HEADER    DE NOVO PROTEIN                         20-MAY-11   2LDA              
TITLE     SOLUTION STRUCTURE OF THE ESTROGEN RECEPTOR-BINDING STAPLED PEPTIDE   
TITLE    2 SP2 (AC-HKXLHQXLQDS-NH2)                                             
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: ESTROGEN RECEPTOR-BINDING STAPLED PEPTIDE SP2;             
COMPND   3 CHAIN: A;                                                            
COMPND   4 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 SYNTHETIC: YES                                                       
KEYWDS    DE NOVO PROTEIN                                                       
EXPDTA    SOLUTION NMR                                                          
NUMMDL    10                                                                    
AUTHOR    C.PHILLIPS,R.BAZIN,A.BENT,N.DAVIES,R.MOORE,A.PANNIFER,A.PICKFORD,     
AUTHOR   2 S.PRIOR,C.READ,L.ROBERTS,M.SCHADE,A.SCOTT,D.BROWN,B.XU,S.IRVING      
REVDAT   3   15-NOV-23 2LDA    1       ATOM                                     
REVDAT   2   14-JUN-23 2LDA    1       LINK                                     
REVDAT   1   06-JUL-11 2LDA    0                                                
JRNL        AUTH   C.PHILLIPS,L.R.ROBERTS,M.SCHADE,R.BAZIN,A.BENT,N.L.DAVIES,   
JRNL        AUTH 2 R.MOORE,A.D.PANNIFER,A.R.PICKFORD,S.H.PRIOR,C.M.READ,        
JRNL        AUTH 3 A.SCOTT,D.G.BROWN,B.XU,S.L.IRVING                            
JRNL        TITL   DESIGN AND STRUCTURE OF STAPLED PEPTIDES BINDING TO ESTROGEN 
JRNL        TITL 2 RECEPTORS.                                                   
JRNL        REF    J.AM.CHEM.SOC.                V. 133  9696 2011              
JRNL        REFN                   ISSN 0002-7863                               
JRNL        PMID   21612236                                                     
JRNL        DOI    10.1021/JA202946K                                            
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : VNMR, NMRSWARM                                       
REMARK   3   AUTHORS     : VARIAN (VNMR)                                        
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 2LDA COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 27-MAY-11.                  
REMARK 100 THE DEPOSITION ID IS D_1000102256.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 298                                
REMARK 210  PH                             : 5.5                                
REMARK 210  IONIC STRENGTH                 : 50                                 
REMARK 210  PRESSURE                       : AMBIENT                            
REMARK 210  SAMPLE CONTENTS                : 5 MM STAPLED PEPTIDE SP2, 90%      
REMARK 210                                   H2O/10% D2O; 5 MM STAPLED          
REMARK 210                                   PEPTIDE SP2, 100% D2O              
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D 1H-1H COSY; 2D 1H-1H TOCSY;     
REMARK 210                                   2D 1H-1H NOESY                     
REMARK 210  SPECTROMETER FIELD STRENGTH    : 600 MHZ                            
REMARK 210  SPECTROMETER MODEL             : INOVA                              
REMARK 210  SPECTROMETER MANUFACTURER      : VARIAN                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : NMRSWARM 0.1, NMRPIPE, ANALYSIS    
REMARK 210   METHOD USED                   : SIMULATED ANNEALING                
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 10                                 
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 10                                 
REMARK 210 CONFORMERS, SELECTION CRITERIA  : ALL CALCULATED STRUCTURES          
REMARK 210                                   SUBMITTED                          
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1                   
REMARK 210                                                                      
REMARK 210 REMARK: NULL                                                         
REMARK 215                                                                      
REMARK 215 NMR STUDY                                                            
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC                         
REMARK 350 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  9 LEU A   4      -16.08    -49.93                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 17657   RELATED DB: BMRB                                 
REMARK 900 RELATED ID: 2LDC   RELATED DB: PDB                                   
REMARK 900 RELATED ID: 2LDD   RELATED DB: PDB                                   
DBREF  2LDA A    0    12  PDB    2LDA     2LDA             0     12             
SEQRES   1 A   13  ACE HIS LYS MK8 LEU HIS GLN MK8 LEU GLN ASP SER NH2          
MODRES 2LDA MK8 A    3  LEU  2-METHYL-L-NORLEUCINE                              
MODRES 2LDA MK8 A    7  LEU  2-METHYL-L-NORLEUCINE                              
HET    ACE  A   0       6                                                       
HET    MK8  A   3      20                                                       
HET    MK8  A   7      20                                                       
HET    NH2  A  12       3                                                       
HETNAM     ACE ACETYL GROUP                                                     
HETNAM     MK8 2-METHYL-L-NORLEUCINE                                            
HETNAM     NH2 AMINO GROUP                                                      
FORMUL   1  ACE    C2 H4 O                                                      
FORMUL   1  MK8    2(C7 H15 N O2)                                               
FORMUL   1  NH2    H2 N                                                         
HELIX    1   1 HIS A    1  SER A   11  1                                  11    
LINK         C   ACE A   0                 N   HIS A   1     1555   1555  1.38  
LINK         C   LYS A   2                 N   MK8 A   3     1555   1555  1.40  
LINK         C   MK8 A   3                 N   LEU A   4     1555   1555  1.40  
LINK         CE  MK8 A   3                 CE  MK8 A   7     1555   1555  1.39  
LINK         C   GLN A   6                 N   MK8 A   7     1555   1555  1.40  
LINK         C   MK8 A   7                 N   LEU A   8     1555   1555  1.38  
LINK         C   SER A  11                 N   NH2 A  12     1555   1555  1.34  
CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1          
ORIGX1      1.000000  0.000000  0.000000        0.00000                         
ORIGX2      0.000000  1.000000  0.000000        0.00000                         
ORIGX3      0.000000  0.000000  1.000000        0.00000                         
SCALE1      1.000000  0.000000  0.000000        0.00000                         
SCALE2      0.000000  1.000000  0.000000        0.00000                         
SCALE3      0.000000  0.000000  1.000000        0.00000                         
MODEL        1                                                                  
HETATM    1  C   ACE A   0       5.305   5.315   3.608  1.00  0.00           C  
HETATM    2  O   ACE A   0       4.232   4.864   4.050  1.00  0.00           O  
HETATM    3  CH3 ACE A   0       6.587   5.077   4.382  1.00  0.00           C  
HETATM    4  H1  ACE A   0       6.859   5.976   4.915  1.00  0.00           H  
HETATM    5  H2  ACE A   0       7.377   4.812   3.696  1.00  0.00           H  
HETATM    6  H3  ACE A   0       6.437   4.272   5.087  1.00  0.00           H  
ATOM      7  N   HIS A   1       5.443   6.045   2.445  1.00  0.00           N  
ATOM      8  CA  HIS A   1       4.323   6.398   1.546  1.00  0.00           C  
ATOM      9  C   HIS A   1       3.893   5.186   0.693  1.00  0.00           C  
ATOM     10  O   HIS A   1       2.706   5.103   0.321  1.00  0.00           O  
ATOM     11  CB  HIS A   1       4.728   7.594   0.650  1.00  0.00           C  
ATOM     12  CG  HIS A   1       3.582   8.282  -0.046  1.00  0.00           C  
ATOM     13  ND1 HIS A   1       2.533   8.868   0.629  1.00  0.00           N  
ATOM     14  CD2 HIS A   1       3.330   8.468  -1.364  1.00  0.00           C  
ATOM     15  CE1 HIS A   1       1.684   9.384  -0.243  1.00  0.00           C  
ATOM     16  NE2 HIS A   1       2.145   9.155  -1.458  1.00  0.00           N  
ATOM     17  H   HIS A   1       6.342   6.360   2.206  1.00  0.00           H  
ATOM     18  HA  HIS A   1       3.489   6.698   2.165  1.00  0.00           H  
ATOM     19  HB2 HIS A   1       5.227   8.333   1.259  1.00  0.00           H  
ATOM     20  HB3 HIS A   1       5.414   7.250  -0.109  1.00  0.00           H  
ATOM     21  HD1 HIS A   1       2.425   8.898   1.602  1.00  0.00           H  
ATOM     22  HD2 HIS A   1       3.946   8.136  -2.189  1.00  0.00           H  
ATOM     23  HE1 HIS A   1       0.771   9.908  -0.002  1.00  0.00           H  
ATOM     24  HE2 HIS A   1       1.736   9.475  -2.289  1.00  0.00           H  
ATOM     25  N   LYS A   2       4.887   4.272   0.388  1.00  0.00           N  
ATOM     26  CA  LYS A   2       4.669   3.055  -0.439  1.00  0.00           C  
ATOM     27  C   LYS A   2       3.839   1.989   0.262  1.00  0.00           C  
ATOM     28  O   LYS A   2       2.889   1.459  -0.334  1.00  0.00           O  
ATOM     29  CB  LYS A   2       5.989   2.421  -0.896  1.00  0.00           C  
ATOM     30  CG  LYS A   2       6.736   3.217  -1.951  1.00  0.00           C  
ATOM     31  CD  LYS A   2       7.961   2.460  -2.441  1.00  0.00           C  
ATOM     32  CE  LYS A   2       8.757   3.266  -3.459  1.00  0.00           C  
ATOM     33  NZ  LYS A   2       7.959   3.574  -4.681  1.00  0.00           N  
ATOM     34  H   LYS A   2       5.787   4.444   0.729  1.00  0.00           H  
ATOM     35  HA  LYS A   2       4.125   3.368  -1.317  1.00  0.00           H  
ATOM     36  HB2 LYS A   2       6.636   2.296  -0.045  1.00  0.00           H  
ATOM     37  HB3 LYS A   2       5.772   1.446  -1.308  1.00  0.00           H  
ATOM     38  HG2 LYS A   2       6.077   3.395  -2.789  1.00  0.00           H  
ATOM     39  HG3 LYS A   2       7.052   4.158  -1.534  1.00  0.00           H  
ATOM     40  HD2 LYS A   2       8.595   2.240  -1.596  1.00  0.00           H  
ATOM     41  HD3 LYS A   2       7.638   1.536  -2.900  1.00  0.00           H  
ATOM     42  HE2 LYS A   2       9.070   4.193  -3.001  1.00  0.00           H  
ATOM     43  HE3 LYS A   2       9.630   2.696  -3.744  1.00  0.00           H  
ATOM     44  HZ1 LYS A   2       8.431   3.188  -5.523  1.00  0.00           H  
ATOM     45  HZ2 LYS A   2       7.860   4.603  -4.793  1.00  0.00           H  
ATOM     46  HZ3 LYS A   2       7.011   3.153  -4.603  1.00  0.00           H  
HETATM   47  C   MK8 A   3       2.001   0.633   2.254  1.00  0.00           C  
HETATM   48  N   MK8 A   3       4.234   1.616   1.549  1.00  0.00           N  
HETATM   49  O   MK8 A   3       1.285  -0.393   2.287  1.00  0.00           O  
HETATM   50  CA  MK8 A   3       3.577   0.533   2.375  1.00  0.00           C  
HETATM   51  CB  MK8 A   3       4.034   0.705   3.887  1.00  0.00           C  
HETATM   52  CD  MK8 A   3       2.023   0.196   5.428  1.00  0.00           C  
HETATM   53  CE  MK8 A   3       1.154  -0.812   6.250  1.00  0.00           C  
HETATM   54  CG  MK8 A   3       3.423  -0.224   5.000  1.00  0.00           C  
HETATM   55  CB1 MK8 A   3       4.157  -0.802   1.808  1.00  0.00           C  
HETATM   56  H   MK8 A   3       5.018   2.052   1.930  1.00  0.00           H  
HETATM   57  HB  MK8 A   3       3.824   1.727   4.174  1.00  0.00           H  
HETATM   58  HBA MK8 A   3       5.102   0.570   3.922  1.00  0.00           H  
HETATM   59  HD  MK8 A   3       1.479   0.451   4.531  1.00  0.00           H  
HETATM   60  HDA MK8 A   3       2.124   1.088   6.022  1.00  0.00           H  
HETATM   61  HE  MK8 A   3       1.311  -0.817   7.320  1.00  0.00           H  
HETATM   62  HG  MK8 A   3       4.077  -0.201   5.862  1.00  0.00           H  
HETATM   63  HGA MK8 A   3       3.375  -1.232   4.619  1.00  0.00           H  
HETATM   64  HB1 MK8 A   3       4.427  -0.664   0.771  1.00  0.00           H  
HETATM   65 HB1A MK8 A   3       3.417  -1.582   1.888  1.00  0.00           H  
HETATM   66 HB1B MK8 A   3       5.035  -1.079   2.375  1.00  0.00           H  
ATOM     67  N   LEU A   4       1.511   1.931   2.105  1.00  0.00           N  
ATOM     68  CA  LEU A   4       0.068   2.262   1.978  1.00  0.00           C  
ATOM     69  C   LEU A   4      -0.504   1.705   0.678  1.00  0.00           C  
ATOM     70  O   LEU A   4      -1.522   0.991   0.722  1.00  0.00           O  
ATOM     71  CB  LEU A   4      -0.197   3.809   2.051  1.00  0.00           C  
ATOM     72  CG  LEU A   4      -1.573   4.367   2.623  1.00  0.00           C  
ATOM     73  CD1 LEU A   4      -2.829   3.905   1.860  1.00  0.00           C  
ATOM     74  CD2 LEU A   4      -1.746   4.086   4.120  1.00  0.00           C  
ATOM     75  H   LEU A   4       2.159   2.671   2.081  1.00  0.00           H  
ATOM     76  HA  LEU A   4      -0.443   1.787   2.798  1.00  0.00           H  
ATOM     77  HB2 LEU A   4       0.588   4.240   2.651  1.00  0.00           H  
ATOM     78  HB3 LEU A   4      -0.087   4.196   1.048  1.00  0.00           H  
ATOM     79  HG  LEU A   4      -1.543   5.443   2.518  1.00  0.00           H  
ATOM     80 HD11 LEU A   4      -3.658   4.551   2.107  1.00  0.00           H  
ATOM     81 HD12 LEU A   4      -3.066   2.890   2.147  1.00  0.00           H  
ATOM     82 HD13 LEU A   4      -2.640   3.944   0.800  1.00  0.00           H  
ATOM     83 HD21 LEU A   4      -2.449   3.275   4.254  1.00  0.00           H  
ATOM     84 HD22 LEU A   4      -2.125   4.972   4.610  1.00  0.00           H  
ATOM     85 HD23 LEU A   4      -0.795   3.815   4.550  1.00  0.00           H  
ATOM     86  N   HIS A   5       0.182   2.036  -0.486  1.00  0.00           N  
ATOM     87  CA  HIS A   5      -0.212   1.575  -1.845  1.00  0.00           C  
ATOM     88  C   HIS A   5      -0.389   0.048  -1.881  1.00  0.00           C  
ATOM     89  O   HIS A   5      -1.198  -0.469  -2.670  1.00  0.00           O  
ATOM     90  CB  HIS A   5       0.844   1.989  -2.871  1.00  0.00           C  
ATOM     91  CG  HIS A   5       0.848   3.458  -3.163  1.00  0.00           C  
ATOM     92  ND1 HIS A   5       1.077   4.414  -2.196  1.00  0.00           N  
ATOM     93  CD2 HIS A   5       0.646   4.138  -4.320  1.00  0.00           C  
ATOM     94  CE1 HIS A   5       1.014   5.616  -2.743  1.00  0.00           C  
ATOM     95  NE2 HIS A   5       0.755   5.475  -4.029  1.00  0.00           N  
ATOM     96  H   HIS A   5       0.983   2.604  -0.411  1.00  0.00           H  
ATOM     97  HA  HIS A   5      -1.147   2.054  -2.105  1.00  0.00           H  
ATOM     98  HB2 HIS A   5       1.821   1.723  -2.497  1.00  0.00           H  
ATOM     99  HB3 HIS A   5       0.660   1.464  -3.796  1.00  0.00           H  
ATOM    100  HD1 HIS A   5       1.259   4.237  -1.250  1.00  0.00           H  
ATOM    101  HD2 HIS A   5       0.435   3.709  -5.291  1.00  0.00           H  
ATOM    102  HE1 HIS A   5       1.153   6.554  -2.226  1.00  0.00           H  
ATOM    103  HE2 HIS A   5       0.710   6.206  -4.681  1.00  0.00           H  
ATOM    104  N   GLN A   6       0.428  -0.640  -1.010  1.00  0.00           N  
ATOM    105  CA  GLN A   6       0.462  -2.117  -0.884  1.00  0.00           C  
ATOM    106  C   GLN A   6      -0.789  -2.740  -0.245  1.00  0.00           C  
ATOM    107  O   GLN A   6      -1.435  -3.569  -0.909  1.00  0.00           O  
ATOM    108  CB  GLN A   6       1.710  -2.587  -0.117  1.00  0.00           C  
ATOM    109  CG  GLN A   6       2.968  -2.753  -0.976  1.00  0.00           C  
ATOM    110  CD  GLN A   6       2.893  -3.933  -1.930  1.00  0.00           C  
ATOM    111  OE1 GLN A   6       2.002  -4.005  -2.776  1.00  0.00           O  
ATOM    112  NE2 GLN A   6       3.832  -4.860  -1.802  1.00  0.00           N  
ATOM    113  H   GLN A   6       1.048  -0.111  -0.465  1.00  0.00           H  
ATOM    114  HA  GLN A   6       0.536  -2.505  -1.890  1.00  0.00           H  
ATOM    115  HB2 GLN A   6       1.929  -1.876   0.660  1.00  0.00           H  
ATOM    116  HB3 GLN A   6       1.490  -3.539   0.341  1.00  0.00           H  
ATOM    117  HG2 GLN A   6       3.117  -1.860  -1.557  1.00  0.00           H  
ATOM    118  HG3 GLN A   6       3.814  -2.896  -0.321  1.00  0.00           H  
ATOM    119 HE21 GLN A   6       4.515  -4.738  -1.110  1.00  0.00           H  
ATOM    120 HE22 GLN A   6       3.804  -5.629  -2.404  1.00  0.00           H  
HETATM  121  C   MK8 A   7      -3.580  -2.948   0.972  1.00  0.00           C  
HETATM  122  N   MK8 A   7      -1.108  -2.387   1.075  1.00  0.00           N  
HETATM  123  O   MK8 A   7      -4.535  -3.723   1.215  1.00  0.00           O  
HETATM  124  CA  MK8 A   7      -2.273  -2.967   1.845  1.00  0.00           C  
HETATM  125  CB  MK8 A   7      -2.598  -2.192   3.173  1.00  0.00           C  
HETATM  126  CD  MK8 A   7      -0.252  -1.935   4.298  1.00  0.00           C  
HETATM  127  CE  MK8 A   7       0.199  -1.705   5.773  1.00  0.00           C  
HETATM  128  CG  MK8 A   7      -1.538  -1.250   3.813  1.00  0.00           C  
HETATM  129  CB1 MK8 A   7      -1.879  -4.388   2.283  1.00  0.00           C  
HETATM  130  H   MK8 A   7      -0.533  -1.754   1.556  1.00  0.00           H  
HETATM  131  HB  MK8 A   7      -2.859  -2.932   3.918  1.00  0.00           H  
HETATM  132  HBA MK8 A   7      -3.475  -1.591   2.996  1.00  0.00           H  
HETATM  133  HD  MK8 A   7       0.551  -1.602   3.651  1.00  0.00           H  
HETATM  134  HDA MK8 A   7      -0.373  -2.993   4.157  1.00  0.00           H  
HETATM  135  HE  MK8 A   7      -0.291  -2.314   6.515  1.00  0.00           H  
HETATM  136  HG  MK8 A   7      -2.004  -0.771   4.663  1.00  0.00           H  
HETATM  137  HGA MK8 A   7      -1.272  -0.502   3.100  1.00  0.00           H  
HETATM  138  HB1 MK8 A   7      -2.323  -5.106   1.613  1.00  0.00           H  
HETATM  139 HB1A MK8 A   7      -2.233  -4.564   3.289  1.00  0.00           H  
HETATM  140 HB1B MK8 A   7      -0.804  -4.485   2.259  1.00  0.00           H  
ATOM    141  N   LEU A   8      -3.600  -1.984  -0.020  1.00  0.00           N  
ATOM    142  CA  LEU A   8      -4.743  -1.743  -0.944  1.00  0.00           C  
ATOM    143  C   LEU A   8      -5.041  -2.932  -1.871  1.00  0.00           C  
ATOM    144  O   LEU A   8      -6.229  -3.227  -2.107  1.00  0.00           O  
ATOM    145  CB  LEU A   8      -4.497  -0.463  -1.819  1.00  0.00           C  
ATOM    146  CG  LEU A   8      -5.699   0.488  -2.221  1.00  0.00           C  
ATOM    147  CD1 LEU A   8      -6.836  -0.188  -3.017  1.00  0.00           C  
ATOM    148  CD2 LEU A   8      -6.263   1.238  -1.011  1.00  0.00           C  
ATOM    149  H   LEU A   8      -2.823  -1.400  -0.099  1.00  0.00           H  
ATOM    150  HA  LEU A   8      -5.616  -1.570  -0.332  1.00  0.00           H  
ATOM    151  HB2 LEU A   8      -3.785   0.149  -1.291  1.00  0.00           H  
ATOM    152  HB3 LEU A   8      -4.027  -0.792  -2.735  1.00  0.00           H  
ATOM    153  HG  LEU A   8      -5.293   1.243  -2.879  1.00  0.00           H  
ATOM    154 HD11 LEU A   8      -6.900   0.252  -4.001  1.00  0.00           H  
ATOM    155 HD12 LEU A   8      -7.772  -0.046  -2.498  1.00  0.00           H  
ATOM    156 HD13 LEU A   8      -6.632  -1.245  -3.107  1.00  0.00           H  
ATOM    157 HD21 LEU A   8      -7.264   0.890  -0.806  1.00  0.00           H  
ATOM    158 HD22 LEU A   8      -6.286   2.296  -1.224  1.00  0.00           H  
ATOM    159 HD23 LEU A   8      -5.635   1.057  -0.151  1.00  0.00           H  
ATOM    160  N   GLN A   9      -3.942  -3.573  -2.420  1.00  0.00           N  
ATOM    161  CA  GLN A   9      -4.035  -4.710  -3.376  1.00  0.00           C  
ATOM    162  C   GLN A   9      -4.284  -6.054  -2.686  1.00  0.00           C  
ATOM    163  O   GLN A   9      -5.060  -6.868  -3.225  1.00  0.00           O  
ATOM    164  CB  GLN A   9      -2.768  -4.804  -4.252  1.00  0.00           C  
ATOM    165  CG  GLN A   9      -2.614  -3.686  -5.284  1.00  0.00           C  
ATOM    166  CD  GLN A   9      -3.630  -3.759  -6.418  1.00  0.00           C  
ATOM    167  OE1 GLN A   9      -4.837  -3.774  -6.183  1.00  0.00           O  
ATOM    168  NE2 GLN A   9      -3.139  -3.793  -7.655  1.00  0.00           N  
ATOM    169  H   GLN A   9      -3.053  -3.238  -2.189  1.00  0.00           H  
ATOM    170  HA  GLN A   9      -4.876  -4.511  -4.022  1.00  0.00           H  
ATOM    171  HB2 GLN A   9      -1.900  -4.783  -3.613  1.00  0.00           H  
ATOM    172  HB3 GLN A   9      -2.784  -5.747  -4.780  1.00  0.00           H  
ATOM    173  HG2 GLN A   9      -2.727  -2.737  -4.786  1.00  0.00           H  
ATOM    174  HG3 GLN A   9      -1.622  -3.748  -5.710  1.00  0.00           H  
ATOM    175 HE21 GLN A   9      -2.165  -3.770  -7.768  1.00  0.00           H  
ATOM    176 HE22 GLN A   9      -3.771  -3.838  -8.405  1.00  0.00           H  
ATOM    177  N   ASP A  10      -3.613  -6.266  -1.496  1.00  0.00           N  
ATOM    178  CA  ASP A  10      -3.726  -7.506  -0.690  1.00  0.00           C  
ATOM    179  C   ASP A  10      -5.131  -7.626  -0.080  1.00  0.00           C  
ATOM    180  O   ASP A  10      -5.708  -8.730  -0.082  1.00  0.00           O  
ATOM    181  CB  ASP A  10      -2.631  -7.542   0.401  1.00  0.00           C  
ATOM    182  CG  ASP A  10      -2.647  -8.811   1.244  1.00  0.00           C  
ATOM    183  OD1 ASP A  10      -2.495  -9.907   0.669  1.00  0.00           O  
ATOM    184  OD2 ASP A  10      -2.815  -8.702   2.476  1.00  0.00           O  
ATOM    185  H   ASP A  10      -3.030  -5.554  -1.166  1.00  0.00           H  
ATOM    186  HA  ASP A  10      -3.576  -8.342  -1.362  1.00  0.00           H  
ATOM    187  HB2 ASP A  10      -1.661  -7.476  -0.072  1.00  0.00           H  
ATOM    188  HB3 ASP A  10      -2.758  -6.696   1.056  1.00  0.00           H  
ATOM    189  N   SER A  11      -5.648  -6.461   0.441  1.00  0.00           N  
ATOM    190  CA  SER A  11      -6.978  -6.347   1.080  1.00  0.00           C  
ATOM    191  C   SER A  11      -8.083  -6.169   0.025  1.00  0.00           C  
ATOM    192  O   SER A  11      -9.250  -5.956   0.361  1.00  0.00           O  
ATOM    193  CB  SER A  11      -6.967  -5.176   2.083  1.00  0.00           C  
ATOM    194  OG  SER A  11      -5.816  -5.235   2.910  1.00  0.00           O  
ATOM    195  H   SER A  11      -5.097  -5.655   0.386  1.00  0.00           H  
ATOM    196  HA  SER A  11      -7.165  -7.267   1.620  1.00  0.00           H  
ATOM    197  HB2 SER A  11      -6.956  -4.238   1.547  1.00  0.00           H  
ATOM    198  HB3 SER A  11      -7.845  -5.220   2.715  1.00  0.00           H  
ATOM    199  HG  SER A  11      -5.984  -5.819   3.653  1.00  0.00           H  
HETATM  200  N   NH2 A  12      -7.735  -6.349  -1.255  1.00  0.00           N  
HETATM  201  HN1 NH2 A  12      -6.804  -6.577  -1.457  1.00  0.00           H  
HETATM  202  HN2 NH2 A  12      -8.431  -6.257  -1.945  1.00  0.00           H  
TER     203      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        2                                                                  
HETATM    1  C   ACE A   0       4.927   5.568   3.396  1.00  0.00           C  
HETATM    2  O   ACE A   0       3.912   4.982   3.820  1.00  0.00           O  
HETATM    3  CH3 ACE A   0       6.201   5.531   4.214  1.00  0.00           C  
HETATM    4  H1  ACE A   0       6.367   4.527   4.575  1.00  0.00           H  
HETATM    5  H2  ACE A   0       6.111   6.206   5.052  1.00  0.00           H  
HETATM    6  H3  ACE A   0       7.034   5.834   3.596  1.00  0.00           H  
ATOM      7  N   HIS A   1       5.004   6.279   2.217  1.00  0.00           N  
ATOM      8  CA  HIS A   1       3.879   6.450   1.275  1.00  0.00           C  
ATOM      9  C   HIS A   1       3.655   5.169   0.448  1.00  0.00           C  
ATOM     10  O   HIS A   1       2.524   4.935  -0.013  1.00  0.00           O  
ATOM     11  CB  HIS A   1       4.147   7.659   0.356  1.00  0.00           C  
ATOM     12  CG  HIS A   1       2.927   8.194  -0.342  1.00  0.00           C  
ATOM     13  ND1 HIS A   1       1.835   8.702   0.332  1.00  0.00           N  
ATOM     14  CD2 HIS A   1       2.635   8.304  -1.661  1.00  0.00           C  
ATOM     15  CE1 HIS A   1       0.926   9.099  -0.542  1.00  0.00           C  
ATOM     16  NE2 HIS A   1       1.387   8.869  -1.756  1.00  0.00           N  
ATOM     17  H   HIS A   1       5.858   6.708   1.996  1.00  0.00           H  
ATOM     18  HA  HIS A   1       2.992   6.647   1.858  1.00  0.00           H  
ATOM     19  HB2 HIS A   1       4.562   8.462   0.947  1.00  0.00           H  
ATOM     20  HB3 HIS A   1       4.863   7.378  -0.402  1.00  0.00           H  
ATOM     21  HD1 HIS A   1       1.741   8.763   1.305  1.00  0.00           H  
ATOM     22  HD2 HIS A   1       3.267   8.004  -2.485  1.00  0.00           H  
ATOM     23  HE1 HIS A   1      -0.032   9.540  -0.302  1.00  0.00           H  
ATOM     24  HE2 HIS A   1       0.881   8.994  -2.586  1.00  0.00           H  
ATOM     25  N   LYS A   2       4.766   4.363   0.268  1.00  0.00           N  
ATOM     26  CA  LYS A   2       4.760   3.092  -0.510  1.00  0.00           C  
ATOM     27  C   LYS A   2       3.999   1.941   0.182  1.00  0.00           C  
ATOM     28  O   LYS A   2       3.224   1.219  -0.479  1.00  0.00           O  
ATOM     29  CB  LYS A   2       6.191   2.626  -0.845  1.00  0.00           C  
ATOM     30  CG  LYS A   2       6.918   3.478  -1.884  1.00  0.00           C  
ATOM     31  CD  LYS A   2       8.270   2.872  -2.243  1.00  0.00           C  
ATOM     32  CE  LYS A   2       9.028   3.712  -3.267  1.00  0.00           C  
ATOM     33  NZ  LYS A   2       8.285   3.840  -4.553  1.00  0.00           N  
ATOM     34  H   LYS A   2       5.609   4.654   0.672  1.00  0.00           H  
ATOM     35  HA  LYS A   2       4.255   3.304  -1.439  1.00  0.00           H  
ATOM     36  HB2 LYS A   2       6.781   2.623   0.057  1.00  0.00           H  
ATOM     37  HB3 LYS A   2       6.140   1.617  -1.223  1.00  0.00           H  
ATOM     38  HG2 LYS A   2       6.313   3.536  -2.777  1.00  0.00           H  
ATOM     39  HG3 LYS A   2       7.075   4.469  -1.488  1.00  0.00           H  
ATOM     40  HD2 LYS A   2       8.867   2.796  -1.347  1.00  0.00           H  
ATOM     41  HD3 LYS A   2       8.110   1.885  -2.652  1.00  0.00           H  
ATOM     42  HE2 LYS A   2       9.195   4.697  -2.858  1.00  0.00           H  
ATOM     43  HE3 LYS A   2       9.982   3.241  -3.461  1.00  0.00           H  
ATOM     44  HZ1 LYS A   2       8.939   4.101  -5.319  1.00  0.00           H  
ATOM     45  HZ2 LYS A   2       7.553   4.574  -4.471  1.00  0.00           H  
ATOM     46  HZ3 LYS A   2       7.830   2.936  -4.793  1.00  0.00           H  
HETATM   47  C   MK8 A   3       2.088   0.512   2.066  1.00  0.00           C  
HETATM   48  N   MK8 A   3       4.256   1.724   1.539  1.00  0.00           N  
HETATM   49  O   MK8 A   3       1.552  -0.544   1.647  1.00  0.00           O  
HETATM   50  CA  MK8 A   3       3.646   0.606   2.363  1.00  0.00           C  
HETATM   51  CB  MK8 A   3       3.862   0.929   3.906  1.00  0.00           C  
HETATM   52  CD  MK8 A   3       1.785  -0.031   5.194  1.00  0.00           C  
HETATM   53  CE  MK8 A   3       1.184  -0.738   6.430  1.00  0.00           C  
HETATM   54  CG  MK8 A   3       3.307  -0.046   5.022  1.00  0.00           C  
HETATM   55  CB1 MK8 A   3       4.461  -0.681   1.970  1.00  0.00           C  
HETATM   56  H   MK8 A   3       4.902   2.308   1.982  1.00  0.00           H  
HETATM   57  HB  MK8 A   3       3.429   1.903   4.092  1.00  0.00           H  
HETATM   58  HBA MK8 A   3       4.923   1.009   4.072  1.00  0.00           H  
HETATM   59  HD  MK8 A   3       1.361  -0.499   4.314  1.00  0.00           H  
HETATM   60  HDA MK8 A   3       1.461   0.994   5.215  1.00  0.00           H  
HETATM   61  HE  MK8 A   3       1.798  -0.758   7.319  1.00  0.00           H  
HETATM   62  HG  MK8 A   3       3.765   0.222   5.965  1.00  0.00           H  
HETATM   63  HGA MK8 A   3       3.601  -1.052   4.768  1.00  0.00           H  
HETATM   64  HB1 MK8 A   3       3.876  -1.284   1.291  1.00  0.00           H  
HETATM   65 HB1A MK8 A   3       4.682  -1.253   2.858  1.00  0.00           H  
HETATM   66 HB1B MK8 A   3       5.385  -0.390   1.491  1.00  0.00           H  
ATOM     67  N   LEU A   4       1.375   1.674   2.361  1.00  0.00           N  
ATOM     68  CA  LEU A   4      -0.102   1.808   2.219  1.00  0.00           C  
ATOM     69  C   LEU A   4      -0.589   1.414   0.826  1.00  0.00           C  
ATOM     70  O   LEU A   4      -1.730   0.921   0.711  1.00  0.00           O  
ATOM     71  CB  LEU A   4      -0.591   3.227   2.599  1.00  0.00           C  
ATOM     72  CG  LEU A   4      -2.116   3.387   2.850  1.00  0.00           C  
ATOM     73  CD1 LEU A   4      -2.533   2.895   4.244  1.00  0.00           C  
ATOM     74  CD2 LEU A   4      -2.532   4.837   2.660  1.00  0.00           C  
ATOM     75  H   LEU A   4       1.874   2.440   2.716  1.00  0.00           H  
ATOM     76  HA  LEU A   4      -0.537   1.112   2.915  1.00  0.00           H  
ATOM     77  HB2 LEU A   4      -0.074   3.530   3.498  1.00  0.00           H  
ATOM     78  HB3 LEU A   4      -0.312   3.902   1.803  1.00  0.00           H  
ATOM     79  HG  LEU A   4      -2.652   2.795   2.124  1.00  0.00           H  
ATOM     80 HD11 LEU A   4      -1.718   3.039   4.937  1.00  0.00           H  
ATOM     81 HD12 LEU A   4      -2.779   1.843   4.194  1.00  0.00           H  
ATOM     82 HD13 LEU A   4      -3.397   3.449   4.579  1.00  0.00           H  
ATOM     83 HD21 LEU A   4      -2.419   5.110   1.621  1.00  0.00           H  
ATOM     84 HD22 LEU A   4      -1.909   5.474   3.270  1.00  0.00           H  
ATOM     85 HD23 LEU A   4      -3.565   4.956   2.952  1.00  0.00           H  
ATOM     86  N   HIS A   5       0.299   1.622  -0.216  1.00  0.00           N  
ATOM     87  CA  HIS A   5       0.007   1.280  -1.626  1.00  0.00           C  
ATOM     88  C   HIS A   5      -0.210  -0.233  -1.730  1.00  0.00           C  
ATOM     89  O   HIS A   5      -1.136  -0.689  -2.422  1.00  0.00           O  
ATOM     90  CB  HIS A   5       1.150   1.748  -2.534  1.00  0.00           C  
ATOM     91  CG  HIS A   5       0.723   2.120  -3.923  1.00  0.00           C  
ATOM     92  ND1 HIS A   5       0.180   1.221  -4.817  1.00  0.00           N  
ATOM     93  CD2 HIS A   5       0.761   3.313  -4.571  1.00  0.00           C  
ATOM     94  CE1 HIS A   5      -0.097   1.845  -5.951  1.00  0.00           C  
ATOM     95  NE2 HIS A   5       0.245   3.112  -5.826  1.00  0.00           N  
ATOM     96  H   HIS A   5       1.176   2.004  -0.007  1.00  0.00           H  
ATOM     97  HA  HIS A   5      -0.903   1.784  -1.908  1.00  0.00           H  
ATOM     98  HB2 HIS A   5       1.612   2.618  -2.090  1.00  0.00           H  
ATOM     99  HB3 HIS A   5       1.883   0.960  -2.609  1.00  0.00           H  
ATOM    100  HD1 HIS A   5       0.023   0.268  -4.648  1.00  0.00           H  
ATOM    101  HD2 HIS A   5       1.129   4.250  -4.174  1.00  0.00           H  
ATOM    102  HE1 HIS A   5      -0.530   1.396  -6.832  1.00  0.00           H  
ATOM    103  HE2 HIS A   5       0.033   3.818  -6.471  1.00  0.00           H  
ATOM    104  N   GLN A   6       0.678  -0.983  -0.995  1.00  0.00           N  
ATOM    105  CA  GLN A   6       0.664  -2.465  -0.916  1.00  0.00           C  
ATOM    106  C   GLN A   6      -0.591  -3.020  -0.220  1.00  0.00           C  
ATOM    107  O   GLN A   6      -1.274  -3.879  -0.797  1.00  0.00           O  
ATOM    108  CB  GLN A   6       1.916  -2.977  -0.189  1.00  0.00           C  
ATOM    109  CG  GLN A   6       3.172  -2.991  -1.050  1.00  0.00           C  
ATOM    110  CD  GLN A   6       3.178  -4.127  -2.054  1.00  0.00           C  
ATOM    111  OE1 GLN A   6       2.266  -4.253  -2.869  1.00  0.00           O  
ATOM    112  NE2 GLN A   6       4.209  -4.960  -2.001  1.00  0.00           N  
ATOM    113  H   GLN A   6       1.371  -0.492  -0.497  1.00  0.00           H  
ATOM    114  HA  GLN A   6       0.678  -2.844  -1.926  1.00  0.00           H  
ATOM    115  HB2 GLN A   6       2.104  -2.354   0.670  1.00  0.00           H  
ATOM    116  HB3 GLN A   6       1.730  -3.984   0.149  1.00  0.00           H  
ATOM    117  HG2 GLN A   6       3.236  -2.063  -1.590  1.00  0.00           H  
ATOM    118  HG3 GLN A   6       4.034  -3.091  -0.407  1.00  0.00           H  
ATOM    119 HE21 GLN A   6       4.902  -4.799  -1.326  1.00  0.00           H  
ATOM    120 HE22 GLN A   6       4.235  -5.700  -2.638  1.00  0.00           H  
HETATM  121  C   MK8 A   7      -3.363  -2.829   1.059  1.00  0.00           C  
HETATM  122  N   MK8 A   7      -0.871  -2.533   1.050  1.00  0.00           N  
HETATM  123  O   MK8 A   7      -4.345  -3.613   1.218  1.00  0.00           O  
HETATM  124  CA  MK8 A   7      -2.031  -2.969   1.900  1.00  0.00           C  
HETATM  125  CB  MK8 A   7      -2.172  -2.021   3.147  1.00  0.00           C  
HETATM  126  CD  MK8 A   7      -1.180  -1.511   5.443  1.00  0.00           C  
HETATM  127  CE  MK8 A   7      -0.049  -1.356   6.529  1.00  0.00           C  
HETATM  128  CG  MK8 A   7      -0.881  -1.629   3.933  1.00  0.00           C  
HETATM  129  CB1 MK8 A   7      -1.791  -4.438   2.394  1.00  0.00           C  
HETATM  130  H   MK8 A   7      -0.272  -1.874   1.427  1.00  0.00           H  
HETATM  131  HB  MK8 A   7      -2.853  -2.489   3.843  1.00  0.00           H  
HETATM  132  HBA MK8 A   7      -2.624  -1.101   2.809  1.00  0.00           H  
HETATM  133  HD  MK8 A   7      -1.754  -2.395   5.706  1.00  0.00           H  
HETATM  134  HDA MK8 A   7      -1.830  -0.665   5.569  1.00  0.00           H  
HETATM  135  HE  MK8 A   7      -0.269  -1.788   7.497  1.00  0.00           H  
HETATM  136  HG  MK8 A   7      -0.523  -0.673   3.575  1.00  0.00           H  
HETATM  137  HGA MK8 A   7      -0.128  -2.386   3.766  1.00  0.00           H  
HETATM  138  HB1 MK8 A   7      -2.736  -4.886   2.666  1.00  0.00           H  
HETATM  139 HB1A MK8 A   7      -1.141  -4.424   3.257  1.00  0.00           H  
HETATM  140 HB1B MK8 A   7      -1.330  -5.014   1.607  1.00  0.00           H  
ATOM    141  N   LEU A   8      -3.370  -1.757   0.181  1.00  0.00           N  
ATOM    142  CA  LEU A   8      -4.515  -1.400  -0.700  1.00  0.00           C  
ATOM    143  C   LEU A   8      -4.814  -2.498  -1.739  1.00  0.00           C  
ATOM    144  O   LEU A   8      -5.983  -2.636  -2.150  1.00  0.00           O  
ATOM    145  CB  LEU A   8      -4.257  -0.045  -1.403  1.00  0.00           C  
ATOM    146  CG  LEU A   8      -5.470   0.623  -2.099  1.00  0.00           C  
ATOM    147  CD1 LEU A   8      -6.365   1.365  -1.104  1.00  0.00           C  
ATOM    148  CD2 LEU A   8      -4.995   1.575  -3.186  1.00  0.00           C  
ATOM    149  H   LEU A   8      -2.573  -1.183   0.154  1.00  0.00           H  
ATOM    150  HA  LEU A   8      -5.382  -1.293  -0.066  1.00  0.00           H  
ATOM    151  HB2 LEU A   8      -3.877   0.645  -0.664  1.00  0.00           H  
ATOM    152  HB3 LEU A   8      -3.491  -0.198  -2.148  1.00  0.00           H  
ATOM    153  HG  LEU A   8      -6.067  -0.143  -2.570  1.00  0.00           H  
ATOM    154 HD11 LEU A   8      -5.819   1.543  -0.191  1.00  0.00           H  
ATOM    155 HD12 LEU A   8      -7.238   0.765  -0.891  1.00  0.00           H  
ATOM    156 HD13 LEU A   8      -6.673   2.308  -1.531  1.00  0.00           H  
ATOM    157 HD21 LEU A   8      -5.159   2.594  -2.868  1.00  0.00           H  
ATOM    158 HD22 LEU A   8      -5.548   1.388  -4.095  1.00  0.00           H  
ATOM    159 HD23 LEU A   8      -3.942   1.419  -3.367  1.00  0.00           H  
ATOM    160  N   GLN A   9      -3.728  -3.242  -2.171  1.00  0.00           N  
ATOM    161  CA  GLN A   9      -3.816  -4.318  -3.198  1.00  0.00           C  
ATOM    162  C   GLN A   9      -4.297  -5.675  -2.652  1.00  0.00           C  
ATOM    163  O   GLN A   9      -5.231  -6.253  -3.242  1.00  0.00           O  
ATOM    164  CB  GLN A   9      -2.479  -4.498  -3.932  1.00  0.00           C  
ATOM    165  CG  GLN A   9      -2.360  -3.637  -5.184  1.00  0.00           C  
ATOM    166  CD  GLN A   9      -1.348  -4.177  -6.182  1.00  0.00           C  
ATOM    167  OE1 GLN A   9      -1.440  -5.325  -6.611  1.00  0.00           O  
ATOM    168  NE2 GLN A   9      -0.386  -3.344  -6.574  1.00  0.00           N  
ATOM    169  H   GLN A   9      -2.848  -3.028  -1.796  1.00  0.00           H  
ATOM    170  HA  GLN A   9      -4.541  -3.982  -3.928  1.00  0.00           H  
ATOM    171  HB2 GLN A   9      -1.673  -4.235  -3.263  1.00  0.00           H  
ATOM    172  HB3 GLN A   9      -2.374  -5.534  -4.221  1.00  0.00           H  
ATOM    173  HG2 GLN A   9      -3.326  -3.594  -5.665  1.00  0.00           H  
ATOM    174  HG3 GLN A   9      -2.061  -2.641  -4.892  1.00  0.00           H  
ATOM    175 HE21 GLN A   9      -0.379  -2.438  -6.205  1.00  0.00           H  
ATOM    176 HE22 GLN A   9       0.277  -3.672  -7.220  1.00  0.00           H  
ATOM    177  N   ASP A  10      -3.618  -6.189  -1.557  1.00  0.00           N  
ATOM    178  CA  ASP A  10      -3.922  -7.515  -0.936  1.00  0.00           C  
ATOM    179  C   ASP A  10      -5.306  -7.563  -0.241  1.00  0.00           C  
ATOM    180  O   ASP A  10      -5.858  -8.669  -0.085  1.00  0.00           O  
ATOM    181  CB  ASP A  10      -2.803  -7.917   0.054  1.00  0.00           C  
ATOM    182  CG  ASP A  10      -2.952  -9.341   0.572  1.00  0.00           C  
ATOM    183  OD1 ASP A  10      -2.903 -10.279  -0.250  1.00  0.00           O  
ATOM    184  OD2 ASP A  10      -3.119  -9.514   1.797  1.00  0.00           O  
ATOM    185  H   ASP A  10      -2.870  -5.667  -1.191  1.00  0.00           H  
ATOM    186  HA  ASP A  10      -3.928  -8.242  -1.739  1.00  0.00           H  
ATOM    187  HB2 ASP A  10      -1.847  -7.845  -0.445  1.00  0.00           H  
ATOM    188  HB3 ASP A  10      -2.808  -7.247   0.900  1.00  0.00           H  
ATOM    189  N   SER A  11      -5.828  -6.358   0.192  1.00  0.00           N  
ATOM    190  CA  SER A  11      -7.129  -6.212   0.906  1.00  0.00           C  
ATOM    191  C   SER A  11      -8.354  -6.160  -0.059  1.00  0.00           C  
ATOM    192  O   SER A  11      -9.467  -5.792   0.351  1.00  0.00           O  
ATOM    193  CB  SER A  11      -7.052  -4.960   1.810  1.00  0.00           C  
ATOM    194  OG  SER A  11      -5.934  -5.029   2.680  1.00  0.00           O  
ATOM    195  H   SER A  11      -5.300  -5.549   0.038  1.00  0.00           H  
ATOM    196  HA  SER A  11      -7.244  -7.081   1.541  1.00  0.00           H  
ATOM    197  HB2 SER A  11      -6.961  -4.077   1.197  1.00  0.00           H  
ATOM    198  HB3 SER A  11      -7.951  -4.893   2.406  1.00  0.00           H  
ATOM    199  HG  SER A  11      -6.237  -5.122   3.586  1.00  0.00           H  
HETATM  200  N   NH2 A  12      -8.275  -6.907  -1.160  1.00  0.00           N  
HETATM  201  HN1 NH2 A  12      -7.478  -7.440  -1.306  1.00  0.00           H  
HETATM  202  HN2 NH2 A  12      -9.035  -6.891  -1.782  1.00  0.00           H  
TER     203      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        3                                                                  
HETATM    1  C   ACE A   0       5.061   5.458   3.343  1.00  0.00           C  
HETATM    2  O   ACE A   0       4.032   4.922   3.796  1.00  0.00           O  
HETATM    3  CH3 ACE A   0       6.347   5.396   4.146  1.00  0.00           C  
HETATM    4  H1  ACE A   0       6.123   5.529   5.195  1.00  0.00           H  
HETATM    5  H2  ACE A   0       7.014   6.181   3.820  1.00  0.00           H  
HETATM    6  H3  ACE A   0       6.820   4.437   3.998  1.00  0.00           H  
ATOM      7  N   HIS A   1       5.144   6.138   2.147  1.00  0.00           N  
ATOM      8  CA  HIS A   1       4.010   6.331   1.217  1.00  0.00           C  
ATOM      9  C   HIS A   1       3.717   5.052   0.413  1.00  0.00           C  
ATOM     10  O   HIS A   1       2.550   4.829   0.039  1.00  0.00           O  
ATOM     11  CB  HIS A   1       4.302   7.516   0.274  1.00  0.00           C  
ATOM     12  CG  HIS A   1       3.084   8.097  -0.389  1.00  0.00           C  
ATOM     13  ND1 HIS A   1       2.237   7.358  -1.188  1.00  0.00           N  
ATOM     14  CD2 HIS A   1       2.582   9.356  -0.375  1.00  0.00           C  
ATOM     15  CE1 HIS A   1       1.268   8.136  -1.637  1.00  0.00           C  
ATOM     16  NE2 HIS A   1       1.453   9.352  -1.158  1.00  0.00           N  
ATOM     17  H   HIS A   1       6.009   6.531   1.904  1.00  0.00           H  
ATOM     18  HA  HIS A   1       3.140   6.567   1.812  1.00  0.00           H  
ATOM     19  HB2 HIS A   1       4.775   8.304   0.839  1.00  0.00           H  
ATOM     20  HB3 HIS A   1       4.977   7.192  -0.504  1.00  0.00           H  
ATOM     21  HD1 HIS A   1       2.332   6.405  -1.395  1.00  0.00           H  
ATOM     22  HD2 HIS A   1       2.993  10.207   0.150  1.00  0.00           H  
ATOM     23  HE1 HIS A   1       0.461   7.830  -2.286  1.00  0.00           H  
ATOM     24  HE2 HIS A   1       0.948  10.147  -1.428  1.00  0.00           H  
ATOM     25  N   LYS A   2       4.804   4.232   0.160  1.00  0.00           N  
ATOM     26  CA  LYS A   2       4.721   2.957  -0.604  1.00  0.00           C  
ATOM     27  C   LYS A   2       3.992   1.860   0.182  1.00  0.00           C  
ATOM     28  O   LYS A   2       3.217   1.092  -0.402  1.00  0.00           O  
ATOM     29  CB  LYS A   2       6.113   2.450  -1.033  1.00  0.00           C  
ATOM     30  CG  LYS A   2       6.818   3.326  -2.068  1.00  0.00           C  
ATOM     31  CD  LYS A   2       8.150   2.717  -2.494  1.00  0.00           C  
ATOM     32  CE  LYS A   2       8.934   3.632  -3.433  1.00  0.00           C  
ATOM     33  NZ  LYS A   2       9.272   4.937  -2.798  1.00  0.00           N  
ATOM     34  H   LYS A   2       5.675   4.510   0.506  1.00  0.00           H  
ATOM     35  HA  LYS A   2       4.147   3.164  -1.493  1.00  0.00           H  
ATOM     36  HB2 LYS A   2       6.747   2.378  -0.164  1.00  0.00           H  
ATOM     37  HB3 LYS A   2       5.999   1.464  -1.456  1.00  0.00           H  
ATOM     38  HG2 LYS A   2       6.183   3.419  -2.936  1.00  0.00           H  
ATOM     39  HG3 LYS A   2       7.000   4.301  -1.648  1.00  0.00           H  
ATOM     40  HD2 LYS A   2       8.746   2.534  -1.613  1.00  0.00           H  
ATOM     41  HD3 LYS A   2       7.958   1.782  -2.999  1.00  0.00           H  
ATOM     42  HE2 LYS A   2       9.851   3.134  -3.711  1.00  0.00           H  
ATOM     43  HE3 LYS A   2       8.346   3.814  -4.321  1.00  0.00           H  
ATOM     44  HZ1 LYS A   2      10.237   4.905  -2.410  1.00  0.00           H  
ATOM     45  HZ2 LYS A   2       8.607   5.143  -2.026  1.00  0.00           H  
ATOM     46  HZ3 LYS A   2       9.218   5.702  -3.500  1.00  0.00           H  
HETATM   47  C   MK8 A   3       2.087   0.717   2.268  1.00  0.00           C  
HETATM   48  N   MK8 A   3       4.263   1.795   1.538  1.00  0.00           N  
HETATM   49  O   MK8 A   3       1.495  -0.378   2.040  1.00  0.00           O  
HETATM   50  CA  MK8 A   3       3.674   0.798   2.492  1.00  0.00           C  
HETATM   51  CB  MK8 A   3       4.073   1.296   3.936  1.00  0.00           C  
HETATM   52  CD  MK8 A   3       2.022   1.413   5.406  1.00  0.00           C  
HETATM   53  CE  MK8 A   3       0.907   0.729   6.260  1.00  0.00           C  
HETATM   54  CG  MK8 A   3       3.356   0.707   5.185  1.00  0.00           C  
HETATM   55  CB1 MK8 A   3       4.412  -0.551   2.262  1.00  0.00           C  
HETATM   56  H   MK8 A   3       4.893   2.444   1.907  1.00  0.00           H  
HETATM   57  HB  MK8 A   3       3.936   2.367   3.959  1.00  0.00           H  
HETATM   58  HBA MK8 A   3       5.125   1.099   4.065  1.00  0.00           H  
HETATM   59  HD  MK8 A   3       1.612   1.623   4.430  1.00  0.00           H  
HETATM   60  HDA MK8 A   3       2.240   2.358   5.880  1.00  0.00           H  
HETATM   61  HE  MK8 A   3       0.951   0.887   7.331  1.00  0.00           H  
HETATM   62  HG  MK8 A   3       3.989   0.857   6.048  1.00  0.00           H  
HETATM   63  HGA MK8 A   3       3.183  -0.349   5.035  1.00  0.00           H  
HETATM   64  HB1 MK8 A   3       5.035  -0.772   3.117  1.00  0.00           H  
HETATM   65 HB1A MK8 A   3       5.028  -0.478   1.379  1.00  0.00           H  
HETATM   66 HB1B MK8 A   3       3.687  -1.341   2.130  1.00  0.00           H  
ATOM     67  N   LEU A   4       1.436   1.937   2.385  1.00  0.00           N  
ATOM     68  CA  LEU A   4      -0.035   2.118   2.257  1.00  0.00           C  
ATOM     69  C   LEU A   4      -0.564   1.594   0.921  1.00  0.00           C  
ATOM     70  O   LEU A   4      -1.701   1.083   0.876  1.00  0.00           O  
ATOM     71  CB  LEU A   4      -0.434   3.602   2.444  1.00  0.00           C  
ATOM     72  CG  LEU A   4      -1.935   3.888   2.720  1.00  0.00           C  
ATOM     73  CD1 LEU A   4      -2.319   3.628   4.180  1.00  0.00           C  
ATOM     74  CD2 LEU A   4      -2.273   5.322   2.350  1.00  0.00           C  
ATOM     75  H   LEU A   4       1.979   2.728   2.588  1.00  0.00           H  
ATOM     76  HA  LEU A   4      -0.494   1.544   3.047  1.00  0.00           H  
ATOM     77  HB2 LEU A   4       0.139   4.003   3.266  1.00  0.00           H  
ATOM     78  HB3 LEU A   4      -0.156   4.135   1.547  1.00  0.00           H  
ATOM     79  HG  LEU A   4      -2.538   3.239   2.103  1.00  0.00           H  
ATOM     80 HD11 LEU A   4      -3.341   3.284   4.227  1.00  0.00           H  
ATOM     81 HD12 LEU A   4      -2.220   4.542   4.744  1.00  0.00           H  
ATOM     82 HD13 LEU A   4      -1.665   2.875   4.595  1.00  0.00           H  
ATOM     83 HD21 LEU A   4      -3.111   5.331   1.669  1.00  0.00           H  
ATOM     84 HD22 LEU A   4      -1.419   5.782   1.879  1.00  0.00           H  
ATOM     85 HD23 LEU A   4      -2.531   5.870   3.245  1.00  0.00           H  
ATOM     86  N   HIS A   5       0.284   1.745  -0.154  1.00  0.00           N  
ATOM     87  CA  HIS A   5      -0.039   1.321  -1.533  1.00  0.00           C  
ATOM     88  C   HIS A   5      -0.220  -0.203  -1.618  1.00  0.00           C  
ATOM     89  O   HIS A   5      -1.150  -0.667  -2.304  1.00  0.00           O  
ATOM     90  CB  HIS A   5       1.059   1.808  -2.497  1.00  0.00           C  
ATOM     91  CG  HIS A   5       0.668   1.817  -3.950  1.00  0.00           C  
ATOM     92  ND1 HIS A   5       0.418   0.671  -4.675  1.00  0.00           N  
ATOM     93  CD2 HIS A   5       0.495   2.849  -4.813  1.00  0.00           C  
ATOM     94  CE1 HIS A   5       0.113   0.998  -5.920  1.00  0.00           C  
ATOM     95  NE2 HIS A   5       0.151   2.312  -6.028  1.00  0.00           N  
ATOM     96  H   HIS A   5       1.153   2.170   0.003  1.00  0.00           H  
ATOM     97  HA  HIS A   5      -0.969   1.789  -1.806  1.00  0.00           H  
ATOM     98  HB2 HIS A   5       1.333   2.817  -2.230  1.00  0.00           H  
ATOM     99  HB3 HIS A   5       1.924   1.171  -2.392  1.00  0.00           H  
ATOM    100  HD1 HIS A   5       0.458  -0.246  -4.331  1.00  0.00           H  
ATOM    101  HD2 HIS A   5       0.602   3.902  -4.586  1.00  0.00           H  
ATOM    102  HE1 HIS A   5      -0.120   0.309  -6.716  1.00  0.00           H  
ATOM    103  HE2 HIS A   5       0.094   2.809  -6.870  1.00  0.00           H  
ATOM    104  N   GLN A   6       0.707  -0.954  -0.922  1.00  0.00           N  
ATOM    105  CA  GLN A   6       0.725  -2.436  -0.895  1.00  0.00           C  
ATOM    106  C   GLN A   6      -0.485  -3.051  -0.169  1.00  0.00           C  
ATOM    107  O   GLN A   6      -1.075  -4.005  -0.697  1.00  0.00           O  
ATOM    108  CB  GLN A   6       2.033  -2.984  -0.283  1.00  0.00           C  
ATOM    109  CG  GLN A   6       3.081  -3.398  -1.314  1.00  0.00           C  
ATOM    110  CD  GLN A   6       3.771  -4.705  -0.960  1.00  0.00           C  
ATOM    111  OE1 GLN A   6       3.119  -5.719  -0.712  1.00  0.00           O  
ATOM    112  NE2 GLN A   6       5.101  -4.693  -0.954  1.00  0.00           N  
ATOM    113  H   GLN A   6       1.405  -0.474  -0.439  1.00  0.00           H  
ATOM    114  HA  GLN A   6       0.683  -2.759  -1.925  1.00  0.00           H  
ATOM    115  HB2 GLN A   6       2.473  -2.231   0.347  1.00  0.00           H  
ATOM    116  HB3 GLN A   6       1.797  -3.847   0.319  1.00  0.00           H  
ATOM    117  HG2 GLN A   6       2.605  -3.508  -2.273  1.00  0.00           H  
ATOM    118  HG3 GLN A   6       3.834  -2.625  -1.374  1.00  0.00           H  
ATOM    119 HE21 GLN A   6       5.560  -3.856  -1.176  1.00  0.00           H  
ATOM    120 HE22 GLN A   6       5.570  -5.523  -0.727  1.00  0.00           H  
HETATM  121  C   MK8 A   7      -3.345  -2.813   1.109  1.00  0.00           C  
HETATM  122  N   MK8 A   7      -0.854  -2.512   1.069  1.00  0.00           N  
HETATM  123  O   MK8 A   7      -4.380  -3.500   1.364  1.00  0.00           O  
HETATM  124  CA  MK8 A   7      -2.007  -3.016   1.918  1.00  0.00           C  
HETATM  125  CB  MK8 A   7      -2.136  -2.130   3.226  1.00  0.00           C  
HETATM  126  CD  MK8 A   7      -0.494  -0.475   4.351  1.00  0.00           C  
HETATM  127  CE  MK8 A   7      -0.143  -0.055   5.811  1.00  0.00           C  
HETATM  128  CG  MK8 A   7      -0.885  -1.930   4.146  1.00  0.00           C  
HETATM  129  CB1 MK8 A   7      -1.809  -4.541   2.315  1.00  0.00           C  
HETATM  130  H   MK8 A   7      -0.345  -1.752   1.413  1.00  0.00           H  
HETATM  131  HB  MK8 A   7      -2.916  -2.566   3.835  1.00  0.00           H  
HETATM  132  HBA MK8 A   7      -2.466  -1.147   2.929  1.00  0.00           H  
HETATM  133  HD  MK8 A   7      -1.315   0.140   4.007  1.00  0.00           H  
HETATM  134  HDA MK8 A   7       0.368  -0.270   3.728  1.00  0.00           H  
HETATM  135  HE  MK8 A   7      -0.806  -0.431   6.573  1.00  0.00           H  
HETATM  136  HG  MK8 A   7      -0.052  -2.468   3.719  1.00  0.00           H  
HETATM  137  HGA MK8 A   7      -1.116  -2.352   5.117  1.00  0.00           H  
HETATM  138  HB1 MK8 A   7      -2.624  -5.124   1.918  1.00  0.00           H  
HETATM  139 HB1A MK8 A   7      -1.791  -4.632   3.392  1.00  0.00           H  
HETATM  140 HB1B MK8 A   7      -0.873  -4.895   1.910  1.00  0.00           H  
ATOM    141  N   LEU A   8      -3.310  -1.797   0.166  1.00  0.00           N  
ATOM    142  CA  LEU A   8      -4.470  -1.402  -0.681  1.00  0.00           C  
ATOM    143  C   LEU A   8      -4.911  -2.519  -1.643  1.00  0.00           C  
ATOM    144  O   LEU A   8      -6.128  -2.697  -1.843  1.00  0.00           O  
ATOM    145  CB  LEU A   8      -4.171  -0.097  -1.462  1.00  0.00           C  
ATOM    146  CG  LEU A   8      -5.386   0.619  -2.114  1.00  0.00           C  
ATOM    147  CD1 LEU A   8      -6.201   1.433  -1.101  1.00  0.00           C  
ATOM    148  CD2 LEU A   8      -4.920   1.519  -3.246  1.00  0.00           C  
ATOM    149  H   LEU A   8      -2.478  -1.287   0.074  1.00  0.00           H  
ATOM    150  HA  LEU A   8      -5.291  -1.206  -0.007  1.00  0.00           H  
ATOM    151  HB2 LEU A   8      -3.701   0.599  -0.783  1.00  0.00           H  
ATOM    152  HB3 LEU A   8      -3.468  -0.333  -2.245  1.00  0.00           H  
ATOM    153  HG  LEU A   8      -6.043  -0.127  -2.538  1.00  0.00           H  
ATOM    154 HD11 LEU A   8      -6.858   0.772  -0.554  1.00  0.00           H  
ATOM    155 HD12 LEU A   8      -6.790   2.172  -1.624  1.00  0.00           H  
ATOM    156 HD13 LEU A   8      -5.532   1.927  -0.413  1.00  0.00           H  
ATOM    157 HD21 LEU A   8      -4.025   1.107  -3.688  1.00  0.00           H  
ATOM    158 HD22 LEU A   8      -4.710   2.504  -2.858  1.00  0.00           H  
ATOM    159 HD23 LEU A   8      -5.695   1.584  -3.995  1.00  0.00           H  
ATOM    160  N   GLN A   9      -3.896  -3.233  -2.254  1.00  0.00           N  
ATOM    161  CA  GLN A   9      -4.122  -4.321  -3.245  1.00  0.00           C  
ATOM    162  C   GLN A   9      -4.457  -5.675  -2.603  1.00  0.00           C  
ATOM    163  O   GLN A   9      -5.342  -6.382  -3.124  1.00  0.00           O  
ATOM    164  CB  GLN A   9      -2.896  -4.488  -4.162  1.00  0.00           C  
ATOM    165  CG  GLN A   9      -2.669  -3.344  -5.147  1.00  0.00           C  
ATOM    166  CD  GLN A   9      -3.693  -3.301  -6.270  1.00  0.00           C  
ATOM    167  OE1 GLN A   9      -4.890  -3.154  -6.029  1.00  0.00           O  
ATOM    168  NE2 GLN A   9      -3.220  -3.433  -7.508  1.00  0.00           N  
ATOM    169  H   GLN A   9      -2.973  -2.989  -2.039  1.00  0.00           H  
ATOM    170  HA  GLN A   9      -4.962  -4.024  -3.855  1.00  0.00           H  
ATOM    171  HB2 GLN A   9      -2.012  -4.575  -3.550  1.00  0.00           H  
ATOM    172  HB3 GLN A   9      -3.013  -5.400  -4.730  1.00  0.00           H  
ATOM    173  HG2 GLN A   9      -2.712  -2.411  -4.609  1.00  0.00           H  
ATOM    174  HG3 GLN A   9      -1.687  -3.459  -5.583  1.00  0.00           H  
ATOM    175 HE21 GLN A   9      -2.253  -3.550  -7.625  1.00  0.00           H  
ATOM    176 HE22 GLN A   9      -3.857  -3.403  -8.255  1.00  0.00           H  
ATOM    177  N   ASP A  10      -3.714  -6.027  -1.491  1.00  0.00           N  
ATOM    178  CA  ASP A  10      -3.870  -7.310  -0.758  1.00  0.00           C  
ATOM    179  C   ASP A  10      -5.219  -7.392  -0.029  1.00  0.00           C  
ATOM    180  O   ASP A  10      -5.526  -8.447   0.560  1.00  0.00           O  
ATOM    181  CB  ASP A  10      -2.695  -7.518   0.219  1.00  0.00           C  
ATOM    182  CG  ASP A  10      -2.713  -8.878   0.899  1.00  0.00           C  
ATOM    183  OD1 ASP A  10      -2.667  -9.899   0.183  1.00  0.00           O  
ATOM    184  OD2 ASP A  10      -2.772  -8.918   2.145  1.00  0.00           O  
ATOM    185  H   ASP A  10      -3.033  -5.399  -1.179  1.00  0.00           H  
ATOM    186  HA  ASP A  10      -3.844  -8.099  -1.496  1.00  0.00           H  
ATOM    187  HB2 ASP A  10      -1.765  -7.434  -0.325  1.00  0.00           H  
ATOM    188  HB3 ASP A  10      -2.726  -6.755   0.980  1.00  0.00           H  
ATOM    189  N   SER A  11      -6.008  -6.262  -0.098  1.00  0.00           N  
ATOM    190  CA  SER A  11      -7.345  -6.142   0.525  1.00  0.00           C  
ATOM    191  C   SER A  11      -8.429  -6.758  -0.373  1.00  0.00           C  
ATOM    192  O   SER A  11      -9.150  -7.659   0.056  1.00  0.00           O  
ATOM    193  CB  SER A  11      -7.639  -4.663   0.862  1.00  0.00           C  
ATOM    194  OG  SER A  11      -9.026  -4.417   1.058  1.00  0.00           O  
ATOM    195  H   SER A  11      -5.665  -5.495  -0.599  1.00  0.00           H  
ATOM    196  HA  SER A  11      -7.321  -6.706   1.449  1.00  0.00           H  
ATOM    197  HB2 SER A  11      -7.124  -4.409   1.777  1.00  0.00           H  
ATOM    198  HB3 SER A  11      -7.274  -4.027   0.067  1.00  0.00           H  
ATOM    199  HG  SER A  11      -9.366  -5.011   1.732  1.00  0.00           H  
HETATM  200  N   NH2 A  12      -8.404  -6.426  -1.663  1.00  0.00           N  
HETATM  201  HN1 NH2 A  12      -7.710  -5.811  -1.972  1.00  0.00           H  
HETATM  202  HN2 NH2 A  12      -9.081  -6.822  -2.255  1.00  0.00           H  
TER     203      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        4                                                                  
HETATM    1  C   ACE A   0       5.066   5.653   3.226  1.00  0.00           C  
HETATM    2  O   ACE A   0       4.050   5.095   3.685  1.00  0.00           O  
HETATM    3  CH3 ACE A   0       6.346   5.642   4.034  1.00  0.00           C  
HETATM    4  H1  ACE A   0       6.174   6.121   4.986  1.00  0.00           H  
HETATM    5  H2  ACE A   0       7.116   6.176   3.497  1.00  0.00           H  
HETATM    6  H3  ACE A   0       6.661   4.622   4.196  1.00  0.00           H  
ATOM      7  N   HIS A   1       5.135   6.310   2.014  1.00  0.00           N  
ATOM      8  CA  HIS A   1       3.999   6.448   1.078  1.00  0.00           C  
ATOM      9  C   HIS A   1       3.748   5.131   0.316  1.00  0.00           C  
ATOM     10  O   HIS A   1       2.612   4.903  -0.140  1.00  0.00           O  
ATOM     11  CB  HIS A   1       4.266   7.606   0.096  1.00  0.00           C  
ATOM     12  CG  HIS A   1       3.034   8.126  -0.592  1.00  0.00           C  
ATOM     13  ND1 HIS A   1       2.226   7.336  -1.382  1.00  0.00           N  
ATOM     14  CD2 HIS A   1       2.475   9.361  -0.602  1.00  0.00           C  
ATOM     15  CE1 HIS A   1       1.225   8.061  -1.848  1.00  0.00           C  
ATOM     16  NE2 HIS A   1       1.352   9.292  -1.389  1.00  0.00           N  
ATOM     17  H   HIS A   1       5.990   6.725   1.765  1.00  0.00           H  
ATOM     18  HA  HIS A   1       3.122   6.687   1.662  1.00  0.00           H  
ATOM     19  HB2 HIS A   1       4.713   8.427   0.635  1.00  0.00           H  
ATOM     20  HB3 HIS A   1       4.953   7.273  -0.667  1.00  0.00           H  
ATOM     21  HD1 HIS A   1       2.367   6.385  -1.574  1.00  0.00           H  
ATOM     22  HD2 HIS A   1       2.846  10.239  -0.091  1.00  0.00           H  
ATOM     23  HE1 HIS A   1       0.437   7.707  -2.496  1.00  0.00           H  
ATOM     24  HE2 HIS A   1       0.680   9.999  -1.481  1.00  0.00           H  
ATOM     25  N   LYS A   2       4.838   4.288   0.185  1.00  0.00           N  
ATOM     26  CA  LYS A   2       4.801   2.979  -0.527  1.00  0.00           C  
ATOM     27  C   LYS A   2       4.004   1.891   0.218  1.00  0.00           C  
ATOM     28  O   LYS A   2       3.190   1.180  -0.405  1.00  0.00           O  
ATOM     29  CB  LYS A   2       6.218   2.457  -0.829  1.00  0.00           C  
ATOM     30  CG  LYS A   2       6.937   3.193  -1.959  1.00  0.00           C  
ATOM     31  CD  LYS A   2       8.281   2.546  -2.275  1.00  0.00           C  
ATOM     32  CE  LYS A   2       9.057   3.324  -3.333  1.00  0.00           C  
ATOM     33  NZ  LYS A   2      10.343   2.657  -3.680  1.00  0.00           N  
ATOM     34  H   LYS A   2       5.687   4.576   0.579  1.00  0.00           H  
ATOM     35  HA  LYS A   2       4.305   3.157  -1.469  1.00  0.00           H  
ATOM     36  HB2 LYS A   2       6.820   2.537   0.060  1.00  0.00           H  
ATOM     37  HB3 LYS A   2       6.147   1.416  -1.103  1.00  0.00           H  
ATOM     38  HG2 LYS A   2       6.318   3.163  -2.843  1.00  0.00           H  
ATOM     39  HG3 LYS A   2       7.104   4.217  -1.668  1.00  0.00           H  
ATOM     40  HD2 LYS A   2       8.870   2.506  -1.372  1.00  0.00           H  
ATOM     41  HD3 LYS A   2       8.107   1.542  -2.636  1.00  0.00           H  
ATOM     42  HE2 LYS A   2       8.454   3.401  -4.225  1.00  0.00           H  
ATOM     43  HE3 LYS A   2       9.269   4.314  -2.955  1.00  0.00           H  
ATOM     44  HZ1 LYS A   2      10.179   1.910  -4.386  1.00  0.00           H  
ATOM     45  HZ2 LYS A   2      10.766   2.229  -2.832  1.00  0.00           H  
ATOM     46  HZ3 LYS A   2      11.010   3.351  -4.075  1.00  0.00           H  
HETATM   47  C   MK8 A   3       2.066   0.572   2.145  1.00  0.00           C  
HETATM   48  N   MK8 A   3       4.269   1.715   1.581  1.00  0.00           N  
HETATM   49  O   MK8 A   3       1.516  -0.495   1.782  1.00  0.00           O  
HETATM   50  CA  MK8 A   3       3.621   0.658   2.455  1.00  0.00           C  
HETATM   51  CB  MK8 A   3       3.824   1.052   3.983  1.00  0.00           C  
HETATM   52  CD  MK8 A   3       1.702   0.203   5.288  1.00  0.00           C  
HETATM   53  CE  MK8 A   3       1.058  -0.401   6.560  1.00  0.00           C  
HETATM   54  CG  MK8 A   3       3.228   0.150   5.139  1.00  0.00           C  
HETATM   55  CB1 MK8 A   3       4.421  -0.653   2.139  1.00  0.00           C  
HETATM   56  H   MK8 A   3       4.946   2.284   1.993  1.00  0.00           H  
HETATM   57  HB  MK8 A   3       3.416   2.045   4.115  1.00  0.00           H  
HETATM   58  HBA MK8 A   3       4.884   1.111   4.161  1.00  0.00           H  
HETATM   59  HD  MK8 A   3       1.285  -0.323   4.437  1.00  0.00           H  
HETATM   60  HDA MK8 A   3       1.394   1.232   5.223  1.00  0.00           H  
HETATM   61  HE  MK8 A   3       1.651  -0.367   7.464  1.00  0.00           H  
HETATM   62  HG  MK8 A   3       3.678   0.458   6.074  1.00  0.00           H  
HETATM   63  HGA MK8 A   3       3.505  -0.874   4.945  1.00  0.00           H  
HETATM   64  HB1 MK8 A   3       5.168  -0.812   2.903  1.00  0.00           H  
HETATM   65 HB1A MK8 A   3       4.904  -0.557   1.179  1.00  0.00           H  
HETATM   66 HB1B MK8 A   3       3.741  -1.492   2.117  1.00  0.00           H  
ATOM     67  N   LEU A   4       1.371   1.763   2.361  1.00  0.00           N  
ATOM     68  CA  LEU A   4      -0.101   1.917   2.191  1.00  0.00           C  
ATOM     69  C   LEU A   4      -0.575   1.412   0.830  1.00  0.00           C  
ATOM     70  O   LEU A   4      -1.678   0.834   0.754  1.00  0.00           O  
ATOM     71  CB  LEU A   4      -0.561   3.377   2.433  1.00  0.00           C  
ATOM     72  CG  LEU A   4      -2.088   3.602   2.623  1.00  0.00           C  
ATOM     73  CD1 LEU A   4      -2.557   3.242   4.039  1.00  0.00           C  
ATOM     74  CD2 LEU A   4      -2.455   5.042   2.300  1.00  0.00           C  
ATOM     75  H   LEU A   4       1.881   2.539   2.675  1.00  0.00           H  
ATOM     76  HA  LEU A   4      -0.560   1.296   2.940  1.00  0.00           H  
ATOM     77  HB2 LEU A   4      -0.063   3.741   3.319  1.00  0.00           H  
ATOM     78  HB3 LEU A   4      -0.238   3.974   1.593  1.00  0.00           H  
ATOM     79  HG  LEU A   4      -2.620   2.964   1.932  1.00  0.00           H  
ATOM     80 HD11 LEU A   4      -2.297   2.214   4.254  1.00  0.00           H  
ATOM     81 HD12 LEU A   4      -3.628   3.361   4.105  1.00  0.00           H  
ATOM     82 HD13 LEU A   4      -2.076   3.891   4.755  1.00  0.00           H  
ATOM     83 HD21 LEU A   4      -3.363   5.059   1.715  1.00  0.00           H  
ATOM     84 HD22 LEU A   4      -1.656   5.500   1.737  1.00  0.00           H  
ATOM     85 HD23 LEU A   4      -2.609   5.589   3.219  1.00  0.00           H  
ATOM     86  N   HIS A   5       0.289   1.623  -0.231  1.00  0.00           N  
ATOM     87  CA  HIS A   5       0.015   1.187  -1.618  1.00  0.00           C  
ATOM     88  C   HIS A   5      -0.176  -0.341  -1.645  1.00  0.00           C  
ATOM     89  O   HIS A   5      -1.073  -0.843  -2.344  1.00  0.00           O  
ATOM     90  CB  HIS A   5       1.155   1.643  -2.545  1.00  0.00           C  
ATOM     91  CG  HIS A   5       0.825   1.585  -4.011  1.00  0.00           C  
ATOM     92  ND1 HIS A   5      -0.242   2.260  -4.566  1.00  0.00           N  
ATOM     93  CD2 HIS A   5       1.429   0.934  -5.035  1.00  0.00           C  
ATOM     94  CE1 HIS A   5      -0.282   2.025  -5.866  1.00  0.00           C  
ATOM     95  NE2 HIS A   5       0.721   1.225  -6.176  1.00  0.00           N  
ATOM     96  H   HIS A   5       1.137   2.078  -0.053  1.00  0.00           H  
ATOM     97  HA  HIS A   5      -0.903   1.655  -1.933  1.00  0.00           H  
ATOM     98  HB2 HIS A   5       1.403   2.669  -2.308  1.00  0.00           H  
ATOM     99  HB3 HIS A   5       2.018   1.023  -2.371  1.00  0.00           H  
ATOM    100  HD1 HIS A   5      -0.873   2.830  -4.080  1.00  0.00           H  
ATOM    101  HD2 HIS A   5       2.309   0.310  -4.970  1.00  0.00           H  
ATOM    102  HE1 HIS A   5      -1.011   2.420  -6.558  1.00  0.00           H  
ATOM    103  HE2 HIS A   5       0.861   0.810  -7.052  1.00  0.00           H  
ATOM    104  N   GLN A   6       0.697  -1.043  -0.843  1.00  0.00           N  
ATOM    105  CA  GLN A   6       0.692  -2.521  -0.695  1.00  0.00           C  
ATOM    106  C   GLN A   6      -0.580  -3.042   0.005  1.00  0.00           C  
ATOM    107  O   GLN A   6      -1.246  -3.936  -0.538  1.00  0.00           O  
ATOM    108  CB  GLN A   6       1.934  -3.017   0.072  1.00  0.00           C  
ATOM    109  CG  GLN A   6       3.190  -3.185  -0.782  1.00  0.00           C  
ATOM    110  CD  GLN A   6       4.294  -3.932  -0.054  1.00  0.00           C  
ATOM    111  OE1 GLN A   6       4.709  -3.538   1.034  1.00  0.00           O  
ATOM    112  NE2 GLN A   6       4.787  -5.010  -0.658  1.00  0.00           N  
ATOM    113  H   GLN A   6       1.367  -0.524  -0.349  1.00  0.00           H  
ATOM    114  HA  GLN A   6       0.716  -2.939  -1.691  1.00  0.00           H  
ATOM    115  HB2 GLN A   6       2.161  -2.317   0.859  1.00  0.00           H  
ATOM    116  HB3 GLN A   6       1.702  -3.972   0.517  1.00  0.00           H  
ATOM    117  HG2 GLN A   6       2.933  -3.730  -1.674  1.00  0.00           H  
ATOM    118  HG3 GLN A   6       3.568  -2.215  -1.054  1.00  0.00           H  
ATOM    119 HE21 GLN A   6       4.419  -5.262  -1.530  1.00  0.00           H  
ATOM    120 HE22 GLN A   6       5.500  -5.508  -0.206  1.00  0.00           H  
HETATM  121  C   MK8 A   7      -3.386  -2.749   1.228  1.00  0.00           C  
HETATM  122  N   MK8 A   7      -0.892  -2.486   1.241  1.00  0.00           N  
HETATM  123  O   MK8 A   7      -4.373  -3.531   1.383  1.00  0.00           O  
HETATM  124  CA  MK8 A   7      -2.067  -2.882   2.086  1.00  0.00           C  
HETATM  125  CB  MK8 A   7      -2.224  -1.895   3.298  1.00  0.00           C  
HETATM  126  CD  MK8 A   7      -1.297  -1.199   5.564  1.00  0.00           C  
HETATM  127  CE  MK8 A   7      -0.192  -0.988   6.670  1.00  0.00           C  
HETATM  128  CG  MK8 A   7      -0.950  -1.466   4.084  1.00  0.00           C  
HETATM  129  CB1 MK8 A   7      -1.853  -4.333   2.643  1.00  0.00           C  
HETATM  130  H   MK8 A   7      -0.306  -1.803   1.594  1.00  0.00           H  
HETATM  131  HB  MK8 A   7      -2.907  -2.346   4.004  1.00  0.00           H  
HETATM  132  HBA MK8 A   7      -2.680  -0.992   2.927  1.00  0.00           H  
HETATM  133  HD  MK8 A   7      -1.914  -2.031   5.888  1.00  0.00           H  
HETATM  134  HDA MK8 A   7      -1.914  -0.319   5.589  1.00  0.00           H  
HETATM  135  HE  MK8 A   7      -0.448  -1.345   7.659  1.00  0.00           H  
HETATM  136  HG  MK8 A   7      -0.559  -0.554   3.650  1.00  0.00           H  
HETATM  137  HGA MK8 A   7      -0.210  -2.252   4.012  1.00  0.00           H  
HETATM  138  HB1 MK8 A   7      -1.239  -4.288   3.532  1.00  0.00           H  
HETATM  139 HB1A MK8 A   7      -1.361  -4.938   1.898  1.00  0.00           H  
HETATM  140 HB1B MK8 A   7      -2.810  -4.768   2.888  1.00  0.00           H  
ATOM    141  N   LEU A   8      -3.392  -1.672   0.354  1.00  0.00           N  
ATOM    142  CA  LEU A   8      -4.540  -1.307  -0.522  1.00  0.00           C  
ATOM    143  C   LEU A   8      -4.865  -2.387  -1.572  1.00  0.00           C  
ATOM    144  O   LEU A   8      -6.052  -2.547  -1.916  1.00  0.00           O  
ATOM    145  CB  LEU A   8      -4.293   0.053  -1.217  1.00  0.00           C  
ATOM    146  CG  LEU A   8      -5.532   0.740  -1.849  1.00  0.00           C  
ATOM    147  CD1 LEU A   8      -6.367   1.486  -0.806  1.00  0.00           C  
ATOM    148  CD2 LEU A   8      -5.107   1.690  -2.958  1.00  0.00           C  
ATOM    149  H   LEU A   8      -2.600  -1.091   0.340  1.00  0.00           H  
ATOM    150  HA  LEU A   8      -5.400  -1.198   0.123  1.00  0.00           H  
ATOM    151  HB2 LEU A   8      -3.871   0.730  -0.488  1.00  0.00           H  
ATOM    152  HB3 LEU A   8      -3.565  -0.101  -1.997  1.00  0.00           H  
ATOM    153  HG  LEU A   8      -6.163  -0.019  -2.289  1.00  0.00           H  
ATOM    154 HD11 LEU A   8      -7.409   1.224  -0.923  1.00  0.00           H  
ATOM    155 HD12 LEU A   8      -6.247   2.550  -0.942  1.00  0.00           H  
ATOM    156 HD13 LEU A   8      -6.036   1.209   0.184  1.00  0.00           H  
ATOM    157 HD21 LEU A   8      -5.392   1.276  -3.914  1.00  0.00           H  
ATOM    158 HD22 LEU A   8      -4.037   1.825  -2.927  1.00  0.00           H  
ATOM    159 HD23 LEU A   8      -5.596   2.644  -2.820  1.00  0.00           H  
ATOM    160  N   GLN A   9      -3.788  -3.082  -2.096  1.00  0.00           N  
ATOM    161  CA  GLN A   9      -3.909  -4.124  -3.157  1.00  0.00           C  
ATOM    162  C   GLN A   9      -4.325  -5.512  -2.637  1.00  0.00           C  
ATOM    163  O   GLN A   9      -5.225  -6.129  -3.243  1.00  0.00           O  
ATOM    164  CB  GLN A   9      -2.597  -4.246  -3.957  1.00  0.00           C  
ATOM    165  CG  GLN A   9      -2.344  -3.105  -4.949  1.00  0.00           C  
ATOM    166  CD  GLN A   9      -3.310  -3.088  -6.132  1.00  0.00           C  
ATOM    167  OE1 GLN A   9      -4.526  -3.075  -5.951  1.00  0.00           O  
ATOM    168  NE2 GLN A   9      -2.767  -3.071  -7.348  1.00  0.00           N  
ATOM    169  H   GLN A   9      -2.892  -2.847  -1.775  1.00  0.00           H  
ATOM    170  HA  GLN A   9      -4.672  -3.783  -3.840  1.00  0.00           H  
ATOM    171  HB2 GLN A   9      -1.770  -4.272  -3.264  1.00  0.00           H  
ATOM    172  HB3 GLN A   9      -2.615  -5.175  -4.508  1.00  0.00           H  
ATOM    173  HG2 GLN A   9      -2.433  -2.168  -4.425  1.00  0.00           H  
ATOM    174  HG3 GLN A   9      -1.338  -3.205  -5.332  1.00  0.00           H  
ATOM    175 HE21 GLN A   9      -1.789  -3.071  -7.420  1.00  0.00           H  
ATOM    176 HE22 GLN A   9      -3.368  -3.058  -8.125  1.00  0.00           H  
ATOM    177  N   ASP A  10      -3.626  -6.005  -1.550  1.00  0.00           N  
ATOM    178  CA  ASP A  10      -3.854  -7.350  -0.950  1.00  0.00           C  
ATOM    179  C   ASP A  10      -5.225  -7.503  -0.254  1.00  0.00           C  
ATOM    180  O   ASP A  10      -5.556  -8.644   0.131  1.00  0.00           O  
ATOM    181  CB  ASP A  10      -2.710  -7.702   0.027  1.00  0.00           C  
ATOM    182  CG  ASP A  10      -2.758  -9.146   0.504  1.00  0.00           C  
ATOM    183  OD1 ASP A  10      -2.692 -10.054  -0.350  1.00  0.00           O  
ATOM    184  OD2 ASP A  10      -2.862  -9.364   1.728  1.00  0.00           O  
ATOM    185  H   ASP A  10      -2.909  -5.453  -1.176  1.00  0.00           H  
ATOM    186  HA  ASP A  10      -3.823  -8.060  -1.765  1.00  0.00           H  
ATOM    187  HB2 ASP A  10      -1.761  -7.547  -0.466  1.00  0.00           H  
ATOM    188  HB3 ASP A  10      -2.764  -7.059   0.893  1.00  0.00           H  
ATOM    189  N   SER A  11      -6.006  -6.361  -0.100  1.00  0.00           N  
ATOM    190  CA  SER A  11      -7.348  -6.361   0.556  1.00  0.00           C  
ATOM    191  C   SER A  11      -8.477  -6.804  -0.430  1.00  0.00           C  
ATOM    192  O   SER A  11      -8.732  -8.002  -0.539  1.00  0.00           O  
ATOM    193  CB  SER A  11      -7.619  -5.005   1.257  1.00  0.00           C  
ATOM    194  OG  SER A  11      -7.319  -3.917   0.401  1.00  0.00           O  
ATOM    195  H   SER A  11      -5.654  -5.510  -0.435  1.00  0.00           H  
ATOM    196  HA  SER A  11      -7.300  -7.123   1.326  1.00  0.00           H  
ATOM    197  HB2 SER A  11      -8.661  -4.951   1.530  1.00  0.00           H  
ATOM    198  HB3 SER A  11      -7.014  -4.932   2.150  1.00  0.00           H  
ATOM    199  HG  SER A  11      -8.106  -3.667  -0.088  1.00  0.00           H  
HETATM  200  N   NH2 A  12      -9.175  -5.888  -1.135  1.00  0.00           N  
HETATM  201  HN1 NH2 A  12      -8.966  -4.941  -1.015  1.00  0.00           H  
HETATM  202  HN2 NH2 A  12      -9.874  -6.211  -1.742  1.00  0.00           H  
TER     203      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        5                                                                  
HETATM    1  C   ACE A   0       5.139   5.539   3.380  1.00  0.00           C  
HETATM    2  O   ACE A   0       4.030   5.126   3.774  1.00  0.00           O  
HETATM    3  CH3 ACE A   0       6.354   5.362   4.266  1.00  0.00           C  
HETATM    4  H1  ACE A   0       7.076   4.735   3.763  1.00  0.00           H  
HETATM    5  H2  ACE A   0       6.058   4.897   5.194  1.00  0.00           H  
HETATM    6  H3  ACE A   0       6.794   6.326   4.469  1.00  0.00           H  
ATOM      7  N   HIS A   1       5.375   6.166   2.177  1.00  0.00           N  
ATOM      8  CA  HIS A   1       4.335   6.443   1.166  1.00  0.00           C  
ATOM      9  C   HIS A   1       3.957   5.183   0.369  1.00  0.00           C  
ATOM     10  O   HIS A   1       2.793   5.061  -0.053  1.00  0.00           O  
ATOM     11  CB  HIS A   1       4.788   7.564   0.213  1.00  0.00           C  
ATOM     12  CG  HIS A   1       4.696   8.937   0.813  1.00  0.00           C  
ATOM     13  ND1 HIS A   1       3.610   9.360   1.553  1.00  0.00           N  
ATOM     14  CD2 HIS A   1       5.545   9.997   0.760  1.00  0.00           C  
ATOM     15  CE1 HIS A   1       3.794  10.614   1.927  1.00  0.00           C  
ATOM     16  NE2 HIS A   1       4.959  11.022   1.460  1.00  0.00           N  
ATOM     17  H   HIS A   1       6.293   6.451   1.985  1.00  0.00           H  
ATOM     18  HA  HIS A   1       3.459   6.786   1.698  1.00  0.00           H  
ATOM     19  HB2 HIS A   1       5.816   7.399  -0.067  1.00  0.00           H  
ATOM     20  HB3 HIS A   1       4.174   7.547  -0.674  1.00  0.00           H  
ATOM     21  HD1 HIS A   1       2.822   8.820   1.771  1.00  0.00           H  
ATOM     22  HD2 HIS A   1       6.496  10.036   0.245  1.00  0.00           H  
ATOM     23  HE1 HIS A   1       3.107  11.205   2.516  1.00  0.00           H  
ATOM     24  HE2 HIS A   1       5.374  11.888   1.657  1.00  0.00           H  
ATOM     25  N   LYS A   2       4.972   4.264   0.165  1.00  0.00           N  
ATOM     26  CA  LYS A   2       4.809   2.992  -0.595  1.00  0.00           C  
ATOM     27  C   LYS A   2       3.963   1.929   0.134  1.00  0.00           C  
ATOM     28  O   LYS A   2       3.128   1.257  -0.504  1.00  0.00           O  
ATOM     29  CB  LYS A   2       6.171   2.386  -0.981  1.00  0.00           C  
ATOM     30  CG  LYS A   2       6.912   3.149  -2.074  1.00  0.00           C  
ATOM     31  CD  LYS A   2       8.206   2.443  -2.461  1.00  0.00           C  
ATOM     32  CE  LYS A   2       8.974   3.199  -3.543  1.00  0.00           C  
ATOM     33  NZ  LYS A   2       8.189   3.336  -4.804  1.00  0.00           N  
ATOM     34  H   LYS A   2       5.854   4.471   0.536  1.00  0.00           H  
ATOM     35  HA  LYS A   2       4.291   3.246  -1.508  1.00  0.00           H  
ATOM     36  HB2 LYS A   2       6.803   2.347  -0.109  1.00  0.00           H  
ATOM     37  HB3 LYS A   2       6.008   1.378  -1.331  1.00  0.00           H  
ATOM     38  HG2 LYS A   2       6.277   3.217  -2.946  1.00  0.00           H  
ATOM     39  HG3 LYS A   2       7.148   4.140  -1.721  1.00  0.00           H  
ATOM     40  HD2 LYS A   2       8.832   2.361  -1.586  1.00  0.00           H  
ATOM     41  HD3 LYS A   2       7.967   1.455  -2.826  1.00  0.00           H  
ATOM     42  HE2 LYS A   2       9.220   4.184  -3.175  1.00  0.00           H  
ATOM     43  HE3 LYS A   2       9.887   2.660  -3.756  1.00  0.00           H  
ATOM     44  HZ1 LYS A   2       8.831   3.373  -5.622  1.00  0.00           H  
ATOM     45  HZ2 LYS A   2       7.625   4.209  -4.781  1.00  0.00           H  
ATOM     46  HZ3 LYS A   2       7.548   2.525  -4.916  1.00  0.00           H  
HETATM   47  C   MK8 A   3       1.945   0.688   2.036  1.00  0.00           C  
HETATM   48  N   MK8 A   3       4.205   1.732   1.497  1.00  0.00           N  
HETATM   49  O   MK8 A   3       1.358  -0.333   1.607  1.00  0.00           O  
HETATM   50  CA  MK8 A   3       3.506   0.696   2.355  1.00  0.00           C  
HETATM   51  CB  MK8 A   3       3.729   1.070   3.886  1.00  0.00           C  
HETATM   52  CD  MK8 A   3       1.563   0.320   5.177  1.00  0.00           C  
HETATM   53  CE  MK8 A   3       0.911  -0.208   6.474  1.00  0.00           C  
HETATM   54  CG  MK8 A   3       3.084   0.192   5.033  1.00  0.00           C  
HETATM   55  CB1 MK8 A   3       4.240  -0.653   2.032  1.00  0.00           C  
HETATM   56  H   MK8 A   3       4.899   2.272   1.923  1.00  0.00           H  
HETATM   57  HB  MK8 A   3       3.371   2.082   4.023  1.00  0.00           H  
HETATM   58  HBA MK8 A   3       4.790   1.075   4.065  1.00  0.00           H  
HETATM   59  HD  MK8 A   3       1.120  -0.219   4.347  1.00  0.00           H  
HETATM   60  HDA MK8 A   3       1.300   1.359   5.073  1.00  0.00           H  
HETATM   61  HE  MK8 A   3       1.490  -0.101   7.378  1.00  0.00           H  
HETATM   62  HG  MK8 A   3       3.544   0.470   5.971  1.00  0.00           H  
HETATM   63  HGA MK8 A   3       3.309  -0.842   4.831  1.00  0.00           H  
HETATM   64  HB1 MK8 A   3       3.757  -1.460   2.564  1.00  0.00           H  
HETATM   65 HB1A MK8 A   3       5.272  -0.587   2.342  1.00  0.00           H  
HETATM   66 HB1B MK8 A   3       4.195  -0.845   0.969  1.00  0.00           H  
ATOM     67  N   LEU A   4       1.290   1.886   2.325  1.00  0.00           N  
ATOM     68  CA  LEU A   4      -0.174   2.106   2.169  1.00  0.00           C  
ATOM     69  C   LEU A   4      -0.699   1.634   0.810  1.00  0.00           C  
ATOM     70  O   LEU A   4      -1.864   1.188   0.740  1.00  0.00           O  
ATOM     71  CB  LEU A   4      -0.555   3.580   2.434  1.00  0.00           C  
ATOM     72  CG  LEU A   4      -2.059   3.868   2.682  1.00  0.00           C  
ATOM     73  CD1 LEU A   4      -2.478   3.543   4.122  1.00  0.00           C  
ATOM     74  CD2 LEU A   4      -2.379   5.318   2.353  1.00  0.00           C  
ATOM     75  H   LEU A   4       1.826   2.620   2.693  1.00  0.00           H  
ATOM     76  HA  LEU A   4      -0.649   1.502   2.924  1.00  0.00           H  
ATOM     77  HB2 LEU A   4      -0.008   3.913   3.303  1.00  0.00           H  
ATOM     78  HB3 LEU A   4      -0.237   4.166   1.586  1.00  0.00           H  
ATOM     79  HG  LEU A   4      -2.646   3.245   2.024  1.00  0.00           H  
ATOM     80 HD11 LEU A   4      -2.172   2.534   4.367  1.00  0.00           H  
ATOM     81 HD12 LEU A   4      -3.550   3.624   4.213  1.00  0.00           H  
ATOM     82 HD13 LEU A   4      -2.004   4.236   4.800  1.00  0.00           H  
ATOM     83 HD21 LEU A   4      -1.518   5.783   1.896  1.00  0.00           H  
ATOM     84 HD22 LEU A   4      -2.634   5.845   3.260  1.00  0.00           H  
ATOM     85 HD23 LEU A   4      -3.213   5.355   1.668  1.00  0.00           H  
ATOM     86  N   HIS A   5       0.194   1.710  -0.244  1.00  0.00           N  
ATOM     87  CA  HIS A   5      -0.119   1.265  -1.617  1.00  0.00           C  
ATOM     88  C   HIS A   5      -0.327  -0.249  -1.615  1.00  0.00           C  
ATOM     89  O   HIS A   5      -1.278  -0.751  -2.239  1.00  0.00           O  
ATOM     90  CB  HIS A   5       0.997   1.667  -2.587  1.00  0.00           C  
ATOM     91  CG  HIS A   5       0.788   3.019  -3.207  1.00  0.00           C  
ATOM     92  ND1 HIS A   5       0.591   4.167  -2.467  1.00  0.00           N  
ATOM     93  CD2 HIS A   5       0.729   3.401  -4.508  1.00  0.00           C  
ATOM     94  CE1 HIS A   5       0.415   5.192  -3.286  1.00  0.00           C  
ATOM     95  NE2 HIS A   5       0.497   4.754  -4.528  1.00  0.00           N  
ATOM     96  H   HIS A   5       1.094   2.053  -0.065  1.00  0.00           H  
ATOM     97  HA  HIS A   5      -1.038   1.746  -1.919  1.00  0.00           H  
ATOM     98  HB2 HIS A   5       1.935   1.688  -2.054  1.00  0.00           H  
ATOM     99  HB3 HIS A   5       1.054   0.940  -3.382  1.00  0.00           H  
ATOM    100  HD1 HIS A   5       0.585   4.225  -1.489  1.00  0.00           H  
ATOM    101  HD2 HIS A   5       0.845   2.760  -5.372  1.00  0.00           H  
ATOM    102  HE1 HIS A   5       0.222   6.212  -2.990  1.00  0.00           H  
ATOM    103  HE2 HIS A   5       0.263   5.277  -5.324  1.00  0.00           H  
ATOM    104  N   GLN A   6       0.600  -0.948  -0.880  1.00  0.00           N  
ATOM    105  CA  GLN A   6       0.608  -2.423  -0.721  1.00  0.00           C  
ATOM    106  C   GLN A   6      -0.668  -2.968  -0.036  1.00  0.00           C  
ATOM    107  O   GLN A   6      -1.363  -3.805  -0.631  1.00  0.00           O  
ATOM    108  CB  GLN A   6       1.858  -2.873   0.058  1.00  0.00           C  
ATOM    109  CG  GLN A   6       3.122  -3.002  -0.794  1.00  0.00           C  
ATOM    110  CD  GLN A   6       3.096  -4.200  -1.726  1.00  0.00           C  
ATOM    111  OE1 GLN A   6       2.247  -4.292  -2.612  1.00  0.00           O  
ATOM    112  NE2 GLN A   6       4.029  -5.125  -1.532  1.00  0.00           N  
ATOM    113  H   GLN A   6       1.310  -0.428  -0.442  1.00  0.00           H  
ATOM    114  HA  GLN A   6       0.660  -2.846  -1.713  1.00  0.00           H  
ATOM    115  HB2 GLN A   6       2.058  -2.160   0.841  1.00  0.00           H  
ATOM    116  HB3 GLN A   6       1.657  -3.832   0.508  1.00  0.00           H  
ATOM    117  HG2 GLN A   6       3.231  -2.115  -1.394  1.00  0.00           H  
ATOM    118  HG3 GLN A   6       3.975  -3.094  -0.138  1.00  0.00           H  
ATOM    119 HE21 GLN A   6       4.676  -4.988  -0.810  1.00  0.00           H  
ATOM    120 HE22 GLN A   6       4.030  -5.907  -2.120  1.00  0.00           H  
HETATM  121  C   MK8 A   7      -3.446  -2.919   1.249  1.00  0.00           C  
HETATM  122  N   MK8 A   7      -0.936  -2.507   1.244  1.00  0.00           N  
HETATM  123  O   MK8 A   7      -4.370  -3.768   1.431  1.00  0.00           O  
HETATM  124  CA  MK8 A   7      -2.098  -2.951   2.090  1.00  0.00           C  
HETATM  125  CB  MK8 A   7      -2.314  -1.978   3.303  1.00  0.00           C  
HETATM  126  CD  MK8 A   7      -1.415  -1.118   5.518  1.00  0.00           C  
HETATM  127  CE  MK8 A   7      -0.326  -0.809   6.611  1.00  0.00           C  
HETATM  128  CG  MK8 A   7      -1.066  -1.431   4.052  1.00  0.00           C  
HETATM  129  CB1 MK8 A   7      -1.773  -4.371   2.645  1.00  0.00           C  
HETATM  130  H   MK8 A   7      -0.310  -1.878   1.639  1.00  0.00           H  
HETATM  131  HB  MK8 A   7      -2.932  -2.490   4.028  1.00  0.00           H  
HETATM  132  HBA MK8 A   7      -2.865  -1.123   2.945  1.00  0.00           H  
HETATM  133  HD  MK8 A   7      -1.992  -1.964   5.877  1.00  0.00           H  
HETATM  134  HDA MK8 A   7      -2.074  -0.270   5.507  1.00  0.00           H  
HETATM  135  HE  MK8 A   7      -0.584  -1.101   7.619  1.00  0.00           H  
HETATM  136  HG  MK8 A   7      -0.739  -0.518   3.575  1.00  0.00           H  
HETATM  137  HGA MK8 A   7      -0.277  -2.168   4.008  1.00  0.00           H  
HETATM  138  HB1 MK8 A   7      -0.744  -4.616   2.423  1.00  0.00           H  
HETATM  139 HB1A MK8 A   7      -2.424  -5.096   2.186  1.00  0.00           H  
HETATM  140 HB1B MK8 A   7      -1.922  -4.381   3.717  1.00  0.00           H  
ATOM    141  N   LEU A   8      -3.555  -1.854   0.369  1.00  0.00           N  
ATOM    142  CA  LEU A   8      -4.750  -1.578  -0.484  1.00  0.00           C  
ATOM    143  C   LEU A   8      -5.035  -2.683  -1.524  1.00  0.00           C  
ATOM    144  O   LEU A   8      -6.221  -2.956  -1.791  1.00  0.00           O  
ATOM    145  CB  LEU A   8      -4.600  -0.210  -1.194  1.00  0.00           C  
ATOM    146  CG  LEU A   8      -5.882   0.398  -1.816  1.00  0.00           C  
ATOM    147  CD1 LEU A   8      -6.742   1.104  -0.768  1.00  0.00           C  
ATOM    148  CD2 LEU A   8      -5.521   1.364  -2.935  1.00  0.00           C  
ATOM    149  H   LEU A   8      -2.816  -1.213   0.337  1.00  0.00           H  
ATOM    150  HA  LEU A   8      -5.601  -1.521   0.178  1.00  0.00           H  
ATOM    151  HB2 LEU A   8      -4.212   0.498  -0.478  1.00  0.00           H  
ATOM    152  HB3 LEU A   8      -3.874  -0.325  -1.983  1.00  0.00           H  
ATOM    153  HG  LEU A   8      -6.474  -0.397  -2.244  1.00  0.00           H  
ATOM    154 HD11 LEU A   8      -6.605   2.172  -0.852  1.00  0.00           H  
ATOM    155 HD12 LEU A   8      -6.448   0.780   0.218  1.00  0.00           H  
ATOM    156 HD13 LEU A   8      -7.781   0.860  -0.933  1.00  0.00           H  
ATOM    157 HD21 LEU A   8      -4.452   1.517  -2.949  1.00  0.00           H  
ATOM    158 HD22 LEU A   8      -6.018   2.309  -2.769  1.00  0.00           H  
ATOM    159 HD23 LEU A   8      -5.839   0.952  -3.882  1.00  0.00           H  
ATOM    160  N   GLN A   9      -3.934  -3.266  -2.130  1.00  0.00           N  
ATOM    161  CA  GLN A   9      -4.024  -4.306  -3.195  1.00  0.00           C  
ATOM    162  C   GLN A   9      -4.261  -5.720  -2.657  1.00  0.00           C  
ATOM    163  O   GLN A   9      -5.006  -6.484  -3.306  1.00  0.00           O  
ATOM    164  CB  GLN A   9      -2.771  -4.286  -4.081  1.00  0.00           C  
ATOM    165  CG  GLN A   9      -2.694  -3.073  -5.000  1.00  0.00           C  
ATOM    166  CD  GLN A   9      -1.392  -3.002  -5.780  1.00  0.00           C  
ATOM    167  OE1 GLN A   9      -0.308  -3.022  -5.199  1.00  0.00           O  
ATOM    168  NE2 GLN A   9      -1.493  -2.903  -7.104  1.00  0.00           N  
ATOM    169  H   GLN A   9      -3.047  -2.951  -1.867  1.00  0.00           H  
ATOM    170  HA  GLN A   9      -4.872  -4.046  -3.812  1.00  0.00           H  
ATOM    171  HB2 GLN A   9      -1.894  -4.289  -3.453  1.00  0.00           H  
ATOM    172  HB3 GLN A   9      -2.765  -5.175  -4.695  1.00  0.00           H  
ATOM    173  HG2 GLN A   9      -3.512  -3.122  -5.705  1.00  0.00           H  
ATOM    174  HG3 GLN A   9      -2.789  -2.179  -4.403  1.00  0.00           H  
ATOM    175 HE21 GLN A   9      -2.389  -2.881  -7.500  1.00  0.00           H  
ATOM    176 HE22 GLN A   9      -0.665  -2.853  -7.630  1.00  0.00           H  
ATOM    177  N   ASP A  10      -3.616  -6.051  -1.479  1.00  0.00           N  
ATOM    178  CA  ASP A  10      -3.728  -7.376  -0.821  1.00  0.00           C  
ATOM    179  C   ASP A  10      -5.144  -7.584  -0.278  1.00  0.00           C  
ATOM    180  O   ASP A  10      -5.612  -8.737  -0.213  1.00  0.00           O  
ATOM    181  CB  ASP A  10      -2.675  -7.527   0.296  1.00  0.00           C  
ATOM    182  CG  ASP A  10      -2.661  -8.913   0.922  1.00  0.00           C  
ATOM    183  OD1 ASP A  10      -3.708  -9.334   1.456  1.00  0.00           O  
ATOM    184  OD2 ASP A  10      -1.603  -9.573   0.878  1.00  0.00           O  
ATOM    185  H   ASP A  10      -3.056  -5.372  -1.056  1.00  0.00           H  
ATOM    186  HA  ASP A  10      -3.544  -8.127  -1.577  1.00  0.00           H  
ATOM    187  HB2 ASP A  10      -1.694  -7.340  -0.116  1.00  0.00           H  
ATOM    188  HB3 ASP A  10      -2.874  -6.805   1.072  1.00  0.00           H  
ATOM    189  N   SER A  11      -5.806  -6.432   0.090  1.00  0.00           N  
ATOM    190  CA  SER A  11      -7.183  -6.398   0.622  1.00  0.00           C  
ATOM    191  C   SER A  11      -8.199  -6.427  -0.521  1.00  0.00           C  
ATOM    192  O   SER A  11      -9.382  -6.684  -0.304  1.00  0.00           O  
ATOM    193  CB  SER A  11      -7.390  -5.148   1.488  1.00  0.00           C  
ATOM    194  OG  SER A  11      -7.342  -3.969   0.703  1.00  0.00           O  
ATOM    195  H   SER A  11      -5.340  -5.579  -0.021  1.00  0.00           H  
ATOM    196  HA  SER A  11      -7.325  -7.280   1.232  1.00  0.00           H  
ATOM    197  HB2 SER A  11      -8.351  -5.201   1.978  1.00  0.00           H  
ATOM    198  HB3 SER A  11      -6.612  -5.097   2.237  1.00  0.00           H  
ATOM    199  HG  SER A  11      -8.192  -3.836   0.274  1.00  0.00           H  
HETATM  200  N   NH2 A  12      -7.734  -6.170  -1.744  1.00  0.00           N  
HETATM  201  HN1 NH2 A  12      -6.778  -5.977  -1.848  1.00  0.00           H  
HETATM  202  HN2 NH2 A  12      -8.366  -6.183  -2.492  1.00  0.00           H  
TER     203      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        6                                                                  
HETATM    1  C   ACE A   0       5.381   5.522   3.373  1.00  0.00           C  
HETATM    2  O   ACE A   0       4.304   5.116   3.851  1.00  0.00           O  
HETATM    3  CH3 ACE A   0       6.659   5.337   4.165  1.00  0.00           C  
HETATM    4  H1  ACE A   0       6.597   4.427   4.743  1.00  0.00           H  
HETATM    5  H2  ACE A   0       6.793   6.177   4.831  1.00  0.00           H  
HETATM    6  H3  ACE A   0       7.498   5.278   3.488  1.00  0.00           H  
ATOM      7  N   HIS A   1       5.525   6.161   2.157  1.00  0.00           N  
ATOM      8  CA  HIS A   1       4.406   6.457   1.240  1.00  0.00           C  
ATOM      9  C   HIS A   1       3.947   5.199   0.471  1.00  0.00           C  
ATOM     10  O   HIS A   1       2.737   5.077   0.197  1.00  0.00           O  
ATOM     11  CB  HIS A   1       4.807   7.583   0.263  1.00  0.00           C  
ATOM     12  CG  HIS A   1       3.640   8.275  -0.387  1.00  0.00           C  
ATOM     13  ND1 HIS A   1       2.697   7.608  -1.139  1.00  0.00           N  
ATOM     14  CD2 HIS A   1       3.265   9.578  -0.388  1.00  0.00           C  
ATOM     15  CE1 HIS A   1       1.793   8.468  -1.573  1.00  0.00           C  
ATOM     16  NE2 HIS A   1       2.114   9.670  -1.132  1.00  0.00           N  
ATOM     17  H   HIS A   1       6.425   6.454   1.896  1.00  0.00           H  
ATOM     18  HA  HIS A   1       3.581   6.811   1.844  1.00  0.00           H  
ATOM     19  HB2 HIS A   1       5.373   8.330   0.801  1.00  0.00           H  
ATOM     20  HB3 HIS A   1       5.426   7.173  -0.520  1.00  0.00           H  
ATOM     21  HD1 HIS A   1       2.691   6.646  -1.328  1.00  0.00           H  
ATOM     22  HD2 HIS A   1       3.778  10.395   0.102  1.00  0.00           H  
ATOM     23  HE1 HIS A   1       0.935   8.229  -2.184  1.00  0.00           H  
ATOM     24  HE2 HIS A   1       1.541  10.463  -1.194  1.00  0.00           H  
ATOM     25  N   LYS A   2       4.937   4.293   0.105  1.00  0.00           N  
ATOM     26  CA  LYS A   2       4.671   3.047  -0.674  1.00  0.00           C  
ATOM     27  C   LYS A   2       3.916   1.944   0.105  1.00  0.00           C  
ATOM     28  O   LYS A   2       3.140   1.186  -0.512  1.00  0.00           O  
ATOM     29  CB  LYS A   2       5.957   2.474  -1.323  1.00  0.00           C  
ATOM     30  CG  LYS A   2       7.102   2.113  -0.382  1.00  0.00           C  
ATOM     31  CD  LYS A   2       8.213   1.388  -1.133  1.00  0.00           C  
ATOM     32  CE  LYS A   2       9.300   0.866  -0.198  1.00  0.00           C  
ATOM     33  NZ  LYS A   2       8.768  -0.110   0.796  1.00  0.00           N  
ATOM     34  H   LYS A   2       5.862   4.500   0.348  1.00  0.00           H  
ATOM     35  HA  LYS A   2       4.023   3.350  -1.481  1.00  0.00           H  
ATOM     36  HB2 LYS A   2       5.693   1.578  -1.858  1.00  0.00           H  
ATOM     37  HB3 LYS A   2       6.326   3.197  -2.034  1.00  0.00           H  
ATOM     38  HG2 LYS A   2       7.511   3.015   0.039  1.00  0.00           H  
ATOM     39  HG3 LYS A   2       6.734   1.469   0.401  1.00  0.00           H  
ATOM     40  HD2 LYS A   2       7.786   0.554  -1.667  1.00  0.00           H  
ATOM     41  HD3 LYS A   2       8.660   2.075  -1.838  1.00  0.00           H  
ATOM     42  HE2 LYS A   2      10.058   0.377  -0.793  1.00  0.00           H  
ATOM     43  HE3 LYS A   2       9.743   1.699   0.327  1.00  0.00           H  
ATOM     44  HZ1 LYS A   2       8.229   0.389   1.533  1.00  0.00           H  
ATOM     45  HZ2 LYS A   2       9.551  -0.626   1.245  1.00  0.00           H  
ATOM     46  HZ3 LYS A   2       8.142  -0.794   0.325  1.00  0.00           H  
HETATM   47  C   MK8 A   3       1.946   0.707   2.067  1.00  0.00           C  
HETATM   48  N   MK8 A   3       4.146   1.826   1.483  1.00  0.00           N  
HETATM   49  O   MK8 A   3       1.390  -0.337   1.653  1.00  0.00           O  
HETATM   50  CA  MK8 A   3       3.506   0.777   2.373  1.00  0.00           C  
HETATM   51  CB  MK8 A   3       3.735   1.179   3.899  1.00  0.00           C  
HETATM   52  CD  MK8 A   3       1.574   0.490   5.222  1.00  0.00           C  
HETATM   53  CE  MK8 A   3       0.893  -0.122   6.469  1.00  0.00           C  
HETATM   54  CG  MK8 A   3       3.089   0.317   5.056  1.00  0.00           C  
HETATM   55  CB1 MK8 A   3       4.281  -0.557   2.074  1.00  0.00           C  
HETATM   56  H   MK8 A   3       4.773   2.444   1.898  1.00  0.00           H  
HETATM   57  HB  MK8 A   3       3.377   2.193   4.021  1.00  0.00           H  
HETATM   58  HBA MK8 A   3       4.797   1.186   4.077  1.00  0.00           H  
HETATM   59  HD  MK8 A   3       1.108   0.049   4.349  1.00  0.00           H  
HETATM   60  HDA MK8 A   3       1.357   1.544   5.217  1.00  0.00           H  
HETATM   61  HE  MK8 A   3       1.472  -0.122   7.381  1.00  0.00           H  
HETATM   62  HG  MK8 A   3       3.572   0.585   5.988  1.00  0.00           H  
HETATM   63  HGA MK8 A   3       3.284  -0.724   4.853  1.00  0.00           H  
HETATM   64  HB1 MK8 A   3       4.740  -0.496   1.097  1.00  0.00           H  
HETATM   65 HB1A MK8 A   3       3.590  -1.386   2.094  1.00  0.00           H  
HETATM   66 HB1B MK8 A   3       5.044  -0.707   2.824  1.00  0.00           H  
ATOM     67  N   LEU A   4       1.249   1.878   2.363  1.00  0.00           N  
ATOM     68  CA  LEU A   4      -0.223   2.044   2.230  1.00  0.00           C  
ATOM     69  C   LEU A   4      -0.744   1.592   0.865  1.00  0.00           C  
ATOM     70  O   LEU A   4      -1.928   1.204   0.776  1.00  0.00           O  
ATOM     71  CB  LEU A   4      -0.646   3.502   2.544  1.00  0.00           C  
ATOM     72  CG  LEU A   4      -2.162   3.769   2.747  1.00  0.00           C  
ATOM     73  CD1 LEU A   4      -2.644   3.342   4.140  1.00  0.00           C  
ATOM     74  CD2 LEU A   4      -2.470   5.238   2.511  1.00  0.00           C  
ATOM     75  H   LEU A   4       1.761   2.633   2.725  1.00  0.00           H  
ATOM     76  HA  LEU A   4      -0.669   1.401   2.971  1.00  0.00           H  
ATOM     77  HB2 LEU A   4      -0.137   3.806   3.447  1.00  0.00           H  
ATOM     78  HB3 LEU A   4      -0.303   4.130   1.735  1.00  0.00           H  
ATOM     79  HG  LEU A   4      -2.718   3.196   2.021  1.00  0.00           H  
ATOM     80 HD11 LEU A   4      -3.666   2.996   4.076  1.00  0.00           H  
ATOM     81 HD12 LEU A   4      -2.590   4.182   4.814  1.00  0.00           H  
ATOM     82 HD13 LEU A   4      -2.017   2.542   4.507  1.00  0.00           H  
ATOM     83 HD21 LEU A   4      -3.491   5.442   2.795  1.00  0.00           H  
ATOM     84 HD22 LEU A   4      -2.333   5.470   1.465  1.00  0.00           H  
ATOM     85 HD23 LEU A   4      -1.803   5.845   3.105  1.00  0.00           H  
ATOM     86  N   HIS A   5       0.164   1.637  -0.174  1.00  0.00           N  
ATOM     87  CA  HIS A   5      -0.149   1.223  -1.556  1.00  0.00           C  
ATOM     88  C   HIS A   5      -0.331  -0.296  -1.589  1.00  0.00           C  
ATOM     89  O   HIS A   5      -1.270  -0.798  -2.231  1.00  0.00           O  
ATOM     90  CB  HIS A   5       0.960   1.684  -2.512  1.00  0.00           C  
ATOM     91  CG  HIS A   5       0.561   1.702  -3.958  1.00  0.00           C  
ATOM     92  ND1 HIS A   5       0.136   0.581  -4.638  1.00  0.00           N  
ATOM     93  CD2 HIS A   5       0.526   2.720  -4.857  1.00  0.00           C  
ATOM     94  CE1 HIS A   5      -0.142   0.906  -5.889  1.00  0.00           C  
ATOM     95  NE2 HIS A   5       0.086   2.196  -6.045  1.00  0.00           N  
ATOM     96  H   HIS A   5       1.072   1.947   0.019  1.00  0.00           H  
ATOM     97  HA  HIS A   5      -1.081   1.690  -1.837  1.00  0.00           H  
ATOM     98  HB2 HIS A   5       1.256   2.688  -2.244  1.00  0.00           H  
ATOM     99  HB3 HIS A   5       1.808   1.027  -2.409  1.00  0.00           H  
ATOM    100  HD1 HIS A   5       0.054  -0.321  -4.263  1.00  0.00           H  
ATOM    101  HD2 HIS A   5       0.799   3.752  -4.675  1.00  0.00           H  
ATOM    102  HE1 HIS A   5      -0.494   0.233  -6.654  1.00  0.00           H  
ATOM    103  HE2 HIS A   5      -0.113   2.711  -6.855  1.00  0.00           H  
ATOM    104  N   GLN A   6       0.601  -1.000  -0.863  1.00  0.00           N  
ATOM    105  CA  GLN A   6       0.627  -2.479  -0.736  1.00  0.00           C  
ATOM    106  C   GLN A   6      -0.593  -3.039   0.024  1.00  0.00           C  
ATOM    107  O   GLN A   6      -1.160  -4.054  -0.406  1.00  0.00           O  
ATOM    108  CB  GLN A   6       1.920  -2.940  -0.040  1.00  0.00           C  
ATOM    109  CG  GLN A   6       3.118  -3.093  -0.970  1.00  0.00           C  
ATOM    110  CD  GLN A   6       3.082  -4.386  -1.757  1.00  0.00           C  
ATOM    111  OE1 GLN A   6       2.135  -4.651  -2.495  1.00  0.00           O  
ATOM    112  NE2 GLN A   6       4.121  -5.201  -1.605  1.00  0.00           N  
ATOM    113  H   GLN A   6       1.300  -0.481  -0.410  1.00  0.00           H  
ATOM    114  HA  GLN A   6       0.615  -2.886  -1.736  1.00  0.00           H  
ATOM    115  HB2 GLN A   6       2.182  -2.229   0.725  1.00  0.00           H  
ATOM    116  HB3 GLN A   6       1.736  -3.895   0.427  1.00  0.00           H  
ATOM    117  HG2 GLN A   6       3.127  -2.274  -1.669  1.00  0.00           H  
ATOM    118  HG3 GLN A   6       4.023  -3.070  -0.379  1.00  0.00           H  
ATOM    119 HE21 GLN A   6       4.844  -4.925  -1.003  1.00  0.00           H  
ATOM    120 HE22 GLN A   6       4.121  -6.044  -2.098  1.00  0.00           H  
HETATM  121  C   MK8 A   7      -3.442  -2.795   1.216  1.00  0.00           C  
HETATM  122  N   MK8 A   7      -0.973  -2.374   1.184  1.00  0.00           N  
HETATM  123  O   MK8 A   7      -4.367  -3.635   1.411  1.00  0.00           O  
HETATM  124  CA  MK8 A   7      -2.115  -2.781   2.073  1.00  0.00           C  
HETATM  125  CB  MK8 A   7      -2.335  -1.706   3.198  1.00  0.00           C  
HETATM  126  CD  MK8 A   7      -1.463  -0.835   5.422  1.00  0.00           C  
HETATM  127  CE  MK8 A   7      -0.372  -0.676   6.548  1.00  0.00           C  
HETATM  128  CG  MK8 A   7      -1.092  -1.147   3.958  1.00  0.00           C  
HETATM  129  CB1 MK8 A   7      -1.817  -4.168   2.752  1.00  0.00           C  
HETATM  130  H   MK8 A   7      -0.462  -1.597   1.444  1.00  0.00           H  
HETATM  131  HB  MK8 A   7      -3.004  -2.132   3.932  1.00  0.00           H  
HETATM  132  HBA MK8 A   7      -2.833  -0.860   2.749  1.00  0.00           H  
HETATM  133  HD  MK8 A   7      -2.140  -1.621   5.742  1.00  0.00           H  
HETATM  134  HDA MK8 A   7      -2.022   0.084   5.417  1.00  0.00           H  
HETATM  135  HE  MK8 A   7      -0.652  -1.046   7.525  1.00  0.00           H  
HETATM  136  HG  MK8 A   7      -0.766  -0.231   3.480  1.00  0.00           H  
HETATM  137  HGA MK8 A   7      -0.299  -1.880   3.924  1.00  0.00           H  
HETATM  138  HB1 MK8 A   7      -1.352  -4.826   2.034  1.00  0.00           H  
HETATM  139 HB1A MK8 A   7      -2.742  -4.605   3.095  1.00  0.00           H  
HETATM  140 HB1B MK8 A   7      -1.154  -4.021   3.593  1.00  0.00           H  
ATOM    141  N   LEU A   8      -3.530  -1.761   0.303  1.00  0.00           N  
ATOM    142  CA  LEU A   8      -4.703  -1.505  -0.578  1.00  0.00           C  
ATOM    143  C   LEU A   8      -4.994  -2.635  -1.589  1.00  0.00           C  
ATOM    144  O   LEU A   8      -6.185  -2.905  -1.843  1.00  0.00           O  
ATOM    145  CB  LEU A   8      -4.521  -0.158  -1.317  1.00  0.00           C  
ATOM    146  CG  LEU A   8      -5.778   0.462  -1.977  1.00  0.00           C  
ATOM    147  CD1 LEU A   8      -6.672   1.177  -0.961  1.00  0.00           C  
ATOM    148  CD2 LEU A   8      -5.365   1.433  -3.071  1.00  0.00           C  
ATOM    149  H   LEU A   8      -2.786  -1.121   0.269  1.00  0.00           H  
ATOM    150  HA  LEU A   8      -5.562  -1.416   0.069  1.00  0.00           H  
ATOM    151  HB2 LEU A   8      -4.133   0.560  -0.610  1.00  0.00           H  
ATOM    152  HB3 LEU A   8      -3.781  -0.302  -2.090  1.00  0.00           H  
ATOM    153  HG  LEU A   8      -6.360  -0.325  -2.434  1.00  0.00           H  
ATOM    154 HD11 LEU A   8      -7.506   0.540  -0.704  1.00  0.00           H  
ATOM    155 HD12 LEU A   8      -7.041   2.096  -1.392  1.00  0.00           H  
ATOM    156 HD13 LEU A   8      -6.101   1.400  -0.072  1.00  0.00           H  
ATOM    157 HD21 LEU A   8      -6.248   1.837  -3.544  1.00  0.00           H  
ATOM    158 HD22 LEU A   8      -4.767   0.916  -3.806  1.00  0.00           H  
ATOM    159 HD23 LEU A   8      -4.789   2.237  -2.638  1.00  0.00           H  
ATOM    160  N   GLN A   9      -3.902  -3.249  -2.186  1.00  0.00           N  
ATOM    161  CA  GLN A   9      -4.017  -4.322  -3.222  1.00  0.00           C  
ATOM    162  C   GLN A   9      -4.262  -5.730  -2.661  1.00  0.00           C  
ATOM    163  O   GLN A   9      -4.996  -6.505  -3.311  1.00  0.00           O  
ATOM    164  CB  GLN A   9      -2.787  -4.343  -4.141  1.00  0.00           C  
ATOM    165  CG  GLN A   9      -2.792  -3.238  -5.188  1.00  0.00           C  
ATOM    166  CD  GLN A   9      -1.613  -3.321  -6.142  1.00  0.00           C  
ATOM    167  OE1 GLN A   9      -0.458  -3.327  -5.718  1.00  0.00           O  
ATOM    168  NE2 GLN A   9      -1.900  -3.375  -7.441  1.00  0.00           N  
ATOM    169  H   GLN A   9      -3.006  -2.937  -1.937  1.00  0.00           H  
ATOM    170  HA  GLN A   9      -4.873  -4.066  -3.830  1.00  0.00           H  
ATOM    171  HB2 GLN A   9      -1.895  -4.235  -3.541  1.00  0.00           H  
ATOM    172  HB3 GLN A   9      -2.752  -5.293  -4.653  1.00  0.00           H  
ATOM    173  HG2 GLN A   9      -3.703  -3.315  -5.764  1.00  0.00           H  
ATOM    174  HG3 GLN A   9      -2.766  -2.284  -4.686  1.00  0.00           H  
ATOM    175 HE21 GLN A   9      -2.843  -3.359  -7.709  1.00  0.00           H  
ATOM    176 HE22 GLN A   9      -1.156  -3.426  -8.080  1.00  0.00           H  
ATOM    177  N   ASP A  10      -3.628  -6.050  -1.473  1.00  0.00           N  
ATOM    178  CA  ASP A  10      -3.740  -7.377  -0.808  1.00  0.00           C  
ATOM    179  C   ASP A  10      -5.158  -7.615  -0.271  1.00  0.00           C  
ATOM    180  O   ASP A  10      -5.590  -8.781  -0.199  1.00  0.00           O  
ATOM    181  CB  ASP A  10      -2.690  -7.521   0.313  1.00  0.00           C  
ATOM    182  CG  ASP A  10      -2.663  -8.912   0.929  1.00  0.00           C  
ATOM    183  OD1 ASP A  10      -3.700  -9.336   1.481  1.00  0.00           O  
ATOM    184  OD2 ASP A  10      -1.609  -9.574   0.854  1.00  0.00           O  
ATOM    185  H   ASP A  10      -3.064  -5.370  -1.054  1.00  0.00           H  
ATOM    186  HA  ASP A  10      -3.542  -8.127  -1.562  1.00  0.00           H  
ATOM    187  HB2 ASP A  10      -1.710  -7.321  -0.094  1.00  0.00           H  
ATOM    188  HB3 ASP A  10      -2.900  -6.806   1.093  1.00  0.00           H  
ATOM    189  N   SER A  11      -5.860  -6.485   0.088  1.00  0.00           N  
ATOM    190  CA  SER A  11      -7.236  -6.487   0.615  1.00  0.00           C  
ATOM    191  C   SER A  11      -8.228  -6.564  -0.578  1.00  0.00           C  
ATOM    192  O   SER A  11      -7.826  -6.963  -1.670  1.00  0.00           O  
ATOM    193  CB  SER A  11      -7.417  -5.231   1.498  1.00  0.00           C  
ATOM    194  OG  SER A  11      -6.298  -5.056   2.348  1.00  0.00           O  
ATOM    195  H   SER A  11      -5.422  -5.617  -0.022  1.00  0.00           H  
ATOM    196  HA  SER A  11      -7.352  -7.377   1.226  1.00  0.00           H  
ATOM    197  HB2 SER A  11      -7.518  -4.360   0.873  1.00  0.00           H  
ATOM    198  HB3 SER A  11      -8.295  -5.337   2.118  1.00  0.00           H  
ATOM    199  HG  SER A  11      -6.587  -4.689   3.186  1.00  0.00           H  
HETATM  200  N   NH2 A  12      -9.514  -6.242  -0.390  1.00  0.00           N  
HETATM  201  HN1 NH2 A  12      -9.800  -5.957   0.498  1.00  0.00           H  
HETATM  202  HN2 NH2 A  12     -10.120  -6.305  -1.164  1.00  0.00           H  
TER     203      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        7                                                                  
HETATM    1  C   ACE A   0       5.108   5.400   3.456  1.00  0.00           C  
HETATM    2  O   ACE A   0       4.030   4.909   3.845  1.00  0.00           O  
HETATM    3  CH3 ACE A   0       6.339   5.275   4.330  1.00  0.00           C  
HETATM    4  H1  ACE A   0       6.284   4.360   4.900  1.00  0.00           H  
HETATM    5  H2  ACE A   0       6.388   6.117   5.004  1.00  0.00           H  
HETATM    6  H3  ACE A   0       7.222   5.259   3.708  1.00  0.00           H  
ATOM      7  N   HIS A   1       5.293   6.078   2.270  1.00  0.00           N  
ATOM      8  CA  HIS A   1       4.226   6.321   1.277  1.00  0.00           C  
ATOM      9  C   HIS A   1       3.913   5.071   0.443  1.00  0.00           C  
ATOM     10  O   HIS A   1       2.762   4.913  -0.003  1.00  0.00           O  
ATOM     11  CB  HIS A   1       4.594   7.497   0.359  1.00  0.00           C  
ATOM     12  CG  HIS A   1       4.487   8.833   1.033  1.00  0.00           C  
ATOM     13  ND1 HIS A   1       3.405   9.193   1.810  1.00  0.00           N  
ATOM     14  CD2 HIS A   1       5.318   9.907   1.032  1.00  0.00           C  
ATOM     15  CE1 HIS A   1       3.574  10.424   2.259  1.00  0.00           C  
ATOM     16  NE2 HIS A   1       4.726  10.878   1.802  1.00  0.00           N  
ATOM     17  H   HIS A   1       6.188   6.426   2.079  1.00  0.00           H  
ATOM     18  HA  HIS A   1       3.339   6.591   1.829  1.00  0.00           H  
ATOM     19  HB2 HIS A   1       5.612   7.380   0.021  1.00  0.00           H  
ATOM     20  HB3 HIS A   1       3.934   7.500  -0.496  1.00  0.00           H  
ATOM     21  HD1 HIS A   1       2.628   8.628   2.004  1.00  0.00           H  
ATOM     22  HD2 HIS A   1       6.261   9.992   0.509  1.00  0.00           H  
ATOM     23  HE1 HIS A   1       2.889  10.965   2.894  1.00  0.00           H  
ATOM     24  HE2 HIS A   1       5.071  11.785   1.940  1.00  0.00           H  
ATOM     25  N   LYS A   2       4.968   4.199   0.241  1.00  0.00           N  
ATOM     26  CA  LYS A   2       4.869   2.939  -0.547  1.00  0.00           C  
ATOM     27  C   LYS A   2       4.042   1.853   0.164  1.00  0.00           C  
ATOM     28  O   LYS A   2       3.251   1.141  -0.489  1.00  0.00           O  
ATOM     29  CB  LYS A   2       6.263   2.382  -0.899  1.00  0.00           C  
ATOM     30  CG  LYS A   2       7.060   3.246  -1.873  1.00  0.00           C  
ATOM     31  CD  LYS A   2       8.426   2.634  -2.169  1.00  0.00           C  
ATOM     32  CE  LYS A   2       9.236   3.481  -3.147  1.00  0.00           C  
ATOM     33  NZ  LYS A   2       8.561   3.620  -4.469  1.00  0.00           N  
ATOM     34  H   LYS A   2       5.832   4.430   0.637  1.00  0.00           H  
ATOM     35  HA  LYS A   2       4.364   3.187  -1.469  1.00  0.00           H  
ATOM     36  HB2 LYS A   2       6.840   2.273   0.005  1.00  0.00           H  
ATOM     37  HB3 LYS A   2       6.137   1.408  -1.346  1.00  0.00           H  
ATOM     38  HG2 LYS A   2       6.508   3.331  -2.798  1.00  0.00           H  
ATOM     39  HG3 LYS A   2       7.203   4.226  -1.447  1.00  0.00           H  
ATOM     40  HD2 LYS A   2       8.977   2.550  -1.245  1.00  0.00           H  
ATOM     41  HD3 LYS A   2       8.283   1.651  -2.593  1.00  0.00           H  
ATOM     42  HE2 LYS A   2       9.382   4.464  -2.723  1.00  0.00           H  
ATOM     43  HE3 LYS A   2      10.199   3.011  -3.295  1.00  0.00           H  
ATOM     44  HZ1 LYS A   2       7.605   4.012  -4.342  1.00  0.00           H  
ATOM     45  HZ2 LYS A   2       8.484   2.692  -4.931  1.00  0.00           H  
ATOM     46  HZ3 LYS A   2       9.106   4.258  -5.084  1.00  0.00           H  
HETATM   47  C   MK8 A   3       1.991   0.662   2.068  1.00  0.00           C  
HETATM   48  N   MK8 A   3       4.244   1.704   1.536  1.00  0.00           N  
HETATM   49  O   MK8 A   3       1.421  -0.331   1.563  1.00  0.00           O  
HETATM   50  CA  MK8 A   3       3.554   0.676   2.400  1.00  0.00           C  
HETATM   51  CB  MK8 A   3       3.806   1.063   3.925  1.00  0.00           C  
HETATM   52  CD  MK8 A   3       1.591   0.656   5.229  1.00  0.00           C  
HETATM   53  CE  MK8 A   3       0.741  -0.043   6.330  1.00  0.00           C  
HETATM   54  CG  MK8 A   3       3.064   0.274   5.068  1.00  0.00           C  
HETATM   55  CB1 MK8 A   3       4.278  -0.683   2.115  1.00  0.00           C  
HETATM   56  H   MK8 A   3       4.894   2.292   1.970  1.00  0.00           H  
HETATM   57  HB  MK8 A   3       3.547   2.108   4.037  1.00  0.00           H  
HETATM   58  HBA MK8 A   3       4.861   0.966   4.115  1.00  0.00           H  
HETATM   59  HD  MK8 A   3       1.114   0.458   4.278  1.00  0.00           H  
HETATM   60  HDA MK8 A   3       1.542   1.717   5.404  1.00  0.00           H  
HETATM   61  HE  MK8 A   3       0.895   0.296   7.344  1.00  0.00           H  
HETATM   62  HG  MK8 A   3       3.577   0.464   5.999  1.00  0.00           H  
HETATM   63  HGA MK8 A   3       3.117  -0.780   4.847  1.00  0.00           H  
HETATM   64  HB1 MK8 A   3       5.025  -0.540   1.348  1.00  0.00           H  
HETATM   65 HB1A MK8 A   3       3.556  -1.413   1.782  1.00  0.00           H  
HETATM   66 HB1B MK8 A   3       4.753  -1.034   3.020  1.00  0.00           H  
ATOM     67  N   LEU A   4       1.315   1.822   2.442  1.00  0.00           N  
ATOM     68  CA  LEU A   4      -0.145   2.041   2.299  1.00  0.00           C  
ATOM     69  C   LEU A   4      -0.673   1.656   0.910  1.00  0.00           C  
ATOM     70  O   LEU A   4      -1.869   1.308   0.804  1.00  0.00           O  
ATOM     71  CB  LEU A   4      -0.505   3.503   2.663  1.00  0.00           C  
ATOM     72  CG  LEU A   4      -2.009   3.847   2.834  1.00  0.00           C  
ATOM     73  CD1 LEU A   4      -2.561   3.380   4.187  1.00  0.00           C  
ATOM     74  CD2 LEU A   4      -2.214   5.343   2.670  1.00  0.00           C  
ATOM     75  H   LEU A   4       1.838   2.531   2.870  1.00  0.00           H  
ATOM     76  HA  LEU A   4      -0.622   1.393   3.019  1.00  0.00           H  
ATOM     77  HB2 LEU A   4      -0.012   3.737   3.595  1.00  0.00           H  
ATOM     78  HB3 LEU A   4      -0.101   4.146   1.896  1.00  0.00           H  
ATOM     79  HG  LEU A   4      -2.573   3.350   2.058  1.00  0.00           H  
ATOM     80 HD11 LEU A   4      -3.628   3.547   4.217  1.00  0.00           H  
ATOM     81 HD12 LEU A   4      -2.086   3.934   4.981  1.00  0.00           H  
ATOM     82 HD13 LEU A   4      -2.359   2.325   4.313  1.00  0.00           H  
ATOM     83 HD21 LEU A   4      -2.431   5.565   1.635  1.00  0.00           H  
ATOM     84 HD22 LEU A   4      -1.316   5.863   2.969  1.00  0.00           H  
ATOM     85 HD23 LEU A   4      -3.039   5.663   3.288  1.00  0.00           H  
ATOM     86  N   HIS A   5       0.237   1.714  -0.131  1.00  0.00           N  
ATOM     87  CA  HIS A   5      -0.093   1.365  -1.530  1.00  0.00           C  
ATOM     88  C   HIS A   5      -0.333  -0.147  -1.633  1.00  0.00           C  
ATOM     89  O   HIS A   5      -1.340  -0.567  -2.232  1.00  0.00           O  
ATOM     90  CB  HIS A   5       1.024   1.851  -2.479  1.00  0.00           C  
ATOM     91  CG  HIS A   5       0.656   1.855  -3.939  1.00  0.00           C  
ATOM     92  ND1 HIS A   5       0.361   0.708  -4.645  1.00  0.00           N  
ATOM     93  CD2 HIS A   5       0.547   2.878  -4.826  1.00  0.00           C  
ATOM     94  CE1 HIS A   5       0.090   1.023  -5.901  1.00  0.00           C  
ATOM     95  NE2 HIS A   5       0.195   2.331  -6.034  1.00  0.00           N  
ATOM     96  H   HIS A   5       1.154   1.992   0.071  1.00  0.00           H  
ATOM     97  HA  HIS A   5      -1.015   1.870  -1.780  1.00  0.00           H  
ATOM     98  HB2 HIS A   5       1.292   2.864  -2.211  1.00  0.00           H  
ATOM     99  HB3 HIS A   5       1.888   1.218  -2.356  1.00  0.00           H  
ATOM    100  HD1 HIS A   5       0.350  -0.202  -4.281  1.00  0.00           H  
ATOM    101  HD2 HIS A   5       0.707   3.929  -4.622  1.00  0.00           H  
ATOM    102  HE1 HIS A   5      -0.167   0.328  -6.686  1.00  0.00           H  
ATOM    103  HE2 HIS A   5       0.046   2.829  -6.865  1.00  0.00           H  
ATOM    104  N   GLN A   6       0.609  -0.941  -1.009  1.00  0.00           N  
ATOM    105  CA  GLN A   6       0.551  -2.427  -0.968  1.00  0.00           C  
ATOM    106  C   GLN A   6      -0.692  -2.930  -0.225  1.00  0.00           C  
ATOM    107  O   GLN A   6      -1.323  -3.905  -0.657  1.00  0.00           O  
ATOM    108  CB  GLN A   6       1.795  -3.017  -0.277  1.00  0.00           C  
ATOM    109  CG  GLN A   6       3.006  -3.208  -1.179  1.00  0.00           C  
ATOM    110  CD  GLN A   6       4.145  -3.919  -0.471  1.00  0.00           C  
ATOM    111  OE1 GLN A   6       4.679  -3.420   0.519  1.00  0.00           O  
ATOM    112  NE2 GLN A   6       4.521  -5.090  -0.972  1.00  0.00           N  
ATOM    113  H   GLN A   6       1.358  -0.489  -0.561  1.00  0.00           H  
ATOM    114  HA  GLN A   6       0.510  -2.785  -1.985  1.00  0.00           H  
ATOM    115  HB2 GLN A   6       2.084  -2.368   0.534  1.00  0.00           H  
ATOM    116  HB3 GLN A   6       1.530  -3.979   0.135  1.00  0.00           H  
ATOM    117  HG2 GLN A   6       2.713  -3.792  -2.034  1.00  0.00           H  
ATOM    118  HG3 GLN A   6       3.362  -2.247  -1.507  1.00  0.00           H  
ATOM    119 HE21 GLN A   6       4.051  -5.430  -1.761  1.00  0.00           H  
ATOM    120 HE22 GLN A   6       5.257  -5.564  -0.533  1.00  0.00           H  
HETATM  121  C   MK8 A   7      -3.485  -2.520   0.962  1.00  0.00           C  
HETATM  122  N   MK8 A   7      -1.021  -2.242   0.926  1.00  0.00           N  
HETATM  123  O   MK8 A   7      -4.460  -3.287   1.183  1.00  0.00           O  
HETATM  124  CA  MK8 A   7      -2.175  -2.562   1.827  1.00  0.00           C  
HETATM  125  CB  MK8 A   7      -2.333  -1.446   2.917  1.00  0.00           C  
HETATM  126  CD  MK8 A   7      -0.651  -1.757   4.829  1.00  0.00           C  
HETATM  127  CE  MK8 A   7      -0.200  -1.052   6.159  1.00  0.00           C  
HETATM  128  CG  MK8 A   7      -1.056  -0.910   3.623  1.00  0.00           C  
HETATM  129  CB1 MK8 A   7      -1.948  -3.939   2.540  1.00  0.00           C  
HETATM  130  H   MK8 A   7      -0.465  -1.495   1.170  1.00  0.00           H  
HETATM  131  HB  MK8 A   7      -2.999  -1.823   3.680  1.00  0.00           H  
HETATM  132  HBA MK8 A   7      -2.807  -0.599   2.451  1.00  0.00           H  
HETATM  133  HD  MK8 A   7       0.156  -2.406   4.510  1.00  0.00           H  
HETATM  134  HDA MK8 A   7      -1.492  -2.375   5.079  1.00  0.00           H  
HETATM  135  HE  MK8 A   7      -0.681  -1.399   7.060  1.00  0.00           H  
HETATM  136  HG  MK8 A   7      -1.234   0.105   3.948  1.00  0.00           H  
HETATM  137  HGA MK8 A   7      -0.249  -0.918   2.918  1.00  0.00           H  
HETATM  138  HB1 MK8 A   7      -2.082  -4.740   1.827  1.00  0.00           H  
HETATM  139 HB1A MK8 A   7      -2.664  -4.049   3.342  1.00  0.00           H  
HETATM  140 HB1B MK8 A   7      -0.948  -3.974   2.943  1.00  0.00           H  
ATOM    141  N   LEU A   8      -3.479  -1.540  -0.015  1.00  0.00           N  
ATOM    142  CA  LEU A   8      -4.611  -1.272  -0.939  1.00  0.00           C  
ATOM    143  C   LEU A   8      -4.901  -2.469  -1.862  1.00  0.00           C  
ATOM    144  O   LEU A   8      -6.073  -2.681  -2.227  1.00  0.00           O  
ATOM    145  CB  LEU A   8      -4.340   0.008  -1.768  1.00  0.00           C  
ATOM    146  CG  LEU A   8      -5.534   0.591  -2.573  1.00  0.00           C  
ATOM    147  CD1 LEU A   8      -6.489   1.396  -1.687  1.00  0.00           C  
ATOM    148  CD2 LEU A   8      -5.025   1.452  -3.718  1.00  0.00           C  
ATOM    149  H   LEU A   8      -2.681  -0.968  -0.085  1.00  0.00           H  
ATOM    150  HA  LEU A   8      -5.484  -1.099  -0.327  1.00  0.00           H  
ATOM    151  HB2 LEU A   8      -3.991   0.775  -1.091  1.00  0.00           H  
ATOM    152  HB3 LEU A   8      -3.545  -0.211  -2.465  1.00  0.00           H  
ATOM    153  HG  LEU A   8      -6.097  -0.226  -3.000  1.00  0.00           H  
ATOM    154 HD11 LEU A   8      -7.252   1.853  -2.301  1.00  0.00           H  
ATOM    155 HD12 LEU A   8      -5.938   2.164  -1.167  1.00  0.00           H  
ATOM    156 HD13 LEU A   8      -6.954   0.736  -0.969  1.00  0.00           H  
ATOM    157 HD21 LEU A   8      -5.083   2.493  -3.438  1.00  0.00           H  
ATOM    158 HD22 LEU A   8      -5.633   1.280  -4.594  1.00  0.00           H  
ATOM    159 HD23 LEU A   8      -4.000   1.192  -3.934  1.00  0.00           H  
ATOM    160  N   GLN A   9      -3.801  -3.207  -2.254  1.00  0.00           N  
ATOM    161  CA  GLN A   9      -3.867  -4.369  -3.181  1.00  0.00           C  
ATOM    162  C   GLN A   9      -4.279  -5.700  -2.527  1.00  0.00           C  
ATOM    163  O   GLN A   9      -5.227  -6.337  -3.031  1.00  0.00           O  
ATOM    164  CB  GLN A   9      -2.530  -4.553  -3.918  1.00  0.00           C  
ATOM    165  CG  GLN A   9      -2.274  -3.531  -5.029  1.00  0.00           C  
ATOM    166  CD  GLN A   9      -3.186  -3.702  -6.241  1.00  0.00           C  
ATOM    167  OE1 GLN A   9      -4.410  -3.681  -6.115  1.00  0.00           O  
ATOM    168  NE2 GLN A   9      -2.592  -3.864  -7.421  1.00  0.00           N  
ATOM    169  H   GLN A   9      -2.921  -2.923  -1.929  1.00  0.00           H  
ATOM    170  HA  GLN A   9      -4.612  -4.124  -3.924  1.00  0.00           H  
ATOM    171  HB2 GLN A   9      -1.725  -4.476  -3.204  1.00  0.00           H  
ATOM    172  HB3 GLN A   9      -2.512  -5.539  -4.357  1.00  0.00           H  
ATOM    173  HG2 GLN A   9      -2.424  -2.542  -4.627  1.00  0.00           H  
ATOM    174  HG3 GLN A   9      -1.249  -3.632  -5.355  1.00  0.00           H  
ATOM    175 HE21 GLN A   9      -1.612  -3.866  -7.450  1.00  0.00           H  
ATOM    176 HE22 GLN A   9      -3.159  -3.972  -8.215  1.00  0.00           H  
ATOM    177  N   ASP A  10      -3.514  -6.137  -1.453  1.00  0.00           N  
ATOM    178  CA  ASP A  10      -3.731  -7.440  -0.758  1.00  0.00           C  
ATOM    179  C   ASP A  10      -5.072  -7.532   0.023  1.00  0.00           C  
ATOM    180  O   ASP A  10      -5.341  -8.608   0.599  1.00  0.00           O  
ATOM    181  CB  ASP A  10      -2.531  -7.767   0.167  1.00  0.00           C  
ATOM    182  CG  ASP A  10      -2.575  -9.193   0.683  1.00  0.00           C  
ATOM    183  OD1 ASP A  10      -2.539 -10.123  -0.150  1.00  0.00           O  
ATOM    184  OD2 ASP A  10      -2.646  -9.380   1.914  1.00  0.00           O  
ATOM    185  H   ASP A  10      -2.752  -5.583  -1.171  1.00  0.00           H  
ATOM    186  HA  ASP A  10      -3.755  -8.196  -1.531  1.00  0.00           H  
ATOM    187  HB2 ASP A  10      -1.612  -7.643  -0.385  1.00  0.00           H  
ATOM    188  HB3 ASP A  10      -2.522  -7.099   1.018  1.00  0.00           H  
ATOM    189  N   SER A  11      -5.913  -6.413   0.023  1.00  0.00           N  
ATOM    190  CA  SER A  11      -7.237  -6.374   0.726  1.00  0.00           C  
ATOM    191  C   SER A  11      -8.378  -7.012  -0.125  1.00  0.00           C  
ATOM    192  O   SER A  11      -8.690  -8.182   0.092  1.00  0.00           O  
ATOM    193  CB  SER A  11      -7.560  -4.946   1.219  1.00  0.00           C  
ATOM    194  OG  SER A  11      -6.543  -4.467   2.074  1.00  0.00           O  
ATOM    195  H   SER A  11      -5.626  -5.613  -0.466  1.00  0.00           H  
ATOM    196  HA  SER A  11      -7.126  -7.002   1.602  1.00  0.00           H  
ATOM    197  HB2 SER A  11      -7.652  -4.281   0.377  1.00  0.00           H  
ATOM    198  HB3 SER A  11      -8.488  -4.960   1.771  1.00  0.00           H  
ATOM    199  HG  SER A  11      -6.330  -5.134   2.729  1.00  0.00           H  
HETATM  200  N   NH2 A  12      -9.097  -6.258  -0.990  1.00  0.00           N  
HETATM  201  HN1 NH2 A  12      -8.899  -5.304  -1.071  1.00  0.00           H  
HETATM  202  HN2 NH2 A  12      -9.801  -6.704  -1.511  1.00  0.00           H  
TER     203      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        8                                                                  
HETATM    1  C   ACE A   0       5.216   5.532   3.420  1.00  0.00           C  
HETATM    2  O   ACE A   0       4.193   4.986   3.876  1.00  0.00           O  
HETATM    3  CH3 ACE A   0       6.518   5.428   4.188  1.00  0.00           C  
HETATM    4  H1  ACE A   0       6.314   5.456   5.248  1.00  0.00           H  
HETATM    5  H2  ACE A   0       7.160   6.256   3.923  1.00  0.00           H  
HETATM    6  H3  ACE A   0       7.009   4.498   3.940  1.00  0.00           H  
ATOM      7  N   HIS A   1       5.277   6.256   2.247  1.00  0.00           N  
ATOM      8  CA  HIS A   1       4.123   6.490   1.353  1.00  0.00           C  
ATOM      9  C   HIS A   1       3.804   5.235   0.518  1.00  0.00           C  
ATOM     10  O   HIS A   1       2.645   5.065   0.098  1.00  0.00           O  
ATOM     11  CB  HIS A   1       4.408   7.698   0.438  1.00  0.00           C  
ATOM     12  CG  HIS A   1       3.180   8.309  -0.177  1.00  0.00           C  
ATOM     13  ND1 HIS A   1       2.291   7.594  -0.952  1.00  0.00           N  
ATOM     14  CD2 HIS A   1       2.699   9.577  -0.130  1.00  0.00           C  
ATOM     15  CE1 HIS A   1       1.319   8.394  -1.355  1.00  0.00           C  
ATOM     16  NE2 HIS A   1       1.543   9.600  -0.870  1.00  0.00           N  
ATOM     17  H   HIS A   1       6.140   6.652   1.998  1.00  0.00           H  
ATOM     18  HA  HIS A   1       3.269   6.720   1.974  1.00  0.00           H  
ATOM     19  HB2 HIS A   1       4.903   8.465   1.014  1.00  0.00           H  
ATOM     20  HB3 HIS A   1       5.059   7.389  -0.366  1.00  0.00           H  
ATOM     21  HD1 HIS A   1       2.363   6.643  -1.174  1.00  0.00           H  
ATOM     22  HD2 HIS A   1       3.145  10.415   0.389  1.00  0.00           H  
ATOM     23  HE1 HIS A   1       0.482   8.108  -1.974  1.00  0.00           H  
ATOM     24  HE2 HIS A   1       1.039  10.406  -1.109  1.00  0.00           H  
ATOM     25  N   LYS A   2       4.864   4.376   0.283  1.00  0.00           N  
ATOM     26  CA  LYS A   2       4.763   3.120  -0.512  1.00  0.00           C  
ATOM     27  C   LYS A   2       3.972   2.000   0.195  1.00  0.00           C  
ATOM     28  O   LYS A   2       3.132   1.333  -0.441  1.00  0.00           O  
ATOM     29  CB  LYS A   2       6.155   2.588  -0.912  1.00  0.00           C  
ATOM     30  CG  LYS A   2       6.871   3.409  -1.986  1.00  0.00           C  
ATOM     31  CD  LYS A   2       8.152   2.720  -2.452  1.00  0.00           C  
ATOM     32  CE  LYS A   2       8.904   3.539  -3.502  1.00  0.00           C  
ATOM     33  NZ  LYS A   2       8.084   3.791  -4.722  1.00  0.00           N  
ATOM     34  H   LYS A   2       5.736   4.615   0.658  1.00  0.00           H  
ATOM     35  HA  LYS A   2       4.232   3.371  -1.416  1.00  0.00           H  
ATOM     36  HB2 LYS A   2       6.784   2.561  -0.038  1.00  0.00           H  
ATOM     37  HB3 LYS A   2       6.041   1.581  -1.284  1.00  0.00           H  
ATOM     38  HG2 LYS A   2       6.213   3.530  -2.834  1.00  0.00           H  
ATOM     39  HG3 LYS A   2       7.126   4.377  -1.586  1.00  0.00           H  
ATOM     40  HD2 LYS A   2       8.798   2.575  -1.600  1.00  0.00           H  
ATOM     41  HD3 LYS A   2       7.896   1.759  -2.876  1.00  0.00           H  
ATOM     42  HE2 LYS A   2       9.188   4.487  -3.069  1.00  0.00           H  
ATOM     43  HE3 LYS A   2       9.796   2.998  -3.787  1.00  0.00           H  
ATOM     44  HZ1 LYS A   2       7.853   4.803  -4.794  1.00  0.00           H  
ATOM     45  HZ2 LYS A   2       7.199   3.248  -4.678  1.00  0.00           H  
ATOM     46  HZ3 LYS A   2       8.611   3.505  -5.573  1.00  0.00           H  
HETATM   47  C   MK8 A   3       2.088   0.570   2.098  1.00  0.00           C  
HETATM   48  N   MK8 A   3       4.277   1.748   1.534  1.00  0.00           N  
HETATM   49  O   MK8 A   3       1.524  -0.507   1.779  1.00  0.00           O  
HETATM   50  CA  MK8 A   3       3.649   0.650   2.371  1.00  0.00           C  
HETATM   51  CB  MK8 A   3       3.881   0.977   3.911  1.00  0.00           C  
HETATM   52  CD  MK8 A   3       1.808   0.029   5.226  1.00  0.00           C  
HETATM   53  CE  MK8 A   3       1.205  -0.667   6.466  1.00  0.00           C  
HETATM   54  CG  MK8 A   3       3.332   0.009   5.038  1.00  0.00           C  
HETATM   55  CB1 MK8 A   3       4.445  -0.640   1.972  1.00  0.00           C  
HETATM   56  H   MK8 A   3       4.975   2.286   1.953  1.00  0.00           H  
HETATM   57  HB  MK8 A   3       3.454   1.953   4.098  1.00  0.00           H  
HETATM   58  HBA MK8 A   3       4.944   1.055   4.067  1.00  0.00           H  
HETATM   59  HD  MK8 A   3       1.376  -0.440   4.350  1.00  0.00           H  
HETATM   60  HDA MK8 A   3       1.489   1.055   5.243  1.00  0.00           H  
HETATM   61  HE  MK8 A   3       1.820  -0.684   7.355  1.00  0.00           H  
HETATM   62  HG  MK8 A   3       3.799   0.283   5.976  1.00  0.00           H  
HETATM   63  HGA MK8 A   3       3.623  -0.999   4.790  1.00  0.00           H  
HETATM   64  HB1 MK8 A   3       3.788  -1.497   2.024  1.00  0.00           H  
HETATM   65 HB1A MK8 A   3       5.272  -0.780   2.652  1.00  0.00           H  
HETATM   66 HB1B MK8 A   3       4.821  -0.534   0.965  1.00  0.00           H  
ATOM     67  N   LEU A   4       1.406   1.770   2.300  1.00  0.00           N  
ATOM     68  CA  LEU A   4      -0.069   1.922   2.161  1.00  0.00           C  
ATOM     69  C   LEU A   4      -0.568   1.451   0.797  1.00  0.00           C  
ATOM     70  O   LEU A   4      -1.653   0.840   0.735  1.00  0.00           O  
ATOM     71  CB  LEU A   4      -0.542   3.366   2.462  1.00  0.00           C  
ATOM     72  CG  LEU A   4      -2.065   3.543   2.725  1.00  0.00           C  
ATOM     73  CD1 LEU A   4      -2.469   3.129   4.149  1.00  0.00           C  
ATOM     74  CD2 LEU A   4      -2.487   4.979   2.460  1.00  0.00           C  
ATOM     75  H   LEU A   4       1.925   2.553   2.585  1.00  0.00           H  
ATOM     76  HA  LEU A   4      -0.508   1.273   2.898  1.00  0.00           H  
ATOM     77  HB2 LEU A   4      -0.010   3.718   3.334  1.00  0.00           H  
ATOM     78  HB3 LEU A   4      -0.272   3.991   1.624  1.00  0.00           H  
ATOM     79  HG  LEU A   4      -2.609   2.912   2.038  1.00  0.00           H  
ATOM     80 HD11 LEU A   4      -2.893   3.975   4.666  1.00  0.00           H  
ATOM     81 HD12 LEU A   4      -1.597   2.780   4.683  1.00  0.00           H  
ATOM     82 HD13 LEU A   4      -3.199   2.333   4.099  1.00  0.00           H  
ATOM     83 HD21 LEU A   4      -2.177   5.268   1.468  1.00  0.00           H  
ATOM     84 HD22 LEU A   4      -2.026   5.629   3.188  1.00  0.00           H  
ATOM     85 HD23 LEU A   4      -3.562   5.056   2.538  1.00  0.00           H  
ATOM     86  N   HIS A   5       0.250   1.730  -0.284  1.00  0.00           N  
ATOM     87  CA  HIS A   5      -0.058   1.336  -1.679  1.00  0.00           C  
ATOM     88  C   HIS A   5      -0.222  -0.189  -1.760  1.00  0.00           C  
ATOM     89  O   HIS A   5      -1.104  -0.685  -2.482  1.00  0.00           O  
ATOM     90  CB  HIS A   5       1.053   1.825  -2.617  1.00  0.00           C  
ATOM     91  CG  HIS A   5       0.604   2.061  -4.027  1.00  0.00           C  
ATOM     92  ND1 HIS A   5       0.129   1.063  -4.853  1.00  0.00           N  
ATOM     93  CD2 HIS A   5       0.559   3.203  -4.759  1.00  0.00           C  
ATOM     94  CE1 HIS A   5      -0.188   1.582  -6.028  1.00  0.00           C  
ATOM     95  NE2 HIS A   5       0.063   2.876  -5.994  1.00  0.00           N  
ATOM     96  H   HIS A   5       1.088   2.210  -0.118  1.00  0.00           H  
ATOM     97  HA  HIS A   5      -0.989   1.800  -1.958  1.00  0.00           H  
ATOM     98  HB2 HIS A   5       1.444   2.759  -2.239  1.00  0.00           H  
ATOM     99  HB3 HIS A   5       1.844   1.092  -2.638  1.00  0.00           H  
ATOM    100  HD1 HIS A   5       0.040   0.116  -4.615  1.00  0.00           H  
ATOM    101  HD2 HIS A   5       0.858   4.190  -4.432  1.00  0.00           H  
ATOM    102  HE1 HIS A   5      -0.586   1.042  -6.873  1.00  0.00           H  
ATOM    103  HE2 HIS A   5      -0.078   3.500  -6.735  1.00  0.00           H  
ATOM    104  N   GLN A   6       0.660  -0.899  -0.977  1.00  0.00           N  
ATOM    105  CA  GLN A   6       0.688  -2.381  -0.881  1.00  0.00           C  
ATOM    106  C   GLN A   6      -0.544  -2.968  -0.158  1.00  0.00           C  
ATOM    107  O   GLN A   6      -1.164  -3.903  -0.686  1.00  0.00           O  
ATOM    108  CB  GLN A   6       1.972  -2.868  -0.183  1.00  0.00           C  
ATOM    109  CG  GLN A   6       3.144  -3.135  -1.126  1.00  0.00           C  
ATOM    110  CD  GLN A   6       4.302  -3.829  -0.435  1.00  0.00           C  
ATOM    111  OE1 GLN A   6       4.820  -3.344   0.570  1.00  0.00           O  
ATOM    112  NE2 GLN A   6       4.727  -4.965  -0.979  1.00  0.00           N  
ATOM    113  H   GLN A   6       1.317  -0.382  -0.463  1.00  0.00           H  
ATOM    114  HA  GLN A   6       0.688  -2.761  -1.890  1.00  0.00           H  
ATOM    115  HB2 GLN A   6       2.286  -2.126   0.534  1.00  0.00           H  
ATOM    116  HB3 GLN A   6       1.750  -3.783   0.344  1.00  0.00           H  
ATOM    117  HG2 GLN A   6       2.801  -3.759  -1.933  1.00  0.00           H  
ATOM    118  HG3 GLN A   6       3.502  -2.202  -1.525  1.00  0.00           H  
ATOM    119 HE21 GLN A   6       4.276  -5.289  -1.786  1.00  0.00           H  
ATOM    120 HE22 GLN A   6       5.476  -5.430  -0.553  1.00  0.00           H  
HETATM  121  C   MK8 A   7      -3.356  -2.748   1.101  1.00  0.00           C  
HETATM  122  N   MK8 A   7      -0.879  -2.422   1.079  1.00  0.00           N  
HETATM  123  O   MK8 A   7      -4.358  -3.494   1.320  1.00  0.00           O  
HETATM  124  CA  MK8 A   7      -2.026  -2.878   1.938  1.00  0.00           C  
HETATM  125  CB  MK8 A   7      -2.172  -1.938   3.191  1.00  0.00           C  
HETATM  126  CD  MK8 A   7      -1.167  -1.434   5.487  1.00  0.00           C  
HETATM  127  CE  MK8 A   7      -0.031  -1.276   6.569  1.00  0.00           C  
HETATM  128  CG  MK8 A   7      -0.881  -1.532   3.972  1.00  0.00           C  
HETATM  129  CB1 MK8 A   7      -1.788  -4.349   2.441  1.00  0.00           C  
HETATM  130  H   MK8 A   7      -0.336  -1.700   1.416  1.00  0.00           H  
HETATM  131  HB  MK8 A   7      -2.839  -2.422   3.890  1.00  0.00           H  
HETATM  132  HBA MK8 A   7      -2.642  -1.024   2.864  1.00  0.00           H  
HETATM  133  HD  MK8 A   7      -1.724  -2.330   5.745  1.00  0.00           H  
HETATM  134  HDA MK8 A   7      -1.829  -0.600   5.630  1.00  0.00           H  
HETATM  135  HE  MK8 A   7      -0.252  -1.700   7.540  1.00  0.00           H  
HETATM  136  HG  MK8 A   7      -0.544  -0.566   3.621  1.00  0.00           H  
HETATM  137  HGA MK8 A   7      -0.116  -2.275   3.792  1.00  0.00           H  
HETATM  138  HB1 MK8 A   7      -1.259  -4.324   3.384  1.00  0.00           H  
HETATM  139 HB1A MK8 A   7      -1.201  -4.888   1.715  1.00  0.00           H  
HETATM  140 HB1B MK8 A   7      -2.740  -4.841   2.574  1.00  0.00           H  
ATOM    141  N   LEU A   8      -3.351  -1.724   0.164  1.00  0.00           N  
ATOM    142  CA  LEU A   8      -4.507  -1.387  -0.715  1.00  0.00           C  
ATOM    143  C   LEU A   8      -4.860  -2.523  -1.694  1.00  0.00           C  
ATOM    144  O   LEU A   8      -6.053  -2.688  -2.016  1.00  0.00           O  
ATOM    145  CB  LEU A   8      -4.253  -0.066  -1.485  1.00  0.00           C  
ATOM    146  CG  LEU A   8      -5.481   0.587  -2.178  1.00  0.00           C  
ATOM    147  CD1 LEU A   8      -6.359   1.363  -1.192  1.00  0.00           C  
ATOM    148  CD2 LEU A   8      -5.024   1.503  -3.303  1.00  0.00           C  
ATOM    149  H   LEU A   8      -2.544  -1.168   0.097  1.00  0.00           H  
ATOM    150  HA  LEU A   8      -5.357  -1.235  -0.065  1.00  0.00           H  
ATOM    151  HB2 LEU A   8      -3.845   0.652  -0.789  1.00  0.00           H  
ATOM    152  HB3 LEU A   8      -3.511  -0.262  -2.243  1.00  0.00           H  
ATOM    153  HG  LEU A   8      -6.090  -0.191  -2.614  1.00  0.00           H  
ATOM    154 HD11 LEU A   8      -6.863   2.164  -1.712  1.00  0.00           H  
ATOM    155 HD12 LEU A   8      -5.742   1.775  -0.407  1.00  0.00           H  
ATOM    156 HD13 LEU A   8      -7.092   0.696  -0.761  1.00  0.00           H  
ATOM    157 HD21 LEU A   8      -4.813   2.484  -2.904  1.00  0.00           H  
ATOM    158 HD22 LEU A   8      -5.805   1.577  -4.045  1.00  0.00           H  
ATOM    159 HD23 LEU A   8      -4.133   1.098  -3.757  1.00  0.00           H  
ATOM    160  N   GLN A   9      -3.798  -3.269  -2.178  1.00  0.00           N  
ATOM    161  CA  GLN A   9      -3.943  -4.378  -3.164  1.00  0.00           C  
ATOM    162  C   GLN A   9      -4.378  -5.716  -2.543  1.00  0.00           C  
ATOM    163  O   GLN A   9      -5.291  -6.360  -3.097  1.00  0.00           O  
ATOM    164  CB  GLN A   9      -2.649  -4.587  -3.963  1.00  0.00           C  
ATOM    165  CG  GLN A   9      -2.499  -3.627  -5.134  1.00  0.00           C  
ATOM    166  CD  GLN A   9      -1.584  -4.161  -6.225  1.00  0.00           C  
ATOM    167  OE1 GLN A   9      -1.830  -5.228  -6.787  1.00  0.00           O  
ATOM    168  NE2 GLN A   9      -0.527  -3.418  -6.539  1.00  0.00           N  
ATOM    169  H   GLN A   9      -2.896  -3.032  -1.877  1.00  0.00           H  
ATOM    170  HA  GLN A   9      -4.709  -4.071  -3.863  1.00  0.00           H  
ATOM    171  HB2 GLN A   9      -1.804  -4.451  -3.305  1.00  0.00           H  
ATOM    172  HB3 GLN A   9      -2.635  -5.596  -4.348  1.00  0.00           H  
ATOM    173  HG2 GLN A   9      -3.475  -3.449  -5.562  1.00  0.00           H  
ATOM    174  HG3 GLN A   9      -2.093  -2.696  -4.769  1.00  0.00           H  
ATOM    175 HE21 GLN A   9      -0.392  -2.578  -6.055  1.00  0.00           H  
ATOM    176 HE22 GLN A   9       0.072  -3.738  -7.248  1.00  0.00           H  
ATOM    177  N   ASP A  10      -3.680  -6.137  -1.424  1.00  0.00           N  
ATOM    178  CA  ASP A  10      -3.930  -7.430  -0.724  1.00  0.00           C  
ATOM    179  C   ASP A  10      -5.305  -7.496  -0.017  1.00  0.00           C  
ATOM    180  O   ASP A  10      -5.636  -8.572   0.524  1.00  0.00           O  
ATOM    181  CB  ASP A  10      -2.792  -7.731   0.278  1.00  0.00           C  
ATOM    182  CG  ASP A  10      -2.877  -9.134   0.862  1.00  0.00           C  
ATOM    183  OD1 ASP A  10      -2.831 -10.105   0.079  1.00  0.00           O  
ATOM    184  OD2 ASP A  10      -2.993  -9.256   2.098  1.00  0.00           O  
ATOM    185  H   ASP A  10      -2.953  -5.568  -1.095  1.00  0.00           H  
ATOM    186  HA  ASP A  10      -3.914  -8.200  -1.484  1.00  0.00           H  
ATOM    187  HB2 ASP A  10      -1.840  -7.637  -0.224  1.00  0.00           H  
ATOM    188  HB3 ASP A  10      -2.833  -7.024   1.091  1.00  0.00           H  
ATOM    189  N   SER A  11      -6.091  -6.349  -0.035  1.00  0.00           N  
ATOM    190  CA  SER A  11      -7.440  -6.260   0.599  1.00  0.00           C  
ATOM    191  C   SER A  11      -8.551  -6.853  -0.344  1.00  0.00           C  
ATOM    192  O   SER A  11      -8.604  -8.073  -0.489  1.00  0.00           O  
ATOM    193  CB  SER A  11      -7.704  -4.812   1.099  1.00  0.00           C  
ATOM    194  OG  SER A  11      -7.327  -3.860   0.121  1.00  0.00           O  
ATOM    195  H   SER A  11      -5.738  -5.555  -0.489  1.00  0.00           H  
ATOM    196  HA  SER A  11      -7.401  -6.905   1.471  1.00  0.00           H  
ATOM    197  HB2 SER A  11      -8.757  -4.697   1.302  1.00  0.00           H  
ATOM    198  HB3 SER A  11      -7.145  -4.632   2.007  1.00  0.00           H  
ATOM    199  HG  SER A  11      -8.110  -3.544  -0.337  1.00  0.00           H  
HETATM  200  N   NH2 A  12      -9.442  -6.052  -0.979  1.00  0.00           N  
HETATM  201  HN1 NH2 A  12      -9.389  -5.084  -0.842  1.00  0.00           H  
HETATM  202  HN2 NH2 A  12     -10.112  -6.478  -1.553  1.00  0.00           H  
TER     203      NH2 A  12                                                      
ENDMDL                                                                          
MODEL        9                                                                  
HETATM    1  C   ACE A   0       5.080   5.366   3.451  1.00  0.00           C  
HETATM    2  O   ACE A   0       4.040   4.833   3.883  1.00  0.00           O  
HETATM    3  CH3 ACE A   0       6.368   5.231   4.238  1.00  0.00           C  
HETATM    4  H1  ACE A   0       6.540   6.136   4.802  1.00  0.00           H  
HETATM    5  H2  ACE A   0       7.191   5.069   3.557  1.00  0.00           H  
HETATM    6  H3  ACE A   0       6.291   4.394   4.915  1.00  0.00           H  
ATOM      7  N   HIS A   1       5.175   6.101   2.288  1.00  0.00           N  
ATOM      8  CA  HIS A   1       4.044   6.365   1.377  1.00  0.00           C  
ATOM      9  C   HIS A   1       3.723   5.129   0.521  1.00  0.00           C  
ATOM     10  O   HIS A   1       2.555   4.941   0.136  1.00  0.00           O  
ATOM     11  CB  HIS A   1       4.361   7.575   0.479  1.00  0.00           C  
ATOM     12  CG  HIS A   1       3.150   8.221  -0.135  1.00  0.00           C  
ATOM     13  ND1 HIS A   1       2.259   7.537  -0.936  1.00  0.00           N  
ATOM     14  CD2 HIS A   1       2.686   9.492  -0.062  1.00  0.00           C  
ATOM     15  CE1 HIS A   1       1.302   8.359  -1.328  1.00  0.00           C  
ATOM     16  NE2 HIS A   1       1.537   9.551  -0.811  1.00  0.00           N  
ATOM     17  H   HIS A   1       6.049   6.480   2.058  1.00  0.00           H  
ATOM     18  HA  HIS A   1       3.184   6.600   1.985  1.00  0.00           H  
ATOM     19  HB2 HIS A   1       4.873   8.324   1.065  1.00  0.00           H  
ATOM     20  HB3 HIS A   1       5.007   7.259  -0.326  1.00  0.00           H  
ATOM     21  HD1 HIS A   1       2.321   6.591  -1.182  1.00  0.00           H  
ATOM     22  HD2 HIS A   1       3.137  10.310   0.483  1.00  0.00           H  
ATOM     23  HE1 HIS A   1       0.466   8.099  -1.962  1.00  0.00           H  
ATOM     24  HE2 HIS A   1       0.906  10.301  -0.822  1.00  0.00           H  
ATOM     25  N   LYS A   2       4.797   4.309   0.231  1.00  0.00           N  
ATOM     26  CA  LYS A   2       4.703   3.073  -0.593  1.00  0.00           C  
ATOM     27  C   LYS A   2       3.955   1.939   0.122  1.00  0.00           C  
ATOM     28  O   LYS A   2       3.192   1.194  -0.523  1.00  0.00           O  
ATOM     29  CB  LYS A   2       6.094   2.571  -1.026  1.00  0.00           C  
ATOM     30  CG  LYS A   2       6.819   3.480  -2.014  1.00  0.00           C  
ATOM     31  CD  LYS A   2       8.205   2.941  -2.347  1.00  0.00           C  
ATOM     32  CE  LYS A   2       8.970   3.865  -3.290  1.00  0.00           C  
ATOM     33  NZ  LYS A   2       8.278   4.038  -4.599  1.00  0.00           N  
ATOM     34  H   LYS A   2       5.674   4.565   0.584  1.00  0.00           H  
ATOM     35  HA  LYS A   2       4.146   3.332  -1.481  1.00  0.00           H  
ATOM     36  HB2 LYS A   2       6.718   2.456  -0.155  1.00  0.00           H  
ATOM     37  HB3 LYS A   2       5.976   1.605  -1.493  1.00  0.00           H  
ATOM     38  HG2 LYS A   2       6.240   3.538  -2.924  1.00  0.00           H  
ATOM     39  HG3 LYS A   2       6.920   4.464  -1.586  1.00  0.00           H  
ATOM     40  HD2 LYS A   2       8.768   2.839  -1.431  1.00  0.00           H  
ATOM     41  HD3 LYS A   2       8.100   1.973  -2.814  1.00  0.00           H  
ATOM     42  HE2 LYS A   2       9.079   4.832  -2.821  1.00  0.00           H  
ATOM     43  HE3 LYS A   2       9.950   3.443  -3.466  1.00  0.00           H  
ATOM     44  HZ1 LYS A   2       7.247   4.044  -4.461  1.00  0.00           H  
ATOM     45  HZ2 LYS A   2       8.526   3.258  -5.240  1.00  0.00           H  
ATOM     46  HZ3 LYS A   2       8.564   4.936  -5.038  1.00  0.00           H  
HETATM   47  C   MK8 A   3       2.001   0.652   2.065  1.00  0.00           C  
HETATM   48  N   MK8 A   3       4.193   1.783   1.492  1.00  0.00           N  
HETATM   49  O   MK8 A   3       1.455  -0.339   1.531  1.00  0.00           O  
HETATM   50  CA  MK8 A   3       3.572   0.706   2.353  1.00  0.00           C  
HETATM   51  CB  MK8 A   3       3.857   1.057   3.881  1.00  0.00           C  
HETATM   52  CD  MK8 A   3       1.689   0.496   5.230  1.00  0.00           C  
HETATM   53  CE  MK8 A   3       0.896  -0.321   6.296  1.00  0.00           C  
HETATM   54  CG  MK8 A   3       3.180   0.204   5.022  1.00  0.00           C  
HETATM   55  CB1 MK8 A   3       4.334  -0.621   2.007  1.00  0.00           C  
HETATM   56  H   MK8 A   3       4.818   2.400   1.924  1.00  0.00           H  
HETATM   57  HB  MK8 A   3       3.569   2.088   4.034  1.00  0.00           H  
HETATM   58  HBA MK8 A   3       4.922   0.990   4.035  1.00  0.00           H  
HETATM   59  HD  MK8 A   3       1.205   0.338   4.275  1.00  0.00           H  
HETATM   60  HDA MK8 A   3       1.587   1.539   5.479  1.00  0.00           H  
HETATM   61  HE  MK8 A   3       1.046  -0.038   7.327  1.00  0.00           H  
HETATM   62  HG  MK8 A   3       3.704   0.401   5.946  1.00  0.00           H  
HETATM   63  HGA MK8 A   3       3.286  -0.840   4.778  1.00  0.00           H  
HETATM   64  HB1 MK8 A   3       4.969  -0.899   2.837  1.00  0.00           H  
HETATM   65 HB1A MK8 A   3       4.942  -0.469   1.127  1.00  0.00           H  
HETATM   66 HB1B MK8 A   3       3.620  -1.410   1.817  1.00  0.00           H  
ATOM     67  N   LEU A   4       1.294   1.771   2.506  1.00  0.00           N  
ATOM     68  CA  LEU A   4      -0.177   1.939   2.409  1.00  0.00           C  
ATOM     69  C   LEU A   4      -0.721   1.647   1.009  1.00  0.00           C  
ATOM     70  O   LEU A   4      -1.946   1.443   0.879  1.00  0.00           O  
ATOM     71  CB  LEU A   4      -0.610   3.346   2.883  1.00  0.00           C  
ATOM     72  CG  LEU A   4      -2.121   3.555   3.194  1.00  0.00           C  
ATOM     73  CD1 LEU A   4      -2.524   2.973   4.556  1.00  0.00           C  
ATOM     74  CD2 LEU A   4      -2.465   5.035   3.146  1.00  0.00           C  
ATOM     75  H   LEU A   4       1.804   2.480   2.952  1.00  0.00           H  
ATOM     76  HA  LEU A   4      -0.609   1.215   3.085  1.00  0.00           H  
ATOM     77  HB2 LEU A   4      -0.055   3.578   3.779  1.00  0.00           H  
ATOM     78  HB3 LEU A   4      -0.329   4.054   2.117  1.00  0.00           H  
ATOM     79  HG  LEU A   4      -2.710   3.057   2.439  1.00  0.00           H  
ATOM     80 HD11 LEU A   4      -1.879   3.371   5.324  1.00  0.00           H  
ATOM     81 HD12 LEU A   4      -2.430   1.897   4.529  1.00  0.00           H  
ATOM     82 HD13 LEU A   4      -3.549   3.238   4.771  1.00  0.00           H  
ATOM     83 HD21 LEU A   4      -2.056   5.527   4.017  1.00  0.00           H  
ATOM     84 HD22 LEU A   4      -3.538   5.156   3.136  1.00  0.00           H  
ATOM     85 HD23 LEU A   4      -2.044   5.474   2.254  1.00  0.00           H  
ATOM     86  N   HIS A   5       0.206   1.616  -0.018  1.00  0.00           N  
ATOM     87  CA  HIS A   5      -0.141   1.331  -1.431  1.00  0.00           C  
ATOM     88  C   HIS A   5      -0.323  -0.183  -1.611  1.00  0.00           C  
ATOM     89  O   HIS A   5      -1.315  -0.614  -2.225  1.00  0.00           O  
ATOM     90  CB  HIS A   5       0.928   1.908  -2.381  1.00  0.00           C  
ATOM     91  CG  HIS A   5       0.502   1.999  -3.823  1.00  0.00           C  
ATOM     92  ND1 HIS A   5       0.119   0.902  -4.567  1.00  0.00           N  
ATOM     93  CD2 HIS A   5       0.405   3.067  -4.657  1.00  0.00           C  
ATOM     94  CE1 HIS A   5      -0.193   1.290  -5.793  1.00  0.00           C  
ATOM     95  NE2 HIS A   5      -0.029   2.596  -5.871  1.00  0.00           N  
ATOM     96  H   HIS A   5       1.146   1.779   0.202  1.00  0.00           H  
ATOM     97  HA  HIS A   5      -1.089   1.810  -1.632  1.00  0.00           H  
ATOM     98  HB2 HIS A   5       1.179   2.909  -2.056  1.00  0.00           H  
ATOM     99  HB3 HIS A   5       1.812   1.292  -2.335  1.00  0.00           H  
ATOM    100  HD1 HIS A   5       0.082  -0.023  -4.245  1.00  0.00           H  
ATOM    101  HD2 HIS A   5       0.633   4.096  -4.415  1.00  0.00           H  
ATOM    102  HE1 HIS A   5      -0.520   0.646  -6.595  1.00  0.00           H  
ATOM    103  HE2 HIS A   5      -0.266   3.149  -6.645  1.00  0.00           H  
ATOM    104  N   GLN A   6       0.655  -0.964  -1.033  1.00  0.00           N  
ATOM    105  CA  GLN A   6       0.663  -2.451  -1.061  1.00  0.00           C  
ATOM    106  C   GLN A   6      -0.545  -3.037  -0.311  1.00  0.00           C  
ATOM    107  O   GLN A   6      -1.118  -4.045  -0.745  1.00  0.00           O  
ATOM    108  CB  GLN A   6       1.953  -3.012  -0.424  1.00  0.00           C  
ATOM    109  CG  GLN A   6       3.141  -3.150  -1.372  1.00  0.00           C  
ATOM    110  CD  GLN A   6       4.345  -3.791  -0.704  1.00  0.00           C  
ATOM    111  OE1 GLN A   6       4.860  -3.279   0.289  1.00  0.00           O  
ATOM    112  NE2 GLN A   6       4.810  -4.909  -1.252  1.00  0.00           N  
ATOM    113  H   GLN A   6       1.386  -0.502  -0.571  1.00  0.00           H  
ATOM    114  HA  GLN A   6       0.613  -2.763  -2.094  1.00  0.00           H  
ATOM    115  HB2 GLN A   6       2.252  -2.364   0.384  1.00  0.00           H  
ATOM    116  HB3 GLN A   6       1.734  -3.987  -0.016  1.00  0.00           H  
ATOM    117  HG2 GLN A   6       2.849  -3.757  -2.211  1.00  0.00           H  
ATOM    118  HG3 GLN A   6       3.433  -2.175  -1.720  1.00  0.00           H  
ATOM    119 HE21 GLN A   6       4.359  -5.259  -2.048  1.00  0.00           H  
ATOM    120 HE22 GLN A   6       5.588  -5.336  -0.838  1.00  0.00           H  
HETATM  121  C   MK8 A   7      -3.360  -2.772   0.929  1.00  0.00           C  
HETATM  122  N   MK8 A   7      -0.903  -2.380   0.848  1.00  0.00           N  
HETATM  123  O   MK8 A   7      -4.331  -3.528   1.213  1.00  0.00           O  
HETATM  124  CA  MK8 A   7      -2.026  -2.774   1.759  1.00  0.00           C  
HETATM  125  CB  MK8 A   7      -2.197  -1.696   2.889  1.00  0.00           C  
HETATM  126  CD  MK8 A   7      -0.416  -2.013   4.707  1.00  0.00           C  
HETATM  127  CE  MK8 A   7       0.013  -1.371   6.072  1.00  0.00           C  
HETATM  128  CG  MK8 A   7      -0.923  -1.121   3.577  1.00  0.00           C  
HETATM  129  CB1 MK8 A   7      -1.739  -4.150   2.438  1.00  0.00           C  
HETATM  130  H   MK8 A   7      -0.389  -1.600   1.093  1.00  0.00           H  
HETATM  131  HB  MK8 A   7      -2.816  -2.129   3.660  1.00  0.00           H  
HETATM  132  HBA MK8 A   7      -2.726  -0.858   2.468  1.00  0.00           H  
HETATM  133  HD  MK8 A   7       0.430  -2.571   4.324  1.00  0.00           H  
HETATM  134  HDA MK8 A   7      -1.199  -2.713   4.931  1.00  0.00           H  
HETATM  135  HE  MK8 A   7      -0.434  -1.803   6.954  1.00  0.00           H  
HETATM  136  HG  MK8 A   7      -1.146  -0.140   3.975  1.00  0.00           H  
HETATM  137  HGA MK8 A   7      -0.148  -1.033   2.841  1.00  0.00           H  
HETATM  138  HB1 MK8 A   7      -1.221  -3.983   3.371  1.00  0.00           H  
HETATM  139 HB1A MK8 A   7      -1.125  -4.754   1.789  1.00  0.00           H  
HETATM  140 HB1B MK8 A   7      -2.672  -4.659   2.629  1.00  0.00           H  
ATOM    141  N   LEU A   8      -3.392  -1.824  -0.074  1.00  0.00           N  
ATOM    142  CA  LEU A   8      -4.554  -1.571  -0.965  1.00  0.00           C  
ATOM    143  C   LEU A   8      -4.913  -2.756  -1.874  1.00  0.00           C  
ATOM    144  O   LEU A   8      -6.117  -2.992  -2.100  1.00  0.00           O  
ATOM    145  CB  LEU A   8      -4.301  -0.297  -1.846  1.00  0.00           C  
ATOM    146  CG  LEU A   8      -5.511   0.601  -2.340  1.00  0.00           C  
ATOM    147  CD1 LEU A   8      -6.559  -0.132  -3.205  1.00  0.00           C  
ATOM    148  CD2 LEU A   8      -6.195   1.335  -1.180  1.00  0.00           C  
ATOM    149  H   LEU A   8      -2.605  -1.249  -0.179  1.00  0.00           H  
ATOM    150  HA  LEU A   8      -5.400  -1.373  -0.327  1.00  0.00           H  
ATOM    151  HB2 LEU A   8      -3.647   0.350  -1.285  1.00  0.00           H  
ATOM    152  HB3 LEU A   8      -3.760  -0.620  -2.725  1.00  0.00           H  
ATOM    153  HG  LEU A   8      -5.092   1.367  -2.977  1.00  0.00           H  
ATOM    154 HD11 LEU A   8      -7.425   0.502  -3.334  1.00  0.00           H  
ATOM    155 HD12 LEU A   8      -6.854  -1.047  -2.715  1.00  0.00           H  
ATOM    156 HD13 LEU A   8      -6.133  -0.361  -4.171  1.00  0.00           H  
ATOM    157 HD21 LEU A   8      -5.477   1.510  -0.391  1.00  0.00           H  
ATOM    158 HD22 LEU A   8      -7.007   0.733  -0.801  1.00  0.00           H  
ATOM    159 HD23 LEU A   8      -6.581   2.281  -1.531  1.00  0.00           H  
ATOM    160  N   GLN A   9      -3.851  -3.457  -2.423  1.00  0.00           N  
ATOM    161  CA  GLN A   9      -4.010  -4.595  -3.370  1.00  0.00           C  
ATOM    162  C   GLN A   9      -4.318  -5.931  -2.690  1.00  0.00           C  
ATOM    163  O   GLN A   9      -5.144  -6.695  -3.232  1.00  0.00           O  
ATOM    164  CB  GLN A   9      -2.770  -4.736  -4.274  1.00  0.00           C  
ATOM    165  CG  GLN A   9      -2.651  -3.662  -5.360  1.00  0.00           C  
ATOM    166  CD  GLN A   9      -3.710  -3.770  -6.453  1.00  0.00           C  
ATOM    167  OE1 GLN A   9      -4.908  -3.762  -6.173  1.00  0.00           O  
ATOM    168  NE2 GLN A   9      -3.267  -3.864  -7.704  1.00  0.00           N  
ATOM    169  H   GLN A   9      -2.943  -3.162  -2.201  1.00  0.00           H  
ATOM    170  HA  GLN A   9      -4.850  -4.354  -4.002  1.00  0.00           H  
ATOM    171  HB2 GLN A   9      -1.883  -4.683  -3.661  1.00  0.00           H  
ATOM    172  HB3 GLN A   9      -2.800  -5.702  -4.758  1.00  0.00           H  
ATOM    173  HG2 GLN A   9      -2.740  -2.694  -4.895  1.00  0.00           H  
ATOM    174  HG3 GLN A   9      -1.676  -3.748  -5.819  1.00  0.00           H  
ATOM    175 HE21 GLN A   9      -2.298  -3.860  -7.854  1.00  0.00           H  
ATOM    176 HE22 GLN A   9      -3.927  -3.929  -8.427  1.00  0.00           H  
ATOM    177  N   ASP A  10      -3.641  -6.199  -1.514  1.00  0.00           N  
ATOM    178  CA  ASP A  10      -3.811  -7.449  -0.730  1.00  0.00           C  
ATOM    179  C   ASP A  10      -5.208  -7.515  -0.097  1.00  0.00           C  
ATOM    180  O   ASP A  10      -5.801  -8.609  -0.037  1.00  0.00           O  
ATOM    181  CB  ASP A  10      -2.707  -7.573   0.339  1.00  0.00           C  
ATOM    182  CG  ASP A  10      -2.748  -8.896   1.089  1.00  0.00           C  
ATOM    183  OD1 ASP A  10      -3.786  -9.190   1.716  1.00  0.00           O  
ATOM    184  OD2 ASP A  10      -1.743  -9.634   1.045  1.00  0.00           O  
ATOM    185  H   ASP A  10      -3.011  -5.525  -1.180  1.00  0.00           H  
ATOM    186  HA  ASP A  10      -3.717  -8.275  -1.422  1.00  0.00           H  
ATOM    187  HB2 ASP A  10      -1.741  -7.495  -0.139  1.00  0.00           H  
ATOM    188  HB3 ASP A  10      -2.811  -6.772   1.053  1.00  0.00           H  
ATOM    189  N   SER A  11      -5.697  -6.319   0.380  1.00  0.00           N  
ATOM    190  CA  SER A  11      -7.014  -6.157   1.039  1.00  0.00           C  
ATOM    191  C   SER A  11      -8.153  -6.008   0.012  1.00  0.00           C  
ATOM    192  O   SER A  11      -9.308  -5.794   0.387  1.00  0.00           O  
ATOM    193  CB  SER A  11      -6.963  -4.947   1.991  1.00  0.00           C  
ATOM    194  OG  SER A  11      -5.801  -4.995   2.800  1.00  0.00           O  
ATOM    195  H   SER A  11      -5.131  -5.525   0.285  1.00  0.00           H  
ATOM    196  HA  SER A  11      -7.199  -7.049   1.624  1.00  0.00           H  
ATOM    197  HB2 SER A  11      -6.949  -4.032   1.420  1.00  0.00           H  
ATOM    198  HB3 SER A  11      -7.829  -4.955   2.640  1.00  0.00           H  
ATOM    199  HG  SER A  11      -6.012  -5.408   3.639  1.00  0.00           H  
HETATM  200  N   NH2 A  12      -7.877  -6.340  -1.252  1.00  0.00           N  
HETATM  201  HN1 NH2 A  12      -6.976  -6.653  -1.466  1.00  0.00           H  
HETATM  202  HN2 NH2 A  12      -8.596  -6.267  -1.920  1.00  0.00           H  
TER     203      NH2 A  12                                                      
ENDMDL                                                                          
MODEL       10                                                                  
HETATM    1  C   ACE A   0       5.118   5.261   3.493  1.00  0.00           C  
HETATM    2  O   ACE A   0       4.043   4.771   3.888  1.00  0.00           O  
HETATM    3  CH3 ACE A   0       6.366   5.096   4.337  1.00  0.00           C  
HETATM    4  H1  ACE A   0       6.593   6.029   4.832  1.00  0.00           H  
HETATM    5  H2  ACE A   0       7.195   4.815   3.704  1.00  0.00           H  
HETATM    6  H3  ACE A   0       6.202   4.327   5.078  1.00  0.00           H  
ATOM      7  N   HIS A   1       5.284   5.975   2.324  1.00  0.00           N  
ATOM      8  CA  HIS A   1       4.198   6.263   1.362  1.00  0.00           C  
ATOM      9  C   HIS A   1       3.863   5.026   0.510  1.00  0.00           C  
ATOM     10  O   HIS A   1       2.710   4.894   0.061  1.00  0.00           O  
ATOM     11  CB  HIS A   1       4.601   7.450   0.463  1.00  0.00           C  
ATOM     12  CG  HIS A   1       3.451   8.124  -0.231  1.00  0.00           C  
ATOM     13  ND1 HIS A   1       2.594   7.461  -1.084  1.00  0.00           N  
ATOM     14  CD2 HIS A   1       3.028   9.411  -0.202  1.00  0.00           C  
ATOM     15  CE1 HIS A   1       1.695   8.311  -1.551  1.00  0.00           C  
ATOM     16  NE2 HIS A   1       1.936   9.500  -1.030  1.00  0.00           N  
ATOM     17  H   HIS A   1       6.179   6.325   2.126  1.00  0.00           H  
ATOM     18  HA  HIS A   1       3.322   6.539   1.930  1.00  0.00           H  
ATOM     19  HB2 HIS A   1       5.100   8.193   1.066  1.00  0.00           H  
ATOM     20  HB3 HIS A   1       5.285   7.103  -0.298  1.00  0.00           H  
ATOM     21  HD1 HIS A   1       2.638   6.510  -1.315  1.00  0.00           H  
ATOM     22  HD2 HIS A   1       3.469  10.220   0.364  1.00  0.00           H  
ATOM     23  HE1 HIS A   1       0.899   8.073  -2.241  1.00  0.00           H  
ATOM     24  HE2 HIS A   1       1.491  10.332  -1.295  1.00  0.00           H  
ATOM     25  N   LYS A   2       4.902   4.136   0.300  1.00  0.00           N  
ATOM     26  CA  LYS A   2       4.781   2.886  -0.502  1.00  0.00           C  
ATOM     27  C   LYS A   2       3.938   1.809   0.192  1.00  0.00           C  
ATOM     28  O   LYS A   2       3.110   1.144  -0.462  1.00  0.00           O  
ATOM     29  CB  LYS A   2       6.158   2.298  -0.855  1.00  0.00           C  
ATOM     30  CG  LYS A   2       6.910   3.052  -1.948  1.00  0.00           C  
ATOM     31  CD  LYS A   2       8.224   2.360  -2.288  1.00  0.00           C  
ATOM     32  CE  LYS A   2       9.031   3.136  -3.326  1.00  0.00           C  
ATOM     33  NZ  LYS A   2      10.289   2.427  -3.693  1.00  0.00           N  
ATOM     34  H   LYS A   2       5.769   4.344   0.704  1.00  0.00           H  
ATOM     35  HA  LYS A   2       4.284   3.154  -1.420  1.00  0.00           H  
ATOM     36  HB2 LYS A   2       6.773   2.285   0.029  1.00  0.00           H  
ATOM     37  HB3 LYS A   2       6.018   1.282  -1.189  1.00  0.00           H  
ATOM     38  HG2 LYS A   2       6.292   3.088  -2.834  1.00  0.00           H  
ATOM     39  HG3 LYS A   2       7.120   4.055  -1.613  1.00  0.00           H  
ATOM     40  HD2 LYS A   2       8.813   2.270  -1.388  1.00  0.00           H  
ATOM     41  HD3 LYS A   2       8.008   1.376  -2.677  1.00  0.00           H  
ATOM     42  HE2 LYS A   2       8.431   3.262  -4.215  1.00  0.00           H  
ATOM     43  HE3 LYS A   2       9.283   4.106  -2.921  1.00  0.00           H  
ATOM     44  HZ1 LYS A   2      10.359   2.335  -4.727  1.00  0.00           H  
ATOM     45  HZ2 LYS A   2      10.302   1.478  -3.270  1.00  0.00           H  
ATOM     46  HZ3 LYS A   2      11.113   2.960  -3.346  1.00  0.00           H  
HETATM   47  C   MK8 A   3       1.920   0.600   2.113  1.00  0.00           C  
HETATM   48  N   MK8 A   3       4.176   1.606   1.550  1.00  0.00           N  
HETATM   49  O   MK8 A   3       1.285  -0.421   1.769  1.00  0.00           O  
HETATM   50  CA  MK8 A   3       3.484   0.571   2.401  1.00  0.00           C  
HETATM   51  CB  MK8 A   3       3.774   0.919   3.923  1.00  0.00           C  
HETATM   52  CD  MK8 A   3       1.606   0.586   5.288  1.00  0.00           C  
HETATM   53  CE  MK8 A   3       0.721  -0.143   6.341  1.00  0.00           C  
HETATM   54  CG  MK8 A   3       3.044   0.121   5.066  1.00  0.00           C  
HETATM   55  CB1 MK8 A   3       4.177  -0.788   2.065  1.00  0.00           C  
HETATM   56  H   MK8 A   3       4.859   2.155   1.982  1.00  0.00           H  
HETATM   57  HB  MK8 A   3       3.544   1.967   4.064  1.00  0.00           H  
HETATM   58  HBA MK8 A   3       4.831   0.793   4.087  1.00  0.00           H  
HETATM   59  HD  MK8 A   3       1.105   0.507   4.333  1.00  0.00           H  
HETATM   60  HDA MK8 A   3       1.637   1.626   5.556  1.00  0.00           H  
HETATM   61  HE  MK8 A   3       0.852   0.159   7.369  1.00  0.00           H  
HETATM   62  HG  MK8 A   3       3.600   0.245   5.985  1.00  0.00           H  
HETATM   63  HGA MK8 A   3       3.026  -0.925   4.801  1.00  0.00           H  
HETATM   64  HB1 MK8 A   3       4.662  -0.716   1.102  1.00  0.00           H  
HETATM   65 HB1A MK8 A   3       3.437  -1.573   2.036  1.00  0.00           H  
HETATM   66 HB1B MK8 A   3       4.912  -1.014   2.824  1.00  0.00           H  
ATOM     67  N   LEU A   4       1.336   1.837   2.332  1.00  0.00           N  
ATOM     68  CA  LEU A   4      -0.115   2.125   2.187  1.00  0.00           C  
ATOM     69  C   LEU A   4      -0.671   1.650   0.839  1.00  0.00           C  
ATOM     70  O   LEU A   4      -1.844   1.232   0.783  1.00  0.00           O  
ATOM     71  CB  LEU A   4      -0.398   3.660   2.374  1.00  0.00           C  
ATOM     72  CG  LEU A   4      -1.816   4.171   2.865  1.00  0.00           C  
ATOM     73  CD1 LEU A   4      -2.999   3.779   1.963  1.00  0.00           C  
ATOM     74  CD2 LEU A   4      -2.111   3.772   4.312  1.00  0.00           C  
ATOM     75  H   LEU A   4       1.918   2.567   2.635  1.00  0.00           H  
ATOM     76  HA  LEU A   4      -0.626   1.586   2.969  1.00  0.00           H  
ATOM     77  HB2 LEU A   4       0.324   4.029   3.086  1.00  0.00           H  
ATOM     78  HB3 LEU A   4      -0.193   4.139   1.427  1.00  0.00           H  
ATOM     79  HG  LEU A   4      -1.781   5.251   2.851  1.00  0.00           H  
ATOM     80 HD11 LEU A   4      -2.864   4.210   0.985  1.00  0.00           H  
ATOM     81 HD12 LEU A   4      -3.917   4.147   2.398  1.00  0.00           H  
ATOM     82 HD13 LEU A   4      -3.046   2.702   1.883  1.00  0.00           H  
ATOM     83 HD21 LEU A   4      -3.167   3.898   4.509  1.00  0.00           H  
ATOM     84 HD22 LEU A   4      -1.544   4.402   4.981  1.00  0.00           H  
ATOM     85 HD23 LEU A   4      -1.836   2.741   4.464  1.00  0.00           H  
ATOM     86  N   HIS A   5       0.194   1.731  -0.238  1.00  0.00           N  
ATOM     87  CA  HIS A   5      -0.159   1.331  -1.621  1.00  0.00           C  
ATOM     88  C   HIS A   5      -0.393  -0.186  -1.713  1.00  0.00           C  
ATOM     89  O   HIS A   5      -1.375  -0.610  -2.352  1.00  0.00           O  
ATOM     90  CB  HIS A   5       0.939   1.801  -2.595  1.00  0.00           C  
ATOM     91  CG  HIS A   5       0.534   1.815  -4.044  1.00  0.00           C  
ATOM     92  ND1 HIS A   5       0.267   0.670  -4.764  1.00  0.00           N  
ATOM     93  CD2 HIS A   5       0.356   2.849  -4.905  1.00  0.00           C  
ATOM     94  CE1 HIS A   5      -0.052   0.998  -6.005  1.00  0.00           C  
ATOM     95  NE2 HIS A   5      -0.006   2.311  -6.114  1.00  0.00           N  
ATOM     96  H   HIS A   5       1.096   2.080  -0.081  1.00  0.00           H  
ATOM     97  HA  HIS A   5      -1.083   1.828  -1.877  1.00  0.00           H  
ATOM     98  HB2 HIS A   5       1.231   2.807  -2.332  1.00  0.00           H  
ATOM     99  HB3 HIS A   5       1.795   1.151  -2.498  1.00  0.00           H  
ATOM    100  HD1 HIS A   5       0.307  -0.246  -4.419  1.00  0.00           H  
ATOM    101  HD2 HIS A   5       0.473   3.900  -4.682  1.00  0.00           H  
ATOM    102  HE1 HIS A   5      -0.304   0.308  -6.796  1.00  0.00           H  
ATOM    103  HE2 HIS A   5      -0.136   2.814  -6.945  1.00  0.00           H  
ATOM    104  N   GLN A   6       0.530  -0.978  -1.058  1.00  0.00           N  
ATOM    105  CA  GLN A   6       0.474  -2.467  -1.026  1.00  0.00           C  
ATOM    106  C   GLN A   6      -0.744  -2.967  -0.244  1.00  0.00           C  
ATOM    107  O   GLN A   6      -1.363  -3.965  -0.633  1.00  0.00           O  
ATOM    108  CB  GLN A   6       1.753  -3.061  -0.412  1.00  0.00           C  
ATOM    109  CG  GLN A   6       2.970  -3.037  -1.329  1.00  0.00           C  
ATOM    110  CD  GLN A   6       3.069  -4.262  -2.214  1.00  0.00           C  
ATOM    111  OE1 GLN A   6       2.167  -4.554  -2.997  1.00  0.00           O  
ATOM    112  NE2 GLN A   6       4.177  -4.985  -2.092  1.00  0.00           N  
ATOM    113  H   GLN A   6       1.268  -0.525  -0.590  1.00  0.00           H  
ATOM    114  HA  GLN A   6       0.382  -2.810  -2.046  1.00  0.00           H  
ATOM    115  HB2 GLN A   6       2.002  -2.517   0.485  1.00  0.00           H  
ATOM    116  HB3 GLN A   6       1.555  -4.088  -0.146  1.00  0.00           H  
ATOM    117  HG2 GLN A   6       2.912  -2.172  -1.964  1.00  0.00           H  
ATOM    118  HG3 GLN A   6       3.862  -2.976  -0.722  1.00  0.00           H  
ATOM    119 HE21 GLN A   6       4.855  -4.692  -1.446  1.00  0.00           H  
ATOM    120 HE22 GLN A   6       4.274  -5.779  -2.654  1.00  0.00           H  
HETATM  121  C   MK8 A   7      -3.532  -2.473   0.937  1.00  0.00           C  
HETATM  122  N   MK8 A   7      -1.077  -2.238   0.880  1.00  0.00           N  
HETATM  123  O   MK8 A   7      -4.526  -3.216   1.159  1.00  0.00           O  
HETATM  124  CA  MK8 A   7      -2.223  -2.535   1.800  1.00  0.00           C  
HETATM  125  CB  MK8 A   7      -2.349  -1.401   2.875  1.00  0.00           C  
HETATM  126  CD  MK8 A   7      -0.648  -1.785   4.749  1.00  0.00           C  
HETATM  127  CE  MK8 A   7      -0.225  -1.134   6.111  1.00  0.00           C  
HETATM  128  CG  MK8 A   7      -1.058  -0.895   3.577  1.00  0.00           C  
HETATM  129  CB1 MK8 A   7      -2.026  -3.912   2.525  1.00  0.00           C  
HETATM  130  H   MK8 A   7      -0.536  -1.471   1.080  1.00  0.00           H  
HETATM  131  HB  MK8 A   7      -3.026  -1.748   3.642  1.00  0.00           H  
HETATM  132  HBA MK8 A   7      -2.797  -0.546   2.397  1.00  0.00           H  
HETATM  133  HD  MK8 A   7       0.175  -2.403   4.411  1.00  0.00           H  
HETATM  134  HDA MK8 A   7      -1.479  -2.431   4.961  1.00  0.00           H  
HETATM  135  HE  MK8 A   7      -0.733  -1.507   6.987  1.00  0.00           H  
HETATM  136  HG  MK8 A   7      -1.224   0.109   3.938  1.00  0.00           H  
HETATM  137  HGA MK8 A   7      -0.260  -0.886   2.862  1.00  0.00           H  
HETATM  138  HB1 MK8 A   7      -0.974  -4.076   2.711  1.00  0.00           H  
HETATM  139 HB1A MK8 A   7      -2.408  -4.707   1.902  1.00  0.00           H  
HETATM  140 HB1B MK8 A   7      -2.561  -3.904   3.464  1.00  0.00           H  
ATOM    141  N   LEU A   8      -3.494  -1.505  -0.049  1.00  0.00           N  
ATOM    142  CA  LEU A   8      -4.602  -1.215  -0.987  1.00  0.00           C  
ATOM    143  C   LEU A   8      -4.899  -2.418  -1.892  1.00  0.00           C  
ATOM    144  O   LEU A   8      -6.071  -2.653  -2.237  1.00  0.00           O  
ATOM    145  CB  LEU A   8      -4.243   0.029  -1.872  1.00  0.00           C  
ATOM    146  CG  LEU A   8      -5.375   0.973  -2.450  1.00  0.00           C  
ATOM    147  CD1 LEU A   8      -6.412   0.275  -3.355  1.00  0.00           C  
ATOM    148  CD2 LEU A   8      -6.073   1.770  -1.343  1.00  0.00           C  
ATOM    149  H   LEU A   8      -2.683  -0.958  -0.119  1.00  0.00           H  
ATOM    150  HA  LEU A   8      -5.482  -0.988  -0.404  1.00  0.00           H  
ATOM    151  HB2 LEU A   8      -3.591   0.656  -1.284  1.00  0.00           H  
ATOM    152  HB3 LEU A   8      -3.669  -0.336  -2.711  1.00  0.00           H  
ATOM    153  HG  LEU A   8      -4.881   1.699  -3.081  1.00  0.00           H  
ATOM    154 HD11 LEU A   8      -6.842  -0.564  -2.828  1.00  0.00           H  
ATOM    155 HD12 LEU A   8      -5.930  -0.074  -4.256  1.00  0.00           H  
ATOM    156 HD13 LEU A   8      -7.193   0.976  -3.614  1.00  0.00           H  
ATOM    157 HD21 LEU A   8      -6.956   2.246  -1.742  1.00  0.00           H  
ATOM    158 HD22 LEU A   8      -5.399   2.526  -0.965  1.00  0.00           H  
ATOM    159 HD23 LEU A   8      -6.352   1.104  -0.541  1.00  0.00           H  
ATOM    160  N   GLN A   9      -3.793  -3.142  -2.292  1.00  0.00           N  
ATOM    161  CA  GLN A   9      -3.846  -4.315  -3.202  1.00  0.00           C  
ATOM    162  C   GLN A   9      -4.222  -5.638  -2.510  1.00  0.00           C  
ATOM    163  O   GLN A   9      -5.166  -6.305  -2.976  1.00  0.00           O  
ATOM    164  CB  GLN A   9      -2.507  -4.478  -3.950  1.00  0.00           C  
ATOM    165  CG  GLN A   9      -2.281  -3.472  -5.086  1.00  0.00           C  
ATOM    166  CD  GLN A   9      -3.226  -3.648  -6.275  1.00  0.00           C  
ATOM    167  OE1 GLN A   9      -4.446  -3.610  -6.122  1.00  0.00           O  
ATOM    168  NE2 GLN A   9      -2.661  -3.827  -7.468  1.00  0.00           N  
ATOM    169  H   GLN A   9      -2.912  -2.840  -1.978  1.00  0.00           H  
ATOM    170  HA  GLN A   9      -4.604  -4.102  -3.941  1.00  0.00           H  
ATOM    171  HB2 GLN A   9      -1.701  -4.360  -3.240  1.00  0.00           H  
ATOM    172  HB3 GLN A   9      -2.459  -5.475  -4.365  1.00  0.00           H  
ATOM    173  HG2 GLN A   9      -2.413  -2.477  -4.695  1.00  0.00           H  
ATOM    174  HG3 GLN A   9      -1.265  -3.581  -5.441  1.00  0.00           H  
ATOM    175 HE21 GLN A   9      -1.683  -3.837  -7.520  1.00  0.00           H  
ATOM    176 HE22 GLN A   9      -3.247  -3.936  -8.248  1.00  0.00           H  
ATOM    177  N   ASP A  10      -3.429  -6.029  -1.441  1.00  0.00           N  
ATOM    178  CA  ASP A  10      -3.602  -7.312  -0.703  1.00  0.00           C  
ATOM    179  C   ASP A  10      -4.919  -7.414   0.110  1.00  0.00           C  
ATOM    180  O   ASP A  10      -5.161  -8.490   0.692  1.00  0.00           O  
ATOM    181  CB  ASP A  10      -2.362  -7.586   0.186  1.00  0.00           C  
ATOM    182  CG  ASP A  10      -2.359  -8.976   0.795  1.00  0.00           C  
ATOM    183  OD1 ASP A  10      -2.985  -9.170   1.856  1.00  0.00           O  
ATOM    184  OD2 ASP A  10      -1.731  -9.875   0.202  1.00  0.00           O  
ATOM    185  H   ASP A  10      -2.675  -5.451  -1.191  1.00  0.00           H  
ATOM    186  HA  ASP A  10      -3.633  -8.090  -1.455  1.00  0.00           H  
ATOM    187  HB2 ASP A  10      -1.471  -7.495  -0.416  1.00  0.00           H  
ATOM    188  HB3 ASP A  10      -2.315  -6.866   0.989  1.00  0.00           H  
ATOM    189  N   SER A  11      -5.783  -6.311   0.114  1.00  0.00           N  
ATOM    190  CA  SER A  11      -7.096  -6.293   0.832  1.00  0.00           C  
ATOM    191  C   SER A  11      -8.210  -6.987  -0.038  1.00  0.00           C  
ATOM    192  O   SER A  11      -8.133  -8.203  -0.214  1.00  0.00           O  
ATOM    193  CB  SER A  11      -7.419  -4.851   1.300  1.00  0.00           C  
ATOM    194  OG  SER A  11      -6.494  -4.422   2.284  1.00  0.00           O  
ATOM    195  H   SER A  11      -5.525  -5.509  -0.395  1.00  0.00           H  
ATOM    196  HA  SER A  11      -6.966  -6.908   1.719  1.00  0.00           H  
ATOM    197  HB2 SER A  11      -7.367  -4.182   0.458  1.00  0.00           H  
ATOM    198  HB3 SER A  11      -8.411  -4.824   1.725  1.00  0.00           H  
ATOM    199  HG  SER A  11      -6.921  -4.413   3.143  1.00  0.00           H  
HETATM  200  N   NH2 A  12      -9.273  -6.298  -0.533  1.00  0.00           N  
HETATM  201  HN1 NH2 A  12      -9.356  -5.340  -0.340  1.00  0.00           H  
HETATM  202  HN2 NH2 A  12      -9.922  -6.793  -1.078  1.00  0.00           H  
TER     203      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   27   48                                                                
CONECT   47   49   50   67                                                      
CONECT   48   27   50   56                                                      
CONECT   49   47                                                                
CONECT   50   47   48   51   55                                                 
CONECT   51   50   54   57   58                                                 
CONECT   52   53   54   59   60                                                 
CONECT   53   52   61  127                                                      
CONECT   54   51   52   62   63                                                 
CONECT   55   50   64   65   66                                                 
CONECT   56   48                                                                
CONECT   57   51                                                                
CONECT   58   51                                                                
CONECT   59   52                                                                
CONECT   60   52                                                                
CONECT   61   53                                                                
CONECT   62   54                                                                
CONECT   63   54                                                                
CONECT   64   55                                                                
CONECT   65   55                                                                
CONECT   66   55                                                                
CONECT   67   47                                                                
CONECT  106  122                                                                
CONECT  121  123  124  141                                                      
CONECT  122  106  124  130                                                      
CONECT  123  121                                                                
CONECT  124  121  122  125  129                                                 
CONECT  125  124  128  131  132                                                 
CONECT  126  127  128  133  134                                                 
CONECT  127   53  126  135                                                      
CONECT  128  125  126  136  137                                                 
CONECT  129  124  138  139  140                                                 
CONECT  130  122                                                                
CONECT  131  125                                                                
CONECT  132  125                                                                
CONECT  133  126                                                                
CONECT  134  126                                                                
CONECT  135  127                                                                
CONECT  136  128                                                                
CONECT  137  128                                                                
CONECT  138  129                                                                
CONECT  139  129                                                                
CONECT  140  129                                                                
CONECT  141  121                                                                
CONECT  191  200                                                                
CONECT  200  191  201  202                                                      
CONECT  201  200                                                                
CONECT  202  200                                                                
MASTER       90    0    4    1    0    0    0    6   99    1   55    1          
END