HEADER    VIRAL PROTEIN                           01-APR-02   1LB0              
TITLE     NMR STRUCTURE OF HIV-1 GP41 659-671 13-MER PEPTIDE                    
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: GP41;                                                      
COMPND   3 CHAIN: A;                                                            
COMPND   4 FRAGMENT: RESIDUES 659-671;                                          
COMPND   5 SYNONYM: TRANSMEMBRANE GLYCOPROTEIN;                                 
COMPND   6 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 SYNTHETIC: YES;                                                      
SOURCE   3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE SEQUENCE  
SOURCE   4 OF THE PEPTIDE IS NATURALLY FOUND IN HIV-1 VIRUS.                    
KEYWDS    3-10 HELIX, GP41 ENVELOPE PROTEIN, VIRAL PROTEIN                      
EXPDTA    SOLUTION NMR                                                          
AUTHOR    Z.BIRON                                                               
REVDAT   3   23-FEB-22 1LB0    1       REMARK                                   
REVDAT   2   24-FEB-09 1LB0    1       VERSN                                    
REVDAT   1   04-DEC-02 1LB0    0                                                
JRNL        AUTH   Z.BIRON,S.KHARE,A.O.SAMSON,Y.HAYEK,F.NAIDER,J.ANGLISTER      
JRNL        TITL   A MONOMERIC 3(10)-HELIX IS FORMED IN WATER BY A 13-RESIDUE   
JRNL        TITL 2 PEPTIDE REPRESENTING THE NEUTRALIZING DETERMINANT OF HIV-1   
JRNL        TITL 3 ON GP41(,).                                                  
JRNL        REF    BIOCHEMISTRY                  V.  41 12687 2002              
JRNL        REFN                   ISSN 0006-2960                               
JRNL        PMID   12379111                                                     
JRNL        DOI    10.1021/BI026261Y                                            
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : AURELIA AMIX 2.8.11, CNS                             
REMARK   3   AUTHORS     : BRUKER (AURELIA), A.T.BRUNGER (CNS)                  
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS:                                           
REMARK   3  THE STRUCTURES ARE BASED ON A TOTAL OF 212 RESTRAINTS, 202 ARE NOE- 
REMARK   3  DERIVED                                                             
REMARK   3  DISTANCE CONSTRAINTS, 9 DIHEDRAL ANGLE RESTRAINTS,1 DISTANCE        
REMARK   3  RESTRAINT                                                           
REMARK   3  FROM HYDROGEN BONDS.                                                
REMARK   4                                                                      
REMARK   4 1LB0 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 02-APR-02.                  
REMARK 100 THE DEPOSITION ID IS D_1000015800.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 277                                
REMARK 210  PH                             : 7.7                                
REMARK 210  IONIC STRENGTH                 : 0.1MM                              
REMARK 210  PRESSURE                       : 1 ATM                              
REMARK 210  SAMPLE CONTENTS                : 3.5MM GP41659-671; 50MM 50MM       
REMARK 210                                   AMMONIUM ACETATE BUFFER.; 5 MM     
REMARK 210                                   GP41659-671; 50MM 50MM AMMONIUM    
REMARK 210                                   ACETATE BUFFER                     
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : NOESY; DQF-COSY; TOCSY             
REMARK 210  SPECTROMETER FIELD STRENGTH    : 800 MHZ; 500 MHZ                   
REMARK 210  SPECTROMETER MODEL             : DRX; DMX                           
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : XWINNMR 3.0, CNS 1.1               
REMARK 210   METHOD USED                   : DISTANCE GEOMETRY SIMULATED        
REMARK 210                                   ANNEALING                          
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: THIS STRUCTURE WAS DETERMINED USING STANDARD 2D              
REMARK 210  HOMONUCLEAR TECHNIQUES.                                             
REMARK 215                                                                      
REMARK 215 NMR STUDY                                                            
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
REMARK 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            
DBREF  1LB0 A    1    13  UNP    P31872   ENV_HV1W1      659    671             
SEQRES   1 A   13  GLU LEU LEU GLU LEU ASP LYS TRP ALA SER LEU TRP ASN          
HELIX    1   1 LEU A    3  ASN A   13  5                                  11    
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      13.551   5.455   4.283  1.00  0.00           N  
ATOM      2  CA  GLU A   1      14.185   4.724   3.154  1.00  0.00           C  
ATOM      3  C   GLU A   1      13.640   3.303   3.043  1.00  0.00           C  
ATOM      4  O   GLU A   1      13.962   2.439   3.859  1.00  0.00           O  
ATOM      5  CB  GLU A   1      15.699   4.697   3.380  1.00  0.00           C  
ATOM      6  CG  GLU A   1      16.481   5.488   2.344  1.00  0.00           C  
ATOM      7  CD  GLU A   1      16.952   6.830   2.868  1.00  0.00           C  
ATOM      8  OE1 GLU A   1      16.352   7.331   3.842  1.00  0.00           O  
ATOM      9  OE2 GLU A   1      17.920   7.382   2.303  1.00  0.00           O  
ATOM     10  H1  GLU A   1      13.851   6.448   4.225  1.00  0.00           H  
ATOM     11  H2  GLU A   1      13.878   5.015   5.168  1.00  0.00           H  
ATOM     12  H3  GLU A   1      12.521   5.368   4.178  1.00  0.00           H  
ATOM     13  HA  GLU A   1      13.971   5.255   2.239  1.00  0.00           H  
ATOM     14  HB2 GLU A   1      15.913   5.112   4.354  1.00  0.00           H  
ATOM     15  HB3 GLU A   1      16.040   3.673   3.352  1.00  0.00           H  
ATOM     16  HG2 GLU A   1      17.345   4.912   2.048  1.00  0.00           H  
ATOM     17  HG3 GLU A   1      15.849   5.654   1.484  1.00  0.00           H  
ATOM     18  N   LEU A   2      12.814   3.069   2.029  1.00  0.00           N  
ATOM     19  CA  LEU A   2      12.225   1.752   1.811  1.00  0.00           C  
ATOM     20  C   LEU A   2      12.937   1.018   0.680  1.00  0.00           C  
ATOM     21  O   LEU A   2      12.327   0.229  -0.042  1.00  0.00           O  
ATOM     22  CB  LEU A   2      10.735   1.884   1.491  1.00  0.00           C  
ATOM     23  CG  LEU A   2       9.886   2.502   2.603  1.00  0.00           C  
ATOM     24  CD1 LEU A   2      10.039   4.015   2.613  1.00  0.00           C  
ATOM     25  CD2 LEU A   2       8.425   2.114   2.435  1.00  0.00           C  
ATOM     26  H   LEU A   2      12.595   3.798   1.412  1.00  0.00           H  
ATOM     27  HA  LEU A   2      12.340   1.183   2.721  1.00  0.00           H  
ATOM     28  HB2 LEU A   2      10.631   2.494   0.606  1.00  0.00           H  
ATOM     29  HB3 LEU A   2      10.346   0.900   1.277  1.00  0.00           H  
ATOM     30  HG  LEU A   2      10.225   2.126   3.558  1.00  0.00           H  
ATOM     31 HD11 LEU A   2      10.994   4.277   3.043  1.00  0.00           H  
ATOM     32 HD12 LEU A   2       9.247   4.453   3.202  1.00  0.00           H  
ATOM     33 HD13 LEU A   2       9.985   4.389   1.602  1.00  0.00           H  
ATOM     34 HD21 LEU A   2       7.979   1.960   3.407  1.00  0.00           H  
ATOM     35 HD22 LEU A   2       8.358   1.201   1.861  1.00  0.00           H  
ATOM     36 HD23 LEU A   2       7.899   2.903   1.919  1.00  0.00           H  
ATOM     37  N   LEU A   3      14.231   1.284   0.530  1.00  0.00           N  
ATOM     38  CA  LEU A   3      15.026   0.648  -0.514  1.00  0.00           C  
ATOM     39  C   LEU A   3      15.583  -0.688  -0.035  1.00  0.00           C  
ATOM     40  O   LEU A   3      16.244  -0.762   1.001  1.00  0.00           O  
ATOM     41  CB  LEU A   3      16.171   1.568  -0.943  1.00  0.00           C  
ATOM     42  CG  LEU A   3      15.737   2.917  -1.519  1.00  0.00           C  
ATOM     43  CD1 LEU A   3      16.841   3.949  -1.350  1.00  0.00           C  
ATOM     44  CD2 LEU A   3      15.360   2.772  -2.985  1.00  0.00           C  
ATOM     45  H   LEU A   3      14.661   1.922   1.137  1.00  0.00           H  
ATOM     46  HA  LEU A   3      14.380   0.473  -1.361  1.00  0.00           H  
ATOM     47  HB2 LEU A   3      16.798   1.752  -0.082  1.00  0.00           H  
ATOM     48  HB3 LEU A   3      16.756   1.054  -1.690  1.00  0.00           H  
ATOM     49  HG  LEU A   3      14.867   3.267  -0.982  1.00  0.00           H  
ATOM     50 HD11 LEU A   3      16.713   4.735  -2.079  1.00  0.00           H  
ATOM     51 HD12 LEU A   3      17.801   3.476  -1.493  1.00  0.00           H  
ATOM     52 HD13 LEU A   3      16.792   4.369  -0.356  1.00  0.00           H  
ATOM     53 HD21 LEU A   3      14.543   3.441  -3.215  1.00  0.00           H  
ATOM     54 HD22 LEU A   3      15.057   1.754  -3.180  1.00  0.00           H  
ATOM     55 HD23 LEU A   3      16.211   3.019  -3.602  1.00  0.00           H  
ATOM     56  N   GLU A   4      15.314  -1.743  -0.798  1.00  0.00           N  
ATOM     57  CA  GLU A   4      15.789  -3.078  -0.453  1.00  0.00           C  
ATOM     58  C   GLU A   4      17.249  -3.258  -0.857  1.00  0.00           C  
ATOM     59  O   GLU A   4      17.986  -4.020  -0.232  1.00  0.00           O  
ATOM     60  CB  GLU A   4      14.924  -4.141  -1.132  1.00  0.00           C  
ATOM     61  CG  GLU A   4      13.687  -4.521  -0.334  1.00  0.00           C  
ATOM     62  CD  GLU A   4      13.449  -6.018  -0.305  1.00  0.00           C  
ATOM     63  OE1 GLU A   4      14.433  -6.774  -0.165  1.00  0.00           O  
ATOM     64  OE2 GLU A   4      12.277  -6.435  -0.423  1.00  0.00           O  
ATOM     65  H   GLU A   4      14.783  -1.620  -1.612  1.00  0.00           H  
ATOM     66  HA  GLU A   4      15.708  -3.191   0.618  1.00  0.00           H  
ATOM     67  HB2 GLU A   4      14.604  -3.767  -2.094  1.00  0.00           H  
ATOM     68  HB3 GLU A   4      15.518  -5.031  -1.281  1.00  0.00           H  
ATOM     69  HG2 GLU A   4      13.809  -4.172   0.681  1.00  0.00           H  
ATOM     70  HG3 GLU A   4      12.827  -4.042  -0.778  1.00  0.00           H  
ATOM     71  N   LEU A   5      17.659  -2.553  -1.908  1.00  0.00           N  
ATOM     72  CA  LEU A   5      19.032  -2.637  -2.396  1.00  0.00           C  
ATOM     73  C   LEU A   5      19.947  -1.642  -1.681  1.00  0.00           C  
ATOM     74  O   LEU A   5      21.039  -1.340  -2.161  1.00  0.00           O  
ATOM     75  CB  LEU A   5      19.074  -2.387  -3.900  1.00  0.00           C  
ATOM     76  CG  LEU A   5      18.351  -1.121  -4.333  1.00  0.00           C  
ATOM     77  CD1 LEU A   5      19.317  -0.141  -4.984  1.00  0.00           C  
ATOM     78  CD2 LEU A   5      17.199  -1.448  -5.272  1.00  0.00           C  
ATOM     79  H   LEU A   5      17.024  -1.965  -2.365  1.00  0.00           H  
ATOM     80  HA  LEU A   5      19.384  -3.627  -2.204  1.00  0.00           H  
ATOM     81  HB2 LEU A   5      20.108  -2.319  -4.208  1.00  0.00           H  
ATOM     82  HB3 LEU A   5      18.618  -3.229  -4.400  1.00  0.00           H  
ATOM     83  HG  LEU A   5      17.945  -0.654  -3.452  1.00  0.00           H  
ATOM     84 HD11 LEU A   5      20.065  -0.688  -5.539  1.00  0.00           H  
ATOM     85 HD12 LEU A   5      19.797   0.452  -4.220  1.00  0.00           H  
ATOM     86 HD13 LEU A   5      18.774   0.507  -5.656  1.00  0.00           H  
ATOM     87 HD21 LEU A   5      16.403  -1.919  -4.715  1.00  0.00           H  
ATOM     88 HD22 LEU A   5      17.544  -2.119  -6.045  1.00  0.00           H  
ATOM     89 HD23 LEU A   5      16.833  -0.537  -5.723  1.00  0.00           H  
ATOM     90  N   ASP A   6      19.500  -1.134  -0.535  1.00  0.00           N  
ATOM     91  CA  ASP A   6      20.289  -0.176   0.233  1.00  0.00           C  
ATOM     92  C   ASP A   6      21.409  -0.868   1.009  1.00  0.00           C  
ATOM     93  O   ASP A   6      22.224  -0.209   1.654  1.00  0.00           O  
ATOM     94  CB  ASP A   6      19.388   0.596   1.199  1.00  0.00           C  
ATOM     95  CG  ASP A   6      18.720  -0.308   2.215  1.00  0.00           C  
ATOM     96  OD1 ASP A   6      18.588  -1.519   1.937  1.00  0.00           O  
ATOM     97  OD2 ASP A   6      18.328   0.194   3.290  1.00  0.00           O  
ATOM     98  H   ASP A   6      18.624  -1.407  -0.197  1.00  0.00           H  
ATOM     99  HA  ASP A   6      20.730   0.519  -0.464  1.00  0.00           H  
ATOM    100  HB2 ASP A   6      19.982   1.326   1.729  1.00  0.00           H  
ATOM    101  HB3 ASP A   6      18.619   1.105   0.635  1.00  0.00           H  
ATOM    102  N   LYS A   7      21.446  -2.198   0.947  1.00  0.00           N  
ATOM    103  CA  LYS A   7      22.466  -2.967   1.646  1.00  0.00           C  
ATOM    104  C   LYS A   7      23.846  -2.763   1.028  1.00  0.00           C  
ATOM    105  O   LYS A   7      24.860  -3.157   1.605  1.00  0.00           O  
ATOM    106  CB  LYS A   7      22.104  -4.450   1.633  1.00  0.00           C  
ATOM    107  CG  LYS A   7      22.801  -5.247   2.717  1.00  0.00           C  
ATOM    108  CD  LYS A   7      22.431  -6.721   2.654  1.00  0.00           C  
ATOM    109  CE  LYS A   7      22.826  -7.451   3.928  1.00  0.00           C  
ATOM    110  NZ  LYS A   7      21.695  -8.242   4.488  1.00  0.00           N  
ATOM    111  H   LYS A   7      20.772  -2.673   0.423  1.00  0.00           H  
ATOM    112  HA  LYS A   7      22.493  -2.622   2.664  1.00  0.00           H  
ATOM    113  HB2 LYS A   7      21.037  -4.551   1.770  1.00  0.00           H  
ATOM    114  HB3 LYS A   7      22.377  -4.868   0.675  1.00  0.00           H  
ATOM    115  HG2 LYS A   7      23.868  -5.147   2.589  1.00  0.00           H  
ATOM    116  HG3 LYS A   7      22.512  -4.851   3.678  1.00  0.00           H  
ATOM    117  HD2 LYS A   7      21.364  -6.808   2.517  1.00  0.00           H  
ATOM    118  HD3 LYS A   7      22.941  -7.174   1.817  1.00  0.00           H  
ATOM    119  HE2 LYS A   7      23.644  -8.119   3.706  1.00  0.00           H  
ATOM    120  HE3 LYS A   7      23.144  -6.725   4.662  1.00  0.00           H  
ATOM    121  HZ1 LYS A   7      21.211  -7.698   5.230  1.00  0.00           H  
ATOM    122  HZ2 LYS A   7      22.048  -9.130   4.899  1.00  0.00           H  
ATOM    123  HZ3 LYS A   7      21.012  -8.469   3.737  1.00  0.00           H  
ATOM    124  N   TRP A   8      23.878  -2.146  -0.144  1.00  0.00           N  
ATOM    125  CA  TRP A   8      25.133  -1.888  -0.842  1.00  0.00           C  
ATOM    126  C   TRP A   8      25.836  -0.649  -0.284  1.00  0.00           C  
ATOM    127  O   TRP A   8      26.929  -0.296  -0.727  1.00  0.00           O  
ATOM    128  CB  TRP A   8      24.879  -1.710  -2.340  1.00  0.00           C  
ATOM    129  CG  TRP A   8      25.004  -2.984  -3.119  1.00  0.00           C  
ATOM    130  CD1 TRP A   8      24.709  -4.244  -2.683  1.00  0.00           C  
ATOM    131  CD2 TRP A   8      25.458  -3.122  -4.470  1.00  0.00           C  
ATOM    132  NE1 TRP A   8      24.952  -5.157  -3.680  1.00  0.00           N  
ATOM    133  CE2 TRP A   8      25.412  -4.493  -4.787  1.00  0.00           C  
ATOM    134  CE3 TRP A   8      25.898  -2.220  -5.443  1.00  0.00           C  
ATOM    135  CZ2 TRP A   8      25.790  -4.981  -6.036  1.00  0.00           C  
ATOM    136  CZ3 TRP A   8      26.273  -2.706  -6.681  1.00  0.00           C  
ATOM    137  CH2 TRP A   8      26.216  -4.076  -6.968  1.00  0.00           C  
ATOM    138  H   TRP A   8      23.038  -1.857  -0.550  1.00  0.00           H  
ATOM    139  HA  TRP A   8      25.774  -2.744  -0.695  1.00  0.00           H  
ATOM    140  HB2 TRP A   8      23.880  -1.327  -2.486  1.00  0.00           H  
ATOM    141  HB3 TRP A   8      25.592  -1.003  -2.738  1.00  0.00           H  
ATOM    142  HD1 TRP A   8      24.340  -4.474  -1.694  1.00  0.00           H  
ATOM    143  HE1 TRP A   8      24.817  -6.125  -3.611  1.00  0.00           H  
ATOM    144  HE3 TRP A   8      25.949  -1.160  -5.240  1.00  0.00           H  
ATOM    145  HZ2 TRP A   8      25.752  -6.034  -6.273  1.00  0.00           H  
ATOM    146  HZ3 TRP A   8      26.616  -2.024  -7.445  1.00  0.00           H  
ATOM    147  HH2 TRP A   8      26.519  -4.411  -7.949  1.00  0.00           H  
ATOM    148  N   ALA A   9      25.206   0.008   0.688  1.00  0.00           N  
ATOM    149  CA  ALA A   9      25.779   1.202   1.296  1.00  0.00           C  
ATOM    150  C   ALA A   9      27.119   0.895   1.958  1.00  0.00           C  
ATOM    151  O   ALA A   9      27.985   1.764   2.060  1.00  0.00           O  
ATOM    152  CB  ALA A   9      24.811   1.793   2.310  1.00  0.00           C  
ATOM    153  H   ALA A   9      24.338  -0.317   1.003  1.00  0.00           H  
ATOM    154  HA  ALA A   9      25.935   1.932   0.515  1.00  0.00           H  
ATOM    155  HB1 ALA A   9      24.187   1.008   2.711  1.00  0.00           H  
ATOM    156  HB2 ALA A   9      24.192   2.534   1.827  1.00  0.00           H  
ATOM    157  HB3 ALA A   9      25.367   2.256   3.112  1.00  0.00           H  
ATOM    158  N   SER A  10      27.282  -0.345   2.409  1.00  0.00           N  
ATOM    159  CA  SER A  10      28.518  -0.764   3.062  1.00  0.00           C  
ATOM    160  C   SER A  10      29.670  -0.865   2.065  1.00  0.00           C  
ATOM    161  O   SER A  10      30.829  -1.001   2.455  1.00  0.00           O  
ATOM    162  CB  SER A  10      28.317  -2.107   3.766  1.00  0.00           C  
ATOM    163  OG  SER A  10      29.011  -2.145   5.001  1.00  0.00           O  
ATOM    164  H   SER A  10      26.556  -0.994   2.300  1.00  0.00           H  
ATOM    165  HA  SER A  10      28.767  -0.018   3.798  1.00  0.00           H  
ATOM    166  HB2 SER A  10      27.265  -2.259   3.954  1.00  0.00           H  
ATOM    167  HB3 SER A  10      28.688  -2.901   3.134  1.00  0.00           H  
ATOM    168  HG  SER A  10      28.769  -2.941   5.480  1.00  0.00           H  
ATOM    169  N   LEU A  11      29.346  -0.797   0.778  1.00  0.00           N  
ATOM    170  CA  LEU A  11      30.358  -0.878  -0.270  1.00  0.00           C  
ATOM    171  C   LEU A  11      30.942   0.497  -0.584  1.00  0.00           C  
ATOM    172  O   LEU A  11      31.829   0.626  -1.428  1.00  0.00           O  
ATOM    173  CB  LEU A  11      29.765  -1.493  -1.540  1.00  0.00           C  
ATOM    174  CG  LEU A  11      28.723  -2.588  -1.305  1.00  0.00           C  
ATOM    175  CD1 LEU A  11      27.952  -2.875  -2.584  1.00  0.00           C  
ATOM    176  CD2 LEU A  11      29.389  -3.854  -0.786  1.00  0.00           C  
ATOM    177  H   LEU A  11      28.407  -0.685   0.528  1.00  0.00           H  
ATOM    178  HA  LEU A  11      31.151  -1.514   0.089  1.00  0.00           H  
ATOM    179  HB2 LEU A  11      29.304  -0.704  -2.115  1.00  0.00           H  
ATOM    180  HB3 LEU A  11      30.571  -1.915  -2.121  1.00  0.00           H  
ATOM    181  HG  LEU A  11      28.018  -2.250  -0.560  1.00  0.00           H  
ATOM    182 HD11 LEU A  11      27.351  -3.762  -2.451  1.00  0.00           H  
ATOM    183 HD12 LEU A  11      28.647  -3.030  -3.396  1.00  0.00           H  
ATOM    184 HD13 LEU A  11      27.312  -2.036  -2.814  1.00  0.00           H  
ATOM    185 HD21 LEU A  11      28.710  -4.373  -0.126  1.00  0.00           H  
ATOM    186 HD22 LEU A  11      30.287  -3.593  -0.246  1.00  0.00           H  
ATOM    187 HD23 LEU A  11      29.643  -4.494  -1.618  1.00  0.00           H  
ATOM    188  N   TRP A  12      30.441   1.521   0.098  1.00  0.00           N  
ATOM    189  CA  TRP A  12      30.914   2.885  -0.111  1.00  0.00           C  
ATOM    190  C   TRP A  12      31.248   3.553   1.219  1.00  0.00           C  
ATOM    191  O   TRP A  12      31.107   4.767   1.367  1.00  0.00           O  
ATOM    192  CB  TRP A  12      29.858   3.704  -0.856  1.00  0.00           C  
ATOM    193  CG  TRP A  12      30.444   4.703  -1.807  1.00  0.00           C  
ATOM    194  CD1 TRP A  12      30.259   6.055  -1.791  1.00  0.00           C  
ATOM    195  CD2 TRP A  12      31.308   4.428  -2.915  1.00  0.00           C  
ATOM    196  NE1 TRP A  12      30.956   6.638  -2.821  1.00  0.00           N  
ATOM    197  CE2 TRP A  12      31.608   5.660  -3.526  1.00  0.00           C  
ATOM    198  CE3 TRP A  12      31.858   3.259  -3.450  1.00  0.00           C  
ATOM    199  CZ2 TRP A  12      32.433   5.756  -4.644  1.00  0.00           C  
ATOM    200  CZ3 TRP A  12      32.676   3.356  -4.560  1.00  0.00           C  
ATOM    201  CH2 TRP A  12      32.957   4.597  -5.146  1.00  0.00           C  
ATOM    202  H   TRP A  12      29.736   1.356   0.756  1.00  0.00           H  
ATOM    203  HA  TRP A  12      31.809   2.836  -0.712  1.00  0.00           H  
ATOM    204  HB2 TRP A  12      29.227   3.036  -1.422  1.00  0.00           H  
ATOM    205  HB3 TRP A  12      29.255   4.239  -0.137  1.00  0.00           H  
ATOM    206  HD1 TRP A  12      29.651   6.578  -1.067  1.00  0.00           H  
ATOM    207  HE1 TRP A  12      30.983   7.598  -3.019  1.00  0.00           H  
ATOM    208  HE3 TRP A  12      31.652   2.294  -3.012  1.00  0.00           H  
ATOM    209  HZ2 TRP A  12      32.660   6.705  -5.107  1.00  0.00           H  
ATOM    210  HZ3 TRP A  12      33.110   2.464  -4.987  1.00  0.00           H  
ATOM    211  HH2 TRP A  12      33.601   4.625  -6.012  1.00  0.00           H  
ATOM    212  N   ASN A  13      31.693   2.754   2.182  1.00  0.00           N  
ATOM    213  CA  ASN A  13      32.047   3.268   3.500  1.00  0.00           C  
ATOM    214  C   ASN A  13      32.653   2.170   4.368  1.00  0.00           C  
ATOM    215  O   ASN A  13      33.825   2.317   4.774  1.00  0.00           O  
ATOM    216  CB  ASN A  13      30.815   3.859   4.188  1.00  0.00           C  
ATOM    217  CG  ASN A  13      31.136   5.123   4.962  1.00  0.00           C  
ATOM    218  OD1 ASN A  13      30.387   6.099   4.916  1.00  0.00           O  
ATOM    219  ND2 ASN A  13      32.254   5.111   5.678  1.00  0.00           N  
ATOM    220  OXT ASN A  13      31.949   1.173   4.635  1.00  0.00           O  
ATOM    221  H   ASN A  13      31.784   1.794   2.004  1.00  0.00           H  
ATOM    222  HA  ASN A  13      32.781   4.049   3.364  1.00  0.00           H  
ATOM    223  HB2 ASN A  13      30.072   4.096   3.442  1.00  0.00           H  
ATOM    224  HB3 ASN A  13      30.410   3.131   4.875  1.00  0.00           H  
ATOM    225 HD21 ASN A  13      32.802   4.299   5.668  1.00  0.00           H  
ATOM    226 HD22 ASN A  13      32.485   5.915   6.189  1.00  0.00           H  
TER     227      ASN A  13                                                      
MASTER       73    0    0    1    0    0    0    6  115    1    0    1          
END