HEADER    MEMBRANE PROTEIN                        10-DEC-00   1HO7              
TITLE     NMR STRUCTURE OF THE POTASSIUM CHANNEL FRAGMENT L45 IN TFE            
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: VOLTAGE-GATED POTASSIUM CHANNEL PROTEIN;                   
COMPND   3 CHAIN: A;                                                            
COMPND   4 FRAGMENT: L45 SEGMENT OF THE SHAKER POTASSIUM CHANNEL                
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER;                        
SOURCE   3 ORGANISM_COMMON: FRUIT FLY;                                          
SOURCE   4 ORGANISM_TAXID: 7227                                                 
KEYWDS    HELIX, MEMBRANE PROTEIN                                               
EXPDTA    SOLUTION NMR                                                          
AUTHOR    O.OHLENSCHLAGER,H.HOJO,R.RAMACHANDRAN,M.GORLACH,P.I.HARIS             
REVDAT   3   23-FEB-22 1HO7    1       REMARK                                   
REVDAT   2   24-FEB-09 1HO7    1       VERSN                                    
REVDAT   1   05-JUN-02 1HO7    0                                                
JRNL        AUTH   O.OHLENSCHLAGER,H.HOJO,R.RAMACHANDRAN,M.GORLACH,P.I.HARIS    
JRNL        TITL   THREE-DIMENSIONAL STRUCTURE OF THE S4-S5 SEGMENT OF THE      
JRNL        TITL 2 SHAKER POTASSIUM CHANNEL.                                    
JRNL        REF    BIOPHYS.J.                    V.  82  2995 2002              
JRNL        REFN                   ISSN 0006-3495                               
JRNL        PMID   12023222                                                     
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : DYANA 1.5, DYANA 1.5                                 
REMARK   3   AUTHORS     : GUENTERT ET AL. (DYANA), GUENTERT ET AL. (DYANA)     
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 1HO7 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 15-DEC-00.                  
REMARK 100 THE DEPOSITION ID IS D_1000012480.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 300                                
REMARK 210  PH                             : 2.7                                
REMARK 210  IONIC STRENGTH                 : 0                                  
REMARK 210  PRESSURE                       : AMBIENT                            
REMARK 210  SAMPLE CONTENTS                : 2MM NA-L45                         
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : DQF-COSY; TOCSY; NOESY             
REMARK 210  SPECTROMETER FIELD STRENGTH    : 600 MHZ; 750 MHZ                   
REMARK 210  SPECTROMETER MODEL             : INOVA                              
REMARK 210  SPECTROMETER MANUFACTURER      : VARIAN                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : NULL                               
REMARK 210   METHOD USED                   : HYBRID DISTANCE                    
REMARK 210                                   GEOMETRY/SIMULATED ANNEALING       
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 100                                
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 1                                  
REMARK 210 CONFORMERS, SELECTION CRITERIA  : CLOSEST TO AVERAGE STRUCTURE       
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1                   
REMARK 210                                                                      
REMARK 210 REMARK: THIS STRUCTURE WAS DETERMINED USING STANDARD 2D              
REMARK 210  HOMONUCLEAR TECHNIQUES.                                             
REMARK 215                                                                      
REMARK 215 NMR STUDY                                                            
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
REMARK 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: CLOSE CONTACTS                                             
REMARK 500                                                                      
REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.                            
REMARK 500                                                                      
REMARK 500  ATM1  RES C  SSEQI   ATM2  RES C  SSEQI           DISTANCE          
REMARK 500   O    ILE A     7     HG1  THR A    11              1.48            
REMARK 500   HG   SER A     2     OE1  GLN A     6              1.51            
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
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   8      -95.71    -84.43                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: PLANAR GROUPS                                              
REMARK 500                                                                      
REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL                 
REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE                    
REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN                    
REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS                        
REMARK 500 AN RMSD GREATER THAN THIS VALUE                                      
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        RMS     TYPE                                    
REMARK 500    ARG A  10         0.08    SIDE CHAIN                              
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1HO2   RELATED DB: PDB                                   
REMARK 900 1HO2 CONTAINS THE SAME PEPTIDE INVESTIGATED IN PHOSPHOLIPID MICELLES 
DBREF  1HO7 A    1    20  UNP    P08510   KCNAS_DROME    378    397             
SEQRES   1 A   20  HIS SER LYS GLY LEU GLN ILE LEU GLY ARG THR LEU LYS          
SEQRES   2 A   20  ALA SER MET ARG GLU LEU GLY                                  
HELIX    1   1 ARG A   10  LEU A   19  1                                  10    
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   HIS A   1     -14.108   1.558  -1.953  1.00  0.00           N  
ATOM      2  CA  HIS A   1     -13.887   0.105  -1.833  1.00  0.00           C  
ATOM      3  C   HIS A   1     -12.401  -0.126  -1.624  1.00  0.00           C  
ATOM      4  O   HIS A   1     -11.595   0.592  -2.214  1.00  0.00           O  
ATOM      5  CB  HIS A   1     -14.391  -0.659  -3.064  1.00  0.00           C  
ATOM      6  CG  HIS A   1     -15.844  -0.394  -3.359  1.00  0.00           C  
ATOM      7  ND1 HIS A   1     -16.925  -0.858  -2.637  1.00  0.00           N  
ATOM      8  CD2 HIS A   1     -16.325   0.396  -4.372  1.00  0.00           C  
ATOM      9  CE1 HIS A   1     -18.032  -0.345  -3.204  1.00  0.00           C  
ATOM     10  NE2 HIS A   1     -17.713   0.428  -4.253  1.00  0.00           N  
ATOM     11  H1  HIS A   1     -13.711   2.007  -1.139  1.00  0.00           H  
ATOM     12  H2  HIS A   1     -13.613   1.895  -2.767  1.00  0.00           H  
ATOM     13  H3  HIS A   1     -15.095   1.759  -2.034  1.00  0.00           H  
ATOM     14  HA  HIS A   1     -14.427  -0.253  -0.957  1.00  0.00           H  
ATOM     15  HB2 HIS A   1     -13.795  -0.375  -3.933  1.00  0.00           H  
ATOM     16  HB3 HIS A   1     -14.255  -1.728  -2.897  1.00  0.00           H  
ATOM     17  HD1 HIS A   1     -16.927  -1.504  -1.859  1.00  0.00           H  
ATOM     18  HD2 HIS A   1     -15.745   0.915  -5.122  1.00  0.00           H  
ATOM     19  HE1 HIS A   1     -19.045  -0.531  -2.871  1.00  0.00           H  
ATOM     20  N   SER A   2     -12.029  -1.085  -0.774  1.00  0.00           N  
ATOM     21  CA  SER A   2     -10.645  -1.253  -0.350  1.00  0.00           C  
ATOM     22  C   SER A   2      -9.715  -1.709  -1.482  1.00  0.00           C  
ATOM     23  O   SER A   2      -8.504  -1.530  -1.377  1.00  0.00           O  
ATOM     24  CB  SER A   2     -10.615  -2.256   0.807  1.00  0.00           C  
ATOM     25  OG  SER A   2     -11.259  -3.455   0.419  1.00  0.00           O  
ATOM     26  H   SER A   2     -12.681  -1.719  -0.327  1.00  0.00           H  
ATOM     27  HA  SER A   2     -10.298  -0.287   0.016  1.00  0.00           H  
ATOM     28  HB2 SER A   2      -9.583  -2.466   1.089  1.00  0.00           H  
ATOM     29  HB3 SER A   2     -11.138  -1.832   1.664  1.00  0.00           H  
ATOM     30  HG  SER A   2     -10.561  -4.040   0.005  1.00  0.00           H  
ATOM     31  N   LYS A   3     -10.267  -2.274  -2.566  1.00  0.00           N  
ATOM     32  CA  LYS A   3      -9.535  -2.983  -3.617  1.00  0.00           C  
ATOM     33  C   LYS A   3      -8.527  -2.135  -4.404  1.00  0.00           C  
ATOM     34  O   LYS A   3      -7.774  -2.700  -5.191  1.00  0.00           O  
ATOM     35  CB  LYS A   3     -10.516  -3.700  -4.562  1.00  0.00           C  
ATOM     36  CG  LYS A   3     -11.344  -4.771  -3.825  1.00  0.00           C  
ATOM     37  CD  LYS A   3     -12.053  -5.779  -4.747  1.00  0.00           C  
ATOM     38  CE  LYS A   3     -13.218  -5.202  -5.565  1.00  0.00           C  
ATOM     39  NZ  LYS A   3     -12.767  -4.376  -6.704  1.00  0.00           N  
ATOM     40  H   LYS A   3     -11.268  -2.385  -2.550  1.00  0.00           H  
ATOM     41  HA  LYS A   3      -8.945  -3.750  -3.125  1.00  0.00           H  
ATOM     42  HB2 LYS A   3     -11.178  -2.966  -5.022  1.00  0.00           H  
ATOM     43  HB3 LYS A   3      -9.940  -4.192  -5.348  1.00  0.00           H  
ATOM     44  HG2 LYS A   3     -10.670  -5.342  -3.186  1.00  0.00           H  
ATOM     45  HG3 LYS A   3     -12.083  -4.288  -3.185  1.00  0.00           H  
ATOM     46  HD2 LYS A   3     -11.327  -6.250  -5.411  1.00  0.00           H  
ATOM     47  HD3 LYS A   3     -12.464  -6.564  -4.109  1.00  0.00           H  
ATOM     48  HE2 LYS A   3     -13.810  -6.035  -5.951  1.00  0.00           H  
ATOM     49  HE3 LYS A   3     -13.856  -4.609  -4.907  1.00  0.00           H  
ATOM     50  HZ1 LYS A   3     -12.184  -4.922  -7.326  1.00  0.00           H  
ATOM     51  HZ2 LYS A   3     -13.564  -4.032  -7.224  1.00  0.00           H  
ATOM     52  N   GLY A   4      -8.465  -0.819  -4.182  1.00  0.00           N  
ATOM     53  CA  GLY A   4      -7.361   0.004  -4.640  1.00  0.00           C  
ATOM     54  C   GLY A   4      -6.256  -0.068  -3.595  1.00  0.00           C  
ATOM     55  O   GLY A   4      -5.245  -0.741  -3.784  1.00  0.00           O  
ATOM     56  H   GLY A   4      -9.041  -0.440  -3.447  1.00  0.00           H  
ATOM     57  HA2 GLY A   4      -6.985  -0.361  -5.596  1.00  0.00           H  
ATOM     58  HA3 GLY A   4      -7.691   1.036  -4.761  1.00  0.00           H  
ATOM     59  N   LEU A   5      -6.448   0.620  -2.467  1.00  0.00           N  
ATOM     60  CA  LEU A   5      -5.398   0.769  -1.470  1.00  0.00           C  
ATOM     61  C   LEU A   5      -4.958  -0.525  -0.778  1.00  0.00           C  
ATOM     62  O   LEU A   5      -3.801  -0.594  -0.373  1.00  0.00           O  
ATOM     63  CB  LEU A   5      -5.696   1.893  -0.475  1.00  0.00           C  
ATOM     64  CG  LEU A   5      -6.804   1.591   0.554  1.00  0.00           C  
ATOM     65  CD1 LEU A   5      -6.660   2.528   1.756  1.00  0.00           C  
ATOM     66  CD2 LEU A   5      -8.220   1.744  -0.025  1.00  0.00           C  
ATOM     67  H   LEU A   5      -7.298   1.149  -2.344  1.00  0.00           H  
ATOM     68  HA  LEU A   5      -4.537   1.107  -2.023  1.00  0.00           H  
ATOM     69  HB2 LEU A   5      -4.758   2.070   0.056  1.00  0.00           H  
ATOM     70  HB3 LEU A   5      -5.925   2.804  -1.030  1.00  0.00           H  
ATOM     71  HG  LEU A   5      -6.680   0.571   0.910  1.00  0.00           H  
ATOM     72 HD11 LEU A   5      -7.424   2.303   2.501  1.00  0.00           H  
ATOM     73 HD12 LEU A   5      -5.683   2.391   2.219  1.00  0.00           H  
ATOM     74 HD13 LEU A   5      -6.763   3.567   1.440  1.00  0.00           H  
ATOM     75 HD21 LEU A   5      -8.956   1.612   0.770  1.00  0.00           H  
ATOM     76 HD22 LEU A   5      -8.346   2.738  -0.456  1.00  0.00           H  
ATOM     77 HD23 LEU A   5      -8.410   0.990  -0.782  1.00  0.00           H  
ATOM     78  N   GLN A   6      -5.789  -1.572  -0.691  1.00  0.00           N  
ATOM     79  CA  GLN A   6      -5.311  -2.854  -0.165  1.00  0.00           C  
ATOM     80  C   GLN A   6      -4.260  -3.488  -1.092  1.00  0.00           C  
ATOM     81  O   GLN A   6      -3.516  -4.365  -0.648  1.00  0.00           O  
ATOM     82  CB  GLN A   6      -6.478  -3.812   0.143  1.00  0.00           C  
ATOM     83  CG  GLN A   6      -7.048  -4.534  -1.084  1.00  0.00           C  
ATOM     84  CD  GLN A   6      -8.314  -5.320  -0.739  1.00  0.00           C  
ATOM     85  OE1 GLN A   6      -9.403  -4.760  -0.633  1.00  0.00           O  
ATOM     86  NE2 GLN A   6      -8.206  -6.629  -0.554  1.00  0.00           N  
ATOM     87  H   GLN A   6      -6.751  -1.495  -1.017  1.00  0.00           H  
ATOM     88  HA  GLN A   6      -4.819  -2.645   0.786  1.00  0.00           H  
ATOM     89  HB2 GLN A   6      -6.124  -4.569   0.844  1.00  0.00           H  
ATOM     90  HB3 GLN A   6      -7.273  -3.251   0.637  1.00  0.00           H  
ATOM     91  HG2 GLN A   6      -7.273  -3.798  -1.851  1.00  0.00           H  
ATOM     92  HG3 GLN A   6      -6.300  -5.218  -1.486  1.00  0.00           H  
ATOM     93 HE21 GLN A   6      -7.318  -7.099  -0.639  1.00  0.00           H  
ATOM     94 HE22 GLN A   6      -9.041  -7.142  -0.317  1.00  0.00           H  
ATOM     95  N   ILE A   7      -4.177  -3.031  -2.351  1.00  0.00           N  
ATOM     96  CA  ILE A   7      -3.196  -3.450  -3.343  1.00  0.00           C  
ATOM     97  C   ILE A   7      -2.106  -2.380  -3.469  1.00  0.00           C  
ATOM     98  O   ILE A   7      -0.937  -2.742  -3.574  1.00  0.00           O  
ATOM     99  CB  ILE A   7      -3.883  -3.752  -4.703  1.00  0.00           C  
ATOM    100  CG1 ILE A   7      -5.040  -4.768  -4.526  1.00  0.00           C  
ATOM    101  CG2 ILE A   7      -2.853  -4.273  -5.726  1.00  0.00           C  
ATOM    102  CD1 ILE A   7      -5.734  -5.194  -5.827  1.00  0.00           C  
ATOM    103  H   ILE A   7      -4.813  -2.297  -2.649  1.00  0.00           H  
ATOM    104  HA  ILE A   7      -2.715  -4.358  -2.982  1.00  0.00           H  
ATOM    105  HB  ILE A   7      -4.302  -2.822  -5.092  1.00  0.00           H  
ATOM    106 HG12 ILE A   7      -4.666  -5.662  -4.024  1.00  0.00           H  
ATOM    107 HG13 ILE A   7      -5.807  -4.322  -3.893  1.00  0.00           H  
ATOM    108 HG21 ILE A   7      -3.315  -4.384  -6.706  1.00  0.00           H  
ATOM    109 HG22 ILE A   7      -2.031  -3.567  -5.842  1.00  0.00           H  
ATOM    110 HG23 ILE A   7      -2.454  -5.236  -5.403  1.00  0.00           H  
ATOM    111 HD11 ILE A   7      -5.083  -5.843  -6.412  1.00  0.00           H  
ATOM    112 HD12 ILE A   7      -6.645  -5.743  -5.584  1.00  0.00           H  
ATOM    113 HD13 ILE A   7      -5.998  -4.315  -6.416  1.00  0.00           H  
ATOM    114  N   LEU A   8      -2.443  -1.086  -3.422  1.00  0.00           N  
ATOM    115  CA  LEU A   8      -1.519   0.016  -3.429  1.00  0.00           C  
ATOM    116  C   LEU A   8      -1.061   0.240  -2.001  1.00  0.00           C  
ATOM    117  O   LEU A   8      -0.146  -0.436  -1.565  1.00  0.00           O  
ATOM    118  CB  LEU A   8      -2.176   1.279  -4.022  1.00  0.00           C  
ATOM    119  CG  LEU A   8      -2.073   1.372  -5.546  1.00  0.00           C  
ATOM    120  CD1 LEU A   8      -2.795   0.244  -6.293  1.00  0.00           C  
ATOM    121  CD2 LEU A   8      -2.617   2.726  -6.019  1.00  0.00           C  
ATOM    122  H   LEU A   8      -3.396  -0.792  -3.366  1.00  0.00           H  
ATOM    123  HA  LEU A   8      -0.651  -0.277  -4.016  1.00  0.00           H  
ATOM    124  HB2 LEU A   8      -3.216   1.340  -3.705  1.00  0.00           H  
ATOM    125  HB3 LEU A   8      -1.648   2.146  -3.622  1.00  0.00           H  
ATOM    126  HG  LEU A   8      -1.013   1.330  -5.769  1.00  0.00           H  
ATOM    127 HD11 LEU A   8      -2.741   0.418  -7.368  1.00  0.00           H  
ATOM    128 HD12 LEU A   8      -2.316  -0.712  -6.086  1.00  0.00           H  
ATOM    129 HD13 LEU A   8      -3.842   0.198  -5.991  1.00  0.00           H  
ATOM    130 HD21 LEU A   8      -2.075   3.538  -5.533  1.00  0.00           H  
ATOM    131 HD22 LEU A   8      -2.481   2.822  -7.097  1.00  0.00           H  
ATOM    132 HD23 LEU A   8      -3.678   2.810  -5.785  1.00  0.00           H  
ATOM    133  N   GLY A   9      -1.688   1.164  -1.277  1.00  0.00           N  
ATOM    134  CA  GLY A   9      -1.266   1.718  -0.001  1.00  0.00           C  
ATOM    135  C   GLY A   9      -1.000   0.705   1.107  1.00  0.00           C  
ATOM    136  O   GLY A   9      -0.471   1.106   2.138  1.00  0.00           O  
ATOM    137  H   GLY A   9      -2.454   1.606  -1.742  1.00  0.00           H  
ATOM    138  HA2 GLY A   9      -0.343   2.273  -0.167  1.00  0.00           H  
ATOM    139  HA3 GLY A   9      -2.030   2.409   0.347  1.00  0.00           H  
ATOM    140  N   ARG A  10      -1.319  -0.582   0.918  1.00  0.00           N  
ATOM    141  CA  ARG A  10      -0.718  -1.649   1.693  1.00  0.00           C  
ATOM    142  C   ARG A  10       0.638  -2.074   1.111  1.00  0.00           C  
ATOM    143  O   ARG A  10       1.654  -1.958   1.798  1.00  0.00           O  
ATOM    144  CB  ARG A  10      -1.672  -2.841   1.793  1.00  0.00           C  
ATOM    145  CG  ARG A  10      -1.101  -3.905   2.744  1.00  0.00           C  
ATOM    146  CD  ARG A  10      -1.775  -5.279   2.545  1.00  0.00           C  
ATOM    147  NE  ARG A  10      -0.863  -6.245   1.899  1.00  0.00           N  
ATOM    148  CZ  ARG A  10      -0.446  -6.235   0.623  1.00  0.00           C  
ATOM    149  NH1 ARG A  10      -1.058  -5.511  -0.309  1.00  0.00           N  
ATOM    150  NH2 ARG A  10       0.621  -6.949   0.267  1.00  0.00           N  
ATOM    151  H   ARG A  10      -1.885  -0.814   0.103  1.00  0.00           H  
ATOM    152  HA  ARG A  10      -0.559  -1.234   2.682  1.00  0.00           H  
ATOM    153  HB2 ARG A  10      -2.643  -2.511   2.166  1.00  0.00           H  
ATOM    154  HB3 ARG A  10      -1.806  -3.253   0.799  1.00  0.00           H  
ATOM    155  HG2 ARG A  10      -0.022  -4.006   2.605  1.00  0.00           H  
ATOM    156  HG3 ARG A  10      -1.244  -3.551   3.765  1.00  0.00           H  
ATOM    157  HD2 ARG A  10      -2.042  -5.673   3.526  1.00  0.00           H  
ATOM    158  HD3 ARG A  10      -2.693  -5.177   1.964  1.00  0.00           H  
ATOM    159  HE  ARG A  10      -0.426  -6.891   2.541  1.00  0.00           H  
ATOM    160 HH11 ARG A  10      -1.986  -5.092  -0.177  1.00  0.00           H  
ATOM    161 HH12 ARG A  10      -0.580  -5.282  -1.185  1.00  0.00           H  
ATOM    162 HH21 ARG A  10       1.127  -7.518   0.930  1.00  0.00           H  
ATOM    163 HH22 ARG A  10       0.929  -6.958  -0.695  1.00  0.00           H  
ATOM    164  N   THR A  11       0.675  -2.605  -0.120  1.00  0.00           N  
ATOM    165  CA  THR A  11       1.900  -3.124  -0.726  1.00  0.00           C  
ATOM    166  C   THR A  11       2.937  -2.015  -0.782  1.00  0.00           C  
ATOM    167  O   THR A  11       4.085  -2.225  -0.409  1.00  0.00           O  
ATOM    168  CB  THR A  11       1.657  -3.608  -2.161  1.00  0.00           C  
ATOM    169  OG1 THR A  11       0.444  -4.322  -2.266  1.00  0.00           O  
ATOM    170  CG2 THR A  11       2.781  -4.516  -2.668  1.00  0.00           C  
ATOM    171  H   THR A  11      -0.114  -2.476  -0.746  1.00  0.00           H  
ATOM    172  HA  THR A  11       2.278  -3.946  -0.117  1.00  0.00           H  
ATOM    173  HB  THR A  11       1.599  -2.715  -2.794  1.00  0.00           H  
ATOM    174  HG1 THR A  11      -0.117  -3.746  -2.862  1.00  0.00           H  
ATOM    175 HG21 THR A  11       2.562  -4.836  -3.687  1.00  0.00           H  
ATOM    176 HG22 THR A  11       3.728  -3.975  -2.670  1.00  0.00           H  
ATOM    177 HG23 THR A  11       2.873  -5.395  -2.030  1.00  0.00           H  
ATOM    178  N   LEU A  12       2.517  -0.817  -1.198  1.00  0.00           N  
ATOM    179  CA  LEU A  12       3.375   0.336  -1.336  1.00  0.00           C  
ATOM    180  C   LEU A  12       3.921   0.772   0.033  1.00  0.00           C  
ATOM    181  O   LEU A  12       4.971   1.400   0.092  1.00  0.00           O  
ATOM    182  CB  LEU A  12       2.602   1.494  -2.007  1.00  0.00           C  
ATOM    183  CG  LEU A  12       1.974   1.236  -3.403  1.00  0.00           C  
ATOM    184  CD1 LEU A  12       1.463   2.568  -3.966  1.00  0.00           C  
ATOM    185  CD2 LEU A  12       2.972   0.621  -4.392  1.00  0.00           C  
ATOM    186  H   LEU A  12       1.530  -0.679  -1.415  1.00  0.00           H  
ATOM    187  HA  LEU A  12       4.205   0.039  -1.976  1.00  0.00           H  
ATOM    188  HB2 LEU A  12       1.809   1.815  -1.330  1.00  0.00           H  
ATOM    189  HB3 LEU A  12       3.302   2.327  -2.099  1.00  0.00           H  
ATOM    190  HG  LEU A  12       1.103   0.571  -3.335  1.00  0.00           H  
ATOM    191 HD11 LEU A  12       0.987   2.406  -4.932  1.00  0.00           H  
ATOM    192 HD12 LEU A  12       0.735   3.006  -3.283  1.00  0.00           H  
ATOM    193 HD13 LEU A  12       2.292   3.266  -4.097  1.00  0.00           H  
ATOM    194 HD21 LEU A  12       3.258  -0.378  -4.065  1.00  0.00           H  
ATOM    195 HD22 LEU A  12       2.512   0.535  -5.377  1.00  0.00           H  
ATOM    196 HD23 LEU A  12       3.863   1.246  -4.468  1.00  0.00           H  
ATOM    197  N   LYS A  13       3.256   0.413   1.141  1.00  0.00           N  
ATOM    198  CA  LYS A  13       3.646   0.798   2.498  1.00  0.00           C  
ATOM    199  C   LYS A  13       4.676  -0.187   3.006  1.00  0.00           C  
ATOM    200  O   LYS A  13       5.678   0.214   3.588  1.00  0.00           O  
ATOM    201  CB  LYS A  13       2.406   0.847   3.412  1.00  0.00           C  
ATOM    202  CG  LYS A  13       2.602   0.298   4.840  1.00  0.00           C  
ATOM    203  CD  LYS A  13       1.538   0.842   5.795  1.00  0.00           C  
ATOM    204  CE  LYS A  13       1.655   0.255   7.207  1.00  0.00           C  
ATOM    205  NZ  LYS A  13       1.341  -1.188   7.250  1.00  0.00           N  
ATOM    206  H   LYS A  13       2.601  -0.361   1.062  1.00  0.00           H  
ATOM    207  HA  LYS A  13       4.106   1.786   2.481  1.00  0.00           H  
ATOM    208  HB2 LYS A  13       2.061   1.881   3.446  1.00  0.00           H  
ATOM    209  HB3 LYS A  13       1.616   0.252   2.965  1.00  0.00           H  
ATOM    210  HG2 LYS A  13       2.540  -0.794   4.799  1.00  0.00           H  
ATOM    211  HG3 LYS A  13       3.578   0.582   5.229  1.00  0.00           H  
ATOM    212  HD2 LYS A  13       1.676   1.922   5.869  1.00  0.00           H  
ATOM    213  HD3 LYS A  13       0.549   0.636   5.390  1.00  0.00           H  
ATOM    214  HE2 LYS A  13       2.669   0.418   7.578  1.00  0.00           H  
ATOM    215  HE3 LYS A  13       0.964   0.786   7.864  1.00  0.00           H  
ATOM    216  HZ1 LYS A  13       0.394  -1.353   6.939  1.00  0.00           H  
ATOM    217  HZ2 LYS A  13       1.989  -1.705   6.671  1.00  0.00           H  
ATOM    218  N   ALA A  14       4.415  -1.470   2.765  1.00  0.00           N  
ATOM    219  CA  ALA A  14       5.348  -2.534   3.045  1.00  0.00           C  
ATOM    220  C   ALA A  14       6.600  -2.248   2.231  1.00  0.00           C  
ATOM    221  O   ALA A  14       7.680  -2.211   2.795  1.00  0.00           O  
ATOM    222  CB  ALA A  14       4.710  -3.883   2.716  1.00  0.00           C  
ATOM    223  H   ALA A  14       3.618  -1.660   2.180  1.00  0.00           H  
ATOM    224  HA  ALA A  14       5.609  -2.514   4.105  1.00  0.00           H  
ATOM    225  HB1 ALA A  14       5.423  -4.677   2.941  1.00  0.00           H  
ATOM    226  HB2 ALA A  14       3.818  -4.021   3.328  1.00  0.00           H  
ATOM    227  HB3 ALA A  14       4.437  -3.926   1.662  1.00  0.00           H  
ATOM    228  N   SER A  15       6.448  -1.893   0.949  1.00  0.00           N  
ATOM    229  CA  SER A  15       7.572  -1.504   0.105  1.00  0.00           C  
ATOM    230  C   SER A  15       8.308  -0.322   0.735  1.00  0.00           C  
ATOM    231  O   SER A  15       9.530  -0.365   0.866  1.00  0.00           O  
ATOM    232  CB  SER A  15       7.066  -1.145  -1.298  1.00  0.00           C  
ATOM    233  OG  SER A  15       8.122  -1.150  -2.237  1.00  0.00           O  
ATOM    234  H   SER A  15       5.494  -1.851   0.574  1.00  0.00           H  
ATOM    235  HA  SER A  15       8.263  -2.353   0.043  1.00  0.00           H  
ATOM    236  HB2 SER A  15       6.322  -1.876  -1.614  1.00  0.00           H  
ATOM    237  HB3 SER A  15       6.595  -0.160  -1.277  1.00  0.00           H  
ATOM    238  HG  SER A  15       8.828  -0.571  -1.934  1.00  0.00           H  
ATOM    239  N   MET A  16       7.578   0.708   1.181  1.00  0.00           N  
ATOM    240  CA  MET A  16       8.191   1.883   1.808  1.00  0.00           C  
ATOM    241  C   MET A  16       8.799   1.584   3.191  1.00  0.00           C  
ATOM    242  O   MET A  16       9.455   2.455   3.760  1.00  0.00           O  
ATOM    243  CB  MET A  16       7.182   3.041   1.869  1.00  0.00           C  
ATOM    244  CG  MET A  16       7.100   3.781   0.527  1.00  0.00           C  
ATOM    245  SD  MET A  16       6.058   5.269   0.528  1.00  0.00           S  
ATOM    246  CE  MET A  16       4.404   4.540   0.645  1.00  0.00           C  
ATOM    247  H   MET A  16       6.558   0.654   1.118  1.00  0.00           H  
ATOM    248  HA  MET A  16       9.026   2.202   1.183  1.00  0.00           H  
ATOM    249  HB2 MET A  16       6.201   2.660   2.153  1.00  0.00           H  
ATOM    250  HB3 MET A  16       7.505   3.759   2.620  1.00  0.00           H  
ATOM    251  HG2 MET A  16       8.108   4.093   0.254  1.00  0.00           H  
ATOM    252  HG3 MET A  16       6.747   3.101  -0.247  1.00  0.00           H  
ATOM    253  HE1 MET A  16       4.323   3.953   1.559  1.00  0.00           H  
ATOM    254  HE2 MET A  16       3.661   5.336   0.662  1.00  0.00           H  
ATOM    255  HE3 MET A  16       4.227   3.900  -0.218  1.00  0.00           H  
ATOM    256  N   ARG A  17       8.635   0.365   3.717  1.00  0.00           N  
ATOM    257  CA  ARG A  17       9.221  -0.116   4.962  1.00  0.00           C  
ATOM    258  C   ARG A  17      10.195  -1.289   4.703  1.00  0.00           C  
ATOM    259  O   ARG A  17      10.855  -1.740   5.635  1.00  0.00           O  
ATOM    260  CB  ARG A  17       8.051  -0.395   5.936  1.00  0.00           C  
ATOM    261  CG  ARG A  17       8.482  -0.802   7.357  1.00  0.00           C  
ATOM    262  CD  ARG A  17       8.517  -2.327   7.534  1.00  0.00           C  
ATOM    263  NE  ARG A  17       9.678  -2.762   8.335  1.00  0.00           N  
ATOM    264  CZ  ARG A  17      10.493  -3.783   8.023  1.00  0.00           C  
ATOM    265  NH1 ARG A  17      10.185  -4.634   7.053  1.00  0.00           N  
ATOM    266  NH2 ARG A  17      11.626  -3.963   8.700  1.00  0.00           N  
ATOM    267  H   ARG A  17       8.038  -0.299   3.232  1.00  0.00           H  
ATOM    268  HA  ARG A  17       9.822   0.689   5.390  1.00  0.00           H  
ATOM    269  HB2 ARG A  17       7.463   0.523   6.025  1.00  0.00           H  
ATOM    270  HB3 ARG A  17       7.376  -1.146   5.517  1.00  0.00           H  
ATOM    271  HG2 ARG A  17       9.460  -0.365   7.572  1.00  0.00           H  
ATOM    272  HG3 ARG A  17       7.770  -0.394   8.076  1.00  0.00           H  
ATOM    273  HD2 ARG A  17       7.595  -2.656   8.016  1.00  0.00           H  
ATOM    274  HD3 ARG A  17       8.561  -2.783   6.547  1.00  0.00           H  
ATOM    275  HE  ARG A  17       9.937  -2.143   9.086  1.00  0.00           H  
ATOM    276 HH11 ARG A  17       9.391  -4.468   6.408  1.00  0.00           H  
ATOM    277 HH12 ARG A  17      10.825  -5.241   6.536  1.00  0.00           H  
ATOM    278 HH21 ARG A  17      11.925  -3.319   9.414  1.00  0.00           H  
ATOM    279 HH22 ARG A  17      12.232  -4.730   8.452  1.00  0.00           H  
ATOM    280  N   GLU A  18      10.350  -1.734   3.449  1.00  0.00           N  
ATOM    281  CA  GLU A  18      11.237  -2.804   3.011  1.00  0.00           C  
ATOM    282  C   GLU A  18      12.421  -2.204   2.257  1.00  0.00           C  
ATOM    283  O   GLU A  18      13.520  -2.753   2.309  1.00  0.00           O  
ATOM    284  CB  GLU A  18      10.481  -3.746   2.043  1.00  0.00           C  
ATOM    285  CG  GLU A  18       9.532  -4.816   2.627  1.00  0.00           C  
ATOM    286  CD  GLU A  18       9.629  -5.019   4.141  1.00  0.00           C  
ATOM    287  OE1 GLU A  18      10.642  -5.598   4.602  1.00  0.00           O  
ATOM    288  OE2 GLU A  18       8.702  -4.590   4.872  1.00  0.00           O  
ATOM    289  H   GLU A  18       9.833  -1.298   2.696  1.00  0.00           H  
ATOM    290  HA  GLU A  18      11.627  -3.362   3.864  1.00  0.00           H  
ATOM    291  HB2 GLU A  18       9.922  -3.135   1.336  1.00  0.00           H  
ATOM    292  HB3 GLU A  18      11.212  -4.266   1.428  1.00  0.00           H  
ATOM    293  HG2 GLU A  18       8.504  -4.570   2.363  1.00  0.00           H  
ATOM    294  HG3 GLU A  18       9.748  -5.768   2.137  1.00  0.00           H  
ATOM    295  N   LEU A  19      12.190  -1.108   1.521  1.00  0.00           N  
ATOM    296  CA  LEU A  19      13.192  -0.514   0.658  1.00  0.00           C  
ATOM    297  C   LEU A  19      14.345   0.080   1.472  1.00  0.00           C  
ATOM    298  O   LEU A  19      14.148   0.623   2.560  1.00  0.00           O  
ATOM    299  CB  LEU A  19      12.560   0.557  -0.251  1.00  0.00           C  
ATOM    300  CG  LEU A  19      11.781  -0.029  -1.448  1.00  0.00           C  
ATOM    301  CD1 LEU A  19      10.890   1.055  -2.071  1.00  0.00           C  
ATOM    302  CD2 LEU A  19      12.722  -0.584  -2.527  1.00  0.00           C  
ATOM    303  H   LEU A  19      11.252  -0.722   1.482  1.00  0.00           H  
ATOM    304  HA  LEU A  19      13.578  -1.327   0.054  1.00  0.00           H  
ATOM    305  HB2 LEU A  19      11.897   1.176   0.356  1.00  0.00           H  
ATOM    306  HB3 LEU A  19      13.347   1.206  -0.638  1.00  0.00           H  
ATOM    307  HG  LEU A  19      11.138  -0.841  -1.108  1.00  0.00           H  
ATOM    308 HD11 LEU A  19      11.503   1.894  -2.402  1.00  0.00           H  
ATOM    309 HD12 LEU A  19      10.352   0.653  -2.929  1.00  0.00           H  
ATOM    310 HD13 LEU A  19      10.172   1.413  -1.331  1.00  0.00           H  
ATOM    311 HD21 LEU A  19      13.390   0.199  -2.887  1.00  0.00           H  
ATOM    312 HD22 LEU A  19      13.319  -1.402  -2.127  1.00  0.00           H  
ATOM    313 HD23 LEU A  19      12.139  -0.969  -3.364  1.00  0.00           H  
ATOM    314  N   GLY A  20      15.538   0.030   0.882  1.00  0.00           N  
ATOM    315  CA  GLY A  20      16.787   0.596   1.352  1.00  0.00           C  
ATOM    316  C   GLY A  20      17.801   0.474   0.220  1.00  0.00           C  
ATOM    317  O   GLY A  20      17.417  -0.096  -0.830  1.00  0.00           O  
ATOM    318  H   GLY A  20      15.674  -0.395  -0.032  1.00  0.00           H  
ATOM    319  HA2 GLY A  20      16.651   1.646   1.608  1.00  0.00           H  
ATOM    320  HA3 GLY A  20      17.143   0.044   2.221  1.00  0.00           H  
TER     321      GLY A  20                                                      
MASTER      114    0    0    1    0    0    0    6  152    1    0    2          
END