HEADER    DE NOVO PROTEIN                         11-OCT-02   1N0D              
TITLE     STABILITY OF CYCLIC BETA-HAIRPINS: ASYMMETRIC CONTIBUTIONS FROM SIDE  
TITLE    2 CHAINS OF HYDROGEN BONDED CROSS-STRAND RESIDUE PAIR                  
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: BHP_VWLH, DISULFIDE CYCLIZED BETA-HAIRPIN PEPTIDE;         
COMPND   3 CHAIN: A;                                                            
COMPND   4 ENGINEERED: YES;                                                     
COMPND   5 OTHER_DETAILS: THE STRUCTURE HAS A VALINE AND HISTIDINE HYDROGEN-    
COMPND   6 BONDED CROSS-STRAND PAIR.                                            
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 SYNTHETIC: YES;                                                      
SOURCE   3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED.               
KEYWDS    BETA HAIRPIN, BETA TURN, CYCLIC DISULFIDE, DE NOVO PROTEIN            
EXPDTA    SOLUTION NMR                                                          
NUMMDL    20                                                                    
AUTHOR    S.J.RUSSELL,T.BLANDL,N.J.SKELTON,A.G.COCHRAN                          
REVDAT   3   23-FEB-22 1N0D    1       REMARK LINK                              
REVDAT   2   24-FEB-09 1N0D    1       VERSN                                    
REVDAT   1   04-FEB-03 1N0D    0                                                
JRNL        AUTH   S.J.RUSSELL,T.BLANDL,N.J.SKELTON,A.G.COCHRAN                 
JRNL        TITL   STABILITY OF CYCLIC BETA-HAIRPINS: ASYMMETRIC CONTRIBUTIONS  
JRNL        TITL 2 FROM SIDE CHAINS OF HYDROGEN BONDED CROSS-STRAND RESIDUE     
JRNL        TITL 3 PAIR                                                         
JRNL        REF    J.AM.CHEM.SOC.                V. 125   388 2003              
JRNL        REFN                   ISSN 0002-7863                               
JRNL        PMID   12517150                                                     
JRNL        DOI    10.1021/JA028075L                                            
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : XWINNMR 3.1, AMBER 6.0                               
REMARK   3   AUTHORS     : BRUKER (XWINNMR), CASE, KOLLMAN ET AL. (AMBER)       
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS:                                           
REMARK   3  100 STRUCTURES WERE CALCULATED USING DISTANCE GEOMETRY.             
REMARK   3  THE 80 STRUCTURES OF LOWEST PENALTY FUNCTION WERE REFINED USING     
REMARK   3  THE SANDER MODULE OF AMBER (V6.0).                                  
REMARK   3  THE CALCULATION EMPLOYED 72 DISTANCE RESTRAINTS, 11 DIHEDRAL ANGLE  
REMARK   3  RESTRAINTS AND 8 CHEMICAL SHIFT RESTRAINTS.                         
REMARK   3  THE 20 STRUCTURES OF LOWEST VIOLATION ENERGY WERE CHOSEN TO         
REMARK   3  REPRESENT THE STRUCTURE.                                            
REMARK   3  THERE ARE NO VIOLATIONS OF THE INPUT RESTRAINTS > 0.1 A OR 2        
REMARK   3  DEGREES.                                                            
REMARK   3  THE RMS. DIFFERENCE BETWEEN CALCULATION AND OBSERVED CHEMICAL       
REMARK   3  SHIFTS IS 0.07 PPM.                                                 
REMARK   3  78% OF THE BACKBONE GEOMETRIES ARE IN THE MOST FAVOURABLE REGION    
REMARK   3  OFTHE RAMACHANDRAN PLOT.                                            
REMARK   3  THE BACKBONE HEAVY ATOM RMSD FROM THE MEAN STRUCTURE IS 0.29+/-     
REMARK   3  0.05 A.                                                             
REMARK   4                                                                      
REMARK   4 1N0D COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 30-OCT-02.                  
REMARK 100 THE DEPOSITION ID IS D_1000017361.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 293; 293                           
REMARK 210  PH                             : 5.0; 5.0                           
REMARK 210  IONIC STRENGTH                 : 0; 0                               
REMARK 210  PRESSURE                       : 1 ATM; 1 ATM                       
REMARK 210  SAMPLE CONTENTS                : 5 MM PEPTIDE, UNBUFFERED; 5 MM     
REMARK 210                                   PEPTIDE, UNBUFFERED                
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : DQF-COSY; 2D TOCSY; 2D ROESY; 2D   
REMARK 210                                   COSY-35                            
REMARK 210  SPECTROMETER FIELD STRENGTH    : 500 MHZ                            
REMARK 210  SPECTROMETER MODEL             : DRX                                
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : FELIX 980, DGII 980, AMBER 6.0     
REMARK 210   METHOD USED                   : DISTANCE GEOMETRY AND RESTRAINED   
REMARK 210                                   MOLECULAR DYNAMICS WITH CHEMICAL   
REMARK 210                                   SHIFT REFINEMENT                   
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 80                                 
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 20                                 
REMARK 210 CONFORMERS, SELECTION CRITERIA  : STRUCTURES WITH THE LEAST          
REMARK 210                                   RESTRAINT VIOLATIONS               
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 5                   
REMARK 210                                                                      
REMARK 210 REMARK: RESONANCE ASSIGNMENTS WERE MADE USING STANDARD 2D            
REMARK 210  HOMONUCLEAR TECHNIQUES                                              
REMARK 215                                                                      
REMARK 215 NMR STUDY                                                            
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: 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  2 GLU A   5       57.25    -96.46                                   
REMARK 500  6 GLU A   5       77.72   -106.68                                   
REMARK 500 10 ASN A   7       10.81   -142.84                                   
REMARK 500 14 GLU A   5       66.95   -108.43                                   
REMARK 500 17 ASN A   7       11.26   -148.11                                   
REMARK 500 20 GLU A   5       40.31    -90.23                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NH2 A 12                  
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1N09   RELATED DB: PDB                                   
REMARK 900 A MINIMAL BETA-HAIRPIN PEPTIDE SCAFFOLD FOR BETA-TURN DISPLAY        
REMARK 900 RELATED ID: 1N0C   RELATED DB: PDB                                   
REMARK 900 STABILITY OF CYCLIC BETA-HAIRPINS: ASYMMETRIC CONTIBUTIONS FROM      
REMARK 900 SIDE CHAINS OF HYDROGEN BONDED CROSS-STRAND RESIDUE PAIR             
REMARK 999                                                                      
REMARK 999 SEQUENCE                                                             
REMARK 999 THERE IS NO SEQUENCE DATABASE REFERENCE SINCE                        
REMARK 999 THE PEPTIDE IS A DE NOVO DESIGNED SEQUENCE.                          
DBREF  1N0D A    1    12  PDB    1N0D     1N0D             1     12             
SEQRES   1 A   12  ACE CYS VAL TRP GLU GLY ASN LYS LEU HIS CYS NH2              
HET    ACE  A   1       6                                                       
HET    NH2  A  12       3                                                       
HETNAM     ACE ACETYL GROUP                                                     
HETNAM     NH2 AMINO GROUP                                                      
FORMUL   1  ACE    C2 H4 O                                                      
FORMUL   1  NH2    H2 N                                                         
SHEET    1   A 2 VAL A   3  TRP A   4  0                                        
SHEET    2   A 2 LEU A   9  HIS A  10 -1  O  HIS A  10   N  VAL A   3           
SSBOND   1 CYS A    2    CYS A   11                          1555   1555  2.04  
LINK         C   ACE A   1                 N   CYS A   2     1555   1555  1.34  
LINK         C   CYS A  11                 N   NH2 A  12     1555   1555  1.33  
SITE     1 AC2  1 CYS A  11                                                     
CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1          
ORIGX1      1.000000  0.000000  0.000000        0.00000                         
ORIGX2      0.000000  1.000000  0.000000        0.00000                         
ORIGX3      0.000000  0.000000  1.000000        0.00000                         
SCALE1      1.000000  0.000000  0.000000        0.00000                         
SCALE2      0.000000  1.000000  0.000000        0.00000                         
SCALE3      0.000000  0.000000  1.000000        0.00000                         
MODEL        1                                                                  
HETATM    1  C   ACE A   1       9.729   1.902  -9.636  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.821   0.789  -9.120  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.971   2.735  -9.881  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.848   2.093  -9.810  1.00  0.00           H  
HETATM    5  H2  ACE A   1      10.930   3.195 -10.867  1.00  0.00           H  
HETATM    6  H3  ACE A   1      11.031   3.505  -9.112  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.563   2.467  -9.960  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.266   1.890  -9.614  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.264   1.944 -10.777  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.370   2.791 -11.665  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.692   2.636  -8.397  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.819   3.003  -7.022  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.561   3.372 -10.403  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.409   0.844  -9.358  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.303   3.593  -8.744  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.852   2.063  -8.005  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.224   1.108 -10.695  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.095   1.090 -11.626  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.769   0.968 -10.880  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.675   0.302  -9.848  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.204  -0.021 -12.690  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.284   0.314 -13.723  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.456  -1.426 -12.119  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.192   0.466  -9.902  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.098   2.044 -12.148  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.256  -0.051 -13.227  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       5.208   1.362 -14.016  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.275   0.130 -13.311  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.138  -0.302 -14.610  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       5.373  -1.444 -11.529  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       3.619  -1.729 -11.490  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       4.551  -2.141 -12.936  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.732   1.606 -11.423  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.361   1.481 -10.946  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.274   0.214 -11.523  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.153  -0.056 -12.716  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.433   2.722 -11.369  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.189   3.956 -10.552  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.555   5.025 -10.924  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.751   4.294  -9.246  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.477   6.002  -9.950  1.00  0.00           N  
ATOM     42  CE2 TRP A   4      -0.321   5.610  -8.899  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.617   3.644  -8.339  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.727   6.251  -7.719  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -2.031   4.278  -7.152  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -1.591   5.577  -6.842  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.865   2.062 -12.312  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.349   1.413  -9.857  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.227   2.938 -12.420  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.497   2.494 -11.293  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.091   5.118 -11.859  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       0.910   6.911 -10.031  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.991   2.660  -8.583  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4      -0.397   7.256  -7.503  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.712   3.778  -6.478  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.934   6.062  -5.938  1.00  0.00           H  
ATOM     57  N   GLU A   5      -0.997  -0.527 -10.680  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -1.708  -1.760 -11.065  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.211  -1.658 -10.738  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.899  -2.654 -10.534  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.000  -2.970 -10.423  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -1.240  -4.311 -11.138  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -0.581  -4.366 -12.517  1.00  0.00           C  
ATOM     64  OE1 GLU A   5       0.606  -4.760 -12.569  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -1.273  -4.019 -13.501  1.00  0.00           O  
ATOM     66  H   GLU A   5      -1.017  -0.255  -9.699  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -1.648  -1.871 -12.147  1.00  0.00           H  
ATOM     68  HB2 GLU A   5       0.077  -2.792 -10.425  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.323  -3.054  -9.385  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -0.823  -5.110 -10.523  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -2.308  -4.502 -11.242  1.00  0.00           H  
ATOM     72  N   GLY A   6      -3.717  -0.421 -10.671  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.093  -0.075 -10.337  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.128   1.019  -9.275  1.00  0.00           C  
ATOM     75  O   GLY A   6      -4.720   2.150  -9.521  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.075   0.332 -10.874  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.604   0.285 -11.229  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -5.619  -0.956  -9.967  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.595   0.660  -8.078  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.774   1.539  -6.921  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.532   1.607  -6.010  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.559   2.284  -4.983  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -7.000   1.020  -6.148  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -6.737  -0.316  -5.457  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -6.122  -1.215  -6.011  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -7.187  -0.486  -4.231  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.831  -0.314  -7.922  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.982   2.554  -7.270  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.285   1.762  -5.404  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.834   0.894  -6.839  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -7.686   0.233  -3.739  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -6.960  -1.378  -3.825  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.465   0.883  -6.373  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.239   0.679  -5.601  1.00  0.00           C  
ATOM     95  C   LYS A   8      -1.020   0.683  -6.535  1.00  0.00           C  
ATOM     96  O   LYS A   8      -1.102   0.310  -7.711  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.396  -0.633  -4.806  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -1.310  -0.851  -3.740  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -1.665  -1.997  -2.775  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -1.804  -3.378  -3.426  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -0.528  -3.860  -3.974  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.539   0.389  -7.250  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.128   1.502  -4.892  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -3.359  -0.602  -4.293  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -2.409  -1.479  -5.497  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -0.349  -1.049  -4.216  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -1.218   0.061  -3.148  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -0.897  -2.053  -2.002  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -2.609  -1.758  -2.284  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -2.139  -4.083  -2.665  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -2.553  -3.344  -4.218  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8       0.167  -3.872  -3.242  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -0.648  -4.791  -4.345  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -0.225  -3.249  -4.720  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.105   1.133  -5.980  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.399   1.314  -6.631  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.334   0.166  -6.214  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.451  -0.126  -5.025  1.00  0.00           O  
ATOM    119  CB  LEU A   9       1.927   2.689  -6.171  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.241   3.150  -6.826  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.024   3.556  -8.284  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       3.796   4.365  -6.078  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.069   1.374  -5.002  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.273   1.311  -7.713  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.162   3.445  -6.367  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.079   2.648  -5.092  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.974   2.347  -6.777  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.289   4.358  -8.343  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       3.960   3.898  -8.721  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       2.663   2.706  -8.852  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.046   5.155  -6.038  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.071   4.077  -5.063  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       4.687   4.738  -6.582  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.013  -0.467  -7.175  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.015  -1.506  -6.928  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.400  -0.978  -7.312  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.597  -0.506  -8.432  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.690  -2.785  -7.719  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.427  -3.502  -7.301  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.354  -4.796  -6.831  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.146  -3.024  -7.388  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.056  -5.083  -6.630  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.286  -4.032  -6.949  1.00  0.00           N  
ATOM    144  H   HIS A  10       2.882  -0.178  -8.145  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.025  -1.761  -5.867  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.621  -2.545  -8.781  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.523  -3.478  -7.591  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       3.126  -5.432  -6.696  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       0.849  -2.048  -7.749  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.675  -6.028  -6.265  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.362  -1.061  -6.390  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.739  -0.623  -6.600  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.676  -1.835  -6.632  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.826  -2.541  -5.641  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.128   0.378  -5.508  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.140   1.898  -5.450  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.146  -1.469  -5.492  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.810  -0.127  -7.563  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.046  -0.117  -4.539  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.172   0.659  -5.649  1.00  0.00           H  
HETATM  161  N   NH2 A  12       9.292  -2.110  -7.777  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12       9.200  -1.497  -8.576  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12       9.875  -2.931  -7.809  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        2                                                                  
HETATM    1  C   ACE A   1       9.664   1.805  -9.736  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.738   0.805  -9.028  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.942   2.478 -10.193  1.00  0.00           C  
HETATM    4  H1  ACE A   1      10.761   3.522 -10.442  1.00  0.00           H  
HETATM    5  H2  ACE A   1      11.666   2.422  -9.382  1.00  0.00           H  
HETATM    6  H3  ACE A   1      11.334   1.946 -11.058  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.501   2.340 -10.125  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.201   1.818  -9.704  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.157   1.850 -10.830  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.204   2.720 -11.697  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.664   2.630  -8.512  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.830   3.126  -7.216  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.501   3.141 -10.739  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.323   0.780  -9.409  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.219   3.546  -8.900  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.867   2.052  -8.046  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.153   0.970 -10.732  1.00  0.00           N  
ATOM     18  CA  VAL A   3       3.970   0.970 -11.604  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.668   0.934 -10.788  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.664   0.526  -9.626  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.023  -0.157 -12.666  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.039   0.172 -13.768  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.344  -1.551 -12.108  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.176   0.298  -9.966  1.00  0.00           H  
ATOM     25  HA  VAL A   3       3.969   1.914 -12.145  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.045  -0.209 -13.147  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       4.885   1.188 -14.131  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.057   0.081 -13.387  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       4.908  -0.517 -14.603  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       3.641  -1.811 -11.319  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       4.261  -2.289 -12.907  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       5.358  -1.580 -11.709  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.556   1.320 -11.429  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.194   1.384 -10.875  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.625   0.198 -11.381  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.911   0.093 -12.573  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.516   2.683 -11.280  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.127   3.898 -10.498  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.713   4.861 -10.937  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.570   4.321  -9.167  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.854   5.828  -9.964  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.091   5.545  -8.850  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.472   3.817  -8.201  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.088   6.209  -7.628  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.682   4.489  -6.979  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -0.982   5.674  -6.685  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.645   1.551 -12.407  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.206   1.384  -9.781  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.357   2.866 -12.344  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.589   2.546 -11.137  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.195   4.862 -11.907  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       1.440   6.642 -10.069  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -2.023   2.914  -8.414  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.452   7.119  -7.418  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.389   4.099  -6.259  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.141   6.181  -5.743  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.090  -0.647 -10.463  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -2.046  -1.716 -10.753  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.457  -1.198 -10.409  1.00  0.00           C  
ATOM     60  O   GLU A   5      -4.167  -1.735  -9.560  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.624  -3.006 -10.020  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -0.569  -3.843 -10.777  1.00  0.00           C  
ATOM     63  CD  GLU A   5       0.816  -3.211 -10.974  1.00  0.00           C  
ATOM     64  OE1 GLU A   5       1.225  -2.380 -10.134  1.00  0.00           O  
ATOM     65  OE2 GLU A   5       1.471  -3.602 -11.965  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.841  -0.481  -9.488  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -2.051  -1.938 -11.823  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -1.262  -2.760  -9.022  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -2.499  -3.646  -9.910  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -0.429  -4.777 -10.230  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -0.975  -4.101 -11.756  1.00  0.00           H  
ATOM     72  N   GLY A   6      -3.832  -0.080 -11.047  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.108   0.633 -10.910  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.338   1.318  -9.559  1.00  0.00           C  
ATOM     75  O   GLY A   6      -5.640   2.507  -9.533  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.164   0.286 -11.714  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.152   1.408 -11.677  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -5.931  -0.060 -11.088  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.205   0.588  -8.443  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.574   1.068  -7.104  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.429   0.975  -6.072  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.619   1.384  -4.925  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.873   0.352  -6.661  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -7.794   1.188  -5.772  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -9.007   1.102  -5.865  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -7.269   2.015  -4.892  1.00  0.00           N  
ATOM     87  H   ASN A   7      -4.955  -0.390  -8.585  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.803   2.131  -7.181  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.458   0.106  -7.548  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -6.637  -0.583  -6.152  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -6.261   2.017  -4.738  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -7.916   2.566  -4.358  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.241   0.495  -6.468  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.039   0.443  -5.627  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.777   0.673  -6.472  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.732   0.287  -7.644  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.025  -0.919  -4.899  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -0.929  -1.096  -3.834  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -1.142  -0.219  -2.585  1.00  0.00           C  
ATOM    100  CE  LYS A   8       0.071  -0.235  -1.644  1.00  0.00           C  
ATOM    101  NZ  LYS A   8       0.459  -1.596  -1.233  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.142   0.194  -7.428  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.106   1.242  -4.888  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -2.990  -1.074  -4.414  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -1.910  -1.704  -5.646  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -0.936  -2.142  -3.523  1.00  0.00           H  
ATOM    107  HG3 LYS A   8       0.046  -0.891  -4.270  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -1.308   0.815  -2.883  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -2.024  -0.568  -2.045  1.00  0.00           H  
ATOM    110  HE2 LYS A   8       0.914   0.232  -2.155  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -0.162   0.349  -0.753  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8       0.465  -2.200  -2.043  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8       1.384  -1.573  -0.828  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -0.199  -1.949  -0.552  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.241   1.281  -5.853  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.587   1.467  -6.395  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.471   0.275  -5.995  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.562  -0.059  -4.814  1.00  0.00           O  
ATOM    119  CB  LEU A   9       2.158   2.790  -5.837  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.435   3.295  -6.544  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.093   4.166  -7.755  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       4.288   4.144  -5.595  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.113   1.526  -4.883  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.522   1.508  -7.484  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.398   3.571  -5.896  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.380   2.640  -4.779  1.00  0.00           H  
ATOM    127  HG  LEU A   9       4.032   2.446  -6.872  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.505   3.597  -8.473  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       2.525   5.037  -7.429  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       4.008   4.511  -8.239  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.704   4.973  -5.196  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.643   3.527  -4.770  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       5.155   4.541  -6.126  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.136  -0.348  -6.972  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.061  -1.465  -6.777  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.450  -1.031  -7.265  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.628  -0.731  -8.449  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.534  -2.728  -7.486  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.206  -3.231  -6.954  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       1.990  -4.402  -6.260  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       0.992  -2.611  -7.089  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       0.678  -4.467  -5.966  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.033  -3.398  -6.452  1.00  0.00           N  
ATOM    144  H   HIS A  10       2.995  -0.030  -7.931  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.131  -1.699  -5.713  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.431  -2.524  -8.553  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.271  -3.523  -7.371  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       2.679  -5.101  -6.027  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       0.811  -1.681  -7.606  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.195  -5.265  -5.417  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.414  -0.928  -6.341  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.773  -0.453  -6.607  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.796  -1.593  -6.589  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.804  -2.425  -5.687  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.170   0.606  -5.571  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.200   2.131  -5.558  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.203  -1.197  -5.391  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.801  -0.001  -7.593  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.110   0.159  -4.579  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.210   0.885  -5.746  1.00  0.00           H  
HETATM  161  N   NH2 A  12       9.707  -1.610  -7.554  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12       9.705  -0.877  -8.261  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.419  -2.320  -7.537  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        3                                                                  
HETATM    1  C   ACE A   1       9.552   1.801  -9.981  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.649   0.656  -9.543  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.775   2.523 -10.501  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.467   1.793 -10.918  1.00  0.00           H  
HETATM    5  H2  ACE A   1      10.495   3.239 -11.272  1.00  0.00           H  
HETATM    6  H3  ACE A   1      11.249   3.041  -9.668  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.410   2.488 -10.018  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.141   2.010  -9.485  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.020   2.120 -10.526  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.012   3.043 -11.342  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.798   2.828  -8.238  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.994   2.792  -6.878  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.417   3.415 -10.415  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.245   0.966  -9.199  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.669   3.869  -8.540  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.849   2.472  -7.852  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.058   1.195 -10.475  1.00  0.00           N  
ATOM     18  CA  VAL A   3       3.992   1.042 -11.470  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.611   0.958 -10.808  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.450   0.374  -9.734  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.281  -0.153 -12.411  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.637   0.017 -13.118  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.269  -1.522 -11.714  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.137   0.474  -9.759  1.00  0.00           H  
ATOM     25  HA  VAL A   3       3.995   1.941 -12.087  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.512  -0.164 -13.184  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       5.716   1.019 -13.540  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.456  -0.138 -12.414  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.728  -0.711 -13.925  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       4.909  -1.510 -10.832  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       3.253  -1.781 -11.418  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       4.636  -2.290 -12.398  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.617   1.578 -11.453  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.224   1.647 -11.007  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.556   0.376 -11.356  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.913   0.148 -12.511  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.455   2.891 -11.600  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.212   4.128 -10.796  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.518   5.207 -11.155  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.697   4.397  -9.451  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.536   6.114 -10.110  1.00  0.00           N  
ATOM     42  CE2 TRP A   4      -0.172   5.649  -9.020  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.528   3.697  -8.552  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.419   6.158  -7.736  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.801   4.205  -7.269  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -1.235   5.424  -6.855  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.835   2.041 -12.320  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.210   1.745  -9.921  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.137   3.039 -12.634  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.534   2.731 -11.609  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.018   5.331 -12.109  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       1.014   7.003 -10.150  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.958   2.754  -8.864  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.002   7.103  -7.432  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.444   3.656  -6.598  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.440   5.797  -5.862  1.00  0.00           H  
ATOM     57  N   GLU A   5      -0.866  -0.431 -10.341  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -1.680  -1.637 -10.464  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.131  -1.312 -10.059  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.627  -1.693  -8.997  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.024  -2.780  -9.672  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -1.413  -4.153 -10.234  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -0.963  -5.290  -9.315  1.00  0.00           C  
ATOM     64  OE1 GLU A   5       0.265  -5.418  -9.114  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -1.857  -6.019  -8.833  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.614  -0.139  -9.398  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -1.694  -1.942 -11.511  1.00  0.00           H  
ATOM     68  HB2 GLU A   5       0.062  -2.689  -9.747  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.300  -2.714  -8.621  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -2.496  -4.199 -10.368  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -0.944  -4.283 -11.212  1.00  0.00           H  
ATOM     72  N   GLY A   6      -3.804  -0.538 -10.919  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.214  -0.153 -10.811  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.529   0.829  -9.679  1.00  0.00           C  
ATOM     75  O   GLY A   6      -5.997   1.935  -9.943  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.291  -0.231 -11.735  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.517   0.315 -11.748  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -5.823  -1.045 -10.668  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.359   0.424  -8.416  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.677   1.239  -7.228  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.506   1.332  -6.229  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.674   1.908  -5.153  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.961   0.720  -6.531  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -8.276   0.760  -7.312  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -9.302   0.333  -6.809  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -8.335   1.261  -8.529  1.00  0.00           N  
ATOM     87  H   ASN A   7      -4.979  -0.516  -8.307  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.869   2.269  -7.536  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -6.799  -0.304  -6.198  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.130   1.323  -5.639  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -7.522   1.639  -9.013  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -9.244   1.209  -8.952  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.332   0.767  -6.548  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.133   0.808  -5.699  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.863   0.916  -6.556  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.882   0.620  -7.752  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.163  -0.449  -4.803  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -1.180  -0.475  -3.617  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -1.514   0.496  -2.473  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -2.821   0.127  -1.761  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -2.950   0.830  -0.473  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.244   0.301  -7.444  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.170   1.700  -5.069  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -3.171  -0.565  -4.401  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -1.974  -1.320  -5.431  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -1.172  -1.486  -3.209  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -0.171  -0.272  -3.970  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -0.700   0.453  -1.750  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -1.584   1.516  -2.850  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -3.664   0.391  -2.400  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -2.841  -0.947  -1.575  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -2.795   1.819  -0.608  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -3.875   0.681  -0.095  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -2.264   0.469   0.176  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.235   1.359  -5.940  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.539   1.572  -6.565  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.517   0.492  -6.075  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.628   0.246  -4.874  1.00  0.00           O  
ATOM    119  CB  LEU A   9       2.005   3.005  -6.239  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.323   3.378  -6.944  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.102   3.896  -8.373  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       4.091   4.424  -6.133  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.184   1.511  -4.945  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.439   1.482  -7.647  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.232   3.716  -6.536  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.137   3.083  -5.159  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.945   2.490  -6.998  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.225   3.430  -8.820  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       2.961   4.977  -8.368  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       3.971   3.658  -8.986  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.455   5.286  -5.933  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.406   3.984  -5.185  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       4.977   4.746  -6.678  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.204  -0.158  -7.018  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.033  -1.349  -6.811  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.446  -1.099  -7.340  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.594  -0.565  -8.435  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.372  -2.527  -7.542  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.098  -2.982  -6.877  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       1.945  -4.121  -6.118  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       0.907  -2.309  -6.860  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       0.688  -4.119  -5.638  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.022  -3.034  -6.060  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.049   0.111  -7.988  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.094  -1.585  -5.747  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.150  -2.235  -8.571  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.067  -3.366  -7.575  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       2.637  -4.838  -5.968  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       0.701  -1.374  -7.359  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.265  -4.882  -4.999  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.482  -1.475  -6.583  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.878  -1.116  -6.863  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.808  -2.343  -6.850  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.405  -3.450  -6.508  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.332  -0.078  -5.824  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.281   1.384  -5.586  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.305  -1.982  -5.729  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.953  -0.666  -7.853  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.396  -0.584  -4.860  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.333   0.268  -6.080  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.080  -2.156  -7.189  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.412  -1.248  -7.478  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.691  -2.957  -7.164  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        4                                                                  
HETATM    1  C   ACE A   1       9.492   1.936 -10.004  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.664   0.880  -9.397  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.664   2.644 -10.650  1.00  0.00           C  
HETATM    4  H1  ACE A   1      10.377   3.021 -11.631  1.00  0.00           H  
HETATM    5  H2  ACE A   1      10.978   3.468 -10.010  1.00  0.00           H  
HETATM    6  H3  ACE A   1      11.486   1.939 -10.762  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.295   2.505 -10.161  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.075   1.982  -9.568  1.00  0.00           C  
ATOM      9  C   CYS A   2       5.916   1.958 -10.578  1.00  0.00           C  
ATOM     10  O   CYS A   2       5.917   2.707 -11.557  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.749   2.785  -8.297  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.991   2.771  -6.966  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.214   3.333 -10.732  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.268   0.960  -9.281  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.594   3.824  -8.589  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.816   2.417  -7.875  1.00  0.00           H  
ATOM     17  N   VAL A   3       4.917   1.104 -10.333  1.00  0.00           N  
ATOM     18  CA  VAL A   3       3.794   0.836 -11.230  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.458   0.969 -10.507  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.252   0.402  -9.431  1.00  0.00           O  
ATOM     21  CB  VAL A   3       3.898  -0.541 -11.927  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.125  -0.599 -12.846  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       3.913  -1.739 -10.964  1.00  0.00           C  
ATOM     24  H   VAL A   3       4.960   0.578  -9.462  1.00  0.00           H  
ATOM     25  HA  VAL A   3       3.835   1.599 -12.006  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.021  -0.655 -12.566  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       6.036  -0.398 -12.284  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       5.201  -1.587 -13.301  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.019   0.142 -13.639  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       4.653  -1.593 -10.178  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       2.926  -1.862 -10.517  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       4.146  -2.655 -11.507  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.547   1.711 -11.136  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.146   1.832 -10.752  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.659   0.634 -11.265  1.00  0.00           C  
ATOM     36  O   TRP A   4      -1.031   0.572 -12.435  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.395   3.176 -11.257  1.00  0.00           C  
ATOM     38  CG  TRP A   4       0.045   4.323 -10.402  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.929   5.287 -10.747  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.336   4.601  -9.020  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       1.128   6.134  -9.674  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.385   5.748  -8.578  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.208   3.989  -8.093  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4       0.273   6.248  -7.271  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.357   4.504  -6.791  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -0.611   5.621  -6.376  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.818   2.154 -11.999  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.075   1.833  -9.664  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.077   3.339 -12.289  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.486   3.149 -11.248  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.411   5.368 -11.714  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       1.755   6.926  -9.693  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.769   3.116  -8.395  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.853   7.103  -6.962  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.031   4.024  -6.096  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -0.714   5.991  -5.365  1.00  0.00           H  
ATOM     57  N   GLU A   5      -0.928  -0.322 -10.374  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -1.747  -1.501 -10.640  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.164  -1.273 -10.104  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.412  -1.357  -8.897  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.076  -2.750 -10.058  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -1.845  -4.017 -10.454  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -1.096  -5.277 -10.025  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -0.056  -5.564 -10.659  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -1.575  -5.935  -9.076  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.603  -0.185  -9.415  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -1.812  -1.647 -11.719  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -0.063  -2.812 -10.458  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.020  -2.674  -8.971  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -2.834  -4.006  -9.991  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -1.979  -4.037 -11.537  1.00  0.00           H  
ATOM     72  N   GLY A   6      -4.078  -0.927 -11.021  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.456  -0.497 -10.769  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.531   0.771  -9.918  1.00  0.00           C  
ATOM     75  O   GLY A   6      -5.852   1.843 -10.422  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.763  -0.884 -11.979  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.940  -0.291 -11.723  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.009  -1.292 -10.269  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.226   0.632  -8.626  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.202   1.708  -7.642  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.041   1.620  -6.624  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.020   2.439  -5.708  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.582   1.766  -6.959  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -6.770   0.706  -5.882  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -7.366  -0.338  -6.091  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -6.242   0.951  -4.701  1.00  0.00           N  
ATOM     87  H   ASN A   7      -4.913  -0.299  -8.367  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.062   2.650  -8.176  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -6.707   2.747  -6.502  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.368   1.651  -7.706  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -5.620   1.748  -4.602  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -6.373   0.254  -3.991  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.102   0.662  -6.752  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -1.978   0.422  -5.812  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.636   0.643  -6.515  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.457   0.260  -7.671  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.060  -0.996  -5.218  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -3.345  -1.259  -4.402  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -4.271  -2.249  -5.124  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -5.432  -2.718  -4.246  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -6.383  -3.518  -5.037  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.161   0.026  -7.545  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -1.993   1.100  -4.949  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -1.955  -1.735  -6.015  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -1.211  -1.128  -4.544  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -3.068  -1.673  -3.432  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -3.875  -0.324  -4.223  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -4.668  -1.771  -6.021  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -3.696  -3.129  -5.416  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -5.045  -3.330  -3.429  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -5.952  -1.856  -3.829  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -6.714  -2.961  -5.813  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -5.915  -4.340  -5.392  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -7.165  -3.793  -4.463  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.298   1.277  -5.802  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.652   1.566  -6.265  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.609   0.467  -5.794  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.960   0.404  -4.617  1.00  0.00           O  
ATOM    119  CB  LEU A   9       2.069   2.970  -5.783  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.405   3.482  -6.356  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.390   3.532  -7.887  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       3.681   4.898  -5.841  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.063   1.560  -4.863  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.642   1.571  -7.354  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.288   3.672  -6.070  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.131   2.969  -4.694  1.00  0.00           H  
ATOM    127  HG  LEU A   9       4.218   2.834  -6.030  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.468   3.988  -8.240  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       4.231   4.117  -8.256  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       3.467   2.523  -8.285  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       2.880   5.571  -6.146  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       3.749   4.889  -4.752  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       4.627   5.261  -6.243  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.011  -0.407  -6.718  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.047  -1.421  -6.496  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.373  -0.918  -7.076  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.373  -0.004  -7.893  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.625  -2.738  -7.160  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.383  -3.345  -6.557  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.333  -4.492  -5.797  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.106  -2.866  -6.671  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.047  -4.697  -5.463  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.265  -3.730  -5.965  1.00  0.00           N  
ATOM    144  H   HIS A  10       2.697  -0.252  -7.675  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.181  -1.593  -5.426  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.447  -2.563  -8.220  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.441  -3.456  -7.072  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       3.112  -5.085  -5.555  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       0.804  -1.978  -7.206  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.683  -5.530  -4.876  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.510  -1.501  -6.689  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.828  -0.953  -7.020  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.841  -2.039  -7.405  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.685  -3.208  -7.064  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.294  -0.095  -5.836  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.344   1.431  -5.556  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.486  -2.312  -6.090  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.750  -0.302  -7.881  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.227  -0.703  -4.932  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.339   0.182  -5.976  1.00  0.00           H  
HETATM  161  N   NH2 A  12       9.898  -1.660  -8.117  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12       9.977  -0.699  -8.443  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.557  -2.361  -8.410  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        5                                                                  
HETATM    1  C   ACE A   1       9.728   1.799 -10.052  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.898   0.774  -9.393  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.900   2.478 -10.727  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.809   1.918 -10.514  1.00  0.00           H  
HETATM    5  H2  ACE A   1      10.728   2.508 -11.803  1.00  0.00           H  
HETATM    6  H3  ACE A   1      10.999   3.493 -10.341  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.544   2.388 -10.231  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.294   1.927  -9.636  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.136   2.014 -10.646  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.117   2.913 -11.486  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.996   2.773  -8.386  1.00  0.00           C  
ATOM     12  SG  CYS A   2       8.292   2.880  -7.115  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.483   3.200 -10.827  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.412   0.886  -9.353  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.793   3.791  -8.720  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       6.091   2.397  -7.911  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.160   1.104 -10.539  1.00  0.00           N  
ATOM     18  CA  VAL A   3       3.992   0.978 -11.432  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.675   0.873 -10.656  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.588   0.216  -9.618  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.114  -0.213 -12.409  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.099   0.101 -13.541  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.530  -1.529 -11.736  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.234   0.456  -9.757  1.00  0.00           H  
ATOM     25  HA  VAL A   3       3.932   1.885 -12.035  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.138  -0.362 -12.875  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       4.821   1.038 -14.024  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.111   0.189 -13.149  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.069  -0.695 -14.286  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       3.868  -1.746 -10.899  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       4.456  -2.346 -12.454  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       5.556  -1.465 -11.376  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.651   1.554 -11.179  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.279   1.584 -10.673  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.546   0.429 -11.249  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.867   0.434 -12.437  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.381   2.917 -11.056  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.059   4.091 -10.186  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.816   5.082 -10.472  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.663   4.443  -8.904  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.781   6.029  -9.464  1.00  0.00           N  
ATOM     42  CE2 TRP A   4      -0.117   5.687  -8.474  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.641   3.844  -8.077  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.521   6.313  -7.286  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -2.050   4.458  -6.878  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -1.497   5.691  -6.487  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.819   2.047 -12.042  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.288   1.500  -9.587  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.143   3.158 -12.093  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.464   2.786 -11.002  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.421   5.139 -11.368  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       1.318   6.885  -9.480  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -2.086   2.911  -8.388  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4      -0.096   7.262  -6.996  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.807   3.993  -6.261  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.834   6.168  -5.576  1.00  0.00           H  
ATOM     57  N   GLU A   5      -0.949  -0.529 -10.407  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -1.907  -1.569 -10.794  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.302  -1.203 -10.276  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.684  -1.550  -9.157  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.470  -2.967 -10.326  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -0.403  -3.607 -11.227  1.00  0.00           C  
ATOM     63  CD  GLU A   5       0.968  -2.949 -11.083  1.00  0.00           C  
ATOM     64  OE1 GLU A   5       1.658  -3.287 -10.097  1.00  0.00           O  
ATOM     65  OE2 GLU A   5       1.305  -2.128 -11.962  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.726  -0.426  -9.418  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -1.974  -1.613 -11.882  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -1.117  -2.922  -9.295  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -2.345  -3.619 -10.364  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -0.315  -4.662 -10.960  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -0.727  -3.556 -12.268  1.00  0.00           H  
ATOM     72  N   GLY A   6      -4.062  -0.467 -11.098  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.456  -0.092 -10.849  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.647   0.910  -9.707  1.00  0.00           C  
ATOM     75  O   GLY A   6      -6.013   2.056  -9.951  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.644  -0.175 -11.971  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.873   0.349 -11.755  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.028  -0.990 -10.615  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.425   0.468  -8.464  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.720   1.223  -7.243  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.527   1.378  -6.284  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.688   2.027  -5.247  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.937   0.594  -6.537  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -6.607  -0.677  -5.765  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -6.887  -1.782  -6.194  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -5.997  -0.550  -4.602  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.063  -0.481  -8.401  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -6.004   2.236  -7.528  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.350   1.318  -5.835  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.712   0.368  -7.271  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -5.683   0.361  -4.285  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -5.794  -1.408  -4.121  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.368   0.763  -6.567  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.185   0.864  -5.701  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.886   0.817  -6.512  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.861   0.356  -7.655  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.248  -0.234  -4.617  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -1.499   0.160  -3.328  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -1.621  -0.874  -2.196  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -1.122  -2.277  -2.569  1.00  0.00           C  
ATOM    101  NZ  LYS A   8       0.244  -2.267  -3.120  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.294   0.211  -7.415  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.223   1.837  -5.209  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -3.290  -0.403  -4.341  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -1.851  -1.167  -5.023  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -0.444   0.315  -3.544  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -1.908   1.104  -2.963  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -1.050  -0.515  -1.338  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -2.664  -0.948  -1.889  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -1.139  -2.901  -1.674  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -1.802  -2.707  -3.306  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8       0.880  -1.841  -2.462  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8       0.537  -3.215  -3.318  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8       0.254  -1.732  -3.978  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.188   1.314  -5.899  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.533   1.387  -6.459  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.363   0.174  -6.007  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.278  -0.248  -4.854  1.00  0.00           O  
ATOM    119  CB  LEU A   9       2.158   2.712  -5.980  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.517   3.074  -6.613  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.368   3.382  -8.104  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       4.118   4.301  -5.924  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.074   1.624  -4.947  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.464   1.390  -7.548  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.459   3.525  -6.189  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.284   2.661  -4.898  1.00  0.00           H  
ATOM    127  HG  LEU A   9       4.212   2.243  -6.485  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.521   4.046  -8.273  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       4.272   3.845  -8.495  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       3.209   2.455  -8.637  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.444   5.154  -6.011  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.292   4.080  -4.871  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       5.077   4.547  -6.380  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.204  -0.338  -6.904  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.227  -1.353  -6.642  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.588  -0.831  -7.114  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.632  -0.077  -8.081  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.868  -2.636  -7.405  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.716  -3.401  -6.803  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.818  -4.591  -6.121  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.394  -3.039  -6.814  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.582  -4.934  -5.720  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.684  -4.017  -6.112  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.163   0.022  -7.857  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.279  -1.569  -5.574  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.639  -2.388  -8.442  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.740  -3.292  -7.413  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       3.662  -5.115  -5.955  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       0.980  -2.152  -7.275  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       1.340  -5.822  -5.151  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.694  -1.263  -6.494  1.00  0.00           N  
ATOM    152  CA  CYS A  11       8.054  -0.870  -6.883  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.964  -2.095  -7.045  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.750  -3.132  -6.423  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.630   0.104  -5.846  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.707   1.649  -5.594  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.617  -1.933  -5.743  1.00  0.00           H  
ATOM    158  HA  CYS A  11       8.034  -0.359  -7.840  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.688  -0.413  -4.889  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.650   0.363  -6.135  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.010  -1.979  -7.859  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.172  -1.123  -8.379  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.605  -2.784  -7.967  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        6                                                                  
HETATM    1  C   ACE A   1       9.807   2.231 -10.032  1.00  0.00           C  
HETATM    2  O   ACE A   1      10.015   1.186  -9.418  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.957   3.011 -10.637  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.853   2.831 -10.046  1.00  0.00           H  
HETATM    5  H2  ACE A   1      11.121   2.676 -11.659  1.00  0.00           H  
HETATM    6  H3  ACE A   1      10.732   4.077 -10.627  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.595   2.773 -10.161  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.354   2.198  -9.649  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.276   2.197 -10.743  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.274   3.073 -11.608  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.879   3.007  -8.430  1.00  0.00           C  
ATOM     12  SG  CYS A   2       8.057   3.262  -7.073  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.503   3.612 -10.715  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.535   1.168  -9.349  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.586   3.997  -8.779  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.992   2.528  -8.018  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.343   1.243 -10.674  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.194   1.104 -11.585  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.887   0.925 -10.794  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.912   0.787  -9.568  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.419  -0.010 -12.639  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.606   0.301 -13.565  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.606  -1.402 -12.021  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.392   0.595  -9.887  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.087   2.038 -12.137  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.536  -0.051 -13.277  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       5.472   1.281 -14.024  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.544   0.294 -13.010  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.661  -0.447 -14.358  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       5.453  -1.406 -11.334  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       3.704  -1.695 -11.486  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       4.791  -2.131 -12.811  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.743   0.920 -11.496  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.398   0.984 -10.910  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.511  -0.180 -11.320  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.702  -0.463 -12.500  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.250   2.327 -11.283  1.00  0.00           C  
ATOM     38  CG  TRP A   4       0.201   3.477 -10.436  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       1.206   4.329 -10.733  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.297   3.881  -9.123  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       1.369   5.228  -9.697  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.488   4.980  -8.666  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.321   3.425  -8.265  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4       0.290   5.576  -7.412  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.518   4.002  -6.995  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -0.713   5.071  -6.566  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.795   0.950 -12.504  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.473   0.966  -9.823  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.051   2.548 -12.333  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.332   2.243 -11.170  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.798   4.295 -11.641  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       2.058   5.967  -9.700  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.951   2.612  -8.592  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.904   6.407  -7.100  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.291   3.623  -6.340  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -0.872   5.508  -5.590  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.137  -0.790 -10.312  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -2.205  -1.781 -10.389  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.523  -1.097  -9.965  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.988  -1.209  -8.829  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.796  -2.998  -9.532  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -2.782  -4.174  -9.561  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -2.949  -4.765 -10.962  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -3.834  -4.266 -11.691  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -2.190  -5.707 -11.280  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.953  -0.441  -9.373  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -2.307  -2.115 -11.423  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -0.831  -3.361  -9.891  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.661  -2.679  -8.497  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -2.408  -4.951  -8.893  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -3.753  -3.855  -9.183  1.00  0.00           H  
ATOM     72  N   GLY A   6      -4.099  -0.313 -10.886  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.343   0.454 -10.727  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.312   1.529  -9.630  1.00  0.00           C  
ATOM     75  O   GLY A   6      -5.109   2.707  -9.911  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.629  -0.256 -11.780  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.557   0.956 -11.670  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.164  -0.233 -10.522  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.567   1.148  -8.374  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.572   2.045  -7.204  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.476   1.693  -6.181  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.429   2.264  -5.093  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.991   2.082  -6.596  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -8.024   2.862  -7.410  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -9.183   2.931  -7.038  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -7.666   3.482  -8.520  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.708   0.155  -8.230  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.323   3.061  -7.515  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.359   1.066  -6.450  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -6.948   2.556  -5.616  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -6.730   3.424  -8.908  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -8.410   3.988  -8.966  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.568   0.786  -6.557  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.443   0.276  -5.774  1.00  0.00           C  
ATOM     95  C   LYS A   8      -1.164   0.393  -6.605  1.00  0.00           C  
ATOM     96  O   LYS A   8      -1.229   0.352  -7.834  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.795  -1.183  -5.430  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -1.663  -2.062  -4.883  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -1.097  -1.614  -3.530  1.00  0.00           C  
ATOM    100  CE  LYS A   8       0.046  -2.568  -3.175  1.00  0.00           C  
ATOM    101  NZ  LYS A   8       0.794  -2.124  -1.988  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.669   0.388  -7.487  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.327   0.861  -4.861  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -3.625  -1.183  -4.721  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -3.147  -1.669  -6.342  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -2.056  -3.072  -4.772  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -0.859  -2.107  -5.617  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -0.716  -0.595  -3.592  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -1.873  -1.659  -2.765  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -0.366  -3.561  -2.994  1.00  0.00           H  
ATOM    111  HE3 LYS A   8       0.732  -2.622  -4.019  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8       1.180  -1.206  -2.159  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8       0.177  -2.093  -1.189  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8       1.547  -2.773  -1.808  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.000   0.493  -5.956  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.288   0.613  -6.638  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.290  -0.460  -6.207  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.184  -1.071  -5.136  1.00  0.00           O  
ATOM    119  CB  LEU A   9       1.786   2.080  -6.576  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.130   2.384  -5.876  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.615   3.776  -6.284  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       3.002   2.323  -4.352  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.000   0.447  -4.949  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.122   0.405  -7.695  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.865   2.419  -7.609  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       1.017   2.703  -6.114  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.898   1.683  -6.194  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.839   4.517  -6.095  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       4.512   4.035  -5.721  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       3.861   3.773  -7.347  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       2.207   2.989  -4.015  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       2.780   1.306  -4.032  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       3.942   2.629  -3.893  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.296  -0.647  -7.058  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.373  -1.613  -6.931  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.694  -0.908  -7.290  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.819  -0.332  -8.376  1.00  0.00           O  
ATOM    138  CB  HIS A  10       4.072  -2.795  -7.869  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.855  -3.623  -7.509  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.441  -3.991  -6.245  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.983  -4.187  -8.403  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.354  -4.773  -6.383  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       1.036  -4.914  -7.677  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.286  -0.082  -7.908  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.422  -1.972  -5.905  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.927  -2.401  -8.877  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.939  -3.456  -7.892  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       2.838  -3.687  -5.368  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       2.026  -4.099  -9.478  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.800  -5.228  -5.571  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.669  -0.899  -6.365  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.968  -0.263  -6.556  1.00  0.00           C  
ATOM    153  C   CYS A  11       9.117  -1.282  -6.652  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.941  -2.476  -6.427  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.214   0.739  -5.420  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.245   2.264  -5.490  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.520  -1.405  -5.509  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.940   0.262  -7.502  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.028   0.247  -4.465  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.263   1.038  -5.429  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.322  -0.811  -6.959  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.449   0.164  -7.192  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      11.089  -1.462  -7.006  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        7                                                                  
HETATM    1  C   ACE A   1       9.607   2.431 -10.054  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.799   1.289  -9.641  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.760   3.258 -10.592  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.279   3.724  -9.757  1.00  0.00           H  
HETATM    5  H2  ACE A   1      11.445   2.602 -11.126  1.00  0.00           H  
HETATM    6  H3  ACE A   1      10.397   4.026 -11.275  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.411   3.021 -10.057  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.174   2.395  -9.602  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.193   2.187 -10.766  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.210   2.925 -11.752  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.558   3.269  -8.503  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.585   3.487  -7.023  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.337   3.952 -10.438  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.396   1.422  -9.170  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.358   4.257  -8.920  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.606   2.839  -8.192  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.294   1.213 -10.607  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.182   0.893 -11.504  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.869   0.862 -10.702  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.887   0.750  -9.475  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.427  -0.422 -12.286  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.765  -0.420 -13.045  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.361  -1.684 -11.413  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.325   0.691  -9.733  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.106   1.696 -12.238  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.639  -0.505 -13.035  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       5.818   0.447 -13.703  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.604  -0.392 -12.349  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.846  -1.324 -13.649  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       3.374  -1.776 -10.960  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       4.532  -2.566 -12.031  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       5.119  -1.644 -10.631  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.730   0.855 -11.403  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.386   1.046 -10.837  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.555  -0.107 -11.198  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.860  -0.330 -12.369  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.178   2.389 -11.322  1.00  0.00           C  
ATOM     38  CG  TRP A   4       0.305   3.569 -10.537  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       1.259   4.448 -10.917  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.149   4.009  -9.221  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       1.433   5.396  -9.925  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.604   5.160  -8.846  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.134   3.558  -8.314  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4       0.415   5.811  -7.617  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.341   4.209  -7.084  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -0.558   5.322  -6.727  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.785   0.809 -12.408  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.424   1.128  -9.746  1.00  0.00           H  
ATOM     49  HB2 TRP A   4       0.053   2.529 -12.379  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.264   2.367 -11.225  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.792   4.413 -11.860  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       2.070   6.175 -10.004  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.742   2.708  -8.583  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       1.003   6.681  -7.364  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.113   3.857  -6.413  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -0.717   5.809  -5.774  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.051  -0.812 -10.181  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -2.117  -1.803 -10.296  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.454  -1.121  -9.973  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.979  -1.211  -8.860  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.813  -3.012  -9.401  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -2.790  -4.172  -9.647  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -2.624  -4.771 -11.045  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -1.730  -5.633 -11.197  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -3.388  -4.351 -11.943  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.836  -0.500  -9.234  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -2.158  -2.158 -11.325  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -0.803  -3.360  -9.621  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.855  -2.716  -8.351  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -2.607  -4.949  -8.905  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -3.815  -3.825  -9.520  1.00  0.00           H  
ATOM     72  N   GLY A   6      -3.965  -0.376 -10.960  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.173   0.446 -10.883  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.141   1.470  -9.745  1.00  0.00           C  
ATOM     75  O   GLY A   6      -4.759   2.619  -9.943  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.435  -0.349 -11.822  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.303   0.984 -11.821  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.038  -0.204 -10.742  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.559   1.034  -8.556  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.731   1.845  -7.353  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.561   1.704  -6.350  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.560   2.389  -5.325  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -7.074   1.431  -6.716  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -7.803   2.583  -6.041  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -8.932   2.902  -6.374  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -7.187   3.237  -5.079  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.710   0.034  -8.491  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.795   2.895  -7.649  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.745   1.042  -7.485  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -6.912   0.637  -5.986  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -6.214   3.021  -4.860  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -7.704   3.989  -4.662  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.598   0.806  -6.626  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.488   0.399  -5.745  1.00  0.00           C  
ATOM     95  C   LYS A   8      -1.147   0.518  -6.492  1.00  0.00           C  
ATOM     96  O   LYS A   8      -1.127   0.388  -7.713  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.698  -1.067  -5.306  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -4.100  -1.415  -4.767  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -4.214  -2.904  -4.403  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -4.393  -3.785  -5.647  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -4.471  -5.211  -5.290  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.688   0.289  -7.497  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.468   1.044  -4.863  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -2.492  -1.712  -6.161  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -1.966  -1.300  -4.530  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -4.297  -0.816  -3.876  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -4.865  -1.185  -5.510  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -3.330  -3.218  -3.846  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -5.089  -3.040  -3.768  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -5.323  -3.499  -6.138  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -3.567  -3.632  -6.343  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -5.038  -5.318  -4.462  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -4.888  -5.729  -6.050  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -3.544  -5.570  -5.110  1.00  0.00           H  
ATOM    115  N   LEU A   9      -0.024   0.687  -5.782  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.315   0.908  -6.369  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.301  -0.213  -5.995  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.253  -0.750  -4.890  1.00  0.00           O  
ATOM    119  CB  LEU A   9       1.777   2.344  -5.998  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.287   2.671  -5.883  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.478   4.192  -5.946  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       3.897   2.209  -4.549  1.00  0.00           C  
ATOM    123  H   LEU A   9      -0.090   0.697  -4.777  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.229   0.883  -7.455  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.361   2.990  -6.771  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       1.306   2.645  -5.062  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.835   2.225  -6.713  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       3.071   4.579  -6.880  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       2.966   4.668  -5.108  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       4.539   4.439  -5.904  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.222   2.435  -3.724  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.094   1.139  -4.567  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       4.845   2.716  -4.366  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.232  -0.519  -6.910  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.341  -1.461  -6.716  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.646  -0.836  -7.232  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.624  -0.156  -8.258  1.00  0.00           O  
ATOM    138  CB  HIS A  10       4.090  -2.771  -7.492  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.774  -3.468  -7.242  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.564  -4.537  -6.397  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.604  -3.235  -7.912  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.286  -4.927  -6.548  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.663  -4.162  -7.455  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.212  -0.016  -7.798  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.442  -1.688  -5.655  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       4.150  -2.562  -8.561  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.895  -3.469  -7.257  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       3.244  -4.965  -5.788  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       1.446  -2.490  -8.679  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.816  -5.750  -6.026  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.802  -1.134  -6.625  1.00  0.00           N  
ATOM    152  CA  CYS A  11       8.090  -0.640  -7.116  1.00  0.00           C  
ATOM    153  C   CYS A  11       9.164  -1.727  -7.010  1.00  0.00           C  
ATOM    154  O   CYS A  11       9.180  -2.504  -6.059  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.530   0.621  -6.350  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.241   1.821  -5.902  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.820  -1.740  -5.818  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.977  -0.370  -8.163  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       9.005   0.303  -5.421  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.291   1.132  -6.942  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.096  -1.771  -7.954  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.076  -1.129  -8.734  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.818  -2.468  -7.862  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        8                                                                  
HETATM    1  C   ACE A   1       9.768   1.998  -9.718  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.888   0.906  -9.168  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      11.007   2.811 -10.084  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.184   3.555  -9.301  1.00  0.00           H  
HETATM    5  H2  ACE A   1      11.872   2.141 -10.149  1.00  0.00           H  
HETATM    6  H3  ACE A   1      10.871   3.308 -11.047  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.581   2.550 -10.007  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.299   1.999  -9.567  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.227   2.037 -10.673  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.264   2.878 -11.574  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.822   2.767  -8.322  1.00  0.00           C  
ATOM     12  SG  CYS A   2       8.019   2.963  -6.962  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.567   3.422 -10.512  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.447   0.955  -9.306  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.538   3.772  -8.640  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.927   2.280  -7.932  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.237   1.140 -10.567  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.151   0.921 -11.529  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.792   0.828 -10.824  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.646   0.127  -9.819  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.403  -0.338 -12.399  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.627  -0.136 -13.307  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.603  -1.649 -11.619  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.271   0.507  -9.767  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.124   1.777 -12.198  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.538  -0.467 -13.051  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       5.533   0.808 -13.854  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.543  -0.117 -12.708  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.688  -0.959 -14.028  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       5.459  -1.575 -10.950  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       3.713  -1.882 -11.041  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       4.775  -2.466 -12.319  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.785   1.536 -11.356  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.405   1.461 -10.860  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.274   0.133 -11.248  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.082  -0.385 -12.346  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.422   2.644 -11.391  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.268   3.918 -10.617  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.446   5.002 -11.001  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.868   4.270  -9.333  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.342   5.988 -10.037  1.00  0.00           N  
ATOM     42  CE2 TRP A   4      -0.466   5.593  -8.991  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.727   3.610  -8.428  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.896   6.233  -7.816  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -2.145   4.227  -7.234  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -1.738   5.537  -6.930  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.964   2.107 -12.167  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.423   1.531  -9.771  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.189   2.813 -12.444  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.476   2.374 -11.340  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.001   5.084 -11.930  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       0.783   6.895 -10.109  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -2.068   2.618  -8.665  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4      -0.587   7.247  -7.601  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.783   3.699  -6.540  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -2.084   6.017  -6.022  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.151  -0.352 -10.361  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -2.038  -1.498 -10.559  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.455  -1.123 -10.089  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.819  -1.356  -8.936  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.469  -2.713  -9.806  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -2.273  -4.003 -10.031  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -1.864  -5.062  -9.008  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -2.463  -5.053  -7.909  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -0.948  -5.847  -9.335  1.00  0.00           O  
ATOM     66  H   GLU A   5      -1.147   0.072  -9.432  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -2.082  -1.742 -11.620  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -0.445  -2.883 -10.140  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.451  -2.484  -8.739  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -3.342  -3.813  -9.929  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -2.091  -4.372 -11.044  1.00  0.00           H  
ATOM     72  N   GLY A   6      -4.253  -0.500 -10.969  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.645  -0.089 -10.735  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.817   1.008  -9.681  1.00  0.00           C  
ATOM     75  O   GLY A   6      -6.271   2.106  -9.984  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.871  -0.318 -11.886  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -6.077   0.267 -11.671  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.219  -0.959 -10.414  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.493   0.685  -8.427  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.597   1.522  -7.232  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.403   1.377  -6.254  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.433   1.986  -5.192  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.949   1.213  -6.545  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -8.066   2.210  -6.849  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -8.867   2.541  -5.990  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -8.178   2.715  -8.062  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.115  -0.255  -8.334  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.598   2.573  -7.534  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.297   0.214  -6.808  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -6.820   1.222  -5.462  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -7.514   2.519  -8.816  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -8.945   3.356  -8.172  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.348   0.618  -6.605  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.128   0.402  -5.799  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.887   0.748  -6.614  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.914   0.658  -7.842  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.021  -1.060  -5.303  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -3.304  -1.694  -4.729  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -4.200  -2.313  -5.817  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -5.348  -3.133  -5.236  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -6.314  -3.495  -6.290  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.394   0.111  -7.480  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.124   1.054  -4.923  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -1.650  -1.691  -6.114  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -1.265  -1.074  -4.514  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -3.007  -2.491  -4.046  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -3.866  -0.952  -4.159  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -4.642  -1.527  -6.421  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -3.602  -2.954  -6.465  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -4.948  -4.039  -4.780  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -5.856  -2.544  -4.473  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -6.679  -2.651  -6.708  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -5.846  -4.043  -6.998  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -7.071  -4.030  -5.890  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.215   1.079  -5.939  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.521   1.354  -6.541  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.528   0.288  -6.087  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.713   0.100  -4.887  1.00  0.00           O  
ATOM    119  CB  LEU A   9       1.948   2.784  -6.157  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.261   3.255  -6.816  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.165   3.293  -8.345  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       3.619   4.665  -6.348  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.159   1.116  -4.930  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.436   1.312  -7.626  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.151   3.476  -6.436  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.065   2.831  -5.075  1.00  0.00           H  
ATOM    127  HG  LEU A   9       4.072   2.587  -6.527  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.177   3.648  -8.658  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       3.933   3.950  -8.765  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       3.338   2.287  -8.716  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.721   4.683  -5.265  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.568   4.966  -6.792  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       2.840   5.365  -6.656  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.165  -0.401  -7.038  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.158  -1.445  -6.776  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.544  -0.961  -7.234  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.672  -0.391  -8.309  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.732  -2.724  -7.505  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.483  -3.328  -6.916  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.423  -4.130  -5.798  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.202  -3.116  -7.350  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.125  -4.394  -5.565  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.347  -3.804  -6.485  1.00  0.00           N  
ATOM    144  H   HIS A  10       2.960  -0.186  -8.012  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.199  -1.653  -5.707  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.560  -2.500  -8.558  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.539  -3.454  -7.446  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       3.200  -4.459  -5.245  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       0.913  -2.512  -8.197  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.747  -5.010  -4.757  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.586  -1.198  -6.428  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.943  -0.707  -6.692  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.918  -1.869  -6.898  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.996  -2.786  -6.085  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.375   0.234  -5.561  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.379   1.756  -5.435  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.448  -1.710  -5.573  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.940  -0.129  -7.609  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.314  -0.310  -4.614  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.420   0.518  -5.727  1.00  0.00           H  
HETATM  161  N   NH2 A  12       9.668  -1.838  -7.996  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12       9.633  -1.038  -8.621  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.282  -2.613  -8.174  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        9                                                                  
HETATM    1  C   ACE A   1       9.874   1.737  -9.756  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.966   0.848  -8.908  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      11.117   2.236 -10.455  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.276   3.285 -10.206  1.00  0.00           H  
HETATM    5  H2  ACE A   1      11.972   1.652 -10.119  1.00  0.00           H  
HETATM    6  H3  ACE A   1      11.001   2.118 -11.532  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.720   2.302 -10.124  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.404   1.915  -9.625  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.349   1.890 -10.745  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.471   2.614 -11.730  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.939   2.900  -8.540  1.00  0.00           C  
ATOM     12  SG  CYS A   2       8.026   3.189  -7.122  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.738   3.005 -10.851  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.474   0.918  -9.204  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.773   3.865  -9.018  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.981   2.557  -8.151  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.274   1.124 -10.537  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.144   0.993 -11.465  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.800   0.941 -10.732  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.692   0.359  -9.653  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.277  -0.246 -12.376  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.190   0.061 -13.570  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.779  -1.508 -11.656  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.255   0.558  -9.690  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.138   1.878 -12.095  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.289  -0.467 -12.787  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       4.914   1.017 -14.016  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.231   0.110 -13.246  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.079  -0.717 -14.323  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       4.158  -1.712 -10.785  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       4.730  -2.359 -12.334  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       5.813  -1.376 -11.336  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.774   1.527 -11.359  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.381   1.526 -10.901  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.382   0.301 -11.413  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.257  -0.080 -12.577  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.326   2.793 -11.401  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.103   4.014 -10.566  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.715   5.047 -10.871  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.727   4.355  -9.289  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.643   6.000  -9.873  1.00  0.00           N  
ATOM     42  CE2 TRP A   4      -0.237   5.629  -8.878  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.670   3.724  -8.447  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.657   6.247  -7.690  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -2.095   4.332  -7.249  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -1.593   5.591  -6.872  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.944   1.929 -12.266  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.354   1.535  -9.811  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.032   2.995 -12.433  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.403   2.613 -11.410  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.318   5.115 -11.767  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       1.166   6.864  -9.886  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -2.071   2.764  -8.735  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4      -0.268   7.216  -7.413  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.817   3.837  -6.616  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.932   6.056  -5.957  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.248  -0.255 -10.562  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -2.162  -1.347 -10.877  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.536  -1.084 -10.231  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.774  -1.396  -9.063  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.516  -2.679 -10.451  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -2.203  -3.923 -11.037  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -2.167  -4.003 -12.571  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -1.168  -3.540 -13.165  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -3.144  -4.548 -13.127  1.00  0.00           O  
ATOM     66  H   GLU A   5      -1.215   0.059  -9.591  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -2.302  -1.374 -11.959  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -0.473  -2.684 -10.772  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.518  -2.751  -9.363  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -1.697  -4.806 -10.643  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -3.238  -3.952 -10.699  1.00  0.00           H  
ATOM     72  N   GLY A   6      -4.435  -0.442 -10.992  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.825  -0.156 -10.614  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.954   0.900  -9.517  1.00  0.00           C  
ATOM     75  O   GLY A   6      -6.325   2.036  -9.797  1.00  0.00           O  
ATOM     76  H   GLY A   6      -4.140  -0.139 -11.908  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -6.361   0.207 -11.491  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.307  -1.075 -10.279  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.646   0.522  -8.272  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.704   1.399  -7.100  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.448   1.326  -6.211  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.482   1.831  -5.086  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -7.010   1.135  -6.321  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -7.038  -0.194  -5.579  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -7.736  -1.124  -5.947  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -6.282  -0.313  -4.506  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.301  -0.430  -8.182  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.749   2.431  -7.451  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.151   1.931  -5.590  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.855   1.169  -7.009  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -5.665   0.453  -4.247  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -6.325  -1.193  -4.024  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.366   0.674  -6.665  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.139   0.486  -5.881  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.882   0.730  -6.720  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.890   0.518  -7.929  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.183  -0.927  -5.276  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -0.994  -1.231  -4.345  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -1.352  -2.231  -3.238  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -2.195  -1.533  -2.162  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -2.675  -2.470  -1.133  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.406   0.233  -7.579  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.130   1.209  -5.065  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -3.115  -1.020  -4.718  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -2.203  -1.671  -6.078  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -0.180  -1.635  -4.945  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -0.644  -0.312  -3.873  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -1.896  -3.076  -3.663  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -0.432  -2.593  -2.781  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -1.582  -0.768  -1.685  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -3.055  -1.051  -2.625  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -1.902  -3.025  -0.792  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -3.075  -1.946  -0.368  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -3.380  -3.076  -1.527  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.193   1.151  -6.050  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.542   1.302  -6.593  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.423   0.152  -6.083  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.360  -0.202  -4.905  1.00  0.00           O  
ATOM    119  CB  LEU A   9       2.091   2.672  -6.141  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.408   3.095  -6.820  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.154   3.634  -8.230  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       4.091   4.194  -6.002  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.104   1.256  -5.053  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.498   1.274  -7.681  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.342   3.442  -6.333  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.252   2.629  -5.062  1.00  0.00           H  
ATOM    127  HG  LEU A   9       4.087   2.245  -6.876  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.652   2.882  -8.832  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       2.520   4.519  -8.181  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       4.095   3.898  -8.708  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.411   5.033  -5.858  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.383   3.796  -5.029  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       4.989   4.540  -6.515  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.282  -0.386  -6.952  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.302  -1.382  -6.615  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.670  -0.915  -7.131  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.738  -0.358  -8.228  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.912  -2.734  -7.234  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.546  -3.242  -6.834  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.247  -3.985  -5.711  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.386  -3.083  -7.545  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       0.933  -4.276  -5.757  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.368  -3.743  -6.850  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.230  -0.080  -7.923  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.361  -1.497  -5.532  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.936  -2.640  -8.321  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.659  -3.477  -6.955  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       2.890  -4.265  -4.988  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       1.280  -2.556  -8.482  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.398  -4.861  -5.022  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.754  -1.143  -6.375  1.00  0.00           N  
ATOM    152  CA  CYS A  11       8.116  -0.697  -6.702  1.00  0.00           C  
ATOM    153  C   CYS A  11       9.164  -1.812  -6.547  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.884  -2.883  -6.018  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.513   0.492  -5.810  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.367   1.890  -5.702  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.647  -1.652  -5.509  1.00  0.00           H  
ATOM    158  HA  CYS A  11       8.148  -0.377  -7.741  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.667   0.117  -4.798  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.470   0.883  -6.158  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.399  -1.551  -6.963  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.607  -0.667  -7.413  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      11.104  -2.260  -6.839  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       10                                                                  
HETATM    1  C   ACE A   1       9.674   2.205  -9.591  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.833   1.143  -8.986  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.869   3.080  -9.919  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.168   2.915 -10.952  1.00  0.00           H  
HETATM    5  H2  ACE A   1      10.612   4.127  -9.766  1.00  0.00           H  
HETATM    6  H3  ACE A   1      11.693   2.817  -9.257  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.475   2.639 -10.008  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.214   1.999  -9.641  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.171   2.019 -10.768  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.184   2.913 -11.621  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.633   2.694  -8.398  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.762   3.064  -7.018  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.429   3.491 -10.542  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.423   0.963  -9.406  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.208   3.647  -8.716  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.813   2.091  -8.010  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.193   1.105 -10.692  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.002   1.071 -11.539  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.722   1.051 -10.691  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.724   0.632  -9.533  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.006  -0.107 -12.545  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.019   0.124 -13.672  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.240  -1.494 -11.922  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.222   0.462  -9.903  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.001   1.989 -12.118  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.022  -0.135 -13.014  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       4.778   1.047 -14.199  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.029   0.198 -13.267  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       4.977  -0.704 -14.381  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       3.720  -1.582 -10.970  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       3.855  -2.257 -12.599  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       5.306  -1.670 -11.767  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.614   1.477 -11.303  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.264   1.453 -10.739  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.471   0.184 -11.189  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.512  -0.130 -12.379  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.472   2.725 -11.196  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.114   3.974 -10.442  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.610   5.016 -10.912  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.487   4.332  -9.078  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.727   5.980  -9.927  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.093   5.596  -8.766  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.276   3.724  -8.076  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.039   6.195  -7.504  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.440   4.329  -6.815  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -0.797   5.543  -6.517  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.688   1.741 -12.271  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.314   1.456  -9.650  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.289   2.886 -12.261  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.546   2.574 -11.077  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.021   5.092 -11.911  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       1.209   6.860 -10.055  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.761   2.784  -8.293  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.429   7.146  -7.299  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.055   3.856  -6.063  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -0.901   5.981  -5.534  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.104  -0.520 -10.245  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -1.959  -1.681 -10.483  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.397  -1.312 -10.080  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.829  -1.516  -8.940  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.383  -2.924  -9.773  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -2.026  -4.229 -10.270  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -1.516  -5.465  -9.521  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -0.281  -5.574  -9.345  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -2.373  -6.297  -9.151  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.996  -0.225  -9.275  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -1.960  -1.902 -11.551  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -0.313  -2.972  -9.983  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.520  -2.835  -8.696  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -3.108  -4.162 -10.148  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -1.811  -4.354 -11.333  1.00  0.00           H  
ATOM     72  N   GLY A   6      -4.110  -0.662 -11.011  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.445  -0.090 -10.812  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.422   1.113  -9.864  1.00  0.00           C  
ATOM     75  O   GLY A   6      -5.541   2.256 -10.302  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.651  -0.467 -11.890  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.834   0.243 -11.774  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.118  -0.853 -10.419  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.263   0.863  -8.559  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.120   1.927  -7.562  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.135   1.627  -6.419  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.119   2.368  -5.443  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.523   2.360  -7.070  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -6.651   3.873  -6.994  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -7.004   4.448  -5.978  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -6.393   4.552  -8.097  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.137  -0.111  -8.301  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -4.658   2.771  -8.075  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.293   2.011  -7.757  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -6.725   1.933  -6.088  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -6.131   4.071  -8.948  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -6.461   5.551  -8.016  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.333   0.555  -6.522  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.195   0.256  -5.629  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.890   0.486  -6.395  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.799   0.159  -7.579  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.325  -1.194  -5.126  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -1.478  -1.530  -3.883  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -1.614  -0.559  -2.695  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -3.072  -0.351  -2.271  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -3.170   0.576  -1.131  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.418  -0.033  -7.346  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.168   0.923  -4.763  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -3.372  -1.386  -4.882  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -2.051  -1.878  -5.932  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -1.775  -2.522  -3.542  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -0.428  -1.582  -4.169  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -1.059  -0.966  -1.850  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -1.169   0.403  -2.949  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -3.638   0.059  -3.109  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -3.502  -1.313  -1.991  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -2.604   0.232  -0.368  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -2.839   1.490  -1.409  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -4.132   0.646  -0.832  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.104   1.092  -5.743  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.442   1.252  -6.309  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.283   0.013  -5.983  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.210  -0.531  -4.881  1.00  0.00           O  
ATOM    119  CB  LEU A   9       2.098   2.526  -5.744  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.329   2.989  -6.552  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       2.926   3.702  -7.846  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       4.189   3.942  -5.720  1.00  0.00           C  
ATOM    123  H   LEU A   9      -0.032   1.336  -4.774  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.352   1.345  -7.391  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.366   3.334  -5.727  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.398   2.320  -4.715  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.944   2.128  -6.808  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.281   3.065  -8.450  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       2.396   4.621  -7.607  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       3.812   3.946  -8.431  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.580   4.754  -5.322  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.643   3.394  -4.895  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       4.986   4.360  -6.335  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.125  -0.389  -6.932  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.089  -1.476  -6.814  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.453  -0.989  -7.319  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.539  -0.420  -8.403  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.558  -2.672  -7.620  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.366  -3.340  -6.978  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.409  -4.418  -6.121  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.052  -2.974  -7.112  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.146  -4.684  -5.738  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.286  -3.832  -6.317  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.082   0.068  -7.844  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.187  -1.773  -5.764  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.273  -2.324  -8.615  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.354  -3.408  -7.737  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       3.231  -4.933  -5.848  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       0.674  -2.156  -7.708  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.857  -5.478  -5.062  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.516  -1.161  -6.523  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.850  -0.627  -6.818  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.893  -1.734  -6.999  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.773  -2.822  -6.445  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.270   0.346  -5.710  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.224   1.811  -5.502  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.417  -1.696  -5.672  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.818  -0.071  -7.750  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.281  -0.198  -4.765  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.287   0.685  -5.907  1.00  0.00           H  
HETATM  161  N   NH2 A  12       9.950  -1.441  -7.747  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.013  -0.530  -8.194  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.652  -2.148  -7.891  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       11                                                                  
HETATM    1  C   ACE A   1       9.637   2.140  -9.629  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.756   1.213  -8.829  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.875   2.723 -10.275  1.00  0.00           C  
HETATM    4  H1  ACE A   1      10.964   2.325 -11.285  1.00  0.00           H  
HETATM    5  H2  ACE A   1      10.809   3.808 -10.299  1.00  0.00           H  
HETATM    6  H3  ACE A   1      11.748   2.428  -9.695  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.465   2.656 -10.009  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.165   2.177  -9.539  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.102   2.205 -10.657  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.035   3.168 -11.418  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.695   3.014  -8.337  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.800   3.169  -6.901  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.456   3.387 -10.705  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.292   1.151  -9.226  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.495   4.025  -8.693  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.752   2.600  -7.985  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.246   1.175 -10.719  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.102   1.027 -11.639  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.804   0.734 -10.875  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.800   0.024  -9.869  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.331  -0.074 -12.702  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.197   0.438 -13.857  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.941  -1.367 -12.139  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.346   0.462  -9.995  1.00  0.00           H  
ATOM     25  HA  VAL A   3       3.959   1.970 -12.168  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.360  -0.330 -13.130  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       6.169   0.767 -13.488  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       5.340  -0.356 -14.590  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       4.698   1.274 -14.348  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       4.369  -1.708 -11.276  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       4.912  -2.145 -12.904  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       5.977  -1.204 -11.844  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.689   1.301 -11.349  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.358   1.137 -10.760  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.320  -0.173 -11.198  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.295  -0.536 -12.371  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.525   2.333 -11.154  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.235   3.632 -10.461  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.613   4.596 -10.891  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.814   4.139  -9.217  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.592   5.661 -10.007  1.00  0.00           N  
ATOM     42  CE2 TRP A   4      -0.269   5.430  -8.953  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.744   3.635  -8.284  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.621   6.179  -7.820  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -2.094   4.367  -7.133  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -1.537   5.637  -6.901  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.755   1.857 -12.187  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.447   1.126  -9.674  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.465   2.485 -12.233  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.562   2.083 -10.928  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.206   4.546 -11.794  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       1.141   6.499 -10.125  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -2.197   2.674  -8.469  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4      -0.192   7.156  -7.654  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.798   3.953  -6.425  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.819   6.195  -6.019  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.001  -0.832 -10.255  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -1.904  -1.980 -10.461  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.372  -1.519 -10.621  1.00  0.00           C  
ATOM     60  O   GLU A   5      -4.275  -2.326 -10.819  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.720  -2.939  -9.263  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -2.306  -4.362  -9.357  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -1.532  -5.316 -10.276  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -1.036  -4.858 -11.328  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -1.458  -6.511  -9.913  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.949  -0.467  -9.305  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -1.619  -2.491 -11.380  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -0.654  -3.056  -9.097  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -2.141  -2.457  -8.378  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -2.285  -4.784  -8.349  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -3.349  -4.334  -9.662  1.00  0.00           H  
ATOM     72  N   GLY A   6      -3.612  -0.204 -10.543  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -4.908   0.460 -10.658  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.094   1.439  -9.504  1.00  0.00           C  
ATOM     75  O   GLY A   6      -4.729   2.605  -9.617  1.00  0.00           O  
ATOM     76  H   GLY A   6      -2.795   0.377 -10.422  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -4.946   1.011 -11.598  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -5.719  -0.271 -10.649  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.605   0.948  -8.370  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.780   1.710  -7.128  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.576   1.601  -6.166  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.615   2.147  -5.064  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -7.050   1.185  -6.438  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -6.822  -0.195  -5.836  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -6.676  -1.177  -6.545  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -6.714  -0.292  -4.527  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.872  -0.030  -8.346  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.921   2.766  -7.367  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.344   1.880  -5.652  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.865   1.124  -7.159  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -6.715   0.529  -3.944  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -6.521  -1.215  -4.178  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.542   0.856  -6.568  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.392   0.430  -5.769  1.00  0.00           C  
ATOM     95  C   LYS A   8      -1.109   0.598  -6.585  1.00  0.00           C  
ATOM     96  O   LYS A   8      -1.126   0.386  -7.797  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.645  -1.039  -5.376  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -1.478  -1.696  -4.628  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -1.848  -3.105  -4.155  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -0.675  -3.688  -3.364  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -1.079  -4.867  -2.582  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.595   0.489  -7.507  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.324   1.040  -4.866  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -3.534  -1.075  -4.744  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -2.852  -1.621  -6.276  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -0.611  -1.764  -5.287  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -1.223  -1.083  -3.762  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -2.730  -3.053  -3.516  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -2.060  -3.745  -5.014  1.00  0.00           H  
ATOM    110  HE2 LYS A   8       0.120  -3.963  -4.056  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -0.298  -2.928  -2.679  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -1.463  -5.570  -3.197  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -0.276  -5.242  -2.097  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -1.779  -4.595  -1.906  1.00  0.00           H  
ATOM    115  N   LEU A   9      -0.004   0.951  -5.926  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.317   1.104  -6.539  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.230  -0.078  -6.177  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.184  -0.571  -5.050  1.00  0.00           O  
ATOM    119  CB  LEU A   9       1.912   2.437  -6.045  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.167   2.904  -6.807  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       2.832   3.270  -8.253  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       3.769   4.129  -6.121  1.00  0.00           C  
ATOM    123  H   LEU A   9      -0.070   1.090  -4.931  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.208   1.144  -7.622  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.152   3.218  -6.122  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.167   2.326  -4.989  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.915   2.113  -6.803  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       1.913   3.849  -8.285  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       3.636   3.850  -8.706  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       2.698   2.364  -8.830  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.046   4.944  -6.104  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.056   3.872  -5.101  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       4.662   4.452  -6.656  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.104  -0.481  -7.105  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.187  -1.440  -6.873  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.517  -0.827  -7.298  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.569  -0.112  -8.293  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.945  -2.730  -7.663  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.731  -3.479  -7.194  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.725  -4.591  -6.387  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.433  -3.140  -7.453  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.440  -4.916  -6.166  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.617  -4.061  -6.791  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.061  -0.084  -8.043  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.244  -1.684  -5.812  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.835  -2.498  -8.724  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.815  -3.380  -7.553  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       3.534  -5.070  -6.023  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       1.113  -2.294  -8.045  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       1.106  -5.747  -5.560  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.593  -1.142  -6.574  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.927  -0.591  -6.804  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.981  -1.700  -6.920  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.805  -2.805  -6.413  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.254   0.388  -5.673  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.143   1.817  -5.516  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.497  -1.788  -5.805  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.939  -0.043  -7.739  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.227  -0.161  -4.731  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.268   0.765  -5.808  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.100  -1.406  -7.569  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.207  -0.492  -8.001  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.798  -2.126  -7.669  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       12                                                                  
HETATM    1  C   ACE A   1       9.668   2.047  -9.776  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.809   1.038  -9.087  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.856   2.684 -10.469  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.771   2.267 -10.060  1.00  0.00           H  
HETATM    5  H2  ACE A   1      10.795   2.460 -11.527  1.00  0.00           H  
HETATM    6  H3  ACE A   1      10.843   3.762 -10.316  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.490   2.625 -10.013  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.221   2.114  -9.522  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.160   2.190 -10.628  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.133   3.151 -11.400  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.777   2.896  -8.277  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.918   2.908  -6.858  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.444   3.405 -10.652  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.356   1.080  -9.244  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.609   3.936  -8.571  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.821   2.496  -7.936  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.272   1.190 -10.684  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.078   1.152 -11.541  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.822   1.158 -10.677  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.867   0.868  -9.485  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.096  -0.046 -12.523  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.242   0.077 -13.538  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.158  -1.416 -11.834  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.319   0.509  -9.925  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.059   2.062 -12.147  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.168  -0.018 -13.098  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       6.199   0.159 -13.025  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       5.260  -0.800 -14.186  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.087   0.961 -14.154  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       3.288  -1.548 -11.192  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       4.140  -2.206 -12.588  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       5.067  -1.510 -11.245  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.681   1.444 -11.294  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.367   1.414 -10.654  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.414   0.181 -11.104  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.628  -0.015 -12.296  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.405   2.695 -10.997  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.013   3.893 -10.193  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.807   4.888 -10.598  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.460   4.256  -8.855  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.897   5.841  -9.599  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.119   5.508  -8.508  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.321   3.660  -7.910  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.152   6.150  -7.291  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.609   4.296  -6.686  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -1.026   5.536  -6.376  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.695   1.635 -12.282  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.462   1.386  -9.555  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.295   2.908 -12.059  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.464   2.514 -10.809  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.298   4.936 -11.561  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       1.447   6.687  -9.681  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.774   2.708  -8.149  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.294   7.109  -7.066  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.282   3.832  -5.980  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.259   6.022  -5.439  1.00  0.00           H  
ATOM     57  N   GLU A   5      -0.865  -0.629 -10.147  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -1.804  -1.721 -10.378  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.196  -1.264  -9.923  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.559  -1.333  -8.745  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.322  -3.023  -9.721  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -2.257  -4.213  -9.981  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -2.519  -4.460 -11.472  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -3.479  -3.849 -11.994  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -1.753  -5.250 -12.066  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.680  -0.397  -9.168  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -1.845  -1.908 -11.449  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -0.333  -3.265 -10.112  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.244  -2.873  -8.644  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -1.809  -5.110  -9.549  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -3.209  -4.044  -9.476  1.00  0.00           H  
ATOM     72  N   GLY A   6      -3.953  -0.729 -10.886  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.341  -0.290 -10.752  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.502   0.948  -9.868  1.00  0.00           C  
ATOM     75  O   GLY A   6      -5.732   2.044 -10.372  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.526  -0.648 -11.797  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.726  -0.049 -11.743  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -5.939  -1.102 -10.338  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.380   0.764  -8.550  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.473   1.820  -7.540  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.405   1.693  -6.428  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.562   2.308  -5.372  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.919   1.863  -6.994  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -7.302   0.679  -6.116  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -8.113  -0.156  -6.479  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -6.736   0.582  -4.933  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.136  -0.184  -8.273  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.288   2.775  -8.028  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.052   2.774  -6.413  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.616   1.908  -7.835  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -6.030   1.265  -4.665  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -7.009  -0.202  -4.370  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.376   0.844  -6.611  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.273   0.574  -5.670  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.919   0.578  -6.396  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.791   0.042  -7.497  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.561  -0.781  -5.002  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -1.425  -1.236  -4.071  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -1.868  -2.346  -3.111  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -2.768  -1.756  -2.021  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -2.956  -2.688  -0.898  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.367   0.291  -7.466  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.210   1.333  -4.890  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -3.486  -0.685  -4.434  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -2.712  -1.545  -5.768  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -0.598  -1.606  -4.679  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -1.068  -0.388  -3.485  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -2.396  -3.132  -3.655  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -0.979  -2.774  -2.647  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -2.303  -0.847  -1.643  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -3.740  -1.503  -2.447  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -2.053  -3.013  -0.581  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -3.424  -2.210  -0.143  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -3.513  -3.475  -1.197  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.091   1.209  -5.790  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.443   1.312  -6.331  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.271   0.039  -6.028  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.268  -0.457  -4.899  1.00  0.00           O  
ATOM    119  CB  LEU A   9       2.081   2.566  -5.708  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.459   2.969  -6.277  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.320   4.008  -7.395  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       4.324   3.553  -5.156  1.00  0.00           C  
ATOM    123  H   LEU A   9      -0.087   1.634  -4.896  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.388   1.432  -7.409  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.398   3.409  -5.831  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.177   2.390  -4.635  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.970   2.095  -6.673  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.761   4.873  -7.039  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       4.305   4.342  -7.718  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       2.802   3.566  -8.246  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.792   4.355  -4.644  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.560   2.764  -4.440  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       5.257   3.940  -5.562  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.009  -0.446  -7.032  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.025  -1.498  -6.951  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.388  -0.905  -7.328  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.463  -0.067  -8.222  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.696  -2.622  -7.946  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.602  -3.558  -7.506  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.769  -4.874  -7.137  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.264  -3.278  -7.473  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.549  -5.379  -6.888  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.605  -4.445  -7.076  1.00  0.00           N  
ATOM    144  H   HIS A  10       2.964   0.048  -7.920  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.075  -1.905  -5.941  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.419  -2.183  -8.906  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.595  -3.218  -8.111  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       3.641  -5.375  -7.083  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       0.806  -2.335  -7.733  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       1.348  -6.398  -6.587  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.477  -1.380  -6.716  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.828  -0.861  -6.953  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.844  -1.984  -7.195  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.615  -3.140  -6.850  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.230   0.029  -5.773  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.218   1.518  -5.528  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.386  -2.134  -6.052  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.836  -0.248  -7.847  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.174  -0.568  -4.862  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.266   0.347  -5.898  1.00  0.00           H  
HETATM  161  N   NH2 A  12       9.989  -1.646  -7.778  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.135  -0.693  -8.099  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.665  -2.370  -7.951  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       13                                                                  
HETATM    1  C   ACE A   1       9.949   1.670  -9.997  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.982   0.576  -9.437  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      11.240   2.337 -10.422  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.982   2.181  -9.641  1.00  0.00           H  
HETATM    5  H2  ACE A   1      11.588   1.888 -11.350  1.00  0.00           H  
HETATM    6  H3  ACE A   1      11.091   3.407 -10.558  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.824   2.346 -10.251  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.509   1.985  -9.733  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.438   1.912 -10.828  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.582   2.466 -11.916  1.00  0.00           O  
ATOM     11  CB  CYS A   2       7.100   2.981  -8.634  1.00  0.00           C  
ATOM     12  SG  CYS A   2       8.274   3.190  -7.264  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.881   3.192 -10.796  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.570   0.998  -9.291  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.965   3.955  -9.103  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       6.135   2.687  -8.216  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.341   1.239 -10.486  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.158   0.957 -11.299  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.893   1.255 -10.487  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.964   1.493  -9.278  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.167  -0.512 -11.780  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.313  -0.775 -12.766  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.260  -1.523 -10.626  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.329   0.846  -9.546  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.159   1.614 -12.170  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.234  -0.704 -12.313  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       6.272  -0.514 -12.318  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       5.332  -1.828 -13.042  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.167  -0.175 -13.664  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       3.542  -1.275  -9.846  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       4.034  -2.522 -10.997  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       5.265  -1.524 -10.203  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.733   1.193 -11.146  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.397   1.242 -10.560  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.464   0.162 -11.222  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.364  -0.057 -12.428  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.240   2.622 -10.788  1.00  0.00           C  
ATOM     38  CG  TRP A   4       0.263   3.749  -9.939  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       1.308   4.557 -10.227  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.265   4.219  -8.661  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       1.456   5.500  -9.227  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.514   5.334  -8.232  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.308   3.795  -7.807  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4       0.287   5.982  -7.007  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.556   4.444  -6.582  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -0.754   5.527  -6.177  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.751   0.921 -12.119  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.439   1.044  -9.492  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.126   2.893 -11.839  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.310   2.536 -10.597  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.925   4.473 -11.113  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       2.181   6.202  -9.222  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.914   2.952  -8.103  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.909   6.810  -6.701  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.368   4.108  -5.951  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -0.939   6.009  -5.227  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.332  -0.480 -10.438  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -2.271  -1.508 -10.896  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.680  -1.186 -10.387  1.00  0.00           C  
ATOM     60  O   GLU A   5      -4.102  -1.626  -9.317  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.788  -2.928 -10.534  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -1.169  -3.081  -9.135  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -0.836  -4.540  -8.827  1.00  0.00           C  
ATOM     64  OE1 GLU A   5       0.281  -4.962  -9.200  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -1.701  -5.210  -8.225  1.00  0.00           O  
ATOM     66  H   GLU A   5      -1.296  -0.284  -9.438  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -2.323  -1.480 -11.985  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -2.633  -3.612 -10.629  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.042  -3.230 -11.269  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -0.249  -2.496  -9.078  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -1.863  -2.705  -8.385  1.00  0.00           H  
ATOM     72  N   GLY A   6      -4.400  -0.356 -11.152  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.772   0.063 -10.868  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.860   1.053  -9.705  1.00  0.00           C  
ATOM     75  O   GLY A   6      -6.180   2.218  -9.921  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.959   0.026 -11.977  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -6.192   0.538 -11.755  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.380  -0.812 -10.632  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.581   0.588  -8.482  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.769   1.349  -7.244  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.573   1.309  -6.270  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.678   1.889  -5.189  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -7.080   0.892  -6.577  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -6.978  -0.480  -5.928  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -7.253  -1.501  -6.537  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -6.576  -0.539  -4.676  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.300  -0.391  -8.440  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.895   2.401  -7.504  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.365   1.616  -5.814  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.879   0.866  -7.318  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -6.278   0.293  -4.189  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -6.554  -1.459  -4.273  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.458   0.640  -6.614  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.258   0.566  -5.761  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.947   0.598  -6.556  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.899   0.103  -7.685  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.356  -0.674  -4.846  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -2.369  -2.022  -5.586  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -2.800  -3.166  -4.656  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -2.290  -4.498  -5.205  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -2.614  -5.622  -4.314  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.445   0.145  -7.497  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.252   1.443  -5.114  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -1.509  -0.671  -4.157  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -3.267  -0.588  -4.252  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -3.059  -1.989  -6.429  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -1.364  -2.219  -5.963  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -2.393  -3.011  -3.657  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -3.890  -3.190  -4.600  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -2.747  -4.673  -6.178  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -1.207  -4.442  -5.326  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -3.601  -5.610  -4.101  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -2.380  -6.491  -4.773  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -2.082  -5.542  -3.458  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.107   1.166  -5.951  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.463   1.284  -6.499  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.399   0.217  -5.928  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.335  -0.120  -4.748  1.00  0.00           O  
ATOM    119  CB  LEU A   9       2.000   2.723  -6.280  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.534   2.947  -6.226  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.929   4.275  -6.878  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       4.041   2.952  -4.780  1.00  0.00           C  
ATOM    123  H   LEU A   9      -0.026   1.527  -5.018  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.402   1.115  -7.570  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.626   3.300  -7.114  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       1.560   3.142  -5.375  1.00  0.00           H  
ATOM    127  HG  LEU A   9       4.061   2.176  -6.779  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       3.279   5.076  -6.527  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       4.965   4.516  -6.637  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       3.838   4.175  -7.960  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.703   2.061  -4.254  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       5.131   2.964  -4.773  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       3.671   3.834  -4.257  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.337  -0.222  -6.768  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.407  -1.148  -6.413  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.730  -0.702  -7.042  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.711   0.019  -8.037  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.997  -2.561  -6.850  1.00  0.00           C  
ATOM    139  CG  HIS A  10       3.021  -3.157  -5.873  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       3.367  -3.804  -4.710  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.661  -2.997  -5.877  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       2.235  -4.020  -4.019  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       1.170  -3.559  -4.693  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.384   0.220  -7.683  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.518  -1.140  -5.330  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.552  -2.532  -7.846  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.879  -3.202  -6.894  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       4.301  -4.044  -4.417  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       1.084  -2.464  -6.619  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       2.188  -4.489  -3.046  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.873  -1.146  -6.504  1.00  0.00           N  
ATOM    152  CA  CYS A  11       8.198  -0.807  -7.033  1.00  0.00           C  
ATOM    153  C   CYS A  11       9.125  -2.028  -7.069  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.975  -2.962  -6.288  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.824   0.330  -6.208  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.782   1.781  -5.869  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.848  -1.765  -5.707  1.00  0.00           H  
ATOM    158  HA  CYS A  11       8.093  -0.474  -8.060  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       9.121  -0.085  -5.244  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.732   0.669  -6.709  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.110  -2.015  -7.961  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.214  -1.224  -8.590  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.714  -2.819  -8.015  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       14                                                                  
HETATM    1  C   ACE A   1       9.747   2.204  -9.644  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.829   1.103  -9.101  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      11.014   2.952 -10.006  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.816   2.228 -10.152  1.00  0.00           H  
HETATM    5  H2  ACE A   1      10.871   3.530 -10.917  1.00  0.00           H  
HETATM    6  H3  ACE A   1      11.277   3.609  -9.178  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.585   2.806  -9.926  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.283   2.295  -9.510  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.261   2.242 -10.658  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.184   3.141 -11.498  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.768   3.127  -8.328  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.829   3.173  -6.849  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.608   3.701 -10.389  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.415   1.279  -9.166  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.647   4.156  -8.673  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.787   2.755  -8.029  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.438   1.189 -10.649  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.309   0.952 -11.541  1.00  0.00           C  
ATOM     19  C   VAL A   3       3.001   1.050 -10.713  1.00  0.00           C  
ATOM     20  O   VAL A   3       3.062   1.244  -9.497  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.496  -0.403 -12.283  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       3.535  -0.575 -13.473  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       5.914  -0.603 -12.855  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.520   0.559  -9.852  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.331   1.765 -12.263  1.00  0.00           H  
ATOM     26  HB  VAL A   3       4.329  -1.207 -11.571  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       3.568   0.305 -14.117  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       3.823  -1.445 -14.066  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       2.519  -0.755 -13.128  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       6.661  -0.563 -12.064  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       5.992  -1.590 -13.310  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       6.135   0.159 -13.605  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.825   1.000 -11.355  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.483   1.074 -10.733  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.444  -0.054 -11.206  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.628  -0.280 -12.401  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.161   2.434 -11.029  1.00  0.00           C  
ATOM     38  CG  TRP A   4       0.333   3.568 -10.188  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       1.413   4.338 -10.457  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.209   4.058  -8.922  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       1.549   5.302  -9.475  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.587   5.165  -8.495  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.273   3.667  -8.078  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4       0.328   5.863  -7.305  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.531   4.349  -6.871  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -0.740   5.448  -6.489  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.844   0.802 -12.344  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.538   0.982  -9.645  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.028   2.680 -12.083  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.236   2.352 -10.851  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       2.046   4.230 -11.329  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       2.257   6.020  -9.491  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.888   2.829  -8.367  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.937   6.709  -7.026  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.350   4.036  -6.237  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -0.955   5.978  -5.572  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.093  -0.705 -10.237  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -2.049  -1.804 -10.385  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.467  -1.291 -10.060  1.00  0.00           C  
ATOM     60  O   GLU A   5      -4.085  -1.634  -9.051  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.591  -3.035  -9.565  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -1.130  -2.711  -8.130  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -0.633  -3.926  -7.347  1.00  0.00           C  
ATOM     64  OE1 GLU A   5       0.246  -4.639  -7.879  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -1.113  -4.098  -6.206  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.932  -0.396  -9.276  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -2.063  -2.123 -11.430  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -2.403  -3.762  -9.526  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -0.759  -3.499 -10.096  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -0.308  -2.002  -8.158  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -1.958  -2.254  -7.595  1.00  0.00           H  
ATOM     72  N   GLY A   6      -3.966  -0.396 -10.924  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.304   0.199 -10.857  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.463   1.250  -9.754  1.00  0.00           C  
ATOM     75  O   GLY A   6      -5.615   2.432 -10.049  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.370  -0.137 -11.698  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.529   0.674 -11.811  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.045  -0.585 -10.691  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.435   0.816  -8.489  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.762   1.633  -7.307  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.674   1.595  -6.212  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.829   2.217  -5.163  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -7.133   1.185  -6.765  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -8.265   1.388  -7.762  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -8.630   0.496  -8.509  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -8.860   2.564  -7.800  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.264  -0.182  -8.386  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.850   2.679  -7.607  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.092   0.128  -6.504  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.367   1.741  -5.857  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -8.582   3.329  -7.210  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -9.591   2.633  -8.485  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.573   0.875  -6.460  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.421   0.635  -5.582  1.00  0.00           C  
ATOM     95  C   LYS A   8      -1.150   0.699  -6.444  1.00  0.00           C  
ATOM     96  O   LYS A   8      -1.228   0.350  -7.619  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.628  -0.762  -4.950  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -1.428  -1.373  -4.205  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -1.174  -0.706  -2.848  1.00  0.00           C  
ATOM    100  CE  LYS A   8       0.277  -0.888  -2.402  1.00  0.00           C  
ATOM    101  NZ  LYS A   8       0.444  -0.556  -0.977  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.511   0.444  -7.375  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.373   1.401  -4.805  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -3.479  -0.716  -4.267  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -2.899  -1.457  -5.745  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -1.634  -2.429  -4.028  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -0.537  -1.329  -4.829  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -1.384   0.363  -2.906  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -1.844  -1.157  -2.114  1.00  0.00           H  
ATOM    110  HE2 LYS A   8       0.597  -1.917  -2.571  1.00  0.00           H  
ATOM    111  HE3 LYS A   8       0.905  -0.223  -2.995  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -0.075   0.284  -0.763  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8       0.095  -1.320  -0.414  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8       1.421  -0.406  -0.776  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.003   1.039  -5.856  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.304   1.081  -6.561  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.254  -0.048  -6.123  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.152  -0.585  -5.021  1.00  0.00           O  
ATOM    119  CB  LEU A   9       1.892   2.508  -6.539  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.211   2.790  -5.793  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.685   4.190  -6.199  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       3.055   2.748  -4.269  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.000   1.262  -4.874  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.132   0.914  -7.624  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       2.071   2.763  -7.583  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       1.134   3.206  -6.186  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.975   2.076  -6.100  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.930   4.933  -5.941  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       4.621   4.431  -5.696  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       3.856   4.218  -7.276  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       2.174   3.312  -3.962  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       2.959   1.716  -3.935  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       3.938   3.178  -3.795  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.187  -0.396  -7.009  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.199  -1.435  -6.814  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.547  -0.918  -7.323  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.581  -0.158  -8.285  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.776  -2.766  -7.475  1.00  0.00           C  
ATOM    139  CG  HIS A  10       3.333  -2.745  -8.927  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       3.769  -3.603  -9.916  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       2.270  -2.055  -9.441  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       2.972  -3.436 -10.987  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       2.057  -2.488 -10.748  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.241   0.133  -7.879  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.290  -1.619  -5.744  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       4.606  -3.470  -7.382  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       2.943  -3.174  -6.899  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       4.515  -4.278  -9.838  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       1.658  -1.339  -8.915  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       3.042  -3.990 -11.914  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.662  -1.294  -6.690  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.982  -0.730  -6.998  1.00  0.00           C  
ATOM    153  C   CYS A  11       9.042  -1.819  -7.214  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.835  -2.986  -6.896  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.372   0.269  -5.897  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.216   1.650  -5.628  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.612  -1.976  -5.949  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.932  -0.183  -7.931  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.457  -0.277  -4.957  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.352   0.691  -6.125  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.194  -1.447  -7.758  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.319  -0.488  -8.070  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.885  -2.157  -7.942  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       15                                                                  
HETATM    1  C   ACE A   1       9.354   2.322 -10.094  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.586   1.186  -9.676  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.412   3.103 -10.846  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.252   2.444 -11.067  1.00  0.00           H  
HETATM    5  H2  ACE A   1       9.995   3.470 -11.783  1.00  0.00           H  
HETATM    6  H3  ACE A   1      10.752   3.938 -10.237  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.173   2.925  -9.965  1.00  0.00           N  
ATOM      8  CA  CYS A   2       6.972   2.243  -9.503  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.011   2.006 -10.672  1.00  0.00           C  
ATOM     10  O   CYS A   2       5.956   2.804 -11.608  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.290   3.066  -8.404  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.282   3.467  -6.940  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.058   3.846 -10.358  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.256   1.278  -9.104  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       5.968   4.010  -8.848  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.397   2.537  -8.068  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.208   0.943 -10.576  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.123   0.625 -11.507  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.778   0.685 -10.777  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.689   0.346  -9.595  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.342  -0.732 -12.217  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.733  -0.824 -12.866  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.147  -1.970 -11.327  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.320   0.334  -9.767  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.106   1.390 -12.283  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.605  -0.790 -13.018  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       5.911   0.049 -13.495  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.508  -0.874 -12.099  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.792  -1.722 -13.480  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       3.161  -1.960 -10.864  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       4.218  -2.868 -11.939  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       4.910  -2.007 -10.551  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.731   1.088 -11.500  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.361   1.189 -10.992  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.479  -0.023 -11.412  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.458  -0.458 -12.562  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.308   2.477 -11.499  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.078   3.716 -10.684  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.655   4.788 -11.058  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.617   4.044  -9.366  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.596   5.758 -10.074  1.00  0.00           N  
ATOM     42  CE2 TRP A   4      -0.173   5.350  -9.002  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.424   3.363  -8.431  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.501   5.944  -7.771  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.730   3.933  -7.181  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -1.276   5.220  -6.851  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.871   1.295 -12.477  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.377   1.235  -9.901  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.006   2.658 -12.532  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.387   2.319 -11.508  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.188   4.873 -11.997  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       1.067   6.649 -10.139  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.791   2.381  -8.686  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4      -0.144   6.930  -7.519  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.300   3.383  -6.452  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.521   5.642  -5.886  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.285  -0.502 -10.470  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -2.251  -1.589 -10.570  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.614  -1.047 -10.102  1.00  0.00           C  
ATOM     60  O   GLU A   5      -4.013  -1.217  -8.947  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.716  -2.768  -9.740  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -2.600  -4.021  -9.776  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -2.066  -5.085  -8.816  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -0.958  -5.596  -9.091  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -2.772  -5.368  -7.822  1.00  0.00           O  
ATOM     66  H   GLU A   5      -1.161  -0.118  -9.534  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -2.338  -1.915 -11.608  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -0.732  -3.039 -10.123  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.587  -2.449  -8.708  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -3.625  -3.770  -9.500  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -2.607  -4.423 -10.790  1.00  0.00           H  
ATOM     72  N   GLY A   6      -4.295  -0.305 -10.987  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.578   0.366 -10.736  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.488   1.481  -9.691  1.00  0.00           C  
ATOM     75  O   GLY A   6      -5.494   2.663 -10.023  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.870  -0.165 -11.893  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.945   0.800 -11.667  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.308  -0.369 -10.395  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.408   1.086  -8.419  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.312   1.950  -7.240  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.167   1.529  -6.296  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.053   2.075  -5.201  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.666   1.962  -6.501  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -7.880   2.247  -7.376  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -8.872   1.540  -7.329  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -7.854   3.277  -8.198  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.339   0.080  -8.293  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.085   2.969  -7.562  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -6.814   0.992  -6.027  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -6.636   2.716  -5.714  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -7.011   3.797  -8.376  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -8.681   3.376  -8.760  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.319   0.575  -6.713  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.204   0.013  -5.937  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.884   0.294  -6.662  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.840   0.270  -7.887  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.433  -1.498  -5.744  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -3.821  -1.883  -5.195  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -4.044  -1.404  -3.757  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -5.455  -1.769  -3.297  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -5.745  -1.202  -1.970  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.480   0.153  -7.623  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.158   0.491  -4.956  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -2.318  -1.992  -6.706  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -1.665  -1.892  -5.077  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -4.603  -1.478  -5.840  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -3.911  -2.969  -5.223  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -3.318  -1.887  -3.101  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -3.918  -0.323  -3.698  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -6.180  -1.383  -4.014  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -5.542  -2.854  -3.254  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -5.015  -1.468  -1.324  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -5.780  -0.193  -2.036  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -6.634  -1.549  -1.640  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.186   0.565  -5.915  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.465   1.061  -6.432  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.579   0.129  -5.949  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.726  -0.090  -4.745  1.00  0.00           O  
ATOM    119  CB  LEU A   9       1.604   2.519  -5.954  1.00  0.00           C  
ATOM    120  CG  LEU A   9       2.800   3.368  -6.425  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       2.882   3.546  -7.943  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       2.632   4.768  -5.815  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.104   0.507  -4.912  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.449   1.053  -7.523  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       0.702   3.045  -6.257  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       1.628   2.505  -4.864  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.731   2.930  -6.064  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       1.936   3.916  -8.323  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       3.657   4.271  -8.190  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       3.111   2.599  -8.425  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       2.540   4.695  -4.731  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       3.493   5.393  -6.052  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       1.732   5.239  -6.211  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.328  -0.454  -6.887  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.348  -1.468  -6.612  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.677  -1.008  -7.207  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.735  -0.617  -8.370  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.884  -2.833  -7.146  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.554  -3.266  -6.570  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.237  -3.343  -5.230  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.421  -3.567  -7.278  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       0.942  -3.690  -5.137  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.403  -3.831  -6.357  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.154  -0.217  -7.863  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.480  -1.564  -5.533  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.801  -2.785  -8.233  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.635  -3.585  -6.899  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       2.844  -3.126  -4.453  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       1.322  -3.576  -8.354  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.399  -3.830  -4.212  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.739  -1.003  -6.399  1.00  0.00           N  
ATOM    152  CA  CYS A  11       8.020  -0.390  -6.746  1.00  0.00           C  
ATOM    153  C   CYS A  11       9.151  -1.423  -6.717  1.00  0.00           C  
ATOM    154  O   CYS A  11       9.308  -2.161  -5.749  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.275   0.781  -5.790  1.00  0.00           C  
ATOM    156  SG  CYS A  11       6.914   1.973  -5.601  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.644  -1.361  -5.461  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.977   0.007  -7.755  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.478   0.366  -4.802  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.166   1.319  -6.114  1.00  0.00           H  
HETATM  161  N   NH2 A  12       9.945  -1.490  -7.780  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12       9.820  -0.859  -8.564  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.660  -2.198  -7.782  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       16                                                                  
HETATM    1  C   ACE A   1       9.719   1.662  -9.862  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.714   0.650  -9.170  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      11.052   2.211 -10.327  1.00  0.00           C  
HETATM    4  H1  ACE A   1      10.918   3.064 -10.992  1.00  0.00           H  
HETATM    5  H2  ACE A   1      11.619   2.518  -9.447  1.00  0.00           H  
HETATM    6  H3  ACE A   1      11.602   1.423 -10.843  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.612   2.330 -10.211  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.278   2.034  -9.679  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.149   2.116 -10.720  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.177   2.952 -11.628  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.974   3.017  -8.544  1.00  0.00           C  
ATOM     12  SG  CYS A   2       8.099   3.056  -7.130  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.705   3.146 -10.796  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.274   1.025  -9.281  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.943   4.020  -8.971  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.981   2.788  -8.163  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.091   1.314 -10.517  1.00  0.00           N  
ATOM     18  CA  VAL A   3       3.925   1.197 -11.396  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.606   1.112 -10.616  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.576   0.583  -9.506  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.050  -0.033 -12.323  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.222   0.138 -13.296  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.207  -1.365 -11.567  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.140   0.659  -9.735  1.00  0.00           H  
ATOM     25  HA  VAL A   3       3.913   2.093 -12.012  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.139  -0.092 -12.920  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       5.238   1.155 -13.687  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.167  -0.061 -12.790  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.108  -0.556 -14.128  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       5.076  -1.335 -10.910  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       3.320  -1.568 -10.969  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       4.340  -2.180 -12.276  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.501   1.581 -11.215  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.153   1.527 -10.633  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.647   0.321 -11.144  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.977   0.229 -12.325  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.614   2.830 -10.902  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.126   4.033 -10.152  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.707   4.980 -10.637  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.459   4.453  -8.791  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.926   5.945  -9.671  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.234   5.668  -8.511  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.286   3.936  -7.768  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4       0.139   6.323  -7.273  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.401   4.592  -6.527  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -0.686   5.776  -6.276  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.581   1.954 -12.146  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.244   1.435  -9.552  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.604   3.044 -11.971  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.656   2.674 -10.613  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.125   4.980 -11.635  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       1.520   6.748  -9.811  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.843   3.030  -7.950  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.684   7.236  -7.095  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.051   4.190  -5.761  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -0.785   6.255  -5.313  1.00  0.00           H  
ATOM     57  N   GLU A   5      -0.999  -0.587 -10.235  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -1.890  -1.726 -10.448  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.318  -1.322 -10.051  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.756  -1.515  -8.914  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.335  -2.918  -9.656  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -2.074  -4.252  -9.826  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -1.983  -4.778 -11.257  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -0.936  -5.381 -11.579  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -2.961  -4.564 -12.006  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.740  -0.395  -9.268  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -1.887  -1.995 -11.507  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -0.312  -3.067  -9.998  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.313  -2.661  -8.596  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -1.613  -4.981  -9.157  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -3.117  -4.143  -9.531  1.00  0.00           H  
ATOM     72  N   GLY A   6      -4.024  -0.685 -10.994  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.399  -0.197 -10.843  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.519   0.998  -9.893  1.00  0.00           C  
ATOM     75  O   GLY A   6      -5.855   2.099 -10.320  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.551  -0.496 -11.868  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.781   0.100 -11.819  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.026  -1.005 -10.466  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.256   0.766  -8.605  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.303   1.761  -7.533  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.150   1.648  -6.510  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.031   2.525  -5.657  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.692   1.720  -6.868  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -7.002   0.390  -6.194  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -6.493   0.072  -5.134  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -7.850  -0.431  -6.782  1.00  0.00           N  
ATOM     87  H   ASN A   7      -4.954  -0.184  -8.407  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.191   2.750  -7.976  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -6.745   2.499  -6.106  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.453   1.935  -7.619  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -8.304  -0.205  -7.650  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -8.027  -1.278  -6.269  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.284   0.623  -6.599  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.125   0.414  -5.711  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.828   0.663  -6.473  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.734   0.311  -7.648  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.112  -1.042  -5.216  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -3.328  -1.433  -4.360  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -3.430  -2.956  -4.184  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -2.303  -3.565  -3.340  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -2.625  -3.555  -1.903  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.405  -0.047  -7.353  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.163   1.093  -4.859  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -2.065  -1.700  -6.086  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -1.206  -1.204  -4.630  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -3.273  -0.941  -3.389  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -4.235  -1.107  -4.862  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -4.391  -3.199  -3.728  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -3.409  -3.421  -5.170  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -2.159  -4.599  -3.652  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -1.376  -3.020  -3.512  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -3.485  -4.064  -1.752  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -1.879  -4.003  -1.387  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -2.737  -2.605  -1.582  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.193   1.201  -5.802  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.540   1.283  -6.366  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.360   0.037  -5.994  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.373  -0.388  -4.839  1.00  0.00           O  
ATOM    119  CB  LEU A   9       2.231   2.578  -5.901  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.468   2.925  -6.756  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.074   3.517  -8.112  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       4.340   3.955  -6.033  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.063   1.458  -4.837  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.448   1.316  -7.449  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.527   3.412  -5.960  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.531   2.459  -4.858  1.00  0.00           H  
ATOM    127  HG  LEU A   9       4.064   2.029  -6.919  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.252   2.960  -8.553  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       2.753   4.549  -7.989  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       3.919   3.483  -8.795  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.740   4.816  -5.739  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.780   3.502  -5.144  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       5.143   4.292  -6.688  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.090  -0.500  -6.971  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.093  -1.546  -6.803  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.436  -1.043  -7.345  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.493  -0.456  -8.422  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.618  -2.830  -7.498  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.405  -3.437  -6.837  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.282  -3.792  -5.511  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.216  -3.720  -7.446  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.038  -4.274  -5.333  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.350  -4.247  -6.484  1.00  0.00           N  
ATOM    144  H   HIS A  10       2.992  -0.106  -7.906  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.218  -1.761  -5.743  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.385  -2.607  -8.541  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.422  -3.567  -7.484  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       2.984  -3.693  -4.795  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       1.009  -3.566  -8.487  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.640  -4.640  -4.397  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.512  -1.251  -6.581  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.850  -0.714  -6.839  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.922  -1.815  -6.862  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.666  -2.967  -6.529  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.180   0.327  -5.758  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.208   1.853  -5.745  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.402  -1.792  -5.738  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.867  -0.224  -7.808  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.056  -0.149  -4.786  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.226   0.619  -5.848  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.153  -1.460  -7.213  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.321  -0.529  -7.576  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.882  -2.152  -7.178  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       17                                                                  
HETATM    1  C   ACE A   1       9.784   2.445  -9.676  1.00  0.00           C  
HETATM    2  O   ACE A   1      10.034   1.334  -9.212  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.912   3.407  -9.987  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.801   3.094  -9.442  1.00  0.00           H  
HETATM    5  H2  ACE A   1      11.118   3.391 -11.057  1.00  0.00           H  
HETATM    6  H3  ACE A   1      10.637   4.413  -9.674  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.548   2.887  -9.919  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.334   2.150  -9.572  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.370   1.990 -10.756  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.427   2.731 -11.737  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.641   2.850  -8.391  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.669   3.222  -6.940  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.435   3.806 -10.318  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.612   1.147  -9.265  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.238   3.796  -8.753  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.793   2.248  -8.061  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.441   1.043 -10.607  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.274   0.798 -11.462  1.00  0.00           C  
ATOM     19  C   VAL A   3       3.001   0.985 -10.630  1.00  0.00           C  
ATOM     20  O   VAL A   3       3.051   0.919  -9.401  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.306  -0.619 -12.085  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.495  -0.794 -13.039  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.335  -1.741 -11.038  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.462   0.524  -9.729  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.262   1.528 -12.271  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.398  -0.745 -12.676  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       5.429  -0.064 -13.845  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.435  -0.660 -12.505  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.473  -1.795 -13.472  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       3.449  -1.685 -10.405  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       4.337  -2.711 -11.535  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       5.230  -1.661 -10.422  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.859   1.170 -11.298  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.533   1.250 -10.675  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.417   0.219 -11.294  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.350  -0.080 -12.486  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.032   2.675 -10.791  1.00  0.00           C  
ATOM     38  CG  TRP A   4       0.458   3.684  -9.790  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       1.562   4.457  -9.911  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.164   4.078  -8.527  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       1.662   5.302  -8.820  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.621   5.112  -7.935  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.316   3.669  -7.820  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4       0.286   5.708  -6.707  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.657   4.250  -6.582  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -0.861   5.266  -6.026  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.873   1.140 -12.307  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.612   1.004  -9.617  1.00  0.00           H  
ATOM     49  HB2 TRP A   4       0.150   3.056 -11.797  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.115   2.621 -10.668  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       2.247   4.427 -10.748  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       2.396   5.985  -8.704  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -1.938   2.893  -8.241  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.900   6.491  -6.291  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.541   3.926  -6.055  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.139   5.707  -5.079  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.314  -0.305 -10.459  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -2.268  -1.376 -10.730  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.630  -1.005 -10.126  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.814  -1.079  -8.907  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.769  -2.694 -10.105  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -0.570  -3.349 -10.808  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -0.809  -3.689 -12.282  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -1.960  -4.043 -12.624  1.00  0.00           O  
ATOM     65  OE2 GLU A   5       0.179  -3.611 -13.044  1.00  0.00           O  
ATOM     66  H   GLU A   5      -1.269  -0.002  -9.485  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -2.384  -1.509 -11.807  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -1.492  -2.505  -9.066  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -2.593  -3.409 -10.099  1.00  0.00           H  
ATOM     70  HG2 GLU A   5       0.300  -2.696 -10.719  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -0.344  -4.280 -10.286  1.00  0.00           H  
ATOM     72  N   GLY A   6      -4.584  -0.580 -10.968  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.966  -0.275 -10.576  1.00  0.00           C  
ATOM     74  C   GLY A   6      -6.083   0.973  -9.694  1.00  0.00           C  
ATOM     75  O   GLY A   6      -6.544   2.015 -10.151  1.00  0.00           O  
ATOM     76  H   GLY A   6      -4.352  -0.493 -11.947  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -6.571  -0.126 -11.470  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -6.375  -1.125 -10.029  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.670   0.849  -8.431  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.620   1.911  -7.426  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.469   1.752  -6.402  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.468   2.468  -5.401  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.991   2.013  -6.734  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -7.249   0.877  -5.753  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -7.362  -0.281  -6.120  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -7.337   1.174  -4.473  1.00  0.00           N  
ATOM     87  H   ASN A   7      -5.287  -0.065  -8.207  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.442   2.853  -7.946  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -7.040   2.965  -6.203  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.782   2.014  -7.484  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -7.172   2.109  -4.143  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -7.518   0.393  -3.869  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.504   0.843  -6.625  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.324   0.633  -5.763  1.00  0.00           C  
ATOM     95  C   LYS A   8      -1.034   0.619  -6.591  1.00  0.00           C  
ATOM     96  O   LYS A   8      -1.091   0.433  -7.804  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.475  -0.692  -4.987  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -3.616  -0.723  -3.956  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -3.380   0.228  -2.771  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -4.426   0.038  -1.668  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -4.269  -1.254  -0.974  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.539   0.283  -7.476  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.239   1.458  -5.056  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -2.642  -1.496  -5.706  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -1.542  -0.910  -4.465  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -4.562  -0.476  -4.437  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -3.687  -1.744  -3.580  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -2.387   0.058  -2.350  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -3.435   1.260  -3.118  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -4.305   0.839  -0.937  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -5.426   0.102  -2.097  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -3.290  -1.417  -0.789  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -4.777  -1.233  -0.102  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -4.628  -1.997  -1.557  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.123   0.786  -5.937  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.435   0.829  -6.596  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.393  -0.261  -6.098  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.268  -0.775  -4.982  1.00  0.00           O  
ATOM    119  CB  LEU A   9       2.004   2.270  -6.565  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.218   2.546  -5.657  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.881   3.871  -6.046  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       2.822   2.605  -4.180  1.00  0.00           C  
ATOM    123  H   LEU A   9       0.097   0.911  -4.938  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.282   0.598  -7.646  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       2.302   2.512  -7.585  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       1.212   2.969  -6.299  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.958   1.762  -5.799  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       4.169   3.844  -7.095  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       3.191   4.700  -5.887  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       4.776   4.022  -5.441  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       2.142   1.791  -3.935  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       3.716   2.510  -3.563  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       2.333   3.555  -3.958  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.390  -0.577  -6.932  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.459  -1.535  -6.657  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.787  -0.942  -7.153  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.780  -0.230  -8.156  1.00  0.00           O  
ATOM    138  CB  HIS A  10       4.160  -2.869  -7.367  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.749  -3.396  -7.224  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       1.972  -3.377  -6.086  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.990  -3.935  -8.229  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       0.778  -3.911  -6.397  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.745  -4.268  -7.689  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.430  -0.079  -7.823  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.511  -1.708  -5.582  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       4.360  -2.745  -8.430  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.849  -3.627  -6.995  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       2.196  -2.876  -5.231  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       2.289  -4.051  -9.261  1.00  0.00           H  
ATOM    150  HE1 HIS A  10      -0.058  -4.006  -5.720  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.924  -1.224  -6.502  1.00  0.00           N  
ATOM    152  CA  CYS A  11       8.196  -0.548  -6.801  1.00  0.00           C  
ATOM    153  C   CYS A  11       9.382  -1.514  -6.912  1.00  0.00           C  
ATOM    154  O   CYS A  11       9.371  -2.607  -6.355  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.468   0.516  -5.728  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.208   1.809  -5.539  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.921  -1.884  -5.739  1.00  0.00           H  
ATOM    158  HA  CYS A  11       8.126  -0.043  -7.757  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.572   0.008  -4.767  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.419   1.004  -5.947  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.440  -1.092  -7.598  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.418  -0.201  -8.087  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      11.241  -1.700  -7.658  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       18                                                                  
HETATM    1  C   ACE A   1       9.612   1.899 -10.006  1.00  0.00           C  
HETATM    2  O   ACE A   1       9.723   0.813  -9.438  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      10.850   2.593 -10.538  1.00  0.00           C  
HETATM    4  H1  ACE A   1      10.590   3.292 -11.334  1.00  0.00           H  
HETATM    5  H2  ACE A   1      11.329   3.127  -9.718  1.00  0.00           H  
HETATM    6  H3  ACE A   1      11.536   1.840 -10.927  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.447   2.534 -10.181  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.164   2.059  -9.664  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.048   2.078 -10.723  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.096   2.836 -11.689  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.760   2.885  -8.436  1.00  0.00           C  
ATOM     12  SG  CYS A   2       7.960   2.973  -7.077  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.440   3.397 -10.702  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.280   1.028  -9.355  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.554   3.906  -8.761  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       5.834   2.478  -8.031  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.023   1.248 -10.498  1.00  0.00           N  
ATOM     18  CA  VAL A   3       3.890   0.996 -11.387  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.595   0.922 -10.577  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.549   0.323  -9.498  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.087  -0.296 -12.216  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.270  -0.162 -13.183  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.289  -1.565 -11.369  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.050   0.701  -9.639  1.00  0.00           H  
ATOM     25  HA  VAL A   3       3.824   1.834 -12.077  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.192  -0.442 -12.821  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       5.116   0.696 -13.837  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.201  -0.032 -12.633  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.349  -1.059 -13.798  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       5.107  -1.428 -10.661  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       3.376  -1.799 -10.822  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       4.522  -2.410 -12.016  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.536   1.546 -11.093  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.198   1.530 -10.507  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.574   0.297 -10.995  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.945   0.217 -12.167  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.548   2.823 -10.876  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.271   4.024 -10.019  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       0.530   5.068 -10.334  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.845   4.344  -8.713  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       0.482   6.012  -9.324  1.00  0.00           N  
ATOM     42  CE2 TRP A   4      -0.351   5.616  -8.297  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.751   3.696  -7.850  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.717   6.203  -7.076  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -2.133   4.277  -6.624  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -1.612   5.523  -6.234  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.636   1.995 -11.990  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.274   1.480  -9.420  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.344   3.072 -11.920  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.619   2.630 -10.800  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.104   5.155 -11.248  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       0.999   6.879  -9.339  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -2.156   2.743  -8.153  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4      -0.322   7.168  -6.791  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.841   3.779  -5.979  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.914   5.962  -5.293  1.00  0.00           H  
ATOM     57  N   GLU A   5      -0.877  -0.646 -10.098  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -1.733  -1.794 -10.412  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.192  -1.387 -10.169  1.00  0.00           C  
ATOM     60  O   GLU A   5      -3.823  -1.752  -9.175  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.322  -3.047  -9.622  1.00  0.00           C  
ATOM     62  CG  GLU A   5       0.088  -3.536 -10.006  1.00  0.00           C  
ATOM     63  CD  GLU A   5       0.441  -4.908  -9.418  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -0.215  -5.325  -8.437  1.00  0.00           O  
ATOM     65  OE2 GLU A   5       1.377  -5.525  -9.972  1.00  0.00           O  
ATOM     66  H   GLU A   5      -0.646  -0.473  -9.118  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -1.636  -2.041 -11.471  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -1.364  -2.844  -8.552  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -2.032  -3.842  -9.859  1.00  0.00           H  
ATOM     70  HG2 GLU A   5       0.155  -3.599 -11.093  1.00  0.00           H  
ATOM     71  HG3 GLU A   5       0.828  -2.811  -9.669  1.00  0.00           H  
ATOM     72  N   GLY A   6      -3.699  -0.554 -11.085  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.057  -0.004 -11.107  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.346   1.020 -10.003  1.00  0.00           C  
ATOM     75  O   GLY A   6      -5.731   2.147 -10.302  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.059  -0.270 -11.819  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.216   0.486 -12.068  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -5.777  -0.818 -11.021  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.184   0.630  -8.731  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.616   1.406  -7.560  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.580   1.459  -6.416  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.844   2.081  -5.389  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.967   0.855  -7.060  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -7.996   0.655  -8.166  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -8.281  -0.458  -8.575  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -8.574   1.713  -8.697  1.00  0.00           N  
ATOM     87  H   ASN A   7      -4.874  -0.335  -8.619  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -5.772   2.441  -7.866  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -6.804  -0.108  -6.576  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.382   1.537  -6.317  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -8.306   2.653  -8.460  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -9.214   1.493  -9.439  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.406   0.832  -6.586  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.290   0.821  -5.626  1.00  0.00           C  
ATOM     95  C   LYS A   8      -0.938   0.769  -6.346  1.00  0.00           C  
ATOM     96  O   LYS A   8      -0.864   0.318  -7.489  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.465  -0.328  -4.615  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -2.806  -1.705  -5.216  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -3.091  -2.697  -4.076  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -3.643  -4.043  -4.556  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -2.666  -4.801  -5.356  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.247   0.359  -7.467  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.309   1.754  -5.060  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -1.555  -0.419  -4.018  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -3.272  -0.043  -3.939  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -3.695  -1.634  -5.840  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -1.975  -2.058  -5.825  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -2.181  -2.864  -3.500  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -3.840  -2.261  -3.414  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -3.908  -4.636  -3.680  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -4.543  -3.876  -5.147  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -1.815  -4.917  -4.826  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -3.049  -5.707  -5.583  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -2.461  -4.297  -6.207  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.118   1.259  -5.691  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.458   1.398  -6.265  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.360   0.241  -5.817  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.385  -0.106  -4.637  1.00  0.00           O  
ATOM    119  CB  LEU A   9       2.049   2.761  -5.842  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.255   3.232  -6.684  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       2.836   3.582  -8.111  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       3.862   4.500  -6.077  1.00  0.00           C  
ATOM    123  H   LEU A   9      -0.004   1.552  -4.736  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.372   1.370  -7.349  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.270   3.524  -5.905  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       2.360   2.693  -4.798  1.00  0.00           H  
ATOM    127  HG  LEU A   9       4.016   2.454  -6.712  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.033   4.308  -8.071  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       3.671   4.000  -8.671  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       2.480   2.701  -8.627  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.091   5.263  -5.960  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.296   4.271  -5.104  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       4.649   4.887  -6.726  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.134  -0.311  -6.752  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.174  -1.311  -6.499  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.466  -0.898  -7.212  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.420  -0.092  -8.139  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.675  -2.684  -6.971  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.449  -3.163  -6.230  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.432  -3.861  -5.043  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.149  -2.938  -6.594  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.144  -4.062  -4.711  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.327  -3.520  -5.625  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.050   0.015  -7.714  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.380  -1.359  -5.429  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.444  -2.629  -8.035  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.472  -3.419  -6.839  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       3.233  -4.150  -4.504  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       0.821  -2.388  -7.462  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.802  -4.580  -3.825  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.622  -1.425  -6.795  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.933  -0.999  -7.299  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.892  -2.179  -7.498  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.634  -3.294  -7.055  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.542   0.037  -6.337  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.491   1.429  -5.828  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.618  -2.144  -6.087  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.811  -0.541  -8.275  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.840  -0.491  -5.431  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.448   0.447  -6.788  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.029  -1.933  -8.142  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.213  -1.009  -8.519  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.675  -2.696  -8.270  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       19                                                                  
HETATM    1  C   ACE A   1      10.012   1.997  -9.508  1.00  0.00           C  
HETATM    2  O   ACE A   1      10.124   0.905  -8.952  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      11.241   2.824  -9.820  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.327   2.960 -10.896  1.00  0.00           H  
HETATM    5  H2  ACE A   1      11.158   3.791  -9.326  1.00  0.00           H  
HETATM    6  H3  ACE A   1      12.125   2.307  -9.448  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.839   2.542  -9.850  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.535   1.969  -9.514  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.519   2.027 -10.667  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.688   2.770 -11.634  1.00  0.00           O  
ATOM     11  CB  CYS A   2       6.970   2.683  -8.272  1.00  0.00           C  
ATOM     12  SG  CYS A   2       8.100   2.905  -6.864  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.846   3.433 -10.322  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.675   0.918  -9.287  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.639   3.675  -8.583  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       6.094   2.141  -7.921  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.437   1.257 -10.517  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.291   1.103 -11.427  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.965   1.186 -10.659  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.969   1.115  -9.434  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.379  -0.230 -12.209  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.477  -0.150 -13.271  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       4.626  -1.482 -11.346  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.401   0.687  -9.672  1.00  0.00           H  
ATOM     25  HA  VAL A   3       4.306   1.926 -12.141  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.434  -0.381 -12.732  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       6.439   0.068 -12.807  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       5.544  -1.098 -13.802  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.233   0.636 -13.984  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       3.824  -1.610 -10.621  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       4.657  -2.363 -11.989  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       5.579  -1.408 -10.823  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.842   1.326 -11.377  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.448   1.328 -10.880  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.349   0.189 -11.515  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.238  -0.039 -12.718  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.233   2.655 -11.225  1.00  0.00           C  
ATOM     38  CG  TRP A   4       0.236   3.817 -10.417  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       1.335   4.560 -10.672  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.352   4.359  -9.198  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       1.474   5.522  -9.693  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.475   5.429  -8.746  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.489   4.043  -8.422  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4       0.206   6.136  -7.565  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.766   4.743  -7.234  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -0.930   5.793  -6.811  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.931   1.348 -12.382  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.394   1.211  -9.795  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.102   2.871 -12.286  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.304   2.550 -11.044  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       2.001   4.406 -11.511  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       2.219   6.204  -9.685  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -2.154   3.252  -8.744  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.867   6.925  -7.243  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.625   4.464  -6.639  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.162   6.338  -5.907  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.179  -0.494 -10.717  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -1.889  -1.716 -11.148  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.418  -1.636 -10.978  1.00  0.00           C  
ATOM     60  O   GLU A   5      -4.136  -2.581 -11.293  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -1.267  -2.924 -10.425  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -1.598  -4.256 -11.116  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -0.665  -5.380 -10.671  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -1.011  -6.050  -9.675  1.00  0.00           O  
ATOM     65  OE2 GLU A   5       0.375  -5.555 -11.343  1.00  0.00           O  
ATOM     66  H   GLU A   5      -1.194  -0.245  -9.726  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -1.721  -1.873 -12.215  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -0.183  -2.806 -10.440  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -1.601  -2.948  -9.386  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -2.625  -4.543 -10.893  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -1.502  -4.132 -12.196  1.00  0.00           H  
ATOM     72  N   GLY A   6      -3.940  -0.505 -10.500  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -5.345  -0.371 -10.136  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.538   0.842  -9.241  1.00  0.00           C  
ATOM     75  O   GLY A   6      -5.298   1.972  -9.655  1.00  0.00           O  
ATOM     76  H   GLY A   6      -3.322   0.282 -10.364  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -5.964  -0.280 -11.028  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -5.644  -1.268  -9.591  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.889   0.582  -7.980  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.979   1.590  -6.925  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.681   1.678  -6.086  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.641   2.411  -5.097  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -7.249   1.290  -6.099  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -7.880   2.536  -5.491  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -9.020   2.869  -5.766  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -7.162   3.269  -4.670  1.00  0.00           N  
ATOM     87  H   ASN A   7      -6.088  -0.377  -7.736  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -6.103   2.570  -7.393  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -8.007   0.857  -6.754  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -7.036   0.568  -5.311  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -6.180   3.034  -4.513  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -7.582   4.127  -4.362  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.622   0.941  -6.461  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.326   0.933  -5.772  1.00  0.00           C  
ATOM     95  C   LYS A   8      -1.144   0.929  -6.746  1.00  0.00           C  
ATOM     96  O   LYS A   8      -1.283   0.630  -7.939  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.248  -0.269  -4.807  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -3.208  -0.129  -3.611  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -3.067  -1.320  -2.655  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -4.104  -1.316  -1.525  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -3.928  -2.493  -0.654  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.696   0.386  -7.301  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.244   1.850  -5.183  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -2.468  -1.187  -5.357  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -1.232  -0.356  -4.413  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -2.979   0.796  -3.077  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -4.234  -0.085  -3.973  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -3.183  -2.241  -3.227  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -2.070  -1.301  -2.213  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -3.991  -0.411  -0.927  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -5.110  -1.336  -1.947  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -2.965  -2.544  -0.353  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -4.530  -2.420   0.153  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -4.161  -3.330  -1.170  1.00  0.00           H  
ATOM    115  N   LEU A   9       0.021   1.205  -6.160  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.343   1.253  -6.766  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.241   0.144  -6.203  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.100  -0.255  -5.046  1.00  0.00           O  
ATOM    119  CB  LEU A   9       1.881   2.689  -6.560  1.00  0.00           C  
ATOM    120  CG  LEU A   9       3.405   2.942  -6.530  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.665   4.439  -6.728  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       4.061   2.580  -5.188  1.00  0.00           C  
ATOM    123  H   LEU A   9      -0.020   1.403  -5.174  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.231   1.065  -7.832  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.463   3.272  -7.377  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       1.466   3.104  -5.642  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.892   2.399  -7.337  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       3.136   4.796  -7.608  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       3.324   4.998  -5.854  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       4.731   4.613  -6.872  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       3.489   3.002  -4.360  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       4.128   1.504  -5.057  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       5.070   2.986  -5.150  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.195  -0.315  -7.020  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.168  -1.354  -6.685  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.543  -0.976  -7.243  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.637  -0.434  -8.341  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.701  -2.712  -7.238  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.287  -3.054  -6.838  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       1.843  -3.306  -5.560  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.189  -2.981  -7.651  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       0.501  -3.360  -5.603  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.058  -3.176  -6.856  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.265   0.120  -7.939  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.244  -1.426  -5.599  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.764  -2.697  -8.327  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.370  -3.493  -6.874  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       2.414  -3.368  -4.731  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       1.201  -2.744  -8.705  1.00  0.00           H  
ATOM    150  HE1 HIS A  10      -0.141  -3.506  -4.745  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.607  -1.257  -6.490  1.00  0.00           N  
ATOM    152  CA  CYS A  11       7.966  -0.837  -6.828  1.00  0.00           C  
ATOM    153  C   CYS A  11       8.906  -2.021  -7.098  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.630  -3.159  -6.734  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.472   0.069  -5.702  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.505   1.579  -5.431  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.469  -1.699  -5.596  1.00  0.00           H  
ATOM    158  HA  CYS A  11       7.950  -0.254  -7.739  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.444  -0.502  -4.773  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.506   0.355  -5.896  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.045  -1.753  -7.727  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.232  -0.813  -8.067  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      10.681  -2.512  -7.906  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       20                                                                  
HETATM    1  C   ACE A   1       9.872   1.966 -10.227  1.00  0.00           C  
HETATM    2  O   ACE A   1      10.079   1.048  -9.435  1.00  0.00           O  
HETATM    3  CH3 ACE A   1      11.010   2.559 -11.037  1.00  0.00           C  
HETATM    4  H1  ACE A   1      11.932   2.496 -10.463  1.00  0.00           H  
HETATM    5  H2  ACE A   1      11.117   1.995 -11.964  1.00  0.00           H  
HETATM    6  H3  ACE A   1      10.804   3.605 -11.270  1.00  0.00           H  
ATOM      7  N   CYS A   2       8.670   2.492 -10.461  1.00  0.00           N  
ATOM      8  CA  CYS A   2       7.420   2.070  -9.831  1.00  0.00           C  
ATOM      9  C   CYS A   2       6.297   1.964 -10.877  1.00  0.00           C  
ATOM     10  O   CYS A   2       6.415   2.491 -11.985  1.00  0.00           O  
ATOM     11  CB  CYS A   2       7.058   3.051  -8.702  1.00  0.00           C  
ATOM     12  SG  CYS A   2       8.255   3.184  -7.339  1.00  0.00           S  
ATOM     13  H   CYS A   2       8.582   3.180 -11.193  1.00  0.00           H  
ATOM     14  HA  CYS A   2       7.568   1.087  -9.398  1.00  0.00           H  
ATOM     15  HB2 CYS A   2       6.955   4.043  -9.144  1.00  0.00           H  
ATOM     16  HB3 CYS A   2       6.090   2.779  -8.272  1.00  0.00           H  
ATOM     17  N   VAL A   3       5.203   1.289 -10.516  1.00  0.00           N  
ATOM     18  CA  VAL A   3       4.024   0.993 -11.347  1.00  0.00           C  
ATOM     19  C   VAL A   3       2.733   1.148 -10.521  1.00  0.00           C  
ATOM     20  O   VAL A   3       2.806   1.330  -9.301  1.00  0.00           O  
ATOM     21  CB  VAL A   3       4.119  -0.434 -11.944  1.00  0.00           C  
ATOM     22  CG1 VAL A   3       5.429  -0.708 -12.700  1.00  0.00           C  
ATOM     23  CG2 VAL A   3       3.971  -1.525 -10.873  1.00  0.00           C  
ATOM     24  H   VAL A   3       5.198   0.910  -9.568  1.00  0.00           H  
ATOM     25  HA  VAL A   3       3.989   1.709 -12.171  1.00  0.00           H  
ATOM     26  HB  VAL A   3       3.302  -0.555 -12.656  1.00  0.00           H  
ATOM     27 HG11 VAL A   3       5.572   0.036 -13.483  1.00  0.00           H  
ATOM     28 HG12 VAL A   3       6.278  -0.680 -12.017  1.00  0.00           H  
ATOM     29 HG13 VAL A   3       5.389  -1.697 -13.156  1.00  0.00           H  
ATOM     30 HG21 VAL A   3       4.753  -1.410 -10.121  1.00  0.00           H  
ATOM     31 HG22 VAL A   3       2.992  -1.464 -10.398  1.00  0.00           H  
ATOM     32 HG23 VAL A   3       4.062  -2.511 -11.329  1.00  0.00           H  
ATOM     33  N   TRP A   4       1.552   1.027 -11.151  1.00  0.00           N  
ATOM     34  CA  TRP A   4       0.260   0.929 -10.456  1.00  0.00           C  
ATOM     35  C   TRP A   4      -0.605  -0.202 -11.027  1.00  0.00           C  
ATOM     36  O   TRP A   4      -0.733  -0.347 -12.239  1.00  0.00           O  
ATOM     37  CB  TRP A   4      -0.552   2.242 -10.514  1.00  0.00           C  
ATOM     38  CG  TRP A   4      -0.065   3.400  -9.692  1.00  0.00           C  
ATOM     39  CD1 TRP A   4       1.003   4.170  -9.995  1.00  0.00           C  
ATOM     40  CD2 TRP A   4      -0.630   3.965  -8.463  1.00  0.00           C  
ATOM     41  NE1 TRP A   4       1.159   5.147  -9.033  1.00  0.00           N  
ATOM     42  CE2 TRP A   4       0.165   5.088  -8.081  1.00  0.00           C  
ATOM     43  CE3 TRP A   4      -1.726   3.650  -7.625  1.00  0.00           C  
ATOM     44  CZ2 TRP A   4      -0.108   5.856  -6.938  1.00  0.00           C  
ATOM     45  CZ3 TRP A   4      -1.998   4.398  -6.462  1.00  0.00           C  
ATOM     46  CH2 TRP A   4      -1.196   5.504  -6.121  1.00  0.00           C  
ATOM     47  H   TRP A   4       1.542   0.843 -12.146  1.00  0.00           H  
ATOM     48  HA  TRP A   4       0.443   0.690  -9.415  1.00  0.00           H  
ATOM     49  HB2 TRP A   4      -0.639   2.563 -11.553  1.00  0.00           H  
ATOM     50  HB3 TRP A   4      -1.563   2.023 -10.169  1.00  0.00           H  
ATOM     51  HD1 TRP A   4       1.636   4.024 -10.860  1.00  0.00           H  
ATOM     52  HE1 TRP A   4       1.924   5.805  -9.024  1.00  0.00           H  
ATOM     53  HE3 TRP A   4      -2.360   2.816  -7.881  1.00  0.00           H  
ATOM     54  HZ2 TRP A   4       0.516   6.702  -6.690  1.00  0.00           H  
ATOM     55  HZ3 TRP A   4      -2.837   4.123  -5.833  1.00  0.00           H  
ATOM     56  HH2 TRP A   4      -1.414   6.082  -5.234  1.00  0.00           H  
ATOM     57  N   GLU A   5      -1.286  -0.934 -10.139  1.00  0.00           N  
ATOM     58  CA  GLU A   5      -2.333  -1.917 -10.463  1.00  0.00           C  
ATOM     59  C   GLU A   5      -3.705  -1.201 -10.479  1.00  0.00           C  
ATOM     60  O   GLU A   5      -4.697  -1.674  -9.928  1.00  0.00           O  
ATOM     61  CB  GLU A   5      -2.237  -3.105  -9.476  1.00  0.00           C  
ATOM     62  CG  GLU A   5      -2.708  -4.438 -10.084  1.00  0.00           C  
ATOM     63  CD  GLU A   5      -2.292  -5.632  -9.219  1.00  0.00           C  
ATOM     64  OE1 GLU A   5      -1.100  -6.008  -9.304  1.00  0.00           O  
ATOM     65  OE2 GLU A   5      -3.167  -6.154  -8.496  1.00  0.00           O  
ATOM     66  H   GLU A   5      -1.159  -0.693  -9.158  1.00  0.00           H  
ATOM     67  HA  GLU A   5      -2.149  -2.299 -11.468  1.00  0.00           H  
ATOM     68  HB2 GLU A   5      -1.192  -3.230  -9.187  1.00  0.00           H  
ATOM     69  HB3 GLU A   5      -2.805  -2.891  -8.569  1.00  0.00           H  
ATOM     70  HG2 GLU A   5      -3.793  -4.429 -10.199  1.00  0.00           H  
ATOM     71  HG3 GLU A   5      -2.264  -4.566 -11.072  1.00  0.00           H  
ATOM     72  N   GLY A   6      -3.727   0.020 -11.033  1.00  0.00           N  
ATOM     73  CA  GLY A   6      -4.849   0.963 -11.150  1.00  0.00           C  
ATOM     74  C   GLY A   6      -5.477   1.484  -9.844  1.00  0.00           C  
ATOM     75  O   GLY A   6      -6.098   2.541  -9.867  1.00  0.00           O  
ATOM     76  H   GLY A   6      -2.854   0.292 -11.468  1.00  0.00           H  
ATOM     77  HA2 GLY A   6      -4.492   1.833 -11.703  1.00  0.00           H  
ATOM     78  HA3 GLY A   6      -5.636   0.502 -11.746  1.00  0.00           H  
ATOM     79  N   ASN A   7      -5.325   0.783  -8.713  1.00  0.00           N  
ATOM     80  CA  ASN A   7      -5.806   1.183  -7.376  1.00  0.00           C  
ATOM     81  C   ASN A   7      -4.687   1.270  -6.318  1.00  0.00           C  
ATOM     82  O   ASN A   7      -4.847   1.960  -5.314  1.00  0.00           O  
ATOM     83  CB  ASN A   7      -6.863   0.169  -6.891  1.00  0.00           C  
ATOM     84  CG  ASN A   7      -8.302   0.447  -7.306  1.00  0.00           C  
ATOM     85  OD1 ASN A   7      -9.195   0.513  -6.479  1.00  0.00           O  
ATOM     86  ND2 ASN A   7      -8.595   0.578  -8.583  1.00  0.00           N  
ATOM     87  H   ASN A   7      -4.957  -0.155  -8.858  1.00  0.00           H  
ATOM     88  HA  ASN A   7      -6.249   2.180  -7.420  1.00  0.00           H  
ATOM     89  HB2 ASN A   7      -6.592  -0.837  -7.212  1.00  0.00           H  
ATOM     90  HB3 ASN A   7      -6.863   0.168  -5.800  1.00  0.00           H  
ATOM     91 HD21 ASN A   7      -7.892   0.575  -9.300  1.00  0.00           H  
ATOM     92 HD22 ASN A   7      -9.573   0.728  -8.761  1.00  0.00           H  
ATOM     93  N   LYS A   8      -3.568   0.572  -6.537  1.00  0.00           N  
ATOM     94  CA  LYS A   8      -2.416   0.431  -5.634  1.00  0.00           C  
ATOM     95  C   LYS A   8      -1.124   0.588  -6.432  1.00  0.00           C  
ATOM     96  O   LYS A   8      -1.133   0.325  -7.638  1.00  0.00           O  
ATOM     97  CB  LYS A   8      -2.420  -0.970  -4.983  1.00  0.00           C  
ATOM     98  CG  LYS A   8      -3.498  -1.269  -3.927  1.00  0.00           C  
ATOM     99  CD  LYS A   8      -3.508  -0.268  -2.760  1.00  0.00           C  
ATOM    100  CE  LYS A   8      -4.065  -0.873  -1.464  1.00  0.00           C  
ATOM    101  NZ  LYS A   8      -5.487  -1.247  -1.565  1.00  0.00           N  
ATOM    102  H   LYS A   8      -3.485   0.137  -7.444  1.00  0.00           H  
ATOM    103  HA  LYS A   8      -2.446   1.206  -4.865  1.00  0.00           H  
ATOM    104  HB2 LYS A   8      -2.505  -1.717  -5.775  1.00  0.00           H  
ATOM    105  HB3 LYS A   8      -1.451  -1.126  -4.504  1.00  0.00           H  
ATOM    106  HG2 LYS A   8      -4.483  -1.302  -4.394  1.00  0.00           H  
ATOM    107  HG3 LYS A   8      -3.282  -2.262  -3.529  1.00  0.00           H  
ATOM    108  HD2 LYS A   8      -2.486   0.053  -2.557  1.00  0.00           H  
ATOM    109  HD3 LYS A   8      -4.095   0.609  -3.035  1.00  0.00           H  
ATOM    110  HE2 LYS A   8      -3.482  -1.758  -1.207  1.00  0.00           H  
ATOM    111  HE3 LYS A   8      -3.954  -0.141  -0.665  1.00  0.00           H  
ATOM    112  HZ1 LYS A   8      -6.029  -0.448  -1.860  1.00  0.00           H  
ATOM    113  HZ2 LYS A   8      -5.596  -1.998  -2.231  1.00  0.00           H  
ATOM    114  HZ3 LYS A   8      -5.814  -1.555  -0.659  1.00  0.00           H  
ATOM    115  N   LEU A   9      -0.018   0.944  -5.766  1.00  0.00           N  
ATOM    116  CA  LEU A   9       1.292   1.146  -6.394  1.00  0.00           C  
ATOM    117  C   LEU A   9       2.361   0.167  -5.883  1.00  0.00           C  
ATOM    118  O   LEU A   9       2.318  -0.286  -4.737  1.00  0.00           O  
ATOM    119  CB  LEU A   9       1.687   2.639  -6.345  1.00  0.00           C  
ATOM    120  CG  LEU A   9       2.934   3.040  -5.534  1.00  0.00           C  
ATOM    121  CD1 LEU A   9       3.450   4.398  -6.013  1.00  0.00           C  
ATOM    122  CD2 LEU A   9       2.613   3.117  -4.037  1.00  0.00           C  
ATOM    123  H   LEU A   9      -0.088   1.097  -4.771  1.00  0.00           H  
ATOM    124  HA  LEU A   9       1.178   0.912  -7.450  1.00  0.00           H  
ATOM    125  HB2 LEU A   9       1.863   2.935  -7.377  1.00  0.00           H  
ATOM    126  HB3 LEU A   9       0.841   3.230  -5.991  1.00  0.00           H  
ATOM    127  HG  LEU A   9       3.742   2.329  -5.702  1.00  0.00           H  
ATOM    128 HD11 LEU A   9       2.676   5.158  -5.906  1.00  0.00           H  
ATOM    129 HD12 LEU A   9       4.326   4.683  -5.433  1.00  0.00           H  
ATOM    130 HD13 LEU A   9       3.740   4.322  -7.063  1.00  0.00           H  
ATOM    131 HD21 LEU A   9       2.216   2.164  -3.688  1.00  0.00           H  
ATOM    132 HD22 LEU A   9       3.520   3.342  -3.478  1.00  0.00           H  
ATOM    133 HD23 LEU A   9       1.875   3.898  -3.851  1.00  0.00           H  
ATOM    134  N   HIS A  10       3.320  -0.152  -6.757  1.00  0.00           N  
ATOM    135  CA  HIS A  10       4.377  -1.146  -6.532  1.00  0.00           C  
ATOM    136  C   HIS A  10       5.715  -0.659  -7.120  1.00  0.00           C  
ATOM    137  O   HIS A  10       5.706   0.153  -8.041  1.00  0.00           O  
ATOM    138  CB  HIS A  10       3.944  -2.467  -7.189  1.00  0.00           C  
ATOM    139  CG  HIS A  10       2.694  -3.114  -6.632  1.00  0.00           C  
ATOM    140  ND1 HIS A  10       2.197  -2.991  -5.352  1.00  0.00           N  
ATOM    141  CD2 HIS A  10       1.848  -3.940  -7.321  1.00  0.00           C  
ATOM    142  CE1 HIS A  10       1.090  -3.749  -5.269  1.00  0.00           C  
ATOM    143  NE2 HIS A  10       0.837  -4.340  -6.445  1.00  0.00           N  
ATOM    144  H   HIS A  10       3.312   0.329  -7.655  1.00  0.00           H  
ATOM    145  HA  HIS A  10       4.515  -1.302  -5.462  1.00  0.00           H  
ATOM    146  HB2 HIS A  10       3.770  -2.280  -8.246  1.00  0.00           H  
ATOM    147  HB3 HIS A  10       4.759  -3.186  -7.111  1.00  0.00           H  
ATOM    148  HD1 HIS A  10       2.495  -2.300  -4.669  1.00  0.00           H  
ATOM    149  HD2 HIS A  10       1.942  -4.227  -8.359  1.00  0.00           H  
ATOM    150  HE1 HIS A  10       0.464  -3.843  -4.392  1.00  0.00           H  
ATOM    151  N   CYS A  11       6.859  -1.156  -6.623  1.00  0.00           N  
ATOM    152  CA  CYS A  11       8.197  -0.702  -7.045  1.00  0.00           C  
ATOM    153  C   CYS A  11       9.212  -1.852  -7.164  1.00  0.00           C  
ATOM    154  O   CYS A  11       8.952  -2.980  -6.751  1.00  0.00           O  
ATOM    155  CB  CYS A  11       8.690   0.380  -6.072  1.00  0.00           C  
ATOM    156  SG  CYS A  11       7.650   1.864  -5.896  1.00  0.00           S  
ATOM    157  H   CYS A  11       6.833  -1.887  -5.929  1.00  0.00           H  
ATOM    158  HA  CYS A  11       8.131  -0.265  -8.036  1.00  0.00           H  
ATOM    159  HB2 CYS A  11       8.780  -0.075  -5.085  1.00  0.00           H  
ATOM    160  HB3 CYS A  11       9.687   0.706  -6.372  1.00  0.00           H  
HETATM  161  N   NH2 A  12      10.391  -1.574  -7.714  1.00  0.00           N  
HETATM  162  HN1 NH2 A  12      10.587  -0.645  -8.071  1.00  0.00           H  
HETATM  163  HN2 NH2 A  12      11.059  -2.323  -7.810  1.00  0.00           H  
TER     164      NH2 A  12                                                      
ENDMDL                                                                          
CONECT    1    2    3    7                                                      
CONECT    2    1                                                                
CONECT    3    1    4    5    6                                                 
CONECT    4    3                                                                
CONECT    5    3                                                                
CONECT    6    3                                                                
CONECT    7    1                                                                
CONECT   12  156                                                                
CONECT  153  161                                                                
CONECT  156   12                                                                
CONECT  161  153  162  163                                                      
CONECT  162  161                                                                
CONECT  163  161                                                                
MASTER      123    0    2    0    2    0    1    6   85    1   13    1          
END