HEADER    ANTIBIOTIC                              25-FEB-19   6QTF              
TITLE     SOLUTION NMR OF SYNTHETIC ANALOGUES OF NISIN AND MUTACIN RING A AND   
TITLE    2 RING B - MUTACIN I RING B, MAJOR CONFORMER                           
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: DCY-LEU-GLY-ALA-THR;                                       
COMPND   3 CHAIN: A;                                                            
COMPND   4 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 SYNTHETIC: YES;                                                      
SOURCE   3 ORGANISM_SCIENTIFIC: LACTOCOCCUS LACTIS;                             
SOURCE   4 ORGANISM_TAXID: 1358                                                 
KEYWDS    PEPTIDE ANTIBIOTIC, LANTIBIOTIC, ANTIMICROBIAL, BACTERIOCIN,          
KEYWDS   2 THIOESTER, ANTIBIOTIC                                                
EXPDTA    SOLUTION NMR                                                          
NUMMDL    15                                                                    
AUTHOR    R.DICKMAN,S.A.MITCHELL,A.FIGUEIREDO,D.F.HANSEN,A.B.TABOR              
REVDAT   3   14-JUN-23 6QTF    1       REMARK                                   
REVDAT   2   02-OCT-19 6QTF    1       JRNL                                     
REVDAT   1   11-SEP-19 6QTF    0                                                
JRNL        AUTH   R.DICKMAN,S.A.MITCHELL,A.M.FIGUEIREDO,D.F.HANSEN,A.B.TABOR   
JRNL        TITL   MOLECULAR RECOGNITION OF LIPID II BY LANTIBIOTICS: SYNTHESIS 
JRNL        TITL 2 AND CONFORMATIONAL STUDIES OF ANALOGUES OF NISIN AND MUTACIN 
JRNL        TITL 3 RINGS A AND B.                                               
JRNL        REF    J.ORG.CHEM.                   V.  84 11493 2019              
JRNL        REFN                   ISSN 0022-3263                               
JRNL        PMID   31464129                                                     
JRNL        DOI    10.1021/ACS.JOC.9B01253                                      
REMARK   1                                                                      
REMARK   1 REFERENCE 1                                                          
REMARK   1  AUTH   R.DICKMAN,E.DANELIUS,S.A.MITCHELL,D.F.HANSEN,M.ERDELYI,      
REMARK   1  AUTH 2 A.B.TABOR                                                    
REMARK   1  TITL   A CHEMICAL BIOLOGY APPROACH TO UNDERSTANDING MOLECULAR       
REMARK   1  TITL 2 RECOGNITION OF LIPID II BY NISIN: SOLID-PHASE SYNTHESIS AND  
REMARK   1  TITL 3 NMR ENSEMBLE ANALYSIS OF NISIN(1-12) AND A SYNTHETIC         
REMARK   1  TITL 4 ANALOGUE.                                                    
REMARK   1  REF    TO BE PUBLISHED                                              
REMARK   1  REFN                                                                
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : XPLOR-NIH                                            
REMARK   3   AUTHORS     : SCHWIETERS, KUSZEWSKI, TJANDRA AND CLORE             
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 6QTF COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 25-FEB-19.                  
REMARK 100 THE DEPOSITION ID IS D_1292100432.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 298                                
REMARK 210  PH                             : 5.0                                
REMARK 210  IONIC STRENGTH                 : TFA SALT                           
REMARK 210  PRESSURE                       : 1 ATM                              
REMARK 210  SAMPLE CONTENTS                : 13.0 MG/ML MUTACIN I RING B,       
REMARK 210                                   DMSO                               
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D 1H-1H COSY; 2D 1H-1H NOESY;     
REMARK 210                                   2D 1H-13C HSQC; 2D 1H-13C HMBC     
REMARK 210  SPECTROMETER FIELD STRENGTH    : 600 MHZ                            
REMARK 210  SPECTROMETER MODEL             : AVANCE                             
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : XPLOR-NIH, CCPNMR ANALYSIS         
REMARK 210   METHOD USED                   : SIMULATED ANNEALING                
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 100                                
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 15                                 
REMARK 210 CONFORMERS, SELECTION CRITERIA  : STRUCTURES WITH THE LOWEST         
REMARK 210                                   ENERGY                             
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1                   
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 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC                  
REMARK 350 SOFTWARE USED: PISA                                                  
REMARK 350 TOTAL BURIED SURFACE AREA: 0 ANGSTROM**2                             
REMARK 350 SURFACE AREA OF THE COMPLEX: 600 ANGSTROM**2                         
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: 0.0 KCAL/MOL                          
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    DCY A     1     H    GLY A     3              1.54            
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  1 LEU A   2       69.12    -58.49                                   
REMARK 500  2 LEU A   2       70.08    -56.96                                   
REMARK 500  3 LEU A   2       68.50    -59.16                                   
REMARK 500  4 LEU A   2       69.44    -58.04                                   
REMARK 500  5 LEU A   2       68.36    -59.05                                   
REMARK 500  6 LEU A   2       66.10    -63.78                                   
REMARK 500  7 LEU A   2       68.62    -60.65                                   
REMARK 500  8 LEU A   2       68.09    -59.36                                   
REMARK 500  9 LEU A   2       68.49    -59.18                                   
REMARK 500 10 LEU A   2       69.94    -57.49                                   
REMARK 500 11 LEU A   2       69.71    -57.55                                   
REMARK 500 12 LEU A   2       68.07    -59.52                                   
REMARK 500 13 LEU A   2       68.39    -59.94                                   
REMARK 500 14 LEU A   2       69.11    -58.43                                   
REMARK 500 15 LEU A   2       70.39    -58.84                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1WCO   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 34360   RELATED DB: BMRB                                 
REMARK 900 RELATED ID: 6QM1   RELATED DB: PDB                                   
REMARK 900 SOLUTION NMR OF SYNTHETIC NISIN RING B (LAN8,11) ANALOGUE            
REMARK 900 RELATED ID: 34363   RELATED DB: BMRB                                 
REMARK 900 SOLUTION NMR OF SYNTHETIC ANALOGUES OF NISIN AND MUTACIN RING A AND  
REMARK 900 RING B - MUTACIN I RING B, MAJOR CONFORMER                           
DBREF  6QTF A    1     5  PDB    6QTF     6QTF             1      5             
SEQRES   1 A    5  DCY LEU GLY ALA THR                                          
HET    DCY  A   1      12                                                       
HETNAM     DCY D-CYSTEINE                                                       
FORMUL   1  DCY    C3 H7 N O2 S                                                 
LINK         C   DCY A   1                 N   LEU A   2     1555   1555  1.33  
LINK         SG  DCY A   1                 CB  ALA A   4     1555   1555  1.82  
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                         
MODEL        1                                                                  
HETATM    1  N   DCY A   1       7.127   2.804   6.982  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.921   3.505   5.683  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.838   4.565   5.848  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.748   4.439   5.293  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.242   4.150   5.239  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.942   5.847   4.657  1.00  0.00           S  
HETATM    7  H2  DCY A   1       8.077   2.379   6.999  1.00  0.00           H  
HETATM    8  H   DCY A   1       7.037   3.485   7.762  1.00  0.00           H  
HETATM    9  H3  DCY A   1       6.411   2.059   7.092  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.606   2.791   4.936  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.676   3.560   4.450  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.922   4.177   6.078  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.152   5.616   6.600  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.203   6.705   6.813  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.819   7.294   5.461  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.221   8.406   5.119  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.835   7.789   7.688  1.00  0.00           C  
ATOM     18  CG  LEU A   2       5.519   7.503   9.157  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       6.551   8.197  10.047  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       4.122   8.032   9.490  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.041   5.666   7.003  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.321   6.321   7.308  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.905   7.790   7.542  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       5.432   8.753   7.416  1.00  0.00           H  
ATOM     25  HG  LEU A   2       5.553   6.437   9.331  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       7.488   7.664   9.994  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       6.198   8.207  11.067  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       6.695   9.212   9.706  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       4.070   9.084   9.251  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       3.926   7.892  10.542  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       3.386   7.495   8.911  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.081   6.516   4.675  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.695   6.936   3.340  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.776   6.480   2.362  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.524   6.338   1.166  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.822   5.624   4.984  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.754   6.466   3.082  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.582   8.016   3.295  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.992   6.238   2.888  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.099   5.787   2.052  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.786   4.454   1.357  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.219   4.232   0.226  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.370   5.657   2.899  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.149   6.371   3.857  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.273   6.527   1.294  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.836   4.701   2.723  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.056   6.437   2.618  1.00  0.00           H  
ATOM     48  N   THR A   5       6.038   3.568   2.021  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.698   2.281   1.425  1.00  0.00           C  
ATOM     50  C   THR A   5       4.497   2.424   0.494  1.00  0.00           C  
ATOM     51  O   THR A   5       3.618   3.208   0.810  1.00  0.00           O  
ATOM     52  CB  THR A   5       5.376   1.265   2.522  1.00  0.00           C  
ATOM     53  OG1 THR A   5       4.752   1.929   3.612  1.00  0.00           O  
ATOM     54  CG2 THR A   5       6.668   0.600   3.000  1.00  0.00           C  
ATOM     55  OXT THR A   5       4.475   1.746  -0.520  1.00  0.00           O  
ATOM     56  H   THR A   5       5.710   3.776   2.918  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.543   1.924   0.855  1.00  0.00           H  
ATOM     58  HB  THR A   5       4.712   0.510   2.131  1.00  0.00           H  
ATOM     59  HG1 THR A   5       4.938   1.429   4.410  1.00  0.00           H  
ATOM     60 HG21 THR A   5       7.511   1.221   2.736  1.00  0.00           H  
ATOM     61 HG22 THR A   5       6.771  -0.367   2.530  1.00  0.00           H  
ATOM     62 HG23 THR A   5       6.634   0.477   4.073  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL        2                                                                  
HETATM    1  N   DCY A   1       7.074   2.770   6.926  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.858   3.476   5.631  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.810   4.567   5.817  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.716   4.481   5.263  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.186   4.084   5.155  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.937   5.817   4.661  1.00  0.00           S  
HETATM    7  H2  DCY A   1       7.135   3.468   7.694  1.00  0.00           H  
HETATM    8  H   DCY A   1       6.280   2.124   7.105  1.00  0.00           H  
HETATM    9  H3  DCY A   1       7.958   2.224   6.881  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.507   2.770   4.891  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.558   3.512   4.323  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.903   4.043   5.962  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.161   5.600   6.581  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.247   6.717   6.805  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.856   7.303   5.450  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.299   8.389   5.082  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.935   7.787   7.656  1.00  0.00           C  
ATOM     18  CG  LEU A   2       4.934   8.387   8.646  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       5.690   9.193   9.704  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       3.966   9.311   7.901  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.054   5.619   6.982  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.364   6.364   7.321  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.753   7.339   8.200  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       6.316   8.567   7.016  1.00  0.00           H  
ATOM     25  HG  LEU A   2       4.380   7.593   9.128  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       6.468   9.771   9.226  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       6.134   8.518  10.420  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       5.006   9.857  10.210  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       3.750   8.897   6.928  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       4.416  10.285   7.785  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       3.050   9.403   8.464  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.067   6.548   4.692  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.673   6.968   3.360  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.752   6.519   2.374  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.503   6.415   1.172  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.775   5.673   5.019  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.732   6.496   3.104  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.558   8.048   3.318  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.962   6.246   2.899  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.071   5.802   2.058  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.784   4.457   1.372  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.206   4.245   0.235  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.354   5.701   2.894  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.114   6.354   3.871  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.227   6.539   1.293  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.860   4.773   2.686  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.005   6.519   2.633  1.00  0.00           H  
ATOM     48  N   THR A   5       6.076   3.549   2.048  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.767   2.251   1.460  1.00  0.00           C  
ATOM     50  C   THR A   5       4.473   2.322   0.655  1.00  0.00           C  
ATOM     51  O   THR A   5       3.629   3.133   0.997  1.00  0.00           O  
ATOM     52  CB  THR A   5       5.631   1.198   2.563  1.00  0.00           C  
ATOM     53  OG1 THR A   5       4.909   1.747   3.656  1.00  0.00           O  
ATOM     54  CG2 THR A   5       7.023   0.768   3.032  1.00  0.00           C  
ATOM     55  OXT THR A   5       4.347   1.565  -0.294  1.00  0.00           O  
ATOM     56  H   THR A   5       5.757   3.747   2.947  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.574   1.964   0.803  1.00  0.00           H  
ATOM     58  HB  THR A   5       5.105   0.338   2.178  1.00  0.00           H  
ATOM     59  HG1 THR A   5       4.823   2.692   3.510  1.00  0.00           H  
ATOM     60 HG21 THR A   5       7.493   0.171   2.265  1.00  0.00           H  
ATOM     61 HG22 THR A   5       6.934   0.186   3.938  1.00  0.00           H  
ATOM     62 HG23 THR A   5       7.623   1.644   3.225  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL        3                                                                  
HETATM    1  N   DCY A   1       7.080   2.770   6.960  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.858   3.483   5.670  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.807   4.570   5.864  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.692   4.457   5.358  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.184   4.094   5.192  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.924   5.818   4.671  1.00  0.00           S  
HETATM    7  H2  DCY A   1       6.587   3.277   7.724  1.00  0.00           H  
HETATM    8  H   DCY A   1       6.710   1.802   6.890  1.00  0.00           H  
HETATM    9  H3  DCY A   1       8.098   2.736   7.167  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.507   2.781   4.929  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.564   3.514   4.369  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.898   4.072   6.003  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.175   5.630   6.580  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.255   6.743   6.805  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.846   7.315   5.453  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.254   8.416   5.083  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.940   7.828   7.639  1.00  0.00           C  
ATOM     18  CG  LEU A   2       5.957   7.409   9.109  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       7.004   6.313   9.316  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       6.309   8.618   9.979  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.082   5.672   6.944  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.380   6.388   7.335  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.954   7.964   7.290  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       5.396   8.757   7.538  1.00  0.00           H  
ATOM     25  HG  LEU A   2       4.982   7.034   9.388  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       7.943   6.627   8.888  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       6.674   5.405   8.833  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       7.131   6.132  10.373  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       5.712   9.466   9.676  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       7.356   8.854   9.861  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       6.106   8.387  11.015  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.081   6.533   4.698  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.672   6.934   3.365  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.752   6.492   2.378  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.505   6.386   1.177  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.819   5.649   5.028  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.737   6.445   3.119  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.540   8.012   3.314  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.963   6.229   2.903  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.076   5.793   2.064  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.788   4.459   1.360  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.218   4.257   0.224  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.352   5.680   2.909  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.114   6.338   3.876  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.240   6.540   1.310  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.845   4.742   2.711  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.015   6.485   2.644  1.00  0.00           H  
ATOM     48  N   THR A   5       6.066   3.549   2.018  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.755   2.261   1.409  1.00  0.00           C  
ATOM     50  C   THR A   5       4.527   2.378   0.509  1.00  0.00           C  
ATOM     51  O   THR A   5       3.699   1.483   0.549  1.00  0.00           O  
ATOM     52  CB  THR A   5       5.497   1.216   2.497  1.00  0.00           C  
ATOM     53  OG1 THR A   5       4.867   1.838   3.608  1.00  0.00           O  
ATOM     54  CG2 THR A   5       6.826   0.600   2.939  1.00  0.00           C  
ATOM     55  OXT THR A   5       4.435   3.361  -0.207  1.00  0.00           O  
ATOM     56  H   THR A   5       5.739   3.738   2.917  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.597   1.943   0.813  1.00  0.00           H  
ATOM     58  HB  THR A   5       4.858   0.439   2.109  1.00  0.00           H  
ATOM     59  HG1 THR A   5       4.481   1.149   4.154  1.00  0.00           H  
ATOM     60 HG21 THR A   5       7.638   1.246   2.643  1.00  0.00           H  
ATOM     61 HG22 THR A   5       6.946  -0.368   2.474  1.00  0.00           H  
ATOM     62 HG23 THR A   5       6.829   0.486   4.013  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL        4                                                                  
HETATM    1  N   DCY A   1       7.097   2.784   6.942  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.869   3.483   5.646  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.815   4.569   5.834  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.716   4.470   5.290  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.191   4.091   5.157  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.934   5.820   4.652  1.00  0.00           S  
HETATM    7  H2  DCY A   1       6.231   2.826   7.516  1.00  0.00           H  
HETATM    8  H   DCY A   1       7.346   1.791   6.762  1.00  0.00           H  
HETATM    9  H3  DCY A   1       7.876   3.246   7.453  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.516   2.773   4.914  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.558   3.515   4.324  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.915   4.059   5.959  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.162   5.610   6.587  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.237   6.718   6.813  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.845   7.309   5.462  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.271   8.407   5.106  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.906   7.795   7.670  1.00  0.00           C  
ATOM     18  CG  LEU A   2       6.170   7.241   9.071  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       7.493   7.798   9.599  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       5.033   7.656  10.006  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.056   5.640   6.982  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.355   6.356   7.325  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.842   8.086   7.215  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       5.256   8.653   7.741  1.00  0.00           H  
ATOM     25  HG  LEU A   2       6.227   6.163   9.027  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       7.758   7.290  10.515  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       7.386   8.856   9.793  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       8.269   7.643   8.865  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       5.040   7.027  10.883  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       4.088   7.550   9.494  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       5.168   8.687  10.301  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.075   6.545   4.691  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.679   6.966   3.359  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.755   6.515   2.371  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.505   6.411   1.171  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.797   5.662   5.011  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.737   6.497   3.106  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.566   8.047   3.318  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.965   6.241   2.894  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.072   5.796   2.051  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.780   4.455   1.362  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.196   4.245   0.222  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.354   5.694   2.887  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.120   6.350   3.866  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.229   6.535   1.288  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.857   4.763   2.683  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.006   6.509   2.623  1.00  0.00           H  
ATOM     48  N   THR A   5       6.073   3.546   2.038  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.759   2.251   1.444  1.00  0.00           C  
ATOM     50  C   THR A   5       4.547   2.363   0.524  1.00  0.00           C  
ATOM     51  O   THR A   5       4.742   2.642  -0.648  1.00  0.00           O  
ATOM     52  CB  THR A   5       5.472   1.229   2.546  1.00  0.00           C  
ATOM     53  OG1 THR A   5       6.607   1.117   3.393  1.00  0.00           O  
ATOM     54  CG2 THR A   5       5.165  -0.132   1.918  1.00  0.00           C  
ATOM     55  OXT THR A   5       3.443   2.169   1.004  1.00  0.00           O  
ATOM     56  H   THR A   5       5.756   3.742   2.939  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.607   1.914   0.869  1.00  0.00           H  
ATOM     58  HB  THR A   5       4.621   1.552   3.125  1.00  0.00           H  
ATOM     59  HG1 THR A   5       7.254   1.766   3.109  1.00  0.00           H  
ATOM     60 HG21 THR A   5       5.064  -0.020   0.848  1.00  0.00           H  
ATOM     61 HG22 THR A   5       4.245  -0.519   2.328  1.00  0.00           H  
ATOM     62 HG23 THR A   5       5.972  -0.817   2.132  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL        5                                                                  
HETATM    1  N   DCY A   1       7.067   2.764   6.952  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.841   3.477   5.662  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.797   4.570   5.862  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.679   4.464   5.363  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.166   4.079   5.173  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.918   5.810   4.671  1.00  0.00           S  
HETATM    7  H2  DCY A   1       8.051   2.428   6.992  1.00  0.00           H  
HETATM    8  H   DCY A   1       6.888   3.412   7.743  1.00  0.00           H  
HETATM    9  H3  DCY A   1       6.419   1.953   7.017  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.478   2.776   4.925  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.529   3.503   4.340  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.890   4.042   5.975  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.177   5.629   6.575  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.268   6.749   6.805  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.854   7.320   5.453  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.269   8.416   5.078  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.969   7.832   7.629  1.00  0.00           C  
ATOM     18  CG  LEU A   2       4.941   8.563   8.494  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       4.734   7.794   9.800  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       5.450   9.971   8.808  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.087   5.665   6.933  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.395   6.403   7.342  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.715   7.376   8.263  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       6.445   8.539   6.965  1.00  0.00           H  
ATOM     25  HG  LEU A   2       4.003   8.626   7.962  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       3.749   8.003  10.188  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       5.477   8.101  10.520  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       4.830   6.734   9.613  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       6.530   9.963   8.852  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       5.054  10.293   9.759  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       5.127  10.651   8.035  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.080   6.541   4.704  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.666   6.941   3.371  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.744   6.501   2.381  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.497   6.405   1.178  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.813   5.661   5.038  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.731   6.452   3.129  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.533   8.019   3.320  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.954   6.229   2.905  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.068   5.795   2.065  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.788   4.459   1.360  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.218   4.262   0.224  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.345   5.688   2.908  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.104   6.332   3.878  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.228   6.542   1.310  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.848   4.756   2.703  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.001   6.502   2.648  1.00  0.00           H  
ATOM     48  N   THR A   5       6.074   3.544   2.018  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.773   2.252   1.410  1.00  0.00           C  
ATOM     50  C   THR A   5       4.877   2.432   0.188  1.00  0.00           C  
ATOM     51  O   THR A   5       3.886   3.135   0.301  1.00  0.00           O  
ATOM     52  CB  THR A   5       5.078   1.344   2.426  1.00  0.00           C  
ATOM     53  OG1 THR A   5       5.331  -0.014   2.095  1.00  0.00           O  
ATOM     54  CG2 THR A   5       3.572   1.605   2.403  1.00  0.00           C  
ATOM     55  OXT THR A   5       5.195   1.863  -0.844  1.00  0.00           O  
ATOM     56  H   THR A   5       5.748   3.730   2.918  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.697   1.787   1.100  1.00  0.00           H  
ATOM     58  HB  THR A   5       5.460   1.551   3.414  1.00  0.00           H  
ATOM     59  HG1 THR A   5       6.040  -0.034   1.448  1.00  0.00           H  
ATOM     60 HG21 THR A   5       3.149   1.194   1.498  1.00  0.00           H  
ATOM     61 HG22 THR A   5       3.391   2.669   2.433  1.00  0.00           H  
ATOM     62 HG23 THR A   5       3.112   1.137   3.261  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL        6                                                                  
HETATM    1  N   DCY A   1       7.110   2.756   7.004  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.905   3.508   5.736  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.820   4.563   5.941  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.682   4.380   5.513  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.227   4.168   5.318  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.914   5.847   4.690  1.00  0.00           S  
HETATM    7  H2  DCY A   1       6.387   3.041   7.697  1.00  0.00           H  
HETATM    8  H   DCY A   1       7.031   1.736   6.820  1.00  0.00           H  
HETATM    9  H3  DCY A   1       8.056   2.964   7.384  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.591   2.823   4.962  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.697   3.570   4.556  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.881   4.226   6.176  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.184   5.672   6.578  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.232   6.757   6.808  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.803   7.316   5.458  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.143   8.446   5.105  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.881   7.866   7.640  1.00  0.00           C  
ATOM     18  CG  LEU A   2       6.697   7.249   8.775  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       7.455   8.351   9.517  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       5.756   6.538   9.749  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.108   5.768   6.880  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.369   6.375   7.337  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.530   8.458   7.009  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       5.111   8.500   8.056  1.00  0.00           H  
ATOM     25  HG  LEU A   2       7.401   6.538   8.368  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       6.846   8.723  10.328  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       7.678   9.157   8.834  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       8.376   7.950   9.914  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       5.607   5.518   9.427  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       4.805   7.051   9.771  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       6.191   6.544  10.738  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.103   6.493   4.688  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.683   6.879   3.353  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.769   6.442   2.372  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.522   6.308   1.173  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.898   5.592   5.008  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.754   6.375   3.115  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.537   7.954   3.292  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.984   6.208   2.902  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.104   5.774   2.072  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.802   4.455   1.347  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.274   4.243   0.230  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.360   5.620   2.940  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.132   6.334   3.874  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.293   6.531   1.333  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.801   4.649   2.784  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.072   6.376   2.656  1.00  0.00           H  
ATOM     48  N   THR A   5       6.020   3.571   1.971  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.691   2.296   1.343  1.00  0.00           C  
ATOM     50  C   THR A   5       4.939   2.522   0.036  1.00  0.00           C  
ATOM     51  O   THR A   5       5.586   2.560  -0.998  1.00  0.00           O  
ATOM     52  CB  THR A   5       4.832   1.452   2.288  1.00  0.00           C  
ATOM     53  OG1 THR A   5       4.446   0.254   1.628  1.00  0.00           O  
ATOM     54  CG2 THR A   5       3.584   2.239   2.692  1.00  0.00           C  
ATOM     55  OXT THR A   5       3.726   2.653   0.088  1.00  0.00           O  
ATOM     56  H   THR A   5       5.663   3.771   2.858  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.605   1.762   1.133  1.00  0.00           H  
ATOM     58  HB  THR A   5       5.400   1.208   3.172  1.00  0.00           H  
ATOM     59  HG1 THR A   5       3.580   0.397   1.238  1.00  0.00           H  
ATOM     60 HG21 THR A   5       3.690   3.267   2.379  1.00  0.00           H  
ATOM     61 HG22 THR A   5       3.464   2.199   3.765  1.00  0.00           H  
ATOM     62 HG23 THR A   5       2.716   1.805   2.217  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL        7                                                                  
HETATM    1  N   DCY A   1       7.125   2.781   6.997  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.935   3.513   5.713  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.838   4.559   5.884  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.733   4.401   5.369  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.255   4.187   5.313  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.930   5.861   4.679  1.00  0.00           S  
HETATM    7  H2  DCY A   1       6.197   2.579   7.420  1.00  0.00           H  
HETATM    8  H   DCY A   1       7.628   1.888   6.816  1.00  0.00           H  
HETATM    9  H3  DCY A   1       7.686   3.365   7.650  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.644   2.815   4.943  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.742   3.594   4.558  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.896   4.252   6.180  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.162   5.636   6.594  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.205   6.718   6.807  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.811   7.294   5.454  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.198   8.409   5.104  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.833   7.814   7.671  1.00  0.00           C  
ATOM     18  CG  LEU A   2       5.640   7.471   9.149  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       6.178   6.065   9.422  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       6.398   8.483  10.012  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.063   5.710   6.962  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.329   6.331   7.310  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.889   7.884   7.452  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       5.357   8.759   7.457  1.00  0.00           H  
ATOM     25  HG  LEU A   2       4.586   7.506   9.391  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       6.271   5.916  10.488  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       7.146   5.955   8.956  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       5.496   5.334   9.013  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       6.039   8.428  11.029  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       6.237   9.477   9.625  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       7.454   8.254   9.990  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.085   6.500   4.673  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.692   6.907   3.336  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.779   6.454   2.363  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.531   6.300   1.167  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.839   5.606   4.988  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.757   6.424   3.081  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.569   7.985   3.282  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.996   6.228   2.893  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.110   5.779   2.066  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.797   4.453   1.360  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.258   4.226   0.241  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.369   5.630   2.929  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.148   6.369   3.863  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.300   6.525   1.316  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.812   4.660   2.774  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.079   6.387   2.641  1.00  0.00           H  
ATOM     48  N   THR A   5       6.017   3.578   2.001  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.674   2.298   1.391  1.00  0.00           C  
ATOM     50  C   THR A   5       4.904   2.511   0.091  1.00  0.00           C  
ATOM     51  O   THR A   5       5.297   1.935  -0.909  1.00  0.00           O  
ATOM     52  CB  THR A   5       4.826   1.467   2.357  1.00  0.00           C  
ATOM     53  OG1 THR A   5       5.388   1.539   3.659  1.00  0.00           O  
ATOM     54  CG2 THR A   5       4.797   0.011   1.891  1.00  0.00           C  
ATOM     55  OXT THR A   5       3.931   3.247   0.116  1.00  0.00           O  
ATOM     56  H   THR A   5       5.668   3.792   2.888  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.583   1.758   1.175  1.00  0.00           H  
ATOM     58  HB  THR A   5       3.819   1.855   2.376  1.00  0.00           H  
ATOM     59  HG1 THR A   5       4.845   2.133   4.183  1.00  0.00           H  
ATOM     60 HG21 THR A   5       3.869  -0.447   2.198  1.00  0.00           H  
ATOM     61 HG22 THR A   5       5.626  -0.524   2.331  1.00  0.00           H  
ATOM     62 HG23 THR A   5       4.877  -0.024   0.815  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL        8                                                                  
HETATM    1  N   DCY A   1       7.076   2.769   6.979  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.869   3.488   5.690  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.810   4.569   5.876  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.694   4.443   5.375  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.197   4.111   5.235  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.924   5.824   4.684  1.00  0.00           S  
HETATM    7  H2  DCY A   1       6.973   3.440   7.768  1.00  0.00           H  
HETATM    8  H   DCY A   1       6.370   2.012   7.073  1.00  0.00           H  
HETATM    9  H3  DCY A   1       8.029   2.355   6.996  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.531   2.788   4.940  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.606   3.525   4.431  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.890   4.110   6.064  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.176   5.637   6.580  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.255   6.748   6.800  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.841   7.310   5.445  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.241   8.411   5.069  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.942   7.840   7.623  1.00  0.00           C  
ATOM     18  CG  LEU A   2       4.901   8.570   8.474  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       4.787   7.884   9.837  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       5.335  10.024   8.670  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.084   5.685   6.937  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.383   6.396   7.335  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.685   7.392   8.266  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       6.417   8.546   6.958  1.00  0.00           H  
ATOM     25  HG  LEU A   2       3.944   8.541   7.975  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       3.754   7.881  10.153  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       5.384   8.419  10.560  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       5.143   6.867   9.759  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       5.113  10.589   7.776  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       6.396  10.061   8.863  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       4.801  10.450   9.506  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.083   6.518   4.694  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.671   6.909   3.358  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.757   6.470   2.377  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.511   6.348   1.177  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.827   5.634   5.028  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.740   6.413   3.115  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.532   7.986   3.300  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.971   6.224   2.907  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.088   5.790   2.072  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.796   4.462   1.360  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.248   4.255   0.235  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.356   5.661   2.925  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.119   6.345   3.879  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.261   6.541   1.324  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.832   4.712   2.738  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.037   6.451   2.655  1.00  0.00           H  
ATOM     48  N   THR A   5       6.050   3.563   2.006  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.733   2.279   1.392  1.00  0.00           C  
ATOM     50  C   THR A   5       4.710   2.457   0.275  1.00  0.00           C  
ATOM     51  O   THR A   5       4.053   3.484   0.258  1.00  0.00           O  
ATOM     52  CB  THR A   5       5.180   1.319   2.448  1.00  0.00           C  
ATOM     53  OG1 THR A   5       4.771   2.060   3.589  1.00  0.00           O  
ATOM     54  CG2 THR A   5       6.266   0.320   2.849  1.00  0.00           C  
ATOM     55  OXT THR A   5       4.600   1.563  -0.548  1.00  0.00           O  
ATOM     56  H   THR A   5       5.708   3.759   2.899  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.636   1.857   0.977  1.00  0.00           H  
ATOM     58  HB  THR A   5       4.335   0.785   2.043  1.00  0.00           H  
ATOM     59  HG1 THR A   5       4.503   2.934   3.295  1.00  0.00           H  
ATOM     60 HG21 THR A   5       6.023  -0.109   3.811  1.00  0.00           H  
ATOM     61 HG22 THR A   5       7.217   0.826   2.910  1.00  0.00           H  
ATOM     62 HG23 THR A   5       6.323  -0.466   2.110  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL        9                                                                  
HETATM    1  N   DCY A   1       7.080   2.771   6.964  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.862   3.484   5.674  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.808   4.570   5.866  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.694   4.454   5.359  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.187   4.098   5.201  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.923   5.819   4.674  1.00  0.00           S  
HETATM    7  H2  DCY A   1       6.173   2.675   7.464  1.00  0.00           H  
HETATM    8  H   DCY A   1       7.476   1.828   6.777  1.00  0.00           H  
HETATM    9  H3  DCY A   1       7.745   3.313   7.552  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.513   2.781   4.931  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.573   3.517   4.381  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.897   4.080   6.015  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.174   5.631   6.580  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.254   6.743   6.804  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.845   7.313   5.451  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.254   8.412   5.079  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.938   7.831   7.635  1.00  0.00           C  
ATOM     18  CG  LEU A   2       5.910   7.438   9.113  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       6.843   6.249   9.345  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       6.376   8.623   9.963  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.081   5.674   6.944  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.381   6.389   7.333  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.963   7.941   7.310  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       5.416   8.767   7.503  1.00  0.00           H  
ATOM     25  HG  LEU A   2       4.903   7.166   9.394  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       7.808   6.458   8.907  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       6.423   5.367   8.884  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       6.957   6.081  10.405  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       6.902   9.330   9.338  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       7.035   8.270  10.741  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       5.519   9.106  10.409  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.081   6.530   4.697  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.672   6.929   3.363  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.754   6.487   2.377  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.506   6.376   1.177  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.817   5.646   5.028  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.738   6.439   3.118  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.538   8.007   3.310  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.965   6.229   2.904  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.079   5.793   2.065  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.789   4.460   1.360  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.223   4.258   0.225  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.353   5.676   2.912  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.116   6.342   3.876  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.244   6.540   1.312  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.843   4.737   2.716  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.020   6.479   2.647  1.00  0.00           H  
ATOM     48  N   THR A   5       6.063   3.552   2.016  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.749   2.265   1.406  1.00  0.00           C  
ATOM     50  C   THR A   5       4.800   2.449   0.226  1.00  0.00           C  
ATOM     51  O   THR A   5       3.963   3.334   0.297  1.00  0.00           O  
ATOM     52  CB  THR A   5       5.107   1.339   2.441  1.00  0.00           C  
ATOM     53  OG1 THR A   5       4.474   0.255   1.775  1.00  0.00           O  
ATOM     54  CG2 THR A   5       4.071   2.118   3.252  1.00  0.00           C  
ATOM     55  OXT THR A   5       4.924   1.702  -0.730  1.00  0.00           O  
ATOM     56  H   THR A   5       5.733   3.743   2.914  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.663   1.812   1.053  1.00  0.00           H  
ATOM     58  HB  THR A   5       5.867   0.959   3.106  1.00  0.00           H  
ATOM     59  HG1 THR A   5       3.524   0.385   1.832  1.00  0.00           H  
ATOM     60 HG21 THR A   5       4.472   2.341   4.229  1.00  0.00           H  
ATOM     61 HG22 THR A   5       3.175   1.523   3.359  1.00  0.00           H  
ATOM     62 HG23 THR A   5       3.832   3.039   2.742  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL       10                                                                  
HETATM    1  N   DCY A   1       7.098   2.771   6.933  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.915   3.497   5.646  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.835   4.561   5.816  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.751   4.450   5.244  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.243   4.147   5.232  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.951   5.852   4.663  1.00  0.00           S  
HETATM    7  H2  DCY A   1       7.450   1.811   6.742  1.00  0.00           H  
HETATM    8  H   DCY A   1       7.785   3.281   7.525  1.00  0.00           H  
HETATM    9  H3  DCY A   1       6.189   2.715   7.432  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.609   2.798   4.880  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.692   3.566   4.444  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.909   4.164   6.084  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.147   5.598   6.590  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.202   6.691   6.807  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.824   7.286   5.456  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.247   8.389   5.110  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.845   7.769   7.683  1.00  0.00           C  
ATOM     18  CG  LEU A   2       4.784   8.392   8.590  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       5.463   9.253   9.655  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       3.847   9.266   7.750  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.031   5.636   7.006  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.318   6.314   7.301  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.621   7.323   8.289  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       6.274   8.535   7.055  1.00  0.00           H  
ATOM     25  HG  LEU A   2       4.214   7.609   9.071  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       4.713   9.715  10.279  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       6.055  10.020   9.176  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       6.105   8.632  10.264  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       3.372   8.658   6.993  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       4.417  10.051   7.277  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       3.093   9.701   8.389  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.071   6.523   4.672  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.693   6.950   3.338  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.775   6.484   2.362  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.518   6.323   1.170  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.796   5.635   4.980  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.748   6.491   3.074  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.592   8.032   3.296  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.994   6.258   2.887  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.101   5.797   2.054  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.790   4.453   1.377  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.228   4.216   0.250  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.375   5.676   2.902  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.154   6.405   3.853  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.274   6.530   1.286  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.850   4.726   2.721  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.054   6.465   2.624  1.00  0.00           H  
ATOM     48  N   THR A   5       6.041   3.575   2.050  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.706   2.279   1.469  1.00  0.00           C  
ATOM     50  C   THR A   5       4.316   2.317   0.844  1.00  0.00           C  
ATOM     51  O   THR A   5       3.351   2.269   1.591  1.00  0.00           O  
ATOM     52  CB  THR A   5       5.752   1.189   2.544  1.00  0.00           C  
ATOM     53  OG1 THR A   5       5.127   1.663   3.728  1.00  0.00           O  
ATOM     54  CG2 THR A   5       7.208   0.825   2.841  1.00  0.00           C  
ATOM     55  OXT THR A   5       4.234   2.391  -0.371  1.00  0.00           O  
ATOM     56  H   THR A   5       5.711   3.795   2.940  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.428   2.043   0.704  1.00  0.00           H  
ATOM     58  HB  THR A   5       5.233   0.312   2.189  1.00  0.00           H  
ATOM     59  HG1 THR A   5       5.685   1.425   4.473  1.00  0.00           H  
ATOM     60 HG21 THR A   5       7.863   1.539   2.365  1.00  0.00           H  
ATOM     61 HG22 THR A   5       7.416  -0.164   2.461  1.00  0.00           H  
ATOM     62 HG23 THR A   5       7.373   0.841   3.909  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL       11                                                                  
HETATM    1  N   DCY A   1       7.121   2.788   6.925  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.912   3.499   5.633  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.834   4.565   5.809  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.754   4.464   5.230  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.234   4.139   5.185  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.948   5.849   4.636  1.00  0.00           S  
HETATM    7  H2  DCY A   1       6.253   2.275   7.182  1.00  0.00           H  
HETATM    8  H   DCY A   1       7.906   2.113   6.827  1.00  0.00           H  
HETATM    9  H3  DCY A   1       7.350   3.478   7.668  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.589   2.792   4.884  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.654   3.558   4.382  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.924   4.144   6.018  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.141   5.593   6.599  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.192   6.681   6.823  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.819   7.297   5.478  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.234   8.411   5.158  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.822   7.749   7.721  1.00  0.00           C  
ATOM     18  CG  LEU A   2       5.899   7.231   9.158  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       6.746   8.187  10.000  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       4.489   7.148   9.747  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.021   5.625   7.024  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.306   6.293   7.308  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.817   7.977   7.365  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       5.218   8.643   7.696  1.00  0.00           H  
ATOM     25  HG  LEU A   2       6.353   6.250   9.163  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       6.306   8.291  10.981  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       6.786   9.152   9.518  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       7.747   7.791  10.096  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       3.831   7.806   9.199  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       4.514   7.447  10.785  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       4.126   6.133   9.674  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.075   6.542   4.675  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.700   6.989   3.345  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.771   6.525   2.358  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.515   6.408   1.160  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.804   5.647   4.968  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.749   6.545   3.081  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.610   8.073   3.317  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.982   6.253   2.878  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.083   5.792   2.036  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.777   4.445   1.363  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.188   4.218   0.225  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.364   5.685   2.873  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.142   6.370   3.849  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.245   6.523   1.265  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.852   4.743   2.684  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.028   6.484   2.593  1.00  0.00           H  
ATOM     48  N   THR A   5       6.059   3.551   2.051  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.729   2.252   1.475  1.00  0.00           C  
ATOM     50  C   THR A   5       4.581   2.385   0.481  1.00  0.00           C  
ATOM     51  O   THR A   5       3.950   3.428   0.470  1.00  0.00           O  
ATOM     52  CB  THR A   5       5.336   1.274   2.585  1.00  0.00           C  
ATOM     53  OG1 THR A   5       4.822   1.999   3.694  1.00  0.00           O  
ATOM     54  CG2 THR A   5       6.563   0.471   3.021  1.00  0.00           C  
ATOM     55  OXT THR A   5       4.349   1.440  -0.255  1.00  0.00           O  
ATOM     56  H   THR A   5       5.747   3.762   2.951  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.596   1.866   0.961  1.00  0.00           H  
ATOM     58  HB  THR A   5       4.581   0.596   2.217  1.00  0.00           H  
ATOM     59  HG1 THR A   5       5.193   1.620   4.493  1.00  0.00           H  
ATOM     60 HG21 THR A   5       6.257  -0.310   3.703  1.00  0.00           H  
ATOM     61 HG22 THR A   5       7.264   1.126   3.516  1.00  0.00           H  
ATOM     62 HG23 THR A   5       7.032   0.030   2.154  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL       12                                                                  
HETATM    1  N   DCY A   1       7.080   2.774   6.985  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.869   3.489   5.696  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.811   4.571   5.882  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.693   4.443   5.386  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.195   4.108   5.234  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.926   5.821   4.683  1.00  0.00           S  
HETATM    7  H2  DCY A   1       6.158   2.537   7.405  1.00  0.00           H  
HETATM    8  H   DCY A   1       7.620   1.903   6.815  1.00  0.00           H  
HETATM    9  H3  DCY A   1       7.612   3.386   7.638  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.527   2.787   4.948  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.599   3.520   4.427  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.893   4.106   6.059  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.178   5.642   6.582  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.255   6.753   6.801  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.841   7.311   5.445  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.239   8.412   5.066  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.938   7.849   7.623  1.00  0.00           C  
ATOM     18  CG  LEU A   2       6.289   7.303   9.007  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       7.088   8.352   9.786  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       5.000   6.976   9.765  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.087   5.693   6.936  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.384   6.400   7.335  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.841   8.165   7.120  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       5.269   8.690   7.728  1.00  0.00           H  
ATOM     25  HG  LEU A   2       6.883   6.407   8.900  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       7.280   9.204   9.151  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       8.026   7.924  10.107  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       6.522   8.668  10.650  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       5.112   7.254  10.803  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       4.801   5.917   9.697  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       4.178   7.525   9.332  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.085   6.515   4.697  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.672   6.901   3.360  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.759   6.461   2.379  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.510   6.329   1.181  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.831   5.633   5.034  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.743   6.400   3.119  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.529   7.977   3.298  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.974   6.224   2.907  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.091   5.790   2.072  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.794   4.464   1.357  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.234   4.263   0.225  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.359   5.657   2.925  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.125   6.350   3.878  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.264   6.541   1.326  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.834   4.708   2.738  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.041   6.445   2.656  1.00  0.00           H  
ATOM     48  N   THR A   5       6.052   3.562   2.004  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.729   2.282   1.384  1.00  0.00           C  
ATOM     50  C   THR A   5       4.665   2.463   0.306  1.00  0.00           C  
ATOM     51  O   THR A   5       4.386   3.599  -0.037  1.00  0.00           O  
ATOM     52  CB  THR A   5       5.223   1.302   2.446  1.00  0.00           C  
ATOM     53  OG1 THR A   5       4.275   1.955   3.278  1.00  0.00           O  
ATOM     54  CG2 THR A   5       6.399   0.815   3.293  1.00  0.00           C  
ATOM     55  OXT THR A   5       4.145   1.462  -0.159  1.00  0.00           O  
ATOM     56  H   THR A   5       5.717   3.754   2.901  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.621   1.875   0.933  1.00  0.00           H  
ATOM     58  HB  THR A   5       4.758   0.456   1.963  1.00  0.00           H  
ATOM     59  HG1 THR A   5       4.036   1.352   3.985  1.00  0.00           H  
ATOM     60 HG21 THR A   5       7.210   1.525   3.224  1.00  0.00           H  
ATOM     61 HG22 THR A   5       6.730  -0.146   2.930  1.00  0.00           H  
ATOM     62 HG23 THR A   5       6.087   0.723   4.323  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL       13                                                                  
HETATM    1  N   DCY A   1       7.082   2.770   6.986  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.880   3.496   5.700  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.815   4.571   5.887  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.698   4.438   5.390  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.207   4.131   5.261  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.923   5.833   4.686  1.00  0.00           S  
HETATM    7  H2  DCY A   1       7.729   1.969   6.833  1.00  0.00           H  
HETATM    8  H   DCY A   1       7.491   3.416   7.689  1.00  0.00           H  
HETATM    9  H3  DCY A   1       6.168   2.416   7.332  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.552   2.800   4.943  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.638   3.540   4.470  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.887   4.148   6.101  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.176   5.644   6.584  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.247   6.749   6.802  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.837   7.308   5.445  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.236   8.410   5.067  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.919   7.846   7.632  1.00  0.00           C  
ATOM     18  CG  LEU A   2       5.347   7.834   9.051  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       3.851   8.147   8.999  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       5.558   6.450   9.675  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.085   5.700   6.938  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.374   6.389   7.330  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.984   7.668   7.671  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       5.731   8.807   7.180  1.00  0.00           H  
ATOM     25  HG  LEU A   2       5.851   8.580   9.648  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       3.287   7.228   9.055  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       3.621   8.656   8.075  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       3.588   8.782   9.833  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       6.236   6.532  10.512  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       5.977   5.781   8.936  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       4.611   6.059  10.017  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.083   6.512   4.694  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.675   6.900   3.357  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.763   6.460   2.377  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.517   6.331   1.177  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.828   5.629   5.030  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.746   6.400   3.112  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.532   7.975   3.296  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.977   6.221   2.907  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.095   5.786   2.074  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.799   4.460   1.358  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.254   4.252   0.233  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.360   5.651   2.929  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.127   6.345   3.878  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.271   6.539   1.327  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.827   4.695   2.751  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.049   6.430   2.655  1.00  0.00           H  
ATOM     48  N   THR A   5       6.041   3.565   1.997  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.719   2.283   1.380  1.00  0.00           C  
ATOM     50  C   THR A   5       4.933   2.494   0.089  1.00  0.00           C  
ATOM     51  O   THR A   5       3.715   2.528   0.159  1.00  0.00           O  
ATOM     52  CB  THR A   5       4.894   1.430   2.347  1.00  0.00           C  
ATOM     53  OG1 THR A   5       4.290   2.271   3.320  1.00  0.00           O  
ATOM     54  CG2 THR A   5       5.803   0.414   3.039  1.00  0.00           C  
ATOM     55  OXT THR A   5       5.560   2.617  -0.950  1.00  0.00           O  
ATOM     56  H   THR A   5       5.697   3.763   2.890  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.635   1.763   1.151  1.00  0.00           H  
ATOM     58  HB  THR A   5       4.126   0.906   1.799  1.00  0.00           H  
ATOM     59  HG1 THR A   5       3.820   2.969   2.859  1.00  0.00           H  
ATOM     60 HG21 THR A   5       5.249  -0.096   3.813  1.00  0.00           H  
ATOM     61 HG22 THR A   5       6.647   0.926   3.478  1.00  0.00           H  
ATOM     62 HG23 THR A   5       6.155  -0.305   2.315  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL       14                                                                  
HETATM    1  N   DCY A   1       7.120   2.794   6.955  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.900   3.496   5.659  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.829   4.568   5.840  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.736   4.456   5.286  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.220   4.122   5.191  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.941   5.834   4.644  1.00  0.00           S  
HETATM    7  H2  DCY A   1       7.050   3.479   7.736  1.00  0.00           H  
HETATM    8  H   DCY A   1       6.400   2.054   7.076  1.00  0.00           H  
HETATM    9  H3  DCY A   1       8.064   2.360   6.958  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.564   2.785   4.919  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.622   3.538   4.382  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.924   4.122   6.012  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.155   5.613   6.598  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.211   6.707   6.819  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.826   7.303   5.469  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.230   8.414   5.129  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.851   7.789   7.694  1.00  0.00           C  
ATOM     18  CG  LEU A   2       7.375   7.668   7.625  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       8.007   9.033   7.904  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       7.852   6.662   8.674  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.044   5.653   7.001  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.329   6.328   7.317  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       5.551   8.764   7.338  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       5.529   7.663   8.716  1.00  0.00           H  
ATOM     25  HG  LEU A   2       7.665   7.333   6.642  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       7.296   9.662   8.419  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       8.287   9.497   6.970  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       8.886   8.904   8.520  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       7.952   7.156   9.629  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       8.809   6.258   8.376  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       7.134   5.860   8.756  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.082   6.530   4.683  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.692   6.954   3.349  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.768   6.495   2.364  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.511   6.361   1.168  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.819   5.639   4.991  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.748   6.489   3.094  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.584   8.034   3.307  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.984   6.243   2.885  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.089   5.790   2.043  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.783   4.451   1.358  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.208   4.229   0.223  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.365   5.674   2.883  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.144   6.371   3.854  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.254   6.527   1.280  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.848   4.729   2.694  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.036   6.471   2.609  1.00  0.00           H  
ATOM     48  N   THR A   5       6.053   3.559   2.031  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.725   2.267   1.442  1.00  0.00           C  
ATOM     50  C   THR A   5       4.898   2.450   0.174  1.00  0.00           C  
ATOM     51  O   THR A   5       4.187   3.438   0.091  1.00  0.00           O  
ATOM     52  CB  THR A   5       4.941   1.419   2.445  1.00  0.00           C  
ATOM     53  OG1 THR A   5       4.650   0.154   1.868  1.00  0.00           O  
ATOM     54  CG2 THR A   5       3.635   2.128   2.807  1.00  0.00           C  
ATOM     55  OXT THR A   5       4.987   1.600  -0.696  1.00  0.00           O  
ATOM     56  H   THR A   5       5.731   3.767   2.929  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.640   1.753   1.192  1.00  0.00           H  
ATOM     58  HB  THR A   5       5.530   1.280   3.339  1.00  0.00           H  
ATOM     59  HG1 THR A   5       4.843   0.206   0.929  1.00  0.00           H  
ATOM     60 HG21 THR A   5       3.166   2.501   1.909  1.00  0.00           H  
ATOM     61 HG22 THR A   5       3.845   2.953   3.472  1.00  0.00           H  
ATOM     62 HG23 THR A   5       2.970   1.431   3.298  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
MODEL       15                                                                  
HETATM    1  N   DCY A   1       7.108   2.800   6.969  1.00  0.00           N  
HETATM    2  CA  DCY A   1       6.859   3.483   5.669  1.00  0.00           C  
HETATM    3  C   DCY A   1       5.812   4.577   5.861  1.00  0.00           C  
HETATM    4  O   DCY A   1       4.703   4.475   5.343  1.00  0.00           O  
HETATM    5  CB  DCY A   1       8.175   4.072   5.145  1.00  0.00           C  
HETATM    6  SG  DCY A   1       7.934   5.805   4.652  1.00  0.00           S  
HETATM    7  H2  DCY A   1       6.803   1.806   6.904  1.00  0.00           H  
HETATM    8  H   DCY A   1       8.122   2.837   7.193  1.00  0.00           H  
HETATM    9  H3  DCY A   1       6.573   3.278   7.722  1.00  0.00           H  
HETATM   10  HA  DCY A   1       6.485   2.767   4.951  1.00  0.00           H  
HETATM   11  HB2 DCY A   1       8.507   3.492   4.300  1.00  0.00           H  
HETATM   12  HB3 DCY A   1       8.920   4.023   5.925  1.00  0.00           H  
ATOM     13  N   LEU A   2       6.174   5.630   6.594  1.00  0.00           N  
ATOM     14  CA  LEU A   2       5.249   6.740   6.817  1.00  0.00           C  
ATOM     15  C   LEU A   2       4.858   7.312   5.457  1.00  0.00           C  
ATOM     16  O   LEU A   2       5.296   8.396   5.079  1.00  0.00           O  
ATOM     17  CB  LEU A   2       5.926   7.822   7.674  1.00  0.00           C  
ATOM     18  CG  LEU A   2       4.891   8.805   8.253  1.00  0.00           C  
ATOM     19  CD1 LEU A   2       4.318   9.681   7.135  1.00  0.00           C  
ATOM     20  CD2 LEU A   2       3.749   8.044   8.937  1.00  0.00           C  
ATOM     21  H   LEU A   2       7.076   5.666   6.971  1.00  0.00           H  
ATOM     22  HA  LEU A   2       4.372   6.373   7.328  1.00  0.00           H  
ATOM     23  HB2 LEU A   2       6.457   7.349   8.487  1.00  0.00           H  
ATOM     24  HB3 LEU A   2       6.631   8.368   7.062  1.00  0.00           H  
ATOM     25  HG  LEU A   2       5.380   9.442   8.978  1.00  0.00           H  
ATOM     26 HD11 LEU A   2       3.627   9.102   6.541  1.00  0.00           H  
ATOM     27 HD12 LEU A   2       5.122  10.041   6.510  1.00  0.00           H  
ATOM     28 HD13 LEU A   2       3.798  10.522   7.571  1.00  0.00           H  
ATOM     29 HD21 LEU A   2       4.132   7.135   9.376  1.00  0.00           H  
ATOM     30 HD22 LEU A   2       2.987   7.802   8.210  1.00  0.00           H  
ATOM     31 HD23 LEU A   2       3.318   8.664   9.712  1.00  0.00           H  
ATOM     32  N   GLY A   3       4.073   6.546   4.705  1.00  0.00           N  
ATOM     33  CA  GLY A   3       3.677   6.956   3.368  1.00  0.00           C  
ATOM     34  C   GLY A   3       4.752   6.507   2.380  1.00  0.00           C  
ATOM     35  O   GLY A   3       4.502   6.414   1.178  1.00  0.00           O  
ATOM     36  H   GLY A   3       3.784   5.672   5.038  1.00  0.00           H  
ATOM     37  HA2 GLY A   3       2.736   6.483   3.117  1.00  0.00           H  
ATOM     38  HA3 GLY A   3       3.559   8.035   3.322  1.00  0.00           H  
ATOM     39  N   ALA A   4       5.959   6.227   2.902  1.00  0.00           N  
ATOM     40  CA  ALA A   4       7.064   5.790   2.053  1.00  0.00           C  
ATOM     41  C   ALA A   4       6.770   4.455   1.350  1.00  0.00           C  
ATOM     42  O   ALA A   4       7.168   4.268   0.199  1.00  0.00           O  
ATOM     43  CB  ALA A   4       8.349   5.684   2.887  1.00  0.00           C  
ATOM     44  H   ALA A   4       6.114   6.330   3.873  1.00  0.00           H  
ATOM     45  HA  ALA A   4       7.219   6.534   1.297  1.00  0.00           H  
ATOM     46  HB2 ALA A   4       8.852   4.755   2.677  1.00  0.00           H  
ATOM     47  HB3 ALA A   4       9.000   6.500   2.622  1.00  0.00           H  
ATOM     48  N   THR A   5       6.079   3.531   2.022  1.00  0.00           N  
ATOM     49  CA  THR A   5       5.767   2.245   1.406  1.00  0.00           C  
ATOM     50  C   THR A   5       4.850   2.438   0.202  1.00  0.00           C  
ATOM     51  O   THR A   5       4.816   3.541  -0.319  1.00  0.00           O  
ATOM     52  CB  THR A   5       5.090   1.323   2.424  1.00  0.00           C  
ATOM     53  OG1 THR A   5       4.876   0.049   1.834  1.00  0.00           O  
ATOM     54  CG2 THR A   5       3.748   1.923   2.845  1.00  0.00           C  
ATOM     55  OXT THR A   5       4.195   1.483  -0.180  1.00  0.00           O  
ATOM     56  H   THR A   5       5.774   3.709   2.932  1.00  0.00           H  
ATOM     57  HA  THR A   5       6.685   1.784   1.075  1.00  0.00           H  
ATOM     58  HB  THR A   5       5.722   1.218   3.292  1.00  0.00           H  
ATOM     59  HG1 THR A   5       5.140   0.100   0.912  1.00  0.00           H  
ATOM     60 HG21 THR A   5       2.945   1.322   2.445  1.00  0.00           H  
ATOM     61 HG22 THR A   5       3.669   2.930   2.463  1.00  0.00           H  
ATOM     62 HG23 THR A   5       3.684   1.939   3.922  1.00  0.00           H  
TER      63      THR A   5                                                      
ENDMDL                                                                          
CONECT    1    2    7    8                                                      
CONECT    2    1    3    5   10                                                 
CONECT    3    2    4   13                                                      
CONECT    4    3                                                                
CONECT    5    2    6   11   12                                                 
CONECT    6    5   43                                                           
CONECT    7    1                                                                
CONECT    8    1                                                                
CONECT   10    2                                                                
CONECT   11    5                                                                
CONECT   12    5                                                                
CONECT   13    3                                                                
CONECT   43    6                                                                
MASTER      132    0    1    0    0    0    0    6   31    1   13    1          
END