -7.196  10.773  1.00  0.00           H  
ATOM    531 HE21 GLN A  39       8.140  -5.688  11.259  1.00  0.00           H  
ATOM    532 HE22 GLN A  39       8.481  -6.165  12.921  1.00  0.00           H  
ATOM    533  N   PHE A  40       3.907  -7.767   8.579  1.00  0.00           N  
ATOM    534  CA  PHE A  40       2.490  -7.465   8.688  1.00  0.00           C  
ATOM    535  C   PHE A  40       1.733  -7.666   7.370  1.00  0.00           C  
ATOM    536  O   PHE A  40       0.522  -7.872   7.398  1.00  0.00           O  
ATOM    537  CB  PHE A  40       2.292  -6.063   9.271  1.00  0.00           C  
ATOM    538  CG  PHE A  40       2.976  -5.788  10.601  1.00  0.00           C  
ATOM    539  CD1 PHE A  40       2.837  -6.677  11.685  1.00  0.00           C  
ATOM    540  CD2 PHE A  40       3.662  -4.574  10.787  1.00  0.00           C  
ATOM    541  CE1 PHE A  40       3.416  -6.369  12.929  1.00  0.00           C  
ATOM    542  CE2 PHE A  40       4.242  -4.267  12.029  1.00  0.00           C  
ATOM    543  CZ  PHE A  40       4.118  -5.164  13.101  1.00  0.00           C  
ATOM    544  H   PHE A  40       4.557  -6.992   8.549  1.00  0.00           H  
ATOM    545  HA  PHE A  40       2.044  -8.166   9.395  1.00  0.00           H  
ATOM    546  HB2 PHE A  40       2.622  -5.307   8.561  1.00  0.00           H  
ATOM    547  HB3 PHE A  40       1.221  -5.940   9.397  1.00  0.00           H  
ATOM    548  HD1 PHE A  40       2.240  -7.571  11.593  1.00  0.00           H  
ATOM    549  HD2 PHE A  40       3.668  -3.831  10.007  1.00  0.00           H  
ATOM    550  HE1 PHE A  40       3.269  -7.028  13.773  1.00  0.00           H  
ATOM    551  HE2 PHE A  40       4.697  -3.300  12.199  1.00  0.00           H  
ATOM    552  HZ  PHE A  40       4.485  -4.873  14.077  1.00  0.00           H  
ATOM    553  N   LEU A  41       2.409  -7.642   6.217  1.00  0.00           N  
ATOM    554  CA  LEU A  41       1.797  -8.038   4.952  1.00  0.00           C  
ATOM    555  C   LEU A  41       1.929  -9.561   4.860  1.00  0.00           C  
ATOM    556  O   LEU A  41       3.016 -10.071   4.598  1.00  0.00           O  
ATOM    557  CB  LEU A  41       2.500  -7.290   3.804  1.00  0.00           C  
ATOM    558  CG  LEU A  41       2.067  -7.510   2.338  1.00  0.00           C  
ATOM    559  CD1 LEU A  41       1.340  -8.819   2.036  1.00  0.00           C  
ATOM    560  CD2 LEU A  41       1.220  -6.346   1.833  1.00  0.00           C  
ATOM    561  H   LEU A  41       3.422  -7.546   6.230  1.00  0.00           H  
ATOM    562  HA  LEU A  41       0.744  -7.754   4.930  1.00  0.00           H  
ATOM    563  HB2 LEU A  41       2.438  -6.231   4.028  1.00  0.00           H  
ATOM    564  HB3 LEU A  41       3.549  -7.520   3.853  1.00  0.00           H  
ATOM    565  HG  LEU A  41       2.972  -7.508   1.728  1.00  0.00           H  
ATOM    566 HD11 LEU A  41       0.469  -8.937   2.678  1.00  0.00           H  
ATOM    567 HD12 LEU A  41       0.998  -8.822   1.002  1.00  0.00           H  
ATOM    568 HD13 LEU A  41       2.033  -9.649   2.166  1.00  0.00           H  
ATOM    569 HD21 LEU A  41       0.336  -6.234   2.447  1.00  0.00           H  
ATOM    570 HD22 LEU A  41       1.813  -5.436   1.869  1.00  0.00           H  
ATOM    571 HD23 LEU A  41       0.918  -6.529   0.804  1.00  0.00           H  
ATOM    572  N   ASP A  42       0.825 -10.287   5.063  1.00  0.00           N  
ATOM    573  CA  ASP A  42       0.776 -11.732   4.865  1.00  0.00           C  
ATOM    574  C   ASP A  42       1.169 -12.063   3.418  1.00  0.00           C  
ATOM    575  O   ASP A  42       0.474 -11.658   2.486  1.00  0.00           O  
ATOM    576  CB  ASP A  42      -0.626 -12.252   5.201  1.00  0.00           C  
ATOM    577  CG  ASP A  42      -0.651 -13.774   5.206  1.00  0.00           C  
ATOM    578  OD1 ASP A  42      -0.430 -14.355   4.124  1.00  0.00           O  
ATOM    579  OD2 ASP A  42      -0.878 -14.327   6.303  1.00  0.00           O  
ATOM    580  H   ASP A  42      -0.033  -9.816   5.298  1.00  0.00           H  
ATOM    581  HA  ASP A  42       1.482 -12.197   5.556  1.00  0.00           H  
ATOM    582  HB2 ASP A  42      -0.920 -11.902   6.190  1.00  0.00           H  
ATOM    583  HB3 ASP A  42      -1.346 -11.895   4.465  1.00  0.00           H  
ATOM    584  N   GLY A  43       2.326 -12.707   3.234  1.00  0.00           N  
ATOM    585  CA  GLY A  43       2.962 -12.906   1.935  1.00  0.00           C  
ATOM    586  C   GLY A  43       4.399 -12.377   1.935  1.00  0.00           C  
ATOM    587  O   GLY A  43       5.239 -12.863   1.181  1.00  0.00           O  
ATOM    588  H   GLY A  43       2.829 -13.011   4.054  1.00  0.00           H  
ATOM    589  HA2 GLY A  43       2.977 -13.973   1.715  1.00  0.00           H  
ATOM    590  HA3 GLY A  43       2.415 -12.398   1.141  1.00  0.00           H  
ATOM    591  N   GLY A  44       4.695 -11.397   2.792  1.00  0.00           N  
ATOM    592  CA  GLY A  44       6.020 -10.816   2.925  1.00  0.00           C  
ATOM    593  C   GLY A  44       6.304  -9.793   1.825  1.00  0.00           C  
ATOM    594  O   GLY A  44       5.495  -9.584   0.918  1.00  0.00           O  
ATOM    595  H   GLY A  44       3.962 -11.015   3.380  1.00  0.00           H  
ATOM    596  HA2 GLY A  44       6.066 -10.311   3.890  1.00  0.00           H  
ATOM    597  HA3 GLY A  44       6.779 -11.599   2.904  1.00  0.00           H  
ATOM    598  N   PHE A  45       7.470  -9.145   1.914  1.00  0.00           N  
ATOM    599  CA  PHE A  45       7.843  -7.997   1.095  1.00  0.00           C  
ATOM    600  C   PHE A  45       7.939  -8.342  -0.393  1.00  0.00           C  
ATOM    601  O   PHE A  45       9.027  -8.623  -0.891  1.00  0.00           O  
ATOM    602  CB  PHE A  45       9.155  -7.390   1.618  1.00  0.00           C  
ATOM    603  CG  PHE A  45       9.372  -5.963   1.169  1.00  0.00           C  
ATOM    604  CD1 PHE A  45      10.001  -5.651  -0.050  1.00  0.00           C  
ATOM    605  CD2 PHE A  45       8.858  -4.936   1.968  1.00  0.00           C  
ATOM    606  CE1 PHE A  45      10.118  -4.306  -0.449  1.00  0.00           C  
ATOM    607  CE2 PHE A  45       8.857  -3.611   1.510  1.00  0.00           C  
ATOM    608  CZ  PHE A  45       9.517  -3.291   0.316  1.00  0.00           C  
ATOM    609  H   PHE A  45       8.096  -9.412   2.660  1.00  0.00           H  
ATOM    610  HA  PHE A  45       7.063  -7.244   1.218  1.00  0.00           H  
ATOM    611  HB2 PHE A  45       9.096  -7.381   2.703  1.00  0.00           H  
ATOM    612  HB3 PHE A  45      10.027  -7.989   1.355  1.00  0.00           H  
ATOM    613  HD1 PHE A  45      10.400  -6.436  -0.678  1.00  0.00           H  
ATOM    614  HD2 PHE A  45       8.514  -5.187   2.956  1.00  0.00           H  
ATOM    615  HE1 PHE A  45      10.642  -4.058  -1.360  1.00  0.00           H  
ATOM    616  HE2 PHE A  45       8.404  -2.829   2.098  1.00  0.00           H  
ATOM    617  HZ  PHE A  45       9.571  -2.261   0.014  1.00  0.00           H  
ATOM    618  N   ASN A  46       6.810  -8.313  -1.108  1.00  0.00           N  
ATOM    619  CA  ASN A  46       6.757  -8.578  -2.540  1.00  0.00           C  
ATOM    620  C   ASN A  46       5.724  -7.670  -3.183  1.00  0.00           C  
ATOM    621  O   ASN A  46       4.704  -7.341  -2.574  1.00  0.00           O  
ATOM    622  CB  ASN A  46       6.374 -10.026  -2.855  1.00  0.00           C  
ATOM    623  CG  ASN A  46       7.270 -11.048  -2.179  1.00  0.00           C  
ATOM    624  OD1 ASN A  46       8.161 -11.636  -2.782  1.00  0.00           O  
ATOM    625  ND2 ASN A  46       6.998 -11.271  -0.902  1.00  0.00           N  
ATOM    626  H   ASN A  46       5.933  -8.157  -0.623  1.00  0.00           H  
ATOM    627  HA  ASN A  46       7.735  -8.383  -2.982  1.00  0.00           H  
ATOM    628  HB2 ASN A  46       5.346 -10.207  -2.546  1.00  0.00           H  
ATOM    629  HB3 ASN A  46       6.430 -10.161  -3.932  1.00  0.00           H  
ATOM    630 HD21 ASN A  46       6.268 -10.708  -0.475  1.00  0.00           H  
ATOM    631 HD22 ASN A  46       7.515 -11.961  -0.384  1.00  0.00           H  
ATOM    632  N   ILE A  47       5.968  -7.315  -4.441  1.00  0.00           N  
ATOM    633  CA  ILE A  47       5.020  -6.529  -5.219  1.00  0.00           C  
ATOM    634  C   ILE A  47       3.765  -7.365  -5.439  1.00  0.00           C  
ATOM    635  O   ILE A  47       2.656  -6.889  -5.231  1.00  0.00           O  
ATOM    636  CB  ILE A  47       5.630  -5.989  -6.533  1.00  0.00           C  
ATOM    637  CG1 ILE A  47       4.595  -5.222  -7.381  1.00  0.00           C  
ATOM    638  CG2 ILE A  47       6.228  -7.084  -7.422  1.00  0.00           C  
ATOM    639  CD1 ILE A  47       4.341  -3.815  -6.836  1.00  0.00           C  
ATOM    640  H   ILE A  47       6.732  -7.797  -4.893  1.00  0.00           H  
ATOM    641  HA  ILE A  47       4.743  -5.676  -4.604  1.00  0.00           H  
ATOM    642  HB  ILE A  47       6.444  -5.310  -6.276  1.00  0.00           H  
ATOM    643 HG12 ILE A  47       4.976  -5.112  -8.396  1.00  0.00           H  
ATOM    644 HG13 ILE A  47       3.651  -5.772  -7.449  1.00  0.00           H  
ATOM    645 HG21 ILE A  47       6.989  -7.643  -6.884  1.00  0.00           H  
ATOM    646 HG22 ILE A  47       5.439  -7.751  -7.765  1.00  0.00           H  
ATOM    647 HG23 ILE A  47       6.701  -6.631  -8.293  1.00  0.00           H  
ATOM    648 HD11 ILE A  47       3.970  -3.866  -5.816  1.00  0.00           H  
ATOM    649 HD12 ILE A  47       5.267  -3.239  -6.853  1.00  0.00           H  
ATOM    650 HD13 ILE A  47       3.602  -3.312  -7.461  1.00  0.00           H  
ATOM    651  N   GLU A  48       3.930  -8.623  -5.830  1.00  0.00           N  
ATOM    652  CA  GLU A  48       2.836  -9.525  -6.125  1.00  0.00           C  
ATOM    653  C   GLU A  48       1.930  -9.663  -4.902  1.00  0.00           C  
ATOM    654  O   GLU A  48       0.709  -9.669  -5.030  1.00  0.00           O  
ATOM    655  CB  GLU A  48       3.405 -10.870  -6.592  1.00  0.00           C  
ATOM    656  CG  GLU A  48       4.424 -10.678  -7.731  1.00  0.00           C  
ATOM    657  CD  GLU A  48       5.874 -10.731  -7.253  1.00  0.00           C  
ATOM    658  OE1 GLU A  48       6.192  -9.947  -6.330  1.00  0.00           O  
ATOM    659  OE2 GLU A  48       6.632 -11.544  -7.817  1.00  0.00           O  
ATOM    660  H   GLU A  48       4.874  -8.979  -5.972  1.00  0.00           H  
ATOM    661  HA  GLU A  48       2.251  -9.100  -6.942  1.00  0.00           H  
ATOM    662  HB2 GLU A  48       3.884 -11.393  -5.763  1.00  0.00           H  
ATOM    663  HB3 GLU A  48       2.575 -11.481  -6.952  1.00  0.00           H  
ATOM    664  HG2 GLU A  48       4.287 -11.469  -8.461  1.00  0.00           H  
ATOM    665  HG3 GLU A  48       4.247  -9.738  -8.249  1.00  0.00           H  
ATOM    666  N   ALA A  49       2.531  -9.725  -3.711  1.00  0.00           N  
ATOM    667  CA  ALA A  49       1.790  -9.776  -2.462  1.00  0.00           C  
ATOM    668  C   ALA A  49       0.979  -8.493  -2.271  1.00  0.00           C  
ATOM    669  O   ALA A  49      -0.212  -8.558  -2.010  1.00  0.00           O  
ATOM    670  CB  ALA A  49       2.743 -10.034  -1.292  1.00  0.00           C  
ATOM    671  H   ALA A  49       3.536  -9.653  -3.680  1.00  0.00           H  
ATOM    672  HA  ALA A  49       1.095 -10.616  -2.512  1.00  0.00           H  
ATOM    673  HB1 ALA A  49       3.331 -10.932  -1.483  1.00  0.00           H  
ATOM    674  HB2 ALA A  49       3.412  -9.186  -1.143  1.00  0.00           H  
ATOM    675  HB3 ALA A  49       2.164 -10.195  -0.385  1.00  0.00           H  
ATOM    676  N   ILE A  50       1.606  -7.324  -2.418  1.00  0.00           N  
ATOM    677  CA  ILE A  50       0.976  -6.020  -2.278  1.00  0.00           C  
ATOM    678  C   ILE A  50      -0.179  -5.903  -3.271  1.00  0.00           C  
ATOM    679  O   ILE A  50      -1.285  -5.565  -2.864  1.00  0.00           O  
ATOM    680  CB  ILE A  50       2.066  -4.920  -2.332  1.00  0.00           C  
ATOM    681  CG1 ILE A  50       1.952  -3.980  -1.124  1.00  0.00           C  
ATOM    682  CG2 ILE A  50       2.037  -4.078  -3.597  1.00  0.00           C  
ATOM    683  CD1 ILE A  50       3.047  -2.906  -1.085  1.00  0.00           C  
ATOM    684  H   ILE A  50       2.556  -7.329  -2.743  1.00  0.00           H  
ATOM    685  HA  ILE A  50       0.485  -5.944  -1.308  1.00  0.00           H  
ATOM    686  HB  ILE A  50       3.049  -5.390  -2.276  1.00  0.00           H  
ATOM    687 HG12 ILE A  50       0.972  -3.501  -1.130  1.00  0.00           H  
ATOM    688 HG13 ILE A  50       2.054  -4.585  -0.228  1.00  0.00           H  
ATOM    689 HG21 ILE A  50       2.045  -4.689  -4.492  1.00  0.00           H  
ATOM    690 HG22 ILE A  50       1.138  -3.464  -3.577  1.00  0.00           H  
ATOM    691 HG23 ILE A  50       2.924  -3.448  -3.632  1.00  0.00           H  
ATOM    692 HD11 ILE A  50       4.028  -3.368  -1.194  1.00  0.00           H  
ATOM    693 HD12 ILE A  50       2.898  -2.167  -1.871  1.00  0.00           H  
ATOM    694 HD13 ILE A  50       3.013  -2.383  -0.132  1.00  0.00           H  
ATOM    695  N   VAL A  51       0.033  -6.257  -4.541  1.00  0.00           N  
ATOM    696  CA  VAL A  51      -1.034  -6.347  -5.529  1.00  0.00           C  
ATOM    697  C   VAL A  51      -2.155  -7.236  -4.972  1.00  0.00           C  
ATOM    698  O   VAL A  51      -3.283  -6.789  -4.784  1.00  0.00           O  
ATOM    699  CB  VAL A  51      -0.459  -6.849  -6.868  1.00  0.00           C  
ATOM    700  CG1 VAL A  51      -1.553  -7.295  -7.847  1.00  0.00           C  
ATOM    701  CG2 VAL A  51       0.370  -5.735  -7.525  1.00  0.00           C  
ATOM    702  H   VAL A  51       0.968  -6.542  -4.813  1.00  0.00           H  
ATOM    703  HA  VAL A  51      -1.423  -5.343  -5.695  1.00  0.00           H  
ATOM    704  HB  VAL A  51       0.192  -7.703  -6.687  1.00  0.00           H  
ATOM    705 HG11 VAL A  51      -2.290  -6.505  -7.973  1.00  0.00           H  
ATOM    706 HG12 VAL A  51      -1.109  -7.526  -8.816  1.00  0.00           H  
ATOM    707 HG13 VAL A  51      -2.053  -8.192  -7.481  1.00  0.00           H  
ATOM    708 HG21 VAL A  51       1.154  -5.393  -6.851  1.00  0.00           H  
ATOM    709 HG22 VAL A  51       0.835  -6.111  -8.437  1.00  0.00           H  
ATOM    710 HG23 VAL A  51      -0.270  -4.889  -7.777  1.00  0.00           H  
ATOM    711  N   TYR A  52      -1.823  -8.482  -4.632  1.00  0.00           N  
ATOM    712  CA  TYR A  52      -2.777  -9.489  -4.186  1.00  0.00           C  
ATOM    713  C   TYR A  52      -3.238  -9.288  -2.730  1.00  0.00           C  
ATOM    714  O   TYR A  52      -3.865 -10.184  -2.168  1.00  0.00           O  
ATOM    715  CB  TYR A  52      -2.127 -10.868  -4.413  1.00  0.00           C  
ATOM    716  CG  TYR A  52      -2.994 -12.097  -4.194  1.00  0.00           C  
ATOM    717  CD1 TYR A  52      -4.243 -12.211  -4.830  1.00  0.00           C  
ATOM    718  CD2 TYR A  52      -2.499 -13.181  -3.443  1.00  0.00           C  
ATOM    719  CE1 TYR A  52      -5.018 -13.373  -4.674  1.00  0.00           C  
ATOM    720  CE2 TYR A  52      -3.258 -14.358  -3.317  1.00  0.00           C  
ATOM    721  CZ  TYR A  52      -4.522 -14.449  -3.920  1.00  0.00           C  
ATOM    722  OH  TYR A  52      -5.246 -15.598  -3.808  1.00  0.00           O  
ATOM    723  H   TYR A  52      -0.861  -8.778  -4.753  1.00  0.00           H  
ATOM    724  HA  TYR A  52      -3.657  -9.415  -4.824  1.00  0.00           H  
ATOM    725  HB2 TYR A  52      -1.777 -10.911  -5.445  1.00  0.00           H  
ATOM    726  HB3 TYR A  52      -1.255 -10.931  -3.761  1.00  0.00           H  
ATOM    727  HD1 TYR A  52      -4.599 -11.425  -5.471  1.00  0.00           H  
ATOM    728  HD2 TYR A  52      -1.521 -13.127  -2.988  1.00  0.00           H  
ATOM    729  HE1 TYR A  52      -5.973 -13.441  -5.175  1.00  0.00           H  
ATOM    730  HE2 TYR A  52      -2.864 -15.197  -2.763  1.00  0.00           H  
ATOM    731  HH  TYR A  52      -6.091 -15.547  -4.257  1.00  0.00           H  
ATOM    732  N   GLN A  53      -2.979  -8.134  -2.100  1.00  0.00           N  
ATOM    733  CA  GLN A  53      -3.389  -7.829  -0.746  1.00  0.00           C  
ATOM    734  C   GLN A  53      -4.196  -6.549  -0.831  1.00  0.00           C  
ATOM    735  O   GLN A  53      -5.325  -6.541  -0.375  1.00  0.00           O  
ATOM    736  CB  GLN A  53      -2.186  -7.737   0.209  1.00  0.00           C  
ATOM    737  CG  GLN A  53      -2.605  -7.914   1.675  1.00  0.00           C  
ATOM    738  CD  GLN A  53      -3.047  -6.611   2.332  1.00  0.00           C  
ATOM    739  OE1 GLN A  53      -4.172  -6.153   2.159  1.00  0.00           O  
ATOM    740  NE2 GLN A  53      -2.182  -6.018   3.146  1.00  0.00           N  
ATOM    741  H   GLN A  53      -2.559  -7.363  -2.591  1.00  0.00           H  
ATOM    742  HA  GLN A  53      -4.049  -8.614  -0.380  1.00  0.00           H  
ATOM    743  HB2 GLN A  53      -1.506  -8.560  -0.004  1.00  0.00           H  
ATOM    744  HB3 GLN A  53      -1.639  -6.805   0.067  1.00  0.00           H  
ATOM    745  HG2 GLN A  53      -3.405  -8.651   1.751  1.00  0.00           H  
ATOM    746  HG3 GLN A  53      -1.753  -8.313   2.225  1.00  0.00           H  
ATOM    747 HE21 GLN A  53      -1.303  -6.459   3.359  1.00  0.00           H  
ATOM    748 HE22 GLN A  53      -2.455  -5.154   3.584  1.00  0.00           H  
ATOM    749  N   ILE A  54      -3.685  -5.498  -1.476  1.00  0.00           N  
ATOM    750  CA  ILE A  54      -4.414  -4.258  -1.690  1.00  0.00           C  
ATOM    751  C   ILE A  54      -5.834  -4.542  -2.201  1.00  0.00           C  
ATOM    752  O   ILE A  54      -6.813  -4.014  -1.673  1.00  0.00           O  
ATOM    753  CB  ILE A  54      -3.565  -3.314  -2.584  1.00  0.00           C  
ATOM    754  CG1 ILE A  54      -3.695  -1.814  -2.339  1.00  0.00           C  
ATOM    755  CG2 ILE A  54      -3.824  -3.433  -4.088  1.00  0.00           C  
ATOM    756  CD1 ILE A  54      -3.848  -1.425  -0.886  1.00  0.00           C  
ATOM    757  H   ILE A  54      -2.747  -5.546  -1.850  1.00  0.00           H  
ATOM    758  HA  ILE A  54      -4.504  -3.851  -0.687  1.00  0.00           H  
ATOM    759  HB  ILE A  54      -2.516  -3.527  -2.386  1.00  0.00           H  
ATOM    760 HG12 ILE A  54      -2.766  -1.384  -2.715  1.00  0.00           H  
ATOM    761 HG13 ILE A  54      -4.544  -1.410  -2.886  1.00  0.00           H  
ATOM    762 HG21 ILE A  54      -3.651  -4.444  -4.434  1.00  0.00           H  
ATOM    763 HG22 ILE A  54      -4.852  -3.133  -4.294  1.00  0.00           H  
ATOM    764 HG23 ILE A  54      -3.166  -2.751  -4.631  1.00  0.00           H  
ATOM    765 HD11 ILE A  54      -3.025  -1.828  -0.296  1.00  0.00           H  
ATOM    766 HD12 ILE A  54      -3.862  -0.348  -0.830  1.00  0.00           H  
ATOM    767 HD13 ILE A  54      -4.810  -1.774  -0.531  1.00  0.00           H  
ATOM    768  N   GLU A  55      -5.970  -5.438  -3.181  1.00  0.00           N  
ATOM    769  CA  GLU A  55      -7.285  -5.806  -3.674  1.00  0.00           C  
ATOM    770  C   GLU A  55      -8.102  -6.592  -2.639  1.00  0.00           C  
ATOM    771  O   GLU A  55      -9.313  -6.415  -2.567  1.00  0.00           O  
ATOM    772  CB  GLU A  55      -7.161  -6.518  -5.024  1.00  0.00           C  
ATOM    773  CG  GLU A  55      -6.473  -7.889  -4.968  1.00  0.00           C  
ATOM    774  CD  GLU A  55      -6.181  -8.430  -6.365  1.00  0.00           C  
ATOM    775  OE1 GLU A  55      -6.356  -7.667  -7.338  1.00  0.00           O  
ATOM    776  OE2 GLU A  55      -5.786  -9.612  -6.433  1.00  0.00           O  
ATOM    777  H   GLU A  55      -5.154  -5.869  -3.601  1.00  0.00           H  
ATOM    778  HA  GLU A  55      -7.828  -4.882  -3.877  1.00  0.00           H  
ATOM    779  HB2 GLU A  55      -8.152  -6.654  -5.459  1.00  0.00           H  
ATOM    780  HB3 GLU A  55      -6.593  -5.872  -5.693  1.00  0.00           H  
ATOM    781  HG2 GLU A  55      -5.534  -7.825  -4.427  1.00  0.00           H  
ATOM    782  HG3 GLU A  55      -7.121  -8.603  -4.461  1.00  0.00           H  
ATOM    783  N   ASN A  56      -7.471  -7.446  -1.824  1.00  0.00           N  
ATOM    784  CA  ASN A  56      -8.188  -8.382  -0.962  1.00  0.00           C  
ATOM    785  C   ASN A  56      -8.612  -7.693   0.331  1.00  0.00           C  
ATOM    786  O   ASN A  56      -9.706  -7.942   0.830  1.00  0.00           O  
ATOM    787  CB  ASN A  56      -7.344  -9.638  -0.686  1.00  0.00           C  
ATOM    788  CG  ASN A  56      -7.539 -10.697  -1.771  1.00  0.00           C  
ATOM    789  OD1 ASN A  56      -8.614 -11.276  -1.886  1.00  0.00           O  
ATOM    790  ND2 ASN A  56      -6.515 -10.982  -2.569  1.00  0.00           N  
ATOM    791  H   ASN A  56      -6.477  -7.331  -1.666  1.00  0.00           H  
ATOM    792  HA  ASN A  56      -9.106  -8.701  -1.461  1.00  0.00           H  
ATOM    793  HB2 ASN A  56      -6.292  -9.377  -0.579  1.00  0.00           H  
ATOM    794  HB3 ASN A  56      -7.678 -10.086   0.250  1.00  0.00           H  
ATOM    795 HD21 ASN A  56      -5.605 -10.551  -2.434  1.00  0.00           H  
ATOM    796 HD22 ASN A  56      -6.649 -11.639  -3.321  1.00  0.00           H  
ATOM    797  N   GLY A  57      -7.754  -6.825   0.871  1.00  0.00           N  
ATOM    798  CA  GLY A  57      -8.091  -6.020   2.042  1.00  0.00           C  
ATOM    799  C   GLY A  57      -7.820  -6.791   3.333  1.00  0.00           C  
ATOM    800  O   GLY A  57      -8.702  -7.432   3.899  1.00  0.00           O  
ATOM    801  H   GLY A  57      -6.847  -6.709   0.414  1.00  0.00           H  
ATOM    802  HA2 GLY A  57      -7.497  -5.107   2.025  1.00  0.00           H  
ATOM    803  HA3 GLY A  57      -9.144  -5.737   2.021  1.00  0.00           H  
ATOM    804  N   LYS A  58      -6.573  -6.738   3.796  1.00  0.00           N  
ATOM    805  CA  LYS A  58      -6.121  -7.491   4.966  1.00  0.00           C  
ATOM    806  C   LYS A  58      -6.452  -6.754   6.265  1.00  0.00           C  
ATOM    807  O   LYS A  58      -5.924  -5.677   6.519  1.00  0.00           O  
ATOM    808  CB  LYS A  58      -4.623  -7.756   4.829  1.00  0.00           C  
ATOM    809  CG  LYS A  58      -3.968  -8.491   6.006  1.00  0.00           C  
ATOM    810  CD  LYS A  58      -3.268  -7.480   6.927  1.00  0.00           C  
ATOM    811  CE  LYS A  58      -2.373  -8.149   7.968  1.00  0.00           C  
ATOM    812  NZ  LYS A  58      -3.125  -8.705   9.105  1.00  0.00           N  
ATOM    813  H   LYS A  58      -5.919  -6.157   3.276  1.00  0.00           H  
ATOM    814  HA  LYS A  58      -6.587  -8.475   4.994  1.00  0.00           H  
ATOM    815  HB2 LYS A  58      -4.486  -8.364   3.934  1.00  0.00           H  
ATOM    816  HB3 LYS A  58      -4.134  -6.794   4.697  1.00  0.00           H  
ATOM    817  HG2 LYS A  58      -4.703  -9.093   6.542  1.00  0.00           H  
ATOM    818  HG3 LYS A  58      -3.211  -9.160   5.590  1.00  0.00           H  
ATOM    819  HD2 LYS A  58      -2.621  -6.843   6.319  1.00  0.00           H  
ATOM    820  HD3 LYS A  58      -3.989  -6.838   7.426  1.00  0.00           H  
ATOM    821  HE2 LYS A  58      -1.787  -8.930   7.483  1.00  0.00           H  
ATOM    822  HE3 LYS A  58      -1.707  -7.381   8.363  1.00  0.00           H  
ATOM    823  HZ1 LYS A  58      -3.641  -7.946   9.548  1.00  0.00           H  
ATOM    824  HZ2 LYS A  58      -3.770  -9.417   8.803  1.00  0.00           H  
ATOM    825  HZ3 LYS A  58      -2.483  -9.084   9.785  1.00  0.00           H  
ATOM    826  N   GLY A  59      -7.251  -7.370   7.137  1.00  0.00           N  
ATOM    827  CA  GLY A  59      -7.504  -6.867   8.470  1.00  0.00           C  
ATOM    828  C   GLY A  59      -8.330  -5.593   8.408  1.00  0.00           C  
ATOM    829  O   GLY A  59      -9.280  -5.484   7.636  1.00  0.00           O  
ATOM    830  H   GLY A  59      -7.751  -8.194   6.864  1.00  0.00           H  
ATOM    831  HA2 GLY A  59      -8.048  -7.616   9.046  1.00  0.00           H  
ATOM    832  HA3 GLY A  59      -6.554  -6.664   8.964  1.00  0.00           H  
ATOM    833  N   ALA A  60      -7.951  -4.615   9.225  1.00  0.00           N  
ATOM    834  CA  ALA A  60      -8.660  -3.348   9.355  1.00  0.00           C  
ATOM    835  C   ALA A  60      -8.313  -2.409   8.197  1.00  0.00           C  
ATOM    836  O   ALA A  60      -7.937  -1.258   8.419  1.00  0.00           O  
ATOM    837  CB  ALA A  60      -8.339  -2.720  10.716  1.00  0.00           C  
ATOM    838  H   ALA A  60      -7.106  -4.783   9.748  1.00  0.00           H  
ATOM    839  HA  ALA A  60      -9.735  -3.534   9.324  1.00  0.00           H  
ATOM    840  HB1 ALA A  60      -8.606  -3.410  11.516  1.00  0.00           H  
ATOM    841  HB2 ALA A  60      -7.277  -2.485  10.783  1.00  0.00           H  
ATOM    842  HB3 ALA A  60      -8.920  -1.804  10.834  1.00  0.00           H  
ATOM    843  N   MET A  61      -8.432  -2.899   6.962  1.00  0.00           N  
ATOM    844  CA  MET A  61      -8.034  -2.186   5.769  1.00  0.00           C  
ATOM    845  C   MET A  61      -9.102  -2.407   4.698  1.00  0.00           C  
ATOM    846  O   MET A  61      -9.472  -3.553   4.450  1.00  0.00           O  
ATOM    847  CB  MET A  61      -6.682  -2.745   5.346  1.00  0.00           C  
ATOM    848  CG  MET A  61      -6.217  -2.316   3.959  1.00  0.00           C  
ATOM    849  SD  MET A  61      -4.429  -2.121   3.858  1.00  0.00           S  
ATOM    850  CE  MET A  61      -4.127  -2.669   2.176  1.00  0.00           C  
ATOM    851  H   MET A  61      -8.739  -3.860   6.819  1.00  0.00           H  
ATOM    852  HA  MET A  61      -7.902  -1.134   6.006  1.00  0.00           H  
ATOM    853  HB2 MET A  61      -5.938  -2.477   6.096  1.00  0.00           H  
ATOM    854  HB3 MET A  61      -6.764  -3.827   5.310  1.00  0.00           H  
ATOM    855  HG2 MET A  61      -6.499  -3.136   3.290  1.00  0.00           H  
ATOM    856  HG3 MET A  61      -6.687  -1.395   3.619  1.00  0.00           H  
ATOM    857  HE1 MET A  61      -4.646  -3.607   1.989  1.00  0.00           H  
ATOM    858  HE2 MET A  61      -4.524  -1.888   1.542  1.00  0.00           H  
ATOM    859  HE3 MET A  61      -3.063  -2.812   2.003  1.00  0.00           H  
ATOM    860  N   PRO A  62      -9.610  -1.337   4.069  1.00  0.00           N  
ATOM    861  CA  PRO A  62     -10.587  -1.453   3.002  1.00  0.00           C  
ATOM    862  C   PRO A  62      -9.997  -2.268   1.846  1.00  0.00           C  
ATOM    863  O   PRO A  62      -8.818  -2.122   1.529  1.00  0.00           O  
ATOM    864  CB  PRO A  62     -10.950  -0.012   2.608  1.00  0.00           C  
ATOM    865  CG  PRO A  62      -9.796   0.843   3.143  1.00  0.00           C  
ATOM    866  CD  PRO A  62      -9.272   0.051   4.330  1.00  0.00           C  
ATOM    867  HA  PRO A  62     -11.478  -1.957   3.381  1.00  0.00           H  
ATOM    868  HB2 PRO A  62     -11.079   0.108   1.530  1.00  0.00           H  
ATOM    869  HB3 PRO A  62     -11.868   0.275   3.123  1.00  0.00           H  
ATOM    870  HG2 PRO A  62      -9.006   0.902   2.398  1.00  0.00           H  
ATOM    871  HG3 PRO A  62     -10.092   1.845   3.460  1.00  0.00           H  
ATOM    872  HD2 PRO A  62      -8.201   0.234   4.409  1.00  0.00           H  
ATOM    873  HD3 PRO A  62      -9.784   0.362   5.240  1.00  0.00           H  
ATOM    874  N   ALA A  63     -10.812  -3.136   1.240  1.00  0.00           N  
ATOM    875  CA  ALA A  63     -10.458  -3.882   0.039  1.00  0.00           C  
ATOM    876  C   ALA A  63     -10.582  -2.949  -1.163  1.00  0.00           C  
ATOM    877  O   ALA A  63     -11.526  -2.160  -1.228  1.00  0.00           O  
ATOM    878  CB  ALA A  63     -11.397  -5.083  -0.105  1.00  0.00           C  
ATOM    879  H   ALA A  63     -11.769  -3.203   1.549  1.00  0.00           H  
ATOM    880  HA  ALA A  63      -9.433  -4.245   0.118  1.00  0.00           H  
ATOM    881  HB1 ALA A  63     -11.314  -5.730   0.769  1.00  0.00           H  
ATOM    882  HB2 ALA A  63     -12.429  -4.744  -0.204  1.00  0.00           H  
ATOM    883  HB3 ALA A  63     -11.134  -5.656  -0.993  1.00  0.00           H  
ATOM    884  N   TRP A  64      -9.615  -2.992  -2.083  1.00  0.00           N  
ATOM    885  CA  TRP A  64      -9.536  -2.041  -3.186  1.00  0.00           C  
ATOM    886  C   TRP A  64      -9.858  -2.671  -4.550  1.00  0.00           C  
ATOM    887  O   TRP A  64      -9.766  -1.996  -5.578  1.00  0.00           O  
ATOM    888  CB  TRP A  64      -8.161  -1.380  -3.134  1.00  0.00           C  
ATOM    889  CG  TRP A  64      -7.919  -0.539  -1.914  1.00  0.00           C  
ATOM    890  CD1 TRP A  64      -7.381  -0.951  -0.747  1.00  0.00           C  
ATOM    891  CD2 TRP A  64      -8.312   0.846  -1.688  1.00  0.00           C  
ATOM    892  NE1 TRP A  64      -7.365   0.088   0.159  1.00  0.00           N  
ATOM    893  CE2 TRP A  64      -7.946   1.222  -0.363  1.00  0.00           C  
ATOM    894  CE3 TRP A  64      -8.973   1.816  -2.464  1.00  0.00           C  
ATOM    895  CZ2 TRP A  64      -8.207   2.500   0.154  1.00  0.00           C  
ATOM    896  CZ3 TRP A  64      -9.270   3.090  -1.949  1.00  0.00           C  
ATOM    897  CH2 TRP A  64      -8.879   3.437  -0.645  1.00  0.00           C  
ATOM    898  H   TRP A  64      -8.829  -3.622  -1.948  1.00  0.00           H  
ATOM    899  HA  TRP A  64     -10.249  -1.229  -3.054  1.00  0.00           H  
ATOM    900  HB2 TRP A  64      -7.387  -2.133  -3.257  1.00  0.00           H  
ATOM    901  HB3 TRP A  64      -8.094  -0.714  -3.979  1.00  0.00           H  
ATOM    902  HD1 TRP A  64      -7.047  -1.950  -0.526  1.00  0.00           H  
ATOM    903  HE1 TRP A  64      -7.037  -0.037   1.104  1.00  0.00           H  
ATOM    904  HE3 TRP A  64      -9.267   1.554  -3.463  1.00  0.00           H  
ATOM    905  HZ2 TRP A  64      -7.917   2.758   1.157  1.00  0.00           H  
ATOM    906  HZ3 TRP A  64      -9.812   3.799  -2.556  1.00  0.00           H  
ATOM    907  HH2 TRP A  64      -9.104   4.420  -0.256  1.00  0.00           H  
ATOM    908  N   ASP A  65     -10.307  -3.928  -4.572  1.00  0.00           N  
ATOM    909  CA  ASP A  65     -10.607  -4.713  -5.770  1.00  0.00           C  
ATOM    910  C   ASP A  65     -11.562  -4.045  -6.753  1.00  0.00           C  
ATOM    911  O   ASP A  65     -11.547  -4.328  -7.948  1.00  0.00           O  
ATOM    912  CB  ASP A  65     -11.165  -6.083  -5.358  1.00  0.00           C  
ATOM    913  CG  ASP A  65     -12.464  -5.957  -4.567  1.00  0.00           C  
ATOM    914  OD1 ASP A  65     -12.449  -5.194  -3.574  1.00  0.00           O  
ATOM    915  OD2 ASP A  65     -13.452  -6.598  -4.981  1.00  0.00           O  
ATOM    916  H   ASP A  65     -10.583  -4.375  -3.700  1.00  0.00           H  
ATOM    917  HA  ASP A  65      -9.679  -4.812  -6.304  1.00  0.00           H  
ATOM    918  HB2 ASP A  65     -11.355  -6.671  -6.256  1.00  0.00           H  
ATOM    919  HB3 ASP A  65     -10.441  -6.621  -4.752  1.00  0.00           H  
ATOM    920  N   GLY A  66     -12.382  -3.152  -6.226  1.00  0.00           N  
ATOM    921  CA  GLY A  66     -13.412  -2.427  -6.955  1.00  0.00           C  
ATOM    922  C   GLY A  66     -13.237  -0.915  -6.870  1.00  0.00           C  
ATOM    923  O   GLY A  66     -14.196  -0.185  -7.114  1.00  0.00           O  
ATOM    924  H   GLY A  66     -12.224  -3.038  -5.239  1.00  0.00           H  
ATOM    925  HA2 GLY A  66     -13.409  -2.699  -8.011  1.00  0.00           H  
ATOM    926  HA3 GLY A  66     -14.384  -2.693  -6.539  1.00  0.00           H  
ATOM    927  N   ARG A  67     -12.039  -0.427  -6.520  1.00  0.00           N  
ATOM    928  CA  ARG A  67     -11.786   1.008  -6.414  1.00  0.00           C  
ATOM    929  C   ARG A  67     -10.593   1.479  -7.245  1.00  0.00           C  
ATOM    930  O   ARG A  67     -10.432   2.690  -7.377  1.00  0.00           O  
ATOM    931  CB  ARG A  67     -11.571   1.376  -4.936  1.00  0.00           C  
ATOM    932  CG  ARG A  67     -12.880   1.666  -4.191  1.00  0.00           C  
ATOM    933  CD  ARG A  67     -13.170   3.173  -4.100  1.00  0.00           C  
ATOM    934  NE  ARG A  67     -13.156   3.821  -5.424  1.00  0.00           N  
ATOM    935  CZ  ARG A  67     -13.880   4.895  -5.777  1.00  0.00           C  
ATOM    936  NH1 ARG A  67     -14.545   5.589  -4.846  1.00  0.00           N  
ATOM    937  NH2 ARG A  67     -13.934   5.268  -7.060  1.00  0.00           N  
ATOM    938  H   ARG A  67     -11.291  -1.068  -6.255  1.00  0.00           H  
ATOM    939  HA  ARG A  67     -12.633   1.573  -6.800  1.00  0.00           H  
ATOM    940  HB2 ARG A  67     -11.065   0.542  -4.450  1.00  0.00           H  
ATOM    941  HB3 ARG A  67     -10.928   2.253  -4.855  1.00  0.00           H  
ATOM    942  HG2 ARG A  67     -13.711   1.145  -4.670  1.00  0.00           H  
ATOM    943  HG3 ARG A  67     -12.787   1.284  -3.172  1.00  0.00           H  
ATOM    944  HD2 ARG A  67     -14.143   3.274  -3.617  1.00  0.00           H  
ATOM    945  HD3 ARG A  67     -12.411   3.642  -3.469  1.00  0.00           H  
ATOM    946  HE  ARG A  67     -12.522   3.426  -6.107  1.00  0.00           H  
ATOM    947 HH11 ARG A  67     -14.440   5.334  -3.876  1.00  0.00           H  
ATOM    948 HH12 ARG A  67     -15.108   6.393  -5.079  1.00  0.00           H  
ATOM    949 HH21 ARG A  67     -13.435   4.739  -7.763  1.00  0.00           H  
ATOM    950 HH22 ARG A  67     -14.479   6.063  -7.357  1.00  0.00           H  
ATOM    951  N   LEU A  68      -9.746   0.560  -7.724  1.00  0.00           N  
ATOM    952  CA  LEU A  68      -8.315   0.832  -7.856  1.00  0.00           C  
ATOM    953  C   LEU A  68      -7.716   0.273  -9.164  1.00  0.00           C  
ATOM    954  O   LEU A  68      -6.552   0.527  -9.430  1.00  0.00           O  
ATOM    955  CB  LEU A  68      -7.661   0.251  -6.579  1.00  0.00           C  
ATOM    956  CG  LEU A  68      -6.708   1.115  -5.731  1.00  0.00           C  
ATOM    957  CD1 LEU A  68      -5.317   1.195  -6.335  1.00  0.00           C  
ATOM    958  CD2 LEU A  68      -7.220   2.526  -5.479  1.00  0.00           C  
ATOM    959  H   LEU A  68      -9.986  -0.412  -7.602  1.00  0.00           H  
ATOM    960  HA  LEU A  68      -8.150   1.908  -7.894  1.00  0.00           H  
ATOM    961  HB2 LEU A  68      -8.475   0.039  -5.894  1.00  0.00           H  
ATOM    962  HB3 LEU A  68      -7.190  -0.700  -6.808  1.00  0.00           H  
ATOM    963  HG  LEU A  68      -6.601   0.652  -4.746  1.00  0.00           H  
ATOM    964 HD11 LEU A  68      -5.405   1.534  -7.358  1.00  0.00           H  
ATOM    965 HD12 LEU A  68      -4.705   1.902  -5.779  1.00  0.00           H  
ATOM    966 HD13 LEU A  68      -4.857   0.213  -6.300  1.00  0.00           H  
ATOM    967 HD21 LEU A  68      -8.268   2.495  -5.196  1.00  0.00           H  
ATOM    968 HD22 LEU A  68      -6.632   2.955  -4.668  1.00  0.00           H  
ATOM    969 HD23 LEU A  68      -7.103   3.133  -6.373  1.00  0.00           H  
ATOM    970  N   ASP A  69      -8.502  -0.449  -9.977  1.00  0.00           N  
ATOM    971  CA  ASP A  69      -8.248  -0.952 -11.330  1.00  0.00           C  
ATOM    972  C   ASP A  69      -6.902  -1.662 -11.567  1.00  0.00           C  
ATOM    973  O   ASP A  69      -5.957  -1.545 -10.797  1.00  0.00           O  
ATOM    974  CB  ASP A  69      -8.524   0.161 -12.356  1.00  0.00           C  
ATOM    975  CG  ASP A  69      -9.220  -0.378 -13.600  1.00  0.00           C  
ATOM    976  OD1 ASP A  69      -8.690  -1.359 -14.164  1.00  0.00           O  
ATOM    977  OD2 ASP A  69     -10.290   0.172 -13.935  1.00  0.00           O  
ATOM    978  H   ASP A  69      -9.455  -0.552  -9.706  1.00  0.00           H  
ATOM    979  HA  ASP A  69      -9.015  -1.715 -11.473  1.00  0.00           H  
ATOM    980  HB2 ASP A  69      -9.184   0.911 -11.919  1.00  0.00           H  
ATOM    981  HB3 ASP A  69      -7.596   0.654 -12.643  1.00  0.00           H  
ATOM    982  N   GLU A  70      -6.761  -2.377 -12.683  1.00  0.00           N  
ATOM    983  CA  GLU A  70      -5.487  -2.996 -13.042  1.00  0.00           C  
ATOM    984  C   GLU A  70      -4.364  -1.954 -13.168  1.00  0.00           C  
ATOM    985  O   GLU A  70      -3.188  -2.311 -13.084  1.00  0.00           O  
ATOM    986  CB  GLU A  70      -5.627  -3.839 -14.320  1.00  0.00           C  
ATOM    987  CG  GLU A  70      -6.129  -5.256 -13.999  1.00  0.00           C  
ATOM    988  CD  GLU A  70      -6.188  -6.153 -15.232  1.00  0.00           C  
ATOM    989  OE1 GLU A  70      -5.284  -6.017 -16.086  1.00  0.00           O  
ATOM    990  OE2 GLU A  70      -7.124  -6.979 -15.290  1.00  0.00           O  
ATOM    991  H   GLU A  70      -7.513  -2.319 -13.374  1.00  0.00           H  
ATOM    992  HA  GLU A  70      -5.192  -3.662 -12.229  1.00  0.00           H  
ATOM    993  HB2 GLU A  70      -6.299  -3.355 -15.030  1.00  0.00           H  
ATOM    994  HB3 GLU A  70      -4.646  -3.933 -14.790  1.00  0.00           H  
ATOM    995  HG2 GLU A  70      -5.445  -5.728 -13.293  1.00  0.00           H  
ATOM    996  HG3 GLU A  70      -7.119  -5.202 -13.547  1.00  0.00           H  
ATOM    997  N   ASP A  71      -4.713  -0.673 -13.334  1.00  0.00           N  
ATOM    998  CA  ASP A  71      -3.733   0.399 -13.407  1.00  0.00           C  
ATOM    999  C   ASP A  71      -3.279   0.731 -11.993  1.00  0.00           C  
ATOM   1000  O   ASP A  71      -2.153   0.431 -11.600  1.00  0.00           O  
ATOM   1001  CB  ASP A  71      -4.312   1.647 -14.099  1.00  0.00           C  
ATOM   1002  CG  ASP A  71      -4.203   1.590 -15.617  1.00  0.00           C  
ATOM   1003  OD1 ASP A  71      -3.068   1.379 -16.096  1.00  0.00           O  
ATOM   1004  OD2 ASP A  71      -5.244   1.804 -16.272  1.00  0.00           O  
ATOM   1005  H   ASP A  71      -5.690  -0.438 -13.223  1.00  0.00           H  
ATOM   1006  HA  ASP A  71      -2.856   0.063 -13.963  1.00  0.00           H  
ATOM   1007  HB2 ASP A  71      -5.350   1.808 -13.808  1.00  0.00           H  
ATOM   1008  HB3 ASP A  71      -3.731   2.518 -13.795  1.00  0.00           H  
ATOM   1009  N   GLU A  72      -4.141   1.383 -11.215  1.00  0.00           N  
ATOM   1010  CA  GLU A  72      -3.722   1.962  -9.953  1.00  0.00           C  
ATOM   1011  C   GLU A  72      -3.365   0.887  -8.915  1.00  0.00           C  
ATOM   1012  O   GLU A  72      -2.488   1.145  -8.090  1.00  0.00           O  
ATOM   1013  CB  GLU A  72      -4.716   3.022  -9.466  1.00  0.00           C  
ATOM   1014  CG  GLU A  72      -4.944   4.127 -10.511  1.00  0.00           C  
ATOM   1015  CD  GLU A  72      -6.024   5.127 -10.101  1.00  0.00           C  
ATOM   1016  OE1 GLU A  72      -6.783   4.813  -9.159  1.00  0.00           O  
ATOM   1017  OE2 GLU A  72      -6.051   6.209 -10.726  1.00  0.00           O  
ATOM   1018  H   GLU A  72      -5.075   1.570 -11.547  1.00  0.00           H  
ATOM   1019  HA  GLU A  72      -2.798   2.508 -10.148  1.00  0.00           H  
ATOM   1020  HB2 GLU A  72      -5.688   2.603  -9.249  1.00  0.00           H  
ATOM   1021  HB3 GLU A  72      -4.320   3.433  -8.539  1.00  0.00           H  
ATOM   1022  HG2 GLU A  72      -4.010   4.661 -10.666  1.00  0.00           H  
ATOM   1023  HG3 GLU A  72      -5.264   3.699 -11.459  1.00  0.00           H  
ATOM   1024  N   ILE A  73      -3.958  -0.319  -8.978  1.00  0.00           N  
ATOM   1025  CA  ILE A  73      -3.475  -1.488  -8.231  1.00  0.00           C  
ATOM   1026  C   ILE A  73      -1.957  -1.602  -8.397  1.00  0.00           C  
ATOM   1027  O   ILE A  73      -1.239  -1.793  -7.417  1.00  0.00           O  
ATOM   1028  CB  ILE A  73      -4.193  -2.783  -8.674  1.00  0.00           C  
ATOM   1029  CG1 ILE A  73      -5.675  -2.852  -8.244  1.00  0.00           C  
ATOM   1030  CG2 ILE A  73      -3.466  -4.050  -8.201  1.00  0.00           C  
ATOM   1031  CD1 ILE A  73      -5.940  -3.107  -6.760  1.00  0.00           C  
ATOM   1032  H   ILE A  73      -4.760  -0.434  -9.603  1.00  0.00           H  
ATOM   1033  HA  ILE A  73      -3.658  -1.349  -7.169  1.00  0.00           H  
ATOM   1034  HB  ILE A  73      -4.155  -2.821  -9.763  1.00  0.00           H  
ATOM   1035 HG12 ILE A  73      -6.168  -1.916  -8.478  1.00  0.00           H  
ATOM   1036 HG13 ILE A  73      -6.161  -3.647  -8.812  1.00  0.00           H  
ATOM   1037 HG21 ILE A  73      -3.256  -4.000  -7.133  1.00  0.00           H  
ATOM   1038 HG22 ILE A  73      -4.087  -4.923  -8.408  1.00  0.00           H  
ATOM   1039 HG23 ILE A  73      -2.528  -4.168  -8.745  1.00  0.00           H  
ATOM   1040 HD11 ILE A  73      -5.467  -4.033  -6.441  1.00  0.00           H  
ATOM   1041 HD12 ILE A  73      -5.558  -2.271  -6.179  1.00  0.00           H  
ATOM   1042 HD13 ILE A  73      -7.019  -3.189  -6.589  1.00  0.00           H  
ATOM   1043  N   ALA A  74      -1.463  -1.457  -9.629  1.00  0.00           N  
ATOM   1044  CA  ALA A  74      -0.038  -1.455  -9.906  1.00  0.00           C  
ATOM   1045  C   ALA A  74       0.578  -0.139  -9.420  1.00  0.00           C  
ATOM   1046  O   ALA A  74       1.547  -0.141  -8.662  1.00  0.00           O  
ATOM   1047  CB  ALA A  74       0.184  -1.683 -11.406  1.00  0.00           C  
ATOM   1048  H   ALA A  74      -2.089  -1.204 -10.387  1.00  0.00           H  
ATOM   1049  HA  ALA A  74       0.426  -2.280  -9.363  1.00  0.00           H  
ATOM   1050  HB1 ALA A  74      -0.426  -2.523 -11.743  1.00  0.00           H  
ATOM   1051  HB2 ALA A  74      -0.101  -0.807 -11.987  1.00  0.00           H  
ATOM   1052  HB3 ALA A  74       1.236  -1.898 -11.585  1.00  0.00           H  
ATOM   1053  N   GLY A  75       0.007   0.984  -9.864  1.00  0.00           N  
ATOM   1054  CA  GLY A  75       0.466   2.336  -9.578  1.00  0.00           C  
ATOM   1055  C   GLY A  75       0.852   2.550  -8.118  1.00  0.00           C  
ATOM   1056  O   GLY A  75       2.008   2.827  -7.791  1.00  0.00           O  
ATOM   1057  H   GLY A  75      -0.800   0.879 -10.471  1.00  0.00           H  
ATOM   1058  HA2 GLY A  75       1.299   2.586 -10.225  1.00  0.00           H  
ATOM   1059  HA3 GLY A  75      -0.340   3.032  -9.800  1.00  0.00           H  
ATOM   1060  N   VAL A  76      -0.141   2.470  -7.233  1.00  0.00           N  
ATOM   1061  CA  VAL A  76       0.040   2.894  -5.857  1.00  0.00           C  
ATOM   1062  C   VAL A  76       0.933   1.905  -5.102  1.00  0.00           C  
ATOM   1063  O   VAL A  76       1.712   2.294  -4.234  1.00  0.00           O  
ATOM   1064  CB  VAL A  76      -1.321   3.152  -5.193  1.00  0.00           C  
ATOM   1065  CG1 VAL A  76      -2.040   1.881  -4.737  1.00  0.00           C  
ATOM   1066  CG2 VAL A  76      -1.149   4.084  -3.994  1.00  0.00           C  
ATOM   1067  H   VAL A  76      -1.056   2.148  -7.540  1.00  0.00           H  
ATOM   1068  HA  VAL A  76       0.550   3.855  -5.904  1.00  0.00           H  
ATOM   1069  HB  VAL A  76      -1.958   3.669  -5.913  1.00  0.00           H  
ATOM   1070 HG11 VAL A  76      -2.180   1.199  -5.573  1.00  0.00           H  
ATOM   1071 HG12 VAL A  76      -1.478   1.376  -3.952  1.00  0.00           H  
ATOM   1072 HG13 VAL A  76      -3.010   2.171  -4.342  1.00  0.00           H  
ATOM   1073 HG21 VAL A  76      -0.588   4.961  -4.305  1.00  0.00           H  
ATOM   1074 HG22 VAL A  76      -2.129   4.403  -3.643  1.00  0.00           H  
ATOM   1075 HG23 VAL A  76      -0.612   3.581  -3.190  1.00  0.00           H  
ATOM   1076  N   ALA A  77       0.847   0.622  -5.461  1.00  0.00           N  
ATOM   1077  CA  ALA A  77       1.687  -0.425  -4.919  1.00  0.00           C  
ATOM   1078  C   ALA A  77       3.131  -0.094  -5.247  1.00  0.00           C  
ATOM   1079  O   ALA A  77       3.982  -0.058  -4.361  1.00  0.00           O  
ATOM   1080  CB  ALA A  77       1.287  -1.746  -5.584  1.00  0.00           C  
ATOM   1081  H   ALA A  77       0.315   0.384  -6.284  1.00  0.00           H  
ATOM   1082  HA  ALA A  77       1.584  -0.470  -3.827  1.00  0.00           H  
ATOM   1083  HB1 ALA A  77       1.183  -1.618  -6.658  1.00  0.00           H  
ATOM   1084  HB2 ALA A  77       2.064  -2.489  -5.438  1.00  0.00           H  
ATOM   1085  HB3 ALA A  77       0.341  -2.105  -5.180  1.00  0.00           H  
ATOM   1086  N   ALA A  78       3.401   0.162  -6.528  1.00  0.00           N  
ATOM   1087  CA  ALA A  78       4.740   0.478  -6.969  1.00  0.00           C  
ATOM   1088  C   ALA A  78       5.272   1.693  -6.214  1.00  0.00           C  
ATOM   1089  O   ALA A  78       6.379   1.645  -5.680  1.00  0.00           O  
ATOM   1090  CB  ALA A  78       4.767   0.697  -8.477  1.00  0.00           C  
ATOM   1091  H   ALA A  78       2.656   0.125  -7.218  1.00  0.00           H  
ATOM   1092  HA  ALA A  78       5.338  -0.396  -6.730  1.00  0.00           H  
ATOM   1093  HB1 ALA A  78       4.381  -0.186  -8.985  1.00  0.00           H  
ATOM   1094  HB2 ALA A  78       4.155   1.563  -8.721  1.00  0.00           H  
ATOM   1095  HB3 ALA A  78       5.792   0.878  -8.802  1.00  0.00           H  
ATOM   1096  N   TYR A  79       4.468   2.764  -6.142  1.00  0.00           N  
ATOM   1097  CA  TYR A  79       4.825   3.943  -5.361  1.00  0.00           C  
ATOM   1098  C   TYR A  79       5.272   3.548  -3.951  1.00  0.00           C  
ATOM   1099  O   TYR A  79       6.425   3.771  -3.580  1.00  0.00           O  
ATOM   1100  CB  TYR A  79       3.650   4.935  -5.324  1.00  0.00           C  
ATOM   1101  CG  TYR A  79       3.775   6.118  -4.371  1.00  0.00           C  
ATOM   1102  CD1 TYR A  79       5.022   6.700  -4.063  1.00  0.00           C  
ATOM   1103  CD2 TYR A  79       2.607   6.667  -3.811  1.00  0.00           C  
ATOM   1104  CE1 TYR A  79       5.093   7.831  -3.231  1.00  0.00           C  
ATOM   1105  CE2 TYR A  79       2.686   7.790  -2.969  1.00  0.00           C  
ATOM   1106  CZ  TYR A  79       3.926   8.362  -2.665  1.00  0.00           C  
ATOM   1107  OH  TYR A  79       3.987   9.456  -1.854  1.00  0.00           O  
ATOM   1108  H   TYR A  79       3.577   2.746  -6.639  1.00  0.00           H  
ATOM   1109  HA  TYR A  79       5.669   4.416  -5.861  1.00  0.00           H  
ATOM   1110  HB2 TYR A  79       3.480   5.315  -6.331  1.00  0.00           H  
ATOM   1111  HB3 TYR A  79       2.759   4.384  -5.036  1.00  0.00           H  
ATOM   1112  HD1 TYR A  79       5.941   6.288  -4.446  1.00  0.00           H  
ATOM   1113  HD2 TYR A  79       1.645   6.238  -4.048  1.00  0.00           H  
ATOM   1114  HE1 TYR A  79       6.042   8.311  -3.058  1.00  0.00           H  
ATOM   1115  HE2 TYR A  79       1.799   8.239  -2.561  1.00  0.00           H  
ATOM   1116  HH  TYR A  79       4.886   9.709  -1.636  1.00  0.00           H  
ATOM   1117  N   VAL A  80       4.366   2.976  -3.153  1.00  0.00           N  
ATOM   1118  CA  VAL A  80       4.673   2.711  -1.752  1.00  0.00           C  
ATOM   1119  C   VAL A  80       5.879   1.771  -1.629  1.00  0.00           C  
ATOM   1120  O   VAL A  80       6.721   1.954  -0.751  1.00  0.00           O  
ATOM   1121  CB  VAL A  80       3.430   2.227  -0.984  1.00  0.00           C  
ATOM   1122  CG1 VAL A  80       2.293   3.255  -1.088  1.00  0.00           C  
ATOM   1123  CG2 VAL A  80       2.963   0.825  -1.350  1.00  0.00           C  
ATOM   1124  H   VAL A  80       3.442   2.756  -3.517  1.00  0.00           H  
ATOM   1125  HA  VAL A  80       4.964   3.663  -1.300  1.00  0.00           H  
ATOM   1126  HB  VAL A  80       3.698   2.123   0.057  1.00  0.00           H  
ATOM   1127 HG11 VAL A  80       2.018   3.456  -2.119  1.00  0.00           H  
ATOM   1128 HG12 VAL A  80       1.408   2.898  -0.566  1.00  0.00           H  
ATOM   1129 HG13 VAL A  80       2.614   4.192  -0.638  1.00  0.00           H  
ATOM   1130 HG21 VAL A  80       3.763   0.117  -1.134  1.00  0.00           H  
ATOM   1131 HG22 VAL A  80       2.101   0.562  -0.737  1.00  0.00           H  
ATOM   1132 HG23 VAL A  80       2.692   0.791  -2.396  1.00  0.00           H  
ATOM   1133  N   TYR A  81       5.982   0.785  -2.527  1.00  0.00           N  
ATOM   1134  CA  TYR A  81       7.094  -0.153  -2.568  1.00  0.00           C  
ATOM   1135  C   TYR A  81       8.426   0.577  -2.789  1.00  0.00           C  
ATOM   1136  O   TYR A  81       9.401   0.279  -2.097  1.00  0.00           O  
ATOM   1137  CB  TYR A  81       6.818  -1.218  -3.636  1.00  0.00           C  
ATOM   1138  CG  TYR A  81       7.717  -2.437  -3.581  1.00  0.00           C  
ATOM   1139  CD1 TYR A  81       8.952  -2.438  -4.256  1.00  0.00           C  
ATOM   1140  CD2 TYR A  81       7.272  -3.607  -2.936  1.00  0.00           C  
ATOM   1141  CE1 TYR A  81       9.720  -3.614  -4.316  1.00  0.00           C  
ATOM   1142  CE2 TYR A  81       8.039  -4.782  -3.001  1.00  0.00           C  
ATOM   1143  CZ  TYR A  81       9.251  -4.791  -3.708  1.00  0.00           C  
ATOM   1144  OH  TYR A  81       9.992  -5.933  -3.757  1.00  0.00           O  
ATOM   1145  H   TYR A  81       5.254   0.684  -3.229  1.00  0.00           H  
ATOM   1146  HA  TYR A  81       7.134  -0.657  -1.601  1.00  0.00           H  
ATOM   1147  HB2 TYR A  81       5.795  -1.571  -3.507  1.00  0.00           H  
ATOM   1148  HB3 TYR A  81       6.889  -0.765  -4.626  1.00  0.00           H  
ATOM   1149  HD1 TYR A  81       9.301  -1.542  -4.749  1.00  0.00           H  
ATOM   1150  HD2 TYR A  81       6.331  -3.616  -2.405  1.00  0.00           H  
ATOM   1151  HE1 TYR A  81      10.663  -3.604  -4.842  1.00  0.00           H  
ATOM   1152  HE2 TYR A  81       7.714  -5.670  -2.482  1.00  0.00           H  
ATOM   1153  HH  TYR A  81      10.791  -5.848  -4.281  1.00  0.00           H  
ATOM   1154  N   ASP A  82       8.479   1.536  -3.726  1.00  0.00           N  
ATOM   1155  CA  ASP A  82       9.679   2.348  -3.931  1.00  0.00           C  
ATOM   1156  C   ASP A  82      10.049   3.060  -2.633  1.00  0.00           C  
ATOM   1157  O   ASP A  82      11.160   2.881  -2.130  1.00  0.00           O  
ATOM   1158  CB  ASP A  82       9.507   3.363  -5.067  1.00  0.00           C  
ATOM   1159  CG  ASP A  82      10.801   4.146  -5.288  1.00  0.00           C  
ATOM   1160  OD1 ASP A  82      11.061   5.083  -4.501  1.00  0.00           O  
ATOM   1161  OD2 ASP A  82      11.529   3.788  -6.238  1.00  0.00           O  
ATOM   1162  H   ASP A  82       7.650   1.746  -4.278  1.00  0.00           H  
ATOM   1163  HA  ASP A  82      10.498   1.680  -4.204  1.00  0.00           H  
ATOM   1164  HB2 ASP A  82       9.248   2.840  -5.987  1.00  0.00           H  
ATOM   1165  HB3 ASP A  82       8.712   4.070  -4.831  1.00  0.00           H  
ATOM   1166  N   GLN A  83       9.101   3.824  -2.069  1.00  0.00           N  
ATOM   1167  CA  GLN A  83       9.332   4.548  -0.825  1.00  0.00           C  
ATOM   1168  C   GLN A  83       9.925   3.623   0.233  1.00  0.00           C  
ATOM   1169  O   GLN A  83      10.982   3.905   0.806  1.00  0.00           O  
ATOM   1170  CB  GLN A  83       8.053   5.185  -0.271  1.00  0.00           C  
ATOM   1171  CG  GLN A  83       7.298   6.100  -1.232  1.00  0.00           C  
ATOM   1172  CD  GLN A  83       8.197   7.132  -1.893  1.00  0.00           C  
ATOM   1173  OE1 GLN A  83       8.364   7.141  -3.107  1.00  0.00           O  
ATOM   1174  NE2 GLN A  83       8.765   8.035  -1.107  1.00  0.00           N  
ATOM   1175  H   GLN A  83       8.219   3.931  -2.562  1.00  0.00           H  
ATOM   1176  HA  GLN A  83      10.048   5.330  -1.033  1.00  0.00           H  
ATOM   1177  HB2 GLN A  83       7.364   4.405   0.046  1.00  0.00           H  
ATOM   1178  HB3 GLN A  83       8.344   5.773   0.598  1.00  0.00           H  
ATOM   1179  HG2 GLN A  83       6.822   5.503  -1.999  1.00  0.00           H  
ATOM   1180  HG3 GLN A  83       6.517   6.611  -0.671  1.00  0.00           H  
ATOM   1181 HE21 GLN A  83       8.641   8.043  -0.103  1.00  0.00           H  
ATOM   1182 HE22 GLN A  83       9.379   8.714  -1.523  1.00  0.00           H  
ATOM   1183  N   ALA A  84       9.221   2.511   0.464  1.00  0.00           N  
ATOM   1184  CA  ALA A  84       9.598   1.479   1.402  1.00  0.00           C  
ATOM   1185  C   ALA A  84      11.049   1.082   1.182  1.00  0.00           C  
ATOM   1186  O   ALA A  84      11.887   1.294   2.060  1.00  0.00           O  
ATOM   1187  CB  ALA A  84       8.672   0.269   1.234  1.00  0.00           C  
ATOM   1188  H   ALA A  84       8.370   2.371  -0.074  1.00  0.00           H  
ATOM   1189  HA  ALA A  84       9.490   1.885   2.408  1.00  0.00           H  
ATOM   1190  HB1 ALA A  84       7.635   0.576   1.308  1.00  0.00           H  
ATOM   1191  HB2 ALA A  84       8.798  -0.180   0.256  1.00  0.00           H  
ATOM   1192  HB3 ALA A  84       8.891  -0.475   1.998  1.00  0.00           H  
ATOM   1193  N   ALA A  85      11.337   0.494   0.017  1.00  0.00           N  
ATOM   1194  CA  ALA A  85      12.652  -0.019  -0.325  1.00  0.00           C  
ATOM   1195  C   ALA A  85      13.706   1.063  -0.103  1.00  0.00           C  
ATOM   1196  O   ALA A  85      14.620   0.865   0.701  1.00  0.00           O  
ATOM   1197  CB  ALA A  85      12.653  -0.518  -1.773  1.00  0.00           C  
ATOM   1198  H   ALA A  85      10.608   0.441  -0.692  1.00  0.00           H  
ATOM   1199  HA  ALA A  85      12.873  -0.867   0.324  1.00  0.00           H  
ATOM   1200  HB1 ALA A  85      12.394   0.291  -2.458  1.00  0.00           H  
ATOM   1201  HB2 ALA A  85      13.644  -0.896  -2.028  1.00  0.00           H  
ATOM   1202  HB3 ALA A  85      11.927  -1.323  -1.886  1.00  0.00           H  
ATOM   1203  N   GLY A  86      13.528   2.197  -0.785  1.00  0.00           N  
ATOM   1204  CA  GLY A  86      14.455   3.313  -0.844  1.00  0.00           C  
ATOM   1205  C   GLY A  86      14.773   3.918   0.518  1.00  0.00           C  
ATOM   1206  O   GLY A  86      15.900   4.355   0.732  1.00  0.00           O  
ATOM   1207  H   GLY A  86      12.686   2.280  -1.349  1.00  0.00           H  
ATOM   1208  HA2 GLY A  86      15.379   2.988  -1.325  1.00  0.00           H  
ATOM   1209  HA3 GLY A  86      13.998   4.100  -1.450  1.00  0.00           H  
ATOM   1210  N   ASN A  87      13.771   4.004   1.401  1.00  0.00           N  
ATOM   1211  CA  ASN A  87      13.760   4.840   2.606  1.00  0.00           C  
ATOM   1212  C   ASN A  87      13.348   6.272   2.245  1.00  0.00           C  
ATOM   1213  O   ASN A  87      13.571   7.190   3.025  1.00  0.00           O  
ATOM   1214  CB  ASN A  87      15.084   4.860   3.402  1.00  0.00           C  
ATOM   1215  CG  ASN A  87      15.663   3.491   3.754  1.00  0.00           C  
ATOM   1216  OD1 ASN A  87      14.968   2.476   3.783  1.00  0.00           O  
ATOM   1217  ND2 ASN A  87      16.958   3.455   4.059  1.00  0.00           N  
ATOM   1218  H   ASN A  87      12.867   3.625   1.125  1.00  0.00           H  
ATOM   1219  HA  ASN A  87      12.989   4.436   3.263  1.00  0.00           H  
ATOM   1220  HB2 ASN A  87      15.830   5.449   2.867  1.00  0.00           H  
ATOM   1221  HB3 ASN A  87      14.899   5.374   4.345  1.00  0.00           H  
ATOM   1222 HD21 ASN A  87      17.504   4.303   4.018  1.00  0.00           H  
ATOM   1223 HD22 ASN A  87      17.391   2.579   4.303  1.00  0.00           H  
ATOM   1224  N   LYS A  88      12.743   6.473   1.070  1.00  0.00           N  
ATOM   1225  CA  LYS A  88      12.273   7.763   0.592  1.00  0.00           C  
ATOM   1226  C   LYS A  88      10.974   8.237   1.266  1.00  0.00           C  
ATOM   1227  O   LYS A  88      10.417   9.244   0.833  1.00  0.00           O  
ATOM   1228  CB  LYS A  88      12.062   7.634  -0.910  1.00  0.00           C  
ATOM   1229  CG  LYS A  88      13.424   7.550  -1.560  1.00  0.00           C  
ATOM   1230  CD  LYS A  88      13.230   7.514  -3.071  1.00  0.00           C  
ATOM   1231  CE  LYS A  88      14.614   7.793  -3.628  1.00  0.00           C  
ATOM   1232  NZ  LYS A  88      14.568   8.059  -5.080  1.00  0.00           N  
ATOM   1233  H   LYS A  88      12.638   5.706   0.424  1.00  0.00           H  
ATOM   1234  HA  LYS A  88      13.063   8.512   0.700  1.00  0.00           H  
ATOM   1235  HB2 LYS A  88      11.495   6.750  -1.164  1.00  0.00           H  
ATOM   1236  HB3 LYS A  88      11.546   8.506  -1.300  1.00  0.00           H  
ATOM   1237  HG2 LYS A  88      13.970   8.443  -1.253  1.00  0.00           H  
ATOM   1238  HG3 LYS A  88      13.972   6.667  -1.229  1.00  0.00           H  
ATOM   1239  HD2 LYS A  88      12.845   6.540  -3.388  1.00  0.00           H  
ATOM   1240  HD3 LYS A  88      12.527   8.293  -3.372  1.00  0.00           H  
ATOM   1241  HE2 LYS A  88      14.981   8.645  -3.052  1.00  0.00           H  
ATOM   1242  HE3 LYS A  88      15.255   6.940  -3.406  1.00  0.00           H  
ATOM   1243  HZ1 LYS A  88      14.177   7.258  -5.559  1.00  0.00           H  
ATOM   1244  HZ2 LYS A  88      13.986   8.864  -5.267  1.00  0.00           H  
ATOM   1245  HZ3 LYS A  88      15.498   8.237  -5.433  1.00  0.00           H  
ATOM   1246  N   TRP A  89      10.443   7.501   2.248  1.00  0.00           N  
ATOM   1247  CA  TRP A  89       9.287   7.958   3.007  1.00  0.00           C  
ATOM   1248  C   TRP A  89       9.659   9.201   3.818  1.00  0.00           C  
ATOM   1249  O   TRP A  89       8.820  10.127   3.852  1.00  0.00           O  
ATOM   1250  CB  TRP A  89       8.759   6.848   3.929  1.00  0.00           C  
ATOM   1251  CG  TRP A  89       7.797   5.864   3.328  1.00  0.00           C  
ATOM   1252  CD1 TRP A  89       7.908   4.517   3.368  1.00  0.00           C  
ATOM   1253  CD2 TRP A  89       6.539   6.136   2.640  1.00  0.00           C  
ATOM   1254  NE1 TRP A  89       6.791   3.933   2.804  1.00  0.00           N  
ATOM   1255  CE2 TRP A  89       5.922   4.890   2.316  1.00  0.00           C  
ATOM   1256  CE3 TRP A  89       5.856   7.311   2.252  1.00  0.00           C  
ATOM   1257  CZ2 TRP A  89       4.695   4.820   1.642  1.00  0.00           C  
ATOM   1258  CZ3 TRP A  89       4.645   7.248   1.541  1.00  0.00           C  
ATOM   1259  CH2 TRP A  89       4.067   6.007   1.234  1.00  0.00           C  
ATOM   1260  OXT TRP A  89      10.768   9.193   4.395  1.00  0.00           O  
ATOM   1261  H   TRP A  89      10.967   6.729   2.620  1.00  0.00           H  
ATOM   1262  HA  TRP A  89       8.507   8.249   2.307  1.00  0.00           H  
ATOM   1263  HB2 TRP A  89       9.602   6.324   4.382  1.00  0.00           H  
ATOM   1264  HB3 TRP A  89       8.209   7.332   4.738  1.00  0.00           H  
ATOM   1265  HD1 TRP A  89       8.732   3.982   3.806  1.00  0.00           H  
ATOM   1266  HE1 TRP A  89       6.653   2.920   2.774  1.00  0.00           H  
ATOM   1267  HE3 TRP A  89       6.269   8.276   2.503  1.00  0.00           H  
ATOM   1268  HZ2 TRP A  89       4.239   3.866   1.436  1.00  0.00           H  
ATOM   1269  HZ3 TRP A  89       4.158   8.157   1.220  1.00  0.00           H  
ATOM   1270  HH2 TRP A  89       3.145   5.976   0.678  1.00  0.00           H  
TER    1271      TRP A  89                                                      
HETATM 1272 FE   HEC A  90      -3.277  -0.019   4.286  1.00  0.00          FE  
HETATM 1273  CHA HEC A  90      -1.819  -2.605   6.026  1.00  0.00           C  
HETATM 1274  CHB HEC A  90      -1.129  -0.436   1.648  1.00  0.00           C  
HETATM 1275  CHC HEC A  90      -5.172   2.236   2.393  1.00  0.00           C  
HETATM 1276  CHD HEC A  90      -5.258   0.741   7.068  1.00  0.00           C  
HETATM 1277  NA  HEC A  90      -1.735  -1.273   3.921  1.00  0.00           N  
HETATM 1278  C1A HEC A  90      -1.314  -2.261   4.769  1.00  0.00           C  
HETATM 1279  C2A HEC A  90      -0.206  -2.929   4.133  1.00  0.00           C  
HETATM 1280  C3A HEC A  90       0.016  -2.293   2.930  1.00  0.00           C  
HETATM 1281  C4A HEC A  90      -0.986  -1.262   2.780  1.00  0.00           C  
HETATM 1282  CMA HEC A  90       1.078  -2.650   1.928  1.00  0.00           C  
HETATM 1283  CAA HEC A  90       0.560  -4.120   4.675  1.00  0.00           C  
HETATM 1284  CBA HEC A  90       1.639  -3.814   5.710  1.00  0.00           C  
HETATM 1285  CGA HEC A  90       1.084  -3.321   7.036  1.00  0.00           C  
HETATM 1286  O1A HEC A  90       0.508  -4.148   7.780  1.00  0.00           O  
HETATM 1287  O2A HEC A  90       1.202  -2.101   7.260  1.00  0.00           O  
HETATM 1288  NB  HEC A  90      -3.161   0.784   2.370  1.00  0.00           N  
HETATM 1289  C1B HEC A  90      -2.170   0.490   1.490  1.00  0.00           C  
HETATM 1290  C2B HEC A  90      -2.380   1.302   0.312  1.00  0.00           C  
HETATM 1291  C3B HEC A  90      -3.579   1.973   0.469  1.00  0.00           C  
HETATM 1292  C4B HEC A  90      -4.041   1.673   1.808  1.00  0.00           C  
HETATM 1293  CMB HEC A  90      -1.486   1.304  -0.907  1.00  0.00           C  
HETATM 1294  CAB HEC A  90      -4.324   2.808  -0.576  1.00  0.00           C  
HETATM 1295  CBB HEC A  90      -4.756   2.008  -1.815  1.00  0.00           C  
HETATM 1296  NC  HEC A  90      -4.973   1.206   4.642  1.00  0.00           N  
HETATM 1297  C1C HEC A  90      -5.534   2.045   3.720  1.00  0.00           C  
HETATM 1298  C2C HEC A  90      -6.550   2.825   4.386  1.00  0.00           C  
HETATM 1299  C3C HEC A  90      -6.540   2.457   5.713  1.00  0.00           C  
HETATM 1300  C4C HEC A  90      -5.558   1.399   5.865  1.00  0.00           C  
HETATM 1301  CMC HEC A  90      -7.325   3.981   3.788  1.00  0.00           C  
HETATM 1302  CAC HEC A  90      -7.301   3.143   6.831  1.00  0.00           C  
HETATM 1303  CBC HEC A  90      -8.820   3.193   6.641  1.00  0.00           C  
HETATM 1304  ND  HEC A  90      -3.494  -0.793   6.216  1.00  0.00           N  
HETATM 1305  C1D HEC A  90      -4.342  -0.307   7.166  1.00  0.00           C  
HETATM 1306  C2D HEC A  90      -4.133  -1.088   8.359  1.00  0.00           C  
HETATM 1307  C3D HEC A  90      -3.266  -2.107   8.042  1.00  0.00           C  
HETATM 1308  C4D HEC A  90      -2.797  -1.863   6.696  1.00  0.00           C  
HETATM 1309  CMD HEC A  90      -4.756  -0.844   9.710  1.00  0.00           C  
HETATM 1310  CAD HEC A  90      -2.935  -3.271   8.946  1.00  0.00           C  
HETATM 1311  CBD HEC A  90      -4.126  -4.220   9.136  1.00  0.00           C  
HETATM 1312  CGD HEC A  90      -3.846  -5.303  10.171  1.00  0.00           C  
HETATM 1313  O1D HEC A  90      -3.231  -4.965  11.201  1.00  0.00           O  
HETATM 1314  O2D HEC A  90      -4.256  -6.457   9.924  1.00  0.00           O  
HETATM 1315  HHA HEC A  90      -1.371  -3.449   6.516  1.00  0.00           H  
HETATM 1316  HHB HEC A  90      -0.443  -0.559   0.826  1.00  0.00           H  
HETATM 1317  HHC HEC A  90      -5.748   2.939   1.825  1.00  0.00           H  
HETATM 1318  HHD HEC A  90      -5.813   0.982   7.958  1.00  0.00           H  
HETATM 1319 HMA1 HEC A  90       0.678  -3.420   1.272  1.00  0.00           H  
HETATM 1320 HMA2 HEC A  90       1.362  -1.780   1.341  1.00  0.00           H  
HETATM 1321 HMA3 HEC A  90       1.968  -3.016   2.437  1.00  0.00           H  
HETATM 1322 HAA1 HEC A  90      -0.123  -4.858   5.090  1.00  0.00           H  
HETATM 1323 HAA2 HEC A  90       1.103  -4.575   3.857  1.00  0.00           H  
HETATM 1324 HBA1 HEC A  90       2.232  -4.720   5.854  1.00  0.00           H  
HETATM 1325 HBA2 HEC A  90       2.272  -3.033   5.306  1.00  0.00           H  
HETATM 1326 HMB1 HEC A  90      -1.572   0.355  -1.435  1.00  0.00           H  
HETATM 1327 HMB2 HEC A  90      -1.750   2.109  -1.586  1.00  0.00           H  
HETATM 1328 HMB3 HEC A  90      -0.453   1.449  -0.597  1.00  0.00           H  
HETATM 1329  HAB HEC A  90      -5.246   3.212  -0.171  1.00  0.00           H  
HETATM 1330 HBB1 HEC A  90      -5.416   1.192  -1.533  1.00  0.00           H  
HETATM 1331 HBB2 HEC A  90      -5.293   2.654  -2.511  1.00  0.00           H  
HETATM 1332 HBB3 HEC A  90      -3.890   1.593  -2.324  1.00  0.00           H  
HETATM 1333 HMC1 HEC A  90      -8.290   3.635   3.422  1.00  0.00           H  
HETATM 1334 HMC2 HEC A  90      -7.484   4.762   4.527  1.00  0.00           H  
HETATM 1335 HMC3 HEC A  90      -6.777   4.450   2.976  1.00  0.00           H  
HETATM 1336  HAC HEC A  90      -7.164   2.574   7.735  1.00  0.00           H  
HETATM 1337 HBC1 HEC A  90      -9.203   2.193   6.454  1.00  0.00           H  
HETATM 1338 HBC2 HEC A  90      -9.278   3.582   7.551  1.00  0.00           H  
HETATM 1339 HBC3 HEC A  90      -9.090   3.848   5.817  1.00  0.00           H  
HETATM 1340 HMD1 HEC A  90      -5.828  -0.696   9.611  1.00  0.00           H  
HETATM 1341 HMD2 HEC A  90      -4.590  -1.691  10.371  1.00  0.00           H  
HETATM 1342 HMD3 HEC A  90      -4.300   0.038  10.154  1.00  0.00           H  
HETATM 1343 HAD1 HEC A  90      -2.111  -3.853   8.542  1.00  0.00           H  
HETATM 1344 HAD2 HEC A  90      -2.623  -2.879   9.915  1.00  0.00           H  
HETATM 1345 HBD1 HEC A  90      -5.007  -3.671   9.459  1.00  0.00           H  
HETATM 1346 HBD2 HEC A  90      -4.351  -4.678   8.176  1.00  0.00           H  
CONECT  201 1294                                                                
CONECT  231 1302                                                                
CONECT  245 1272                                                                
CONECT  849 1272                                                                
CONECT 1272  245  849 1277 1288                                                 
CONECT 1272 1296 1304                                                           
CONECT 1273 1278 1308 1315                                                      
CONECT 1274 1281 1289 1316                                                      
CONECT 1275 1292 1297 1317                                                      
CONECT 1276 1300 1305 1318                                                      
CONECT 1277 1272 1278 1281                                                      
CONECT 1278 1273 1277 1279                                                      
CONECT 1279 1278 1280 1283                                                      
CONECT 1280 1279 1281 1282                                                      
CONECT 1281 1274 1277 1280                                                      
CONECT 1282 1280 1319 1320 1321                                                 
CONECT 1283 1279 1284 1322 1323                                                 
CONECT 1284 1283 1285 1324 1325                                                 
CONECT 1285 1284 1286 1287                                                      
CONECT 1286 1285                                                                
CONECT 1287 1285                                                                
CONECT 1288 1272 1289 1292                                                      
CONECT 1289 1274 1288 1290                                                      
CONECT 1290 1289 1291 1293                                                      
CONECT 1291 1290 1292 1294                                                      
CONECT 1292 1275 1288 1291                                                      
CONECT 1293 1290 1326 1327 1328                                                 
CONECT 1294  201 1291 1295 1329                                                 
CONECT 1295 1294 1330 1331 1332                                                 
CONECT 1296 1272 1297 1300                                                      
CONECT 1297 1275 1296 1298                                                      
CONECT 1298 1297 1299 1301                                                      
CONECT 1299 1298 1300 1302                                                      
CONECT 1300 1276 1296 1299                                                      
CONECT 1301 1298 1333 1334 1335                                                 
CONECT 1302  231 1299 1303 1336                                                 
CONECT 1303 1302 1337 1338 1339                                                 
CONECT 1304 1272 1305 1308                                                      
CONECT 1305 1276 1304 1306                                                      
CONECT 1306 1305 1307 1309                                                      
CONECT 1307 1306 1308 1310                                                      
CONECT 1308 1273 1304 1307                                                      
CONECT 1309 1306 1340 1341 1342                                                 
CONECT 1310 1307 1311 1343 1344                                                 
CONECT 1311 1310 1312 1345 1346                                                 
CONECT 1312 1311 1313 1314                                                      
CONECT 1313 1312                                                                
CONECT 1314 1312                                                                
CONECT 1315 1273                                                                
CONECT 1316 1274                                                                
CONECT 1317 1275                                                                
CONECT 1318 1276                                                                
CONECT 1319 1282                                                                
CONECT 1320 1282                                                                
CONECT 1321 1282                                                                
CONECT 1322 1283                                                                
CONECT 1323 1283                                                                
CONECT 1324 1284                                                                
CONECT 1325 1284                                                                
CONECT 1326 1293                                                                
CONECT 1327 1293                                                                
CONECT 1328 1293                                                                
CONECT 1329 1294                                                                
CONECT 1330 1295                                                                
CONECT 1331 1295                                                                
CONECT 1332 1295                                                                
CONECT 1333 1301                                                                
CONECT 1334 1301                                                                
CONECT 1335 1301                                                                
CONECT 1336 1302                                                                
CONECT 1337 1303                                                                
CONECT 1338 1303                                                                
CONECT 1339 1303                                                                
CONECT 1340 1309                                                                
CONECT 1341 1309                                                                
CONECT 1342 1309                                                                
CONECT 1343 1310                                                                
CONECT 1344 1310                                                                
CONECT 1345 1311                                                                
CONECT 1346 1311                                                                
MASTER      121    0    1    5    0    0    6    6 1345    1   80    7          
END