HEADER    ANTIBIOTIC                              09-MAR-19   6QYW              
TITLE     SOLUTION NMR OF SYNTHETIC ANALOGUES OF NISIN AND MUTACIN RING A AND   
TITLE    2 RING B - NISIN RING A                                                
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: ILE-DBU-DAL-ILE-DHA-LEU-CYS-ALA;                           
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   2   02-OCT-19 6QYW    1       JRNL                                     
REVDAT   1   11-SEP-19 6QYW    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 ANA-LOGUE.                                                   
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 2.45                                       
REMARK   3   AUTHORS     : SCHWIETERS, KUSZEWSKI, TJANDRA AND CLORE             
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 6QYW COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 10-MAR-19.                  
REMARK 100 THE DEPOSITION ID IS D_1292101156.                                   
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                : 0.7 MG/ML NISIN RING A, 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 2.45, CCPNMR ANALYSIS    
REMARK 210   METHOD USED                   : SIMULATED ANNEALING                
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 150                                
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: 920 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: 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 CYS A   7      -15.76   -145.39                                   
REMARK 500  2 DAL A   3      -33.76    -35.40                                   
REMARK 500  2 ILE A   4      -86.23    -75.36                                   
REMARK 500  2 LEU A   6     -174.18    -52.16                                   
REMARK 500  2 CYS A   7      -78.66     88.97                                   
REMARK 500  3 DAL A   3       15.37    -62.68                                   
REMARK 500  3 CYS A   7      -61.43   -125.15                                   
REMARK 500  4 DAL A   3      -18.95   -147.48                                   
REMARK 500  4 CYS A   7       -8.89     85.40                                   
REMARK 500  5 DAL A   3        2.38   -149.81                                   
REMARK 500  6 DAL A   3       -9.30   -148.94                                   
REMARK 500  6 CYS A   7      -13.28   -151.88                                   
REMARK 500  7 DAL A   3      -23.53    -36.96                                   
REMARK 500  7 CYS A   7      -20.79   -165.22                                   
REMARK 500  8 DAL A   3       68.05    -70.79                                   
REMARK 500  8 ILE A   4       76.29    -52.43                                   
REMARK 500  8 CYS A   7      -36.49   -147.83                                   
REMARK 500  9 DAL A   3       -4.38    -51.49                                   
REMARK 500  9 CYS A   7       -4.71   -179.20                                   
REMARK 500 10 DAL A   3      -16.08    -47.29                                   
REMARK 500 10 LEU A   6      109.49   -169.73                                   
REMARK 500 10 CYS A   7      -46.57   -151.95                                   
REMARK 500 11 DAL A   3        6.78    -64.28                                   
REMARK 500 11 CYS A   7      -48.72   -135.85                                   
REMARK 500 12 DAL A   3      -32.81    -35.44                                   
REMARK 500 12 CYS A   7       14.88    176.64                                   
REMARK 500 13 DAL A   3      -22.82    -38.94                                   
REMARK 500 13 CYS A   7      -53.40    153.67                                   
REMARK 500 14 DAL A   3       25.77   -148.32                                   
REMARK 500 15 DAL A   3      -36.86   -148.67                                   
REMARK 500 15 CYS A   7      -43.48   -159.43                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1WCO   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 6QM1   RELATED DB: PDB                                   
REMARK 900 SOLUTION NMR OF SYNTHETIC NISIN RING B (LAN8,11) ANALOGUE            
REMARK 900 RELATED ID: 6QTF   RELATED DB: PDB                                   
REMARK 900 SOLUTION NMR OF SYNTHETIC MUTACIN I RING B, MAJOR CONFORMER          
REMARK 900 RELATED ID: 6QYR   RELATED DB: PDB                                   
REMARK 900 SOLUTION NMR OF SYNTHETIC MUTACIN I RING B, MINOR CONFORMER          
REMARK 900 RELATED ID: 6QYS   RELATED DB: PDB                                   
REMARK 900 SOLUTION NMR OF SYNTHETIC NISIN RING B                               
REMARK 900 RELATED ID: 6QYV   RELATED DB: PDB                                   
REMARK 900 SOLUTION NMR OF SYNTHETIC MUTACIN I RING A (SER2, ALA5, ALA8)        
REMARK 900 ANALOGUE                                                             
REMARK 900 RELATED ID: 6QYT   RELATED DB: PDB                                   
REMARK 900 SOLUTION NMR OF SYNTHETIC MUTACIN I RING A TRUNCATED ANALOGUE        
REMARK 900 RELATED ID: 6QYU   RELATED DB: PDB                                   
REMARK 900 SOLUTION NMR OF SYNTHETIC MUTACIN I RING A                           
REMARK 900 RELATED ID: 34374   RELATED DB: BMRB                                 
REMARK 900 SOLUTION NMR OF SYNTHETIC ANALOGUES OF NISIN AND MUTACIN RING A AND  
REMARK 900 RING B - NISIN RING A                                                
DBREF  6QYW A    1     8  PDB    6QYW     6QYW             1      8             
SEQRES   1 A    8  ILE DBU DAL ILE DHA LEU CYS ALA                              
HET    DBU  A   2      11                                                       
HET    DAL  A   3       9                                                       
HET    DHA  A   5       8                                                       
HETNAM     DBU (2Z)-2-AMINOBUT-2-ENOIC ACID                                     
HETNAM     DAL D-ALANINE                                                        
HETNAM     DHA 2-AMINO-ACRYLIC ACID                                             
HETSYN     DBU Z-DEHYDROBUTYRINE                                                
HETSYN     DHA 2,3-DIDEHYDROALANINE                                             
FORMUL   1  DBU    C4 H7 N O2                                                   
FORMUL   1  DAL    C3 H7 N O2                                                   
FORMUL   1  DHA    C3 H5 N O2                                                   
LINK         C   ILE A   1                 N   DBU A   2     1555   1555  1.35  
LINK         C   DBU A   2                 N   DAL A   3     1555   1555  1.34  
LINK         CB  DAL A   3                 SG  CYS A   7     1555   1555  1.81  
LINK         C   DAL A   3                 N   ILE A   4     1555   1555  1.33  
LINK         C   ILE A   4                 N   DHA A   5     1555   1555  1.35  
LINK         C   DHA A   5                 N   LEU A   6     1555   1555  1.34  
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                                                                  
ATOM      1  N   ILE A   1      11.031   0.270   5.833  1.00  0.00           N1+
ATOM      2  CA  ILE A   1      11.042   1.552   6.593  1.00  0.00           C  
ATOM      3  C   ILE A   1      10.338   2.630   5.775  1.00  0.00           C  
ATOM      4  O   ILE A   1      10.234   2.530   4.553  1.00  0.00           O  
ATOM      5  CB  ILE A   1      12.489   1.966   6.873  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      13.133   2.486   5.584  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      13.276   0.758   7.384  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      13.060   1.409   4.501  1.00  0.00           C  
ATOM      9  H1  ILE A   1      10.667   0.437   4.874  1.00  0.00           H  
ATOM     10  H2  ILE A   1      10.421  -0.417   6.323  1.00  0.00           H  
ATOM     11  H3  ILE A   1      11.998  -0.106   5.774  1.00  0.00           H  
ATOM     12  HA  ILE A   1      10.520   1.416   7.528  1.00  0.00           H  
ATOM     13  HB  ILE A   1      12.499   2.744   7.622  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      12.610   3.370   5.251  1.00  0.00           H  
ATOM     15 HG13 ILE A   1      14.167   2.732   5.775  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      13.720   0.238   6.548  1.00  0.00           H  
ATOM     17 HG22 ILE A   1      12.609   0.090   7.909  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      14.053   1.093   8.055  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      13.729   1.666   3.693  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      12.050   1.344   4.125  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      13.352   0.457   4.918  1.00  0.00           H  
HETATM   22  N   DBU A   2       9.849   3.680   6.459  1.00  0.00           N  
HETATM   23  CA  DBU A   2       9.195   4.705   5.784  1.00  0.00           C  
HETATM   24  CB  DBU A   2       9.638   5.938   5.503  1.00  0.00           C  
HETATM   25  CG  DBU A   2      11.019   6.469   5.894  1.00  0.00           C  
HETATM   26  C   DBU A   2       7.834   4.274   5.363  1.00  0.00           C  
HETATM   27  O   DBU A   2       6.867   4.329   6.123  1.00  0.00           O  
HETATM   28  H   DBU A   2       9.928   3.767   7.431  1.00  0.00           H  
HETATM   29  HB  DBU A   2       8.977   6.601   4.964  1.00  0.00           H  
HETATM   30  HG1 DBU A   2      11.763   5.707   5.712  1.00  0.00           H  
HETATM   31  HG2 DBU A   2      11.020   6.731   6.942  1.00  0.00           H  
HETATM   32  HG3 DBU A   2      11.248   7.345   5.303  1.00  0.00           H  
HETATM   33  N   DAL A   3       7.723   3.821   4.102  1.00  0.00           N  
HETATM   34  CA  DAL A   3       6.419   3.381   3.620  1.00  0.00           C  
HETATM   35  CB  DAL A   3       5.398   4.510   3.771  1.00  0.00           C  
HETATM   36  C   DAL A   3       5.947   2.154   4.394  1.00  0.00           C  
HETATM   37  O   DAL A   3       4.838   1.665   4.183  1.00  0.00           O  
HETATM   38  H   DAL A   3       8.493   3.777   3.497  1.00  0.00           H  
HETATM   39  HA  DAL A   3       6.501   3.125   2.573  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       5.881   5.378   4.196  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       4.598   4.189   4.423  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.797   1.663   5.289  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.454   0.492   6.089  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.164   0.735   6.866  1.00  0.00           C  
ATOM     45  O   ILE A   4       4.378  -0.186   7.091  1.00  0.00           O  
ATOM     46  CB  ILE A   4       7.595   0.173   7.061  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       7.649  -1.338   7.303  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       7.361   0.892   8.391  1.00  0.00           C  
ATOM     49  CD1 ILE A   4       6.299  -1.818   7.839  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.667   2.094   5.415  1.00  0.00           H  
ATOM     51  HA  ILE A   4       6.313  -0.352   5.431  1.00  0.00           H  
ATOM     52  HB  ILE A   4       8.531   0.503   6.635  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       7.869  -1.843   6.373  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       8.421  -1.560   8.025  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       7.156   1.936   8.204  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       8.241   0.802   9.010  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       6.518   0.445   8.898  1.00  0.00           H  
ATOM     58 HD11 ILE A   4       5.872  -1.055   8.472  1.00  0.00           H  
ATOM     59 HD12 ILE A   4       6.441  -2.724   8.410  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       5.634  -2.015   7.011  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.940   1.994   7.282  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.786   2.298   7.995  1.00  0.00           C  
HETATM   63  CB  DHA A   5       3.631   2.434   9.319  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.631   2.476   7.073  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.875   1.547   6.788  1.00  0.00           O  
HETATM   66  H   DHA A   5       5.561   2.732   7.106  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       4.474   2.304   9.982  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       2.661   2.675   9.731  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.464   3.711   6.570  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.353   3.959   5.659  1.00  0.00           C  
ATOM     71  C   LEU A   6       1.624   5.194   4.807  1.00  0.00           C  
ATOM     72  O   LEU A   6       1.496   6.324   5.277  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.061   4.158   6.454  1.00  0.00           C  
ATOM     74  CG  LEU A   6      -1.130   3.677   5.623  1.00  0.00           C  
ATOM     75  CD1 LEU A   6      -1.154   4.416   4.284  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -1.003   2.173   5.371  1.00  0.00           C  
ATOM     77  H   LEU A   6       3.066   4.451   6.797  1.00  0.00           H  
ATOM     78  HA  LEU A   6       1.236   3.104   5.010  1.00  0.00           H  
ATOM     79  HB2 LEU A   6       0.113   3.589   7.372  1.00  0.00           H  
ATOM     80  HB3 LEU A   6      -0.063   5.205   6.685  1.00  0.00           H  
ATOM     81  HG  LEU A   6      -2.046   3.877   6.161  1.00  0.00           H  
ATOM     82 HD11 LEU A   6      -1.100   5.481   4.460  1.00  0.00           H  
ATOM     83 HD12 LEU A   6      -2.070   4.184   3.761  1.00  0.00           H  
ATOM     84 HD13 LEU A   6      -0.309   4.107   3.687  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -0.618   2.006   4.376  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -1.973   1.708   5.464  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -0.327   1.743   6.095  1.00  0.00           H  
ATOM     88  N   CYS A   7       1.999   4.969   3.552  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.286   6.071   2.641  1.00  0.00           C  
ATOM     90  C   CYS A   7       1.862   5.714   1.220  1.00  0.00           C  
ATOM     91  O   CYS A   7       1.744   6.586   0.360  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.782   6.392   2.665  1.00  0.00           C  
ATOM     93  SG  CYS A   7       4.719   4.933   2.147  1.00  0.00           S  
ATOM     94  H   CYS A   7       2.084   4.046   3.233  1.00  0.00           H  
ATOM     95  HA  CYS A   7       1.738   6.944   2.963  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       3.985   7.209   1.989  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       4.075   6.672   3.666  1.00  0.00           H  
ATOM     98  N   ALA A   8       1.633   4.427   0.984  1.00  0.00           N  
ATOM     99  CA  ALA A   8       1.220   3.966  -0.337  1.00  0.00           C  
ATOM    100  C   ALA A   8       0.060   2.981  -0.222  1.00  0.00           C  
ATOM    101  O   ALA A   8      -0.451   2.575  -1.254  1.00  0.00           O  
ATOM    102  CB  ALA A   8       2.397   3.290  -1.045  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -0.299   2.648   0.894  1.00  0.00           O  
ATOM    104  H   ALA A   8       1.743   3.776   1.708  1.00  0.00           H  
ATOM    105  HA  ALA A   8       0.903   4.815  -0.922  1.00  0.00           H  
ATOM    106  HB1 ALA A   8       3.312   3.519  -0.520  1.00  0.00           H  
ATOM    107  HB2 ALA A   8       2.463   3.654  -2.060  1.00  0.00           H  
ATOM    108  HB3 ALA A   8       2.245   2.221  -1.055  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL        2                                                                  
ATOM      1  N   ILE A   1       9.555   3.952   9.280  1.00  0.00           N1+
ATOM      2  CA  ILE A   1       8.259   4.029  10.012  1.00  0.00           C  
ATOM      3  C   ILE A   1       7.219   4.711   9.129  1.00  0.00           C  
ATOM      4  O   ILE A   1       6.132   5.059   9.590  1.00  0.00           O  
ATOM      5  CB  ILE A   1       8.453   4.827  11.303  1.00  0.00           C  
ATOM      6  CG1 ILE A   1       9.306   4.013  12.281  1.00  0.00           C  
ATOM      7  CG2 ILE A   1       7.090   5.117  11.935  1.00  0.00           C  
ATOM      8  CD1 ILE A   1       8.410   3.069  13.085  1.00  0.00           C  
ATOM      9  H1  ILE A   1       9.376   3.953   8.256  1.00  0.00           H  
ATOM     10  H2  ILE A   1      10.050   3.076   9.545  1.00  0.00           H  
ATOM     11  H3  ILE A   1      10.143   4.772   9.527  1.00  0.00           H  
ATOM     12  HA  ILE A   1       7.925   3.031  10.253  1.00  0.00           H  
ATOM     13  HB  ILE A   1       8.951   5.759  11.078  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      10.035   3.437  11.728  1.00  0.00           H  
ATOM     15 HG13 ILE A   1       9.817   4.684  12.957  1.00  0.00           H  
ATOM     16 HG21 ILE A   1       6.413   4.303  11.720  1.00  0.00           H  
ATOM     17 HG22 ILE A   1       6.693   6.034  11.527  1.00  0.00           H  
ATOM     18 HG23 ILE A   1       7.204   5.218  13.005  1.00  0.00           H  
ATOM     19 HD11 ILE A   1       7.959   3.611  13.903  1.00  0.00           H  
ATOM     20 HD12 ILE A   1       9.004   2.255  13.476  1.00  0.00           H  
ATOM     21 HD13 ILE A   1       7.636   2.674  12.444  1.00  0.00           H  
HETATM   22  N   DBU A   2       7.555   4.906   7.842  1.00  0.00           N  
HETATM   23  CA  DBU A   2       6.660   5.523   6.975  1.00  0.00           C  
HETATM   24  CB  DBU A   2       6.093   6.733   7.077  1.00  0.00           C  
HETATM   25  CG  DBU A   2       6.342   7.710   8.228  1.00  0.00           C  
HETATM   26  C   DBU A   2       6.355   4.642   5.814  1.00  0.00           C  
HETATM   27  O   DBU A   2       5.336   3.955   5.768  1.00  0.00           O  
HETATM   28  H   DBU A   2       8.419   4.632   7.469  1.00  0.00           H  
HETATM   29  HB  DBU A   2       5.416   7.039   6.293  1.00  0.00           H  
HETATM   30  HG1 DBU A   2       7.002   7.254   8.950  1.00  0.00           H  
HETATM   31  HG2 DBU A   2       5.402   7.954   8.702  1.00  0.00           H  
HETATM   32  HG3 DBU A   2       6.795   8.611   7.843  1.00  0.00           H  
HETATM   33  N   DAL A   3       7.258   4.646   4.817  1.00  0.00           N  
HETATM   34  CA  DAL A   3       7.019   3.811   3.646  1.00  0.00           C  
HETATM   35  CB  DAL A   3       6.135   4.562   2.649  1.00  0.00           C  
HETATM   36  C   DAL A   3       6.337   2.508   4.046  1.00  0.00           C  
HETATM   37  O   DAL A   3       5.521   1.969   3.299  1.00  0.00           O  
HETATM   38  H   DAL A   3       8.069   5.196   4.852  1.00  0.00           H  
HETATM   39  HA  DAL A   3       7.964   3.585   3.174  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       5.886   3.909   1.826  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       6.666   5.426   2.276  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.673   2.008   5.231  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.076   0.771   5.720  1.00  0.00           C  
ATOM     44  C   ILE A   4       4.649   1.033   6.186  1.00  0.00           C  
ATOM     45  O   ILE A   4       3.698   0.878   5.421  1.00  0.00           O  
ATOM     46  CB  ILE A   4       6.909   0.210   6.876  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       8.100   1.134   7.135  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       7.420  -1.186   6.513  1.00  0.00           C  
ATOM     49  CD1 ILE A   4       9.059   0.468   8.122  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.324   2.482   5.787  1.00  0.00           H  
ATOM     51  HA  ILE A   4       6.055   0.050   4.917  1.00  0.00           H  
ATOM     52  HB  ILE A   4       6.298   0.147   7.765  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       8.614   1.327   6.205  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       7.748   2.067   7.553  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       6.583  -1.828   6.284  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       7.971  -1.596   7.347  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       8.068  -1.120   5.652  1.00  0.00           H  
ATOM     58 HD11 ILE A   4       9.567  -0.350   7.633  1.00  0.00           H  
ATOM     59 HD12 ILE A   4       8.503   0.092   8.968  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       9.786   1.191   8.462  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.494   1.454   7.454  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.223   1.729   7.936  1.00  0.00           C  
HETATM   63  CB  DHA A   5       2.649   1.338   9.080  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.488   2.585   6.970  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.832   2.110   6.042  1.00  0.00           O  
HETATM   66  H   DHA A   5       5.246   1.593   8.068  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       3.190   0.716   9.777  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       1.638   1.643   9.310  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.591   3.910   7.165  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.905   4.811   6.250  1.00  0.00           C  
ATOM     71  C   LEU A   6       2.267   4.475   4.805  1.00  0.00           C  
ATOM     72  O   LEU A   6       2.949   3.484   4.544  1.00  0.00           O  
ATOM     73  CB  LEU A   6       2.294   6.256   6.558  1.00  0.00           C  
ATOM     74  CG  LEU A   6       1.216   6.900   7.431  1.00  0.00           C  
ATOM     75  CD1 LEU A   6       1.262   6.289   8.831  1.00  0.00           C  
ATOM     76  CD2 LEU A   6       1.470   8.407   7.526  1.00  0.00           C  
ATOM     77  H   LEU A   6       3.118   4.287   7.901  1.00  0.00           H  
ATOM     78  HA  LEU A   6       0.842   4.699   6.379  1.00  0.00           H  
ATOM     79  HB2 LEU A   6       3.239   6.270   7.082  1.00  0.00           H  
ATOM     80  HB3 LEU A   6       2.386   6.808   5.635  1.00  0.00           H  
ATOM     81  HG  LEU A   6       0.245   6.723   6.992  1.00  0.00           H  
ATOM     82 HD11 LEU A   6       1.979   6.825   9.436  1.00  0.00           H  
ATOM     83 HD12 LEU A   6       1.553   5.251   8.762  1.00  0.00           H  
ATOM     84 HD13 LEU A   6       0.284   6.359   9.286  1.00  0.00           H  
ATOM     85 HD21 LEU A   6       2.480   8.623   7.210  1.00  0.00           H  
ATOM     86 HD22 LEU A   6       1.335   8.731   8.547  1.00  0.00           H  
ATOM     87 HD23 LEU A   6       0.772   8.929   6.887  1.00  0.00           H  
ATOM     88  N   CYS A   7       1.801   5.300   3.872  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.076   5.080   2.454  1.00  0.00           C  
ATOM     90  C   CYS A   7       1.004   4.188   1.837  1.00  0.00           C  
ATOM     91  O   CYS A   7       0.095   4.668   1.161  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.450   4.428   2.265  1.00  0.00           C  
ATOM     93  SG  CYS A   7       4.615   5.096   3.477  1.00  0.00           S  
ATOM     94  H   CYS A   7       1.258   6.072   4.141  1.00  0.00           H  
ATOM     95  HA  CYS A   7       2.070   6.032   1.945  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       3.364   3.361   2.397  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       3.810   4.638   1.268  1.00  0.00           H  
ATOM     98  N   ALA A   8       1.116   2.885   2.077  1.00  0.00           N  
ATOM     99  CA  ALA A   8       0.149   1.934   1.541  1.00  0.00           C  
ATOM    100  C   ALA A   8      -1.257   2.269   2.027  1.00  0.00           C  
ATOM    101  O   ALA A   8      -1.424   3.328   2.609  1.00  0.00           O  
ATOM    102  CB  ALA A   8       0.517   0.514   1.979  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -2.147   1.463   1.809  1.00  0.00           O  
ATOM    104  H   ALA A   8       1.861   2.558   2.624  1.00  0.00           H  
ATOM    105  HA  ALA A   8       0.169   1.982   0.463  1.00  0.00           H  
ATOM    106  HB1 ALA A   8      -0.246  -0.174   1.646  1.00  0.00           H  
ATOM    107  HB2 ALA A   8       0.589   0.477   3.056  1.00  0.00           H  
ATOM    108  HB3 ALA A   8       1.467   0.238   1.546  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL        3                                                                  
ATOM      1  N   ILE A   1      10.804   0.641   3.811  1.00  0.00           N1+
ATOM      2  CA  ILE A   1      11.220   2.061   3.989  1.00  0.00           C  
ATOM      3  C   ILE A   1      10.049   2.978   3.650  1.00  0.00           C  
ATOM      4  O   ILE A   1       9.255   2.685   2.756  1.00  0.00           O  
ATOM      5  CB  ILE A   1      12.402   2.363   3.067  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      13.333   1.147   3.018  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      13.172   3.573   3.602  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      13.037   0.328   1.762  1.00  0.00           C  
ATOM      9  H1  ILE A   1      10.842   0.391   2.804  1.00  0.00           H  
ATOM     10  H2  ILE A   1       9.832   0.518   4.164  1.00  0.00           H  
ATOM     11  H3  ILE A   1      11.447   0.022   4.344  1.00  0.00           H  
ATOM     12  HA  ILE A   1      11.515   2.221   5.016  1.00  0.00           H  
ATOM     13  HB  ILE A   1      12.038   2.580   2.073  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      14.360   1.482   2.998  1.00  0.00           H  
ATOM     15 HG13 ILE A   1      13.171   0.535   3.893  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      12.609   4.032   4.401  1.00  0.00           H  
ATOM     17 HG22 ILE A   1      13.317   4.288   2.807  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      14.132   3.252   3.977  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      13.636   0.695   0.943  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      11.990   0.417   1.512  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      13.275  -0.710   1.945  1.00  0.00           H  
HETATM   22  N   DBU A   2       9.941   4.107   4.375  1.00  0.00           N  
HETATM   23  CA  DBU A   2       8.901   4.996   4.127  1.00  0.00           C  
HETATM   24  CB  DBU A   2       8.970   6.292   3.791  1.00  0.00           C  
HETATM   25  CG  DBU A   2      10.276   7.068   3.612  1.00  0.00           C  
HETATM   26  C   DBU A   2       7.582   4.320   4.281  1.00  0.00           C  
HETATM   27  O   DBU A   2       6.900   4.448   5.297  1.00  0.00           O  
HETATM   28  H   DBU A   2      10.570   4.346   5.087  1.00  0.00           H  
HETATM   29  HB  DBU A   2       8.042   6.823   3.638  1.00  0.00           H  
HETATM   30  HG1 DBU A   2      10.111   7.902   2.945  1.00  0.00           H  
HETATM   31  HG2 DBU A   2      11.028   6.416   3.194  1.00  0.00           H  
HETATM   32  HG3 DBU A   2      10.611   7.436   4.571  1.00  0.00           H  
HETATM   33  N   DAL A   3       7.183   3.561   3.243  1.00  0.00           N  
HETATM   34  CA  DAL A   3       5.901   2.867   3.320  1.00  0.00           C  
HETATM   35  CB  DAL A   3       4.769   3.877   3.528  1.00  0.00           C  
HETATM   36  C   DAL A   3       5.896   1.851   4.459  1.00  0.00           C  
HETATM   37  O   DAL A   3       5.030   0.977   4.519  1.00  0.00           O  
HETATM   38  H   DAL A   3       7.729   3.460   2.436  1.00  0.00           H  
HETATM   39  HA  DAL A   3       5.732   2.346   2.389  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       5.164   4.766   3.989  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       4.015   3.444   4.171  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.864   1.969   5.362  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.954   1.052   6.493  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.581   0.853   7.124  1.00  0.00           C  
ATOM     45  O   ILE A   4       5.214  -0.259   7.505  1.00  0.00           O  
ATOM     46  CB  ILE A   4       7.922   1.606   7.540  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       9.238   1.997   6.864  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       8.195   0.539   8.601  1.00  0.00           C  
ATOM     49  CD1 ILE A   4      10.135   2.718   7.872  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.527   2.682   5.268  1.00  0.00           H  
ATOM     51  HA  ILE A   4       7.323   0.100   6.145  1.00  0.00           H  
ATOM     52  HB  ILE A   4       7.484   2.476   8.009  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       9.738   1.107   6.507  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       9.036   2.653   6.032  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       9.160   0.717   9.051  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       8.188  -0.438   8.140  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       7.429   0.584   9.362  1.00  0.00           H  
ATOM     58 HD11 ILE A   4      10.894   2.038   8.231  1.00  0.00           H  
ATOM     59 HD12 ILE A   4       9.538   3.061   8.704  1.00  0.00           H  
ATOM     60 HD13 ILE A   4      10.607   3.563   7.394  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.809   1.949   7.235  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.542   1.855   7.795  1.00  0.00           C  
HETATM   63  CB  DHA A   5       3.199   1.471   9.031  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.503   2.261   6.810  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.771   1.438   6.257  1.00  0.00           O  
HETATM   66  H   DHA A   5       5.096   2.836   6.931  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       3.959   1.179   9.740  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       2.159   1.451   9.324  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.413   3.578   6.559  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.417   4.051   5.605  1.00  0.00           C  
ATOM     71  C   LEU A   6       1.906   5.311   4.897  1.00  0.00           C  
ATOM     72  O   LEU A   6       2.161   6.332   5.535  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.102   4.347   6.325  1.00  0.00           C  
ATOM     74  CG  LEU A   6      -0.826   3.137   6.213  1.00  0.00           C  
ATOM     75  CD1 LEU A   6      -2.007   3.306   7.173  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -1.347   3.024   4.777  1.00  0.00           C  
ATOM     77  H   LEU A   6       2.996   4.231   7.001  1.00  0.00           H  
ATOM     78  HA  LEU A   6       1.245   3.280   4.868  1.00  0.00           H  
ATOM     79  HB2 LEU A   6       0.301   4.555   7.367  1.00  0.00           H  
ATOM     80  HB3 LEU A   6      -0.373   5.205   5.872  1.00  0.00           H  
ATOM     81  HG  LEU A   6      -0.279   2.241   6.471  1.00  0.00           H  
ATOM     82 HD11 LEU A   6      -2.316   2.338   7.537  1.00  0.00           H  
ATOM     83 HD12 LEU A   6      -2.829   3.775   6.653  1.00  0.00           H  
ATOM     84 HD13 LEU A   6      -1.708   3.925   8.006  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -0.920   3.812   4.175  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -2.423   3.113   4.775  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -1.065   2.065   4.368  1.00  0.00           H  
ATOM     88  N   CYS A   7       2.031   5.233   3.576  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.485   6.376   2.793  1.00  0.00           C  
ATOM     90  C   CYS A   7       1.480   6.700   1.694  1.00  0.00           C  
ATOM     91  O   CYS A   7       0.908   7.790   1.662  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.847   6.079   2.161  1.00  0.00           C  
ATOM     93  SG  CYS A   7       4.032   4.289   1.924  1.00  0.00           S  
ATOM     94  H   CYS A   7       1.810   4.394   3.120  1.00  0.00           H  
ATOM     95  HA  CYS A   7       2.582   7.232   3.444  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       3.910   6.574   1.203  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       4.631   6.446   2.803  1.00  0.00           H  
ATOM     98  N   ALA A   8       1.269   5.745   0.794  1.00  0.00           N  
ATOM     99  CA  ALA A   8       0.330   5.938  -0.304  1.00  0.00           C  
ATOM    100  C   ALA A   8      -1.064   6.249   0.230  1.00  0.00           C  
ATOM    101  O   ALA A   8      -1.918   6.599  -0.568  1.00  0.00           O  
ATOM    102  CB  ALA A   8       0.278   4.681  -1.174  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -1.257   6.133   1.429  1.00  0.00           O  
ATOM    104  H   ALA A   8       1.755   4.897   0.872  1.00  0.00           H  
ATOM    105  HA  ALA A   8       0.667   6.766  -0.911  1.00  0.00           H  
ATOM    106  HB1 ALA A   8       0.974   4.781  -1.993  1.00  0.00           H  
ATOM    107  HB2 ALA A   8      -0.721   4.553  -1.562  1.00  0.00           H  
ATOM    108  HB3 ALA A   8       0.546   3.820  -0.578  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL        4                                                                  
ATOM      1  N   ILE A   1       7.200   4.035   9.649  1.00  0.00           N1+
ATOM      2  CA  ILE A   1       6.134   4.825   8.972  1.00  0.00           C  
ATOM      3  C   ILE A   1       6.701   5.458   7.706  1.00  0.00           C  
ATOM      4  O   ILE A   1       5.958   5.965   6.865  1.00  0.00           O  
ATOM      5  CB  ILE A   1       5.632   5.916   9.920  1.00  0.00           C  
ATOM      6  CG1 ILE A   1       5.601   5.370  11.350  1.00  0.00           C  
ATOM      7  CG2 ILE A   1       4.224   6.345   9.506  1.00  0.00           C  
ATOM      8  CD1 ILE A   1       6.817   5.886  12.121  1.00  0.00           C  
ATOM      9  H1  ILE A   1       6.918   3.035   9.689  1.00  0.00           H  
ATOM     10  H2  ILE A   1       7.337   4.396  10.616  1.00  0.00           H  
ATOM     11  H3  ILE A   1       8.088   4.122   9.117  1.00  0.00           H  
ATOM     12  HA  ILE A   1       5.315   4.173   8.710  1.00  0.00           H  
ATOM     13  HB  ILE A   1       6.296   6.767   9.872  1.00  0.00           H  
ATOM     14 HG12 ILE A   1       4.696   5.699  11.840  1.00  0.00           H  
ATOM     15 HG13 ILE A   1       5.624   4.291  11.324  1.00  0.00           H  
ATOM     16 HG21 ILE A   1       3.906   7.176  10.118  1.00  0.00           H  
ATOM     17 HG22 ILE A   1       3.541   5.518   9.639  1.00  0.00           H  
ATOM     18 HG23 ILE A   1       4.229   6.644   8.468  1.00  0.00           H  
ATOM     19 HD11 ILE A   1       7.676   5.908  11.466  1.00  0.00           H  
ATOM     20 HD12 ILE A   1       7.019   5.231  12.956  1.00  0.00           H  
ATOM     21 HD13 ILE A   1       6.616   6.882  12.486  1.00  0.00           H  
HETATM   22  N   DBU A   2       8.039   5.430   7.568  1.00  0.00           N  
HETATM   23  CA  DBU A   2       8.633   5.987   6.443  1.00  0.00           C  
HETATM   24  CB  DBU A   2       9.734   6.745   6.369  1.00  0.00           C  
HETATM   25  CG  DBU A   2      10.579   7.158   7.576  1.00  0.00           C  
HETATM   26  C   DBU A   2       7.868   5.633   5.215  1.00  0.00           C  
HETATM   27  O   DBU A   2       7.415   6.497   4.468  1.00  0.00           O  
HETATM   28  H   DBU A   2       8.635   5.028   8.234  1.00  0.00           H  
HETATM   29  HB  DBU A   2      10.045   7.090   5.393  1.00  0.00           H  
HETATM   30  HG1 DBU A   2      10.126   8.011   8.058  1.00  0.00           H  
HETATM   31  HG2 DBU A   2      11.575   7.417   7.246  1.00  0.00           H  
HETATM   32  HG3 DBU A   2      10.634   6.336   8.273  1.00  0.00           H  
HETATM   33  N   DAL A   3       7.707   4.310   4.988  1.00  0.00           N  
HETATM   34  CA  DAL A   3       6.966   3.840   3.816  1.00  0.00           C  
HETATM   35  CB  DAL A   3       5.956   4.908   3.355  1.00  0.00           C  
HETATM   36  C   DAL A   3       6.251   2.534   4.170  1.00  0.00           C  
HETATM   37  O   DAL A   3       5.313   2.110   3.500  1.00  0.00           O  
HETATM   38  H   DAL A   3       8.072   3.642   5.602  1.00  0.00           H  
HETATM   39  HA  DAL A   3       7.665   3.650   3.014  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       6.469   5.646   2.756  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       5.523   5.389   4.220  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.718   1.891   5.238  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.125   0.633   5.680  1.00  0.00           C  
ATOM     44  C   ILE A   4       4.714   0.871   6.206  1.00  0.00           C  
ATOM     45  O   ILE A   4       3.732   0.451   5.593  1.00  0.00           O  
ATOM     46  CB  ILE A   4       6.983   0.003   6.779  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       7.868   1.078   7.412  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       7.866  -1.091   6.176  1.00  0.00           C  
ATOM     49  CD1 ILE A   4       8.485   0.536   8.702  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.476   2.267   5.735  1.00  0.00           H  
ATOM     51  HA  ILE A   4       6.077  -0.046   4.842  1.00  0.00           H  
ATOM     52  HB  ILE A   4       6.341  -0.428   7.534  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       8.653   1.350   6.721  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       7.271   1.948   7.639  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       8.184  -0.793   5.188  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       7.305  -2.012   6.112  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       8.733  -1.240   6.803  1.00  0.00           H  
ATOM     58 HD11 ILE A   4       9.515   0.857   8.772  1.00  0.00           H  
ATOM     59 HD12 ILE A   4       8.445  -0.543   8.695  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       7.935   0.912   9.552  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.609   1.562   7.356  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.355   1.825   7.894  1.00  0.00           C  
HETATM   63  CB  DHA A   5       2.859   1.465   9.085  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.537   2.619   6.936  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.889   2.087   6.036  1.00  0.00           O  
HETATM   66  H   DHA A   5       5.385   1.904   7.847  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       3.461   0.889   9.772  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       1.854   1.749   9.363  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.555   3.953   7.108  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.781   4.789   6.198  1.00  0.00           C  
ATOM     71  C   LEU A   6       2.397   4.761   4.800  1.00  0.00           C  
ATOM     72  O   LEU A   6       3.574   4.441   4.640  1.00  0.00           O  
ATOM     73  CB  LEU A   6       1.746   6.230   6.713  1.00  0.00           C  
ATOM     74  CG  LEU A   6       0.298   6.723   6.762  1.00  0.00           C  
ATOM     75  CD1 LEU A   6       0.246   8.096   7.437  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -0.247   6.835   5.336  1.00  0.00           C  
ATOM     77  H   LEU A   6       3.074   4.379   7.822  1.00  0.00           H  
ATOM     78  HA  LEU A   6       0.772   4.410   6.144  1.00  0.00           H  
ATOM     79  HB2 LEU A   6       2.173   6.267   7.705  1.00  0.00           H  
ATOM     80  HB3 LEU A   6       2.317   6.864   6.052  1.00  0.00           H  
ATOM     81  HG  LEU A   6      -0.302   6.023   7.325  1.00  0.00           H  
ATOM     82 HD11 LEU A   6       1.251   8.444   7.624  1.00  0.00           H  
ATOM     83 HD12 LEU A   6      -0.286   8.016   8.374  1.00  0.00           H  
ATOM     84 HD13 LEU A   6      -0.265   8.796   6.793  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -0.592   5.866   5.006  1.00  0.00           H  
ATOM     86 HD22 LEU A   6       0.535   7.182   4.678  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -1.069   7.535   5.319  1.00  0.00           H  
ATOM     88  N   CYS A   7       1.595   5.099   3.797  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.071   5.114   2.418  1.00  0.00           C  
ATOM     90  C   CYS A   7       1.965   3.727   1.790  1.00  0.00           C  
ATOM     91  O   CYS A   7       2.162   3.565   0.587  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.523   5.591   2.373  1.00  0.00           C  
ATOM     93  SG  CYS A   7       4.636   4.163   2.363  1.00  0.00           S  
ATOM     94  H   CYS A   7       0.668   5.347   3.986  1.00  0.00           H  
ATOM     95  HA  CYS A   7       1.464   5.801   1.847  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       3.682   6.176   1.479  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       3.727   6.200   3.242  1.00  0.00           H  
ATOM     98  N   ALA A   8       1.652   2.731   2.612  1.00  0.00           N  
ATOM     99  CA  ALA A   8       1.523   1.363   2.120  1.00  0.00           C  
ATOM    100  C   ALA A   8       0.274   1.222   1.257  1.00  0.00           C  
ATOM    101  O   ALA A   8       0.039   0.130   0.765  1.00  0.00           O  
ATOM    102  CB  ALA A   8       1.449   0.386   3.295  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -0.431   2.205   1.101  1.00  0.00           O  
ATOM    104  H   ALA A   8       1.507   2.918   3.563  1.00  0.00           H  
ATOM    105  HA  ALA A   8       2.390   1.123   1.522  1.00  0.00           H  
ATOM    106  HB1 ALA A   8       0.561  -0.224   3.201  1.00  0.00           H  
ATOM    107  HB2 ALA A   8       1.408   0.939   4.220  1.00  0.00           H  
ATOM    108  HB3 ALA A   8       2.323  -0.248   3.293  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL        5                                                                  
ATOM      1  N   ILE A   1      11.588   3.312   6.569  1.00  0.00           N1+
ATOM      2  CA  ILE A   1      11.490   3.678   5.128  1.00  0.00           C  
ATOM      3  C   ILE A   1      10.293   4.599   4.918  1.00  0.00           C  
ATOM      4  O   ILE A   1       9.501   4.825   5.833  1.00  0.00           O  
ATOM      5  CB  ILE A   1      11.320   2.408   4.291  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      12.207   1.298   4.858  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      11.727   2.695   2.845  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      13.655   1.785   4.928  1.00  0.00           C  
ATOM      9  H1  ILE A   1      10.944   2.520   6.771  1.00  0.00           H  
ATOM     10  H2  ILE A   1      11.324   4.131   7.154  1.00  0.00           H  
ATOM     11  H3  ILE A   1      12.563   3.027   6.791  1.00  0.00           H  
ATOM     12  HA  ILE A   1      12.393   4.189   4.826  1.00  0.00           H  
ATOM     13  HB  ILE A   1      10.286   2.096   4.318  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      11.866   1.036   5.850  1.00  0.00           H  
ATOM     15 HG13 ILE A   1      12.151   0.430   4.217  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      11.822   1.764   2.307  1.00  0.00           H  
ATOM     17 HG22 ILE A   1      12.673   3.215   2.834  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      10.973   3.308   2.373  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      13.823   2.525   4.160  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      14.322   0.949   4.774  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      13.842   2.221   5.898  1.00  0.00           H  
HETATM   22  N   DBU A   2      10.156   5.137   3.692  1.00  0.00           N  
HETATM   23  CA  DBU A   2       9.088   5.984   3.421  1.00  0.00           C  
HETATM   24  CB  DBU A   2       8.982   7.296   3.645  1.00  0.00           C  
HETATM   25  CG  DBU A   2      10.080   8.158   4.272  1.00  0.00           C  
HETATM   26  C   DBU A   2       7.964   5.232   2.804  1.00  0.00           C  
HETATM   27  O   DBU A   2       7.275   5.715   1.905  1.00  0.00           O  
HETATM   28  H   DBU A   2      10.782   4.960   2.958  1.00  0.00           H  
HETATM   29  HB  DBU A   2       8.061   7.777   3.365  1.00  0.00           H  
HETATM   30  HG1 DBU A   2      10.871   8.313   3.553  1.00  0.00           H  
HETATM   31  HG2 DBU A   2      10.479   7.657   5.142  1.00  0.00           H  
HETATM   32  HG3 DBU A   2       9.666   9.111   4.565  1.00  0.00           H  
HETATM   33  N   DAL A   3       7.754   3.998   3.297  1.00  0.00           N  
HETATM   34  CA  DAL A   3       6.669   3.173   2.771  1.00  0.00           C  
HETATM   35  CB  DAL A   3       5.528   4.062   2.277  1.00  0.00           C  
HETATM   36  C   DAL A   3       6.150   2.248   3.865  1.00  0.00           C  
HETATM   37  O   DAL A   3       5.270   1.418   3.634  1.00  0.00           O  
HETATM   38  H   DAL A   3       8.307   3.638   4.014  1.00  0.00           H  
HETATM   39  HA  DAL A   3       7.038   2.580   1.948  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       5.699   4.332   1.245  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       5.491   4.955   2.880  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.718   2.390   5.057  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.324   1.557   6.187  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.006   2.038   6.784  1.00  0.00           C  
ATOM     45  O   ILE A   4       4.654   3.212   6.681  1.00  0.00           O  
ATOM     46  CB  ILE A   4       7.411   1.586   7.264  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       8.323   2.795   7.043  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       8.239   0.304   7.186  1.00  0.00           C  
ATOM     49  CD1 ILE A   4       7.496   4.082   7.118  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.423   3.061   5.175  1.00  0.00           H  
ATOM     51  HA  ILE A   4       6.202   0.540   5.846  1.00  0.00           H  
ATOM     52  HB  ILE A   4       6.948   1.655   8.238  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       9.087   2.814   7.807  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       8.788   2.724   6.071  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       7.581  -0.552   7.218  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       8.922   0.265   8.022  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       8.799   0.293   6.263  1.00  0.00           H  
ATOM     58 HD11 ILE A   4       8.039   4.827   7.680  1.00  0.00           H  
ATOM     59 HD12 ILE A   4       6.556   3.877   7.606  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       7.309   4.449   6.119  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.271   1.113   7.425  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.057   1.462   8.007  1.00  0.00           C  
HETATM   63  CB  DHA A   5       2.603   1.169   9.232  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.225   2.263   7.065  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.446   1.735   6.274  1.00  0.00           O  
HETATM   66  H   DHA A   5       4.551   0.177   7.514  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       3.209   0.587   9.912  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       1.629   1.514   9.546  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.370   3.598   7.138  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.577   4.443   6.251  1.00  0.00           C  
ATOM     71  C   LEU A   6       2.446   5.050   5.152  1.00  0.00           C  
ATOM     72  O   LEU A   6       3.540   5.548   5.415  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.911   5.565   7.054  1.00  0.00           C  
ATOM     74  CG  LEU A   6       1.235   5.399   8.539  1.00  0.00           C  
ATOM     75  CD1 LEU A   6       0.792   6.649   9.303  1.00  0.00           C  
ATOM     76  CD2 LEU A   6       0.491   4.179   9.086  1.00  0.00           C  
ATOM     77  H   LEU A   6       2.988   4.019   7.771  1.00  0.00           H  
ATOM     78  HA  LEU A   6       0.808   3.840   5.794  1.00  0.00           H  
ATOM     79  HB2 LEU A   6       1.276   6.521   6.710  1.00  0.00           H  
ATOM     80  HB3 LEU A   6      -0.159   5.518   6.915  1.00  0.00           H  
ATOM     81  HG  LEU A   6       2.299   5.262   8.663  1.00  0.00           H  
ATOM     82 HD11 LEU A   6       0.195   7.275   8.655  1.00  0.00           H  
ATOM     83 HD12 LEU A   6       1.663   7.197   9.631  1.00  0.00           H  
ATOM     84 HD13 LEU A   6       0.205   6.357  10.162  1.00  0.00           H  
ATOM     85 HD21 LEU A   6       1.114   3.671   9.807  1.00  0.00           H  
ATOM     86 HD22 LEU A   6       0.258   3.507   8.274  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -0.424   4.499   9.562  1.00  0.00           H  
ATOM     88  N   CYS A   7       1.943   5.010   3.923  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.672   5.566   2.789  1.00  0.00           C  
ATOM     90  C   CYS A   7       1.889   6.716   2.174  1.00  0.00           C  
ATOM     91  O   CYS A   7       2.171   7.153   1.059  1.00  0.00           O  
ATOM     92  CB  CYS A   7       2.905   4.485   1.733  1.00  0.00           C  
ATOM     93  SG  CYS A   7       3.954   3.179   2.417  1.00  0.00           S  
ATOM     94  H   CYS A   7       1.064   4.605   3.774  1.00  0.00           H  
ATOM     95  HA  CYS A   7       3.622   5.937   3.132  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       1.955   4.064   1.435  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       3.388   4.922   0.872  1.00  0.00           H  
ATOM     98  N   ALA A   8       0.902   7.197   2.914  1.00  0.00           N  
ATOM     99  CA  ALA A   8       0.068   8.298   2.445  1.00  0.00           C  
ATOM    100  C   ALA A   8       0.274   9.536   3.312  1.00  0.00           C  
ATOM    101  O   ALA A   8       0.052   9.440   4.508  1.00  0.00           O  
ATOM    102  CB  ALA A   8      -1.405   7.889   2.479  1.00  0.00           C  
ATOM    103  OXT ALA A   8       0.651  10.561   2.768  1.00  0.00           O  
ATOM    104  H   ALA A   8       0.730   6.802   3.794  1.00  0.00           H  
ATOM    105  HA  ALA A   8       0.341   8.535   1.427  1.00  0.00           H  
ATOM    106  HB1 ALA A   8      -1.913   8.302   1.620  1.00  0.00           H  
ATOM    107  HB2 ALA A   8      -1.862   8.265   3.382  1.00  0.00           H  
ATOM    108  HB3 ALA A   8      -1.480   6.812   2.458  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL        6                                                                  
ATOM      1  N   ILE A   1      11.303   2.516   2.768  1.00  0.00           N1+
ATOM      2  CA  ILE A   1      11.710   3.025   4.108  1.00  0.00           C  
ATOM      3  C   ILE A   1      10.636   3.968   4.640  1.00  0.00           C  
ATOM      4  O   ILE A   1      10.357   3.993   5.839  1.00  0.00           O  
ATOM      5  CB  ILE A   1      13.042   3.768   3.987  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      13.006   4.676   2.750  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      14.182   2.755   3.856  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      13.580   3.932   1.541  1.00  0.00           C  
ATOM      9  H1  ILE A   1      11.783   1.612   2.581  1.00  0.00           H  
ATOM     10  H2  ILE A   1      11.570   3.209   2.039  1.00  0.00           H  
ATOM     11  H3  ILE A   1      10.275   2.370   2.750  1.00  0.00           H  
ATOM     12  HA  ILE A   1      11.825   2.194   4.787  1.00  0.00           H  
ATOM     13  HB  ILE A   1      13.198   4.369   4.871  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      11.984   4.960   2.545  1.00  0.00           H  
ATOM     15 HG13 ILE A   1      13.595   5.561   2.938  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      15.069   3.257   3.497  1.00  0.00           H  
ATOM     17 HG22 ILE A   1      13.899   1.983   3.155  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      14.383   2.313   4.819  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      14.653   3.859   1.639  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      13.338   4.473   0.638  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      13.154   2.941   1.491  1.00  0.00           H  
HETATM   22  N   DBU A   2      10.025   4.758   3.739  1.00  0.00           N  
HETATM   23  CA  DBU A   2       9.037   5.644   4.153  1.00  0.00           C  
HETATM   24  CB  DBU A   2       9.173   6.791   4.825  1.00  0.00           C  
HETATM   25  CG  DBU A   2      10.513   7.372   5.283  1.00  0.00           C  
HETATM   26  C   DBU A   2       7.688   5.159   3.751  1.00  0.00           C  
HETATM   27  O   DBU A   2       6.841   5.914   3.280  1.00  0.00           O  
HETATM   28  H   DBU A   2      10.242   4.746   2.783  1.00  0.00           H  
HETATM   29  HB  DBU A   2       8.277   7.344   5.059  1.00  0.00           H  
HETATM   30  HG1 DBU A   2      10.367   7.944   6.188  1.00  0.00           H  
HETATM   31  HG2 DBU A   2      10.911   8.014   4.511  1.00  0.00           H  
HETATM   32  HG3 DBU A   2      11.208   6.566   5.474  1.00  0.00           H  
HETATM   33  N   DAL A   3       7.466   3.844   3.939  1.00  0.00           N  
HETATM   34  CA  DAL A   3       6.172   3.253   3.588  1.00  0.00           C  
HETATM   35  CB  DAL A   3       5.043   4.282   3.714  1.00  0.00           C  
HETATM   36  C   DAL A   3       5.865   2.084   4.516  1.00  0.00           C  
HETATM   37  O   DAL A   3       4.755   1.550   4.512  1.00  0.00           O  
HETATM   38  H   DAL A   3       8.157   3.262   4.317  1.00  0.00           H  
HETATM   39  HA  DAL A   3       6.212   2.896   2.569  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       5.302   5.014   4.463  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       4.136   3.777   4.011  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.854   1.692   5.310  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.676   0.585   6.241  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.351   0.722   6.984  1.00  0.00           C  
ATOM     45  O   ILE A   4       4.704  -0.273   7.311  1.00  0.00           O  
ATOM     46  CB  ILE A   4       7.830   0.558   7.243  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       9.159   0.528   6.484  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       7.717  -0.691   8.118  1.00  0.00           C  
ATOM     49  CD1 ILE A   4      10.242  -0.092   7.370  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.717   2.154   5.270  1.00  0.00           H  
ATOM     51  HA  ILE A   4       6.672  -0.342   5.688  1.00  0.00           H  
ATOM     52  HB  ILE A   4       7.789   1.439   7.866  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       9.047  -0.062   5.586  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       9.446   1.535   6.221  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       6.683  -0.848   8.390  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       8.308  -0.559   9.013  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       8.080  -1.548   7.571  1.00  0.00           H  
ATOM     58 HD11 ILE A   4      10.255  -1.162   7.227  1.00  0.00           H  
ATOM     59 HD12 ILE A   4      10.029   0.130   8.406  1.00  0.00           H  
ATOM     60 HD13 ILE A   4      11.204   0.320   7.104  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.939   1.975   7.251  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.739   2.184   7.921  1.00  0.00           C  
HETATM   63  CB  DHA A   5       3.508   2.201   9.241  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.632   2.412   6.952  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.924   1.492   6.544  1.00  0.00           O  
HETATM   66  H   DHA A   5       5.448   2.771   6.990  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       4.319   2.036   9.935  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       2.511   2.380   9.615  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.452   3.682   6.546  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.386   3.978   5.595  1.00  0.00           C  
ATOM     71  C   LEU A   6       1.711   5.241   4.805  1.00  0.00           C  
ATOM     72  O   LEU A   6       1.698   6.347   5.347  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.059   4.164   6.334  1.00  0.00           C  
ATOM     74  CG  LEU A   6      -1.070   3.517   5.530  1.00  0.00           C  
ATOM     75  CD1 LEU A   6      -1.064   4.068   4.101  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -0.865   2.001   5.491  1.00  0.00           C  
ATOM     77  H   LEU A   6       3.017   4.415   6.870  1.00  0.00           H  
ATOM     78  HA  LEU A   6       1.291   3.150   4.909  1.00  0.00           H  
ATOM     79  HB2 LEU A   6       0.121   3.700   7.308  1.00  0.00           H  
ATOM     80  HB3 LEU A   6      -0.143   5.218   6.450  1.00  0.00           H  
ATOM     81  HG  LEU A   6      -2.018   3.743   5.997  1.00  0.00           H  
ATOM     82 HD11 LEU A   6      -0.743   5.099   4.115  1.00  0.00           H  
ATOM     83 HD12 LEU A   6      -2.060   4.007   3.688  1.00  0.00           H  
ATOM     84 HD13 LEU A   6      -0.387   3.487   3.493  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -0.360   1.728   4.575  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -1.824   1.506   5.535  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -0.265   1.698   6.335  1.00  0.00           H  
ATOM     88  N   CYS A   7       2.000   5.068   3.519  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.326   6.201   2.661  1.00  0.00           C  
ATOM     90  C   CYS A   7       1.943   5.901   1.215  1.00  0.00           C  
ATOM     91  O   CYS A   7       1.903   6.798   0.374  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.822   6.511   2.744  1.00  0.00           C  
ATOM     93  SG  CYS A   7       4.772   5.100   2.120  1.00  0.00           S  
ATOM     94  H   CYS A   7       1.995   4.164   3.142  1.00  0.00           H  
ATOM     95  HA  CYS A   7       1.772   7.065   2.997  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       4.041   7.384   2.147  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       4.093   6.703   3.771  1.00  0.00           H  
ATOM     98  N   ALA A   8       1.660   4.633   0.937  1.00  0.00           N  
ATOM     99  CA  ALA A   8       1.279   4.221  -0.409  1.00  0.00           C  
ATOM    100  C   ALA A   8      -0.167   3.732  -0.430  1.00  0.00           C  
ATOM    101  O   ALA A   8      -0.657   3.349   0.619  1.00  0.00           O  
ATOM    102  CB  ALA A   8       2.203   3.103  -0.894  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -0.762   3.750  -1.495  1.00  0.00           O  
ATOM    104  H   ALA A   8       1.707   3.962   1.649  1.00  0.00           H  
ATOM    105  HA  ALA A   8       1.374   5.065  -1.076  1.00  0.00           H  
ATOM    106  HB1 ALA A   8       3.016   3.528  -1.462  1.00  0.00           H  
ATOM    107  HB2 ALA A   8       1.645   2.419  -1.518  1.00  0.00           H  
ATOM    108  HB3 ALA A   8       2.599   2.570  -0.042  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL        7                                                                  
ATOM      1  N   ILE A   1      11.677   4.309   4.237  1.00  0.00           N1+
ATOM      2  CA  ILE A   1      11.023   5.492   4.864  1.00  0.00           C  
ATOM      3  C   ILE A   1       9.686   5.757   4.179  1.00  0.00           C  
ATOM      4  O   ILE A   1       9.626   5.940   2.964  1.00  0.00           O  
ATOM      5  CB  ILE A   1      11.937   6.710   4.717  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      11.181   7.969   5.151  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      12.369   6.854   3.256  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      12.179   9.028   5.621  1.00  0.00           C  
ATOM      9  H1  ILE A   1      12.496   4.619   3.678  1.00  0.00           H  
ATOM     10  H2  ILE A   1      10.994   3.827   3.615  1.00  0.00           H  
ATOM     11  H3  ILE A   1      11.993   3.653   4.979  1.00  0.00           H  
ATOM     12  HA  ILE A   1      10.856   5.295   5.913  1.00  0.00           H  
ATOM     13  HB  ILE A   1      12.811   6.582   5.338  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      10.613   8.354   4.317  1.00  0.00           H  
ATOM     15 HG13 ILE A   1      10.510   7.724   5.962  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      13.421   6.628   3.168  1.00  0.00           H  
ATOM     17 HG22 ILE A   1      12.189   7.866   2.924  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      11.801   6.169   2.643  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      12.700   8.669   6.496  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      11.651   9.938   5.865  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      12.892   9.226   4.834  1.00  0.00           H  
HETATM   22  N   DBU A   2       8.599   5.775   4.971  1.00  0.00           N  
HETATM   23  CA  DBU A   2       7.344   6.010   4.421  1.00  0.00           C  
HETATM   24  CB  DBU A   2       6.762   7.181   4.130  1.00  0.00           C  
HETATM   25  CG  DBU A   2       7.411   8.547   4.363  1.00  0.00           C  
HETATM   26  C   DBU A   2       6.637   4.725   4.159  1.00  0.00           C  
HETATM   27  O   DBU A   2       5.729   4.320   4.886  1.00  0.00           O  
HETATM   28  H   DBU A   2       8.640   5.630   5.938  1.00  0.00           H  
HETATM   29  HB  DBU A   2       5.771   7.160   3.703  1.00  0.00           H  
HETATM   30  HG1 DBU A   2       6.864   9.303   3.819  1.00  0.00           H  
HETATM   31  HG2 DBU A   2       8.435   8.524   4.017  1.00  0.00           H  
HETATM   32  HG3 DBU A   2       7.393   8.779   5.418  1.00  0.00           H  
HETATM   33  N   DAL A   3       7.050   4.035   3.081  1.00  0.00           N  
HETATM   34  CA  DAL A   3       6.403   2.766   2.762  1.00  0.00           C  
HETATM   35  CB  DAL A   3       5.130   3.015   1.953  1.00  0.00           C  
HETATM   36  C   DAL A   3       6.058   2.004   4.038  1.00  0.00           C  
HETATM   37  O   DAL A   3       5.161   1.161   4.044  1.00  0.00           O  
HETATM   38  H   DAL A   3       7.771   4.358   2.504  1.00  0.00           H  
HETATM   39  HA  DAL A   3       7.080   2.168   2.171  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       4.779   2.082   1.537  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       5.342   3.708   1.152  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.775   2.307   5.115  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.534   1.643   6.390  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.212   2.103   6.995  1.00  0.00           C  
ATOM     45  O   ILE A   4       4.921   3.297   7.040  1.00  0.00           O  
ATOM     46  CB  ILE A   4       7.674   1.947   7.363  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       9.016   1.669   6.684  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       7.538   1.060   8.602  1.00  0.00           C  
ATOM     49  CD1 ILE A   4      10.034   2.730   7.110  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.478   2.986   5.051  1.00  0.00           H  
ATOM     51  HA  ILE A   4       6.492   0.576   6.227  1.00  0.00           H  
ATOM     52  HB  ILE A   4       7.626   2.986   7.659  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       9.372   0.692   6.975  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       8.893   1.704   5.612  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       8.298   1.325   9.321  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       7.656   0.024   8.318  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       6.561   1.202   9.041  1.00  0.00           H  
ATOM     58 HD11 ILE A   4      10.968   2.560   6.595  1.00  0.00           H  
ATOM     59 HD12 ILE A   4      10.194   2.666   8.177  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       9.657   3.711   6.861  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.401   1.141   7.470  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.179   1.481   8.040  1.00  0.00           C  
HETATM   63  CB  DHA A   5       2.762   1.291   9.299  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.293   2.135   7.037  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.488   1.494   6.362  1.00  0.00           O  
HETATM   66  H   DHA A   5       4.628   0.188   7.439  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       3.411   0.816  10.020  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       1.775   1.612   9.597  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.424   3.469   6.915  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.584   4.176   5.954  1.00  0.00           C  
ATOM     71  C   LEU A   6       2.436   5.024   5.014  1.00  0.00           C  
ATOM     72  O   LEU A   6       3.560   5.398   5.346  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.592   5.076   6.691  1.00  0.00           C  
ATOM     74  CG  LEU A   6      -0.484   4.217   7.357  1.00  0.00           C  
ATOM     75  CD1 LEU A   6      -1.334   5.091   8.282  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -1.377   3.595   6.281  1.00  0.00           C  
ATOM     77  H   LEU A   6       3.063   3.979   7.454  1.00  0.00           H  
ATOM     78  HA  LEU A   6       1.033   3.453   5.371  1.00  0.00           H  
ATOM     79  HB2 LEU A   6       1.115   5.646   7.445  1.00  0.00           H  
ATOM     80  HB3 LEU A   6       0.127   5.750   5.989  1.00  0.00           H  
ATOM     81  HG  LEU A   6      -0.013   3.434   7.935  1.00  0.00           H  
ATOM     82 HD11 LEU A   6      -2.322   4.665   8.372  1.00  0.00           H  
ATOM     83 HD12 LEU A   6      -1.408   6.087   7.868  1.00  0.00           H  
ATOM     84 HD13 LEU A   6      -0.872   5.139   9.256  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -1.190   2.532   6.229  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -1.156   4.045   5.324  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -2.414   3.766   6.529  1.00  0.00           H  
ATOM     88  N   CYS A   7       1.887   5.326   3.842  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.599   6.136   2.858  1.00  0.00           C  
ATOM     90  C   CYS A   7       1.636   6.635   1.784  1.00  0.00           C  
ATOM     91  O   CYS A   7       1.917   7.615   1.093  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.714   5.316   2.205  1.00  0.00           C  
ATOM     93  SG  CYS A   7       3.854   3.712   3.031  1.00  0.00           S  
ATOM     94  H   CYS A   7       0.985   5.002   3.635  1.00  0.00           H  
ATOM     95  HA  CYS A   7       3.037   6.986   3.357  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       3.485   5.163   1.161  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       4.649   5.849   2.293  1.00  0.00           H  
ATOM     98  N   ALA A   8       0.502   5.955   1.652  1.00  0.00           N  
ATOM     99  CA  ALA A   8      -0.496   6.337   0.659  1.00  0.00           C  
ATOM    100  C   ALA A   8      -1.358   7.483   1.177  1.00  0.00           C  
ATOM    101  O   ALA A   8      -2.088   7.266   2.130  1.00  0.00           O  
ATOM    102  CB  ALA A   8      -1.386   5.138   0.325  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -1.276   8.562   0.614  1.00  0.00           O  
ATOM    104  H   ALA A   8       0.333   5.183   2.231  1.00  0.00           H  
ATOM    105  HA  ALA A   8       0.009   6.657  -0.240  1.00  0.00           H  
ATOM    106  HB1 ALA A   8      -1.887   5.312  -0.616  1.00  0.00           H  
ATOM    107  HB2 ALA A   8      -2.121   5.007   1.105  1.00  0.00           H  
ATOM    108  HB3 ALA A   8      -0.777   4.249   0.250  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL        8                                                                  
ATOM      1  N   ILE A   1       9.337  -2.037   2.904  1.00  0.00           N1+
ATOM      2  CA  ILE A   1      10.583  -1.220   2.858  1.00  0.00           C  
ATOM      3  C   ILE A   1      10.234   0.210   2.460  1.00  0.00           C  
ATOM      4  O   ILE A   1      10.959   1.151   2.786  1.00  0.00           O  
ATOM      5  CB  ILE A   1      11.546  -1.823   1.836  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      12.888  -1.086   1.904  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      10.956  -1.679   0.431  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      14.023  -2.102   2.028  1.00  0.00           C  
ATOM      9  H1  ILE A   1       9.560  -2.992   3.246  1.00  0.00           H  
ATOM     10  H2  ILE A   1       8.926  -2.096   1.950  1.00  0.00           H  
ATOM     11  H3  ILE A   1       8.653  -1.592   3.550  1.00  0.00           H  
ATOM     12  HA  ILE A   1      11.047  -1.219   3.833  1.00  0.00           H  
ATOM     13  HB  ILE A   1      11.697  -2.870   2.057  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      13.023  -0.500   1.006  1.00  0.00           H  
ATOM     15 HG13 ILE A   1      12.897  -0.433   2.765  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      11.446  -0.866  -0.084  1.00  0.00           H  
ATOM     17 HG22 ILE A   1       9.898  -1.474   0.504  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      11.108  -2.596  -0.119  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      14.079  -2.458   3.046  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      14.958  -1.633   1.759  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      13.836  -2.935   1.365  1.00  0.00           H  
HETATM   22  N   DBU A   2       9.108   0.377   1.745  1.00  0.00           N  
HETATM   23  CA  DBU A   2       8.724   1.650   1.344  1.00  0.00           C  
HETATM   24  CB  DBU A   2       8.985   2.280   0.189  1.00  0.00           C  
HETATM   25  CG  DBU A   2       9.799   1.677  -0.958  1.00  0.00           C  
HETATM   26  C   DBU A   2       7.925   2.317   2.409  1.00  0.00           C  
HETATM   27  O   DBU A   2       8.451   2.807   3.407  1.00  0.00           O  
HETATM   28  H   DBU A   2       8.528  -0.367   1.482  1.00  0.00           H  
HETATM   29  HB  DBU A   2       8.596   3.279   0.061  1.00  0.00           H  
HETATM   30  HG1 DBU A   2      10.849   1.878  -0.797  1.00  0.00           H  
HETATM   31  HG2 DBU A   2       9.487   2.119  -1.892  1.00  0.00           H  
HETATM   32  HG3 DBU A   2       9.638   0.610  -0.992  1.00  0.00           H  
HETATM   33  N   DAL A   3       6.595   2.353   2.212  1.00  0.00           N  
HETATM   34  CA  DAL A   3       5.748   2.993   3.212  1.00  0.00           C  
HETATM   35  CB  DAL A   3       6.289   4.385   3.544  1.00  0.00           C  
HETATM   36  C   DAL A   3       5.685   2.156   4.485  1.00  0.00           C  
HETATM   37  O   DAL A   3       4.638   1.605   4.826  1.00  0.00           O  
HETATM   38  H   DAL A   3       6.178   1.963   1.416  1.00  0.00           H  
HETATM   39  HA  DAL A   3       4.750   3.094   2.811  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       6.671   4.846   2.645  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       7.084   4.298   4.269  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.809   2.071   5.189  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.864   1.306   6.430  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.744   1.749   7.367  1.00  0.00           C  
ATOM     45  O   ILE A   4       5.974   2.484   8.329  1.00  0.00           O  
ATOM     46  CB  ILE A   4       8.221   1.508   7.108  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       9.336   1.075   6.152  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       8.290   0.663   8.381  1.00  0.00           C  
ATOM     49  CD1 ILE A   4      10.492   2.074   6.227  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.611   2.536   4.873  1.00  0.00           H  
ATOM     51  HA  ILE A   4       6.738   0.258   6.203  1.00  0.00           H  
ATOM     52  HB  ILE A   4       8.346   2.551   7.361  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       9.688   0.093   6.433  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       8.953   1.044   5.143  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       8.498  -0.365   8.120  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       7.346   0.718   8.902  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       9.077   1.037   9.020  1.00  0.00           H  
ATOM     58 HD11 ILE A   4      10.138   3.055   5.947  1.00  0.00           H  
ATOM     59 HD12 ILE A   4      11.276   1.768   5.552  1.00  0.00           H  
ATOM     60 HD13 ILE A   4      10.875   2.104   7.236  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.510   1.304   7.071  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.425   1.667   7.860  1.00  0.00           C  
HETATM   63  CB  DHA A   5       3.279   1.570   9.188  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.337   2.224   7.007  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.340   1.567   6.708  1.00  0.00           O  
HETATM   66  H   DHA A   5       4.325   0.727   6.301  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       4.076   1.164   9.792  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       2.364   1.898   9.659  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.518   3.484   6.572  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.501   4.090   5.721  1.00  0.00           C  
ATOM     71  C   LEU A   6       2.086   5.267   4.946  1.00  0.00           C  
ATOM     72  O   LEU A   6       2.411   6.304   5.525  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.315   4.567   6.564  1.00  0.00           C  
ATOM     74  CG  LEU A   6      -0.991   4.062   5.948  1.00  0.00           C  
ATOM     75  CD1 LEU A   6      -2.164   4.439   6.854  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -1.183   4.701   4.571  1.00  0.00           C  
ATOM     77  H   LEU A   6       3.315   4.004   6.804  1.00  0.00           H  
ATOM     78  HA  LEU A   6       1.154   3.350   5.016  1.00  0.00           H  
ATOM     79  HB2 LEU A   6       0.412   4.184   7.570  1.00  0.00           H  
ATOM     80  HB3 LEU A   6       0.305   5.646   6.591  1.00  0.00           H  
ATOM     81  HG  LEU A   6      -0.948   2.987   5.846  1.00  0.00           H  
ATOM     82 HD11 LEU A   6      -3.075   4.015   6.459  1.00  0.00           H  
ATOM     83 HD12 LEU A   6      -2.257   5.514   6.894  1.00  0.00           H  
ATOM     84 HD13 LEU A   6      -1.989   4.056   7.849  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -0.228   4.778   4.073  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -1.610   5.685   4.687  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -1.848   4.088   3.980  1.00  0.00           H  
ATOM     88  N   CYS A   7       2.216   5.095   3.635  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.762   6.146   2.783  1.00  0.00           C  
ATOM     90  C   CYS A   7       2.123   6.093   1.399  1.00  0.00           C  
ATOM     91  O   CYS A   7       1.876   7.126   0.777  1.00  0.00           O  
ATOM     92  CB  CYS A   7       4.279   5.980   2.654  1.00  0.00           C  
ATOM     93  SG  CYS A   7       4.958   5.404   4.229  1.00  0.00           S  
ATOM     94  H   CYS A   7       1.939   4.247   3.232  1.00  0.00           H  
ATOM     95  HA  CYS A   7       2.553   7.106   3.230  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       4.498   5.257   1.881  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       4.723   6.930   2.396  1.00  0.00           H  
ATOM     98  N   ALA A   8       1.855   4.880   0.922  1.00  0.00           N  
ATOM     99  CA  ALA A   8       1.241   4.704  -0.389  1.00  0.00           C  
ATOM    100  C   ALA A   8      -0.198   5.208  -0.376  1.00  0.00           C  
ATOM    101  O   ALA A   8      -1.043   4.543  -0.953  1.00  0.00           O  
ATOM    102  CB  ALA A   8       1.262   3.226  -0.784  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -0.435   6.251   0.212  1.00  0.00           O  
ATOM    104  H   ALA A   8       2.072   4.091   1.463  1.00  0.00           H  
ATOM    105  HA  ALA A   8       1.804   5.267  -1.118  1.00  0.00           H  
ATOM    106  HB1 ALA A   8       0.854   3.113  -1.778  1.00  0.00           H  
ATOM    107  HB2 ALA A   8       0.667   2.657  -0.084  1.00  0.00           H  
ATOM    108  HB3 ALA A   8       2.279   2.862  -0.769  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL        9                                                                  
ATOM      1  N   ILE A   1      11.706   1.695   5.190  1.00  0.00           N1+
ATOM      2  CA  ILE A   1      11.383   2.981   5.870  1.00  0.00           C  
ATOM      3  C   ILE A   1      10.297   3.710   5.087  1.00  0.00           C  
ATOM      4  O   ILE A   1      10.129   3.492   3.887  1.00  0.00           O  
ATOM      5  CB  ILE A   1      12.642   3.847   5.942  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      12.418   4.992   6.934  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      12.944   4.424   4.557  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      13.285   4.773   8.175  1.00  0.00           C  
ATOM      9  H1  ILE A   1      10.849   1.314   4.743  1.00  0.00           H  
ATOM     10  H2  ILE A   1      12.066   1.014   5.889  1.00  0.00           H  
ATOM     11  H3  ILE A   1      12.429   1.860   4.461  1.00  0.00           H  
ATOM     12  HA  ILE A   1      11.029   2.778   6.871  1.00  0.00           H  
ATOM     13  HB  ILE A   1      13.476   3.242   6.269  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      12.686   5.930   6.468  1.00  0.00           H  
ATOM     15 HG13 ILE A   1      11.379   5.019   7.225  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      13.974   4.747   4.518  1.00  0.00           H  
ATOM     17 HG22 ILE A   1      12.296   5.267   4.370  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      12.776   3.666   3.807  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      14.294   5.102   7.972  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      13.293   3.722   8.427  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      12.881   5.338   9.002  1.00  0.00           H  
HETATM   22  N   DBU A   2       9.547   4.590   5.774  1.00  0.00           N  
HETATM   23  CA  DBU A   2       8.537   5.295   5.131  1.00  0.00           C  
HETATM   24  CB  DBU A   2       8.537   6.570   4.721  1.00  0.00           C  
HETATM   25  CG  DBU A   2       9.712   7.533   4.898  1.00  0.00           C  
HETATM   26  C   DBU A   2       7.345   4.428   4.917  1.00  0.00           C  
HETATM   27  O   DBU A   2       6.529   4.209   5.811  1.00  0.00           O  
HETATM   28  H   DBU A   2       9.675   4.769   6.729  1.00  0.00           H  
HETATM   29  HB  DBU A   2       7.648   6.944   4.234  1.00  0.00           H  
HETATM   30  HG1 DBU A   2       9.988   7.578   5.942  1.00  0.00           H  
HETATM   31  HG2 DBU A   2       9.426   8.518   4.558  1.00  0.00           H  
HETATM   32  HG3 DBU A   2      10.554   7.183   4.319  1.00  0.00           H  
HETATM   33  N   DAL A   3       7.215   3.899   3.687  1.00  0.00           N  
HETATM   34  CA  DAL A   3       6.072   3.039   3.405  1.00  0.00           C  
HETATM   35  CB  DAL A   3       4.786   3.869   3.383  1.00  0.00           C  
HETATM   36  C   DAL A   3       5.956   1.940   4.457  1.00  0.00           C  
HETATM   37  O   DAL A   3       5.007   1.156   4.449  1.00  0.00           O  
HETATM   38  H   DAL A   3       7.866   4.073   2.974  1.00  0.00           H  
HETATM   39  HA  DAL A   3       6.207   2.582   2.436  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       4.594   4.256   4.372  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       3.961   3.246   3.072  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.927   1.892   5.364  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.924   0.886   6.419  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.535   0.781   7.046  1.00  0.00           C  
ATOM     45  O   ILE A   4       5.097  -0.302   7.433  1.00  0.00           O  
ATOM     46  CB  ILE A   4       7.975   1.246   7.485  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       8.918   0.058   7.691  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       7.297   1.589   8.816  1.00  0.00           C  
ATOM     49  CD1 ILE A   4       8.110  -1.170   8.113  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.658   2.543   5.322  1.00  0.00           H  
ATOM     51  HA  ILE A   4       7.181  -0.070   5.987  1.00  0.00           H  
ATOM     52  HB  ILE A   4       8.545   2.100   7.147  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       9.439  -0.151   6.768  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       9.636   0.297   8.463  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       6.597   2.397   8.667  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       8.046   1.888   9.535  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       6.772   0.721   9.187  1.00  0.00           H  
ATOM     58 HD11 ILE A   4       7.860  -1.754   7.240  1.00  0.00           H  
ATOM     59 HD12 ILE A   4       7.204  -0.852   8.606  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       8.697  -1.771   8.792  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.834   1.925   7.144  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.561   1.915   7.700  1.00  0.00           C  
HETATM   63  CB  DHA A   5       3.192   1.566   8.941  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.549   2.366   6.706  1.00  0.00           C  
HETATM   65  O   DHA A   5       2.003   1.583   5.930  1.00  0.00           O  
HETATM   66  H   DHA A   5       5.178   2.789   6.836  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       3.933   1.240   9.656  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       2.152   1.611   9.230  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.270   3.682   6.705  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.288   4.194   5.757  1.00  0.00           C  
ATOM     71  C   LEU A   6       1.883   5.331   4.933  1.00  0.00           C  
ATOM     72  O   LEU A   6       2.306   6.351   5.477  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.053   4.698   6.505  1.00  0.00           C  
ATOM     74  CG  LEU A   6       0.455   5.145   7.911  1.00  0.00           C  
ATOM     75  CD1 LEU A   6      -0.601   6.104   8.463  1.00  0.00           C  
ATOM     76  CD2 LEU A   6       0.558   3.921   8.824  1.00  0.00           C  
ATOM     77  H   LEU A   6       2.706   4.306   7.323  1.00  0.00           H  
ATOM     78  HA  LEU A   6       0.993   3.397   5.092  1.00  0.00           H  
ATOM     79  HB2 LEU A   6      -0.377   5.532   5.970  1.00  0.00           H  
ATOM     80  HB3 LEU A   6      -0.674   3.903   6.576  1.00  0.00           H  
ATOM     81  HG  LEU A   6       1.410   5.647   7.870  1.00  0.00           H  
ATOM     82 HD11 LEU A   6      -0.654   6.003   9.538  1.00  0.00           H  
ATOM     83 HD12 LEU A   6      -1.563   5.870   8.032  1.00  0.00           H  
ATOM     84 HD13 LEU A   6      -0.332   7.119   8.211  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -0.259   3.928   9.531  1.00  0.00           H  
ATOM     86 HD22 LEU A   6       1.496   3.949   9.359  1.00  0.00           H  
ATOM     87 HD23 LEU A   6       0.510   3.022   8.228  1.00  0.00           H  
ATOM     88  N   CYS A   7       1.911   5.149   3.616  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.454   6.167   2.724  1.00  0.00           C  
ATOM     90  C   CYS A   7       2.349   5.718   1.269  1.00  0.00           C  
ATOM     91  O   CYS A   7       2.674   6.473   0.353  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.919   6.440   3.071  1.00  0.00           C  
ATOM     93  SG  CYS A   7       4.978   5.243   2.219  1.00  0.00           S  
ATOM     94  H   CYS A   7       1.557   4.316   3.238  1.00  0.00           H  
ATOM     95  HA  CYS A   7       1.891   7.079   2.850  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       4.181   7.439   2.756  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       4.060   6.352   4.138  1.00  0.00           H  
ATOM     98  N   ALA A   8       1.894   4.487   1.065  1.00  0.00           N  
ATOM     99  CA  ALA A   8       1.751   3.951  -0.284  1.00  0.00           C  
ATOM    100  C   ALA A   8       0.283   3.928  -0.699  1.00  0.00           C  
ATOM    101  O   ALA A   8      -0.388   4.926  -0.488  1.00  0.00           O  
ATOM    102  CB  ALA A   8       2.322   2.534  -0.345  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -0.148   2.915  -1.223  1.00  0.00           O  
ATOM    104  H   ALA A   8       1.649   3.930   1.834  1.00  0.00           H  
ATOM    105  HA  ALA A   8       2.300   4.578  -0.970  1.00  0.00           H  
ATOM    106  HB1 ALA A   8       1.912   2.017  -1.201  1.00  0.00           H  
ATOM    107  HB2 ALA A   8       2.061   2.000   0.556  1.00  0.00           H  
ATOM    108  HB3 ALA A   8       3.397   2.582  -0.437  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL       10                                                                  
ATOM      1  N   ILE A   1      11.383   0.738   4.301  1.00  0.00           N1+
ATOM      2  CA  ILE A   1      12.027   1.714   5.225  1.00  0.00           C  
ATOM      3  C   ILE A   1      11.215   3.004   5.243  1.00  0.00           C  
ATOM      4  O   ILE A   1      11.544   3.967   4.551  1.00  0.00           O  
ATOM      5  CB  ILE A   1      13.453   1.999   4.748  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      13.907   0.882   3.806  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      14.392   2.062   5.954  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      15.367   1.109   3.406  1.00  0.00           C  
ATOM      9  H1  ILE A   1      11.863  -0.181   4.376  1.00  0.00           H  
ATOM     10  H2  ILE A   1      11.453   1.088   3.323  1.00  0.00           H  
ATOM     11  H3  ILE A   1      10.381   0.625   4.558  1.00  0.00           H  
ATOM     12  HA  ILE A   1      12.059   1.297   6.221  1.00  0.00           H  
ATOM     13  HB  ILE A   1      13.475   2.945   4.226  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      13.815  -0.070   4.308  1.00  0.00           H  
ATOM     15 HG13 ILE A   1      13.290   0.884   2.921  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      14.549   1.066   6.340  1.00  0.00           H  
ATOM     17 HG22 ILE A   1      13.952   2.681   6.721  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      15.339   2.483   5.650  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      15.429   1.244   2.336  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      15.958   0.254   3.696  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      15.745   1.993   3.901  1.00  0.00           H  
HETATM   22  N   DBU A   2      10.137   3.026   6.047  1.00  0.00           N  
HETATM   23  CA  DBU A   2       9.345   4.165   6.117  1.00  0.00           C  
HETATM   24  CB  DBU A   2       9.663   5.377   6.591  1.00  0.00           C  
HETATM   25  CG  DBU A   2      11.031   5.748   7.168  1.00  0.00           C  
HETATM   26  C   DBU A   2       7.986   3.894   5.572  1.00  0.00           C  
HETATM   27  O   DBU A   2       7.003   3.770   6.302  1.00  0.00           O  
HETATM   28  H   DBU A   2       9.870   2.262   6.601  1.00  0.00           H  
HETATM   29  HB  DBU A   2       8.904   6.145   6.560  1.00  0.00           H  
HETATM   30  HG1 DBU A   2      11.676   4.881   7.149  1.00  0.00           H  
HETATM   31  HG2 DBU A   2      10.911   6.084   8.188  1.00  0.00           H  
HETATM   32  HG3 DBU A   2      11.470   6.537   6.578  1.00  0.00           H  
HETATM   33  N   DAL A   3       7.898   3.789   4.234  1.00  0.00           N  
HETATM   34  CA  DAL A   3       6.599   3.521   3.631  1.00  0.00           C  
HETATM   35  CB  DAL A   3       5.727   4.776   3.685  1.00  0.00           C  
HETATM   36  C   DAL A   3       5.900   2.379   4.360  1.00  0.00           C  
HETATM   37  O   DAL A   3       4.693   2.183   4.215  1.00  0.00           O  
HETATM   38  H   DAL A   3       8.680   3.885   3.653  1.00  0.00           H  
HETATM   39  HA  DAL A   3       6.743   3.240   2.598  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       6.357   5.648   3.777  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       5.064   4.719   4.535  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.666   1.629   5.144  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.112   0.508   5.892  1.00  0.00           C  
ATOM     44  C   ILE A   4       4.831   0.923   6.609  1.00  0.00           C  
ATOM     45  O   ILE A   4       3.760   0.371   6.360  1.00  0.00           O  
ATOM     46  CB  ILE A   4       7.133   0.006   6.914  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       8.446  -0.328   6.198  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       6.595  -1.248   7.604  1.00  0.00           C  
ATOM     49  CD1 ILE A   4       8.187  -1.386   5.124  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.623   1.833   5.220  1.00  0.00           H  
ATOM     51  HA  ILE A   4       5.884  -0.294   5.206  1.00  0.00           H  
ATOM     52  HB  ILE A   4       7.310   0.776   7.653  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       8.841   0.566   5.737  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       9.159  -0.710   6.913  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       5.719  -1.599   7.080  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       6.335  -1.014   8.626  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       7.353  -2.018   7.594  1.00  0.00           H  
ATOM     58 HD11 ILE A   4       9.119  -1.866   4.861  1.00  0.00           H  
ATOM     59 HD12 ILE A   4       7.765  -0.915   4.248  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       7.496  -2.124   5.503  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.941   1.912   7.514  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.818   2.347   8.207  1.00  0.00           C  
HETATM   63  CB  DHA A   5       3.692   2.623   9.512  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.658   2.492   7.285  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.806   1.612   7.163  1.00  0.00           O  
HETATM   66  H   DHA A   5       5.790   2.358   7.718  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       4.539   2.516  10.174  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       2.744   2.956   9.907  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.599   3.643   6.591  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.491   3.855   5.667  1.00  0.00           C  
ATOM     71  C   LEU A   6       1.747   5.089   4.808  1.00  0.00           C  
ATOM     72  O   LEU A   6       1.706   6.217   5.297  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.185   4.025   6.450  1.00  0.00           C  
ATOM     74  CG  LEU A   6      -0.984   4.297   5.490  1.00  0.00           C  
ATOM     75  CD1 LEU A   6      -0.960   5.758   5.029  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -0.877   3.379   4.270  1.00  0.00           C  
ATOM     77  H   LEU A   6       3.277   4.343   6.687  1.00  0.00           H  
ATOM     78  HA  LEU A   6       1.407   2.992   5.025  1.00  0.00           H  
ATOM     79  HB2 LEU A   6      -0.015   3.122   7.008  1.00  0.00           H  
ATOM     80  HB3 LEU A   6       0.285   4.852   7.137  1.00  0.00           H  
ATOM     81  HG  LEU A   6      -1.915   4.102   6.003  1.00  0.00           H  
ATOM     82 HD11 LEU A   6      -0.457   5.826   4.076  1.00  0.00           H  
ATOM     83 HD12 LEU A   6      -0.439   6.361   5.756  1.00  0.00           H  
ATOM     84 HD13 LEU A   6      -1.973   6.117   4.925  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -1.816   3.380   3.736  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -0.648   2.374   4.593  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -0.093   3.735   3.617  1.00  0.00           H  
ATOM     88  N   CYS A   7       2.015   4.868   3.525  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.278   5.971   2.608  1.00  0.00           C  
ATOM     90  C   CYS A   7       1.879   5.592   1.185  1.00  0.00           C  
ATOM     91  O   CYS A   7       1.221   6.363   0.489  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.763   6.336   2.643  1.00  0.00           C  
ATOM     93  SG  CYS A   7       4.750   4.897   2.165  1.00  0.00           S  
ATOM     94  H   CYS A   7       2.038   3.947   3.190  1.00  0.00           H  
ATOM     95  HA  CYS A   7       1.700   6.829   2.918  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       3.950   7.147   1.953  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       4.035   6.645   3.642  1.00  0.00           H  
ATOM     98  N   ALA A   8       2.285   4.399   0.761  1.00  0.00           N  
ATOM     99  CA  ALA A   8       1.965   3.928  -0.581  1.00  0.00           C  
ATOM    100  C   ALA A   8       1.359   2.530  -0.529  1.00  0.00           C  
ATOM    101  O   ALA A   8       1.034   2.006  -1.582  1.00  0.00           O  
ATOM    102  CB  ALA A   8       3.229   3.906  -1.442  1.00  0.00           C  
ATOM    103  OXT ALA A   8       1.228   2.003   0.564  1.00  0.00           O  
ATOM    104  H   ALA A   8       2.808   3.827   1.360  1.00  0.00           H  
ATOM    105  HA  ALA A   8       1.251   4.603  -1.029  1.00  0.00           H  
ATOM    106  HB1 ALA A   8       3.393   4.886  -1.867  1.00  0.00           H  
ATOM    107  HB2 ALA A   8       3.112   3.184  -2.237  1.00  0.00           H  
ATOM    108  HB3 ALA A   8       4.077   3.633  -0.830  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL       11                                                                  
ATOM      1  N   ILE A   1      11.679   2.524   6.335  1.00  0.00           N1+
ATOM      2  CA  ILE A   1      11.598   3.779   7.137  1.00  0.00           C  
ATOM      3  C   ILE A   1      10.597   4.730   6.488  1.00  0.00           C  
ATOM      4  O   ILE A   1      10.443   5.872   6.919  1.00  0.00           O  
ATOM      5  CB  ILE A   1      12.980   4.435   7.196  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      13.666   4.307   5.834  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      13.832   3.741   8.260  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      14.828   5.299   5.753  1.00  0.00           C  
ATOM      9  H1  ILE A   1      10.721   2.208   6.089  1.00  0.00           H  
ATOM     10  H2  ILE A   1      12.157   1.787   6.895  1.00  0.00           H  
ATOM     11  H3  ILE A   1      12.217   2.703   5.464  1.00  0.00           H  
ATOM     12  HA  ILE A   1      11.269   3.543   8.139  1.00  0.00           H  
ATOM     13  HB  ILE A   1      12.870   5.480   7.449  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      14.042   3.300   5.715  1.00  0.00           H  
ATOM     15 HG13 ILE A   1      12.956   4.522   5.051  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      13.570   2.695   8.306  1.00  0.00           H  
ATOM     17 HG22 ILE A   1      13.652   4.200   9.221  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      14.876   3.840   8.004  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      15.692   4.884   6.254  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      14.545   6.224   6.232  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      15.068   5.488   4.718  1.00  0.00           H  
HETATM   22  N   DBU A   2       9.907   4.253   5.435  1.00  0.00           N  
HETATM   23  CA  DBU A   2       8.979   5.064   4.790  1.00  0.00           C  
HETATM   24  CB  DBU A   2       9.178   6.245   4.187  1.00  0.00           C  
HETATM   25  CG  DBU A   2      10.534   6.948   4.098  1.00  0.00           C  
HETATM   26  C   DBU A   2       7.621   4.451   4.830  1.00  0.00           C  
HETATM   27  O   DBU A   2       6.926   4.470   5.844  1.00  0.00           O  
HETATM   28  H   DBU A   2      10.025   3.346   5.085  1.00  0.00           H  
HETATM   29  HB  DBU A   2       8.327   6.732   3.737  1.00  0.00           H  
HETATM   30  HG1 DBU A   2      10.391   7.965   3.763  1.00  0.00           H  
HETATM   31  HG2 DBU A   2      11.166   6.424   3.397  1.00  0.00           H  
HETATM   32  HG3 DBU A   2      11.003   6.952   5.071  1.00  0.00           H  
HETATM   33  N   DAL A   3       7.200   3.879   3.686  1.00  0.00           N  
HETATM   34  CA  DAL A   3       5.877   3.260   3.643  1.00  0.00           C  
HETATM   35  CB  DAL A   3       4.805   4.277   4.037  1.00  0.00           C  
HETATM   36  C   DAL A   3       5.804   2.067   4.589  1.00  0.00           C  
HETATM   37  O   DAL A   3       4.809   1.343   4.608  1.00  0.00           O  
HETATM   38  H   DAL A   3       7.754   3.867   2.878  1.00  0.00           H  
HETATM   39  HA  DAL A   3       5.682   2.922   2.637  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       4.846   4.450   5.102  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       3.831   3.892   3.772  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.853   1.869   5.377  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.875   0.761   6.321  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.551   0.706   7.083  1.00  0.00           C  
ATOM     45  O   ILE A   4       5.172  -0.334   7.621  1.00  0.00           O  
ATOM     46  CB  ILE A   4       8.056   0.928   7.293  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       8.903  -0.350   7.288  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       7.551   1.193   8.716  1.00  0.00           C  
ATOM     49  CD1 ILE A   4       8.102  -1.499   7.904  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.618   2.479   5.326  1.00  0.00           H  
ATOM     51  HA  ILE A   4       7.000  -0.161   5.773  1.00  0.00           H  
ATOM     52  HB  ILE A   4       8.665   1.760   6.971  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       9.170  -0.600   6.271  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       9.800  -0.189   7.867  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       8.394   1.335   9.375  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       6.968   0.350   9.054  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       6.937   2.080   8.719  1.00  0.00           H  
ATOM     58 HD11 ILE A   4       8.524  -2.441   7.588  1.00  0.00           H  
ATOM     59 HD12 ILE A   4       7.075  -1.437   7.576  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       8.141  -1.429   8.981  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.837   1.846   7.120  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.619   1.887   7.785  1.00  0.00           C  
HETATM   63  CB  DHA A   5       3.349   1.580   9.062  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.539   2.345   6.866  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.718   1.564   6.383  1.00  0.00           O  
HETATM   66  H   DHA A   5       5.136   2.674   6.688  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       4.140   1.250   9.719  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       2.341   1.662   9.438  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.517   3.663   6.591  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.490   4.179   5.694  1.00  0.00           C  
ATOM     71  C   LEU A   6       2.054   5.292   4.817  1.00  0.00           C  
ATOM     72  O   LEU A   6       2.574   6.290   5.319  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.306   4.719   6.503  1.00  0.00           C  
ATOM     74  CG  LEU A   6      -0.768   3.634   6.634  1.00  0.00           C  
ATOM     75  CD1 LEU A   6      -1.763   4.025   7.730  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -1.514   3.488   5.303  1.00  0.00           C  
ATOM     77  H   LEU A   6       3.171   4.284   6.974  1.00  0.00           H  
ATOM     78  HA  LEU A   6       1.143   3.378   5.062  1.00  0.00           H  
ATOM     79  HB2 LEU A   6       0.648   5.009   7.486  1.00  0.00           H  
ATOM     80  HB3 LEU A   6      -0.111   5.578   6.000  1.00  0.00           H  
ATOM     81  HG  LEU A   6      -0.300   2.696   6.891  1.00  0.00           H  
ATOM     82 HD11 LEU A   6      -1.933   3.179   8.379  1.00  0.00           H  
ATOM     83 HD12 LEU A   6      -2.698   4.322   7.276  1.00  0.00           H  
ATOM     84 HD13 LEU A   6      -1.366   4.846   8.305  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -2.470   3.017   5.478  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -0.933   2.881   4.628  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -1.669   4.465   4.868  1.00  0.00           H  
ATOM     88  N   CYS A   7       1.942   5.117   3.504  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.438   6.113   2.561  1.00  0.00           C  
ATOM     90  C   CYS A   7       1.418   6.343   1.453  1.00  0.00           C  
ATOM     91  O   CYS A   7       1.080   7.482   1.132  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.762   5.651   1.948  1.00  0.00           C  
ATOM     93  SG  CYS A   7       5.092   5.834   3.162  1.00  0.00           S  
ATOM     94  H   CYS A   7       1.513   4.303   3.161  1.00  0.00           H  
ATOM     95  HA  CYS A   7       2.602   7.042   3.087  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       3.682   4.614   1.656  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       3.985   6.252   1.079  1.00  0.00           H  
ATOM     98  N   ALA A   8       0.929   5.251   0.874  1.00  0.00           N  
ATOM     99  CA  ALA A   8      -0.056   5.344  -0.199  1.00  0.00           C  
ATOM    100  C   ALA A   8      -1.399   5.822   0.345  1.00  0.00           C  
ATOM    101  O   ALA A   8      -2.091   6.523  -0.374  1.00  0.00           O  
ATOM    102  CB  ALA A   8      -0.231   3.980  -0.870  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -1.716   5.477   1.472  1.00  0.00           O  
ATOM    104  H   ALA A   8       1.235   4.369   1.173  1.00  0.00           H  
ATOM    105  HA  ALA A   8       0.295   6.052  -0.935  1.00  0.00           H  
ATOM    106  HB1 ALA A   8      -0.988   3.415  -0.346  1.00  0.00           H  
ATOM    107  HB2 ALA A   8       0.705   3.442  -0.843  1.00  0.00           H  
ATOM    108  HB3 ALA A   8      -0.535   4.122  -1.897  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL       12                                                                  
ATOM      1  N   ILE A   1      10.767   4.456   5.832  1.00  0.00           N1+
ATOM      2  CA  ILE A   1      10.261   5.493   6.775  1.00  0.00           C  
ATOM      3  C   ILE A   1       8.748   5.359   6.910  1.00  0.00           C  
ATOM      4  O   ILE A   1       8.250   4.743   7.854  1.00  0.00           O  
ATOM      5  CB  ILE A   1      10.616   6.882   6.239  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      12.012   6.844   5.613  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      10.599   7.893   7.387  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      12.601   8.256   5.595  1.00  0.00           C  
ATOM      9  H1  ILE A   1      10.001   4.164   5.194  1.00  0.00           H  
ATOM     10  H2  ILE A   1      11.103   3.633   6.372  1.00  0.00           H  
ATOM     11  H3  ILE A   1      11.550   4.848   5.273  1.00  0.00           H  
ATOM     12  HA  ILE A   1      10.721   5.353   7.741  1.00  0.00           H  
ATOM     13  HB  ILE A   1       9.892   7.175   5.492  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      12.649   6.194   6.195  1.00  0.00           H  
ATOM     15 HG13 ILE A   1      11.943   6.471   4.602  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      11.574   7.928   7.849  1.00  0.00           H  
ATOM     17 HG22 ILE A   1       9.864   7.593   8.120  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      10.347   8.869   7.001  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      12.913   8.529   6.592  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      11.853   8.954   5.248  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      13.452   8.282   4.931  1.00  0.00           H  
HETATM   22  N   DBU A   2       8.005   5.941   5.954  1.00  0.00           N  
HETATM   23  CA  DBU A   2       6.619   5.863   6.007  1.00  0.00           C  
HETATM   24  CB  DBU A   2       5.754   6.701   6.593  1.00  0.00           C  
HETATM   25  CG  DBU A   2       6.160   7.966   7.354  1.00  0.00           C  
HETATM   26  C   DBU A   2       6.134   4.653   5.286  1.00  0.00           C  
HETATM   27  O   DBU A   2       5.319   3.878   5.787  1.00  0.00           O  
HETATM   28  H   DBU A   2       8.395   6.432   5.200  1.00  0.00           H  
HETATM   29  HB  DBU A   2       4.702   6.469   6.525  1.00  0.00           H  
HETATM   30  HG1 DBU A   2       6.095   7.784   8.416  1.00  0.00           H  
HETATM   31  HG2 DBU A   2       5.497   8.775   7.085  1.00  0.00           H  
HETATM   32  HG3 DBU A   2       7.175   8.231   7.095  1.00  0.00           H  
HETATM   33  N   DAL A   3       6.641   4.457   4.056  1.00  0.00           N  
HETATM   34  CA  DAL A   3       6.213   3.293   3.290  1.00  0.00           C  
HETATM   35  CB  DAL A   3       4.921   3.610   2.533  1.00  0.00           C  
HETATM   36  C   DAL A   3       5.983   2.099   4.212  1.00  0.00           C  
HETATM   37  O   DAL A   3       5.112   1.267   3.959  1.00  0.00           O  
HETATM   38  H   DAL A   3       7.290   5.075   3.658  1.00  0.00           H  
HETATM   39  HA  DAL A   3       6.981   3.040   2.576  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       4.089   3.601   3.221  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       4.762   2.868   1.765  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.768   2.023   5.280  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.642   0.926   6.231  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.214   0.835   6.764  1.00  0.00           C  
ATOM     45  O   ILE A   4       4.525  -0.162   6.553  1.00  0.00           O  
ATOM     46  CB  ILE A   4       7.610   1.131   7.397  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       9.039   1.238   6.860  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       7.513  -0.057   8.356  1.00  0.00           C  
ATOM     49  CD1 ILE A   4       9.980   1.647   7.994  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.446   2.715   5.430  1.00  0.00           H  
ATOM     51  HA  ILE A   4       6.889   0.001   5.733  1.00  0.00           H  
ATOM     52  HB  ILE A   4       7.351   2.039   7.923  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       9.346   0.281   6.462  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       9.075   1.981   6.078  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       8.414  -0.648   8.288  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       6.661  -0.667   8.090  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       7.396   0.305   9.366  1.00  0.00           H  
ATOM     58 HD11 ILE A   4      10.942   1.919   7.582  1.00  0.00           H  
ATOM     59 HD12 ILE A   4      10.102   0.819   8.677  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       9.563   2.491   8.520  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.767   1.890   7.469  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.479   1.880   7.990  1.00  0.00           C  
HETATM   63  CB  DHA A   5       3.078   1.537   9.223  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.490   2.323   6.969  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.827   1.520   6.312  1.00  0.00           O  
HETATM   66  H   DHA A   5       5.311   2.686   7.643  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       3.802   1.216   9.958  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       2.032   1.580   9.486  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.363   3.652   6.807  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.412   4.157   5.824  1.00  0.00           C  
ATOM     71  C   LEU A   6       2.065   5.208   4.933  1.00  0.00           C  
ATOM     72  O   LEU A   6       2.641   6.180   5.423  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.201   4.768   6.535  1.00  0.00           C  
ATOM     74  CG  LEU A   6       0.658   5.464   7.818  1.00  0.00           C  
ATOM     75  CD1 LEU A   6      -0.193   6.713   8.052  1.00  0.00           C  
ATOM     76  CD2 LEU A   6       0.495   4.509   9.001  1.00  0.00           C  
ATOM     77  H   LEU A   6       2.890   4.292   7.331  1.00  0.00           H  
ATOM     78  HA  LEU A   6       1.076   3.336   5.209  1.00  0.00           H  
ATOM     79  HB2 LEU A   6      -0.273   5.488   5.882  1.00  0.00           H  
ATOM     80  HB3 LEU A   6      -0.503   3.988   6.782  1.00  0.00           H  
ATOM     81  HG  LEU A   6       1.696   5.749   7.721  1.00  0.00           H  
ATOM     82 HD11 LEU A   6      -1.180   6.558   7.645  1.00  0.00           H  
ATOM     83 HD12 LEU A   6       0.268   7.559   7.565  1.00  0.00           H  
ATOM     84 HD13 LEU A   6      -0.266   6.904   9.112  1.00  0.00           H  
ATOM     85 HD21 LEU A   6       1.027   3.591   8.799  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -0.553   4.292   9.148  1.00  0.00           H  
ATOM     87 HD23 LEU A   6       0.896   4.968   9.892  1.00  0.00           H  
ATOM     88  N   CYS A   7       1.970   5.007   3.622  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.554   5.945   2.671  1.00  0.00           C  
ATOM     90  C   CYS A   7       2.376   5.440   1.241  1.00  0.00           C  
ATOM     91  O   CYS A   7       3.022   5.930   0.314  1.00  0.00           O  
ATOM     92  CB  CYS A   7       4.044   6.143   2.979  1.00  0.00           C  
ATOM     93  SG  CYS A   7       5.055   5.246   1.772  1.00  0.00           S  
ATOM     94  H   CYS A   7       1.498   4.216   3.289  1.00  0.00           H  
ATOM     95  HA  CYS A   7       2.052   6.897   2.768  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       4.283   7.195   2.934  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       4.256   5.771   3.971  1.00  0.00           H  
ATOM     98  N   ALA A   8       1.496   4.458   1.070  1.00  0.00           N  
ATOM     99  CA  ALA A   8       1.241   3.894  -0.252  1.00  0.00           C  
ATOM    100  C   ALA A   8       1.427   4.953  -1.334  1.00  0.00           C  
ATOM    101  O   ALA A   8       0.631   5.877  -1.373  1.00  0.00           O  
ATOM    102  CB  ALA A   8      -0.184   3.341  -0.318  1.00  0.00           C  
ATOM    103  OXT ALA A   8       2.361   4.825  -2.108  1.00  0.00           O  
ATOM    104  H   ALA A   8       1.011   4.106   1.845  1.00  0.00           H  
ATOM    105  HA  ALA A   8       1.936   3.087  -0.428  1.00  0.00           H  
ATOM    106  HB1 ALA A   8      -0.886   4.160  -0.335  1.00  0.00           H  
ATOM    107  HB2 ALA A   8      -0.371   2.724   0.549  1.00  0.00           H  
ATOM    108  HB3 ALA A   8      -0.298   2.749  -1.213  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL       13                                                                  
ATOM      1  N   ILE A   1       9.779   4.153   9.227  1.00  0.00           N1+
ATOM      2  CA  ILE A   1       8.313   4.409   9.171  1.00  0.00           C  
ATOM      3  C   ILE A   1       7.932   4.851   7.762  1.00  0.00           C  
ATOM      4  O   ILE A   1       8.768   4.868   6.859  1.00  0.00           O  
ATOM      5  CB  ILE A   1       7.949   5.504  10.176  1.00  0.00           C  
ATOM      6  CG1 ILE A   1       8.589   5.188  11.530  1.00  0.00           C  
ATOM      7  CG2 ILE A   1       6.429   5.565  10.333  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      10.095   5.466  11.467  1.00  0.00           C  
ATOM      9  H1  ILE A   1      10.074   3.636   8.375  1.00  0.00           H  
ATOM     10  H2  ILE A   1      10.000   3.586  10.071  1.00  0.00           H  
ATOM     11  H3  ILE A   1      10.288   5.058   9.273  1.00  0.00           H  
ATOM     12  HA  ILE A   1       7.781   3.503   9.419  1.00  0.00           H  
ATOM     13  HB  ILE A   1       8.310   6.456   9.816  1.00  0.00           H  
ATOM     14 HG12 ILE A   1       8.141   5.809  12.293  1.00  0.00           H  
ATOM     15 HG13 ILE A   1       8.427   4.148  11.771  1.00  0.00           H  
ATOM     16 HG21 ILE A   1       6.051   6.444   9.831  1.00  0.00           H  
ATOM     17 HG22 ILE A   1       6.177   5.614  11.382  1.00  0.00           H  
ATOM     18 HG23 ILE A   1       5.986   4.683   9.897  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      10.413   5.937  12.386  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      10.308   6.120  10.634  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      10.627   4.535  11.339  1.00  0.00           H  
HETATM   22  N   DBU A   2       6.652   5.214   7.568  1.00  0.00           N  
HETATM   23  CA  DBU A   2       6.232   5.627   6.309  1.00  0.00           C  
HETATM   24  CB  DBU A   2       6.017   6.873   5.865  1.00  0.00           C  
HETATM   25  CG  DBU A   2       6.200   8.135   6.711  1.00  0.00           C  
HETATM   26  C   DBU A   2       6.030   4.456   5.413  1.00  0.00           C  
HETATM   27  O   DBU A   2       5.191   3.587   5.652  1.00  0.00           O  
HETATM   28  H   DBU A   2       5.980   5.203   8.281  1.00  0.00           H  
HETATM   29  HB  DBU A   2       5.690   6.993   4.843  1.00  0.00           H  
HETATM   30  HG1 DBU A   2       6.153   9.006   6.073  1.00  0.00           H  
HETATM   31  HG2 DBU A   2       7.161   8.101   7.203  1.00  0.00           H  
HETATM   32  HG3 DBU A   2       5.418   8.188   7.452  1.00  0.00           H  
HETATM   33  N   DAL A   3       6.825   4.404   4.330  1.00  0.00           N  
HETATM   34  CA  DAL A   3       6.695   3.287   3.402  1.00  0.00           C  
HETATM   35  CB  DAL A   3       5.553   3.549   2.418  1.00  0.00           C  
HETATM   36  C   DAL A   3       6.448   1.984   4.158  1.00  0.00           C  
HETATM   37  O   DAL A   3       5.914   1.023   3.602  1.00  0.00           O  
HETATM   38  H   DAL A   3       7.494   5.096   4.145  1.00  0.00           H  
HETATM   39  HA  DAL A   3       7.616   3.192   2.844  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       5.404   2.675   1.800  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       5.812   4.389   1.792  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.848   1.960   5.425  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.676   0.768   6.251  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.244   0.667   6.768  1.00  0.00           C  
ATOM     45  O   ILE A   4       4.665  -0.417   6.808  1.00  0.00           O  
ATOM     46  CB  ILE A   4       7.644   0.811   7.436  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       9.055   0.450   6.960  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       7.195  -0.190   8.503  1.00  0.00           C  
ATOM     49  CD1 ILE A   4       9.183  -1.070   6.826  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.272   2.754   5.809  1.00  0.00           H  
ATOM     51  HA  ILE A   4       6.894  -0.104   5.654  1.00  0.00           H  
ATOM     52  HB  ILE A   4       7.649   1.806   7.858  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       9.241   0.914   6.003  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       9.779   0.807   7.679  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       8.060  -0.591   9.008  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       6.645  -0.993   8.036  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       6.560   0.311   9.220  1.00  0.00           H  
ATOM     58 HD11 ILE A   4       9.777  -1.305   5.957  1.00  0.00           H  
ATOM     59 HD12 ILE A   4       8.202  -1.508   6.720  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       9.662  -1.469   7.707  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.666   1.810   7.177  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.366   1.789   7.665  1.00  0.00           C  
HETATM   63  CB  DHA A   5       2.905   1.221   8.787  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.444   2.517   6.751  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.841   1.945   5.842  1.00  0.00           O  
HETATM   66  H   DHA A   5       5.121   2.678   7.153  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       3.580   0.694   9.445  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       1.857   1.288   9.039  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.306   3.836   6.978  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.414   4.611   6.121  1.00  0.00           C  
ATOM     71  C   LEU A   6       2.177   5.201   4.940  1.00  0.00           C  
ATOM     72  O   LEU A   6       3.316   5.645   5.085  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.765   5.738   6.926  1.00  0.00           C  
ATOM     74  CG  LEU A   6      -0.184   5.142   7.966  1.00  0.00           C  
ATOM     75  CD1 LEU A   6       0.628   4.498   9.089  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -1.067   6.249   8.546  1.00  0.00           C  
ATOM     77  H   LEU A   6       2.783   4.292   7.702  1.00  0.00           H  
ATOM     78  HA  LEU A   6       0.637   3.961   5.746  1.00  0.00           H  
ATOM     79  HB2 LEU A   6       1.534   6.311   7.425  1.00  0.00           H  
ATOM     80  HB3 LEU A   6       0.210   6.383   6.261  1.00  0.00           H  
ATOM     81  HG  LEU A   6      -0.806   4.392   7.496  1.00  0.00           H  
ATOM     82 HD11 LEU A   6       0.893   3.489   8.811  1.00  0.00           H  
ATOM     83 HD12 LEU A   6       0.039   4.479   9.995  1.00  0.00           H  
ATOM     84 HD13 LEU A   6       1.527   5.072   9.258  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -1.639   5.856   9.374  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -1.740   6.609   7.782  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -0.445   7.061   8.891  1.00  0.00           H  
ATOM     88  N   CYS A   7       1.535   5.205   3.777  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.148   5.746   2.566  1.00  0.00           C  
ATOM     90  C   CYS A   7       1.554   5.085   1.328  1.00  0.00           C  
ATOM     91  O   CYS A   7       1.087   5.762   0.413  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.660   5.520   2.582  1.00  0.00           C  
ATOM     93  SG  CYS A   7       4.029   3.910   3.332  1.00  0.00           S  
ATOM     94  H   CYS A   7       0.628   4.839   3.730  1.00  0.00           H  
ATOM     95  HA  CYS A   7       1.955   6.807   2.521  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       4.029   5.541   1.568  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       4.136   6.303   3.153  1.00  0.00           H  
ATOM     98  N   ALA A   8       1.579   3.757   1.305  1.00  0.00           N  
ATOM     99  CA  ALA A   8       1.042   3.010   0.175  1.00  0.00           C  
ATOM    100  C   ALA A   8      -0.374   3.473  -0.152  1.00  0.00           C  
ATOM    101  O   ALA A   8      -0.590   3.906  -1.271  1.00  0.00           O  
ATOM    102  CB  ALA A   8       1.032   1.516   0.500  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -1.220   3.390   0.723  1.00  0.00           O  
ATOM    104  H   ALA A   8       1.965   3.271   2.064  1.00  0.00           H  
ATOM    105  HA  ALA A   8       1.673   3.174  -0.686  1.00  0.00           H  
ATOM    106  HB1 ALA A   8       2.041   1.131   0.460  1.00  0.00           H  
ATOM    107  HB2 ALA A   8       0.419   0.993  -0.220  1.00  0.00           H  
ATOM    108  HB3 ALA A   8       0.629   1.366   1.492  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL       14                                                                  
ATOM      1  N   ILE A   1       9.603   6.198   6.891  1.00  0.00           N1+
ATOM      2  CA  ILE A   1       8.727   7.254   6.310  1.00  0.00           C  
ATOM      3  C   ILE A   1       8.332   6.859   4.891  1.00  0.00           C  
ATOM      4  O   ILE A   1       7.378   7.396   4.328  1.00  0.00           O  
ATOM      5  CB  ILE A   1       9.483   8.583   6.290  1.00  0.00           C  
ATOM      6  CG1 ILE A   1       8.524   9.708   5.855  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      10.665   8.477   5.321  1.00  0.00           C  
ATOM      8  CD1 ILE A   1       9.012  10.364   4.558  1.00  0.00           C  
ATOM      9  H1  ILE A   1      10.285   5.878   6.174  1.00  0.00           H  
ATOM     10  H2  ILE A   1       9.018   5.393   7.198  1.00  0.00           H  
ATOM     11  H3  ILE A   1      10.118   6.583   7.707  1.00  0.00           H  
ATOM     12  HA  ILE A   1       7.838   7.356   6.914  1.00  0.00           H  
ATOM     13  HB  ILE A   1       9.856   8.794   7.283  1.00  0.00           H  
ATOM     14 HG12 ILE A   1       7.538   9.295   5.695  1.00  0.00           H  
ATOM     15 HG13 ILE A   1       8.474  10.454   6.634  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      10.300   8.237   4.333  1.00  0.00           H  
ATOM     17 HG22 ILE A   1      11.336   7.700   5.655  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      11.192   9.420   5.290  1.00  0.00           H  
ATOM     19 HD11 ILE A   1       9.996  10.779   4.714  1.00  0.00           H  
ATOM     20 HD12 ILE A   1       8.329  11.151   4.274  1.00  0.00           H  
ATOM     21 HD13 ILE A   1       9.053   9.623   3.773  1.00  0.00           H  
HETATM   22  N   DBU A   2       9.077   5.907   4.304  1.00  0.00           N  
HETATM   23  CA  DBU A   2       8.780   5.492   3.012  1.00  0.00           C  
HETATM   24  CB  DBU A   2       9.532   5.588   1.908  1.00  0.00           C  
HETATM   25  CG  DBU A   2      10.932   6.205   1.869  1.00  0.00           C  
HETATM   26  C   DBU A   2       7.425   4.877   2.959  1.00  0.00           C  
HETATM   27  O   DBU A   2       6.436   5.527   2.630  1.00  0.00           O  
HETATM   28  H   DBU A   2       9.838   5.475   4.746  1.00  0.00           H  
HETATM   29  HB  DBU A   2       9.124   5.204   0.984  1.00  0.00           H  
HETATM   30  HG1 DBU A   2      11.636   5.476   1.497  1.00  0.00           H  
HETATM   31  HG2 DBU A   2      11.220   6.507   2.866  1.00  0.00           H  
HETATM   32  HG3 DBU A   2      10.928   7.067   1.219  1.00  0.00           H  
HETATM   33  N   DAL A   3       7.362   3.570   3.292  1.00  0.00           N  
HETATM   34  CA  DAL A   3       6.077   2.864   3.277  1.00  0.00           C  
HETATM   35  CB  DAL A   3       4.913   3.826   3.543  1.00  0.00           C  
HETATM   36  C   DAL A   3       6.063   1.777   4.346  1.00  0.00           C  
HETATM   37  O   DAL A   3       5.339   0.789   4.229  1.00  0.00           O  
HETATM   38  H   DAL A   3       8.165   3.070   3.550  1.00  0.00           H  
HETATM   39  HA  DAL A   3       5.939   2.407   2.309  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       5.250   4.635   4.168  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       4.123   3.292   4.052  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.866   1.967   5.389  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.934   0.994   6.473  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.581   0.873   7.166  1.00  0.00           C  
ATOM     45  O   ILE A   4       5.239  -0.178   7.708  1.00  0.00           O  
ATOM     46  CB  ILE A   4       7.995   1.413   7.492  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       8.162   2.934   7.459  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       9.328   0.748   7.144  1.00  0.00           C  
ATOM     49  CD1 ILE A   4       8.516   3.438   8.860  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.420   2.775   5.431  1.00  0.00           H  
ATOM     51  HA  ILE A   4       7.204   0.032   6.064  1.00  0.00           H  
ATOM     52  HB  ILE A   4       7.686   1.104   8.480  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       8.954   3.195   6.772  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       7.239   3.392   7.137  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       9.360   0.538   6.085  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       9.424  -0.175   7.697  1.00  0.00           H  
ATOM     57 HG23 ILE A   4      10.140   1.411   7.406  1.00  0.00           H  
ATOM     58 HD11 ILE A   4       9.368   2.890   9.235  1.00  0.00           H  
ATOM     59 HD12 ILE A   4       7.674   3.289   9.520  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       8.755   4.490   8.815  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.797   1.966   7.149  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.549   1.936   7.758  1.00  0.00           C  
HETATM   63  CB  DHA A   5       3.242   1.621   9.023  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.484   2.319   6.790  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.807   1.477   6.199  1.00  0.00           O  
HETATM   66  H   DHA A   5       5.063   2.806   6.719  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       4.021   1.345   9.718  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       2.214   1.643   9.354  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.305   3.638   6.601  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.278   4.083   5.666  1.00  0.00           C  
ATOM     71  C   LEU A   6       1.730   5.340   4.929  1.00  0.00           C  
ATOM     72  O   LEU A   6       1.809   6.420   5.515  1.00  0.00           O  
ATOM     73  CB  LEU A   6      -0.026   4.369   6.416  1.00  0.00           C  
ATOM     74  CG  LEU A   6       0.186   4.143   7.914  1.00  0.00           C  
ATOM     75  CD1 LEU A   6       1.183   5.173   8.454  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -1.152   4.296   8.643  1.00  0.00           C  
ATOM     77  H   LEU A   6       2.843   4.309   7.071  1.00  0.00           H  
ATOM     78  HA  LEU A   6       1.099   3.300   4.945  1.00  0.00           H  
ATOM     79  HB2 LEU A   6      -0.324   5.393   6.244  1.00  0.00           H  
ATOM     80  HB3 LEU A   6      -0.798   3.704   6.060  1.00  0.00           H  
ATOM     81  HG  LEU A   6       0.574   3.148   8.076  1.00  0.00           H  
ATOM     82 HD11 LEU A   6       2.022   4.660   8.902  1.00  0.00           H  
ATOM     83 HD12 LEU A   6       0.699   5.789   9.198  1.00  0.00           H  
ATOM     84 HD13 LEU A   6       1.533   5.795   7.644  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -1.870   3.605   8.226  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -1.513   5.307   8.523  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -1.016   4.084   9.693  1.00  0.00           H  
ATOM     88  N   CYS A   7       2.022   5.192   3.641  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.461   6.324   2.831  1.00  0.00           C  
ATOM     90  C   CYS A   7       1.639   6.413   1.550  1.00  0.00           C  
ATOM     91  O   CYS A   7       1.273   7.503   1.109  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.941   6.177   2.475  1.00  0.00           C  
ATOM     93  SG  CYS A   7       4.281   4.468   1.966  1.00  0.00           S  
ATOM     94  H   CYS A   7       1.938   4.308   3.227  1.00  0.00           H  
ATOM     95  HA  CYS A   7       2.327   7.233   3.398  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       4.178   6.845   1.659  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       4.544   6.434   3.330  1.00  0.00           H  
ATOM     98  N   ALA A   8       1.354   5.259   0.957  1.00  0.00           N  
ATOM     99  CA  ALA A   8       0.576   5.215  -0.275  1.00  0.00           C  
ATOM    100  C   ALA A   8      -0.821   4.663  -0.008  1.00  0.00           C  
ATOM    101  O   ALA A   8      -1.339   4.911   1.068  1.00  0.00           O  
ATOM    102  CB  ALA A   8       1.285   4.335  -1.306  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -1.353   4.001  -0.885  1.00  0.00           O  
ATOM    104  H   ALA A   8       1.673   4.422   1.354  1.00  0.00           H  
ATOM    105  HA  ALA A   8       0.489   6.215  -0.672  1.00  0.00           H  
ATOM    106  HB1 ALA A   8       1.694   3.465  -0.815  1.00  0.00           H  
ATOM    107  HB2 ALA A   8       2.083   4.896  -1.770  1.00  0.00           H  
ATOM    108  HB3 ALA A   8       0.578   4.023  -2.061  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
MODEL       15                                                                  
ATOM      1  N   ILE A   1      10.873   4.168   6.392  1.00  0.00           N1+
ATOM      2  CA  ILE A   1      10.126   5.297   7.014  1.00  0.00           C  
ATOM      3  C   ILE A   1       9.001   5.733   6.080  1.00  0.00           C  
ATOM      4  O   ILE A   1       9.126   5.650   4.859  1.00  0.00           O  
ATOM      5  CB  ILE A   1      11.088   6.461   7.265  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      10.516   7.370   8.357  1.00  0.00           C  
ATOM      7  CG2 ILE A   1      11.267   7.263   5.975  1.00  0.00           C  
ATOM      8  CD1 ILE A   1      11.244   7.105   9.676  1.00  0.00           C  
ATOM      9  H1  ILE A   1      11.822   4.488   6.117  1.00  0.00           H  
ATOM     10  H2  ILE A   1      10.359   3.836   5.549  1.00  0.00           H  
ATOM     11  H3  ILE A   1      10.957   3.389   7.076  1.00  0.00           H  
ATOM     12  HA  ILE A   1       9.705   4.972   7.955  1.00  0.00           H  
ATOM     13  HB  ILE A   1      12.046   6.073   7.582  1.00  0.00           H  
ATOM     14 HG12 ILE A   1      10.651   8.403   8.071  1.00  0.00           H  
ATOM     15 HG13 ILE A   1       9.463   7.165   8.482  1.00  0.00           H  
ATOM     16 HG21 ILE A   1      11.362   6.585   5.140  1.00  0.00           H  
ATOM     17 HG22 ILE A   1      12.157   7.869   6.050  1.00  0.00           H  
ATOM     18 HG23 ILE A   1      10.408   7.901   5.825  1.00  0.00           H  
ATOM     19 HD11 ILE A   1      10.805   7.706  10.458  1.00  0.00           H  
ATOM     20 HD12 ILE A   1      12.289   7.362   9.569  1.00  0.00           H  
ATOM     21 HD13 ILE A   1      11.156   6.058   9.933  1.00  0.00           H  
HETATM   22  N   DBU A   2       7.881   6.194   6.664  1.00  0.00           N  
HETATM   23  CA  DBU A   2       6.804   6.603   5.885  1.00  0.00           C  
HETATM   24  CB  DBU A   2       5.945   7.602   6.104  1.00  0.00           C  
HETATM   25  CG  DBU A   2       5.992   8.537   7.313  1.00  0.00           C  
HETATM   26  C   DBU A   2       6.669   5.746   4.676  1.00  0.00           C  
HETATM   27  O   DBU A   2       6.335   6.209   3.587  1.00  0.00           O  
HETATM   28  H   DBU A   2       7.774   6.255   7.636  1.00  0.00           H  
HETATM   29  HB  DBU A   2       5.167   7.757   5.374  1.00  0.00           H  
HETATM   30  HG1 DBU A   2       5.881   9.559   6.983  1.00  0.00           H  
HETATM   31  HG2 DBU A   2       6.939   8.423   7.820  1.00  0.00           H  
HETATM   32  HG3 DBU A   2       5.189   8.289   7.991  1.00  0.00           H  
HETATM   33  N   DAL A   3       6.936   4.442   4.863  1.00  0.00           N  
HETATM   34  CA  DAL A   3       6.831   3.494   3.752  1.00  0.00           C  
HETATM   35  CB  DAL A   3       5.799   3.959   2.724  1.00  0.00           C  
HETATM   36  C   DAL A   3       6.413   2.124   4.274  1.00  0.00           C  
HETATM   37  O   DAL A   3       5.643   1.411   3.630  1.00  0.00           O  
HETATM   38  H   DAL A   3       7.196   4.102   5.742  1.00  0.00           H  
HETATM   39  HA  DAL A   3       7.790   3.411   3.266  1.00  0.00           H  
HETATM   40  HB1 DAL A   3       5.486   3.112   2.129  1.00  0.00           H  
HETATM   41  HB2 DAL A   3       6.236   4.704   2.078  1.00  0.00           H  
ATOM     42  N   ILE A   4       6.918   1.764   5.452  1.00  0.00           N  
ATOM     43  CA  ILE A   4       6.583   0.479   6.054  1.00  0.00           C  
ATOM     44  C   ILE A   4       5.333   0.611   6.916  1.00  0.00           C  
ATOM     45  O   ILE A   4       4.974  -0.305   7.656  1.00  0.00           O  
ATOM     46  CB  ILE A   4       7.748  -0.024   6.910  1.00  0.00           C  
ATOM     47  CG1 ILE A   4       8.602   1.163   7.364  1.00  0.00           C  
ATOM     48  CG2 ILE A   4       8.608  -0.982   6.084  1.00  0.00           C  
ATOM     49  CD1 ILE A   4       9.548   0.718   8.481  1.00  0.00           C  
ATOM     50  H   ILE A   4       7.523   2.374   5.923  1.00  0.00           H  
ATOM     51  HA  ILE A   4       6.393  -0.237   5.268  1.00  0.00           H  
ATOM     52  HB  ILE A   4       7.361  -0.543   7.775  1.00  0.00           H  
ATOM     53 HG12 ILE A   4       9.179   1.531   6.528  1.00  0.00           H  
ATOM     54 HG13 ILE A   4       7.959   1.948   7.731  1.00  0.00           H  
ATOM     55 HG21 ILE A   4       8.059  -1.895   5.906  1.00  0.00           H  
ATOM     56 HG22 ILE A   4       9.516  -1.207   6.624  1.00  0.00           H  
ATOM     57 HG23 ILE A   4       8.855  -0.521   5.139  1.00  0.00           H  
ATOM     58 HD11 ILE A   4      10.168   1.549   8.780  1.00  0.00           H  
ATOM     59 HD12 ILE A   4      10.173  -0.088   8.124  1.00  0.00           H  
ATOM     60 HD13 ILE A   4       8.971   0.376   9.328  1.00  0.00           H  
HETATM   61  N   DHA A   5       4.658   1.771   6.815  1.00  0.00           N  
HETATM   62  CA  DHA A   5       3.507   1.976   7.564  1.00  0.00           C  
HETATM   63  CB  DHA A   5       3.266   1.646   8.839  1.00  0.00           C  
HETATM   64  C   DHA A   5       2.467   2.656   6.744  1.00  0.00           C  
HETATM   65  O   DHA A   5       1.757   2.039   5.950  1.00  0.00           O  
HETATM   66  H   DHA A   5       4.941   2.501   6.226  1.00  0.00           H  
HETATM   67  HB1 DHA A   5       4.027   1.153   9.426  1.00  0.00           H  
HETATM   68  HB2 DHA A   5       2.310   1.874   9.287  1.00  0.00           H  
ATOM     69  N   LEU A   6       2.352   3.984   6.918  1.00  0.00           N  
ATOM     70  CA  LEU A   6       1.354   4.710   6.141  1.00  0.00           C  
ATOM     71  C   LEU A   6       1.997   5.353   4.917  1.00  0.00           C  
ATOM     72  O   LEU A   6       2.931   6.145   5.037  1.00  0.00           O  
ATOM     73  CB  LEU A   6       0.696   5.789   7.003  1.00  0.00           C  
ATOM     74  CG  LEU A   6      -0.067   5.130   8.153  1.00  0.00           C  
ATOM     75  CD1 LEU A   6       0.788   5.163   9.422  1.00  0.00           C  
ATOM     76  CD2 LEU A   6      -1.373   5.890   8.399  1.00  0.00           C  
ATOM     77  H   LEU A   6       2.917   4.478   7.548  1.00  0.00           H  
ATOM     78  HA  LEU A   6       0.597   4.017   5.813  1.00  0.00           H  
ATOM     79  HB2 LEU A   6       1.457   6.445   7.403  1.00  0.00           H  
ATOM     80  HB3 LEU A   6       0.009   6.363   6.400  1.00  0.00           H  
ATOM     81  HG  LEU A   6      -0.288   4.104   7.896  1.00  0.00           H  
ATOM     82 HD11 LEU A   6       0.910   6.187   9.747  1.00  0.00           H  
ATOM     83 HD12 LEU A   6       1.756   4.733   9.215  1.00  0.00           H  
ATOM     84 HD13 LEU A   6       0.300   4.595  10.199  1.00  0.00           H  
ATOM     85 HD21 LEU A   6      -1.860   5.493   9.278  1.00  0.00           H  
ATOM     86 HD22 LEU A   6      -2.023   5.774   7.544  1.00  0.00           H  
ATOM     87 HD23 LEU A   6      -1.158   6.937   8.549  1.00  0.00           H  
ATOM     88  N   CYS A   7       1.491   5.000   3.739  1.00  0.00           N  
ATOM     89  CA  CYS A   7       2.023   5.543   2.494  1.00  0.00           C  
ATOM     90  C   CYS A   7       0.999   5.404   1.373  1.00  0.00           C  
ATOM     91  O   CYS A   7       0.788   6.332   0.593  1.00  0.00           O  
ATOM     92  CB  CYS A   7       3.309   4.804   2.117  1.00  0.00           C  
ATOM     93  SG  CYS A   7       4.362   4.649   3.577  1.00  0.00           S  
ATOM     94  H   CYS A   7       0.747   4.362   3.706  1.00  0.00           H  
ATOM     95  HA  CYS A   7       2.250   6.590   2.635  1.00  0.00           H  
ATOM     96  HB2 CYS A   7       3.064   3.820   1.745  1.00  0.00           H  
ATOM     97  HB3 CYS A   7       3.839   5.355   1.353  1.00  0.00           H  
ATOM     98  N   ALA A   8       0.360   4.240   1.304  1.00  0.00           N  
ATOM     99  CA  ALA A   8      -0.647   3.991   0.279  1.00  0.00           C  
ATOM    100  C   ALA A   8      -2.028   4.395   0.782  1.00  0.00           C  
ATOM    101  O   ALA A   8      -2.673   3.571   1.411  1.00  0.00           O  
ATOM    102  CB  ALA A   8      -0.653   2.508  -0.102  1.00  0.00           C  
ATOM    103  OXT ALA A   8      -2.422   5.523   0.534  1.00  0.00           O  
ATOM    104  H   ALA A   8       0.567   3.538   1.957  1.00  0.00           H  
ATOM    105  HA  ALA A   8      -0.408   4.575  -0.597  1.00  0.00           H  
ATOM    106  HB1 ALA A   8      -1.488   2.308  -0.757  1.00  0.00           H  
ATOM    107  HB2 ALA A   8      -0.745   1.908   0.791  1.00  0.00           H  
ATOM    108  HB3 ALA A   8       0.269   2.261  -0.607  1.00  0.00           H  
TER     109      ALA A   8                                                      
ENDMDL                                                                          
CONECT    3   22                                                                
CONECT   22    3   23   28                                                      
CONECT   23   22   24   26                                                      
CONECT   24   23   25   29                                                      
CONECT   25   24   30   31   32                                                 
CONECT   26   23   27   33                                                      
CONECT   27   26                                                                
CONECT   28   22                                                                
CONECT   29   24                                                                
CONECT   30   25                                                                
CONECT   31   25                                                                
CONECT   32   25                                                                
CONECT   33   26   34   38                                                      
CONECT   34   33   35   36   39                                                 
CONECT   35   34   40   41   93                                                 
CONECT   36   34   37   42                                                      
CONECT   37   36                                                                
CONECT   38   33                                                                
CONECT   39   34                                                                
CONECT   40   35                                                                
CONECT   41   35                                                                
CONECT   42   36                                                                
CONECT   44   61                                                                
CONECT   61   44   62   66                                                      
CONECT   62   61   63   64                                                      
CONECT   63   62   67   68                                                      
CONECT   64   62   65   69                                                      
CONECT   65   64                                                                
CONECT   66   61                                                                
CONECT   67   63                                                                
CONECT   68   63                                                                
CONECT   69   64                                                                
CONECT   93   35                                                                
MASTER      149    0    3    0    0    0    0    6   52    1   33    1          
END