HEADER    NEUROPEPTIDE                            19-SEP-03   1R02              
TITLE     SOLUTION STRUCTURE OF HUMAN OREXIN-A:REGULATOR OF APPETITE AND        
TITLE    2 WAKEFULNESS                                                          
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: OREXIN-A;                                                  
COMPND   3 CHAIN: A;                                                            
COMPND   4 SYNONYM: HYPOCRETIN-1;                                               
COMPND   5 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 SYNTHETIC: YES;                                                      
SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
SOURCE   5 ORGANISM_TAXID: 9606                                                 
KEYWDS    TURN, HELIX-LOOP-HELIX, NEUROPEPTIDE                                  
EXPDTA    SOLUTION NMR                                                          
AUTHOR    H.-Y.KIM,E.HONG,J.-I.KIM,W.LEE                                        
REVDAT   4   09-OCT-19 1R02    1       SOURCE JRNL   REMARK                     
REVDAT   3   24-FEB-09 1R02    1       VERSN                                    
REVDAT   2   24-JAN-06 1R02    1       JRNL                                     
REVDAT   1   19-SEP-04 1R02    0                                                
JRNL        AUTH   H.Y.KIM,E.HONG,J.I.KIM,W.LEE                                 
JRNL        TITL   SOLUTION STRUCTURE OF HUMAN OREXIN-A: REGULATOR OF APPETITE  
JRNL        TITL 2 AND WAKEFULNESS.                                             
JRNL        REF    J.BIOCHEM.MOL.BIOL.           V.  37   565 2004              
JRNL        REFN                   ISSN 1225-8687                               
JRNL        PMID   15479620                                                     
JRNL        DOI    10.5483/BMBREP.2004.37.5.565                                 
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : CNS 1.0, CNS 1.0                                     
REMARK   3   AUTHORS     : BRUNGER (CNS), BRUNGER (CNS)                         
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 1R02 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 26-SEP-03.                  
REMARK 100 THE DEPOSITION ID IS D_1000020279.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 278                                
REMARK 210  PH                             : 7.0                                
REMARK 210  IONIC STRENGTH                 : 50MM K2HPO4                        
REMARK 210  PRESSURE                       : AMBIENT                            
REMARK 210  SAMPLE CONTENTS                : 2MM OREXIN-A; 50MM PHOSPHATE       
REMARK 210                                   BUFFER; 90% H2O, 10% D2O; 2MM      
REMARK 210                                   OREXIN-A; 50MM PHOSPHATE BUFFER;   
REMARK 210                                   100% D2O                           
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D NOESY; 2D TOCSY; DQF-COSY       
REMARK 210  SPECTROMETER FIELD STRENGTH    : 500 MHZ; 600 MHZ                   
REMARK 210  SPECTROMETER MODEL             : DRX                                
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : XWINNMR 2.0, NMRPIPE 1.7, SPARKY   
REMARK 210                                   3.60                               
REMARK 210   METHOD USED                   : DISTANCE GEOMETRY, SIMULATED       
REMARK 210                                   ANNEALING, MOLECULAR DYNAMICS      
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : NULL                               
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 1                                  
REMARK 210 CONFORMERS, SELECTION CRITERIA  : NULL                               
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL                
REMARK 210                                                                      
REMARK 210 REMARK: 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 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: TORSION ANGLES                                             
REMARK 500                                                                      
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:            
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)                    
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-           
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400            
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        PSI       PHI                                   
REMARK 500    LEU A   3      163.12     60.04                                   
REMARK 500    ASP A   5       90.64    -49.45                                   
REMARK 500    CYS A   7       72.50     62.73                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1CQ0   RELATED DB: PDB                                   
REMARK 900 SOLUTION STRUCTURE OF A HUMAN HYPOCRETIN-2/OREXIN-B                  
DBREF  1R02 A    1    33  UNP    O43612   OREX_HUMAN      34     66             
SEQRES   1 A   33  GLN PRO LEU PRO ASP CYS CYS ARG GLN LYS THR CYS SER          
SEQRES   2 A   33  CYS ARG LEU TYR GLU LEU LEU HIS GLY ALA GLY ASN HIS          
SEQRES   3 A   33  ALA ALA GLY ILE LEU THR LEU                                  
HELIX    1   1 SER A   13  GLY A   22  1                                  10    
HELIX    2   2 GLY A   24  THR A   32  1                                   9    
SSBOND   1 CYS A    6    CYS A   12                          1555   1555  2.03  
SSBOND   2 CYS A    7    CYS A   14                          1555   1555  2.03  
CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1          
ORIGX1      1.000000  0.000000  0.000000        0.00000                         
ORIGX2      0.000000  1.000000  0.000000        0.00000                         
ORIGX3      0.000000  0.000000  1.000000        0.00000                         
SCALE1      1.000000  0.000000  0.000000        0.00000                         
SCALE2      0.000000  1.000000  0.000000        0.00000                         
SCALE3      0.000000  0.000000  1.000000        0.00000                         
ATOM      1  N   GLN A   1       7.066  21.384   0.641  1.00 11.02           N  
ATOM      2  CA  GLN A   1       5.949  20.973   1.534  1.00 10.36           C  
ATOM      3  C   GLN A   1       5.275  19.686   1.047  1.00  9.45           C  
ATOM      4  O   GLN A   1       5.014  18.782   1.840  1.00  9.34           O  
ATOM      5  CB  GLN A   1       4.928  22.115   1.616  1.00 10.69           C  
ATOM      6  CG  GLN A   1       3.676  21.765   2.403  1.00 11.26           C  
ATOM      7  CD  GLN A   1       3.987  21.223   3.784  1.00 11.68           C  
ATOM      8  OE1 GLN A   1       3.745  20.021   4.019  1.00 11.97           O  
ATOM      9  NE2 GLN A   1       4.475  22.002   4.632  1.00 11.90           N  
ATOM     10  H1  GLN A   1       7.823  21.771   1.239  1.00 11.21           H  
ATOM     11  H2  GLN A   1       6.702  22.105  -0.016  1.00 11.26           H  
ATOM     12  H3  GLN A   1       7.392  20.540   0.130  1.00 11.19           H  
ATOM     13  HA  GLN A   1       6.354  20.797   2.521  1.00 10.53           H  
ATOM     14  HB2 GLN A   1       5.397  22.965   2.088  1.00 10.93           H  
ATOM     15  HB3 GLN A   1       4.631  22.391   0.615  1.00 10.52           H  
ATOM     16  HG2 GLN A   1       3.073  22.656   2.510  1.00 11.34           H  
ATOM     17  HG3 GLN A   1       3.119  21.019   1.857  1.00 11.54           H  
ATOM     18  N   PRO A   2       4.985  19.578  -0.265  1.00  9.01           N  
ATOM     19  CA  PRO A   2       4.342  18.385  -0.827  1.00  8.36           C  
ATOM     20  C   PRO A   2       5.069  17.099  -0.447  1.00  7.61           C  
ATOM     21  O   PRO A   2       4.476  16.021  -0.438  1.00  7.65           O  
ATOM     22  CB  PRO A   2       4.420  18.613  -2.338  1.00  8.47           C  
ATOM     23  CG  PRO A   2       4.493  20.092  -2.493  1.00  8.99           C  
ATOM     24  CD  PRO A   2       5.254  20.596  -1.300  1.00  9.41           C  
ATOM     25  HA  PRO A   2       3.307  18.314  -0.523  1.00  8.65           H  
ATOM     26  HB2 PRO A   2       5.300  18.128  -2.734  1.00  8.09           H  
ATOM     27  HB3 PRO A   2       3.536  18.211  -2.811  1.00  8.85           H  
ATOM     28  HG2 PRO A   2       5.017  20.340  -3.405  1.00  8.92           H  
ATOM     29  HG3 PRO A   2       3.497  20.510  -2.506  1.00  9.38           H  
ATOM     30  HD2 PRO A   2       6.311  20.649  -1.521  1.00  9.49           H  
ATOM     31  HD3 PRO A   2       4.883  21.562  -0.997  1.00 10.10           H  
ATOM     32  N   LEU A   3       6.357  17.218  -0.135  1.00  7.22           N  
ATOM     33  CA  LEU A   3       7.159  16.061   0.243  1.00  6.78           C  
ATOM     34  C   LEU A   3       7.187  15.037  -0.890  1.00  5.80           C  
ATOM     35  O   LEU A   3       6.360  15.090  -1.798  1.00  5.70           O  
ATOM     36  CB  LEU A   3       6.595  15.420   1.515  1.00  7.43           C  
ATOM     37  CG  LEU A   3       6.892  16.177   2.811  1.00  8.26           C  
ATOM     38  CD1 LEU A   3       6.447  15.364   4.017  1.00  8.84           C  
ATOM     39  CD2 LEU A   3       8.375  16.511   2.912  1.00  8.91           C  
ATOM     40  H   LEU A   3       6.778  18.104  -0.161  1.00  7.44           H  
ATOM     41  HA  LEU A   3       8.166  16.399   0.435  1.00  7.05           H  
ATOM     42  HB2 LEU A   3       5.522  15.345   1.407  1.00  7.79           H  
ATOM     43  HB3 LEU A   3       6.999  14.424   1.605  1.00  7.25           H  
ATOM     44  HG  LEU A   3       6.339  17.105   2.815  1.00  8.27           H  
ATOM     45 HD11 LEU A   3       6.310  16.019   4.865  1.00  9.03           H  
ATOM     46 HD12 LEU A   3       7.200  14.624   4.251  1.00  9.15           H  
ATOM     47 HD13 LEU A   3       5.514  14.868   3.793  1.00  9.01           H  
ATOM     48 HD21 LEU A   3       8.940  15.836   2.288  1.00  9.21           H  
ATOM     49 HD22 LEU A   3       8.699  16.411   3.936  1.00  9.12           H  
ATOM     50 HD23 LEU A   3       8.537  17.526   2.582  1.00  9.11           H  
ATOM     51  N   PRO A   4       8.143  14.087  -0.855  1.00  5.41           N  
ATOM     52  CA  PRO A   4       8.271  13.051  -1.880  1.00  4.85           C  
ATOM     53  C   PRO A   4       6.918  12.489  -2.304  1.00  3.83           C  
ATOM     54  O   PRO A   4       6.125  12.056  -1.470  1.00  3.70           O  
ATOM     55  CB  PRO A   4       9.122  11.963  -1.203  1.00  5.28           C  
ATOM     56  CG  PRO A   4       9.396  12.451   0.188  1.00  5.78           C  
ATOM     57  CD  PRO A   4       9.170  13.934   0.178  1.00  5.97           C  
ATOM     58  HA  PRO A   4       8.789  13.425  -2.752  1.00  5.34           H  
ATOM     59  HB2 PRO A   4       8.574  11.034  -1.189  1.00  4.92           H  
ATOM     60  HB3 PRO A   4      10.040  11.831  -1.757  1.00  5.96           H  
ATOM     61  HG2 PRO A   4       8.717  11.976   0.881  1.00  5.64           H  
ATOM     62  HG3 PRO A   4      10.419  12.231   0.459  1.00  6.51           H  
ATOM     63  HD2 PRO A   4       8.813  14.272   1.138  1.00  5.98           H  
ATOM     64  HD3 PRO A   4      10.075  14.454  -0.098  1.00  6.80           H  
ATOM     65  N   ASP A   5       6.661  12.512  -3.609  1.00  3.60           N  
ATOM     66  CA  ASP A   5       5.403  12.018  -4.160  1.00  3.19           C  
ATOM     67  C   ASP A   5       5.063  10.629  -3.623  1.00  2.76           C  
ATOM     68  O   ASP A   5       5.459   9.616  -4.199  1.00  3.40           O  
ATOM     69  CB  ASP A   5       5.478  11.978  -5.687  1.00  4.05           C  
ATOM     70  CG  ASP A   5       4.157  12.332  -6.341  1.00  4.88           C  
ATOM     71  OD1 ASP A   5       3.122  11.763  -5.934  1.00  5.41           O  
ATOM     72  OD2 ASP A   5       4.157  13.178  -7.260  1.00  5.37           O  
ATOM     73  H   ASP A   5       7.335  12.879  -4.219  1.00  4.11           H  
ATOM     74  HA  ASP A   5       4.622  12.703  -3.867  1.00  3.28           H  
ATOM     75  HB2 ASP A   5       6.224  12.684  -6.022  1.00  4.29           H  
ATOM     76  HB3 ASP A   5       5.761  10.985  -6.002  1.00  4.32           H  
ATOM     77  N   CYS A   6       4.328  10.593  -2.515  1.00  2.29           N  
ATOM     78  CA  CYS A   6       3.932   9.344  -1.901  1.00  2.54           C  
ATOM     79  C   CYS A   6       2.560   8.906  -2.404  1.00  2.88           C  
ATOM     80  O   CYS A   6       1.599   8.829  -1.638  1.00  3.18           O  
ATOM     81  CB  CYS A   6       3.921   9.486  -0.377  1.00  2.76           C  
ATOM     82  SG  CYS A   6       5.414   8.839   0.444  1.00  3.72           S  
ATOM     83  H   CYS A   6       4.045  11.423  -2.104  1.00  2.35           H  
ATOM     84  HA  CYS A   6       4.660   8.612  -2.179  1.00  3.23           H  
ATOM     85  HB2 CYS A   6       3.835  10.532  -0.122  1.00  2.78           H  
ATOM     86  HB3 CYS A   6       3.071   8.955   0.019  1.00  3.17           H  
ATOM     87  N   CYS A   7       2.476   8.626  -3.702  1.00  3.50           N  
ATOM     88  CA  CYS A   7       1.222   8.201  -4.314  1.00  4.42           C  
ATOM     89  C   CYS A   7       0.168   9.297  -4.203  1.00  5.09           C  
ATOM     90  O   CYS A   7      -0.782   9.187  -3.428  1.00  5.93           O  
ATOM     91  CB  CYS A   7       0.714   6.915  -3.658  1.00  4.57           C  
ATOM     92  SG  CYS A   7       1.771   5.464  -3.955  1.00  4.70           S  
ATOM     93  H   CYS A   7       3.275   8.712  -4.262  1.00  3.63           H  
ATOM     94  HA  CYS A   7       1.413   8.009  -5.359  1.00  4.89           H  
ATOM     95  HB2 CYS A   7       0.654   7.065  -2.590  1.00  4.23           H  
ATOM     96  HB3 CYS A   7      -0.271   6.690  -4.040  1.00  5.33           H  
ATOM     97  N   ARG A   8       0.343  10.357  -4.989  1.00  4.97           N  
ATOM     98  CA  ARG A   8      -0.592  11.476  -4.987  1.00  5.71           C  
ATOM     99  C   ARG A   8      -0.588  12.192  -3.639  1.00  5.67           C  
ATOM    100  O   ARG A   8      -1.576  12.824  -3.260  1.00  6.47           O  
ATOM    101  CB  ARG A   8      -2.004  10.990  -5.320  1.00  6.52           C  
ATOM    102  CG  ARG A   8      -2.388  11.193  -6.775  1.00  7.17           C  
ATOM    103  CD  ARG A   8      -3.003  12.565  -6.999  1.00  7.79           C  
ATOM    104  NE  ARG A   8      -2.182  13.636  -6.440  1.00  8.46           N  
ATOM    105  CZ  ARG A   8      -1.103  14.133  -7.042  1.00  8.96           C  
ATOM    106  NH1 ARG A   8      -0.703  13.651  -8.212  1.00  8.92           N  
ATOM    107  NH2 ARG A   8      -0.420  15.116  -6.469  1.00  9.74           N  
ATOM    108  H   ARG A   8       1.119  10.384  -5.586  1.00  4.54           H  
ATOM    109  HA  ARG A   8      -0.272  12.172  -5.748  1.00  6.00           H  
ATOM    110  HB2 ARG A   8      -2.070   9.935  -5.096  1.00  6.53           H  
ATOM    111  HB3 ARG A   8      -2.713  11.525  -4.705  1.00  6.96           H  
ATOM    112  HG2 ARG A   8      -1.503  11.103  -7.386  1.00  7.40           H  
ATOM    113  HG3 ARG A   8      -3.102  10.436  -7.058  1.00  7.28           H  
ATOM    114  HD2 ARG A   8      -3.115  12.726  -8.062  1.00  7.81           H  
ATOM    115  HD3 ARG A   8      -3.977  12.588  -6.531  1.00  8.01           H  
ATOM    116  HE  ARG A   8      -2.449  14.007  -5.574  1.00  8.70           H  
ATOM    117 HH11 ARG A   8      -1.213  12.909  -8.648  1.00  8.49           H  
ATOM    118 HH12 ARG A   8       0.107  14.030  -8.657  1.00  9.46           H  
ATOM    119 HH21 ARG A   8      -0.714  15.484  -5.587  1.00  9.96           H  
ATOM    120 HH22 ARG A   8       0.390  15.491  -6.922  1.00 10.23           H  
ATOM    121  N   GLN A   9       0.525  12.091  -2.918  1.00  5.00           N  
ATOM    122  CA  GLN A   9       0.649  12.732  -1.613  1.00  5.35           C  
ATOM    123  C   GLN A   9      -0.448  12.255  -0.667  1.00  4.93           C  
ATOM    124  O   GLN A   9      -0.985  13.034   0.122  1.00  5.51           O  
ATOM    125  CB  GLN A   9       0.583  14.254  -1.763  1.00  6.33           C  
ATOM    126  CG  GLN A   9       1.035  15.008  -0.524  1.00  7.12           C  
ATOM    127  CD  GLN A   9       0.166  16.215  -0.226  1.00  8.09           C  
ATOM    128  OE1 GLN A   9      -0.329  16.878  -1.138  1.00  8.52           O  
ATOM    129  NE2 GLN A   9      -0.023  16.507   1.055  1.00  8.65           N  
ATOM    130  H   GLN A   9       1.280  11.575  -3.270  1.00  4.50           H  
ATOM    131  HA  GLN A   9       1.609  12.460  -1.200  1.00  5.59           H  
ATOM    132  HB2 GLN A   9       1.213  14.550  -2.589  1.00  6.58           H  
ATOM    133  HB3 GLN A   9      -0.437  14.538  -1.980  1.00  6.55           H  
ATOM    134  HG2 GLN A   9       0.997  14.339   0.323  1.00  7.15           H  
ATOM    135  HG3 GLN A   9       2.051  15.341  -0.672  1.00  7.27           H  
ATOM    136 HE21 GLN A   9       0.403  15.934   1.728  1.00  8.46           H  
ATOM    137 HE22 GLN A   9      -0.580  17.281   1.276  1.00  9.36           H  
ATOM    138  N   LYS A  10      -0.782  10.971  -0.756  1.00  4.31           N  
ATOM    139  CA  LYS A  10      -1.814  10.388   0.079  1.00  4.37           C  
ATOM    140  C   LYS A  10      -1.236   9.834   1.379  1.00  4.08           C  
ATOM    141  O   LYS A  10      -1.820   8.940   1.988  1.00  4.54           O  
ATOM    142  CB  LYS A  10      -2.545   9.280  -0.681  1.00  4.46           C  
ATOM    143  CG  LYS A  10      -4.049   9.280  -0.459  1.00  5.62           C  
ATOM    144  CD  LYS A  10      -4.769  10.085  -1.529  1.00  6.45           C  
ATOM    145  CE  LYS A  10      -4.878  11.550  -1.144  1.00  7.39           C  
ATOM    146  NZ  LYS A  10      -5.617  11.735   0.136  1.00  8.31           N  
ATOM    147  H   LYS A  10      -0.331  10.407  -1.402  1.00  4.13           H  
ATOM    148  HA  LYS A  10      -2.509  11.168   0.310  1.00  5.13           H  
ATOM    149  HB2 LYS A  10      -2.359   9.402  -1.738  1.00  4.34           H  
ATOM    150  HB3 LYS A  10      -2.156   8.324  -0.363  1.00  4.24           H  
ATOM    151  HG2 LYS A  10      -4.407   8.262  -0.486  1.00  5.93           H  
ATOM    152  HG3 LYS A  10      -4.260   9.712   0.508  1.00  5.90           H  
ATOM    153  HD2 LYS A  10      -4.219  10.006  -2.455  1.00  6.60           H  
ATOM    154  HD3 LYS A  10      -5.761   9.680  -1.662  1.00  6.54           H  
ATOM    155  HE2 LYS A  10      -3.883  11.957  -1.036  1.00  7.47           H  
ATOM    156  HE3 LYS A  10      -5.398  12.078  -1.929  1.00  7.58           H  
ATOM    157  HZ1 LYS A  10      -6.044  12.683   0.169  1.00  8.73           H  
ATOM    158  HZ2 LYS A  10      -4.968  11.631   0.942  1.00  8.66           H  
ATOM    159  HZ3 LYS A  10      -6.371  11.023   0.219  1.00  8.44           H  
ATOM    160  N   THR A  11      -0.089  10.368   1.800  1.00  3.87           N  
ATOM    161  CA  THR A  11       0.568   9.924   3.029  1.00  4.20           C  
ATOM    162  C   THR A  11       1.287   8.589   2.817  1.00  3.95           C  
ATOM    163  O   THR A  11       1.626   7.896   3.776  1.00  4.77           O  
ATOM    164  CB  THR A  11      -0.446   9.832   4.184  1.00  5.33           C  
ATOM    165  OG1 THR A  11       0.103  10.375   5.371  1.00  5.89           O  
ATOM    166  CG2 THR A  11      -0.915   8.424   4.505  1.00  6.05           C  
ATOM    167  H   THR A  11       0.329  11.076   1.269  1.00  3.90           H  
ATOM    168  HA  THR A  11       1.309  10.669   3.280  1.00  4.31           H  
ATOM    169  HB  THR A  11      -1.318  10.417   3.924  1.00  5.61           H  
ATOM    170  HG1 THR A  11      -0.001  11.330   5.367  1.00  6.04           H  
ATOM    171 HG21 THR A  11      -1.918   8.459   4.906  1.00  6.35           H  
ATOM    172 HG22 THR A  11      -0.252   7.981   5.234  1.00  6.40           H  
ATOM    173 HG23 THR A  11      -0.909   7.827   3.606  1.00  6.26           H  
ATOM    174  N   CYS A  12       1.521   8.240   1.555  1.00  3.15           N  
ATOM    175  CA  CYS A  12       2.204   6.996   1.217  1.00  3.44           C  
ATOM    176  C   CYS A  12       1.353   5.785   1.590  1.00  3.70           C  
ATOM    177  O   CYS A  12       1.857   4.798   2.127  1.00  4.45           O  
ATOM    178  CB  CYS A  12       3.566   6.929   1.915  1.00  4.07           C  
ATOM    179  SG  CYS A  12       4.983   6.881   0.769  1.00  4.19           S  
ATOM    180  H   CYS A  12       1.234   8.835   0.831  1.00  2.70           H  
ATOM    181  HA  CYS A  12       2.360   6.989   0.147  1.00  3.60           H  
ATOM    182  HB2 CYS A  12       3.683   7.801   2.541  1.00  4.43           H  
ATOM    183  HB3 CYS A  12       3.608   6.042   2.528  1.00  4.65           H  
ATOM    184  N   SER A  13       0.060   5.866   1.296  1.00  3.48           N  
ATOM    185  CA  SER A  13      -0.861   4.777   1.595  1.00  4.06           C  
ATOM    186  C   SER A  13      -0.442   3.499   0.874  1.00  3.61           C  
ATOM    187  O   SER A  13      -0.772   2.393   1.306  1.00  3.91           O  
ATOM    188  CB  SER A  13      -2.286   5.161   1.190  1.00  5.03           C  
ATOM    189  OG  SER A  13      -2.326   5.644  -0.142  1.00  5.44           O  
ATOM    190  H   SER A  13      -0.282   6.678   0.866  1.00  3.22           H  
ATOM    191  HA  SER A  13      -0.834   4.602   2.659  1.00  4.48           H  
ATOM    192  HB2 SER A  13      -2.924   4.293   1.263  1.00  5.32           H  
ATOM    193  HB3 SER A  13      -2.650   5.932   1.851  1.00  5.51           H  
ATOM    194  HG  SER A  13      -1.896   5.013  -0.725  1.00  5.70           H  
ATOM    195  N   CYS A  14       0.290   3.656  -0.226  1.00  3.25           N  
ATOM    196  CA  CYS A  14       0.755   2.515  -1.004  1.00  3.49           C  
ATOM    197  C   CYS A  14       1.599   1.574  -0.146  1.00  3.10           C  
ATOM    198  O   CYS A  14       1.705   0.384  -0.439  1.00  3.42           O  
ATOM    199  CB  CYS A  14       1.567   2.992  -2.209  1.00  3.87           C  
ATOM    200  SG  CYS A  14       0.589   3.891  -3.455  1.00  3.94           S  
ATOM    201  H   CYS A  14       0.522   4.561  -0.520  1.00  3.14           H  
ATOM    202  HA  CYS A  14      -0.113   1.979  -1.357  1.00  4.13           H  
ATOM    203  HB2 CYS A  14       2.350   3.652  -1.869  1.00  4.07           H  
ATOM    204  HB3 CYS A  14       2.013   2.136  -2.695  1.00  4.45           H  
ATOM    205  N   ARG A  15       2.196   2.115   0.913  1.00  2.82           N  
ATOM    206  CA  ARG A  15       3.027   1.317   1.811  1.00  3.05           C  
ATOM    207  C   ARG A  15       2.266   0.093   2.309  1.00  2.88           C  
ATOM    208  O   ARG A  15       2.786  -1.023   2.293  1.00  2.95           O  
ATOM    209  CB  ARG A  15       3.490   2.163   2.998  1.00  3.75           C  
ATOM    210  CG  ARG A  15       4.700   3.029   2.692  1.00  4.44           C  
ATOM    211  CD  ARG A  15       5.988   2.383   3.180  1.00  5.34           C  
ATOM    212  NE  ARG A  15       6.406   1.278   2.321  1.00  5.97           N  
ATOM    213  CZ  ARG A  15       7.028   1.439   1.155  1.00  6.80           C  
ATOM    214  NH1 ARG A  15       7.306   2.657   0.705  1.00  7.11           N  
ATOM    215  NH2 ARG A  15       7.375   0.380   0.438  1.00  7.58           N  
ATOM    216  H   ARG A  15       2.074   3.068   1.098  1.00  2.82           H  
ATOM    217  HA  ARG A  15       3.892   0.988   1.256  1.00  3.40           H  
ATOM    218  HB2 ARG A  15       2.680   2.809   3.303  1.00  3.88           H  
ATOM    219  HB3 ARG A  15       3.742   1.505   3.816  1.00  4.17           H  
ATOM    220  HG2 ARG A  15       4.766   3.175   1.624  1.00  4.59           H  
ATOM    221  HG3 ARG A  15       4.580   3.984   3.181  1.00  4.64           H  
ATOM    222  HD2 ARG A  15       6.767   3.130   3.194  1.00  5.64           H  
ATOM    223  HD3 ARG A  15       5.830   2.009   4.181  1.00  5.63           H  
ATOM    224  HE  ARG A  15       6.215   0.368   2.628  1.00  6.01           H  
ATOM    225 HH11 ARG A  15       7.047   3.460   1.242  1.00  6.75           H  
ATOM    226 HH12 ARG A  15       7.773   2.771  -0.171  1.00  7.87           H  
ATOM    227 HH21 ARG A  15       7.170  -0.540   0.772  1.00  7.60           H  
ATOM    228 HH22 ARG A  15       7.843   0.500  -0.438  1.00  8.29           H  
ATOM    229  N   LEU A  16       1.031   0.309   2.745  1.00  3.12           N  
ATOM    230  CA  LEU A  16       0.196  -0.779   3.239  1.00  3.69           C  
ATOM    231  C   LEU A  16      -0.245  -1.676   2.091  1.00  3.70           C  
ATOM    232  O   LEU A  16      -0.281  -2.900   2.222  1.00  3.89           O  
ATOM    233  CB  LEU A  16      -1.030  -0.223   3.967  1.00  4.63           C  
ATOM    234  CG  LEU A  16      -0.724   0.654   5.184  1.00  5.61           C  
ATOM    235  CD1 LEU A  16      -0.807   2.127   4.817  1.00  6.29           C  
ATOM    236  CD2 LEU A  16      -1.678   0.331   6.326  1.00  6.33           C  
ATOM    237  H   LEU A  16       0.669   1.220   2.730  1.00  3.20           H  
ATOM    238  HA  LEU A  16       0.784  -1.361   3.934  1.00  3.85           H  
ATOM    239  HB2 LEU A  16      -1.605   0.361   3.263  1.00  4.63           H  
ATOM    240  HB3 LEU A  16      -1.635  -1.056   4.294  1.00  4.93           H  
ATOM    241  HG  LEU A  16       0.283   0.450   5.521  1.00  5.67           H  
ATOM    242 HD11 LEU A  16      -1.739   2.536   5.178  1.00  6.60           H  
ATOM    243 HD12 LEU A  16      -0.759   2.234   3.743  1.00  6.60           H  
ATOM    244 HD13 LEU A  16       0.017   2.658   5.269  1.00  6.49           H  
ATOM    245 HD21 LEU A  16      -1.507  -0.680   6.664  1.00  6.60           H  
ATOM    246 HD22 LEU A  16      -2.697   0.428   5.981  1.00  6.71           H  
ATOM    247 HD23 LEU A  16      -1.507   1.018   7.142  1.00  6.53           H  
ATOM    248  N   TYR A  17      -0.576  -1.056   0.961  1.00  3.87           N  
ATOM    249  CA  TYR A  17      -1.013  -1.797  -0.217  1.00  4.56           C  
ATOM    250  C   TYR A  17       0.154  -2.528  -0.876  1.00  4.27           C  
ATOM    251  O   TYR A  17      -0.045  -3.390  -1.732  1.00  4.95           O  
ATOM    252  CB  TYR A  17      -1.671  -0.850  -1.223  1.00  5.35           C  
ATOM    253  CG  TYR A  17      -3.160  -0.688  -1.017  1.00  6.48           C  
ATOM    254  CD1 TYR A  17      -4.055  -1.632  -1.506  1.00  7.11           C  
ATOM    255  CD2 TYR A  17      -3.671   0.408  -0.335  1.00  7.20           C  
ATOM    256  CE1 TYR A  17      -5.416  -1.487  -1.321  1.00  8.27           C  
ATOM    257  CE2 TYR A  17      -5.033   0.560  -0.146  1.00  8.35           C  
ATOM    258  CZ  TYR A  17      -5.900  -0.391  -0.640  1.00  8.82           C  
ATOM    259  OH  TYR A  17      -7.256  -0.244  -0.455  1.00 10.05           O  
ATOM    260  H   TYR A  17      -0.524  -0.078   0.921  1.00  3.75           H  
ATOM    261  HA  TYR A  17      -1.735  -2.525   0.104  1.00  5.04           H  
ATOM    262  HB2 TYR A  17      -1.217   0.126  -1.138  1.00  5.11           H  
ATOM    263  HB3 TYR A  17      -1.511  -1.231  -2.221  1.00  5.59           H  
ATOM    264  HD1 TYR A  17      -3.672  -2.491  -2.037  1.00  6.87           H  
ATOM    265  HD2 TYR A  17      -2.990   1.152   0.052  1.00  7.03           H  
ATOM    266  HE1 TYR A  17      -6.096  -2.233  -1.709  1.00  8.87           H  
ATOM    267  HE2 TYR A  17      -5.411   1.420   0.387  1.00  9.02           H  
ATOM    268  HH  TYR A  17      -7.573  -0.925   0.141  1.00 10.44           H  
ATOM    269  N   GLU A  18       1.369  -2.179  -0.471  1.00  3.58           N  
ATOM    270  CA  GLU A  18       2.567  -2.803  -1.018  1.00  3.85           C  
ATOM    271  C   GLU A  18       2.800  -4.171  -0.389  1.00  3.50           C  
ATOM    272  O   GLU A  18       2.907  -5.178  -1.090  1.00  3.97           O  
ATOM    273  CB  GLU A  18       3.786  -1.905  -0.789  1.00  4.01           C  
ATOM    274  CG  GLU A  18       4.049  -0.938  -1.932  1.00  5.07           C  
ATOM    275  CD  GLU A  18       5.443  -0.344  -1.883  1.00  5.76           C  
ATOM    276  OE1 GLU A  18       6.403  -1.102  -1.628  1.00  6.16           O  
ATOM    277  OE2 GLU A  18       5.575   0.877  -2.103  1.00  6.26           O  
ATOM    278  H   GLU A  18       1.462  -1.489   0.215  1.00  3.18           H  
ATOM    279  HA  GLU A  18       2.420  -2.927  -2.080  1.00  4.60           H  
ATOM    280  HB2 GLU A  18       3.630  -1.332   0.112  1.00  3.74           H  
ATOM    281  HB3 GLU A  18       4.658  -2.528  -0.664  1.00  4.02           H  
ATOM    282  HG2 GLU A  18       3.931  -1.465  -2.867  1.00  5.45           H  
ATOM    283  HG3 GLU A  18       3.329  -0.135  -1.880  1.00  5.35           H  
ATOM    284  N   LEU A  19       2.871  -4.203   0.935  1.00  2.98           N  
ATOM    285  CA  LEU A  19       3.083  -5.450   1.660  1.00  3.03           C  
ATOM    286  C   LEU A  19       1.865  -6.363   1.540  1.00  3.19           C  
ATOM    287  O   LEU A  19       1.952  -7.566   1.790  1.00  3.34           O  
ATOM    288  CB  LEU A  19       3.380  -5.166   3.133  1.00  3.46           C  
ATOM    289  CG  LEU A  19       4.823  -4.761   3.438  1.00  4.09           C  
ATOM    290  CD1 LEU A  19       4.983  -3.251   3.352  1.00  4.61           C  
ATOM    291  CD2 LEU A  19       5.240  -5.267   4.810  1.00  4.74           C  
ATOM    292  H   LEU A  19       2.774  -3.368   1.439  1.00  2.84           H  
ATOM    293  HA  LEU A  19       3.936  -5.948   1.221  1.00  3.27           H  
ATOM    294  HB2 LEU A  19       2.727  -4.369   3.461  1.00  3.58           H  
ATOM    295  HB3 LEU A  19       3.150  -6.053   3.702  1.00  3.72           H  
ATOM    296  HG  LEU A  19       5.476  -5.208   2.701  1.00  4.28           H  
ATOM    297 HD11 LEU A  19       4.220  -2.775   3.948  1.00  4.88           H  
ATOM    298 HD12 LEU A  19       4.887  -2.937   2.323  1.00  4.77           H  
ATOM    299 HD13 LEU A  19       5.957  -2.971   3.725  1.00  5.02           H  
ATOM    300 HD21 LEU A  19       4.370  -5.334   5.448  1.00  4.92           H  
ATOM    301 HD22 LEU A  19       5.954  -4.584   5.245  1.00  5.20           H  
ATOM    302 HD23 LEU A  19       5.691  -6.244   4.712  1.00  5.02           H  
ATOM    303  N   LEU A  20       0.728  -5.786   1.157  1.00  3.57           N  
ATOM    304  CA  LEU A  20      -0.504  -6.551   1.005  1.00  4.40           C  
ATOM    305  C   LEU A  20      -0.530  -7.295  -0.328  1.00  4.77           C  
ATOM    306  O   LEU A  20      -1.055  -8.403  -0.418  1.00  5.14           O  
ATOM    307  CB  LEU A  20      -1.719  -5.625   1.111  1.00  5.25           C  
ATOM    308  CG  LEU A  20      -2.034  -5.130   2.523  1.00  6.12           C  
ATOM    309  CD1 LEU A  20      -2.959  -3.924   2.474  1.00  6.63           C  
ATOM    310  CD2 LEU A  20      -2.657  -6.246   3.351  1.00  6.95           C  
ATOM    311  H   LEU A  20       0.717  -4.824   0.971  1.00  3.50           H  
ATOM    312  HA  LEU A  20      -0.545  -7.274   1.807  1.00  4.48           H  
ATOM    313  HB2 LEU A  20      -1.545  -4.766   0.480  1.00  5.02           H  
ATOM    314  HB3 LEU A  20      -2.582  -6.156   0.737  1.00  5.74           H  
ATOM    315  HG  LEU A  20      -1.116  -4.829   3.006  1.00  6.13           H  
ATOM    316 HD11 LEU A  20      -3.947  -4.239   2.174  1.00  7.01           H  
ATOM    317 HD12 LEU A  20      -2.578  -3.209   1.759  1.00  6.74           H  
ATOM    318 HD13 LEU A  20      -3.006  -3.467   3.449  1.00  6.84           H  
ATOM    319 HD21 LEU A  20      -3.346  -5.822   4.065  1.00  7.22           H  
ATOM    320 HD22 LEU A  20      -1.879  -6.781   3.875  1.00  7.23           H  
ATOM    321 HD23 LEU A  20      -3.186  -6.925   2.699  1.00  7.30           H  
ATOM    322  N   HIS A  21       0.040  -6.678  -1.360  1.00  4.96           N  
ATOM    323  CA  HIS A  21       0.077  -7.292  -2.684  1.00  5.80           C  
ATOM    324  C   HIS A  21       1.425  -7.961  -2.942  1.00  5.63           C  
ATOM    325  O   HIS A  21       1.489  -9.060  -3.494  1.00  6.37           O  
ATOM    326  CB  HIS A  21      -0.221  -6.246  -3.769  1.00  6.46           C  
ATOM    327  CG  HIS A  21       0.977  -5.454  -4.207  1.00  7.53           C  
ATOM    328  ND1 HIS A  21       1.150  -4.120  -3.906  1.00  8.12           N  
ATOM    329  CD2 HIS A  21       2.060  -5.818  -4.935  1.00  8.35           C  
ATOM    330  CE1 HIS A  21       2.288  -3.698  -4.429  1.00  9.16           C  
ATOM    331  NE2 HIS A  21       2.858  -4.708  -5.057  1.00  9.30           N  
ATOM    332  H   HIS A  21       0.443  -5.795  -1.229  1.00  4.70           H  
ATOM    333  HA  HIS A  21      -0.692  -8.049  -2.713  1.00  6.38           H  
ATOM    334  HB2 HIS A  21      -0.620  -6.746  -4.638  1.00  6.21           H  
ATOM    335  HB3 HIS A  21      -0.958  -5.551  -3.392  1.00  6.64           H  
ATOM    336  HD1 HIS A  21       0.532  -3.566  -3.385  1.00  7.96           H  
ATOM    337  HD2 HIS A  21       2.258  -6.799  -5.343  1.00  8.42           H  
ATOM    338  HE1 HIS A  21       2.683  -2.695  -4.354  1.00  9.90           H  
ATOM    339  HE2 HIS A  21       3.664  -4.645  -5.612  1.00 10.08           H  
ATOM    340  N   GLY A  22       2.500  -7.292  -2.537  1.00  4.92           N  
ATOM    341  CA  GLY A  22       3.831  -7.838  -2.732  1.00  5.08           C  
ATOM    342  C   GLY A  22       4.170  -8.919  -1.725  1.00  4.40           C  
ATOM    343  O   GLY A  22       4.397 -10.072  -2.094  1.00  4.95           O  
ATOM    344  H   GLY A  22       2.389  -6.421  -2.102  1.00  4.53           H  
ATOM    345  HA2 GLY A  22       3.893  -8.256  -3.727  1.00  5.65           H  
ATOM    346  HA3 GLY A  22       4.552  -7.038  -2.643  1.00  5.45           H  
ATOM    347  N   ALA A  23       4.205  -8.547  -0.450  1.00  3.55           N  
ATOM    348  CA  ALA A  23       4.519  -9.493   0.614  1.00  3.20           C  
ATOM    349  C   ALA A  23       3.256  -9.927   1.350  1.00  2.87           C  
ATOM    350  O   ALA A  23       3.268 -10.122   2.565  1.00  3.20           O  
ATOM    351  CB  ALA A  23       5.515  -8.882   1.588  1.00  3.70           C  
ATOM    352  H   ALA A  23       4.016  -7.613  -0.219  1.00  3.50           H  
ATOM    353  HA  ALA A  23       4.976 -10.362   0.164  1.00  3.50           H  
ATOM    354  HB1 ALA A  23       4.984  -8.311   2.335  1.00  3.97           H  
ATOM    355  HB2 ALA A  23       6.191  -8.233   1.050  1.00  4.07           H  
ATOM    356  HB3 ALA A  23       6.077  -9.668   2.069  1.00  4.01           H  
ATOM    357  N   GLY A  24       2.164 -10.073   0.606  1.00  2.89           N  
ATOM    358  CA  GLY A  24       0.908 -10.480   1.201  1.00  3.16           C  
ATOM    359  C   GLY A  24       0.621 -11.954   1.001  1.00  2.62           C  
ATOM    360  O   GLY A  24      -0.527 -12.347   0.798  1.00  2.27           O  
ATOM    361  H   GLY A  24       2.214  -9.903  -0.357  1.00  3.17           H  
ATOM    362  HA2 GLY A  24       0.940 -10.273   2.261  1.00  3.55           H  
ATOM    363  HA3 GLY A  24       0.108  -9.906   0.757  1.00  3.89           H  
ATOM    364  N   ASN A  25       1.668 -12.773   1.063  1.00  3.16           N  
ATOM    365  CA  ASN A  25       1.522 -14.214   0.890  1.00  3.34           C  
ATOM    366  C   ASN A  25       0.472 -14.773   1.847  1.00  3.02           C  
ATOM    367  O   ASN A  25      -0.129 -15.815   1.587  1.00  3.12           O  
ATOM    368  CB  ASN A  25       2.863 -14.915   1.118  1.00  4.61           C  
ATOM    369  CG  ASN A  25       3.115 -16.020   0.112  1.00  5.37           C  
ATOM    370  OD1 ASN A  25       4.228 -16.178  -0.391  1.00  5.66           O  
ATOM    371  ND2 ASN A  25       2.079 -16.794  -0.189  1.00  6.10           N  
ATOM    372  H   ASN A  25       2.558 -12.399   1.231  1.00  3.77           H  
ATOM    373  HA  ASN A  25       1.199 -14.395  -0.124  1.00  3.33           H  
ATOM    374  HB2 ASN A  25       3.659 -14.190   1.033  1.00  5.01           H  
ATOM    375  HB3 ASN A  25       2.875 -15.343   2.109  1.00  4.95           H  
ATOM    376 HD21 ASN A  25       1.222 -16.611   0.251  1.00  6.13           H  
ATOM    377 HD22 ASN A  25       2.213 -17.519  -0.836  1.00  6.77           H  
ATOM    378  N   HIS A  26       0.255 -14.069   2.955  1.00  3.21           N  
ATOM    379  CA  HIS A  26      -0.724 -14.492   3.949  1.00  3.77           C  
ATOM    380  C   HIS A  26      -2.126 -14.035   3.558  1.00  3.53           C  
ATOM    381  O   HIS A  26      -3.112 -14.717   3.839  1.00  4.27           O  
ATOM    382  CB  HIS A  26      -0.356 -13.934   5.326  1.00  4.44           C  
ATOM    383  CG  HIS A  26       1.081 -14.142   5.688  1.00  5.44           C  
ATOM    384  ND1 HIS A  26       1.993 -13.110   5.769  1.00  6.16           N  
ATOM    385  CD2 HIS A  26       1.765 -15.270   5.990  1.00  6.15           C  
ATOM    386  CE1 HIS A  26       3.176 -13.595   6.103  1.00  7.13           C  
ATOM    387  NE2 HIS A  26       3.064 -14.904   6.245  1.00  7.15           N  
ATOM    388  H   HIS A  26       0.763 -13.244   3.105  1.00  3.33           H  
ATOM    389  HA  HIS A  26      -0.708 -15.571   3.992  1.00  4.38           H  
ATOM    390  HB2 HIS A  26      -0.553 -12.873   5.341  1.00  4.46           H  
ATOM    391  HB3 HIS A  26      -0.963 -14.419   6.076  1.00  4.56           H  
ATOM    392  HD1 HIS A  26       1.802 -12.163   5.606  1.00  6.16           H  
ATOM    393  HD2 HIS A  26       1.364 -16.274   6.024  1.00  6.18           H  
ATOM    394  HE1 HIS A  26       4.079 -13.021   6.241  1.00  7.94           H  
ATOM    395  HE2 HIS A  26       3.814 -15.522   6.375  1.00  7.90           H  
ATOM    396  N   ALA A  27      -2.206 -12.879   2.907  1.00  2.99           N  
ATOM    397  CA  ALA A  27      -3.487 -12.335   2.475  1.00  3.54           C  
ATOM    398  C   ALA A  27      -3.978 -13.032   1.211  1.00  3.33           C  
ATOM    399  O   ALA A  27      -5.156 -13.369   1.093  1.00  4.11           O  
ATOM    400  CB  ALA A  27      -3.372 -10.836   2.243  1.00  3.91           C  
ATOM    401  H   ALA A  27      -1.384 -12.384   2.710  1.00  2.63           H  
ATOM    402  HA  ALA A  27      -4.205 -12.499   3.267  1.00  4.34           H  
ATOM    403  HB1 ALA A  27      -2.527 -10.450   2.794  1.00  4.18           H  
ATOM    404  HB2 ALA A  27      -4.274 -10.348   2.581  1.00  4.09           H  
ATOM    405  HB3 ALA A  27      -3.232 -10.644   1.189  1.00  4.23           H  
ATOM    406  N   ALA A  28      -3.065 -13.246   0.270  1.00  2.64           N  
ATOM    407  CA  ALA A  28      -3.402 -13.906  -0.986  1.00  2.96           C  
ATOM    408  C   ALA A  28      -3.904 -15.324  -0.742  1.00  3.03           C  
ATOM    409  O   ALA A  28      -4.911 -15.744  -1.310  1.00  3.55           O  
ATOM    410  CB  ALA A  28      -2.195 -13.924  -1.912  1.00  3.18           C  
ATOM    411  H   ALA A  28      -2.143 -12.955   0.424  1.00  2.27           H  
ATOM    412  HA  ALA A  28      -4.184 -13.334  -1.464  1.00  3.66           H  
ATOM    413  HB1 ALA A  28      -2.373 -14.616  -2.722  1.00  3.43           H  
ATOM    414  HB2 ALA A  28      -1.320 -14.235  -1.359  1.00  3.40           H  
ATOM    415  HB3 ALA A  28      -2.033 -12.933  -2.312  1.00  3.57           H  
ATOM    416  N   GLY A  29      -3.194 -16.059   0.110  1.00  3.01           N  
ATOM    417  CA  GLY A  29      -3.584 -17.424   0.416  1.00  3.73           C  
ATOM    418  C   GLY A  29      -4.999 -17.518   0.953  1.00  4.27           C  
ATOM    419  O   GLY A  29      -5.665 -18.541   0.787  1.00  4.94           O  
ATOM    420  H   GLY A  29      -2.400 -15.671   0.535  1.00  2.84           H  
ATOM    421  HA2 GLY A  29      -3.511 -18.017  -0.483  1.00  3.97           H  
ATOM    422  HA3 GLY A  29      -2.904 -17.823   1.155  1.00  4.13           H  
ATOM    423  N   ILE A  30      -5.460 -16.451   1.596  1.00  4.35           N  
ATOM    424  CA  ILE A  30      -6.804 -16.418   2.158  1.00  5.35           C  
ATOM    425  C   ILE A  30      -7.819 -15.936   1.125  1.00  5.61           C  
ATOM    426  O   ILE A  30      -8.985 -16.328   1.156  1.00  6.45           O  
ATOM    427  CB  ILE A  30      -6.878 -15.503   3.397  1.00  6.08           C  
ATOM    428  CG1 ILE A  30      -5.755 -15.846   4.378  1.00  6.77           C  
ATOM    429  CG2 ILE A  30      -8.235 -15.630   4.071  1.00  6.80           C  
ATOM    430  CD1 ILE A  30      -5.414 -14.715   5.323  1.00  7.30           C  
ATOM    431  H   ILE A  30      -4.882 -15.666   1.696  1.00  3.93           H  
ATOM    432  HA  ILE A  30      -7.064 -17.421   2.461  1.00  5.76           H  
ATOM    433  HB  ILE A  30      -6.759 -14.481   3.068  1.00  5.91           H  
ATOM    434 HG12 ILE A  30      -6.053 -16.696   4.974  1.00  7.33           H  
ATOM    435 HG13 ILE A  30      -4.863 -16.095   3.822  1.00  6.68           H  
ATOM    436 HG21 ILE A  30      -8.137 -15.399   5.121  1.00  7.09           H  
ATOM    437 HG22 ILE A  30      -8.601 -16.640   3.956  1.00  7.11           H  
ATOM    438 HG23 ILE A  30      -8.930 -14.942   3.614  1.00  7.04           H  
ATOM    439 HD11 ILE A  30      -5.189 -13.825   4.755  1.00  7.25           H  
ATOM    440 HD12 ILE A  30      -4.556 -14.989   5.917  1.00  7.62           H  
ATOM    441 HD13 ILE A  30      -6.256 -14.522   5.973  1.00  7.69           H  
ATOM    442  N   LEU A  31      -7.366 -15.085   0.211  1.00  5.17           N  
ATOM    443  CA  LEU A  31      -8.233 -14.553  -0.834  1.00  5.76           C  
ATOM    444  C   LEU A  31      -8.470 -15.582  -1.937  1.00  5.42           C  
ATOM    445  O   LEU A  31      -9.270 -15.359  -2.844  1.00  6.08           O  
ATOM    446  CB  LEU A  31      -7.625 -13.279  -1.428  1.00  6.52           C  
ATOM    447  CG  LEU A  31      -8.422 -12.655  -2.576  1.00  7.36           C  
ATOM    448  CD1 LEU A  31      -8.290 -11.141  -2.557  1.00  8.01           C  
ATOM    449  CD2 LEU A  31      -7.954 -13.214  -3.911  1.00  8.09           C  
ATOM    450  H   LEU A  31      -6.426 -14.810   0.236  1.00  4.63           H  
ATOM    451  HA  LEU A  31      -9.181 -14.309  -0.380  1.00  6.31           H  
ATOM    452  HB2 LEU A  31      -7.537 -12.546  -0.638  1.00  6.60           H  
ATOM    453  HB3 LEU A  31      -6.636 -13.513  -1.791  1.00  6.69           H  
ATOM    454  HG  LEU A  31      -9.467 -12.901  -2.456  1.00  7.29           H  
ATOM    455 HD11 LEU A  31      -8.028 -10.815  -1.561  1.00  8.21           H  
ATOM    456 HD12 LEU A  31      -9.230 -10.693  -2.846  1.00  8.25           H  
ATOM    457 HD13 LEU A  31      -7.519 -10.837  -3.249  1.00  8.30           H  
ATOM    458 HD21 LEU A  31      -7.241 -12.535  -4.356  1.00  8.47           H  
ATOM    459 HD22 LEU A  31      -8.804 -13.328  -4.571  1.00  8.29           H  
ATOM    460 HD23 LEU A  31      -7.490 -14.176  -3.756  1.00  8.27           H  
ATOM    461  N   THR A  32      -7.771 -16.711  -1.856  1.00  4.75           N  
ATOM    462  CA  THR A  32      -7.910 -17.770  -2.848  1.00  4.91           C  
ATOM    463  C   THR A  32      -8.842 -18.870  -2.349  1.00  5.46           C  
ATOM    464  O   THR A  32      -8.712 -20.030  -2.738  1.00  5.80           O  
ATOM    465  CB  THR A  32      -6.539 -18.362  -3.186  1.00  5.15           C  
ATOM    466  OG1 THR A  32      -5.625 -17.340  -3.541  1.00  5.52           O  
ATOM    467  CG2 THR A  32      -6.581 -19.356  -4.326  1.00  5.77           C  
ATOM    468  H   THR A  32      -7.148 -16.836  -1.110  1.00  4.44           H  
ATOM    469  HA  THR A  32      -8.332 -17.334  -3.741  1.00  5.01           H  
ATOM    470  HB  THR A  32      -6.156 -18.874  -2.314  1.00  5.13           H  
ATOM    471  HG1 THR A  32      -5.881 -16.959  -4.383  1.00  5.59           H  
ATOM    472 HG21 THR A  32      -7.324 -19.048  -5.046  1.00  6.02           H  
ATOM    473 HG22 THR A  32      -6.834 -20.334  -3.942  1.00  6.04           H  
ATOM    474 HG23 THR A  32      -5.612 -19.397  -4.804  1.00  6.06           H  
ATOM    475  N   LEU A  33      -9.783 -18.497  -1.487  1.00  5.97           N  
ATOM    476  CA  LEU A  33     -10.736 -19.453  -0.936  1.00  6.85           C  
ATOM    477  C   LEU A  33     -10.018 -20.571  -0.187  1.00  7.51           C  
ATOM    478  O   LEU A  33     -10.708 -21.452   0.366  1.00  7.81           O  
ATOM    479  CB  LEU A  33     -11.601 -20.043  -2.052  1.00  7.27           C  
ATOM    480  CG  LEU A  33     -12.071 -19.040  -3.107  1.00  7.87           C  
ATOM    481  CD1 LEU A  33     -12.991 -19.715  -4.113  1.00  8.08           C  
ATOM    482  CD2 LEU A  33     -12.773 -17.862  -2.446  1.00  8.48           C  
ATOM    483  OXT LEU A  33      -8.769 -20.557  -0.163  1.00  7.98           O  
ATOM    484  H   LEU A  33      -9.837 -17.556  -1.214  1.00  5.99           H  
ATOM    485  HA  LEU A  33     -11.373 -18.923  -0.242  1.00  7.08           H  
ATOM    486  HB2 LEU A  33     -11.031 -20.815  -2.548  1.00  7.07           H  
ATOM    487  HB3 LEU A  33     -12.473 -20.495  -1.604  1.00  7.69           H  
ATOM    488  HG  LEU A  33     -11.213 -18.661  -3.642  1.00  8.04           H  
ATOM    489 HD11 LEU A  33     -12.516 -20.606  -4.494  1.00  8.27           H  
ATOM    490 HD12 LEU A  33     -13.192 -19.036  -4.928  1.00  8.16           H  
ATOM    491 HD13 LEU A  33     -13.920 -19.979  -3.629  1.00  8.27           H  
ATOM    492 HD21 LEU A  33     -12.052 -17.087  -2.232  1.00  8.84           H  
ATOM    493 HD22 LEU A  33     -13.234 -18.189  -1.527  1.00  8.47           H  
ATOM    494 HD23 LEU A  33     -13.531 -17.476  -3.112  1.00  8.84           H  
TER     495      LEU A  33                                                      
CONECT   82  179                                                                
CONECT   92  200                                                                
CONECT  179   82                                                                
CONECT  200   92                                                                
MASTER       92    0    0    2    0    0    0    6  248    1    4    3          
END