HEADER    DE NOVO PROTEIN                         20-DEC-17   6FCE              
TITLE     NMR ENSEMBLE OF MACROCYCLIC PEPTIDOMIMETIC CONTAINING CONSTRAINED A,A-
TITLE    2 DIALKYLATED AMINO ACIDS WITH POTENT AND SELECTIVE ACTIVITY AT HUMAN  
TITLE    3 MELANOCORTIN RECEPTORS                                               
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: ACP-HIS-DPHE-ARG-TRP-ASP-NH2;                              
COMPND   3 CHAIN: A;                                                            
COMPND   4 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 SYNTHETIC: YES;                                                      
SOURCE   3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT;                            
SOURCE   4 ORGANISM_TAXID: 32630                                                
KEYWDS    MELANOCORTIN, PEPTIDOMIMETICS, AMINO ACID, DIALKYLATED, DE NOVO       
KEYWDS   2 PROTEIN                                                              
EXPDTA    SOLUTION NMR                                                          
NUMMDL    10                                                                    
AUTHOR    D.BRANCACCIO,A.CAROTENUTO,P.GRIECO,F.MERLINO,Y.ZHOU,M.CAI,A.M.YOUSIF, 
AUTHOR   2 S.DI MARO,E.NOVELLINO,V.J.HRUBY                                      
REVDAT   2   23-MAY-18 6FCE    1       SOURCE JRNL   ATOM                       
REVDAT   1   25-APR-18 6FCE    0                                                
JRNL        AUTH   F.MERLINO,Y.ZHOU,M.CAI,A.CAROTENUTO,A.M.YOUSIF,D.BRANCACCIO, 
JRNL        AUTH 2 S.DI MARO,S.ZAPPAVIGNA,A.LIMATOLA,E.NOVELLINO,P.GRIECO,      
JRNL        AUTH 3 V.J.HRUBY                                                    
JRNL        TITL   DEVELOPMENT OF MACROCYCLIC PEPTIDOMIMETICS CONTAINING        
JRNL        TITL 2 CONSTRAINED ALPHA , ALPHA-DIALKYLATED AMINO ACIDS WITH       
JRNL        TITL 3 POTENT AND SELECTIVE ACTIVITY AT HUMAN MELANOCORTIN          
JRNL        TITL 4 RECEPTORS.                                                   
JRNL        REF    J. MED. CHEM.                 V.  61  4263 2018              
JRNL        REFN                   ISSN 1520-4804                               
JRNL        PMID   29660981                                                     
JRNL        DOI    10.1021/ACS.JMEDCHEM.8B00488                                 
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : CYANA                                                
REMARK   3   AUTHORS     : GUNTERT, MUMENTHALER AND WUTHRICH                    
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 6FCE COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 20-DEC-17.                  
REMARK 100 THE DEPOSITION ID IS D_1200008071.                                   
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                 : 0                                  
REMARK 210  PRESSURE                       : 1 ATM                              
REMARK 210  SAMPLE CONTENTS                : 2.0 MM PEPTIDE, 10 % V/V [U-99%    
REMARK 210                                   2H] D2O, 0.1 MM TSP, 200 MM [U-    
REMARK 210                                   100% 2H] DPC, 90% H2O/10% D2O      
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 1D 1H; 2D 1H-1H TOCSY; 2D 1H-1H    
REMARK 210                                   NOESY; 2D DQF-COSY                 
REMARK 210  SPECTROMETER FIELD STRENGTH    : 700 MHZ                            
REMARK 210  SPECTROMETER MODEL             : INOVA                              
REMARK 210  SPECTROMETER MANUFACTURER      : VARIAN                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : XEASY, NMRDRAW                     
REMARK 210   METHOD USED                   : SIMULATED ANNEALING                
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 100                                
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 10                                 
REMARK 210 CONFORMERS, SELECTION CRITERIA  : STRUCTURES WITH THE LOWEST         
REMARK 210                                   ENERGY                             
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1                   
REMARK 210                                                                      
REMARK 210 REMARK: NULL                                                         
REMARK 215                                                                      
REMARK 215 NMR STUDY                                                            
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC                         
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC                  
REMARK 350 SOFTWARE USED: PISA                                                  
REMARK 350 TOTAL BURIED SURFACE AREA: 110 ANGSTROM**2                           
REMARK 350 SURFACE AREA OF THE COMPLEX: 970 ANGSTROM**2                         
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: 0.0 KCAL/MOL                          
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: COVALENT BOND ANGLES                                       
REMARK 500                                                                      
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES              
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE               
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                 
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)              
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999                        
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996                     
REMARK 500                                                                      
REMARK 500  M RES CSSEQI ATM1   ATM2   ATM3                                     
REMARK 500  1 HIS A   6   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.5 DEGREES          
REMARK 500  1 ARG A   8   NE  -  CZ  -  NH1 ANGL. DEV. =   3.4 DEGREES          
REMARK 500  2 HIS A   6   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.3 DEGREES          
REMARK 500  2 ARG A   8   NE  -  CZ  -  NH1 ANGL. DEV. =   3.4 DEGREES          
REMARK 500  2 TRP A   9   CD1 -  NE1 -  CE2 ANGL. DEV. =  -5.5 DEGREES          
REMARK 500  3 HIS A   6   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.6 DEGREES          
REMARK 500  3 ARG A   8   NE  -  CZ  -  NH2 ANGL. DEV. =   3.4 DEGREES          
REMARK 500  4 HIS A   6   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.5 DEGREES          
REMARK 500  4 ARG A   8   NE  -  CZ  -  NH2 ANGL. DEV. =   3.2 DEGREES          
REMARK 500  5 HIS A   6   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.4 DEGREES          
REMARK 500  5 ARG A   8   NE  -  CZ  -  NH1 ANGL. DEV. =   3.4 DEGREES          
REMARK 500  6 HIS A   6   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.5 DEGREES          
REMARK 500  6 ARG A   8   NE  -  CZ  -  NH2 ANGL. DEV. =   3.3 DEGREES          
REMARK 500  7 HIS A   6   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.4 DEGREES          
REMARK 500  7 ARG A   8   NE  -  CZ  -  NH2 ANGL. DEV. =   3.3 DEGREES          
REMARK 500  8 HIS A   6   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.6 DEGREES          
REMARK 500  8 ARG A   8   NE  -  CZ  -  NH2 ANGL. DEV. =   3.6 DEGREES          
REMARK 500  9 HIS A   6   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.5 DEGREES          
REMARK 500  9 ARG A   8   NE  -  CZ  -  NH1 ANGL. DEV. =   3.2 DEGREES          
REMARK 500 10 HIS A   6   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.6 DEGREES          
REMARK 500 10 ARG A   8   NE  -  CZ  -  NH2 ANGL. DEV. =   3.3 DEGREES          
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 34222   RELATED DB: BMRB                                 
REMARK 900 NMR ENSEMBLE OF MACROCYCLIC PEPTIDOMIMETIC CONTAINING CONSTRAINED A, 
REMARK 900 A-DIALKYLATED AMINO ACIDS WITH POTENT AND SELECTIVE ACTIVITY AT      
REMARK 900 HUMAN MELANOCORTIN RECEPTORS                                         
DBREF  6FCE A    5    11  PDB    6FCE     6FCE             5     11             
SEQRES   1 A    7  AC5 HIS DPN ARG TRP ASP NH2                                  
HET    AC5  A   5      17                                                       
HET    DPN  A   7      20                                                       
HET    NH2  A  11       3                                                       
HETNAM     AC5 1-AMINOCYCLOPENTANECARBOXYLIC ACID                               
HETNAM     DPN D-PHENYLALANINE                                                  
HETNAM     NH2 AMINO GROUP                                                      
HETSYN     AC5 CYCLO-LEUCINE                                                    
FORMUL   1  AC5    C6 H11 N O2                                                  
FORMUL   1  DPN    C9 H11 N O2                                                  
FORMUL   1  NH2    H2 N                                                         
LINK         N   AC5 A   5                 CG  ASP A  10     1555   1555  1.34  
LINK         C   AC5 A   5                 N   HIS A   6     1555   1555  1.33  
LINK         C   HIS A   6                 N   DPN A   7     1555   1555  1.35  
LINK         C   DPN A   7                 N   ARG A   8     1555   1555  1.34  
LINK         C   ASP A  10                 N   NH2 A  11     1555   1555  1.32  
CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1          
ORIGX1      1.000000  0.000000  0.000000        0.00000                         
ORIGX2      0.000000  1.000000  0.000000        0.00000                         
ORIGX3      0.000000  0.000000  1.000000        0.00000                         
SCALE1      1.000000  0.000000  0.000000        0.00000                         
SCALE2      0.000000  1.000000  0.000000        0.00000                         
SCALE3      0.000000  0.000000  1.000000        0.00000                         
MODEL        1                                                                  
HETATM    1  N   AC5 A   5       0.636  -4.615   0.232  1.00  0.00           N  
HETATM    2  O   AC5 A   5      -2.100  -4.714   2.817  1.00  0.00           O  
HETATM    3  CA  AC5 A   5      -0.297  -5.290   1.209  1.00  0.00           C  
HETATM    4  C   AC5 A   5      -1.011  -4.404   2.323  1.00  0.00           C  
HETATM    5  CB1 AC5 A   5      -1.287  -6.145   0.389  1.00  0.00           C  
HETATM    6  CB2 AC5 A   5       0.514  -6.420   1.894  1.00  0.00           C  
HETATM    7  CG1 AC5 A   5      -0.631  -7.486   0.017  1.00  0.00           C  
HETATM    8  CG2 AC5 A   5       0.570  -7.638   0.956  1.00  0.00           C  
HETATM    9  H   AC5 A   5       1.418  -5.149  -0.143  1.00  0.00           H  
HETATM   10 HB11 AC5 A   5      -1.653  -5.583  -0.489  1.00  0.00           H  
HETATM   11 HB12 AC5 A   5      -2.177  -6.343   1.005  1.00  0.00           H  
HETATM   12 HB21 AC5 A   5       0.008  -6.736   2.829  1.00  0.00           H  
HETATM   13 HB22 AC5 A   5       1.521  -6.085   2.215  1.00  0.00           H  
HETATM   14 HG11 AC5 A   5      -1.345  -8.326   0.119  1.00  0.00           H  
HETATM   15 HG12 AC5 A   5      -0.300  -7.482  -1.039  1.00  0.00           H  
HETATM   16 HG21 AC5 A   5       1.513  -7.639   0.376  1.00  0.00           H  
HETATM   17 HG22 AC5 A   5       0.546  -8.593   1.516  1.00  0.00           H  
ATOM     18  N   HIS A   6      -0.348  -3.322   2.728  1.00  0.00           N  
ATOM     19  CA  HIS A   6      -0.885  -2.314   3.694  1.00  0.00           C  
ATOM     20  C   HIS A   6      -1.362  -0.938   3.092  1.00  0.00           C  
ATOM     21  O   HIS A   6      -1.830  -0.075   3.840  1.00  0.00           O  
ATOM     22  CB  HIS A   6       0.229  -2.165   4.774  1.00  0.00           C  
ATOM     23  CG  HIS A   6      -0.231  -1.673   6.138  1.00  0.00           C  
ATOM     24  ND1 HIS A   6      -0.212  -0.362   6.563  1.00  0.00           N  
ATOM     25  CD2 HIS A   6      -0.672  -2.506   7.169  1.00  0.00           C  
ATOM     26  CE1 HIS A   6      -0.687  -0.521   7.838  1.00  0.00           C  
ATOM     27  NE2 HIS A   6      -0.986  -1.776   8.307  1.00  0.00           N  
ATOM     28  H   HIS A   6       0.409  -3.177   2.054  1.00  0.00           H  
ATOM     29  HA  HIS A   6      -1.788  -2.723   4.185  1.00  0.00           H  
ATOM     30  HB2 HIS A   6       0.745  -3.129   4.946  1.00  0.00           H  
ATOM     31  HB3 HIS A   6       1.029  -1.503   4.408  1.00  0.00           H  
ATOM     32  HD1 HIS A   6      -0.030   0.491   6.025  1.00  0.00           H  
ATOM     33  HD2 HIS A   6      -0.734  -3.579   7.070  1.00  0.00           H  
ATOM     34  HE1 HIS A   6      -0.845   0.338   8.476  1.00  0.00           H  
HETATM   35  N   DPN A   7      -1.239  -0.708   1.773  1.00  0.00           N  
HETATM   36  CA  DPN A   7      -1.493   0.608   1.124  1.00  0.00           C  
HETATM   37  C   DPN A   7      -0.304   0.943   0.164  1.00  0.00           C  
HETATM   38  O   DPN A   7       0.143   0.113  -0.635  1.00  0.00           O  
HETATM   39  CB  DPN A   7      -2.867   0.562   0.409  1.00  0.00           C  
HETATM   40  CG  DPN A   7      -3.378   1.926  -0.084  1.00  0.00           C  
HETATM   41  CD1 DPN A   7      -4.029   2.794   0.799  1.00  0.00           C  
HETATM   42  CD2 DPN A   7      -3.171   2.323  -1.409  1.00  0.00           C  
HETATM   43  CE1 DPN A   7      -4.465   4.044   0.363  1.00  0.00           C  
HETATM   44  CE2 DPN A   7      -3.607   3.574  -1.844  1.00  0.00           C  
HETATM   45  CZ  DPN A   7      -4.252   4.431  -0.957  1.00  0.00           C  
HETATM   46  H   DPN A   7      -0.972  -1.548   1.241  1.00  0.00           H  
HETATM   47  HA  DPN A   7      -1.552   1.395   1.905  1.00  0.00           H  
HETATM   48  HB2 DPN A   7      -2.810  -0.157  -0.427  1.00  0.00           H  
HETATM   49  HB3 DPN A   7      -3.629   0.126   1.087  1.00  0.00           H  
HETATM   50  HD1 DPN A   7      -4.197   2.505   1.828  1.00  0.00           H  
HETATM   51  HD2 DPN A   7      -2.665   1.667  -2.103  1.00  0.00           H  
HETATM   52  HE1 DPN A   7      -4.968   4.711   1.047  1.00  0.00           H  
HETATM   53  HE2 DPN A   7      -3.444   3.876  -2.869  1.00  0.00           H  
HETATM   54  HZ  DPN A   7      -4.593   5.400  -1.297  1.00  0.00           H  
ATOM     55  N   ARG A   8       0.255   2.158   0.294  1.00  0.00           N  
ATOM     56  CA  ARG A   8       1.536   2.559  -0.385  1.00  0.00           C  
ATOM     57  C   ARG A   8       2.791   1.626  -0.223  1.00  0.00           C  
ATOM     58  O   ARG A   8       3.567   1.422  -1.158  1.00  0.00           O  
ATOM     59  CB  ARG A   8       1.845   4.041  -0.026  1.00  0.00           C  
ATOM     60  CG  ARG A   8       2.161   4.346   1.461  1.00  0.00           C  
ATOM     61  CD  ARG A   8       2.668   5.780   1.706  1.00  0.00           C  
ATOM     62  NE  ARG A   8       2.946   6.018   3.153  1.00  0.00           N  
ATOM     63  CZ  ARG A   8       4.062   5.671   3.801  1.00  0.00           C  
ATOM     64  NH1 ARG A   8       5.049   5.013   3.246  1.00  0.00           N  
ATOM     65  NH2 ARG A   8       4.174   6.000   5.056  1.00  0.00           N  
ATOM     66  H   ARG A   8      -0.297   2.808   0.862  1.00  0.00           H  
ATOM     67  HA  ARG A   8       1.329   2.531  -1.464  1.00  0.00           H  
ATOM     68  HB2 ARG A   8       2.691   4.375  -0.658  1.00  0.00           H  
ATOM     69  HB3 ARG A   8       0.996   4.670  -0.349  1.00  0.00           H  
ATOM     70  HG2 ARG A   8       1.257   4.160   2.071  1.00  0.00           H  
ATOM     71  HG3 ARG A   8       2.910   3.624   1.835  1.00  0.00           H  
ATOM     72  HD2 ARG A   8       3.555   6.008   1.076  1.00  0.00           H  
ATOM     73  HD3 ARG A   8       1.900   6.502   1.362  1.00  0.00           H  
ATOM     74  HE  ARG A   8       2.265   6.511   3.738  1.00  0.00           H  
ATOM     75 HH11 ARG A   8       5.859   4.766   3.818  1.00  0.00           H  
ATOM     76 HH12 ARG A   8       4.888   4.775   2.267  1.00  0.00           H  
ATOM     77 HH21 ARG A   8       3.399   6.522   5.470  1.00  0.00           H  
ATOM     78 HH22 ARG A   8       5.038   5.731   5.530  1.00  0.00           H  
ATOM     79  N   TRP A   9       2.924   1.039   0.970  1.00  0.00           N  
ATOM     80  CA  TRP A   9       3.868  -0.057   1.320  1.00  0.00           C  
ATOM     81  C   TRP A   9       3.931  -1.304   0.369  1.00  0.00           C  
ATOM     82  O   TRP A   9       4.996  -1.908   0.236  1.00  0.00           O  
ATOM     83  CB  TRP A   9       3.486  -0.519   2.754  1.00  0.00           C  
ATOM     84  CG  TRP A   9       3.564   0.524   3.884  1.00  0.00           C  
ATOM     85  CD1 TRP A   9       4.662   0.879   4.688  1.00  0.00           C  
ATOM     86  CD2 TRP A   9       2.536   1.336   4.287  1.00  0.00           C  
ATOM     87  NE1 TRP A   9       4.324   1.903   5.606  1.00  0.00           N  
ATOM     88  CE2 TRP A   9       2.988   2.166   5.334  1.00  0.00           C  
ATOM     89  CE3 TRP A   9       1.226   1.446   3.792  1.00  0.00           C  
ATOM     90  CZ2 TRP A   9       2.104   3.116   5.911  1.00  0.00           C  
ATOM     91  CZ3 TRP A   9       0.374   2.392   4.351  1.00  0.00           C  
ATOM     92  CH2 TRP A   9       0.802   3.215   5.403  1.00  0.00           C  
ATOM     93  H   TRP A   9       2.152   1.292   1.592  1.00  0.00           H  
ATOM     94  HA  TRP A   9       4.883   0.373   1.380  1.00  0.00           H  
ATOM     95  HB2 TRP A   9       2.470  -0.957   2.730  1.00  0.00           H  
ATOM     96  HB3 TRP A   9       4.097  -1.370   3.052  1.00  0.00           H  
ATOM     97  HD1 TRP A   9       5.641   0.427   4.594  1.00  0.00           H  
ATOM     98  HE1 TRP A   9       4.890   2.264   6.384  1.00  0.00           H  
ATOM     99  HE3 TRP A   9       0.919   0.803   2.983  1.00  0.00           H  
ATOM    100  HZ2 TRP A   9       2.432   3.752   6.719  1.00  0.00           H  
ATOM    101  HZ3 TRP A   9      -0.622   2.457   3.945  1.00  0.00           H  
ATOM    102  HH2 TRP A   9       0.114   3.932   5.826  1.00  0.00           H  
ATOM    103  N   ASP A  10       2.811  -1.691  -0.276  1.00  0.00           N  
ATOM    104  CA  ASP A  10       2.779  -2.797  -1.278  1.00  0.00           C  
ATOM    105  C   ASP A  10       3.592  -2.574  -2.598  1.00  0.00           C  
ATOM    106  O   ASP A  10       4.116  -3.522  -3.177  1.00  0.00           O  
ATOM    107  CB  ASP A  10       1.294  -3.133  -1.619  1.00  0.00           C  
ATOM    108  CG  ASP A  10       0.332  -3.523  -0.484  1.00  0.00           C  
ATOM    109  OD1 ASP A  10      -0.672  -2.847  -0.275  1.00  0.00           O  
ATOM    110  H   ASP A  10       2.003  -1.073  -0.127  1.00  0.00           H  
ATOM    111  HA  ASP A  10       3.233  -3.692  -0.810  1.00  0.00           H  
ATOM    112  HB2 ASP A  10       0.843  -2.268  -2.144  1.00  0.00           H  
ATOM    113  HB3 ASP A  10       1.261  -3.948  -2.366  1.00  0.00           H  
HETATM  114  N   NH2 A  11       3.728  -1.382  -3.149  1.00  0.00           N  
HETATM  115  HN1 NH2 A  11       4.372  -1.391  -3.943  1.00  0.00           H  
HETATM  116  HN2 NH2 A  11       3.466  -0.583  -2.561  1.00  0.00           H  
TER     117      NH2 A  11                                                      
ENDMDL                                                                          
MODEL        2                                                                  
HETATM    1  N   AC5 A   5       0.757  -4.618   0.294  1.00  0.00           N  
HETATM    2  O   AC5 A   5      -1.747  -4.868   3.155  1.00  0.00           O  
HETATM    3  CA  AC5 A   5      -0.167  -5.285   1.287  1.00  0.00           C  
HETATM    4  C   AC5 A   5      -0.801  -4.440   2.488  1.00  0.00           C  
HETATM    5  CB1 AC5 A   5      -1.253  -6.051   0.477  1.00  0.00           C  
HETATM    6  CB2 AC5 A   5       0.671  -6.450   1.890  1.00  0.00           C  
HETATM    7  CG1 AC5 A   5      -1.125  -7.549   0.781  1.00  0.00           C  
HETATM    8  CG2 AC5 A   5       0.358  -7.720   1.088  1.00  0.00           C  
HETATM    9  H   AC5 A   5       1.520  -5.156  -0.118  1.00  0.00           H  
HETATM   10 HB11 AC5 A   5      -1.142  -5.881  -0.610  1.00  0.00           H  
HETATM   11 HB12 AC5 A   5      -2.265  -5.672   0.709  1.00  0.00           H  
HETATM   12 HB21 AC5 A   5       0.376  -6.638   2.943  1.00  0.00           H  
HETATM   13 HB22 AC5 A   5       1.756  -6.235   1.952  1.00  0.00           H  
HETATM   14 HG11 AC5 A   5      -1.740  -7.818   1.664  1.00  0.00           H  
HETATM   15 HG12 AC5 A   5      -1.468  -8.189  -0.056  1.00  0.00           H  
HETATM   16 HG21 AC5 A   5       0.954  -7.763   0.154  1.00  0.00           H  
HETATM   17 HG22 AC5 A   5       0.572  -8.650   1.652  1.00  0.00           H  
ATOM     18  N   HIS A   6      -0.237  -3.267   2.769  1.00  0.00           N  
ATOM     19  CA  HIS A   6      -0.756  -2.305   3.797  1.00  0.00           C  
ATOM     20  C   HIS A   6      -1.255  -0.903   3.262  1.00  0.00           C  
ATOM     21  O   HIS A   6      -1.633  -0.034   4.052  1.00  0.00           O  
ATOM     22  CB  HIS A   6       0.395  -2.201   4.845  1.00  0.00           C  
ATOM     23  CG  HIS A   6      -0.012  -1.840   6.266  1.00  0.00           C  
ATOM     24  ND1 HIS A   6      -0.349  -0.577   6.694  1.00  0.00           N  
ATOM     25  CD2 HIS A   6      -0.030  -2.733   7.343  1.00  0.00           C  
ATOM     26  CE1 HIS A   6      -0.601  -0.831   8.015  1.00  0.00           C  
ATOM     27  NE2 HIS A   6      -0.415  -2.095   8.514  1.00  0.00           N  
ATOM     28  H   HIS A   6       0.365  -3.044   1.971  1.00  0.00           H  
ATOM     29  HA  HIS A   6      -1.647  -2.734   4.295  1.00  0.00           H  
ATOM     30  HB2 HIS A   6       0.953  -3.158   4.914  1.00  0.00           H  
ATOM     31  HB3 HIS A   6       1.156  -1.484   4.507  1.00  0.00           H  
ATOM     32  HD1 HIS A   6      -0.665   0.207   6.112  1.00  0.00           H  
ATOM     33  HD2 HIS A   6       0.224  -3.780   7.253  1.00  0.00           H  
ATOM     34  HE1 HIS A   6      -0.992  -0.057   8.662  1.00  0.00           H  
HETATM   35  N   DPN A   7      -1.239  -0.649   1.944  1.00  0.00           N  
HETATM   36  CA  DPN A   7      -1.492   0.687   1.339  1.00  0.00           C  
HETATM   37  C   DPN A   7      -0.322   1.048   0.358  1.00  0.00           C  
HETATM   38  O   DPN A   7       0.137   0.231  -0.447  1.00  0.00           O  
HETATM   39  CB  DPN A   7      -2.888   0.670   0.667  1.00  0.00           C  
HETATM   40  CG  DPN A   7      -3.398   2.052   0.226  1.00  0.00           C  
HETATM   41  CD1 DPN A   7      -3.218   2.485  -1.092  1.00  0.00           C  
HETATM   42  CD2 DPN A   7      -4.021   2.900   1.148  1.00  0.00           C  
HETATM   43  CE1 DPN A   7      -3.652   3.752  -1.481  1.00  0.00           C  
HETATM   44  CE2 DPN A   7      -4.457   4.164   0.757  1.00  0.00           C  
HETATM   45  CZ  DPN A   7      -4.270   4.589  -0.556  1.00  0.00           C  
HETATM   46  H   DPN A   7      -1.009  -1.480   1.383  1.00  0.00           H  
HETATM   47  HA  DPN A   7      -1.524   1.455   2.142  1.00  0.00           H  
HETATM   48  HB2 DPN A   7      -2.866  -0.027  -0.189  1.00  0.00           H  
HETATM   49  HB3 DPN A   7      -3.633   0.225   1.356  1.00  0.00           H  
HETATM   50  HD1 DPN A   7      -2.741   1.842  -1.819  1.00  0.00           H  
HETATM   51  HD2 DPN A   7      -4.178   2.576   2.169  1.00  0.00           H  
HETATM   52  HE1 DPN A   7      -3.520   4.078  -2.503  1.00  0.00           H  
HETATM   53  HE2 DPN A   7      -4.949   4.812   1.469  1.00  0.00           H  
HETATM   54  HZ  DPN A   7      -4.620   5.566  -0.862  1.00  0.00           H  
ATOM     55  N   ARG A   8       0.229   2.265   0.491  1.00  0.00           N  
ATOM     56  CA  ARG A   8       1.505   2.675  -0.196  1.00  0.00           C  
ATOM     57  C   ARG A   8       2.800   1.784  -0.046  1.00  0.00           C  
ATOM     58  O   ARG A   8       3.700   1.801  -0.883  1.00  0.00           O  
ATOM     59  CB  ARG A   8       1.794   4.151   0.196  1.00  0.00           C  
ATOM     60  CG  ARG A   8       2.108   4.421   1.694  1.00  0.00           C  
ATOM     61  CD  ARG A   8       2.958   5.683   1.935  1.00  0.00           C  
ATOM     62  NE  ARG A   8       3.370   5.792   3.367  1.00  0.00           N  
ATOM     63  CZ  ARG A   8       4.370   5.126   3.943  1.00  0.00           C  
ATOM     64  NH1 ARG A   8       5.103   4.244   3.323  1.00  0.00           N  
ATOM     65  NH2 ARG A   8       4.626   5.363   5.188  1.00  0.00           N  
ATOM     66  H   ARG A   8      -0.363   2.915   1.016  1.00  0.00           H  
ATOM     67  HA  ARG A   8       1.300   2.652  -1.277  1.00  0.00           H  
ATOM     68  HB2 ARG A   8       2.635   4.495  -0.437  1.00  0.00           H  
ATOM     69  HB3 ARG A   8       0.944   4.783  -0.119  1.00  0.00           H  
ATOM     70  HG2 ARG A   8       1.159   4.477   2.263  1.00  0.00           H  
ATOM     71  HG3 ARG A   8       2.625   3.543   2.121  1.00  0.00           H  
ATOM     72  HD2 ARG A   8       3.840   5.709   1.259  1.00  0.00           H  
ATOM     73  HD3 ARG A   8       2.369   6.579   1.644  1.00  0.00           H  
ATOM     74  HE  ARG A   8       2.886   6.435   4.003  1.00  0.00           H  
ATOM     75 HH11 ARG A   8       5.799   3.725   3.862  1.00  0.00           H  
ATOM     76 HH12 ARG A   8       4.828   4.082   2.352  1.00  0.00           H  
ATOM     77 HH21 ARG A   8       5.385   4.823   5.610  1.00  0.00           H  
ATOM     78 HH22 ARG A   8       4.044   6.056   5.658  1.00  0.00           H  
ATOM     79  N   TRP A   9       2.864   1.035   1.051  1.00  0.00           N  
ATOM     80  CA  TRP A   9       3.876  -0.019   1.340  1.00  0.00           C  
ATOM     81  C   TRP A   9       3.984  -1.224   0.336  1.00  0.00           C  
ATOM     82  O   TRP A   9       5.062  -1.808   0.220  1.00  0.00           O  
ATOM     83  CB  TRP A   9       3.519  -0.548   2.758  1.00  0.00           C  
ATOM     84  CG  TRP A   9       3.649   0.433   3.935  1.00  0.00           C  
ATOM     85  CD1 TRP A   9       4.753   0.657   4.778  1.00  0.00           C  
ATOM     86  CD2 TRP A   9       2.655   1.251   4.406  1.00  0.00           C  
ATOM     87  NE1 TRP A   9       4.460   1.615   5.783  1.00  0.00           N  
ATOM     88  CE2 TRP A   9       3.133   1.952   5.532  1.00  0.00           C  
ATOM     89  CE3 TRP A   9       1.345   1.442   3.938  1.00  0.00           C  
ATOM     90  CZ2 TRP A   9       2.274   2.851   6.217  1.00  0.00           C  
ATOM     91  CZ3 TRP A   9       0.524   2.347   4.594  1.00  0.00           C  
ATOM     92  CH2 TRP A   9       0.973   3.041   5.726  1.00  0.00           C  
ATOM     93  H   TRP A   9       1.984   1.093   1.566  1.00  0.00           H  
ATOM     94  HA  TRP A   9       4.875   0.448   1.407  1.00  0.00           H  
ATOM     95  HB2 TRP A   9       2.497  -0.978   2.741  1.00  0.00           H  
ATOM     96  HB3 TRP A   9       4.126  -1.425   2.994  1.00  0.00           H  
ATOM     97  HD1 TRP A   9       5.689   0.126   4.674  1.00  0.00           H  
ATOM     98  HE1 TRP A   9       4.946   1.718   6.682  1.00  0.00           H  
ATOM     99  HE3 TRP A   9       1.006   0.870   3.088  1.00  0.00           H  
ATOM    100  HZ2 TRP A   9       2.611   3.373   7.100  1.00  0.00           H  
ATOM    101  HZ3 TRP A   9      -0.476   2.467   4.207  1.00  0.00           H  
ATOM    102  HH2 TRP A   9       0.296   3.713   6.233  1.00  0.00           H  
ATOM    103  N   ASP A  10       2.893  -1.620  -0.346  1.00  0.00           N  
ATOM    104  CA  ASP A  10       2.875  -2.800  -1.264  1.00  0.00           C  
ATOM    105  C   ASP A  10       3.700  -2.697  -2.594  1.00  0.00           C  
ATOM    106  O   ASP A  10       4.203  -3.696  -3.100  1.00  0.00           O  
ATOM    107  CB  ASP A  10       1.392  -3.160  -1.569  1.00  0.00           C  
ATOM    108  CG  ASP A  10       0.462  -3.516  -0.402  1.00  0.00           C  
ATOM    109  OD1 ASP A  10      -0.503  -2.803  -0.145  1.00  0.00           O  
ATOM    110  H   ASP A  10       2.057  -1.045  -0.187  1.00  0.00           H  
ATOM    111  HA  ASP A  10       3.332  -3.657  -0.729  1.00  0.00           H  
ATOM    112  HB2 ASP A  10       0.922  -2.325  -2.123  1.00  0.00           H  
ATOM    113  HB3 ASP A  10       1.354  -4.005  -2.283  1.00  0.00           H  
HETATM  114  N   NH2 A  11       3.866  -1.560  -3.237  1.00  0.00           N  
HETATM  115  HN1 NH2 A  11       4.523  -1.654  -4.017  1.00  0.00           H  
HETATM  116  HN2 NH2 A  11       3.625  -0.713  -2.713  1.00  0.00           H  
TER     117      NH2 A  11                                                      
ENDMDL                                                                          
MODEL        3                                                                  
HETATM    1  N   AC5 A   5       0.580  -4.562   0.194  1.00  0.00           N  
HETATM    2  O   AC5 A   5      -2.323  -4.566   2.552  1.00  0.00           O  
HETATM    3  CA  AC5 A   5      -0.394  -5.246   1.124  1.00  0.00           C  
HETATM    4  C   AC5 A   5      -1.160  -4.349   2.199  1.00  0.00           C  
HETATM    5  CB1 AC5 A   5      -1.366  -6.079   0.265  1.00  0.00           C  
HETATM    6  CB2 AC5 A   5       0.373  -6.401   1.821  1.00  0.00           C  
HETATM    7  CG1 AC5 A   5      -1.718  -7.368   1.027  1.00  0.00           C  
HETATM    8  CG2 AC5 A   5      -0.654  -7.505   2.120  1.00  0.00           C  
HETATM    9  H   AC5 A   5       1.431  -5.035  -0.117  1.00  0.00           H  
HETATM   10 HB11 AC5 A   5      -0.888  -6.344  -0.693  1.00  0.00           H  
HETATM   11 HB12 AC5 A   5      -2.251  -5.470   0.007  1.00  0.00           H  
HETATM   12 HB21 AC5 A   5       0.900  -6.069   2.736  1.00  0.00           H  
HETATM   13 HB22 AC5 A   5       1.155  -6.835   1.166  1.00  0.00           H  
HETATM   14 HG11 AC5 A   5      -2.728  -7.298   1.476  1.00  0.00           H  
HETATM   15 HG12 AC5 A   5      -1.730  -8.245   0.351  1.00  0.00           H  
HETATM   16 HG21 AC5 A   5      -0.195  -8.512   2.144  1.00  0.00           H  
HETATM   17 HG22 AC5 A   5      -1.111  -7.342   3.117  1.00  0.00           H  
ATOM     18  N   HIS A   6      -0.457  -3.336   2.703  1.00  0.00           N  
ATOM     19  CA  HIS A   6      -1.012  -2.308   3.631  1.00  0.00           C  
ATOM     20  C   HIS A   6      -1.470  -0.941   3.003  1.00  0.00           C  
ATOM     21  O   HIS A   6      -1.968  -0.084   3.737  1.00  0.00           O  
ATOM     22  CB  HIS A   6       0.079  -2.083   4.716  1.00  0.00           C  
ATOM     23  CG  HIS A   6       0.266  -3.211   5.728  1.00  0.00           C  
ATOM     24  ND1 HIS A   6      -0.623  -3.522   6.737  1.00  0.00           N  
ATOM     25  CD2 HIS A   6       1.361  -4.082   5.767  1.00  0.00           C  
ATOM     26  CE1 HIS A   6       0.026  -4.590   7.301  1.00  0.00           C  
ATOM     27  NE2 HIS A   6       1.232  -5.008   6.795  1.00  0.00           N  
ATOM     28  H   HIS A   6       0.402  -3.247   2.157  1.00  0.00           H  
ATOM     29  HA  HIS A   6      -1.920  -2.696   4.125  1.00  0.00           H  
ATOM     30  HB2 HIS A   6       1.047  -1.835   4.243  1.00  0.00           H  
ATOM     31  HB3 HIS A   6      -0.154  -1.178   5.288  1.00  0.00           H  
ATOM     32  HD1 HIS A   6      -1.524  -3.096   6.972  1.00  0.00           H  
ATOM     33  HD2 HIS A   6       2.191  -4.029   5.083  1.00  0.00           H  
ATOM     34  HE1 HIS A   6      -0.408  -5.111   8.145  1.00  0.00           H  
HETATM   35  N   DPN A   7      -1.289  -0.707   1.692  1.00  0.00           N  
HETATM   36  CA  DPN A   7      -1.514   0.612   1.040  1.00  0.00           C  
HETATM   37  C   DPN A   7      -0.286   0.949   0.132  1.00  0.00           C  
HETATM   38  O   DPN A   7       0.174   0.129  -0.671  1.00  0.00           O  
HETATM   39  CB  DPN A   7      -2.857   0.571   0.268  1.00  0.00           C  
HETATM   40  CG  DPN A   7      -3.341   1.935  -0.249  1.00  0.00           C  
HETATM   41  CD1 DPN A   7      -3.076   2.328  -1.566  1.00  0.00           C  
HETATM   42  CD2 DPN A   7      -4.029   2.807   0.602  1.00  0.00           C  
HETATM   43  CE1 DPN A   7      -3.488   3.578  -2.022  1.00  0.00           C  
HETATM   44  CE2 DPN A   7      -4.442   4.056   0.143  1.00  0.00           C  
HETATM   45  CZ  DPN A   7      -4.170   4.441  -1.168  1.00  0.00           C  
HETATM   46  H   DPN A   7      -1.024  -1.550   1.163  1.00  0.00           H  
HETATM   47  HA  DPN A   7      -1.605   1.396   1.823  1.00  0.00           H  
HETATM   48  HB2 DPN A   7      -2.764  -0.150  -0.565  1.00  0.00           H  
HETATM   49  HB3 DPN A   7      -3.648   0.138   0.913  1.00  0.00           H  
HETATM   50  HD1 DPN A   7      -2.541   1.670  -2.236  1.00  0.00           H  
HETATM   51  HD2 DPN A   7      -4.243   2.519   1.622  1.00  0.00           H  
HETATM   52  HE1 DPN A   7      -3.280   3.878  -3.039  1.00  0.00           H  
HETATM   53  HE2 DPN A   7      -4.973   4.727   0.805  1.00  0.00           H  
HETATM   54  HZ  DPN A   7      -4.494   5.410  -1.522  1.00  0.00           H  
ATOM     55  N   ARG A   8       0.280   2.156   0.304  1.00  0.00           N  
ATOM     56  CA  ARG A   8       1.569   2.566  -0.352  1.00  0.00           C  
ATOM     57  C   ARG A   8       2.820   1.624  -0.203  1.00  0.00           C  
ATOM     58  O   ARG A   8       3.605   1.446  -1.136  1.00  0.00           O  
ATOM     59  CB  ARG A   8       1.877   4.039   0.042  1.00  0.00           C  
ATOM     60  CG  ARG A   8       2.204   4.306   1.534  1.00  0.00           C  
ATOM     61  CD  ARG A   8       2.663   5.750   1.814  1.00  0.00           C  
ATOM     62  NE  ARG A   8       2.962   5.955   3.261  1.00  0.00           N  
ATOM     63  CZ  ARG A   8       4.110   5.647   3.872  1.00  0.00           C  
ATOM     64  NH1 ARG A   8       4.240   5.947   5.132  1.00  0.00           N  
ATOM     65  NH2 ARG A   8       5.114   5.055   3.275  1.00  0.00           N  
ATOM     66  H   ARG A   8      -0.279   2.796   0.873  1.00  0.00           H  
ATOM     67  HA  ARG A   8       1.372   2.566  -1.434  1.00  0.00           H  
ATOM     68  HB2 ARG A   8       2.718   4.392  -0.587  1.00  0.00           H  
ATOM     69  HB3 ARG A   8       1.024   4.674  -0.259  1.00  0.00           H  
ATOM     70  HG2 ARG A   8       1.317   4.069   2.151  1.00  0.00           H  
ATOM     71  HG3 ARG A   8       2.985   3.599   1.873  1.00  0.00           H  
ATOM     72  HD2 ARG A   8       3.524   6.032   1.173  1.00  0.00           H  
ATOM     73  HD3 ARG A   8       1.859   6.451   1.511  1.00  0.00           H  
ATOM     74  HE  ARG A   8       2.272   6.394   3.877  1.00  0.00           H  
ATOM     75 HH11 ARG A   8       5.129   5.710   5.576  1.00  0.00           H  
ATOM     76 HH12 ARG A   8       3.452   6.420   5.579  1.00  0.00           H  
ATOM     77 HH21 ARG A   8       5.951   4.834   3.817  1.00  0.00           H  
ATOM     78 HH22 ARG A   8       4.937   4.833   2.293  1.00  0.00           H  
ATOM     79  N   TRP A   9       2.941   1.005   0.973  1.00  0.00           N  
ATOM     80  CA  TRP A   9       3.890  -0.094   1.300  1.00  0.00           C  
ATOM     81  C   TRP A   9       3.935  -1.331   0.335  1.00  0.00           C  
ATOM     82  O   TRP A   9       4.992  -1.948   0.195  1.00  0.00           O  
ATOM     83  CB  TRP A   9       3.532  -0.576   2.734  1.00  0.00           C  
ATOM     84  CG  TRP A   9       3.597   0.459   3.871  1.00  0.00           C  
ATOM     85  CD1 TRP A   9       4.699   0.856   4.648  1.00  0.00           C  
ATOM     86  CD2 TRP A   9       2.551   1.244   4.283  1.00  0.00           C  
ATOM     87  NE1 TRP A   9       4.348   1.883   5.559  1.00  0.00           N  
ATOM     88  CE2 TRP A   9       3.001   2.106   5.305  1.00  0.00           C  
ATOM     89  CE3 TRP A   9       1.234   1.319   3.798  1.00  0.00           C  
ATOM     90  CZ2 TRP A   9       2.108   3.055   5.867  1.00  0.00           C  
ATOM     91  CZ3 TRP A   9       0.374   2.263   4.344  1.00  0.00           C  
ATOM     92  CH2 TRP A   9       0.797   3.120   5.371  1.00  0.00           C  
ATOM     93  H   TRP A   9       2.170   1.247   1.600  1.00  0.00           H  
ATOM     94  HA  TRP A   9       4.905   0.336   1.348  1.00  0.00           H  
ATOM     95  HB2 TRP A   9       2.526  -1.036   2.715  1.00  0.00           H  
ATOM     96  HB3 TRP A   9       4.166  -1.418   3.016  1.00  0.00           H  
ATOM     97  HD1 TRP A   9       5.692   0.442   4.535  1.00  0.00           H  
ATOM     98  HE1 TRP A   9       4.920   2.279   6.313  1.00  0.00           H  
ATOM     99  HE3 TRP A   9       0.934   0.659   2.999  1.00  0.00           H  
ATOM    100  HZ2 TRP A   9       2.434   3.719   6.654  1.00  0.00           H  
ATOM    101  HZ3 TRP A   9      -0.625   2.309   3.939  1.00  0.00           H  
ATOM    102  HH2 TRP A   9       0.103   3.836   5.781  1.00  0.00           H  
ATOM    103  N   ASP A  10       2.809  -1.696  -0.310  1.00  0.00           N  
ATOM    104  CA  ASP A  10       2.754  -2.794  -1.317  1.00  0.00           C  
ATOM    105  C   ASP A  10       3.576  -2.578  -2.635  1.00  0.00           C  
ATOM    106  O   ASP A  10       4.096  -3.530  -3.211  1.00  0.00           O  
ATOM    107  CB  ASP A  10       1.267  -3.098  -1.665  1.00  0.00           C  
ATOM    108  CG  ASP A  10       0.284  -3.482  -0.546  1.00  0.00           C  
ATOM    109  OD1 ASP A  10      -0.740  -2.821  -0.380  1.00  0.00           O  
ATOM    110  H   ASP A  10       2.017  -1.056  -0.158  1.00  0.00           H  
ATOM    111  HA  ASP A  10       3.192  -3.700  -0.857  1.00  0.00           H  
ATOM    112  HB2 ASP A  10       0.835  -2.218  -2.185  1.00  0.00           H  
ATOM    113  HB3 ASP A  10       1.219  -3.903  -2.421  1.00  0.00           H  
HETATM  114  N   NH2 A  11       3.723  -1.387  -3.185  1.00  0.00           N  
HETATM  115  HN1 NH2 A  11       4.371  -1.400  -3.975  1.00  0.00           H  
HETATM  116  HN2 NH2 A  11       3.463  -0.585  -2.599  1.00  0.00           H  
TER     117      NH2 A  11                                                      
ENDMDL                                                                          
MODEL        4                                                                  
HETATM    1  N   AC5 A   5       0.635  -4.609   0.260  1.00  0.00           N  
HETATM    2  O   AC5 A   5      -2.091  -4.728   2.874  1.00  0.00           O  
HETATM    3  CA  AC5 A   5      -0.323  -5.273   1.221  1.00  0.00           C  
HETATM    4  C   AC5 A   5      -1.029  -4.387   2.343  1.00  0.00           C  
HETATM    5  CB1 AC5 A   5      -1.371  -6.047   0.375  1.00  0.00           C  
HETATM    6  CB2 AC5 A   5       0.474  -6.428   1.902  1.00  0.00           C  
HETATM    7  CG1 AC5 A   5      -1.398  -7.498   0.866  1.00  0.00           C  
HETATM    8  CG2 AC5 A   5       0.059  -7.749   1.237  1.00  0.00           C  
HETATM    9  H   AC5 A   5       1.459  -5.112  -0.075  1.00  0.00           H  
HETATM   10 HB11 AC5 A   5      -1.105  -6.032  -0.698  1.00  0.00           H  
HETATM   11 HB12 AC5 A   5      -2.361  -5.560   0.425  1.00  0.00           H  
HETATM   12 HB21 AC5 A   5       0.228  -6.502   2.980  1.00  0.00           H  
HETATM   13 HB22 AC5 A   5       1.573  -6.289   1.889  1.00  0.00           H  
HETATM   14 HG11 AC5 A   5      -2.053  -7.596   1.755  1.00  0.00           H  
HETATM   15 HG12 AC5 A   5      -1.776  -8.204   0.103  1.00  0.00           H  
HETATM   16 HG21 AC5 A   5       0.668  -7.939   0.329  1.00  0.00           H  
HETATM   17 HG22 AC5 A   5       0.186  -8.623   1.903  1.00  0.00           H  
ATOM     18  N   HIS A   6      -0.404  -3.266   2.699  1.00  0.00           N  
ATOM     19  CA  HIS A   6      -0.971  -2.239   3.620  1.00  0.00           C  
ATOM     20  C   HIS A   6      -1.468  -0.897   2.970  1.00  0.00           C  
ATOM     21  O   HIS A   6      -1.947  -0.023   3.697  1.00  0.00           O  
ATOM     22  CB  HIS A   6       0.132  -1.968   4.682  1.00  0.00           C  
ATOM     23  CG  HIS A   6       0.351  -3.066   5.719  1.00  0.00           C  
ATOM     24  ND1 HIS A   6      -0.512  -3.358   6.755  1.00  0.00           N  
ATOM     25  CD2 HIS A   6       1.454  -3.929   5.756  1.00  0.00           C  
ATOM     26  CE1 HIS A   6       0.156  -4.407   7.331  1.00  0.00           C  
ATOM     27  NE2 HIS A   6       1.354  -4.829   6.809  1.00  0.00           N  
ATOM     28  H   HIS A   6       0.373  -3.110   2.055  1.00  0.00           H  
ATOM     29  HA  HIS A   6      -1.864  -2.634   4.135  1.00  0.00           H  
ATOM     30  HB2 HIS A   6       1.089  -1.720   4.186  1.00  0.00           H  
ATOM     31  HB3 HIS A   6      -0.106  -1.051   5.232  1.00  0.00           H  
ATOM     32  HD1 HIS A   6      -1.414  -2.936   6.996  1.00  0.00           H  
ATOM     33  HD2 HIS A   6       2.266  -3.892   5.051  1.00  0.00           H  
ATOM     34  HE1 HIS A   6      -0.256  -4.910   8.195  1.00  0.00           H  
HETATM   35  N   DPN A   7      -1.346  -0.702   1.645  1.00  0.00           N  
HETATM   36  CA  DPN A   7      -1.619   0.594   0.963  1.00  0.00           C  
HETATM   37  C   DPN A   7      -0.394   0.963   0.068  1.00  0.00           C  
HETATM   38  O   DPN A   7       0.020   0.201  -0.813  1.00  0.00           O  
HETATM   39  CB  DPN A   7      -2.943   0.480   0.168  1.00  0.00           C  
HETATM   40  CG  DPN A   7      -3.478   1.818  -0.372  1.00  0.00           C  
HETATM   41  CD1 DPN A   7      -4.235   2.657   0.453  1.00  0.00           C  
HETATM   42  CD2 DPN A   7      -3.189   2.220  -1.681  1.00  0.00           C  
HETATM   43  CE1 DPN A   7      -4.693   3.884  -0.025  1.00  0.00           C  
HETATM   44  CE2 DPN A   7      -3.645   3.447  -2.156  1.00  0.00           C  
HETATM   45  CZ  DPN A   7      -4.397   4.278  -1.327  1.00  0.00           C  
HETATM   46  H   DPN A   7      -1.064  -1.551   1.135  1.00  0.00           H  
HETATM   47  HA  DPN A   7      -1.766   1.389   1.723  1.00  0.00           H  
HETATM   48  HB2 DPN A   7      -2.799  -0.240  -0.656  1.00  0.00           H  
HETATM   49  HB3 DPN A   7      -3.727   0.015   0.801  1.00  0.00           H  
HETATM   50  HD1 DPN A   7      -4.469   2.364   1.466  1.00  0.00           H  
HETATM   51  HD2 DPN A   7      -2.599   1.588  -2.328  1.00  0.00           H  
HETATM   52  HE1 DPN A   7      -5.278   4.529   0.615  1.00  0.00           H  
HETATM   53  HE2 DPN A   7      -3.417   3.753  -3.166  1.00  0.00           H  
HETATM   54  HZ  DPN A   7      -4.754   5.228  -1.698  1.00  0.00           H  
ATOM     55  N   ARG A   8       0.210   2.133   0.332  1.00  0.00           N  
ATOM     56  CA  ARG A   8       1.483   2.590  -0.327  1.00  0.00           C  
ATOM     57  C   ARG A   8       2.685   1.576  -0.310  1.00  0.00           C  
ATOM     58  O   ARG A   8       3.358   1.324  -1.311  1.00  0.00           O  
ATOM     59  CB  ARG A   8       1.974   3.945   0.284  1.00  0.00           C  
ATOM     60  CG  ARG A   8       0.952   5.027   0.734  1.00  0.00           C  
ATOM     61  CD  ARG A   8       1.591   6.329   1.258  1.00  0.00           C  
ATOM     62  NE  ARG A   8       2.354   6.091   2.519  1.00  0.00           N  
ATOM     63  CZ  ARG A   8       3.160   6.972   3.112  1.00  0.00           C  
ATOM     64  NH1 ARG A   8       3.858   6.574   4.134  1.00  0.00           N  
ATOM     65  NH2 ARG A   8       3.284   8.216   2.722  1.00  0.00           N  
ATOM     66  H   ARG A   8      -0.311   2.717   0.989  1.00  0.00           H  
ATOM     67  HA  ARG A   8       1.251   2.741  -1.394  1.00  0.00           H  
ATOM     68  HB2 ARG A   8       2.605   3.726   1.166  1.00  0.00           H  
ATOM     69  HB3 ARG A   8       2.679   4.403  -0.438  1.00  0.00           H  
ATOM     70  HG2 ARG A   8       0.282   5.269  -0.113  1.00  0.00           H  
ATOM     71  HG3 ARG A   8       0.283   4.623   1.520  1.00  0.00           H  
ATOM     72  HD2 ARG A   8       2.242   6.752   0.467  1.00  0.00           H  
ATOM     73  HD3 ARG A   8       0.789   7.073   1.435  1.00  0.00           H  
ATOM     74  HE  ARG A   8       2.345   5.167   2.960  1.00  0.00           H  
ATOM     75 HH11 ARG A   8       4.475   7.259   4.572  1.00  0.00           H  
ATOM     76 HH12 ARG A   8       3.772   5.590   4.392  1.00  0.00           H  
ATOM     77 HH21 ARG A   8       3.922   8.829   3.235  1.00  0.00           H  
ATOM     78 HH22 ARG A   8       2.698   8.466   1.923  1.00  0.00           H  
ATOM     79  N   TRP A   9       2.893   1.003   0.878  1.00  0.00           N  
ATOM     80  CA  TRP A   9       3.914  -0.018   1.225  1.00  0.00           C  
ATOM     81  C   TRP A   9       3.961  -1.326   0.363  1.00  0.00           C  
ATOM     82  O   TRP A   9       5.017  -1.958   0.275  1.00  0.00           O  
ATOM     83  CB  TRP A   9       3.661  -0.362   2.724  1.00  0.00           C  
ATOM     84  CG  TRP A   9       3.679   0.800   3.742  1.00  0.00           C  
ATOM     85  CD1 TRP A   9       4.784   1.426   4.349  1.00  0.00           C  
ATOM     86  CD2 TRP A   9       2.588   1.556   4.097  1.00  0.00           C  
ATOM     87  NE1 TRP A   9       4.393   2.568   5.090  1.00  0.00           N  
ATOM     88  CE2 TRP A   9       3.017   2.630   4.908  1.00  0.00           C  
ATOM     89  CE3 TRP A   9       1.249   1.464   3.671  1.00  0.00           C  
ATOM     90  CZ2 TRP A   9       2.086   3.626   5.304  1.00  0.00           C  
ATOM     91  CZ3 TRP A   9       0.350   2.444   4.072  1.00  0.00           C  
ATOM     92  CH2 TRP A   9       0.758   3.512   4.882  1.00  0.00           C  
ATOM     93  H   TRP A   9       2.213   1.318   1.574  1.00  0.00           H  
ATOM     94  HA  TRP A   9       4.906   0.462   1.165  1.00  0.00           H  
ATOM     95  HB2 TRP A   9       2.699  -0.902   2.808  1.00  0.00           H  
ATOM     96  HB3 TRP A   9       4.377  -1.114   3.054  1.00  0.00           H  
ATOM     97  HD1 TRP A   9       5.807   1.107   4.204  1.00  0.00           H  
ATOM     98  HE1 TRP A   9       4.983   3.156   5.692  1.00  0.00           H  
ATOM     99  HE3 TRP A   9       0.968   0.670   2.996  1.00  0.00           H  
ATOM    100  HZ2 TRP A   9       2.393   4.467   5.905  1.00  0.00           H  
ATOM    101  HZ3 TRP A   9      -0.668   2.355   3.725  1.00  0.00           H  
ATOM    102  HH2 TRP A   9       0.035   4.259   5.179  1.00  0.00           H  
ATOM    103  N   ASP A  10       2.841  -1.725  -0.269  1.00  0.00           N  
ATOM    104  CA  ASP A  10       2.801  -2.839  -1.260  1.00  0.00           C  
ATOM    105  C   ASP A  10       3.625  -2.630  -2.578  1.00  0.00           C  
ATOM    106  O   ASP A  10       4.176  -3.578  -3.128  1.00  0.00           O  
ATOM    107  CB  ASP A  10       1.317  -3.158  -1.608  1.00  0.00           C  
ATOM    108  CG  ASP A  10       0.340  -3.529  -0.482  1.00  0.00           C  
ATOM    109  OD1 ASP A  10      -0.674  -2.855  -0.305  1.00  0.00           O  
ATOM    110  H   ASP A  10       2.066  -1.056  -0.165  1.00  0.00           H  
ATOM    111  HA  ASP A  10       3.245  -3.734  -0.784  1.00  0.00           H  
ATOM    112  HB2 ASP A  10       0.880  -2.292  -2.143  1.00  0.00           H  
ATOM    113  HB3 ASP A  10       1.279  -3.978  -2.350  1.00  0.00           H  
HETATM  114  N   NH2 A  11       3.738  -1.447  -3.156  1.00  0.00           N  
HETATM  115  HN1 NH2 A  11       4.388  -1.459  -3.944  1.00  0.00           H  
HETATM  116  HN2 NH2 A  11       3.444  -0.637  -2.595  1.00  0.00           H  
TER     117      NH2 A  11                                                      
ENDMDL                                                                          
MODEL        5                                                                  
HETATM    1  N   AC5 A   5       0.666  -4.651   0.260  1.00  0.00           N  
HETATM    2  O   AC5 A   5      -1.926  -4.847   3.017  1.00  0.00           O  
HETATM    3  CA  AC5 A   5      -0.253  -5.327   1.254  1.00  0.00           C  
HETATM    4  C   AC5 A   5      -0.921  -4.461   2.411  1.00  0.00           C  
HETATM    5  CB1 AC5 A   5      -1.314  -6.124   0.443  1.00  0.00           C  
HETATM    6  CB2 AC5 A   5       0.589  -6.462   1.910  1.00  0.00           C  
HETATM    7  CG1 AC5 A   5      -1.213  -7.601   0.841  1.00  0.00           C  
HETATM    8  CG2 AC5 A   5       0.266  -7.768   1.172  1.00  0.00           C  
HETATM    9  H   AC5 A   5       1.476  -5.153  -0.107  1.00  0.00           H  
HETATM   10 HB11 AC5 A   5      -1.144  -6.026  -0.645  1.00  0.00           H  
HETATM   11 HB12 AC5 A   5      -2.328  -5.717   0.602  1.00  0.00           H  
HETATM   12 HB21 AC5 A   5       0.308  -6.600   2.975  1.00  0.00           H  
HETATM   13 HB22 AC5 A   5       1.675  -6.249   1.946  1.00  0.00           H  
HETATM   14 HG11 AC5 A   5      -1.839  -7.805   1.732  1.00  0.00           H  
HETATM   15 HG12 AC5 A   5      -1.554  -8.286   0.042  1.00  0.00           H  
HETATM   16 HG21 AC5 A   5       0.870  -7.860   0.247  1.00  0.00           H  
HETATM   17 HG22 AC5 A   5       0.468  -8.668   1.785  1.00  0.00           H  
ATOM     18  N   HIS A   6      -0.315  -3.314   2.723  1.00  0.00           N  
ATOM     19  CA  HIS A   6      -0.845  -2.320   3.707  1.00  0.00           C  
ATOM     20  C   HIS A   6      -1.333  -0.941   3.120  1.00  0.00           C  
ATOM     21  O   HIS A   6      -1.777  -0.077   3.880  1.00  0.00           O  
ATOM     22  CB  HIS A   6       0.283  -2.173   4.772  1.00  0.00           C  
ATOM     23  CG  HIS A   6      -0.166  -1.719   6.152  1.00  0.00           C  
ATOM     24  ND1 HIS A   6      -0.199  -0.416   6.595  1.00  0.00           N  
ATOM     25  CD2 HIS A   6      -0.539  -2.587   7.183  1.00  0.00           C  
ATOM     26  CE1 HIS A   6      -0.636  -0.613   7.879  1.00  0.00           C  
ATOM     27  NE2 HIS A   6      -0.861  -1.888   8.338  1.00  0.00           N  
ATOM     28  H   HIS A   6       0.364  -3.132   1.977  1.00  0.00           H  
ATOM     29  HA  HIS A   6      -1.743  -2.734   4.202  1.00  0.00           H  
ATOM     30  HB2 HIS A   6       0.820  -3.131   4.916  1.00  0.00           H  
ATOM     31  HB3 HIS A   6       1.066  -1.490   4.412  1.00  0.00           H  
ATOM     32  HD1 HIS A   6      -0.081   0.451   6.059  1.00  0.00           H  
ATOM     33  HD2 HIS A   6      -0.551  -3.661   7.071  1.00  0.00           H  
ATOM     34  HE1 HIS A   6      -0.820   0.231   8.530  1.00  0.00           H  
HETATM   35  N   DPN A   7      -1.246  -0.709   1.798  1.00  0.00           N  
HETATM   36  CA  DPN A   7      -1.493   0.612   1.158  1.00  0.00           C  
HETATM   37  C   DPN A   7      -0.309   0.940   0.191  1.00  0.00           C  
HETATM   38  O   DPN A   7       0.127   0.107  -0.612  1.00  0.00           O  
HETATM   39  CB  DPN A   7      -2.874   0.584   0.458  1.00  0.00           C  
HETATM   40  CG  DPN A   7      -3.375   1.957  -0.022  1.00  0.00           C  
HETATM   41  CD1 DPN A   7      -3.178   2.359  -1.348  1.00  0.00           C  
HETATM   42  CD2 DPN A   7      -4.008   2.827   0.873  1.00  0.00           C  
HETATM   43  CE1 DPN A   7      -3.604   3.617  -1.771  1.00  0.00           C  
HETATM   44  CE2 DPN A   7      -4.434   4.084   0.448  1.00  0.00           C  
HETATM   45  CZ  DPN A   7      -4.231   4.478  -0.873  1.00  0.00           C  
HETATM   46  H   DPN A   7      -0.986  -1.547   1.258  1.00  0.00           H  
HETATM   47  HA  DPN A   7      -1.537   1.395   1.946  1.00  0.00           H  
HETATM   48  HB2 DPN A   7      -2.833  -0.130  -0.384  1.00  0.00           H  
HETATM   49  HB3 DPN A   7      -3.633   0.152   1.141  1.00  0.00           H  
HETATM   50  HD1 DPN A   7      -2.685   1.703  -2.051  1.00  0.00           H  
HETATM   51  HD2 DPN A   7      -4.170   2.532   1.901  1.00  0.00           H  
HETATM   52  HE1 DPN A   7      -3.447   3.923  -2.794  1.00  0.00           H  
HETATM   53  HE2 DPN A   7      -4.924   4.753   1.141  1.00  0.00           H  
HETATM   54  HZ  DPN A   7      -4.563   5.452  -1.204  1.00  0.00           H  
ATOM     55  N   ARG A   8       0.257   2.153   0.316  1.00  0.00           N  
ATOM     56  CA  ARG A   8       1.532   2.548  -0.374  1.00  0.00           C  
ATOM     57  C   ARG A   8       2.787   1.612  -0.225  1.00  0.00           C  
ATOM     58  O   ARG A   8       3.554   1.407  -1.167  1.00  0.00           O  
ATOM     59  CB  ARG A   8       1.850   4.029  -0.019  1.00  0.00           C  
ATOM     60  CG  ARG A   8       2.182   4.332   1.466  1.00  0.00           C  
ATOM     61  CD  ARG A   8       2.693   5.765   1.707  1.00  0.00           C  
ATOM     62  NE  ARG A   8       2.986   6.002   3.151  1.00  0.00           N  
ATOM     63  CZ  ARG A   8       4.107   5.653   3.788  1.00  0.00           C  
ATOM     64  NH1 ARG A   8       5.089   4.996   3.223  1.00  0.00           N  
ATOM     65  NH2 ARG A   8       4.233   5.980   5.042  1.00  0.00           N  
ATOM     66  H   ARG A   8      -0.288   2.805   0.887  1.00  0.00           H  
ATOM     67  HA  ARG A   8       1.316   2.521  -1.452  1.00  0.00           H  
ATOM     68  HB2 ARG A   8       2.691   4.361  -0.659  1.00  0.00           H  
ATOM     69  HB3 ARG A   8       0.999   4.662  -0.332  1.00  0.00           H  
ATOM     70  HG2 ARG A   8       1.283   4.145   2.085  1.00  0.00           H  
ATOM     71  HG3 ARG A   8       2.934   3.609   1.831  1.00  0.00           H  
ATOM     72  HD2 ARG A   8       3.572   5.994   1.068  1.00  0.00           H  
ATOM     73  HD3 ARG A   8       1.921   6.488   1.373  1.00  0.00           H  
ATOM     74  HE  ARG A   8       2.310   6.495   3.744  1.00  0.00           H  
ATOM     75 HH11 ARG A   8       4.917   4.759   2.244  1.00  0.00           H  
ATOM     76 HH12 ARG A   8       5.904   4.747   3.784  1.00  0.00           H  
ATOM     77 HH21 ARG A   8       3.463   6.502   5.464  1.00  0.00           H  
ATOM     78 HH22 ARG A   8       5.101   5.710   5.506  1.00  0.00           H  
ATOM     79  N   TRP A   9       2.929   1.024   0.965  1.00  0.00           N  
ATOM     80  CA  TRP A   9       3.881  -0.069   1.308  1.00  0.00           C  
ATOM     81  C   TRP A   9       3.937  -1.315   0.358  1.00  0.00           C  
ATOM     82  O   TRP A   9       5.004  -1.918   0.217  1.00  0.00           O  
ATOM     83  CB  TRP A   9       3.511  -0.530   2.747  1.00  0.00           C  
ATOM     84  CG  TRP A   9       3.602   0.514   3.875  1.00  0.00           C  
ATOM     85  CD1 TRP A   9       4.708   0.869   4.667  1.00  0.00           C  
ATOM     86  CD2 TRP A   9       2.576   1.325   4.289  1.00  0.00           C  
ATOM     87  NE1 TRP A   9       4.379   1.891   5.590  1.00  0.00           N  
ATOM     88  CE2 TRP A   9       3.041   2.154   5.331  1.00  0.00           C  
ATOM     89  CE3 TRP A   9       1.261   1.435   3.807  1.00  0.00           C  
ATOM     90  CZ2 TRP A   9       2.162   3.103   5.916  1.00  0.00           C  
ATOM     91  CZ3 TRP A   9       0.417   2.380   4.375  1.00  0.00           C  
ATOM     92  CH2 TRP A   9       0.855   3.203   5.422  1.00  0.00           C  
ATOM     93  H   TRP A   9       2.166   1.279   1.596  1.00  0.00           H  
ATOM     94  HA  TRP A   9       4.895   0.365   1.358  1.00  0.00           H  
ATOM     95  HB2 TRP A   9       2.496  -0.970   2.732  1.00  0.00           H  
ATOM     96  HB3 TRP A   9       4.128  -1.382   3.038  1.00  0.00           H  
ATOM     97  HD1 TRP A   9       5.685   0.417   4.563  1.00  0.00           H  
ATOM     98  HE1 TRP A   9       4.952   2.251   6.362  1.00  0.00           H  
ATOM     99  HE3 TRP A   9       0.947   0.791   3.000  1.00  0.00           H  
ATOM    100  HZ2 TRP A   9       2.500   3.739   6.722  1.00  0.00           H  
ATOM    101  HZ3 TRP A   9      -0.583   2.447   3.978  1.00  0.00           H  
ATOM    102  HH2 TRP A   9       0.172   3.920   5.852  1.00  0.00           H  
ATOM    103  N   ASP A  10       2.814  -1.707  -0.277  1.00  0.00           N  
ATOM    104  CA  ASP A  10       2.775  -2.814  -1.276  1.00  0.00           C  
ATOM    105  C   ASP A  10       3.571  -2.588  -2.607  1.00  0.00           C  
ATOM    106  O   ASP A  10       4.092  -3.532  -3.194  1.00  0.00           O  
ATOM    107  CB  ASP A  10       1.291  -3.163  -1.598  1.00  0.00           C  
ATOM    108  CG  ASP A  10       0.346  -3.560  -0.452  1.00  0.00           C  
ATOM    109  OD1 ASP A  10      -0.660  -2.890  -0.230  1.00  0.00           O  
ATOM    110  H   ASP A  10       2.009  -1.086  -0.125  1.00  0.00           H  
ATOM    111  HA  ASP A  10       3.244  -3.706  -0.815  1.00  0.00           H  
ATOM    112  HB2 ASP A  10       0.827  -2.302  -2.120  1.00  0.00           H  
ATOM    113  HB3 ASP A  10       1.255  -3.979  -2.346  1.00  0.00           H  
HETATM  114  N   NH2 A  11       3.695  -1.393  -3.159  1.00  0.00           N  
HETATM  115  HN1 NH2 A  11       4.330  -1.399  -3.960  1.00  0.00           H  
HETATM  116  HN2 NH2 A  11       3.439  -0.596  -2.567  1.00  0.00           H  
TER     117      NH2 A  11                                                      
ENDMDL                                                                          
MODEL        6                                                                  
HETATM    1  N   AC5 A   5       0.655  -4.605   0.246  1.00  0.00           N  
HETATM    2  O   AC5 A   5      -2.068  -4.789   2.863  1.00  0.00           O  
HETATM    3  CA  AC5 A   5      -0.299  -5.289   1.198  1.00  0.00           C  
HETATM    4  C   AC5 A   5      -1.010  -4.429   2.335  1.00  0.00           C  
HETATM    5  CB1 AC5 A   5      -1.340  -6.058   0.340  1.00  0.00           C  
HETATM    6  CB2 AC5 A   5       0.509  -6.450   1.859  1.00  0.00           C  
HETATM    7  CG1 AC5 A   5      -1.353  -7.517   0.805  1.00  0.00           C  
HETATM    8  CG2 AC5 A   5       0.107  -7.761   1.169  1.00  0.00           C  
HETATM    9  H   AC5 A   5       1.472  -5.107  -0.107  1.00  0.00           H  
HETATM   10 HB11 AC5 A   5      -1.078  -6.018  -0.733  1.00  0.00           H  
HETATM   11 HB12 AC5 A   5      -2.335  -5.583   0.402  1.00  0.00           H  
HETATM   12 HB21 AC5 A   5       0.259  -6.545   2.936  1.00  0.00           H  
HETATM   13 HB22 AC5 A   5       1.606  -6.300   1.851  1.00  0.00           H  
HETATM   14 HG11 AC5 A   5      -2.005  -7.639   1.691  1.00  0.00           H  
HETATM   15 HG12 AC5 A   5      -1.723  -8.213   0.026  1.00  0.00           H  
HETATM   16 HG21 AC5 A   5       0.717  -7.928   0.259  1.00  0.00           H  
HETATM   17 HG22 AC5 A   5       0.242  -8.647   1.819  1.00  0.00           H  
ATOM     18  N   HIS A   6      -0.395  -3.308   2.708  1.00  0.00           N  
ATOM     19  CA  HIS A   6      -0.969  -2.304   3.653  1.00  0.00           C  
ATOM     20  C   HIS A   6      -1.452  -0.941   3.034  1.00  0.00           C  
ATOM     21  O   HIS A   6      -1.938  -0.086   3.779  1.00  0.00           O  
ATOM     22  CB  HIS A   6       0.122  -2.069   4.735  1.00  0.00           C  
ATOM     23  CG  HIS A   6       0.325  -3.199   5.740  1.00  0.00           C  
ATOM     24  ND1 HIS A   6      -0.552  -3.519   6.756  1.00  0.00           N  
ATOM     25  CD2 HIS A   6       1.424  -4.065   5.766  1.00  0.00           C  
ATOM     26  CE1 HIS A   6       0.105  -4.589   7.308  1.00  0.00           C  
ATOM     27  NE2 HIS A   6       1.309  -4.998   6.789  1.00  0.00           N  
ATOM     28  H   HIS A   6       0.379  -3.132   2.068  1.00  0.00           H  
ATOM     29  HA  HIS A   6      -1.871  -2.708   4.146  1.00  0.00           H  
ATOM     30  HB2 HIS A   6       1.086  -1.808   4.259  1.00  0.00           H  
ATOM     31  HB3 HIS A   6      -0.121  -1.168   5.309  1.00  0.00           H  
ATOM     32  HD1 HIS A   6      -1.455  -3.102   6.999  1.00  0.00           H  
ATOM     33  HD2 HIS A   6       2.246  -4.007   5.071  1.00  0.00           H  
ATOM     34  HE1 HIS A   6      -0.319  -5.117   8.151  1.00  0.00           H  
HETATM   35  N   DPN A   7      -1.307  -0.708   1.718  1.00  0.00           N  
HETATM   36  CA  DPN A   7      -1.540   0.613   1.073  1.00  0.00           C  
HETATM   37  C   DPN A   7      -0.317   0.955   0.159  1.00  0.00           C  
HETATM   38  O   DPN A   7       0.132   0.142  -0.657  1.00  0.00           O  
HETATM   39  CB  DPN A   7      -2.886   0.569   0.307  1.00  0.00           C  
HETATM   40  CG  DPN A   7      -3.377   1.935  -0.202  1.00  0.00           C  
HETATM   41  CD1 DPN A   7      -3.120   2.333  -1.519  1.00  0.00           C  
HETATM   42  CD2 DPN A   7      -4.063   2.801   0.656  1.00  0.00           C  
HETATM   43  CE1 DPN A   7      -3.541   3.583  -1.968  1.00  0.00           C  
HETATM   44  CE2 DPN A   7      -4.484   4.051   0.204  1.00  0.00           C  
HETATM   45  CZ  DPN A   7      -4.221   4.441  -1.107  1.00  0.00           C  
HETATM   46  H   DPN A   7      -1.028  -1.545   1.186  1.00  0.00           H  
HETATM   47  HA  DPN A   7      -1.630   1.394   1.856  1.00  0.00           H  
HETATM   48  HB2 DPN A   7      -2.796  -0.147  -0.528  1.00  0.00           H  
HETATM   49  HB3 DPN A   7      -3.673   0.132   0.954  1.00  0.00           H  
HETATM   50  HD1 DPN A   7      -2.587   1.679  -2.194  1.00  0.00           H  
HETATM   51  HD2 DPN A   7      -4.271   2.510   1.676  1.00  0.00           H  
HETATM   52  HE1 DPN A   7      -3.339   3.887  -2.985  1.00  0.00           H  
HETATM   53  HE2 DPN A   7      -5.014   4.717   0.869  1.00  0.00           H  
HETATM   54  HZ  DPN A   7      -4.549   5.409  -1.458  1.00  0.00           H  
ATOM     55  N   ARG A   8       0.253   2.159   0.335  1.00  0.00           N  
ATOM     56  CA  ARG A   8       1.529   2.575  -0.342  1.00  0.00           C  
ATOM     57  C   ARG A   8       2.792   1.652  -0.202  1.00  0.00           C  
ATOM     58  O   ARG A   8       3.588   1.506  -1.131  1.00  0.00           O  
ATOM     59  CB  ARG A   8       1.828   4.054   0.027  1.00  0.00           C  
ATOM     60  CG  ARG A   8       2.199   4.352   1.507  1.00  0.00           C  
ATOM     61  CD  ARG A   8       2.579   5.815   1.807  1.00  0.00           C  
ATOM     62  NE  ARG A   8       3.938   6.124   1.277  1.00  0.00           N  
ATOM     63  CZ  ARG A   8       4.556   7.300   1.377  1.00  0.00           C  
ATOM     64  NH1 ARG A   8       5.748   7.415   0.866  1.00  0.00           N  
ATOM     65  NH2 ARG A   8       4.031   8.349   1.963  1.00  0.00           N  
ATOM     66  H   ARG A   8      -0.293   2.793   0.923  1.00  0.00           H  
ATOM     67  HA  ARG A   8       1.318   2.556  -1.420  1.00  0.00           H  
ATOM     68  HB2 ARG A   8       2.644   4.410  -0.631  1.00  0.00           H  
ATOM     69  HB3 ARG A   8       0.958   4.675  -0.258  1.00  0.00           H  
ATOM     70  HG2 ARG A   8       1.331   4.082   2.139  1.00  0.00           H  
ATOM     71  HG3 ARG A   8       3.007   3.676   1.851  1.00  0.00           H  
ATOM     72  HD2 ARG A   8       1.813   6.498   1.386  1.00  0.00           H  
ATOM     73  HD3 ARG A   8       2.557   5.966   2.907  1.00  0.00           H  
ATOM     74  HE  ARG A   8       4.478   5.400   0.795  1.00  0.00           H  
ATOM     75 HH11 ARG A   8       6.209   8.323   0.951  1.00  0.00           H  
ATOM     76 HH12 ARG A   8       6.141   6.585   0.414  1.00  0.00           H  
ATOM     77 HH21 ARG A   8       4.574   9.213   1.996  1.00  0.00           H  
ATOM     78 HH22 ARG A   8       3.098   8.191   2.342  1.00  0.00           H  
ATOM     79  N   TRP A   9       2.916   1.014   0.962  1.00  0.00           N  
ATOM     80  CA  TRP A   9       3.909  -0.049   1.285  1.00  0.00           C  
ATOM     81  C   TRP A   9       3.970  -1.295   0.336  1.00  0.00           C  
ATOM     82  O   TRP A   9       5.038  -1.894   0.193  1.00  0.00           O  
ATOM     83  CB  TRP A   9       3.607  -0.515   2.738  1.00  0.00           C  
ATOM     84  CG  TRP A   9       3.668   0.550   3.846  1.00  0.00           C  
ATOM     85  CD1 TRP A   9       4.792   1.055   4.528  1.00  0.00           C  
ATOM     86  CD2 TRP A   9       2.609   1.318   4.262  1.00  0.00           C  
ATOM     87  NE1 TRP A   9       4.442   2.131   5.376  1.00  0.00           N  
ATOM     88  CE2 TRP A   9       3.074   2.281   5.182  1.00  0.00           C  
ATOM     89  CE3 TRP A   9       1.273   1.327   3.819  1.00  0.00           C  
ATOM     90  CZ2 TRP A   9       2.186   3.270   5.676  1.00  0.00           C  
ATOM     91  CZ3 TRP A   9       0.413   2.301   4.311  1.00  0.00           C  
ATOM     92  CH2 TRP A   9       0.857   3.259   5.233  1.00  0.00           C  
ATOM     93  H   TRP A   9       2.154   1.248   1.603  1.00  0.00           H  
ATOM     94  HA  TRP A   9       4.911   0.415   1.294  1.00  0.00           H  
ATOM     95  HB2 TRP A   9       2.616  -1.011   2.757  1.00  0.00           H  
ATOM     96  HB3 TRP A   9       4.278  -1.326   3.019  1.00  0.00           H  
ATOM     97  HD1 TRP A   9       5.802   0.706   4.361  1.00  0.00           H  
ATOM     98  HE1 TRP A   9       5.057   2.699   5.972  1.00  0.00           H  
ATOM     99  HE3 TRP A   9       0.968   0.612   3.072  1.00  0.00           H  
ATOM    100  HZ2 TRP A   9       2.532   4.025   6.367  1.00  0.00           H  
ATOM    101  HZ3 TRP A   9      -0.599   2.296   3.938  1.00  0.00           H  
ATOM    102  HH2 TRP A   9       0.166   4.007   5.596  1.00  0.00           H  
ATOM    103  N   ASP A  10       2.846  -1.689  -0.296  1.00  0.00           N  
ATOM    104  CA  ASP A  10       2.802  -2.807  -1.285  1.00  0.00           C  
ATOM    105  C   ASP A  10       3.614  -2.606  -2.610  1.00  0.00           C  
ATOM    106  O   ASP A  10       4.149  -3.560  -3.166  1.00  0.00           O  
ATOM    107  CB  ASP A  10       1.316  -3.134  -1.615  1.00  0.00           C  
ATOM    108  CG  ASP A  10       0.354  -3.515  -0.478  1.00  0.00           C  
ATOM    109  OD1 ASP A  10      -0.657  -2.844  -0.280  1.00  0.00           O  
ATOM    110  H   ASP A  10       2.042  -1.071  -0.134  1.00  0.00           H  
ATOM    111  HA  ASP A  10       3.252  -3.700  -0.809  1.00  0.00           H  
ATOM    112  HB2 ASP A  10       0.867  -2.269  -2.142  1.00  0.00           H  
ATOM    113  HB3 ASP A  10       1.273  -3.951  -2.359  1.00  0.00           H  
HETATM  114  N   NH2 A  11       3.733  -1.425  -3.188  1.00  0.00           N  
HETATM  115  HN1 NH2 A  11       4.380  -1.443  -3.981  1.00  0.00           H  
HETATM  116  HN2 NH2 A  11       3.455  -0.617  -2.620  1.00  0.00           H  
TER     117      NH2 A  11                                                      
ENDMDL                                                                          
MODEL        7                                                                  
HETATM    1  N   AC5 A   5       0.802  -4.615   0.103  1.00  0.00           N  
HETATM    2  O   AC5 A   5      -2.317  -4.836   2.008  1.00  0.00           O  
HETATM    3  CA  AC5 A   5      -0.023  -5.317   1.148  1.00  0.00           C  
HETATM    4  C   AC5 A   5      -1.143  -4.475   1.898  1.00  0.00           C  
HETATM    5  CB1 AC5 A   5      -0.572  -6.613   0.534  1.00  0.00           C  
HETATM    6  CB2 AC5 A   5       0.991  -5.934   2.156  1.00  0.00           C  
HETATM    7  CG1 AC5 A   5       0.548  -7.664   0.476  1.00  0.00           C  
HETATM    8  CG2 AC5 A   5       1.483  -7.298   1.631  1.00  0.00           C  
HETATM    9  H   AC5 A   5       1.722  -4.995  -0.117  1.00  0.00           H  
HETATM   10 HB11 AC5 A   5      -1.027  -6.393  -0.445  1.00  0.00           H  
HETATM   11 HB12 AC5 A   5      -1.376  -6.989   1.185  1.00  0.00           H  
HETATM   12 HB21 AC5 A   5       0.494  -6.104   3.131  1.00  0.00           H  
HETATM   13 HB22 AC5 A   5       1.831  -5.250   2.394  1.00  0.00           H  
HETATM   14 HG11 AC5 A   5       0.156  -8.698   0.555  1.00  0.00           H  
HETATM   15 HG12 AC5 A   5       1.084  -7.602  -0.490  1.00  0.00           H  
HETATM   16 HG21 AC5 A   5       2.532  -7.241   1.282  1.00  0.00           H  
HETATM   17 HG22 AC5 A   5       1.461  -8.066   2.429  1.00  0.00           H  
ATOM     18  N   HIS A   6      -0.694  -3.348   2.442  1.00  0.00           N  
ATOM     19  CA  HIS A   6      -1.470  -2.488   3.375  1.00  0.00           C  
ATOM     20  C   HIS A   6      -1.463  -0.957   3.042  1.00  0.00           C  
ATOM     21  O   HIS A   6      -1.448  -0.109   3.939  1.00  0.00           O  
ATOM     22  CB  HIS A   6      -1.007  -2.856   4.811  1.00  0.00           C  
ATOM     23  CG  HIS A   6       0.477  -2.794   5.185  1.00  0.00           C  
ATOM     24  ND1 HIS A   6       1.327  -3.881   5.233  1.00  0.00           N  
ATOM     25  CD2 HIS A   6       1.148  -1.648   5.597  1.00  0.00           C  
ATOM     26  CE1 HIS A   6       2.466  -3.269   5.689  1.00  0.00           C  
ATOM     27  NE2 HIS A   6       2.466  -1.920   5.934  1.00  0.00           N  
ATOM     28  H   HIS A   6       0.319  -3.340   2.348  1.00  0.00           H  
ATOM     29  HA  HIS A   6      -2.545  -2.753   3.322  1.00  0.00           H  
ATOM     30  HB2 HIS A   6      -1.564  -2.205   5.495  1.00  0.00           H  
ATOM     31  HB3 HIS A   6      -1.367  -3.869   5.026  1.00  0.00           H  
ATOM     32  HD1 HIS A   6       1.117  -4.878   5.126  1.00  0.00           H  
ATOM     33  HD2 HIS A   6       0.666  -0.689   5.646  1.00  0.00           H  
ATOM     34  HE1 HIS A   6       3.359  -3.849   5.886  1.00  0.00           H  
HETATM   35  N   DPN A   7      -1.542  -0.611   1.748  1.00  0.00           N  
HETATM   36  CA  DPN A   7      -1.543   0.791   1.249  1.00  0.00           C  
HETATM   37  C   DPN A   7      -0.362   1.014   0.247  1.00  0.00           C  
HETATM   38  O   DPN A   7      -0.025   0.153  -0.573  1.00  0.00           O  
HETATM   39  CB  DPN A   7      -2.940   1.089   0.639  1.00  0.00           C  
HETATM   40  CG  DPN A   7      -3.199   2.574   0.329  1.00  0.00           C  
HETATM   41  CD1 DPN A   7      -3.576   3.450   1.351  1.00  0.00           C  
HETATM   42  CD2 DPN A   7      -3.024   3.066  -0.969  1.00  0.00           C  
HETATM   43  CE1 DPN A   7      -3.771   4.803   1.080  1.00  0.00           C  
HETATM   44  CE2 DPN A   7      -3.220   4.419  -1.238  1.00  0.00           C  
HETATM   45  CZ  DPN A   7      -3.593   5.287  -0.215  1.00  0.00           C  
HETATM   46  H   DPN A   7      -1.401  -1.425   1.141  1.00  0.00           H  
HETATM   47  HA  DPN A   7      -1.409   1.483   2.105  1.00  0.00           H  
HETATM   48  HB2 DPN A   7      -3.081   0.470  -0.267  1.00  0.00           H  
HETATM   49  HB3 DPN A   7      -3.732   0.736   1.328  1.00  0.00           H  
HETATM   50  HD1 DPN A   7      -3.714   3.089   2.361  1.00  0.00           H  
HETATM   51  HD2 DPN A   7      -2.726   2.405  -1.771  1.00  0.00           H  
HETATM   52  HE1 DPN A   7      -4.065   5.478   1.872  1.00  0.00           H  
HETATM   53  HE2 DPN A   7      -3.083   4.795  -2.242  1.00  0.00           H  
HETATM   54  HZ  DPN A   7      -3.748   6.335  -0.424  1.00  0.00           H  
ATOM     55  N   ARG A   8       0.300   2.180   0.357  1.00  0.00           N  
ATOM     56  CA  ARG A   8       1.551   2.500  -0.411  1.00  0.00           C  
ATOM     57  C   ARG A   8       2.753   1.490  -0.337  1.00  0.00           C  
ATOM     58  O   ARG A   8       3.474   1.270  -1.312  1.00  0.00           O  
ATOM     59  CB  ARG A   8       1.968   3.957  -0.058  1.00  0.00           C  
ATOM     60  CG  ARG A   8       2.530   4.186   1.369  1.00  0.00           C  
ATOM     61  CD  ARG A   8       2.894   5.644   1.675  1.00  0.00           C  
ATOM     62  NE  ARG A   8       3.471   5.697   3.047  1.00  0.00           N  
ATOM     63  CZ  ARG A   8       3.892   6.798   3.668  1.00  0.00           C  
ATOM     64  NH1 ARG A   8       4.401   6.676   4.859  1.00  0.00           N  
ATOM     65  NH2 ARG A   8       3.825   7.998   3.144  1.00  0.00           N  
ATOM     66  H   ARG A   8      -0.155   2.859   0.972  1.00  0.00           H  
ATOM     67  HA  ARG A   8       1.269   2.495  -1.474  1.00  0.00           H  
ATOM     68  HB2 ARG A   8       2.725   4.286  -0.794  1.00  0.00           H  
ATOM     69  HB3 ARG A   8       1.104   4.630  -0.227  1.00  0.00           H  
ATOM     70  HG2 ARG A   8       1.789   3.825   2.108  1.00  0.00           H  
ATOM     71  HG3 ARG A   8       3.423   3.544   1.505  1.00  0.00           H  
ATOM     72  HD2 ARG A   8       3.623   6.018   0.925  1.00  0.00           H  
ATOM     73  HD3 ARG A   8       1.990   6.284   1.595  1.00  0.00           H  
ATOM     74  HE  ARG A   8       3.588   4.837   3.591  1.00  0.00           H  
ATOM     75 HH11 ARG A   8       4.722   7.529   5.320  1.00  0.00           H  
ATOM     76 HH12 ARG A   8       4.461   5.729   5.238  1.00  0.00           H  
ATOM     77 HH21 ARG A   8       4.171   8.790   3.687  1.00  0.00           H  
ATOM     78 HH22 ARG A   8       3.418   8.020   2.207  1.00  0.00           H  
ATOM     79  N   TRP A   9       2.908   0.874   0.836  1.00  0.00           N  
ATOM     80  CA  TRP A   9       3.893  -0.195   1.157  1.00  0.00           C  
ATOM     81  C   TRP A   9       3.933  -1.460   0.231  1.00  0.00           C  
ATOM     82  O   TRP A   9       4.981  -2.098   0.124  1.00  0.00           O  
ATOM     83  CB  TRP A   9       3.611  -0.606   2.629  1.00  0.00           C  
ATOM     84  CG  TRP A   9       3.785   0.495   3.693  1.00  0.00           C  
ATOM     85  CD1 TRP A   9       4.960   0.925   4.337  1.00  0.00           C  
ATOM     86  CD2 TRP A   9       2.792   1.327   4.141  1.00  0.00           C  
ATOM     87  NE1 TRP A   9       4.710   2.024   5.194  1.00  0.00           N  
ATOM     88  CE2 TRP A   9       3.347   2.252   5.052  1.00  0.00           C  
ATOM     89  CE3 TRP A   9       1.429   1.387   3.789  1.00  0.00           C  
ATOM     90  CZ2 TRP A   9       2.525   3.250   5.634  1.00  0.00           C  
ATOM     91  CZ3 TRP A   9       0.640   2.380   4.355  1.00  0.00           C  
ATOM     92  CH2 TRP A   9       1.174   3.299   5.269  1.00  0.00           C  
ATOM     93  H   TRP A   9       2.194   1.162   1.510  1.00  0.00           H  
ATOM     94  HA  TRP A   9       4.900   0.258   1.135  1.00  0.00           H  
ATOM     95  HB2 TRP A   9       2.595  -1.041   2.709  1.00  0.00           H  
ATOM     96  HB3 TRP A   9       4.244  -1.447   2.915  1.00  0.00           H  
ATOM     97  HD1 TRP A   9       5.933   0.484   4.168  1.00  0.00           H  
ATOM     98  HE1 TRP A   9       5.363   2.462   5.855  1.00  0.00           H  
ATOM     99  HE3 TRP A   9       1.032   0.655   3.094  1.00  0.00           H  
ATOM    100  HZ2 TRP A   9       2.930   3.950   6.348  1.00  0.00           H  
ATOM    101  HZ3 TRP A   9      -0.398   2.414   4.066  1.00  0.00           H  
ATOM    102  HH2 TRP A   9       0.531   4.051   5.704  1.00  0.00           H  
ATOM    103  N   ASP A  10       2.818  -1.808  -0.440  1.00  0.00           N  
ATOM    104  CA  ASP A  10       2.797  -2.853  -1.505  1.00  0.00           C  
ATOM    105  C   ASP A  10       3.592  -2.530  -2.816  1.00  0.00           C  
ATOM    106  O   ASP A  10       4.117  -3.431  -3.465  1.00  0.00           O  
ATOM    107  CB  ASP A  10       1.318  -3.205  -1.851  1.00  0.00           C  
ATOM    108  CG  ASP A  10       0.353  -3.687  -0.758  1.00  0.00           C  
ATOM    109  OD1 ASP A  10      -0.788  -3.228  -0.724  1.00  0.00           O  
ATOM    110  H   ASP A  10       2.041  -1.148  -0.294  1.00  0.00           H  
ATOM    111  HA  ASP A  10       3.281  -3.763  -1.101  1.00  0.00           H  
ATOM    112  HB2 ASP A  10       0.846  -2.321  -2.322  1.00  0.00           H  
ATOM    113  HB3 ASP A  10       1.300  -3.981  -2.637  1.00  0.00           H  
HETATM  114  N   NH2 A  11       3.714  -1.302  -3.286  1.00  0.00           N  
HETATM  115  HN1 NH2 A  11       4.345  -1.253  -4.088  1.00  0.00           H  
HETATM  116  HN2 NH2 A  11       3.461  -0.543  -2.642  1.00  0.00           H  
TER     117      NH2 A  11                                                      
ENDMDL                                                                          
MODEL        8                                                                  
HETATM    1  N   AC5 A   5       0.626  -4.579   0.214  1.00  0.00           N  
HETATM    2  O   AC5 A   5      -2.224  -4.658   2.645  1.00  0.00           O  
HETATM    3  CA  AC5 A   5      -0.314  -5.269   1.172  1.00  0.00           C  
HETATM    4  C   AC5 A   5      -1.088  -4.382   2.245  1.00  0.00           C  
HETATM    5  CB1 AC5 A   5      -1.266  -6.147   0.337  1.00  0.00           C  
HETATM    6  CB2 AC5 A   5       0.506  -6.383   1.876  1.00  0.00           C  
HETATM    7  CG1 AC5 A   5      -0.542  -7.439  -0.076  1.00  0.00           C  
HETATM    8  CG2 AC5 A   5       0.558  -7.632   0.973  1.00  0.00           C  
HETATM    9  H   AC5 A   5       1.420  -5.105  -0.149  1.00  0.00           H  
HETATM   10 HB11 AC5 A   5      -1.664  -5.575  -0.519  1.00  0.00           H  
HETATM   11 HB12 AC5 A   5      -2.135  -6.411   0.959  1.00  0.00           H  
HETATM   12 HB21 AC5 A   5       0.012  -6.675   2.824  1.00  0.00           H  
HETATM   13 HB22 AC5 A   5       1.518  -6.046   2.176  1.00  0.00           H  
HETATM   14 HG11 AC5 A   5      -1.232  -8.303  -0.128  1.00  0.00           H  
HETATM   15 HG12 AC5 A   5      -0.097  -7.326  -1.084  1.00  0.00           H  
HETATM   16 HG21 AC5 A   5       1.546  -7.729   0.485  1.00  0.00           H  
HETATM   17 HG22 AC5 A   5       0.407  -8.558   1.559  1.00  0.00           H  
ATOM     18  N   HIS A   6      -0.431  -3.323   2.716  1.00  0.00           N  
ATOM     19  CA  HIS A   6      -1.016  -2.307   3.640  1.00  0.00           C  
ATOM     20  C   HIS A   6      -1.494  -0.950   3.008  1.00  0.00           C  
ATOM     21  O   HIS A   6      -1.991  -0.092   3.742  1.00  0.00           O  
ATOM     22  CB  HIS A   6       0.064  -2.060   4.731  1.00  0.00           C  
ATOM     23  CG  HIS A   6       0.269  -3.182   5.746  1.00  0.00           C  
ATOM     24  ND1 HIS A   6      -0.617  -3.506   6.753  1.00  0.00           N  
ATOM     25  CD2 HIS A   6       1.381  -4.030   5.795  1.00  0.00           C  
ATOM     26  CE1 HIS A   6       0.052  -4.558   7.325  1.00  0.00           C  
ATOM     27  NE2 HIS A   6       1.267  -4.954   6.824  1.00  0.00           N  
ATOM     28  H   HIS A   6       0.417  -3.195   2.164  1.00  0.00           H  
ATOM     29  HA  HIS A   6      -1.919  -2.713   4.130  1.00  0.00           H  
ATOM     30  HB2 HIS A   6       1.030  -1.795   4.262  1.00  0.00           H  
ATOM     31  HB3 HIS A   6      -0.189  -1.158   5.300  1.00  0.00           H  
ATOM     32  HD1 HIS A   6      -1.527  -3.097   6.985  1.00  0.00           H  
ATOM     33  HD2 HIS A   6       2.214  -3.963   5.112  1.00  0.00           H  
ATOM     34  HE1 HIS A   6      -0.374  -5.083   8.169  1.00  0.00           H  
HETATM   35  N   DPN A   7      -1.330  -0.722   1.693  1.00  0.00           N  
HETATM   36  CA  DPN A   7      -1.542   0.601   1.045  1.00  0.00           C  
HETATM   37  C   DPN A   7      -0.319   0.924   0.125  1.00  0.00           C  
HETATM   38  O   DPN A   7       0.124   0.100  -0.683  1.00  0.00           O  
HETATM   39  CB  DPN A   7      -2.894   0.589   0.287  1.00  0.00           C  
HETATM   40  CG  DPN A   7      -3.367   1.973  -0.189  1.00  0.00           C  
HETATM   41  CD1 DPN A   7      -3.100   2.402  -1.494  1.00  0.00           C  
HETATM   42  CD2 DPN A   7      -4.040   2.828   0.691  1.00  0.00           C  
HETATM   43  CE1 DPN A   7      -3.499   3.671  -1.912  1.00  0.00           C  
HETATM   44  CE2 DPN A   7      -4.440   4.096   0.270  1.00  0.00           C  
HETATM   45  CZ  DPN A   7      -4.169   4.515  -1.029  1.00  0.00           C  
HETATM   46  H   DPN A   7      -1.050  -1.563   1.166  1.00  0.00           H  
HETATM   47  HA  DPN A   7      -1.611   1.383   1.830  1.00  0.00           H  
HETATM   48  HB2 DPN A   7      -2.820  -0.112  -0.563  1.00  0.00           H  
HETATM   49  HB3 DPN A   7      -3.682   0.150   0.932  1.00  0.00           H  
HETATM   50  HD1 DPN A   7      -2.575   1.757  -2.186  1.00  0.00           H  
HETATM   51  HD2 DPN A   7      -4.255   2.512   1.702  1.00  0.00           H  
HETATM   52  HE1 DPN A   7      -3.293   3.996  -2.921  1.00  0.00           H  
HETATM   53  HE2 DPN A   7      -4.965   4.750   0.952  1.00  0.00           H  
HETATM   54  HZ  DPN A   7      -4.483   5.495  -1.357  1.00  0.00           H  
ATOM     55  N   ARG A   8       0.257   2.128   0.286  1.00  0.00           N  
ATOM     56  CA  ARG A   8       1.527   2.534  -0.408  1.00  0.00           C  
ATOM     57  C   ARG A   8       2.788   1.608  -0.254  1.00  0.00           C  
ATOM     58  O   ARG A   8       3.545   1.394  -1.202  1.00  0.00           O  
ATOM     59  CB  ARG A   8       1.807   4.025  -0.074  1.00  0.00           C  
ATOM     60  CG  ARG A   8       2.249   4.348   1.380  1.00  0.00           C  
ATOM     61  CD  ARG A   8       2.444   5.845   1.688  1.00  0.00           C  
ATOM     62  NE  ARG A   8       1.132   6.541   1.820  1.00  0.00           N  
ATOM     63  CZ  ARG A   8       0.520   6.858   2.963  1.00  0.00           C  
ATOM     64  NH1 ARG A   8      -0.625   7.475   2.897  1.00  0.00           N  
ATOM     65  NH2 ARG A   8       1.001   6.581   4.150  1.00  0.00           N  
ATOM     66  H   ARG A   8      -0.279   2.768   0.876  1.00  0.00           H  
ATOM     67  HA  ARG A   8       1.309   2.493  -1.485  1.00  0.00           H  
ATOM     68  HB2 ARG A   8       2.585   4.395  -0.769  1.00  0.00           H  
ATOM     69  HB3 ARG A   8       0.907   4.616  -0.327  1.00  0.00           H  
ATOM     70  HG2 ARG A   8       1.532   3.911   2.100  1.00  0.00           H  
ATOM     71  HG3 ARG A   8       3.206   3.828   1.577  1.00  0.00           H  
ATOM     72  HD2 ARG A   8       3.088   5.970   2.582  1.00  0.00           H  
ATOM     73  HD3 ARG A   8       3.036   6.319   0.878  1.00  0.00           H  
ATOM     74  HE  ARG A   8       0.604   6.783   0.980  1.00  0.00           H  
ATOM     75 HH11 ARG A   8      -1.078   7.715   3.781  1.00  0.00           H  
ATOM     76 HH12 ARG A   8      -0.979   7.696   1.964  1.00  0.00           H  
ATOM     77 HH21 ARG A   8       0.470   6.870   4.972  1.00  0.00           H  
ATOM     78 HH22 ARG A   8       1.889   6.076   4.134  1.00  0.00           H  
ATOM     79  N   TRP A   9       2.940   1.032   0.942  1.00  0.00           N  
ATOM     80  CA  TRP A   9       3.883  -0.071   1.278  1.00  0.00           C  
ATOM     81  C   TRP A   9       3.936  -1.313   0.321  1.00  0.00           C  
ATOM     82  O   TRP A   9       5.001  -1.917   0.172  1.00  0.00           O  
ATOM     83  CB  TRP A   9       3.517  -0.549   2.714  1.00  0.00           C  
ATOM     84  CG  TRP A   9       3.573   0.492   3.845  1.00  0.00           C  
ATOM     85  CD1 TRP A   9       4.679   0.922   4.601  1.00  0.00           C  
ATOM     86  CD2 TRP A   9       2.521   1.274   4.253  1.00  0.00           C  
ATOM     87  NE1 TRP A   9       4.323   1.960   5.494  1.00  0.00           N  
ATOM     88  CE2 TRP A   9       2.973   2.164   5.249  1.00  0.00           C  
ATOM     89  CE3 TRP A   9       1.203   1.336   3.769  1.00  0.00           C  
ATOM     90  CZ2 TRP A   9       2.081   3.128   5.786  1.00  0.00           C  
ATOM     91  CZ3 TRP A   9       0.341   2.288   4.298  1.00  0.00           C  
ATOM     92  CH2 TRP A   9       0.766   3.169   5.303  1.00  0.00           C  
ATOM     93  H   TRP A   9       2.196   1.307   1.587  1.00  0.00           H  
ATOM     94  HA  TRP A   9       4.898   0.359   1.330  1.00  0.00           H  
ATOM     95  HB2 TRP A   9       2.511  -1.011   2.691  1.00  0.00           H  
ATOM     96  HB3 TRP A   9       4.152  -1.386   3.006  1.00  0.00           H  
ATOM     97  HD1 TRP A   9       5.681   0.537   4.471  1.00  0.00           H  
ATOM     98  HE1 TRP A   9       4.928   2.463   6.156  1.00  0.00           H  
ATOM     99  HE3 TRP A   9       0.908   0.666   2.977  1.00  0.00           H  
ATOM    100  HZ2 TRP A   9       2.412   3.815   6.552  1.00  0.00           H  
ATOM    101  HZ3 TRP A   9      -0.660   2.321   3.899  1.00  0.00           H  
ATOM    102  HH2 TRP A   9       0.069   3.888   5.706  1.00  0.00           H  
ATOM    103  N   ASP A  10       2.810  -1.696  -0.311  1.00  0.00           N  
ATOM    104  CA  ASP A  10       2.761  -2.791  -1.324  1.00  0.00           C  
ATOM    105  C   ASP A  10       3.565  -2.560  -2.649  1.00  0.00           C  
ATOM    106  O   ASP A  10       4.071  -3.504  -3.246  1.00  0.00           O  
ATOM    107  CB  ASP A  10       1.273  -3.112  -1.656  1.00  0.00           C  
ATOM    108  CG  ASP A  10       0.311  -3.501  -0.520  1.00  0.00           C  
ATOM    109  OD1 ASP A  10      -0.710  -2.843  -0.334  1.00  0.00           O  
ATOM    110  H   ASP A  10       2.007  -1.075  -0.147  1.00  0.00           H  
ATOM    111  HA  ASP A  10       3.216  -3.694  -0.870  1.00  0.00           H  
ATOM    112  HB2 ASP A  10       0.827  -2.242  -2.175  1.00  0.00           H  
ATOM    113  HB3 ASP A  10       1.230  -3.924  -2.406  1.00  0.00           H  
HETATM  114  N   NH2 A  11       3.711  -1.361  -3.184  1.00  0.00           N  
HETATM  115  HN1 NH2 A  11       4.351  -1.365  -3.982  1.00  0.00           H  
HETATM  116  HN2 NH2 A  11       3.470  -0.566  -2.579  1.00  0.00           H  
TER     117      NH2 A  11                                                      
ENDMDL                                                                          
MODEL        9                                                                  
HETATM    1  N   AC5 A   5       0.587  -4.575   0.204  1.00  0.00           N  
HETATM    2  O   AC5 A   5      -2.277  -4.630   2.626  1.00  0.00           O  
HETATM    3  CA  AC5 A   5      -0.370  -5.264   1.147  1.00  0.00           C  
HETATM    4  C   AC5 A   5      -1.134  -4.374   2.228  1.00  0.00           C  
HETATM    5  CB1 AC5 A   5      -1.342  -6.112   0.303  1.00  0.00           C  
HETATM    6  CB2 AC5 A   5       0.417  -6.407   1.841  1.00  0.00           C  
HETATM    7  CG1 AC5 A   5      -1.663  -7.407   1.069  1.00  0.00           C  
HETATM    8  CG2 AC5 A   5      -0.590  -7.523   2.155  1.00  0.00           C  
HETATM    9  H   AC5 A   5       1.442  -5.040  -0.109  1.00  0.00           H  
HETATM   10 HB11 AC5 A   5      -0.876  -6.368  -0.663  1.00  0.00           H  
HETATM   11 HB12 AC5 A   5      -2.241  -5.517   0.058  1.00  0.00           H  
HETATM   12 HB21 AC5 A   5       0.951  -6.062   2.749  1.00  0.00           H  
HETATM   13 HB22 AC5 A   5       1.200  -6.831   1.181  1.00  0.00           H  
HETATM   14 HG11 AC5 A   5      -2.672  -7.357   1.524  1.00  0.00           H  
HETATM   15 HG12 AC5 A   5      -1.663  -8.285   0.394  1.00  0.00           H  
HETATM   16 HG21 AC5 A   5      -0.117  -8.523   2.184  1.00  0.00           H  
HETATM   17 HG22 AC5 A   5      -1.043  -7.359   3.154  1.00  0.00           H  
ATOM     18  N   HIS A   6      -0.454  -3.331   2.698  1.00  0.00           N  
ATOM     19  CA  HIS A   6      -1.018  -2.307   3.625  1.00  0.00           C  
ATOM     20  C   HIS A   6      -1.481  -0.943   2.994  1.00  0.00           C  
ATOM     21  O   HIS A   6      -1.982  -0.086   3.726  1.00  0.00           O  
ATOM     22  CB  HIS A   6       0.071  -2.074   4.713  1.00  0.00           C  
ATOM     23  CG  HIS A   6       0.415  -3.183   5.710  1.00  0.00           C  
ATOM     24  ND1 HIS A   6       1.519  -3.130   6.535  1.00  0.00           N  
ATOM     25  CD2 HIS A   6      -0.290  -4.374   5.945  1.00  0.00           C  
ATOM     26  CE1 HIS A   6       1.381  -4.319   7.203  1.00  0.00           C  
ATOM     27  NE2 HIS A   6       0.324  -5.146   6.920  1.00  0.00           N  
ATOM     28  H   HIS A   6       0.398  -3.230   2.145  1.00  0.00           H  
ATOM     29  HA  HIS A   6      -1.927  -2.695   4.118  1.00  0.00           H  
ATOM     30  HB2 HIS A   6       1.008  -1.763   4.227  1.00  0.00           H  
ATOM     31  HB3 HIS A   6      -0.226  -1.204   5.312  1.00  0.00           H  
ATOM     32  HD1 HIS A   6       2.229  -2.398   6.634  1.00  0.00           H  
ATOM     33  HD2 HIS A   6      -1.184  -4.644   5.407  1.00  0.00           H  
ATOM     34  HE1 HIS A   6       2.100  -4.611   7.958  1.00  0.00           H  
HETATM   35  N   DPN A   7      -1.300  -0.711   1.683  1.00  0.00           N  
HETATM   36  CA  DPN A   7      -1.524   0.609   1.032  1.00  0.00           C  
HETATM   37  C   DPN A   7      -0.297   0.945   0.121  1.00  0.00           C  
HETATM   38  O   DPN A   7       0.155   0.127  -0.688  1.00  0.00           O  
HETATM   39  CB  DPN A   7      -2.867   0.570   0.259  1.00  0.00           C  
HETATM   40  CG  DPN A   7      -3.351   1.936  -0.257  1.00  0.00           C  
HETATM   41  CD1 DPN A   7      -4.039   2.805   0.595  1.00  0.00           C  
HETATM   42  CD2 DPN A   7      -3.084   2.329  -1.573  1.00  0.00           C  
HETATM   43  CE1 DPN A   7      -4.452   4.055   0.137  1.00  0.00           C  
HETATM   44  CE2 DPN A   7      -3.496   3.580  -2.028  1.00  0.00           C  
HETATM   45  CZ  DPN A   7      -4.179   4.441  -1.173  1.00  0.00           C  
HETATM   46  H   DPN A   7      -1.034  -1.553   1.154  1.00  0.00           H  
HETATM   47  HA  DPN A   7      -1.614   1.392   1.813  1.00  0.00           H  
HETATM   48  HB2 DPN A   7      -2.776  -0.151  -0.574  1.00  0.00           H  
HETATM   49  HB3 DPN A   7      -3.658   0.136   0.904  1.00  0.00           H  
HETATM   50  HD1 DPN A   7      -4.254   2.517   1.614  1.00  0.00           H  
HETATM   51  HD2 DPN A   7      -2.548   1.671  -2.243  1.00  0.00           H  
HETATM   52  HE1 DPN A   7      -4.985   4.724   0.797  1.00  0.00           H  
HETATM   53  HE2 DPN A   7      -3.287   3.880  -3.046  1.00  0.00           H  
HETATM   54  HZ  DPN A   7      -4.502   5.409  -1.529  1.00  0.00           H  
ATOM     55  N   ARG A   8       0.279   2.146   0.300  1.00  0.00           N  
ATOM     56  CA  ARG A   8       1.564   2.555  -0.362  1.00  0.00           C  
ATOM     57  C   ARG A   8       2.808   1.601  -0.228  1.00  0.00           C  
ATOM     58  O   ARG A   8       3.571   1.401  -1.175  1.00  0.00           O  
ATOM     59  CB  ARG A   8       1.876   4.025   0.050  1.00  0.00           C  
ATOM     60  CG  ARG A   8       2.306   4.249   1.521  1.00  0.00           C  
ATOM     61  CD  ARG A   8       2.546   5.723   1.885  1.00  0.00           C  
ATOM     62  NE  ARG A   8       2.980   5.786   3.306  1.00  0.00           N  
ATOM     63  CZ  ARG A   8       3.264   6.900   3.981  1.00  0.00           C  
ATOM     64  NH1 ARG A   8       3.176   8.101   3.465  1.00  0.00           N  
ATOM     65  NH2 ARG A   8       3.652   6.789   5.217  1.00  0.00           N  
ATOM     66  H   ARG A   8      -0.274   2.785   0.877  1.00  0.00           H  
ATOM     67  HA  ARG A   8       1.361   2.567  -1.443  1.00  0.00           H  
ATOM     68  HB2 ARG A   8       2.671   4.411  -0.619  1.00  0.00           H  
ATOM     69  HB3 ARG A   8       0.995   4.654  -0.178  1.00  0.00           H  
ATOM     70  HG2 ARG A   8       1.535   3.823   2.189  1.00  0.00           H  
ATOM     71  HG3 ARG A   8       3.228   3.666   1.717  1.00  0.00           H  
ATOM     72  HD2 ARG A   8       3.318   6.156   1.215  1.00  0.00           H  
ATOM     73  HD3 ARG A   8       1.614   6.306   1.724  1.00  0.00           H  
ATOM     74  HE  ARG A   8       3.095   4.924   3.851  1.00  0.00           H  
ATOM     75 HH11 ARG A   8       3.412   8.905   4.050  1.00  0.00           H  
ATOM     76 HH12 ARG A   8       2.868   8.116   2.491  1.00  0.00           H  
ATOM     77 HH21 ARG A   8       3.731   5.843   5.593  1.00  0.00           H  
ATOM     78 HH22 ARG A   8       3.870   7.653   5.717  1.00  0.00           H  
ATOM     79  N   TRP A   9       2.939   0.992   0.953  1.00  0.00           N  
ATOM     80  CA  TRP A   9       3.892  -0.104   1.282  1.00  0.00           C  
ATOM     81  C   TRP A   9       3.928  -1.349   0.328  1.00  0.00           C  
ATOM     82  O   TRP A   9       4.981  -1.973   0.186  1.00  0.00           O  
ATOM     83  CB  TRP A   9       3.551  -0.571   2.725  1.00  0.00           C  
ATOM     84  CG  TRP A   9       3.615   0.480   3.849  1.00  0.00           C  
ATOM     85  CD1 TRP A   9       4.726   0.920   4.593  1.00  0.00           C  
ATOM     86  CD2 TRP A   9       2.562   1.253   4.268  1.00  0.00           C  
ATOM     87  NE1 TRP A   9       4.372   1.958   5.487  1.00  0.00           N  
ATOM     88  CE2 TRP A   9       3.015   2.148   5.260  1.00  0.00           C  
ATOM     89  CE3 TRP A   9       1.237   1.301   3.801  1.00  0.00           C  
ATOM     90  CZ2 TRP A   9       2.120   3.102   5.810  1.00  0.00           C  
ATOM     91  CZ3 TRP A   9       0.372   2.244   4.340  1.00  0.00           C  
ATOM     92  CH2 TRP A   9       0.801   3.133   5.336  1.00  0.00           C  
ATOM     93  H   TRP A   9       2.187   1.250   1.595  1.00  0.00           H  
ATOM     94  HA  TRP A   9       4.908   0.328   1.313  1.00  0.00           H  
ATOM     95  HB2 TRP A   9       2.550  -1.041   2.721  1.00  0.00           H  
ATOM     96  HB3 TRP A   9       4.196  -1.401   3.013  1.00  0.00           H  
ATOM     97  HD1 TRP A   9       5.728   0.534   4.456  1.00  0.00           H  
ATOM     98  HE1 TRP A   9       4.972   2.423   6.180  1.00  0.00           H  
ATOM     99  HE3 TRP A   9       0.937   0.626   3.013  1.00  0.00           H  
ATOM    100  HZ2 TRP A   9       2.446   3.785   6.580  1.00  0.00           H  
ATOM    101  HZ3 TRP A   9      -0.634   2.267   3.952  1.00  0.00           H  
ATOM    102  HH2 TRP A   9       0.101   3.849   5.742  1.00  0.00           H  
ATOM    103  N   ASP A  10       2.797  -1.714  -0.310  1.00  0.00           N  
ATOM    104  CA  ASP A  10       2.737  -2.803  -1.326  1.00  0.00           C  
ATOM    105  C   ASP A  10       3.546  -2.574  -2.649  1.00  0.00           C  
ATOM    106  O   ASP A  10       4.053  -3.519  -3.245  1.00  0.00           O  
ATOM    107  CB  ASP A  10       1.246  -3.107  -1.662  1.00  0.00           C  
ATOM    108  CG  ASP A  10       0.273  -3.501  -0.538  1.00  0.00           C  
ATOM    109  OD1 ASP A  10      -0.758  -2.853  -0.370  1.00  0.00           O  
ATOM    110  H   ASP A  10       2.013  -1.063  -0.160  1.00  0.00           H  
ATOM    111  HA  ASP A  10       3.180  -3.712  -0.877  1.00  0.00           H  
ATOM    112  HB2 ASP A  10       0.810  -2.226  -2.174  1.00  0.00           H  
ATOM    113  HB3 ASP A  10       1.196  -3.908  -2.423  1.00  0.00           H  
HETATM  114  N   NH2 A  11       3.694  -1.374  -3.185  1.00  0.00           N  
HETATM  115  HN1 NH2 A  11       4.333  -1.380  -3.982  1.00  0.00           H  
HETATM  116  HN2 NH2 A  11       3.447  -0.579  -2.584  1.00  0.00           H  
TER     117      NH2 A  11                                                      
ENDMDL                                                                          
MODEL       10                                                                  
HETATM    1  N   AC5 A   5       0.659  -4.655   0.259  1.00  0.00           N  
HETATM    2  O   AC5 A   5      -1.932  -4.844   3.015  1.00  0.00           O  
HETATM    3  CA  AC5 A   5      -0.260  -5.328   1.251  1.00  0.00           C  
HETATM    4  C   AC5 A   5      -0.926  -4.461   2.410  1.00  0.00           C  
HETATM    5  CB1 AC5 A   5      -1.324  -6.123   0.440  1.00  0.00           C  
HETATM    6  CB2 AC5 A   5       0.577  -6.467   1.908  1.00  0.00           C  
HETATM    7  CG1 AC5 A   5      -1.228  -7.599   0.840  1.00  0.00           C  
HETATM    8  CG2 AC5 A   5       0.251  -7.772   1.171  1.00  0.00           C  
HETATM    9  H   AC5 A   5       1.470  -5.156  -0.109  1.00  0.00           H  
HETATM   10 HB11 AC5 A   5      -1.152  -6.026  -0.647  1.00  0.00           H  
HETATM   11 HB12 AC5 A   5      -2.337  -5.712   0.598  1.00  0.00           H  
HETATM   12 HB21 AC5 A   5       0.299  -6.603   2.972  1.00  0.00           H  
HETATM   13 HB22 AC5 A   5       1.666  -6.257   1.941  1.00  0.00           H  
HETATM   14 HG11 AC5 A   5      -1.855  -7.801   1.733  1.00  0.00           H  
HETATM   15 HG12 AC5 A   5      -1.572  -8.284   0.042  1.00  0.00           H  
HETATM   16 HG21 AC5 A   5       0.853  -7.866   0.245  1.00  0.00           H  
HETATM   17 HG22 AC5 A   5       0.450  -8.672   1.784  1.00  0.00           H  
ATOM     18  N   HIS A   6      -0.316  -3.318   2.721  1.00  0.00           N  
ATOM     19  CA  HIS A   6      -0.844  -2.321   3.705  1.00  0.00           C  
ATOM     20  C   HIS A   6      -1.336  -0.944   3.118  1.00  0.00           C  
ATOM     21  O   HIS A   6      -1.784  -0.082   3.879  1.00  0.00           O  
ATOM     22  CB  HIS A   6       0.290  -2.169   4.764  1.00  0.00           C  
ATOM     23  CG  HIS A   6      -0.155  -1.716   6.146  1.00  0.00           C  
ATOM     24  ND1 HIS A   6      -0.194  -0.411   6.587  1.00  0.00           N  
ATOM     25  CD2 HIS A   6      -0.522  -2.584   7.179  1.00  0.00           C  
ATOM     26  CE1 HIS A   6      -0.624  -0.609   7.871  1.00  0.00           C  
ATOM     27  NE2 HIS A   6      -0.844  -1.883   8.335  1.00  0.00           N  
ATOM     28  H   HIS A   6       0.365  -3.138   1.977  1.00  0.00           H  
ATOM     29  HA  HIS A   6      -1.737  -2.736   4.206  1.00  0.00           H  
ATOM     30  HB2 HIS A   6       0.829  -3.127   4.907  1.00  0.00           H  
ATOM     31  HB3 HIS A   6       1.070  -1.486   4.399  1.00  0.00           H  
ATOM     32  HD1 HIS A   6      -0.081   0.455   6.049  1.00  0.00           H  
ATOM     33  HD2 HIS A   6      -0.530  -3.658   7.069  1.00  0.00           H  
ATOM     34  HE1 HIS A   6      -0.811   0.235   8.522  1.00  0.00           H  
HETATM   35  N   DPN A   7      -1.248  -0.711   1.796  1.00  0.00           N  
HETATM   36  CA  DPN A   7      -1.505   0.609   1.157  1.00  0.00           C  
HETATM   37  C   DPN A   7      -0.329   0.940   0.181  1.00  0.00           C  
HETATM   38  O   DPN A   7       0.093   0.112  -0.635  1.00  0.00           O  
HETATM   39  CB  DPN A   7      -2.891   0.575   0.464  1.00  0.00           C  
HETATM   40  CG  DPN A   7      -3.402   1.944  -0.011  1.00  0.00           C  
HETATM   41  CD1 DPN A   7      -3.212   2.349  -1.337  1.00  0.00           C  
HETATM   42  CD2 DPN A   7      -4.036   2.811   0.887  1.00  0.00           C  
HETATM   43  CE1 DPN A   7      -3.647   3.605  -1.757  1.00  0.00           C  
HETATM   44  CE2 DPN A   7      -4.471   4.064   0.465  1.00  0.00           C  
HETATM   45  CZ  DPN A   7      -4.276   4.461  -0.856  1.00  0.00           C  
HETATM   46  H   DPN A   7      -0.987  -1.548   1.255  1.00  0.00           H  
HETATM   47  HA  DPN A   7      -1.548   1.392   1.943  1.00  0.00           H  
HETATM   48  HB2 DPN A   7      -2.852  -0.139  -0.377  1.00  0.00           H  
HETATM   49  HB3 DPN A   7      -3.643   0.138   1.151  1.00  0.00           H  
HETATM   50  HD1 DPN A   7      -2.718   1.697  -2.043  1.00  0.00           H  
HETATM   51  HD2 DPN A   7      -4.191   2.513   1.916  1.00  0.00           H  
HETATM   52  HE1 DPN A   7      -3.498   3.914  -2.782  1.00  0.00           H  
HETATM   53  HE2 DPN A   7      -4.962   4.730   1.162  1.00  0.00           H  
HETATM   54  HZ  DPN A   7      -4.616   5.433  -1.183  1.00  0.00           H  
ATOM     55  N   ARG A   8       0.243   2.149   0.310  1.00  0.00           N  
ATOM     56  CA  ARG A   8       1.510   2.547  -0.395  1.00  0.00           C  
ATOM     57  C   ARG A   8       2.761   1.603  -0.259  1.00  0.00           C  
ATOM     58  O   ARG A   8       3.508   1.382  -1.212  1.00  0.00           O  
ATOM     59  CB  ARG A   8       1.823   4.030  -0.031  1.00  0.00           C  
ATOM     60  CG  ARG A   8       2.286   4.294   1.424  1.00  0.00           C  
ATOM     61  CD  ARG A   8       2.524   5.776   1.750  1.00  0.00           C  
ATOM     62  NE  ARG A   8       2.987   5.871   3.161  1.00  0.00           N  
ATOM     63  CZ  ARG A   8       3.278   7.000   3.806  1.00  0.00           C  
ATOM     64  NH1 ARG A   8       3.694   6.917   5.035  1.00  0.00           N  
ATOM     65  NH2 ARG A   8       3.169   8.191   3.268  1.00  0.00           N  
ATOM     66  H   ARG A   8      -0.291   2.799   0.895  1.00  0.00           H  
ATOM     67  HA  ARG A   8       1.283   2.524  -1.470  1.00  0.00           H  
ATOM     68  HB2 ARG A   8       2.599   4.402  -0.727  1.00  0.00           H  
ATOM     69  HB3 ARG A   8       0.932   4.647  -0.254  1.00  0.00           H  
ATOM     70  HG2 ARG A   8       1.533   3.878   2.120  1.00  0.00           H  
ATOM     71  HG3 ARG A   8       3.216   3.721   1.612  1.00  0.00           H  
ATOM     72  HD2 ARG A   8       3.278   6.197   1.054  1.00  0.00           H  
ATOM     73  HD3 ARG A   8       1.585   6.350   1.596  1.00  0.00           H  
ATOM     74  HE  ARG A   8       3.121   5.022   3.721  1.00  0.00           H  
ATOM     75 HH11 ARG A   8       3.917   7.792   5.514  1.00  0.00           H  
ATOM     76 HH12 ARG A   8       3.786   5.979   5.429  1.00  0.00           H  
ATOM     77 HH21 ARG A   8       2.841   8.184   2.301  1.00  0.00           H  
ATOM     78 HH22 ARG A   8       3.414   9.007   3.831  1.00  0.00           H  
ATOM     79  N   TRP A   9       2.917   1.027   0.937  1.00  0.00           N  
ATOM     80  CA  TRP A   9       3.886  -0.050   1.283  1.00  0.00           C  
ATOM     81  C   TRP A   9       3.937  -1.315   0.355  1.00  0.00           C  
ATOM     82  O   TRP A   9       5.003  -1.920   0.221  1.00  0.00           O  
ATOM     83  CB  TRP A   9       3.550  -0.484   2.738  1.00  0.00           C  
ATOM     84  CG  TRP A   9       3.636   0.589   3.839  1.00  0.00           C  
ATOM     85  CD1 TRP A   9       4.757   1.019   4.573  1.00  0.00           C  
ATOM     86  CD2 TRP A   9       2.597   1.381   4.258  1.00  0.00           C  
ATOM     87  NE1 TRP A   9       4.425   2.069   5.462  1.00  0.00           N  
ATOM     88  CE2 TRP A   9       3.070   2.275   5.243  1.00  0.00           C  
ATOM     89  CE3 TRP A   9       1.268   1.437   3.811  1.00  0.00           C  
ATOM     90  CZ2 TRP A   9       2.187   3.234   5.804  1.00  0.00           C  
ATOM     91  CZ3 TRP A   9       0.415   2.387   4.359  1.00  0.00           C  
ATOM     92  CH2 TRP A   9       0.863   3.273   5.349  1.00  0.00           C  
ATOM     93  H   TRP A   9       2.172   1.297   1.582  1.00  0.00           H  
ATOM     94  HA  TRP A   9       4.895   0.395   1.302  1.00  0.00           H  
ATOM     95  HB2 TRP A   9       2.544  -0.947   2.751  1.00  0.00           H  
ATOM     96  HB3 TRP A   9       4.189  -1.315   3.038  1.00  0.00           H  
ATOM     97  HD1 TRP A   9       5.750   0.613   4.440  1.00  0.00           H  
ATOM     98  HE1 TRP A   9       5.033   2.524   6.155  1.00  0.00           H  
ATOM     99  HE3 TRP A   9       0.951   0.756   3.035  1.00  0.00           H  
ATOM    100  HZ2 TRP A   9       2.528   3.915   6.571  1.00  0.00           H  
ATOM    101  HZ3 TRP A   9      -0.596   2.412   3.988  1.00  0.00           H  
ATOM    102  HH2 TRP A   9       0.173   3.995   5.762  1.00  0.00           H  
ATOM    103  N   ASP A  10       2.812  -1.713  -0.272  1.00  0.00           N  
ATOM    104  CA  ASP A  10       2.774  -2.819  -1.273  1.00  0.00           C  
ATOM    105  C   ASP A  10       3.571  -2.590  -2.603  1.00  0.00           C  
ATOM    106  O   ASP A  10       4.090  -3.534  -3.189  1.00  0.00           O  
ATOM    107  CB  ASP A  10       1.289  -3.166  -1.598  1.00  0.00           C  
ATOM    108  CG  ASP A  10       0.341  -3.562  -0.454  1.00  0.00           C  
ATOM    109  OD1 ASP A  10      -0.664  -2.891  -0.233  1.00  0.00           O  
ATOM    110  H   ASP A  10       2.010  -1.087  -0.124  1.00  0.00           H  
ATOM    111  HA  ASP A  10       3.241  -3.711  -0.812  1.00  0.00           H  
ATOM    112  HB2 ASP A  10       0.827  -2.302  -2.117  1.00  0.00           H  
ATOM    113  HB3 ASP A  10       1.253  -3.979  -2.345  1.00  0.00           H  
HETATM  114  N   NH2 A  11       3.696  -1.397  -3.153  1.00  0.00           N  
HETATM  115  HN1 NH2 A  11       4.331  -1.401  -3.953  1.00  0.00           H  
HETATM  116  HN2 NH2 A  11       3.441  -0.598  -2.559  1.00  0.00           H  
TER     117      NH2 A  11                                                      
ENDMDL                                                                          
CONECT    1    3    9  108                                                      
CONECT    2    4                                                                
CONECT    3    1    4    5    6                                                 
CONECT    4    2    3   18                                                      
CONECT    5    3    7   10   11                                                 
CONECT    6    3    8   12   13                                                 
CONECT    7    5    8   14   15                                                 
CONECT    8    6    7   16   17                                                 
CONECT    9    1                                                                
CONECT   10    5                                                                
CONECT   11    5                                                                
CONECT   12    6                                                                
CONECT   13    6                                                                
CONECT   14    7                                                                
CONECT   15    7                                                                
CONECT   16    8                                                                
CONECT   17    8                                                                
CONECT   18    4                                                                
CONECT   20   35                                                                
CONECT   35   20   36   46                                                      
CONECT   36   35   37   39   47                                                 
CONECT   37   36   38   55                                                      
CONECT   38   37                                                                
CONECT   39   36   40   48   49                                                 
CONECT   40   39   41   42                                                      
CONECT   41   40   43   50                                                      
CONECT   42   40   44   51                                                      
CONECT   43   41   45   52                                                      
CONECT   44   42   45   53                                                      
CONECT   45   43   44   54                                                      
CONECT   46   35                                                                
CONECT   47   36                                                                
CONECT   48   39                                                                
CONECT   49   39                                                                
CONECT   50   41                                                                
CONECT   51   42                                                                
CONECT   52   43                                                                
CONECT   53   44                                                                
CONECT   54   45                                                                
CONECT   55   37                                                                
CONECT  105  114                                                                
CONECT  108    1                                                                
CONECT  114  105  115  116                                                      
CONECT  115  114                                                                
CONECT  116  114                                                                
MASTER      117    0    3    0    0    0    0    6   62    1   45    1          
END