HEADER    DE NOVO PROTEIN                         20-JUL-18   6E5K              
TITLE     HETEROGENEOUS-BACKBONE MIMICS OF A DESIGNED DISULFIDE-RICH PROTEIN:   
TITLE    2 AIB TURN, AIB HELIX, N-METHYL HAIRPIN                                
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: DESIGNED PEPTIDE NC_HEE_D1: AIB TURN, AIB HELIX, N-METHYL  
COMPND   3 HAIRPIN MUTANT;                                                      
COMPND   4 CHAIN: A;                                                            
COMPND   5 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 SYNTHETIC: YES;                                                      
SOURCE   3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT;                            
SOURCE   4 ORGANISM_TAXID: 32630                                                
KEYWDS    HETEROGENEOUS BACKBONE FOLDAMER, DE NOVO PROTEIN                      
EXPDTA    SOLUTION NMR                                                          
NUMMDL    10                                                                    
AUTHOR    C.C.CABALTEJA,D.S.MIHALKO,W.S.HORNE                                   
REVDAT   3   01-JAN-20 6E5K    1       REMARK                                   
REVDAT   2   16-JAN-19 6E5K    1       JRNL                                     
REVDAT   1   21-NOV-18 6E5K    0                                                
JRNL        AUTH   C.C.CABALTEJA,D.S.MIHALKO,W.S.HORNE                          
JRNL        TITL   HETEROGENEOUS-BACKBONE FOLDAMER MIMICS OF A COMPUTATIONALLY  
JRNL        TITL 2 DESIGNED, DISULFIDE-RICH MINIPROTEIN.                        
JRNL        REF    CHEMBIOCHEM                   V.  20   103 2019              
JRNL        REFN                   ESSN 1439-7633                               
JRNL        PMID   30326175                                                     
JRNL        DOI    10.1002/CBIC.201800558                                       
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : ARIA 2.3                                             
REMARK   3   AUTHORS     : LINGE, O'DONOGHUE AND NILGES                         
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 6E5K COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 24-JUL-18.                  
REMARK 100 THE DEPOSITION ID IS D_1000235747.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 275                                
REMARK 210  PH                             : 4.0                                
REMARK 210  IONIC STRENGTH                 : 5                                  
REMARK 210  PRESSURE                       : 1 ATM                              
REMARK 210  SAMPLE CONTENTS                : 0.2 MM NA DSS, 1.0 MM NA           
REMARK 210                                   DESIGNED PEPTIDE NC_HEE_D1: AIB    
REMARK 210                                   TURN, AIB HELIX, N-METHYL          
REMARK 210                                   HAIRPIN MUTANT, 90% H2O/10% D2O    
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D TOCSY; 2D NOESY; 2D COSY        
REMARK 210  SPECTROMETER FIELD STRENGTH    : 700 MHZ                            
REMARK 210  SPECTROMETER MODEL             : AVANCE                             
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : SPARKY                             
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  : LOW                                
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1                   
REMARK 210                                                                      
REMARK 210 REMARK: NULL                                                         
REMARK 215                                                                      
REMARK 215 NMR STUDY                                                            
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: TORSION ANGLES                                             
REMARK 500                                                                      
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:            
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)                    
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-           
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400            
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        PSI       PHI                                   
REMARK 500  1 TYR A  11       35.55    -98.68                                   
REMARK 500  2 TYR A  11       48.76   -101.34                                   
REMARK 500  3 TYR A  11       45.83   -109.63                                   
REMARK 500  4 TYR A  11       54.41    -93.07                                   
REMARK 500  5 AIB A  12     -104.66     56.98                                   
REMARK 500  6 AIB A  12       70.81     24.43                                   
REMARK 500  8 TYR A  11       51.26    -97.79                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 30499   RELATED DB: BMRB                                 
REMARK 900 HETEROGENEOUS-BACKBONE MIMICS OF A DESIGNED DISULFIDE-RICH PROTEIN:  
REMARK 900 AIB TURN, AIB HELIX, N-METHYL HAIRPIN                                
DBREF  6E5K A    1    28  PDB    6E5K     6E5K             1     28             
SEQRES   1 A   28  ASN ASP AIB CYS LYS AIB LEU LYS AIB ARG TYR AIB GLY          
SEQRES   2 A   28  CYS GLU MVA ARG CYS ASP DPR PRO ARG TYR GLU MVA HIS          
SEQRES   3 A   28  CYS NH2                                                      
HET    AIB  A   3      13                                                       
HET    AIB  A   6      13                                                       
HET    AIB  A   9      13                                                       
HET    AIB  A  12      13                                                       
HET    MVA  A  16      19                                                       
HET    DPR  A  20      14                                                       
HET    MVA  A  25      19                                                       
HET    NH2  A  28       3                                                       
HETNAM     AIB ALPHA-AMINOISOBUTYRIC ACID                                       
HETNAM     MVA N-METHYLVALINE                                                   
HETNAM     DPR D-PROLINE                                                        
HETNAM     NH2 AMINO GROUP                                                      
FORMUL   1  AIB    4(C4 H9 N O2)                                                
FORMUL   1  MVA    2(C6 H13 N O2)                                               
FORMUL   1  DPR    C5 H9 N O2                                                   
FORMUL   1  NH2    H2 N                                                         
HELIX    1 AA1 ASP A    2  TYR A   11  1                                  10    
SHEET    1 AA1 2 GLU A  15  ASP A  19  0                                        
SHEET    2 AA1 2 ARG A  22  HIS A  26 -1  O  GLU A  24   N  ARG A  17           
SSBOND   1 CYS A    4    CYS A   18                          1555   1555  2.03  
SSBOND   2 CYS A   14    CYS A   27                          1555   1555  2.03  
LINK         C   ASP A   2                 N   AIB A   3     1555   1555  1.33  
LINK         C   AIB A   3                 N   CYS A   4     1555   1555  1.33  
LINK         C   LYS A   5                 N   AIB A   6     1555   1555  1.33  
LINK         C   AIB A   6                 N   LEU A   7     1555   1555  1.33  
LINK         C   LYS A   8                 N   AIB A   9     1555   1555  1.33  
LINK         C   AIB A   9                 N   ARG A  10     1555   1555  1.33  
LINK         C   TYR A  11                 N   AIB A  12     1555   1555  1.33  
LINK         C   AIB A  12                 N   GLY A  13     1555   1555  1.33  
LINK         C   GLU A  15                 N   MVA A  16     1555   1555  1.35  
LINK         C   MVA A  16                 N   ARG A  17     1555   1555  1.32  
LINK         C   ASP A  19                 N   DPR A  20     1555   1555  1.34  
LINK         C   DPR A  20                 N   PRO A  21     1555   1555  1.34  
LINK         C   GLU A  24                 N   MVA A  25     1555   1555  1.33  
LINK         C   MVA A  25                 N   HIS A  26     1555   1555  1.32  
LINK         C   CYS A  27                 N   NH2 A  28     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                                                                  
ATOM      1  N   ASN A   1       9.734 -11.516  -2.445  1.00  1.83           N  
ATOM      2  CA  ASN A   1       8.770 -10.660  -1.720  1.00  1.49           C  
ATOM      3  C   ASN A   1       8.993  -9.200  -2.084  1.00  1.11           C  
ATOM      4  O   ASN A   1       9.986  -8.861  -2.729  1.00  1.38           O  
ATOM      5  CB  ASN A   1       8.906 -10.851  -0.202  1.00  1.76           C  
ATOM      6  CG  ASN A   1      10.271 -10.452   0.327  1.00  2.41           C  
ATOM      7  OD1 ASN A   1      11.286 -10.607  -0.352  1.00  3.13           O  
ATOM      8  ND2 ASN A   1      10.305  -9.928   1.543  1.00  2.72           N  
ATOM      9  H1  ASN A   1       9.622 -11.387  -3.471  1.00  1.62           H  
ATOM     10  H2  ASN A   1       9.574 -12.514  -2.213  1.00  2.41           H  
ATOM     11  H3  ASN A   1      10.707 -11.259  -2.183  1.00  2.27           H  
ATOM     12  HA  ASN A   1       7.774 -10.943  -2.024  1.00  1.51           H  
ATOM     13  HB2 ASN A   1       8.160 -10.255   0.297  1.00  2.07           H  
ATOM     14  HB3 ASN A   1       8.740 -11.893   0.036  1.00  1.95           H  
ATOM     15 HD21 ASN A   1       9.455  -9.825   2.028  1.00  2.63           H  
ATOM     16 HD22 ASN A   1      11.174  -9.664   1.911  1.00  3.34           H  
ATOM     17  N   ASP A   2       8.065  -8.343  -1.676  1.00  0.74           N  
ATOM     18  CA  ASP A   2       8.138  -6.920  -1.969  1.00  0.50           C  
ATOM     19  C   ASP A   2       7.221  -6.162  -1.020  1.00  0.36           C  
ATOM     20  O   ASP A   2       6.093  -6.595  -0.776  1.00  0.33           O  
ATOM     21  CB  ASP A   2       7.729  -6.650  -3.420  1.00  0.73           C  
ATOM     22  CG  ASP A   2       7.876  -5.194  -3.813  1.00  1.34           C  
ATOM     23  OD1 ASP A   2       6.978  -4.391  -3.490  1.00  2.21           O  
ATOM     24  OD2 ASP A   2       8.888  -4.846  -4.455  1.00  1.35           O1-
ATOM     25  H   ASP A   2       7.307  -8.675  -1.151  1.00  0.90           H  
ATOM     26  HA  ASP A   2       9.155  -6.592  -1.816  1.00  0.62           H  
ATOM     27  HB2 ASP A   2       8.347  -7.244  -4.077  1.00  1.22           H  
ATOM     28  HB3 ASP A   2       6.697  -6.936  -3.553  1.00  1.02           H  
HETATM   29  N   AIB A   3       7.715  -5.046  -0.484  1.00  0.36           N  
HETATM   30  CA  AIB A   3       6.968  -4.235   0.491  1.00  0.37           C  
HETATM   31  C   AIB A   3       5.583  -3.873  -0.061  1.00  0.33           C  
HETATM   32  O   AIB A   3       4.557  -4.109   0.587  1.00  0.30           O  
HETATM   33  CB1 AIB A   3       7.738  -2.963   0.791  1.00  0.49           C  
HETATM   34  CB2 AIB A   3       6.832  -4.998   1.796  1.00  0.41           C  
HETATM   35  H   AIB A   3       8.615  -4.759  -0.743  1.00  0.41           H  
HETATM   36 HB11 AIB A   3       7.215  -2.395   1.546  1.00  1.25           H  
HETATM   37 HB12 AIB A   3       7.822  -2.373  -0.108  1.00  0.95           H  
HETATM   38 HB13 AIB A   3       8.724  -3.215   1.150  1.00  1.20           H  
HETATM   39 HB21 AIB A   3       6.308  -5.925   1.616  1.00  1.26           H  
HETATM   40 HB22 AIB A   3       6.275  -4.402   2.504  1.00  1.09           H  
HETATM   41 HB23 AIB A   3       7.813  -5.209   2.195  1.00  0.94           H  
ATOM     42  N   CYS A   4       5.555  -3.324  -1.269  1.00  0.37           N  
ATOM     43  CA  CYS A   4       4.308  -2.869  -1.866  1.00  0.40           C  
ATOM     44  C   CYS A   4       3.400  -4.052  -2.173  1.00  0.32           C  
ATOM     45  O   CYS A   4       2.180  -3.937  -2.108  1.00  0.33           O  
ATOM     46  CB  CYS A   4       4.572  -2.055  -3.135  1.00  0.49           C  
ATOM     47  SG  CYS A   4       3.060  -1.460  -3.965  1.00  1.18           S  
ATOM     48  H   CYS A   4       6.390  -3.240  -1.780  1.00  0.41           H  
ATOM     49  HA  CYS A   4       3.815  -2.237  -1.145  1.00  0.43           H  
ATOM     50  HB2 CYS A   4       5.168  -1.192  -2.881  1.00  1.21           H  
ATOM     51  HB3 CYS A   4       5.116  -2.664  -3.837  1.00  1.05           H  
ATOM     52  N   LYS A   5       4.001  -5.191  -2.489  1.00  0.30           N  
ATOM     53  CA  LYS A   5       3.241  -6.410  -2.738  1.00  0.31           C  
ATOM     54  C   LYS A   5       2.536  -6.858  -1.463  1.00  0.20           C  
ATOM     55  O   LYS A   5       1.344  -7.178  -1.483  1.00  0.20           O  
ATOM     56  CB  LYS A   5       4.167  -7.518  -3.251  1.00  0.39           C  
ATOM     57  CG  LYS A   5       3.492  -8.876  -3.415  1.00  0.80           C  
ATOM     58  CD  LYS A   5       2.430  -8.865  -4.505  1.00  1.37           C  
ATOM     59  CE  LYS A   5       1.821 -10.248  -4.701  1.00  2.05           C  
ATOM     60  NZ  LYS A   5       1.111 -10.726  -3.484  1.00  2.62           N1+
ATOM     61  H   LYS A   5       4.982  -5.213  -2.555  1.00  0.32           H  
ATOM     62  HA  LYS A   5       2.500  -6.189  -3.487  1.00  0.38           H  
ATOM     63  HB2 LYS A   5       4.561  -7.221  -4.211  1.00  0.76           H  
ATOM     64  HB3 LYS A   5       4.987  -7.632  -2.557  1.00  0.63           H  
ATOM     65  HG2 LYS A   5       4.240  -9.610  -3.670  1.00  1.40           H  
ATOM     66  HG3 LYS A   5       3.027  -9.146  -2.478  1.00  1.26           H  
ATOM     67  HD2 LYS A   5       1.647  -8.177  -4.226  1.00  1.80           H  
ATOM     68  HD3 LYS A   5       2.882  -8.544  -5.432  1.00  1.90           H  
ATOM     69  HE2 LYS A   5       1.120 -10.205  -5.522  1.00  2.44           H  
ATOM     70  HE3 LYS A   5       2.612 -10.944  -4.942  1.00  2.54           H  
ATOM     71  HZ1 LYS A   5       0.373 -10.047  -3.211  1.00  2.86           H  
ATOM     72  HZ2 LYS A   5       1.779 -10.835  -2.696  1.00  2.84           H  
ATOM     73  HZ3 LYS A   5       0.664 -11.647  -3.670  1.00  3.23           H  
HETATM   74  N   AIB A   6       3.283  -6.858  -0.360  1.00  0.16           N  
HETATM   75  CA  AIB A   6       2.758  -7.251   0.950  1.00  0.16           C  
HETATM   76  C   AIB A   6       1.579  -6.342   1.312  1.00  0.12           C  
HETATM   77  O   AIB A   6       0.507  -6.815   1.711  1.00  0.16           O  
HETATM   78  CB1 AIB A   6       3.844  -7.109   1.997  1.00  0.22           C  
HETATM   79  CB2 AIB A   6       2.331  -8.708   0.933  1.00  0.25           C  
HETATM   80  H   AIB A   6       4.224  -6.577  -0.427  1.00  0.18           H  
HETATM   81 HB11 AIB A   6       3.457  -7.406   2.960  1.00  1.10           H  
HETATM   82 HB12 AIB A   6       4.166  -6.079   2.042  1.00  1.03           H  
HETATM   83 HB13 AIB A   6       4.684  -7.737   1.735  1.00  0.90           H  
HETATM   84 HB21 AIB A   6       1.543  -8.843   0.207  1.00  1.08           H  
HETATM   85 HB22 AIB A   6       1.972  -8.992   1.911  1.00  1.03           H  
HETATM   86 HB23 AIB A   6       3.175  -9.327   0.668  1.00  1.03           H  
ATOM     87  N   LEU A   7       1.785  -5.038   1.150  1.00  0.12           N  
ATOM     88  CA  LEU A   7       0.758  -4.055   1.467  1.00  0.16           C  
ATOM     89  C   LEU A   7      -0.448  -4.230   0.559  1.00  0.17           C  
ATOM     90  O   LEU A   7      -1.585  -4.177   1.013  1.00  0.21           O  
ATOM     91  CB  LEU A   7       1.303  -2.632   1.325  1.00  0.23           C  
ATOM     92  CG  LEU A   7       2.503  -2.293   2.213  1.00  0.28           C  
ATOM     93  CD1 LEU A   7       2.981  -0.879   1.932  1.00  0.38           C  
ATOM     94  CD2 LEU A   7       2.145  -2.441   3.684  1.00  0.35           C  
ATOM     95  H   LEU A   7       2.655  -4.729   0.807  1.00  0.15           H  
ATOM     96  HA  LEU A   7       0.448  -4.216   2.489  1.00  0.19           H  
ATOM     97  HB2 LEU A   7       1.591  -2.485   0.295  1.00  0.25           H  
ATOM     98  HB3 LEU A   7       0.508  -1.943   1.556  1.00  0.28           H  
ATOM     99  HG  LEU A   7       3.314  -2.973   1.991  1.00  0.24           H  
ATOM    100 HD11 LEU A   7       3.829  -0.655   2.561  1.00  1.02           H  
ATOM    101 HD12 LEU A   7       2.182  -0.184   2.141  1.00  0.98           H  
ATOM    102 HD13 LEU A   7       3.268  -0.795   0.894  1.00  1.03           H  
ATOM    103 HD21 LEU A   7       1.847  -3.458   3.884  1.00  1.14           H  
ATOM    104 HD22 LEU A   7       1.331  -1.773   3.923  1.00  0.90           H  
ATOM    105 HD23 LEU A   7       3.004  -2.190   4.289  1.00  1.09           H  
ATOM    106  N   LYS A   8      -0.187  -4.451  -0.719  1.00  0.19           N  
ATOM    107  CA  LYS A   8      -1.244  -4.634  -1.702  1.00  0.27           C  
ATOM    108  C   LYS A   8      -2.140  -5.797  -1.307  1.00  0.25           C  
ATOM    109  O   LYS A   8      -3.357  -5.645  -1.227  1.00  0.31           O  
ATOM    110  CB  LYS A   8      -0.632  -4.875  -3.084  1.00  0.35           C  
ATOM    111  CG  LYS A   8      -1.654  -5.069  -4.195  1.00  1.12           C  
ATOM    112  CD  LYS A   8      -0.979  -5.421  -5.515  1.00  1.10           C  
ATOM    113  CE  LYS A   8      -0.174  -4.253  -6.075  1.00  2.05           C  
ATOM    114  NZ  LYS A   8      -1.050  -3.150  -6.551  1.00  2.55           N1+
ATOM    115  H   LYS A   8       0.749  -4.493  -1.013  1.00  0.20           H  
ATOM    116  HA  LYS A   8      -1.833  -3.733  -1.728  1.00  0.31           H  
ATOM    117  HB2 LYS A   8      -0.013  -4.028  -3.338  1.00  0.78           H  
ATOM    118  HB3 LYS A   8      -0.010  -5.758  -3.039  1.00  1.00           H  
ATOM    119  HG2 LYS A   8      -2.324  -5.869  -3.919  1.00  1.72           H  
ATOM    120  HG3 LYS A   8      -2.215  -4.153  -4.319  1.00  1.60           H  
ATOM    121  HD2 LYS A   8      -0.314  -6.255  -5.353  1.00  1.29           H  
ATOM    122  HD3 LYS A   8      -1.739  -5.699  -6.231  1.00  1.23           H  
ATOM    123  HE2 LYS A   8       0.476  -3.874  -5.302  1.00  2.55           H  
ATOM    124  HE3 LYS A   8       0.423  -4.608  -6.903  1.00  2.55           H  
ATOM    125  HZ1 LYS A   8      -1.641  -3.479  -7.342  1.00  2.92           H  
ATOM    126  HZ2 LYS A   8      -0.475  -2.347  -6.875  1.00  2.95           H  
ATOM    127  HZ3 LYS A   8      -1.671  -2.827  -5.784  1.00  2.82           H  
HETATM  128  N   AIB A   9      -1.516  -6.938  -1.027  1.00  0.21           N  
HETATM  129  CA  AIB A   9      -2.233  -8.154  -0.629  1.00  0.24           C  
HETATM  130  C   AIB A   9      -2.995  -7.903   0.676  1.00  0.26           C  
HETATM  131  O   AIB A   9      -4.111  -8.394   0.859  1.00  0.35           O  
HETATM  132  CB1 AIB A   9      -1.243  -9.282  -0.431  1.00  0.23           C  
HETATM  133  CB2 AIB A   9      -3.198  -8.585  -1.722  1.00  0.32           C  
HETATM  134  H   AIB A   9      -0.536  -6.966  -1.089  1.00  0.18           H  
HETATM  135 HB11 AIB A   9      -1.774 -10.186  -0.174  1.00  1.04           H  
HETATM  136 HB12 AIB A   9      -0.562  -9.026   0.367  1.00  0.97           H  
HETATM  137 HB13 AIB A   9      -0.686  -9.440  -1.344  1.00  1.10           H  
HETATM  138 HB21 AIB A   9      -2.650  -8.770  -2.633  1.00  1.03           H  
HETATM  139 HB22 AIB A   9      -3.922  -7.802  -1.891  1.00  1.10           H  
HETATM  140 HB23 AIB A   9      -3.708  -9.487  -1.418  1.00  0.99           H  
ATOM    141  N   ARG A  10      -2.387  -7.140   1.579  1.00  0.21           N  
ATOM    142  CA  ARG A  10      -3.002  -6.848   2.867  1.00  0.27           C  
ATOM    143  C   ARG A  10      -4.244  -5.982   2.692  1.00  0.33           C  
ATOM    144  O   ARG A  10      -5.286  -6.240   3.291  1.00  0.44           O  
ATOM    145  CB  ARG A  10      -2.010  -6.133   3.787  1.00  0.28           C  
ATOM    146  CG  ARG A  10      -2.539  -5.915   5.194  1.00  0.37           C  
ATOM    147  CD  ARG A  10      -1.587  -5.072   6.031  1.00  0.46           C  
ATOM    148  NE  ARG A  10      -0.243  -5.648   6.100  1.00  1.04           N  
ATOM    149  CZ  ARG A  10       0.833  -4.968   6.496  1.00  1.36           C  
ATOM    150  NH1 ARG A  10       0.710  -3.718   6.932  1.00  1.26           N1+
ATOM    151  NH2 ARG A  10       2.027  -5.548   6.482  1.00  2.18           N  
ATOM    152  H   ARG A  10      -1.499  -6.766   1.376  1.00  0.16           H  
ATOM    153  HA  ARG A  10      -3.290  -7.784   3.317  1.00  0.33           H  
ATOM    154  HB2 ARG A  10      -1.107  -6.723   3.852  1.00  0.30           H  
ATOM    155  HB3 ARG A  10      -1.770  -5.169   3.362  1.00  0.27           H  
ATOM    156  HG2 ARG A  10      -3.490  -5.407   5.131  1.00  0.45           H  
ATOM    157  HG3 ARG A  10      -2.674  -6.874   5.671  1.00  0.42           H  
ATOM    158  HD2 ARG A  10      -1.521  -4.087   5.592  1.00  0.90           H  
ATOM    159  HD3 ARG A  10      -1.987  -4.990   7.031  1.00  1.00           H  
ATOM    160  HE  ARG A  10      -0.137  -6.591   5.828  1.00  1.56           H  
ATOM    161 HH11 ARG A  10       1.518  -3.204   7.229  1.00  1.61           H  
ATOM    162 HH12 ARG A  10      -0.196  -3.287   6.976  1.00  1.29           H  
ATOM    163 HH21 ARG A  10       2.122  -6.498   6.174  1.00  2.69           H  
ATOM    164 HH22 ARG A  10       2.842  -5.039   6.778  1.00  2.46           H  
ATOM    165  N   TYR A  11      -4.128  -4.968   1.854  1.00  0.31           N  
ATOM    166  CA  TYR A  11      -5.190  -3.993   1.671  1.00  0.39           C  
ATOM    167  C   TYR A  11      -6.016  -4.305   0.433  1.00  0.58           C  
ATOM    168  O   TYR A  11      -6.482  -3.396  -0.247  1.00  0.93           O  
ATOM    169  CB  TYR A  11      -4.593  -2.590   1.558  1.00  0.32           C  
ATOM    170  CG  TYR A  11      -3.845  -2.145   2.793  1.00  0.24           C  
ATOM    171  CD1 TYR A  11      -4.513  -1.918   3.988  1.00  0.27           C  
ATOM    172  CD2 TYR A  11      -2.475  -1.940   2.760  1.00  0.24           C  
ATOM    173  CE1 TYR A  11      -3.833  -1.500   5.115  1.00  0.31           C  
ATOM    174  CE2 TYR A  11      -1.788  -1.525   3.880  1.00  0.24           C  
ATOM    175  CZ  TYR A  11      -2.471  -1.305   5.055  1.00  0.27           C  
ATOM    176  OH  TYR A  11      -1.790  -0.885   6.173  1.00  0.38           O  
ATOM    177  H   TYR A  11      -3.299  -4.872   1.332  1.00  0.29           H  
ATOM    178  HA  TYR A  11      -5.829  -4.032   2.539  1.00  0.44           H  
ATOM    179  HB2 TYR A  11      -3.903  -2.568   0.728  1.00  0.34           H  
ATOM    180  HB3 TYR A  11      -5.387  -1.885   1.377  1.00  0.37           H  
ATOM    181  HD1 TYR A  11      -5.580  -2.074   4.032  1.00  0.33           H  
ATOM    182  HD2 TYR A  11      -1.940  -2.116   1.836  1.00  0.32           H  
ATOM    183  HE1 TYR A  11      -4.369  -1.330   6.034  1.00  0.41           H  
ATOM    184  HE2 TYR A  11      -0.723  -1.374   3.832  1.00  0.29           H  
ATOM    185  HH  TYR A  11      -2.033  -1.441   6.924  1.00  0.93           H  
HETATM  186  N   AIB A  12      -6.203  -5.594   0.164  1.00  0.54           N  
HETATM  187  CA  AIB A  12      -6.991  -6.064  -0.991  1.00  0.73           C  
HETATM  188  C   AIB A  12      -8.411  -5.480  -0.947  1.00  0.64           C  
HETATM  189  O   AIB A  12      -9.008  -5.186  -1.986  1.00  1.44           O  
HETATM  190  CB1 AIB A  12      -7.068  -7.576  -0.963  1.00  1.05           C  
HETATM  191  CB2 AIB A  12      -6.308  -5.671  -2.289  1.00  1.04           C  
HETATM  192  H   AIB A  12      -5.786  -6.259   0.753  1.00  0.64           H  
HETATM  193 HB11 AIB A  12      -7.546  -7.895  -0.049  1.00  1.35           H  
HETATM  194 HB12 AIB A  12      -6.071  -7.989  -1.011  1.00  1.34           H  
HETATM  195 HB13 AIB A  12      -7.643  -7.922  -1.809  1.00  1.69           H  
HETATM  196 HB21 AIB A  12      -5.309  -6.079  -2.307  1.00  1.46           H  
HETATM  197 HB22 AIB A  12      -6.258  -4.594  -2.357  1.00  1.41           H  
HETATM  198 HB23 AIB A  12      -6.871  -6.059  -3.124  1.00  1.18           H  
ATOM    199  N   GLY A  13      -8.943  -5.308   0.257  1.00  0.60           N  
ATOM    200  CA  GLY A  13     -10.286  -4.776   0.410  1.00  0.84           C  
ATOM    201  C   GLY A  13     -10.322  -3.266   0.281  1.00  0.80           C  
ATOM    202  O   GLY A  13     -11.383  -2.647   0.349  1.00  1.24           O  
ATOM    203  H   GLY A  13      -8.418  -5.540   1.051  1.00  1.15           H  
ATOM    204  HA2 GLY A  13     -10.920  -5.206  -0.349  1.00  0.99           H  
ATOM    205  HA3 GLY A  13     -10.665  -5.052   1.382  1.00  1.02           H  
ATOM    206  N   CYS A  14      -9.154  -2.680   0.085  1.00  0.33           N  
ATOM    207  CA  CYS A  14      -9.011  -1.243  -0.055  1.00  0.29           C  
ATOM    208  C   CYS A  14      -8.126  -0.947  -1.260  1.00  0.34           C  
ATOM    209  O   CYS A  14      -7.886  -1.825  -2.088  1.00  0.62           O  
ATOM    210  CB  CYS A  14      -8.382  -0.664   1.214  1.00  0.25           C  
ATOM    211  SG  CYS A  14      -9.283  -1.055   2.748  1.00  0.39           S  
ATOM    212  H   CYS A  14      -8.348  -3.239   0.018  1.00  0.23           H  
ATOM    213  HA  CYS A  14      -9.987  -0.811  -0.207  1.00  0.35           H  
ATOM    214  HB2 CYS A  14      -7.381  -1.049   1.315  1.00  0.26           H  
ATOM    215  HB3 CYS A  14      -8.339   0.412   1.126  1.00  0.26           H  
ATOM    216  N   GLU A  15      -7.668   0.286  -1.378  1.00  0.27           N  
ATOM    217  CA  GLU A  15      -6.697   0.640  -2.400  1.00  0.27           C  
ATOM    218  C   GLU A  15      -5.435   1.186  -1.743  1.00  0.21           C  
ATOM    219  O   GLU A  15      -5.520   2.096  -0.919  1.00  0.33           O  
ATOM    220  CB  GLU A  15      -7.273   1.686  -3.352  1.00  0.31           C  
ATOM    221  CG  GLU A  15      -8.531   1.236  -4.074  1.00  0.37           C  
ATOM    222  CD  GLU A  15      -9.065   2.303  -4.997  1.00  0.84           C  
ATOM    223  OE1 GLU A  15      -9.561   3.331  -4.493  1.00  1.65           O  
ATOM    224  OE2 GLU A  15      -8.989   2.125  -6.231  1.00  0.80           O1-
ATOM    225  H   GLU A  15      -8.000   0.983  -0.769  1.00  0.38           H  
ATOM    226  HA  GLU A  15      -6.452  -0.253  -2.953  1.00  0.31           H  
ATOM    227  HB2 GLU A  15      -7.512   2.574  -2.786  1.00  0.31           H  
ATOM    228  HB3 GLU A  15      -6.526   1.932  -4.093  1.00  0.34           H  
ATOM    229  HG2 GLU A  15      -8.303   0.356  -4.657  1.00  0.85           H  
ATOM    230  HG3 GLU A  15      -9.288   1.000  -3.342  1.00  0.82           H  
HETATM  231  N   MVA A  16      -4.250   0.656  -2.094  1.00  0.25           N  
HETATM  232  CN  MVA A  16      -4.207  -0.395  -3.135  1.00  0.53           C  
HETATM  233  CA  MVA A  16      -3.003   1.151  -1.476  1.00  0.19           C  
HETATM  234  CB  MVA A  16      -2.343   0.127  -0.493  1.00  0.21           C  
HETATM  235  CG1 MVA A  16      -1.808  -1.114  -1.188  1.00  0.36           C  
HETATM  236  CG2 MVA A  16      -1.229   0.801   0.299  1.00  0.21           C  
HETATM  237  C   MVA A  16      -1.978   1.611  -2.519  1.00  0.24           C  
HETATM  238  O   MVA A  16      -1.457   0.833  -3.325  1.00  0.48           O  
HETATM  239  HN1 MVA A  16      -3.180  -0.589  -3.407  1.00  1.23           H  
HETATM  240  HN2 MVA A  16      -4.751  -0.061  -4.006  1.00  1.12           H  
HETATM  241  HN3 MVA A  16      -4.654  -1.300  -2.754  1.00  1.12           H  
HETATM  242  HA  MVA A  16      -3.244   2.027  -0.884  1.00  0.20           H  
HETATM  243  HB  MVA A  16      -3.096  -0.192   0.212  1.00  0.37           H  
HETATM  244 HG11 MVA A  16      -1.121  -0.819  -1.969  1.00  1.08           H  
HETATM  245 HG12 MVA A  16      -2.628  -1.669  -1.616  1.00  1.13           H  
HETATM  246 HG13 MVA A  16      -1.289  -1.731  -0.468  1.00  1.07           H  
HETATM  247 HG21 MVA A  16      -0.504   1.219  -0.385  1.00  1.05           H  
HETATM  248 HG22 MVA A  16      -0.744   0.071   0.931  1.00  1.05           H  
HETATM  249 HG23 MVA A  16      -1.644   1.589   0.910  1.00  0.94           H  
ATOM    250  N   ARG A  17      -1.713   2.900  -2.496  1.00  0.23           N  
ATOM    251  CA  ARG A  17      -0.741   3.515  -3.366  1.00  0.27           C  
ATOM    252  C   ARG A  17       0.607   3.572  -2.660  1.00  0.23           C  
ATOM    253  O   ARG A  17       0.824   4.406  -1.780  1.00  0.34           O  
ATOM    254  CB  ARG A  17      -1.208   4.922  -3.735  1.00  0.34           C  
ATOM    255  CG  ARG A  17      -0.256   5.670  -4.646  1.00  1.33           C  
ATOM    256  CD  ARG A  17      -0.693   7.114  -4.833  1.00  1.48           C  
ATOM    257  NE  ARG A  17       0.236   7.863  -5.677  1.00  2.36           N  
ATOM    258  CZ  ARG A  17       0.803   9.017  -5.325  1.00  3.00           C  
ATOM    259  NH1 ARG A  17       0.550   9.560  -4.137  1.00  3.01           N1+
ATOM    260  NH2 ARG A  17       1.628   9.629  -6.166  1.00  3.96           N  
ATOM    261  H   ARG A  17      -2.189   3.466  -1.849  1.00  0.34           H  
ATOM    262  HA  ARG A  17      -0.652   2.917  -4.259  1.00  0.31           H  
ATOM    263  HB2 ARG A  17      -2.163   4.852  -4.231  1.00  1.08           H  
ATOM    264  HB3 ARG A  17      -1.326   5.495  -2.829  1.00  0.90           H  
ATOM    265  HG2 ARG A  17       0.731   5.650  -4.209  1.00  2.00           H  
ATOM    266  HG3 ARG A  17      -0.235   5.178  -5.608  1.00  1.97           H  
ATOM    267  HD2 ARG A  17      -1.671   7.128  -5.293  1.00  1.68           H  
ATOM    268  HD3 ARG A  17      -0.747   7.588  -3.864  1.00  1.71           H  
ATOM    269  HE  ARG A  17       0.445   7.486  -6.562  1.00  2.76           H  
ATOM    270 HH11 ARG A  17       0.978  10.427  -3.877  1.00  3.63           H  
ATOM    271 HH12 ARG A  17      -0.078   9.103  -3.487  1.00  2.64           H  
ATOM    272 HH21 ARG A  17       1.821   9.226  -7.065  1.00  4.30           H  
ATOM    273 HH22 ARG A  17       2.066  10.493  -5.905  1.00  4.48           H  
ATOM    274  N   CYS A  18       1.493   2.664  -3.018  1.00  0.27           N  
ATOM    275  CA  CYS A  18       2.817   2.619  -2.423  1.00  0.31           C  
ATOM    276  C   CYS A  18       3.737   3.621  -3.109  1.00  0.38           C  
ATOM    277  O   CYS A  18       3.823   3.657  -4.339  1.00  0.41           O  
ATOM    278  CB  CYS A  18       3.390   1.203  -2.529  1.00  0.37           C  
ATOM    279  SG  CYS A  18       3.383   0.527  -4.222  1.00  0.47           S  
ATOM    280  H   CYS A  18       1.255   2.008  -3.705  1.00  0.40           H  
ATOM    281  HA  CYS A  18       2.723   2.886  -1.380  1.00  0.33           H  
ATOM    282  HB2 CYS A  18       4.413   1.209  -2.182  1.00  0.45           H  
ATOM    283  HB3 CYS A  18       2.808   0.539  -1.907  1.00  0.37           H  
ATOM    284  N   ASP A  19       4.406   4.446  -2.321  1.00  0.50           N  
ATOM    285  CA  ASP A  19       5.311   5.449  -2.863  1.00  0.68           C  
ATOM    286  C   ASP A  19       6.601   5.480  -2.057  1.00  0.80           C  
ATOM    287  O   ASP A  19       6.684   6.165  -1.036  1.00  0.84           O  
ATOM    288  CB  ASP A  19       4.660   6.832  -2.856  1.00  0.80           C  
ATOM    289  CG  ASP A  19       5.543   7.881  -3.503  1.00  1.11           C  
ATOM    290  OD1 ASP A  19       6.026   8.789  -2.789  1.00  1.76           O  
ATOM    291  OD2 ASP A  19       5.768   7.801  -4.728  1.00  1.10           O1-
ATOM    292  H   ASP A  19       4.301   4.375  -1.345  1.00  0.49           H  
ATOM    293  HA  ASP A  19       5.540   5.172  -3.879  1.00  0.74           H  
ATOM    294  HB2 ASP A  19       3.726   6.788  -3.396  1.00  1.05           H  
ATOM    295  HB3 ASP A  19       4.470   7.126  -1.835  1.00  1.05           H  
HETATM  296  N   DPR A  20       7.619   4.730  -2.503  1.00  0.95           N  
HETATM  297  CA  DPR A  20       8.892   4.614  -1.790  1.00  1.13           C  
HETATM  298  CB  DPR A  20       9.675   3.583  -2.601  1.00  1.31           C  
HETATM  299  CG  DPR A  20       9.063   3.616  -3.956  1.00  1.35           C  
HETATM  300  CD  DPR A  20       7.613   3.942  -3.746  1.00  1.02           C  
HETATM  301  C   DPR A  20       8.696   4.132  -0.354  1.00  1.11           C  
HETATM  302  O   DPR A  20       8.210   3.024  -0.120  1.00  1.10           O  
HETATM  303  HA  DPR A  20       9.432   5.547  -1.788  1.00  1.22           H  
HETATM  304  HB2 DPR A  20      10.717   3.860  -2.630  1.00  1.44           H  
HETATM  305  HB3 DPR A  20       9.567   2.611  -2.147  1.00  1.39           H  
HETATM  306  HG2 DPR A  20       9.538   4.379  -4.558  1.00  1.54           H  
HETATM  307  HG3 DPR A  20       9.165   2.650  -4.428  1.00  1.59           H  
HETATM  308  HD2 DPR A  20       7.239   4.527  -4.572  1.00  1.05           H  
HETATM  309  HD3 DPR A  20       7.037   3.040  -3.626  1.00  0.93           H  
ATOM    310  N   PRO A  21       9.060   4.970   0.623  1.00  1.18           N  
ATOM    311  CA  PRO A  21       8.922   4.645   2.042  1.00  1.23           C  
ATOM    312  C   PRO A  21       7.504   4.881   2.566  1.00  1.04           C  
ATOM    313  O   PRO A  21       7.187   4.547   3.709  1.00  1.12           O  
ATOM    314  CB  PRO A  21       9.899   5.615   2.699  1.00  1.43           C  
ATOM    315  CG  PRO A  21       9.864   6.817   1.822  1.00  1.40           C  
ATOM    316  CD  PRO A  21       9.657   6.305   0.421  1.00  1.30           C  
ATOM    317  HA  PRO A  21       9.221   3.629   2.250  1.00  1.35           H  
ATOM    318  HB2 PRO A  21       9.567   5.842   3.701  1.00  1.46           H  
ATOM    319  HB3 PRO A  21      10.884   5.176   2.728  1.00  1.61           H  
ATOM    320  HG2 PRO A  21       9.046   7.456   2.113  1.00  1.32           H  
ATOM    321  HG3 PRO A  21      10.800   7.351   1.891  1.00  1.59           H  
ATOM    322  HD2 PRO A  21       8.981   6.948  -0.121  1.00  1.23           H  
ATOM    323  HD3 PRO A  21      10.601   6.227  -0.097  1.00  1.47           H  
ATOM    324  N   ARG A  22       6.655   5.455   1.727  1.00  0.84           N  
ATOM    325  CA  ARG A  22       5.299   5.794   2.131  1.00  0.70           C  
ATOM    326  C   ARG A  22       4.292   4.870   1.468  1.00  0.52           C  
ATOM    327  O   ARG A  22       4.605   4.183   0.496  1.00  0.54           O  
ATOM    328  CB  ARG A  22       4.966   7.234   1.742  1.00  0.82           C  
ATOM    329  CG  ARG A  22       5.962   8.268   2.234  1.00  1.37           C  
ATOM    330  CD  ARG A  22       5.567   9.664   1.773  1.00  1.91           C  
ATOM    331  NE  ARG A  22       5.340   9.714   0.325  1.00  2.59           N  
ATOM    332  CZ  ARG A  22       4.241  10.216  -0.244  1.00  3.29           C  
ATOM    333  NH1 ARG A  22       3.283  10.756   0.496  1.00  3.45           N1+
ATOM    334  NH2 ARG A  22       4.100  10.175  -1.560  1.00  4.24           N  
ATOM    335  H   ARG A  22       6.941   5.644   0.805  1.00  0.84           H  
ATOM    336  HA  ARG A  22       5.226   5.686   3.202  1.00  0.71           H  
ATOM    337  HB2 ARG A  22       4.923   7.297   0.665  1.00  1.26           H  
ATOM    338  HB3 ARG A  22       3.994   7.484   2.144  1.00  0.94           H  
ATOM    339  HG2 ARG A  22       5.987   8.247   3.314  1.00  1.75           H  
ATOM    340  HG3 ARG A  22       6.940   8.030   1.843  1.00  1.90           H  
ATOM    341  HD2 ARG A  22       4.660   9.953   2.282  1.00  1.99           H  
ATOM    342  HD3 ARG A  22       6.358  10.354   2.030  1.00  2.56           H  
ATOM    343  HE  ARG A  22       6.044   9.339  -0.255  1.00  2.93           H  
ATOM    344 HH11 ARG A  22       3.374  10.793   1.495  1.00  3.20           H  
ATOM    345 HH12 ARG A  22       2.462  11.132   0.060  1.00  4.13           H  
ATOM    346 HH21 ARG A  22       3.275  10.553  -1.991  1.00  4.82           H  
ATOM    347 HH22 ARG A  22       4.819   9.754  -2.134  1.00  4.54           H  
ATOM    348  N   TYR A  23       3.086   4.860   2.003  1.00  0.40           N  
ATOM    349  CA  TYR A  23       1.975   4.172   1.381  1.00  0.29           C  
ATOM    350  C   TYR A  23       0.679   4.868   1.753  1.00  0.24           C  
ATOM    351  O   TYR A  23       0.518   5.346   2.877  1.00  0.30           O  
ATOM    352  CB  TYR A  23       1.928   2.697   1.793  1.00  0.28           C  
ATOM    353  CG  TYR A  23       1.616   2.466   3.254  1.00  0.27           C  
ATOM    354  CD1 TYR A  23       0.323   2.168   3.666  1.00  0.26           C  
ATOM    355  CD2 TYR A  23       2.611   2.544   4.218  1.00  0.33           C  
ATOM    356  CE1 TYR A  23       0.031   1.958   4.998  1.00  0.29           C  
ATOM    357  CE2 TYR A  23       2.327   2.334   5.553  1.00  0.37           C  
ATOM    358  CZ  TYR A  23       1.035   2.042   5.939  1.00  0.35           C  
ATOM    359  OH  TYR A  23       0.746   1.836   7.269  1.00  0.42           O  
ATOM    360  H   TYR A  23       2.936   5.331   2.850  1.00  0.41           H  
ATOM    361  HA  TYR A  23       2.105   4.233   0.311  1.00  0.32           H  
ATOM    362  HB2 TYR A  23       1.169   2.197   1.214  1.00  0.28           H  
ATOM    363  HB3 TYR A  23       2.886   2.248   1.582  1.00  0.34           H  
ATOM    364  HD1 TYR A  23      -0.461   2.106   2.926  1.00  0.26           H  
ATOM    365  HD2 TYR A  23       3.622   2.775   3.911  1.00  0.36           H  
ATOM    366  HE1 TYR A  23      -0.981   1.726   5.296  1.00  0.29           H  
ATOM    367  HE2 TYR A  23       3.115   2.402   6.287  1.00  0.44           H  
ATOM    368  HH  TYR A  23       1.149   2.540   7.797  1.00  0.90           H  
ATOM    369  N   GLU A  24      -0.223   4.955   0.803  1.00  0.20           N  
ATOM    370  CA  GLU A  24      -1.507   5.580   1.032  1.00  0.21           C  
ATOM    371  C   GLU A  24      -2.602   4.544   0.849  1.00  0.19           C  
ATOM    372  O   GLU A  24      -2.567   3.785  -0.106  1.00  0.32           O  
ATOM    373  CB  GLU A  24      -1.705   6.741   0.060  1.00  0.32           C  
ATOM    374  CG  GLU A  24      -0.540   7.716   0.044  1.00  0.49           C  
ATOM    375  CD  GLU A  24      -0.791   8.909  -0.847  1.00  1.22           C  
ATOM    376  OE1 GLU A  24      -0.845  10.043  -0.324  1.00  1.64           O  
ATOM    377  OE2 GLU A  24      -0.949   8.724  -2.070  1.00  1.99           O1-
ATOM    378  H   GLU A  24      -0.024   4.581  -0.084  1.00  0.21           H  
ATOM    379  HA  GLU A  24      -1.528   5.950   2.045  1.00  0.27           H  
ATOM    380  HB2 GLU A  24      -1.831   6.342  -0.935  1.00  0.32           H  
ATOM    381  HB3 GLU A  24      -2.597   7.281   0.337  1.00  0.43           H  
ATOM    382  HG2 GLU A  24      -0.369   8.068   1.051  1.00  0.85           H  
ATOM    383  HG3 GLU A  24       0.341   7.200  -0.310  1.00  0.91           H  
HETATM  384  N   MVA A  25      -3.590   4.485   1.740  1.00  0.17           N  
HETATM  385  CN  MVA A  25      -3.682   5.518   2.796  1.00  0.28           C  
HETATM  386  CA  MVA A  25      -4.605   3.424   1.628  1.00  0.18           C  
HETATM  387  CB  MVA A  25      -4.290   2.188   2.525  1.00  0.28           C  
HETATM  388  CG1 MVA A  25      -4.012   2.566   3.970  1.00  0.51           C  
HETATM  389  CG2 MVA A  25      -5.427   1.180   2.450  1.00  0.76           C  
HETATM  390  C   MVA A  25      -6.023   3.924   1.891  1.00  0.25           C  
HETATM  391  O   MVA A  25      -6.381   4.348   2.994  1.00  0.47           O  
HETATM  392  HN1 MVA A  25      -4.662   5.482   3.250  1.00  1.20           H  
HETATM  393  HN2 MVA A  25      -3.524   6.493   2.359  1.00  0.93           H  
HETATM  394  HN3 MVA A  25      -2.931   5.332   3.547  1.00  1.04           H  
HETATM  395  HA  MVA A  25      -4.599   3.062   0.608  1.00  0.17           H  
HETATM  396  HB  MVA A  25      -3.404   1.712   2.134  1.00  0.69           H  
HETATM  397 HG11 MVA A  25      -3.094   3.134   4.020  1.00  1.16           H  
HETATM  398 HG12 MVA A  25      -3.915   1.670   4.563  1.00  1.12           H  
HETATM  399 HG13 MVA A  25      -4.826   3.164   4.349  1.00  1.28           H  
HETATM  400 HG21 MVA A  25      -6.348   1.652   2.763  1.00  1.28           H  
HETATM  401 HG22 MVA A  25      -5.211   0.346   3.101  1.00  1.27           H  
HETATM  402 HG23 MVA A  25      -5.531   0.828   1.435  1.00  1.43           H  
ATOM    403  N   HIS A  26      -6.829   3.860   0.845  1.00  0.17           N  
ATOM    404  CA  HIS A  26      -8.202   4.317   0.903  1.00  0.24           C  
ATOM    405  C   HIS A  26      -9.140   3.129   1.008  1.00  0.32           C  
ATOM    406  O   HIS A  26      -9.080   2.210   0.195  1.00  0.43           O  
ATOM    407  CB  HIS A  26      -8.551   5.140  -0.339  1.00  0.32           C  
ATOM    408  CG  HIS A  26      -7.784   6.422  -0.464  1.00  0.44           C  
ATOM    409  ND1 HIS A  26      -8.327   7.653  -0.172  1.00  0.57           N  
ATOM    410  CD2 HIS A  26      -6.514   6.660  -0.871  1.00  0.55           C  
ATOM    411  CE1 HIS A  26      -7.427   8.591  -0.393  1.00  0.72           C  
ATOM    412  NE2 HIS A  26      -6.317   8.017  -0.817  1.00  0.70           N  
ATOM    413  H   HIS A  26      -6.490   3.466   0.008  1.00  0.22           H  
ATOM    414  HA  HIS A  26      -8.312   4.933   1.780  1.00  0.30           H  
ATOM    415  HB2 HIS A  26      -8.350   4.548  -1.216  1.00  0.33           H  
ATOM    416  HB3 HIS A  26      -9.602   5.382  -0.313  1.00  0.40           H  
ATOM    417  HD1 HIS A  26      -9.241   7.815   0.157  1.00  0.61           H  
ATOM    418  HD2 HIS A  26      -5.788   5.918  -1.176  1.00  0.59           H  
ATOM    419  HE1 HIS A  26      -7.574   9.651  -0.251  1.00  0.87           H  
ATOM    420  HE2 HIS A  26      -5.445   8.466  -0.893  1.00  0.83           H  
ATOM    421  N   CYS A  27      -9.988   3.147   2.016  1.00  0.38           N  
ATOM    422  CA  CYS A  27     -10.960   2.093   2.213  1.00  0.50           C  
ATOM    423  C   CYS A  27     -12.367   2.655   2.077  1.00  0.74           C  
ATOM    424  O   CYS A  27     -13.023   2.978   3.068  1.00  1.38           O  
ATOM    425  CB  CYS A  27     -10.780   1.452   3.587  1.00  0.59           C  
ATOM    426  SG  CYS A  27      -9.157   0.657   3.835  1.00  0.75           S  
ATOM    427  H   CYS A  27      -9.962   3.896   2.648  1.00  0.41           H  
ATOM    428  HA  CYS A  27     -10.802   1.345   1.450  1.00  0.47           H  
ATOM    429  HB2 CYS A  27     -10.892   2.213   4.345  1.00  0.95           H  
ATOM    430  HB3 CYS A  27     -11.542   0.701   3.724  1.00  0.83           H  
HETATM  431  N   NH2 A  28     -12.827   2.789   0.846  1.00  0.99           N  
HETATM  432  HN1 NH2 A  28     -12.250   2.511   0.101  1.00  1.44           H  
HETATM  433  HN2 NH2 A  28     -13.723   3.159   0.727  1.00  1.11           H  
TER     434      NH2 A  28                                                      
ENDMDL                                                                          
MODEL        2                                                                  
ATOM      1  N   ASN A   1       9.473 -11.289  -1.505  1.00  1.83           N  
ATOM      2  CA  ASN A   1       8.199 -10.542  -1.425  1.00  1.49           C  
ATOM      3  C   ASN A   1       8.475  -9.046  -1.425  1.00  1.11           C  
ATOM      4  O   ASN A   1       9.309  -8.563  -0.661  1.00  1.38           O  
ATOM      5  CB  ASN A   1       7.433 -10.934  -0.155  1.00  1.76           C  
ATOM      6  CG  ASN A   1       6.096 -10.225  -0.033  1.00  2.41           C  
ATOM      7  OD1 ASN A   1       6.002  -9.148   0.554  1.00  3.13           O  
ATOM      8  ND2 ASN A   1       5.051 -10.827  -0.580  1.00  2.72           N  
ATOM      9  H1  ASN A   1       9.972 -11.049  -2.385  1.00  1.62           H  
ATOM     10  H2  ASN A   1       9.292 -12.311  -1.486  1.00  2.41           H  
ATOM     11  H3  ASN A   1      10.081 -11.042  -0.697  1.00  2.27           H  
ATOM     12  HA  ASN A   1       7.603 -10.789  -2.292  1.00  1.51           H  
ATOM     13  HB2 ASN A   1       7.253 -11.997  -0.164  1.00  2.07           H  
ATOM     14  HB3 ASN A   1       8.032 -10.682   0.708  1.00  1.95           H  
ATOM     15 HD21 ASN A   1       5.195 -11.690  -1.030  1.00  2.63           H  
ATOM     16 HD22 ASN A   1       4.175 -10.393  -0.509  1.00  3.34           H  
ATOM     17  N   ASP A   2       7.791  -8.317  -2.292  1.00  0.74           N  
ATOM     18  CA  ASP A   2       7.983  -6.877  -2.393  1.00  0.50           C  
ATOM     19  C   ASP A   2       7.102  -6.148  -1.387  1.00  0.36           C  
ATOM     20  O   ASP A   2       5.994  -6.598  -1.094  1.00  0.33           O  
ATOM     21  CB  ASP A   2       7.670  -6.389  -3.808  1.00  0.73           C  
ATOM     22  CG  ASP A   2       7.971  -4.917  -3.989  1.00  1.34           C  
ATOM     23  OD1 ASP A   2       7.023  -4.109  -3.972  1.00  2.21           O  
ATOM     24  OD2 ASP A   2       9.155  -4.560  -4.152  1.00  1.35           O1-
ATOM     25  H   ASP A   2       7.141  -8.755  -2.879  1.00  0.90           H  
ATOM     26  HA  ASP A   2       9.016  -6.664  -2.168  1.00  0.62           H  
ATOM     27  HB2 ASP A   2       8.263  -6.948  -4.516  1.00  1.22           H  
ATOM     28  HB3 ASP A   2       6.623  -6.550  -4.013  1.00  1.02           H  
HETATM   29  N   AIB A   3       7.606  -5.026  -0.869  1.00  0.36           N  
HETATM   30  CA  AIB A   3       6.886  -4.213   0.123  1.00  0.37           C  
HETATM   31  C   AIB A   3       5.483  -3.880  -0.400  1.00  0.33           C  
HETATM   32  O   AIB A   3       4.484  -4.023   0.313  1.00  0.30           O  
HETATM   33  CB1 AIB A   3       7.646  -2.924   0.375  1.00  0.49           C  
HETATM   34  CB2 AIB A   3       6.803  -4.956   1.443  1.00  0.41           C  
HETATM   35  H   AIB A   3       8.493  -4.729  -1.162  1.00  0.41           H  
HETATM   36 HB11 AIB A   3       8.643  -3.155   0.717  1.00  1.25           H  
HETATM   37 HB12 AIB A   3       7.132  -2.344   1.126  1.00  0.95           H  
HETATM   38 HB13 AIB A   3       7.704  -2.355  -0.541  1.00  1.20           H  
HETATM   39 HB21 AIB A   3       7.800  -5.141   1.816  1.00  1.26           H  
HETATM   40 HB22 AIB A   3       6.296  -5.897   1.293  1.00  1.09           H  
HETATM   41 HB23 AIB A   3       6.256  -4.360   2.157  1.00  0.94           H  
ATOM     42  N   CYS A   4       5.415  -3.459  -1.658  1.00  0.37           N  
ATOM     43  CA  CYS A   4       4.156  -3.058  -2.262  1.00  0.40           C  
ATOM     44  C   CYS A   4       3.222  -4.248  -2.420  1.00  0.32           C  
ATOM     45  O   CYS A   4       2.002  -4.107  -2.331  1.00  0.33           O  
ATOM     46  CB  CYS A   4       4.402  -2.404  -3.617  1.00  0.49           C  
ATOM     47  SG  CYS A   4       5.384  -0.873  -3.529  1.00  1.18           S  
ATOM     48  H   CYS A   4       6.235  -3.426  -2.199  1.00  0.41           H  
ATOM     49  HA  CYS A   4       3.691  -2.339  -1.607  1.00  0.43           H  
ATOM     50  HB2 CYS A   4       4.929  -3.095  -4.252  1.00  1.21           H  
ATOM     51  HB3 CYS A   4       3.453  -2.160  -4.068  1.00  1.05           H  
ATOM     52  N   LYS A   5       3.795  -5.422  -2.646  1.00  0.30           N  
ATOM     53  CA  LYS A   5       3.000  -6.630  -2.780  1.00  0.31           C  
ATOM     54  C   LYS A   5       2.413  -7.012  -1.430  1.00  0.20           C  
ATOM     55  O   LYS A   5       1.239  -7.369  -1.334  1.00  0.20           O  
ATOM     56  CB  LYS A   5       3.839  -7.784  -3.339  1.00  0.39           C  
ATOM     57  CG  LYS A   5       3.019  -9.025  -3.656  1.00  0.80           C  
ATOM     58  CD  LYS A   5       3.874 -10.142  -4.228  1.00  1.37           C  
ATOM     59  CE  LYS A   5       3.024 -11.342  -4.625  1.00  2.05           C  
ATOM     60  NZ  LYS A   5       2.006 -10.986  -5.652  1.00  2.62           N1+
ATOM     61  H   LYS A   5       4.772  -5.476  -2.718  1.00  0.32           H  
ATOM     62  HA  LYS A   5       2.191  -6.416  -3.461  1.00  0.38           H  
ATOM     63  HB2 LYS A   5       4.323  -7.454  -4.246  1.00  0.76           H  
ATOM     64  HB3 LYS A   5       4.593  -8.050  -2.613  1.00  0.63           H  
ATOM     65  HG2 LYS A   5       2.549  -9.377  -2.748  1.00  1.40           H  
ATOM     66  HG3 LYS A   5       2.257  -8.765  -4.377  1.00  1.26           H  
ATOM     67  HD2 LYS A   5       4.393  -9.774  -5.101  1.00  1.80           H  
ATOM     68  HD3 LYS A   5       4.593 -10.451  -3.482  1.00  1.90           H  
ATOM     69  HE2 LYS A   5       3.672 -12.110  -5.023  1.00  2.44           H  
ATOM     70  HE3 LYS A   5       2.521 -11.717  -3.746  1.00  2.54           H  
ATOM     71  HZ1 LYS A   5       1.384 -10.232  -5.297  1.00  2.86           H  
ATOM     72  HZ2 LYS A   5       1.425 -11.815  -5.883  1.00  2.84           H  
ATOM     73  HZ3 LYS A   5       2.472 -10.653  -6.520  1.00  3.23           H  
HETATM   74  N   AIB A   6       3.242  -6.914  -0.391  1.00  0.16           N  
HETATM   75  CA  AIB A   6       2.816  -7.189   0.983  1.00  0.16           C  
HETATM   76  C   AIB A   6       1.630  -6.287   1.329  1.00  0.12           C  
HETATM   77  O   AIB A   6       0.595  -6.757   1.818  1.00  0.16           O  
HETATM   78  CB1 AIB A   6       3.954  -6.909   1.939  1.00  0.22           C  
HETATM   79  CB2 AIB A   6       2.444  -8.651   1.139  1.00  0.25           C  
HETATM   80  H   AIB A   6       4.174  -6.646  -0.554  1.00  0.18           H  
HETATM   81 HB11 AIB A   6       4.806  -7.520   1.676  1.00  1.10           H  
HETATM   82 HB12 AIB A   6       3.642  -7.141   2.947  1.00  1.03           H  
HETATM   83 HB13 AIB A   6       4.227  -5.865   1.878  1.00  0.90           H  
HETATM   84 HB21 AIB A   6       2.135  -8.836   2.156  1.00  1.08           H  
HETATM   85 HB22 AIB A   6       3.299  -9.267   0.905  1.00  1.03           H  
HETATM   86 HB23 AIB A   6       1.635  -8.888   0.467  1.00  1.03           H  
ATOM     87  N   LEU A   7       1.787  -4.993   1.052  1.00  0.12           N  
ATOM     88  CA  LEU A   7       0.744  -4.015   1.336  1.00  0.16           C  
ATOM     89  C   LEU A   7      -0.514  -4.320   0.540  1.00  0.17           C  
ATOM     90  O   LEU A   7      -1.610  -4.326   1.088  1.00  0.21           O  
ATOM     91  CB  LEU A   7       1.212  -2.597   1.003  1.00  0.23           C  
ATOM     92  CG  LEU A   7       2.404  -2.080   1.811  1.00  0.28           C  
ATOM     93  CD1 LEU A   7       2.811  -0.703   1.316  1.00  0.38           C  
ATOM     94  CD2 LEU A   7       2.063  -2.023   3.293  1.00  0.35           C  
ATOM     95  H   LEU A   7       2.630  -4.688   0.643  1.00  0.15           H  
ATOM     96  HA  LEU A   7       0.512  -4.074   2.387  1.00  0.19           H  
ATOM     97  HB2 LEU A   7       1.475  -2.567  -0.042  1.00  0.25           H  
ATOM     98  HB3 LEU A   7       0.382  -1.924   1.163  1.00  0.28           H  
ATOM     99  HG  LEU A   7       3.242  -2.750   1.680  1.00  0.24           H  
ATOM    100 HD11 LEU A   7       3.646  -0.345   1.898  1.00  1.02           H  
ATOM    101 HD12 LEU A   7       1.978  -0.023   1.423  1.00  0.98           H  
ATOM    102 HD13 LEU A   7       3.096  -0.763   0.277  1.00  1.03           H  
ATOM    103 HD21 LEU A   7       1.221  -1.366   3.441  1.00  1.14           H  
ATOM    104 HD22 LEU A   7       2.913  -1.648   3.843  1.00  0.90           H  
ATOM    105 HD23 LEU A   7       1.816  -3.014   3.646  1.00  1.09           H  
ATOM    106  N   LYS A   8      -0.347  -4.581  -0.746  1.00  0.19           N  
ATOM    107  CA  LYS A   8      -1.480  -4.820  -1.625  1.00  0.27           C  
ATOM    108  C   LYS A   8      -2.268  -6.042  -1.166  1.00  0.25           C  
ATOM    109  O   LYS A   8      -3.490  -5.995  -1.076  1.00  0.31           O  
ATOM    110  CB  LYS A   8      -1.005  -4.997  -3.068  1.00  0.35           C  
ATOM    111  CG  LYS A   8      -2.133  -5.021  -4.085  1.00  1.12           C  
ATOM    112  CD  LYS A   8      -1.597  -5.129  -5.502  1.00  1.10           C  
ATOM    113  CE  LYS A   8      -2.717  -5.064  -6.528  1.00  2.05           C  
ATOM    114  NZ  LYS A   8      -3.466  -3.780  -6.458  1.00  2.55           N1+
ATOM    115  H   LYS A   8       0.564  -4.611  -1.116  1.00  0.20           H  
ATOM    116  HA  LYS A   8      -2.123  -3.955  -1.571  1.00  0.31           H  
ATOM    117  HB2 LYS A   8      -0.341  -4.184  -3.319  1.00  0.78           H  
ATOM    118  HB3 LYS A   8      -0.463  -5.929  -3.142  1.00  1.00           H  
ATOM    119  HG2 LYS A   8      -2.767  -5.871  -3.883  1.00  1.72           H  
ATOM    120  HG3 LYS A   8      -2.707  -4.111  -3.994  1.00  1.60           H  
ATOM    121  HD2 LYS A   8      -0.911  -4.315  -5.679  1.00  1.29           H  
ATOM    122  HD3 LYS A   8      -1.076  -6.070  -5.608  1.00  1.23           H  
ATOM    123  HE2 LYS A   8      -2.291  -5.167  -7.515  1.00  2.55           H  
ATOM    124  HE3 LYS A   8      -3.400  -5.880  -6.347  1.00  2.55           H  
ATOM    125  HZ1 LYS A   8      -3.919  -3.679  -5.529  1.00  2.92           H  
ATOM    126  HZ2 LYS A   8      -4.201  -3.754  -7.192  1.00  2.95           H  
ATOM    127  HZ3 LYS A   8      -2.820  -2.980  -6.607  1.00  2.82           H  
HETATM  128  N   AIB A   9      -1.548  -7.120  -0.857  1.00  0.21           N  
HETATM  129  CA  AIB A   9      -2.155  -8.360  -0.360  1.00  0.24           C  
HETATM  130  C   AIB A   9      -2.889  -8.073   0.954  1.00  0.26           C  
HETATM  131  O   AIB A   9      -3.985  -8.581   1.199  1.00  0.35           O  
HETATM  132  CB1 AIB A   9      -1.071  -9.390  -0.114  1.00  0.23           C  
HETATM  133  CB2 AIB A   9      -3.103  -8.939  -1.393  1.00  0.32           C  
HETATM  134  H   AIB A   9      -0.572  -7.084  -0.967  1.00  0.18           H  
HETATM  135 HB11 AIB A   9      -1.519 -10.309   0.232  1.00  1.04           H  
HETATM  136 HB12 AIB A   9      -0.387  -9.018   0.634  1.00  0.97           H  
HETATM  137 HB13 AIB A   9      -0.535  -9.576  -1.033  1.00  1.10           H  
HETATM  138 HB21 AIB A   9      -3.562  -9.833  -0.999  1.00  1.03           H  
HETATM  139 HB22 AIB A   9      -2.553  -9.181  -2.291  1.00  1.10           H  
HETATM  140 HB23 AIB A   9      -3.866  -8.214  -1.624  1.00  0.99           H  
ATOM    141  N   ARG A  10      -2.266  -7.252   1.792  1.00  0.21           N  
ATOM    142  CA  ARG A  10      -2.813  -6.916   3.100  1.00  0.27           C  
ATOM    143  C   ARG A  10      -4.092  -6.094   2.971  1.00  0.33           C  
ATOM    144  O   ARG A  10      -5.065  -6.317   3.689  1.00  0.44           O  
ATOM    145  CB  ARG A  10      -1.763  -6.155   3.914  1.00  0.28           C  
ATOM    146  CG  ARG A  10      -2.216  -5.762   5.308  1.00  0.37           C  
ATOM    147  CD  ARG A  10      -1.069  -5.173   6.114  1.00  0.46           C  
ATOM    148  NE  ARG A  10       0.017  -6.138   6.305  1.00  1.04           N  
ATOM    149  CZ  ARG A  10       1.217  -5.834   6.799  1.00  1.36           C  
ATOM    150  NH1 ARG A  10       1.510  -4.589   7.145  1.00  1.26           N1+
ATOM    151  NH2 ARG A  10       2.129  -6.786   6.943  1.00  2.18           N  
ATOM    152  H   ARG A  10      -1.407  -6.854   1.521  1.00  0.16           H  
ATOM    153  HA  ARG A  10      -3.045  -7.839   3.604  1.00  0.33           H  
ATOM    154  HB2 ARG A  10      -0.883  -6.772   4.009  1.00  0.30           H  
ATOM    155  HB3 ARG A  10      -1.498  -5.252   3.380  1.00  0.27           H  
ATOM    156  HG2 ARG A  10      -3.001  -5.025   5.223  1.00  0.45           H  
ATOM    157  HG3 ARG A  10      -2.593  -6.637   5.815  1.00  0.42           H  
ATOM    158  HD2 ARG A  10      -0.683  -4.310   5.591  1.00  0.90           H  
ATOM    159  HD3 ARG A  10      -1.444  -4.868   7.080  1.00  1.00           H  
ATOM    160  HE  ARG A  10      -0.164  -7.073   6.057  1.00  1.56           H  
ATOM    161 HH11 ARG A  10       2.417  -4.370   7.517  1.00  1.61           H  
ATOM    162 HH12 ARG A  10       0.825  -3.861   7.045  1.00  1.29           H  
ATOM    163 HH21 ARG A  10       1.916  -7.731   6.682  1.00  2.69           H  
ATOM    164 HH22 ARG A  10       3.034  -6.563   7.317  1.00  2.46           H  
ATOM    165  N   TYR A  11      -4.089  -5.162   2.034  1.00  0.31           N  
ATOM    166  CA  TYR A  11      -5.209  -4.257   1.842  1.00  0.39           C  
ATOM    167  C   TYR A  11      -6.068  -4.696   0.659  1.00  0.58           C  
ATOM    168  O   TYR A  11      -6.425  -3.889  -0.194  1.00  0.93           O  
ATOM    169  CB  TYR A  11      -4.688  -2.835   1.625  1.00  0.32           C  
ATOM    170  CG  TYR A  11      -3.992  -2.257   2.835  1.00  0.24           C  
ATOM    171  CD1 TYR A  11      -4.721  -1.798   3.923  1.00  0.27           C  
ATOM    172  CD2 TYR A  11      -2.609  -2.168   2.890  1.00  0.24           C  
ATOM    173  CE1 TYR A  11      -4.091  -1.265   5.031  1.00  0.31           C  
ATOM    174  CE2 TYR A  11      -1.969  -1.639   3.994  1.00  0.24           C  
ATOM    175  CZ  TYR A  11      -2.714  -1.186   5.062  1.00  0.27           C  
ATOM    176  OH  TYR A  11      -2.080  -0.658   6.167  1.00  0.38           O  
ATOM    177  H   TYR A  11      -3.307  -5.082   1.444  1.00  0.29           H  
ATOM    178  HA  TYR A  11      -5.810  -4.276   2.738  1.00  0.44           H  
ATOM    179  HB2 TYR A  11      -3.980  -2.839   0.809  1.00  0.34           H  
ATOM    180  HB3 TYR A  11      -5.512  -2.191   1.374  1.00  0.37           H  
ATOM    181  HD1 TYR A  11      -5.799  -1.861   3.896  1.00  0.33           H  
ATOM    182  HD2 TYR A  11      -2.026  -2.524   2.051  1.00  0.32           H  
ATOM    183  HE1 TYR A  11      -4.677  -0.913   5.865  1.00  0.41           H  
ATOM    184  HE2 TYR A  11      -0.892  -1.582   4.015  1.00  0.29           H  
ATOM    185  HH  TYR A  11      -2.564  -0.913   6.965  1.00  0.93           H  
HETATM  186  N   AIB A  12      -6.412  -5.982   0.644  1.00  0.54           N  
HETATM  187  CA  AIB A  12      -7.210  -6.592  -0.438  1.00  0.73           C  
HETATM  188  C   AIB A  12      -8.507  -5.811  -0.687  1.00  0.64           C  
HETATM  189  O   AIB A  12      -8.965  -5.701  -1.827  1.00  1.44           O  
HETATM  190  CB1 AIB A  12      -7.552  -8.019  -0.063  1.00  1.05           C  
HETATM  191  CB2 AIB A  12      -6.401  -6.651  -1.717  1.00  1.04           C  
HETATM  192  H   AIB A  12      -6.108  -6.552   1.380  1.00  0.64           H  
HETATM  193 HB11 AIB A  12      -8.143  -8.021   0.840  1.00  1.35           H  
HETATM  194 HB12 AIB A  12      -6.642  -8.577   0.100  1.00  1.34           H  
HETATM  195 HB13 AIB A  12      -8.116  -8.476  -0.863  1.00  1.69           H  
HETATM  196 HB21 AIB A  12      -5.483  -7.186  -1.535  1.00  1.46           H  
HETATM  197 HB22 AIB A  12      -6.173  -5.648  -2.046  1.00  1.41           H  
HETATM  198 HB23 AIB A  12      -6.970  -7.161  -2.480  1.00  1.18           H  
ATOM    199  N   GLY A  13      -9.100  -5.279   0.370  1.00  0.60           N  
ATOM    200  CA  GLY A  13     -10.362  -4.580   0.227  1.00  0.84           C  
ATOM    201  C   GLY A  13     -10.199  -3.075   0.157  1.00  0.80           C  
ATOM    202  O   GLY A  13     -11.178  -2.331   0.257  1.00  1.24           O  
ATOM    203  H   GLY A  13      -8.678  -5.359   1.251  1.00  1.15           H  
ATOM    204  HA2 GLY A  13     -10.843  -4.920  -0.676  1.00  0.99           H  
ATOM    205  HA3 GLY A  13     -10.991  -4.825   1.069  1.00  1.02           H  
ATOM    206  N   CYS A  14      -8.971  -2.617  -0.022  1.00  0.33           N  
ATOM    207  CA  CYS A  14      -8.690  -1.193  -0.064  1.00  0.29           C  
ATOM    208  C   CYS A  14      -7.723  -0.879  -1.199  1.00  0.34           C  
ATOM    209  O   CYS A  14      -7.127  -1.779  -1.788  1.00  0.62           O  
ATOM    210  CB  CYS A  14      -8.093  -0.738   1.270  1.00  0.25           C  
ATOM    211  SG  CYS A  14      -9.005  -1.311   2.744  1.00  0.39           S  
ATOM    212  H   CYS A  14      -8.229  -3.255  -0.141  1.00  0.23           H  
ATOM    213  HA  CYS A  14      -9.618  -0.671  -0.233  1.00  0.35           H  
ATOM    214  HB2 CYS A  14      -7.087  -1.108   1.346  1.00  0.26           H  
ATOM    215  HB3 CYS A  14      -8.074   0.343   1.296  1.00  0.26           H  
ATOM    216  N   GLU A  15      -7.590   0.393  -1.517  1.00  0.27           N  
ATOM    217  CA  GLU A  15      -6.636   0.831  -2.520  1.00  0.27           C  
ATOM    218  C   GLU A  15      -5.373   1.343  -1.835  1.00  0.21           C  
ATOM    219  O   GLU A  15      -5.463   2.178  -0.932  1.00  0.33           O  
ATOM    220  CB  GLU A  15      -7.252   1.927  -3.391  1.00  0.31           C  
ATOM    221  CG  GLU A  15      -8.456   1.459  -4.193  1.00  0.37           C  
ATOM    222  CD  GLU A  15      -8.104   0.387  -5.206  1.00  0.84           C  
ATOM    223  OE1 GLU A  15      -8.419  -0.793  -4.957  1.00  1.65           O  
ATOM    224  OE2 GLU A  15      -7.497   0.716  -6.248  1.00  0.80           O1-
ATOM    225  H   GLU A  15      -8.150   1.062  -1.065  1.00  0.38           H  
ATOM    226  HA  GLU A  15      -6.386  -0.016  -3.138  1.00  0.31           H  
ATOM    227  HB2 GLU A  15      -7.564   2.743  -2.756  1.00  0.31           H  
ATOM    228  HB3 GLU A  15      -6.504   2.285  -4.081  1.00  0.34           H  
ATOM    229  HG2 GLU A  15      -9.191   1.059  -3.511  1.00  0.85           H  
ATOM    230  HG3 GLU A  15      -8.874   2.304  -4.716  1.00  0.82           H  
HETATM  231  N   MVA A  16      -4.183   0.856  -2.238  1.00  0.25           N  
HETATM  232  CN  MVA A  16      -4.134  -0.065  -3.395  1.00  0.53           C  
HETATM  233  CA  MVA A  16      -2.937   1.266  -1.560  1.00  0.19           C  
HETATM  234  CB  MVA A  16      -2.415   0.191  -0.554  1.00  0.21           C  
HETATM  235  CG1 MVA A  16      -1.973  -1.095  -1.237  1.00  0.36           C  
HETATM  236  CG2 MVA A  16      -1.276   0.760   0.279  1.00  0.21           C  
HETATM  237  C   MVA A  16      -1.812   1.657  -2.534  1.00  0.24           C  
HETATM  238  O   MVA A  16      -1.345   0.867  -3.362  1.00  0.48           O  
HETATM  239  HN1 MVA A  16      -4.541  -1.024  -3.111  1.00  1.23           H  
HETATM  240  HN2 MVA A  16      -3.108  -0.189  -3.711  1.00  1.12           H  
HETATM  241  HN3 MVA A  16      -4.712   0.345  -4.208  1.00  1.12           H  
HETATM  242  HA  MVA A  16      -3.147   2.150  -0.973  1.00  0.20           H  
HETATM  243  HB  MVA A  16      -3.222  -0.057   0.118  1.00  0.37           H  
HETATM  244 HG11 MVA A  16      -1.196  -0.871  -1.955  1.00  1.08           H  
HETATM  245 HG12 MVA A  16      -2.815  -1.543  -1.742  1.00  1.13           H  
HETATM  246 HG13 MVA A  16      -1.589  -1.781  -0.496  1.00  1.07           H  
HETATM  247 HG21 MVA A  16      -1.631   1.612   0.839  1.00  1.05           H  
HETATM  248 HG22 MVA A  16      -0.472   1.068  -0.374  1.00  1.05           H  
HETATM  249 HG23 MVA A  16      -0.916   0.005   0.961  1.00  0.94           H  
ATOM    250  N   ARG A  17      -1.384   2.899  -2.407  1.00  0.23           N  
ATOM    251  CA  ARG A  17      -0.304   3.452  -3.198  1.00  0.27           C  
ATOM    252  C   ARG A  17       0.970   3.502  -2.363  1.00  0.23           C  
ATOM    253  O   ARG A  17       1.035   4.205  -1.360  1.00  0.34           O  
ATOM    254  CB  ARG A  17      -0.702   4.851  -3.670  1.00  0.34           C  
ATOM    255  CG  ARG A  17       0.460   5.729  -4.084  1.00  1.33           C  
ATOM    256  CD  ARG A  17      -0.005   7.144  -4.387  1.00  1.48           C  
ATOM    257  NE  ARG A  17       1.097   8.104  -4.379  1.00  2.36           N  
ATOM    258  CZ  ARG A  17       0.952   9.399  -4.649  1.00  3.00           C  
ATOM    259  NH1 ARG A  17      -0.243   9.882  -4.978  1.00  3.01           N1+
ATOM    260  NH2 ARG A  17       1.999  10.213  -4.589  1.00  3.96           N  
ATOM    261  H   ARG A  17      -1.811   3.472  -1.736  1.00  0.34           H  
ATOM    262  HA  ARG A  17      -0.147   2.814  -4.053  1.00  0.31           H  
ATOM    263  HB2 ARG A  17      -1.365   4.752  -4.513  1.00  1.08           H  
ATOM    264  HB3 ARG A  17      -1.229   5.344  -2.871  1.00  0.90           H  
ATOM    265  HG2 ARG A  17       1.181   5.756  -3.281  1.00  2.00           H  
ATOM    266  HG3 ARG A  17       0.916   5.310  -4.969  1.00  1.97           H  
ATOM    267  HD2 ARG A  17      -0.471   7.156  -5.363  1.00  1.68           H  
ATOM    268  HD3 ARG A  17      -0.730   7.439  -3.642  1.00  1.71           H  
ATOM    269  HE  ARG A  17       1.998   7.761  -4.139  1.00  2.76           H  
ATOM    270 HH11 ARG A  17      -0.354  10.857  -5.181  1.00  3.63           H  
ATOM    271 HH12 ARG A  17      -1.039   9.269  -5.025  1.00  2.64           H  
ATOM    272 HH21 ARG A  17       2.902   9.854  -4.340  1.00  4.30           H  
ATOM    273 HH22 ARG A  17       1.894  11.190  -4.792  1.00  4.48           H  
ATOM    274  N   CYS A  18       1.972   2.741  -2.764  1.00  0.27           N  
ATOM    275  CA  CYS A  18       3.196   2.629  -1.986  1.00  0.31           C  
ATOM    276  C   CYS A  18       4.269   3.600  -2.475  1.00  0.38           C  
ATOM    277  O   CYS A  18       4.652   3.582  -3.647  1.00  0.41           O  
ATOM    278  CB  CYS A  18       3.721   1.195  -2.053  1.00  0.37           C  
ATOM    279  SG  CYS A  18       3.997   0.589  -3.752  1.00  0.47           S  
ATOM    280  H   CYS A  18       1.890   2.243  -3.605  1.00  0.40           H  
ATOM    281  HA  CYS A  18       2.958   2.866  -0.960  1.00  0.33           H  
ATOM    282  HB2 CYS A  18       4.662   1.137  -1.526  1.00  0.45           H  
ATOM    283  HB3 CYS A  18       3.007   0.536  -1.580  1.00  0.37           H  
ATOM    284  N   ASP A  19       4.750   4.444  -1.574  1.00  0.50           N  
ATOM    285  CA  ASP A  19       5.840   5.362  -1.882  1.00  0.68           C  
ATOM    286  C   ASP A  19       6.914   5.277  -0.805  1.00  0.80           C  
ATOM    287  O   ASP A  19       6.925   6.068   0.144  1.00  0.84           O  
ATOM    288  CB  ASP A  19       5.336   6.805  -2.004  1.00  0.80           C  
ATOM    289  CG  ASP A  19       4.557   7.059  -3.281  1.00  1.11           C  
ATOM    290  OD1 ASP A  19       3.310   7.012  -3.249  1.00  1.76           O  
ATOM    291  OD2 ASP A  19       5.188   7.318  -4.329  1.00  1.10           O1-
ATOM    292  H   ASP A  19       4.368   4.449  -0.669  1.00  0.49           H  
ATOM    293  HA  ASP A  19       6.270   5.058  -2.824  1.00  0.74           H  
ATOM    294  HB2 ASP A  19       4.694   7.023  -1.166  1.00  1.05           H  
ATOM    295  HB3 ASP A  19       6.184   7.475  -1.983  1.00  1.05           H  
HETATM  296  N   DPR A  20       7.813   4.287  -0.918  1.00  0.95           N  
HETATM  297  CA  DPR A  20       8.935   4.123   0.011  1.00  1.13           C  
HETATM  298  CB  DPR A  20       9.686   2.904  -0.527  1.00  1.31           C  
HETATM  299  CG  DPR A  20       8.690   2.179  -1.361  1.00  1.35           C  
HETATM  300  CD  DPR A  20       7.807   3.241  -1.951  1.00  1.02           C  
HETATM  301  C   DPR A  20       8.464   3.880   1.444  1.00  1.11           C  
HETATM  302  O   DPR A  20       7.821   2.870   1.737  1.00  1.10           O  
HETATM  303  HA  DPR A  20       9.591   4.977  -0.010  1.00  1.22           H  
HETATM  304  HB2 DPR A  20      10.531   3.231  -1.115  1.00  1.44           H  
HETATM  305  HB3 DPR A  20      10.026   2.300   0.299  1.00  1.39           H  
HETATM  306  HG2 DPR A  20       9.195   1.631  -2.141  1.00  1.54           H  
HETATM  307  HG3 DPR A  20       8.110   1.509  -0.744  1.00  1.59           H  
HETATM  308  HD2 DPR A  20       8.225   3.610  -2.876  1.00  1.05           H  
HETATM  309  HD3 DPR A  20       6.811   2.859  -2.108  1.00  0.93           H  
ATOM    310  N   PRO A  21       8.776   4.814   2.352  1.00  1.18           N  
ATOM    311  CA  PRO A  21       8.403   4.709   3.762  1.00  1.23           C  
ATOM    312  C   PRO A  21       6.927   5.011   4.023  1.00  1.04           C  
ATOM    313  O   PRO A  21       6.427   4.774   5.124  1.00  1.12           O  
ATOM    314  CB  PRO A  21       9.283   5.762   4.431  1.00  1.43           C  
ATOM    315  CG  PRO A  21       9.492   6.791   3.378  1.00  1.40           C  
ATOM    316  CD  PRO A  21       9.544   6.042   2.074  1.00  1.30           C  
ATOM    317  HA  PRO A  21       8.642   3.736   4.161  1.00  1.35           H  
ATOM    318  HB2 PRO A  21       8.772   6.171   5.290  1.00  1.46           H  
ATOM    319  HB3 PRO A  21      10.216   5.316   4.735  1.00  1.61           H  
ATOM    320  HG2 PRO A  21       8.666   7.484   3.378  1.00  1.32           H  
ATOM    321  HG3 PRO A  21      10.421   7.311   3.549  1.00  1.59           H  
ATOM    322  HD2 PRO A  21       9.079   6.620   1.290  1.00  1.23           H  
ATOM    323  HD3 PRO A  21      10.566   5.805   1.814  1.00  1.47           H  
ATOM    324  N   ARG A  22       6.226   5.532   3.023  1.00  0.84           N  
ATOM    325  CA  ARG A  22       4.826   5.893   3.204  1.00  0.70           C  
ATOM    326  C   ARG A  22       3.937   5.173   2.201  1.00  0.52           C  
ATOM    327  O   ARG A  22       4.420   4.622   1.213  1.00  0.54           O  
ATOM    328  CB  ARG A  22       4.635   7.409   3.076  1.00  0.82           C  
ATOM    329  CG  ARG A  22       5.031   7.968   1.719  1.00  1.37           C  
ATOM    330  CD  ARG A  22       4.700   9.449   1.603  1.00  1.91           C  
ATOM    331  NE  ARG A  22       3.259   9.702   1.630  1.00  2.59           N  
ATOM    332  CZ  ARG A  22       2.711  10.860   2.002  1.00  3.29           C  
ATOM    333  NH1 ARG A  22       3.482  11.878   2.368  1.00  3.45           N1+
ATOM    334  NH2 ARG A  22       1.393  11.000   2.004  1.00  4.24           N  
ATOM    335  H   ARG A  22       6.652   5.665   2.144  1.00  0.84           H  
ATOM    336  HA  ARG A  22       4.536   5.590   4.197  1.00  0.71           H  
ATOM    337  HB2 ARG A  22       3.596   7.645   3.247  1.00  1.26           H  
ATOM    338  HB3 ARG A  22       5.235   7.898   3.829  1.00  0.94           H  
ATOM    339  HG2 ARG A  22       6.094   7.835   1.584  1.00  1.75           H  
ATOM    340  HG3 ARG A  22       4.499   7.426   0.952  1.00  1.90           H  
ATOM    341  HD2 ARG A  22       5.161   9.973   2.427  1.00  1.99           H  
ATOM    342  HD3 ARG A  22       5.105   9.823   0.673  1.00  2.56           H  
ATOM    343  HE  ARG A  22       2.664   8.966   1.347  1.00  2.93           H  
ATOM    344 HH11 ARG A  22       4.480  11.783   2.367  1.00  3.20           H  
ATOM    345 HH12 ARG A  22       3.068  12.753   2.638  1.00  4.13           H  
ATOM    346 HH21 ARG A  22       0.977  11.869   2.284  1.00  4.82           H  
ATOM    347 HH22 ARG A  22       0.798  10.227   1.723  1.00  4.54           H  
ATOM    348  N   TYR A  23       2.644   5.162   2.476  1.00  0.40           N  
ATOM    349  CA  TYR A  23       1.671   4.585   1.568  1.00  0.29           C  
ATOM    350  C   TYR A  23       0.303   5.216   1.781  1.00  0.24           C  
ATOM    351  O   TYR A  23      -0.064   5.571   2.902  1.00  0.30           O  
ATOM    352  CB  TYR A  23       1.589   3.062   1.734  1.00  0.28           C  
ATOM    353  CG  TYR A  23       1.173   2.599   3.112  1.00  0.27           C  
ATOM    354  CD1 TYR A  23      -0.165   2.413   3.428  1.00  0.26           C  
ATOM    355  CD2 TYR A  23       2.120   2.360   4.098  1.00  0.33           C  
ATOM    356  CE1 TYR A  23      -0.548   2.002   4.687  1.00  0.29           C  
ATOM    357  CE2 TYR A  23       1.746   1.946   5.358  1.00  0.37           C  
ATOM    358  CZ  TYR A  23       0.405   1.728   5.634  1.00  0.35           C  
ATOM    359  OH  TYR A  23       0.039   1.360   6.911  1.00  0.42           O  
ATOM    360  H   TYR A  23       2.330   5.550   3.321  1.00  0.41           H  
ATOM    361  HA  TYR A  23       1.994   4.804   0.561  1.00  0.32           H  
ATOM    362  HB2 TYR A  23       0.871   2.673   1.030  1.00  0.28           H  
ATOM    363  HB3 TYR A  23       2.557   2.637   1.521  1.00  0.34           H  
ATOM    364  HD1 TYR A  23      -0.913   2.595   2.669  1.00  0.26           H  
ATOM    365  HD2 TYR A  23       3.165   2.497   3.866  1.00  0.36           H  
ATOM    366  HE1 TYR A  23      -1.593   1.863   4.915  1.00  0.29           H  
ATOM    367  HE2 TYR A  23       2.497   1.766   6.111  1.00  0.44           H  
ATOM    368  HH  TYR A  23       0.576   1.826   7.569  1.00  0.90           H  
ATOM    369  N   GLU A  24      -0.429   5.363   0.696  1.00  0.20           N  
ATOM    370  CA  GLU A  24      -1.770   5.916   0.732  1.00  0.21           C  
ATOM    371  C   GLU A  24      -2.778   4.779   0.671  1.00  0.19           C  
ATOM    372  O   GLU A  24      -2.700   3.940  -0.219  1.00  0.32           O  
ATOM    373  CB  GLU A  24      -1.990   6.851  -0.457  1.00  0.32           C  
ATOM    374  CG  GLU A  24      -0.962   7.964  -0.568  1.00  0.49           C  
ATOM    375  CD  GLU A  24      -1.112   9.008   0.513  1.00  1.22           C  
ATOM    376  OE1 GLU A  24      -0.285   9.018   1.448  1.00  1.64           O  
ATOM    377  OE2 GLU A  24      -2.062   9.812   0.452  1.00  1.99           O1-
ATOM    378  H   GLU A  24      -0.057   5.077  -0.166  1.00  0.21           H  
ATOM    379  HA  GLU A  24      -1.891   6.463   1.653  1.00  0.27           H  
ATOM    380  HB2 GLU A  24      -1.961   6.270  -1.364  1.00  0.32           H  
ATOM    381  HB3 GLU A  24      -2.966   7.302  -0.364  1.00  0.43           H  
ATOM    382  HG2 GLU A  24       0.022   7.531  -0.492  1.00  0.85           H  
ATOM    383  HG3 GLU A  24      -1.070   8.442  -1.530  1.00  0.91           H  
HETATM  384  N   MVA A  25      -3.746   4.725   1.588  1.00  0.17           N  
HETATM  385  CN  MVA A  25      -3.866   5.816   2.579  1.00  0.28           C  
HETATM  386  CA  MVA A  25      -4.703   3.606   1.572  1.00  0.18           C  
HETATM  387  CB  MVA A  25      -4.299   2.458   2.544  1.00  0.28           C  
HETATM  388  CG1 MVA A  25      -4.183   2.923   3.987  1.00  0.51           C  
HETATM  389  CG2 MVA A  25      -5.287   1.307   2.435  1.00  0.76           C  
HETATM  390  C   MVA A  25      -6.144   4.045   1.842  1.00  0.25           C  
HETATM  391  O   MVA A  25      -6.496   4.521   2.925  1.00  0.47           O  
HETATM  392  HN1 MVA A  25      -3.912   6.764   2.066  1.00  1.20           H  
HETATM  393  HN2 MVA A  25      -3.009   5.802   3.236  1.00  0.93           H  
HETATM  394  HN3 MVA A  25      -4.768   5.679   3.158  1.00  1.04           H  
HETATM  395  HA  MVA A  25      -4.698   3.176   0.579  1.00  0.17           H  
HETATM  396  HB  MVA A  25      -3.332   2.089   2.238  1.00  0.69           H  
HETATM  397 HG11 MVA A  25      -5.105   3.395   4.287  1.00  1.16           H  
HETATM  398 HG12 MVA A  25      -3.370   3.629   4.071  1.00  1.12           H  
HETATM  399 HG13 MVA A  25      -3.989   2.072   4.623  1.00  1.28           H  
HETATM  400 HG21 MVA A  25      -5.270   0.911   1.431  1.00  1.28           H  
HETATM  401 HG22 MVA A  25      -6.281   1.663   2.662  1.00  1.27           H  
HETATM  402 HG23 MVA A  25      -5.016   0.530   3.134  1.00  1.43           H  
ATOM    403  N   HIS A  26      -6.978   3.873   0.828  1.00  0.17           N  
ATOM    404  CA  HIS A  26      -8.387   4.225   0.919  1.00  0.24           C  
ATOM    405  C   HIS A  26      -9.246   2.973   0.891  1.00  0.32           C  
ATOM    406  O   HIS A  26      -9.216   2.209  -0.075  1.00  0.43           O  
ATOM    407  CB  HIS A  26      -8.797   5.152  -0.227  1.00  0.32           C  
ATOM    408  CG  HIS A  26      -8.289   6.554  -0.093  1.00  0.44           C  
ATOM    409  ND1 HIS A  26      -9.119   7.642   0.061  1.00  0.57           N  
ATOM    410  CD2 HIS A  26      -7.031   7.045  -0.115  1.00  0.55           C  
ATOM    411  CE1 HIS A  26      -8.393   8.739   0.129  1.00  0.72           C  
ATOM    412  NE2 HIS A  26      -7.122   8.406   0.026  1.00  0.70           N  
ATOM    413  H   HIS A  26      -6.636   3.477  -0.008  1.00  0.22           H  
ATOM    414  HA  HIS A  26      -8.542   4.735   1.858  1.00  0.30           H  
ATOM    415  HB2 HIS A  26      -8.421   4.751  -1.154  1.00  0.33           H  
ATOM    416  HB3 HIS A  26      -9.873   5.194  -0.272  1.00  0.40           H  
ATOM    417  HD1 HIS A  26     -10.100   7.613   0.109  1.00  0.61           H  
ATOM    418  HD2 HIS A  26      -6.120   6.471  -0.222  1.00  0.59           H  
ATOM    419  HE1 HIS A  26      -8.776   9.741   0.251  1.00  0.87           H  
ATOM    420  HE2 HIS A  26      -6.368   9.003   0.229  1.00  0.83           H  
ATOM    421  N   CYS A  27      -9.988   2.754   1.956  1.00  0.38           N  
ATOM    422  CA  CYS A  27     -10.888   1.620   2.036  1.00  0.50           C  
ATOM    423  C   CYS A  27     -12.307   2.049   1.695  1.00  0.74           C  
ATOM    424  O   CYS A  27     -13.068   2.472   2.563  1.00  1.38           O  
ATOM    425  CB  CYS A  27     -10.841   1.004   3.431  1.00  0.59           C  
ATOM    426  SG  CYS A  27      -9.200   0.355   3.888  1.00  0.75           S  
ATOM    427  H   CYS A  27      -9.928   3.370   2.717  1.00  0.41           H  
ATOM    428  HA  CYS A  27     -10.562   0.884   1.316  1.00  0.47           H  
ATOM    429  HB2 CYS A  27     -11.113   1.754   4.157  1.00  0.95           H  
ATOM    430  HB3 CYS A  27     -11.545   0.188   3.480  1.00  0.83           H  
HETATM  431  N   NH2 A  28     -12.653   1.967   0.424  1.00  0.99           N  
HETATM  432  HN1 NH2 A  28     -11.995   1.620  -0.217  1.00  1.44           H  
HETATM  433  HN2 NH2 A  28     -13.551   2.261   0.172  1.00  1.11           H  
TER     434      NH2 A  28                                                      
ENDMDL                                                                          
MODEL        3                                                                  
ATOM      1  N   ASN A   1       9.167 -11.599  -1.678  1.00  1.83           N  
ATOM      2  CA  ASN A   1       8.159 -10.603  -1.250  1.00  1.49           C  
ATOM      3  C   ASN A   1       8.658  -9.195  -1.506  1.00  1.11           C  
ATOM      4  O   ASN A   1       9.860  -8.968  -1.637  1.00  1.38           O  
ATOM      5  CB  ASN A   1       7.829 -10.767   0.238  1.00  1.76           C  
ATOM      6  CG  ASN A   1       6.983 -11.992   0.513  1.00  2.41           C  
ATOM      7  OD1 ASN A   1       7.046 -12.980  -0.214  1.00  3.13           O  
ATOM      8  ND2 ASN A   1       6.185 -11.934   1.569  1.00  2.72           N  
ATOM      9  H1  ASN A   1      10.051 -11.461  -1.150  1.00  1.62           H  
ATOM     10  H2  ASN A   1       9.362 -11.493  -2.693  1.00  2.41           H  
ATOM     11  H3  ASN A   1       8.817 -12.560  -1.501  1.00  2.27           H  
ATOM     12  HA  ASN A   1       7.261 -10.764  -1.830  1.00  1.51           H  
ATOM     13  HB2 ASN A   1       8.748 -10.856   0.796  1.00  2.07           H  
ATOM     14  HB3 ASN A   1       7.290  -9.896   0.579  1.00  1.95           H  
ATOM     15 HD21 ASN A   1       6.187 -11.112   2.111  1.00  2.63           H  
ATOM     16 HD22 ASN A   1       5.625 -12.715   1.772  1.00  3.34           H  
ATOM     17  N   ASP A   2       7.728  -8.255  -1.583  1.00  0.74           N  
ATOM     18  CA  ASP A   2       8.062  -6.856  -1.784  1.00  0.50           C  
ATOM     19  C   ASP A   2       7.121  -5.986  -0.972  1.00  0.36           C  
ATOM     20  O   ASP A   2       6.007  -6.408  -0.669  1.00  0.33           O  
ATOM     21  CB  ASP A   2       7.974  -6.482  -3.263  1.00  0.73           C  
ATOM     22  CG  ASP A   2       8.297  -5.023  -3.504  1.00  1.34           C  
ATOM     23  OD1 ASP A   2       7.359  -4.236  -3.742  1.00  2.21           O  
ATOM     24  OD2 ASP A   2       9.492  -4.662  -3.474  1.00  1.35           O1-
ATOM     25  H   ASP A   2       6.786  -8.505  -1.490  1.00  0.90           H  
ATOM     26  HA  ASP A   2       9.072  -6.701  -1.437  1.00  0.62           H  
ATOM     27  HB2 ASP A   2       8.671  -7.084  -3.824  1.00  1.22           H  
ATOM     28  HB3 ASP A   2       6.973  -6.674  -3.617  1.00  1.02           H  
HETATM   29  N   AIB A   3       7.577  -4.784  -0.628  1.00  0.36           N  
HETATM   30  CA  AIB A   3       6.789  -3.833   0.162  1.00  0.37           C  
HETATM   31  C   AIB A   3       5.411  -3.628  -0.482  1.00  0.33           C  
HETATM   32  O   AIB A   3       4.378  -3.786   0.172  1.00  0.30           O  
HETATM   33  CB1 AIB A   3       7.521  -2.508   0.235  1.00  0.49           C  
HETATM   34  CB2 AIB A   3       6.632  -4.341   1.582  1.00  0.41           C  
HETATM   35  H   AIB A   3       8.477  -4.524  -0.915  1.00  0.41           H  
HETATM   36 HB11 AIB A   3       8.485  -2.654   0.698  1.00  1.25           H  
HETATM   37 HB12 AIB A   3       6.943  -1.808   0.819  1.00  0.95           H  
HETATM   38 HB13 AIB A   3       7.658  -2.118  -0.763  1.00  1.20           H  
HETATM   39 HB21 AIB A   3       6.056  -3.632   2.158  1.00  1.26           H  
HETATM   40 HB22 AIB A   3       7.608  -4.461   2.029  1.00  1.09           H  
HETATM   41 HB23 AIB A   3       6.123  -5.293   1.569  1.00  0.94           H  
ATOM     42  N   CYS A   4       5.402  -3.303  -1.770  1.00  0.37           N  
ATOM     43  CA  CYS A   4       4.159  -3.009  -2.466  1.00  0.40           C  
ATOM     44  C   CYS A   4       3.267  -4.243  -2.518  1.00  0.32           C  
ATOM     45  O   CYS A   4       2.053  -4.146  -2.352  1.00  0.33           O  
ATOM     46  CB  CYS A   4       4.436  -2.489  -3.877  1.00  0.49           C  
ATOM     47  SG  CYS A   4       5.397  -0.941  -3.922  1.00  1.18           S  
ATOM     48  H   CYS A   4       6.249  -3.278  -2.270  1.00  0.41           H  
ATOM     49  HA  CYS A   4       3.648  -2.242  -1.907  1.00  0.43           H  
ATOM     50  HB2 CYS A   4       4.989  -3.233  -4.423  1.00  1.21           H  
ATOM     51  HB3 CYS A   4       3.497  -2.309  -4.375  1.00  1.05           H  
ATOM     52  N   LYS A   5       3.884  -5.403  -2.714  1.00  0.30           N  
ATOM     53  CA  LYS A   5       3.153  -6.664  -2.766  1.00  0.31           C  
ATOM     54  C   LYS A   5       2.463  -6.934  -1.434  1.00  0.20           C  
ATOM     55  O   LYS A   5       1.264  -7.220  -1.392  1.00  0.20           O  
ATOM     56  CB  LYS A   5       4.106  -7.818  -3.103  1.00  0.39           C  
ATOM     57  CG  LYS A   5       3.425  -9.175  -3.216  1.00  0.80           C  
ATOM     58  CD  LYS A   5       4.445 -10.295  -3.359  1.00  1.37           C  
ATOM     59  CE  LYS A   5       3.775 -11.652  -3.523  1.00  2.05           C  
ATOM     60  NZ  LYS A   5       3.002 -11.742  -4.790  1.00  2.62           N1+
ATOM     61  H   LYS A   5       4.859  -5.412  -2.822  1.00  0.32           H  
ATOM     62  HA  LYS A   5       2.404  -6.583  -3.537  1.00  0.38           H  
ATOM     63  HB2 LYS A   5       4.589  -7.605  -4.045  1.00  0.76           H  
ATOM     64  HB3 LYS A   5       4.860  -7.882  -2.332  1.00  0.63           H  
ATOM     65  HG2 LYS A   5       2.836  -9.349  -2.327  1.00  1.40           H  
ATOM     66  HG3 LYS A   5       2.780  -9.174  -4.084  1.00  1.26           H  
ATOM     67  HD2 LYS A   5       5.056 -10.101  -4.227  1.00  1.80           H  
ATOM     68  HD3 LYS A   5       5.068 -10.315  -2.476  1.00  1.90           H  
ATOM     69  HE2 LYS A   5       4.538 -12.419  -3.523  1.00  2.44           H  
ATOM     70  HE3 LYS A   5       3.107 -11.813  -2.690  1.00  2.54           H  
ATOM     71  HZ1 LYS A   5       2.272 -11.002  -4.822  1.00  2.86           H  
ATOM     72  HZ2 LYS A   5       2.541 -12.670  -4.862  1.00  2.84           H  
ATOM     73  HZ3 LYS A   5       3.637 -11.623  -5.605  1.00  3.23           H  
HETATM   74  N   AIB A   6       3.235  -6.810  -0.356  1.00  0.16           N  
HETATM   75  CA  AIB A   6       2.747  -7.055   1.002  1.00  0.16           C  
HETATM   76  C   AIB A   6       1.570  -6.125   1.291  1.00  0.12           C  
HETATM   77  O   AIB A   6       0.526  -6.559   1.775  1.00  0.16           O  
HETATM   78  CB1 AIB A   6       3.859  -6.786   1.997  1.00  0.22           C  
HETATM   79  CB2 AIB A   6       2.332  -8.506   1.163  1.00  0.25           C  
HETATM   80  H   AIB A   6       4.169  -6.533  -0.476  1.00  0.18           H  
HETATM   81 HB11 AIB A   6       3.508  -6.999   2.995  1.00  1.10           H  
HETATM   82 HB12 AIB A   6       4.154  -5.749   1.934  1.00  1.03           H  
HETATM   83 HB13 AIB A   6       4.705  -7.417   1.769  1.00  0.90           H  
HETATM   84 HB21 AIB A   6       3.188  -9.145   0.999  1.00  1.08           H  
HETATM   85 HB22 AIB A   6       1.564  -8.741   0.441  1.00  1.03           H  
HETATM   86 HB23 AIB A   6       1.951  -8.663   2.161  1.00  1.03           H  
ATOM     87  N   LEU A   7       1.744  -4.847   0.970  1.00  0.12           N  
ATOM     88  CA  LEU A   7       0.722  -3.849   1.242  1.00  0.16           C  
ATOM     89  C   LEU A   7      -0.529  -4.114   0.417  1.00  0.17           C  
ATOM     90  O   LEU A   7      -1.648  -3.997   0.915  1.00  0.21           O  
ATOM     91  CB  LEU A   7       1.252  -2.444   0.951  1.00  0.23           C  
ATOM     92  CG  LEU A   7       2.496  -2.028   1.739  1.00  0.28           C  
ATOM     93  CD1 LEU A   7       2.959  -0.648   1.304  1.00  0.38           C  
ATOM     94  CD2 LEU A   7       2.218  -2.041   3.233  1.00  0.35           C  
ATOM     95  H   LEU A   7       2.586  -4.571   0.541  1.00  0.15           H  
ATOM     96  HA  LEU A   7       0.468  -3.918   2.287  1.00  0.19           H  
ATOM     97  HB2 LEU A   7       1.481  -2.383  -0.101  1.00  0.25           H  
ATOM     98  HB3 LEU A   7       0.465  -1.740   1.170  1.00  0.28           H  
ATOM     99  HG  LEU A   7       3.295  -2.728   1.537  1.00  0.24           H  
ATOM    100 HD11 LEU A   7       3.844  -0.373   1.859  1.00  1.02           H  
ATOM    101 HD12 LEU A   7       2.175   0.068   1.499  1.00  0.98           H  
ATOM    102 HD13 LEU A   7       3.183  -0.659   0.248  1.00  1.03           H  
ATOM    103 HD21 LEU A   7       1.940  -3.038   3.540  1.00  1.14           H  
ATOM    104 HD22 LEU A   7       1.411  -1.357   3.452  1.00  0.90           H  
ATOM    105 HD23 LEU A   7       3.104  -1.733   3.767  1.00  1.09           H  
ATOM    106  N   LYS A   8      -0.341  -4.484  -0.841  1.00  0.19           N  
ATOM    107  CA  LYS A   8      -1.464  -4.762  -1.721  1.00  0.27           C  
ATOM    108  C   LYS A   8      -2.285  -5.930  -1.200  1.00  0.25           C  
ATOM    109  O   LYS A   8      -3.499  -5.815  -1.057  1.00  0.31           O  
ATOM    110  CB  LYS A   8      -0.989  -5.040  -3.149  1.00  0.35           C  
ATOM    111  CG  LYS A   8      -0.585  -3.785  -3.911  1.00  1.12           C  
ATOM    112  CD  LYS A   8      -0.172  -4.099  -5.343  1.00  1.10           C  
ATOM    113  CE  LYS A   8      -1.305  -4.743  -6.133  1.00  2.05           C  
ATOM    114  NZ  LYS A   8      -2.527  -3.899  -6.141  1.00  2.55           N1+
ATOM    115  H   LYS A   8       0.577  -4.576  -1.183  1.00  0.20           H  
ATOM    116  HA  LYS A   8      -2.090  -3.886  -1.728  1.00  0.31           H  
ATOM    117  HB2 LYS A   8      -0.137  -5.701  -3.109  1.00  0.78           H  
ATOM    118  HB3 LYS A   8      -1.785  -5.524  -3.692  1.00  1.00           H  
ATOM    119  HG2 LYS A   8      -1.421  -3.104  -3.933  1.00  1.72           H  
ATOM    120  HG3 LYS A   8       0.246  -3.318  -3.402  1.00  1.60           H  
ATOM    121  HD2 LYS A   8       0.116  -3.181  -5.832  1.00  1.29           H  
ATOM    122  HD3 LYS A   8       0.671  -4.776  -5.320  1.00  1.23           H  
ATOM    123  HE2 LYS A   8      -0.978  -4.893  -7.151  1.00  2.55           H  
ATOM    124  HE3 LYS A   8      -1.540  -5.700  -5.689  1.00  2.55           H  
ATOM    125  HZ1 LYS A   8      -3.283  -4.366  -6.680  1.00  2.92           H  
ATOM    126  HZ2 LYS A   8      -2.326  -2.978  -6.578  1.00  2.95           H  
ATOM    127  HZ3 LYS A   8      -2.861  -3.740  -5.169  1.00  2.82           H  
HETATM  128  N   AIB A   9      -1.609  -7.034  -0.894  1.00  0.21           N  
HETATM  129  CA  AIB A   9      -2.262  -8.234  -0.356  1.00  0.24           C  
HETATM  130  C   AIB A   9      -2.946  -7.888   0.971  1.00  0.26           C  
HETATM  131  O   AIB A   9      -4.061  -8.335   1.253  1.00  0.35           O  
HETATM  132  CB1 AIB A   9      -1.219  -9.305  -0.118  1.00  0.23           C  
HETATM  133  CB2 AIB A   9      -3.269  -8.791  -1.349  1.00  0.32           C  
HETATM  134  H   AIB A   9      -0.633  -7.044  -1.028  1.00  0.18           H  
HETATM  135 HB11 AIB A   9      -0.493  -8.946   0.596  1.00  1.04           H  
HETATM  136 HB12 AIB A   9      -0.724  -9.539  -1.048  1.00  0.97           H  
HETATM  137 HB13 AIB A   9      -1.697 -10.191   0.269  1.00  1.10           H  
HETATM  138 HB21 AIB A   9      -4.043  -8.058  -1.525  1.00  1.03           H  
HETATM  139 HB22 AIB A   9      -3.709  -9.691  -0.950  1.00  1.10           H  
HETATM  140 HB23 AIB A   9      -2.769  -9.016  -2.280  1.00  0.99           H  
ATOM    141  N   ARG A  10      -2.261  -7.084   1.772  1.00  0.21           N  
ATOM    142  CA  ARG A  10      -2.732  -6.704   3.097  1.00  0.27           C  
ATOM    143  C   ARG A  10      -4.012  -5.879   3.018  1.00  0.33           C  
ATOM    144  O   ARG A  10      -4.936  -6.066   3.811  1.00  0.44           O  
ATOM    145  CB  ARG A  10      -1.631  -5.914   3.805  1.00  0.28           C  
ATOM    146  CG  ARG A  10      -1.966  -5.475   5.215  1.00  0.37           C  
ATOM    147  CD  ARG A  10      -0.749  -4.842   5.868  1.00  0.46           C  
ATOM    148  NE  ARG A  10      -1.039  -4.298   7.190  1.00  1.04           N  
ATOM    149  CZ  ARG A  10      -0.106  -4.074   8.111  1.00  1.36           C  
ATOM    150  NH1 ARG A  10       1.164  -4.381   7.865  1.00  1.26           N1+
ATOM    151  NH2 ARG A  10      -0.440  -3.544   9.279  1.00  2.18           N  
ATOM    152  H   ARG A  10      -1.396  -6.732   1.462  1.00  0.16           H  
ATOM    153  HA  ARG A  10      -2.928  -7.606   3.653  1.00  0.33           H  
ATOM    154  HB2 ARG A  10      -0.742  -6.523   3.849  1.00  0.30           H  
ATOM    155  HB3 ARG A  10      -1.415  -5.029   3.223  1.00  0.27           H  
ATOM    156  HG2 ARG A  10      -2.767  -4.753   5.178  1.00  0.45           H  
ATOM    157  HG3 ARG A  10      -2.270  -6.335   5.790  1.00  0.42           H  
ATOM    158  HD2 ARG A  10       0.019  -5.595   5.965  1.00  0.90           H  
ATOM    159  HD3 ARG A  10      -0.392  -4.046   5.232  1.00  1.00           H  
ATOM    160  HE  ARG A  10      -1.974  -4.075   7.393  1.00  1.56           H  
ATOM    161 HH11 ARG A  10       1.868  -4.212   8.561  1.00  1.61           H  
ATOM    162 HH12 ARG A  10       1.427  -4.787   6.985  1.00  1.29           H  
ATOM    163 HH21 ARG A  10      -1.395  -3.309   9.474  1.00  2.69           H  
ATOM    164 HH22 ARG A  10       0.266  -3.371   9.973  1.00  2.46           H  
ATOM    165  N   TYR A  11      -4.067  -4.979   2.054  1.00  0.31           N  
ATOM    166  CA  TYR A  11      -5.191  -4.067   1.929  1.00  0.39           C  
ATOM    167  C   TYR A  11      -6.045  -4.404   0.708  1.00  0.58           C  
ATOM    168  O   TYR A  11      -6.441  -3.516  -0.044  1.00  0.93           O  
ATOM    169  CB  TYR A  11      -4.675  -2.632   1.846  1.00  0.32           C  
ATOM    170  CG  TYR A  11      -3.893  -2.206   3.068  1.00  0.24           C  
ATOM    171  CD1 TYR A  11      -4.537  -1.956   4.271  1.00  0.27           C  
ATOM    172  CD2 TYR A  11      -2.513  -2.055   3.019  1.00  0.24           C  
ATOM    173  CE1 TYR A  11      -3.830  -1.568   5.392  1.00  0.31           C  
ATOM    174  CE2 TYR A  11      -1.797  -1.667   4.136  1.00  0.24           C  
ATOM    175  CZ  TYR A  11      -2.460  -1.424   5.320  1.00  0.27           C  
ATOM    176  OH  TYR A  11      -1.751  -1.041   6.440  1.00  0.38           O  
ATOM    177  H   TYR A  11      -3.328  -4.921   1.404  1.00  0.29           H  
ATOM    178  HA  TYR A  11      -5.798  -4.168   2.816  1.00  0.44           H  
ATOM    179  HB2 TYR A  11      -4.028  -2.538   0.986  1.00  0.34           H  
ATOM    180  HB3 TYR A  11      -5.513  -1.963   1.736  1.00  0.37           H  
ATOM    181  HD1 TYR A  11      -5.609  -2.071   4.325  1.00  0.33           H  
ATOM    182  HD2 TYR A  11      -1.996  -2.248   2.088  1.00  0.32           H  
ATOM    183  HE1 TYR A  11      -4.351  -1.379   6.317  1.00  0.41           H  
ATOM    184  HE2 TYR A  11      -0.727  -1.556   4.076  1.00  0.29           H  
ATOM    185  HH  TYR A  11      -1.080  -0.387   6.195  1.00  0.93           H  
HETATM  186  N   AIB A  12      -6.338  -5.693   0.543  1.00  0.54           N  
HETATM  187  CA  AIB A  12      -7.153  -6.201  -0.580  1.00  0.73           C  
HETATM  188  C   AIB A  12      -8.505  -5.476  -0.651  1.00  0.64           C  
HETATM  189  O   AIB A  12      -9.022  -5.212  -1.737  1.00  1.44           O  
HETATM  190  CB1 AIB A  12      -7.390  -7.687  -0.397  1.00  1.05           C  
HETATM  191  CB2 AIB A  12      -6.413  -6.024  -1.890  1.00  1.04           C  
HETATM  192  H   AIB A  12      -5.984  -6.335   1.194  1.00  0.64           H  
HETATM  193 HB11 AIB A  12      -6.441  -8.198  -0.326  1.00  1.35           H  
HETATM  194 HB12 AIB A  12      -7.943  -8.069  -1.243  1.00  1.34           H  
HETATM  195 HB13 AIB A  12      -7.957  -7.851   0.507  1.00  1.69           H  
HETATM  196 HB21 AIB A  12      -5.458  -6.524  -1.834  1.00  1.46           H  
HETATM  197 HB22 AIB A  12      -6.259  -4.972  -2.076  1.00  1.41           H  
HETATM  198 HB23 AIB A  12      -6.996  -6.449  -2.694  1.00  1.18           H  
ATOM    199  N   GLY A  13      -9.073  -5.156   0.503  1.00  0.60           N  
ATOM    200  CA  GLY A  13     -10.368  -4.504   0.531  1.00  0.84           C  
ATOM    201  C   GLY A  13     -10.276  -3.000   0.362  1.00  0.80           C  
ATOM    202  O   GLY A  13     -11.268  -2.287   0.517  1.00  1.24           O  
ATOM    203  H   GLY A  13      -8.610  -5.365   1.342  1.00  1.15           H  
ATOM    204  HA2 GLY A  13     -10.976  -4.906  -0.264  1.00  0.99           H  
ATOM    205  HA3 GLY A  13     -10.845  -4.718   1.476  1.00  1.02           H  
ATOM    206  N   CYS A  14      -9.088  -2.515   0.041  1.00  0.33           N  
ATOM    207  CA  CYS A  14      -8.857  -1.090  -0.113  1.00  0.29           C  
ATOM    208  C   CYS A  14      -7.949  -0.836  -1.314  1.00  0.34           C  
ATOM    209  O   CYS A  14      -7.573  -1.769  -2.029  1.00  0.62           O  
ATOM    210  CB  CYS A  14      -8.208  -0.535   1.156  1.00  0.25           C  
ATOM    211  SG  CYS A  14      -9.059  -0.992   2.705  1.00  0.39           S  
ATOM    212  H   CYS A  14      -8.337  -3.135  -0.100  1.00  0.23           H  
ATOM    213  HA  CYS A  14      -9.806  -0.605  -0.274  1.00  0.35           H  
ATOM    214  HB2 CYS A  14      -7.199  -0.903   1.219  1.00  0.26           H  
ATOM    215  HB3 CYS A  14      -8.187   0.544   1.098  1.00  0.26           H  
ATOM    216  N   GLU A  15      -7.617   0.425  -1.545  1.00  0.27           N  
ATOM    217  CA  GLU A  15      -6.672   0.789  -2.590  1.00  0.27           C  
ATOM    218  C   GLU A  15      -5.387   1.335  -1.972  1.00  0.21           C  
ATOM    219  O   GLU A  15      -5.369   2.462  -1.463  1.00  0.33           O  
ATOM    220  CB  GLU A  15      -7.285   1.825  -3.534  1.00  0.31           C  
ATOM    221  CG  GLU A  15      -8.488   1.309  -4.305  1.00  0.37           C  
ATOM    222  CD  GLU A  15      -9.052   2.338  -5.260  1.00  0.84           C  
ATOM    223  OE1 GLU A  15     -10.001   3.051  -4.881  1.00  1.65           O  
ATOM    224  OE2 GLU A  15      -8.557   2.428  -6.402  1.00  0.80           O1-
ATOM    225  H   GLU A  15      -8.027   1.135  -1.005  1.00  0.38           H  
ATOM    226  HA  GLU A  15      -6.439  -0.102  -3.152  1.00  0.31           H  
ATOM    227  HB2 GLU A  15      -7.598   2.681  -2.954  1.00  0.31           H  
ATOM    228  HB3 GLU A  15      -6.534   2.136  -4.244  1.00  0.34           H  
ATOM    229  HG2 GLU A  15      -8.191   0.440  -4.873  1.00  0.85           H  
ATOM    230  HG3 GLU A  15      -9.259   1.032  -3.601  1.00  0.82           H  
HETATM  231  N   MVA A  16      -4.308   0.529  -1.959  1.00  0.25           N  
HETATM  232  CN  MVA A  16      -4.446  -0.860  -2.445  1.00  0.53           C  
HETATM  233  CA  MVA A  16      -3.011   1.004  -1.444  1.00  0.19           C  
HETATM  234  CB  MVA A  16      -2.187  -0.130  -0.751  1.00  0.21           C  
HETATM  235  CG1 MVA A  16      -1.252  -0.851  -1.722  1.00  0.36           C  
HETATM  236  CG2 MVA A  16      -1.384   0.430   0.411  1.00  0.21           C  
HETATM  237  C   MVA A  16      -2.159   1.630  -2.554  1.00  0.24           C  
HETATM  238  O   MVA A  16      -2.217   1.221  -3.719  1.00  0.48           O  
HETATM  239  HN1 MVA A  16      -5.370  -1.279  -2.076  1.00  1.23           H  
HETATM  240  HN2 MVA A  16      -3.619  -1.451  -2.088  1.00  1.12           H  
HETATM  241  HN3 MVA A  16      -4.457  -0.867  -3.524  1.00  1.12           H  
HETATM  242  HA  MVA A  16      -3.181   1.773  -0.700  1.00  0.20           H  
HETATM  243  HB  MVA A  16      -2.881  -0.856  -0.355  1.00  0.37           H  
HETATM  244 HG11 MVA A  16      -0.814  -1.704  -1.229  1.00  1.08           H  
HETATM  245 HG12 MVA A  16      -0.470  -0.175  -2.032  1.00  1.13           H  
HETATM  246 HG13 MVA A  16      -1.807  -1.178  -2.588  1.00  1.07           H  
HETATM  247 HG21 MVA A  16      -0.823  -0.363   0.877  1.00  1.05           H  
HETATM  248 HG22 MVA A  16      -2.053   0.872   1.133  1.00  1.05           H  
HETATM  249 HG23 MVA A  16      -0.699   1.183   0.045  1.00  0.94           H  
ATOM    250  N   ARG A  17      -1.395   2.643  -2.178  1.00  0.23           N  
ATOM    251  CA  ARG A  17      -0.427   3.267  -3.064  1.00  0.27           C  
ATOM    252  C   ARG A  17       0.917   3.313  -2.362  1.00  0.23           C  
ATOM    253  O   ARG A  17       1.083   4.057  -1.395  1.00  0.34           O  
ATOM    254  CB  ARG A  17      -0.841   4.695  -3.412  1.00  0.34           C  
ATOM    255  CG  ARG A  17      -2.242   4.827  -3.976  1.00  1.33           C  
ATOM    256  CD  ARG A  17      -2.589   6.288  -4.216  1.00  1.48           C  
ATOM    257  NE  ARG A  17      -3.991   6.482  -4.573  1.00  2.36           N  
ATOM    258  CZ  ARG A  17      -4.661   7.608  -4.343  1.00  3.00           C  
ATOM    259  NH1 ARG A  17      -4.055   8.638  -3.764  1.00  3.01           N1+
ATOM    260  NH2 ARG A  17      -5.934   7.708  -4.694  1.00  3.96           N  
ATOM    261  H   ARG A  17      -1.487   2.986  -1.262  1.00  0.34           H  
ATOM    262  HA  ARG A  17      -0.349   2.678  -3.963  1.00  0.31           H  
ATOM    263  HB2 ARG A  17      -0.781   5.297  -2.521  1.00  1.08           H  
ATOM    264  HB3 ARG A  17      -0.146   5.086  -4.140  1.00  0.90           H  
ATOM    265  HG2 ARG A  17      -2.295   4.290  -4.913  1.00  2.00           H  
ATOM    266  HG3 ARG A  17      -2.945   4.405  -3.273  1.00  1.97           H  
ATOM    267  HD2 ARG A  17      -2.381   6.844  -3.314  1.00  1.68           H  
ATOM    268  HD3 ARG A  17      -1.969   6.664  -5.017  1.00  1.71           H  
ATOM    269  HE  ARG A  17      -4.456   5.732  -5.014  1.00  2.76           H  
ATOM    270 HH11 ARG A  17      -4.562   9.488  -3.590  1.00  3.63           H  
ATOM    271 HH12 ARG A  17      -3.085   8.576  -3.495  1.00  2.64           H  
ATOM    272 HH21 ARG A  17      -6.398   6.936  -5.135  1.00  4.30           H  
ATOM    273 HH22 ARG A  17      -6.439   8.559  -4.517  1.00  4.48           H  
ATOM    274  N   CYS A  18       1.866   2.519  -2.819  1.00  0.27           N  
ATOM    275  CA  CYS A  18       3.168   2.478  -2.177  1.00  0.31           C  
ATOM    276  C   CYS A  18       4.078   3.572  -2.728  1.00  0.38           C  
ATOM    277  O   CYS A  18       4.326   3.650  -3.932  1.00  0.41           O  
ATOM    278  CB  CYS A  18       3.812   1.095  -2.325  1.00  0.37           C  
ATOM    279  SG  CYS A  18       3.981   0.510  -4.042  1.00  0.47           S  
ATOM    280  H   CYS A  18       1.695   1.960  -3.610  1.00  0.40           H  
ATOM    281  HA  CYS A  18       3.007   2.673  -1.125  1.00  0.33           H  
ATOM    282  HB2 CYS A  18       4.801   1.122  -1.894  1.00  0.45           H  
ATOM    283  HB3 CYS A  18       3.213   0.372  -1.790  1.00  0.37           H  
ATOM    284  N   ASP A  19       4.554   4.423  -1.834  1.00  0.50           N  
ATOM    285  CA  ASP A  19       5.415   5.535  -2.200  1.00  0.68           C  
ATOM    286  C   ASP A  19       6.648   5.542  -1.299  1.00  0.80           C  
ATOM    287  O   ASP A  19       6.661   6.188  -0.247  1.00  0.84           O  
ATOM    288  CB  ASP A  19       4.655   6.859  -2.063  1.00  0.80           C  
ATOM    289  CG  ASP A  19       5.376   8.019  -2.719  1.00  1.11           C  
ATOM    290  OD1 ASP A  19       6.201   8.671  -2.037  1.00  1.76           O  
ATOM    291  OD2 ASP A  19       5.139   8.282  -3.918  1.00  1.10           O1-
ATOM    292  H   ASP A  19       4.325   4.299  -0.887  1.00  0.49           H  
ATOM    293  HA  ASP A  19       5.722   5.402  -3.225  1.00  0.74           H  
ATOM    294  HB2 ASP A  19       3.684   6.756  -2.523  1.00  1.05           H  
ATOM    295  HB3 ASP A  19       4.528   7.084  -1.014  1.00  1.05           H  
HETATM  296  N   DPR A  20       7.697   4.803  -1.690  1.00  0.95           N  
HETATM  297  CA  DPR A  20       8.898   4.646  -0.868  1.00  1.13           C  
HETATM  298  CB  DPR A  20       9.778   3.692  -1.677  1.00  1.31           C  
HETATM  299  CG  DPR A  20       9.278   3.801  -3.075  1.00  1.35           C  
HETATM  300  CD  DPR A  20       7.804   4.070  -2.962  1.00  1.02           C  
HETATM  301  C   DPR A  20       8.569   4.048   0.499  1.00  1.11           C  
HETATM  302  O   DPR A  20       7.992   2.962   0.591  1.00  1.10           O  
HETATM  303  HA  DPR A  20       9.416   5.582  -0.739  1.00  1.22           H  
HETATM  304  HB2 DPR A  20      10.810   3.998  -1.599  1.00  1.44           H  
HETATM  305  HB3 DPR A  20       9.665   2.688  -1.297  1.00  1.39           H  
HETATM  306  HG2 DPR A  20       9.770   4.618  -3.581  1.00  1.54           H  
HETATM  307  HG3 DPR A  20       9.450   2.873  -3.601  1.00  1.59           H  
HETATM  308  HD2 DPR A  20       7.470   4.679  -3.787  1.00  1.05           H  
HETATM  309  HD3 DPR A  20       7.250   3.145  -2.922  1.00  0.93           H  
ATOM    310  N   PRO A  21       8.922   4.759   1.577  1.00  1.18           N  
ATOM    311  CA  PRO A  21       8.656   4.312   2.947  1.00  1.23           C  
ATOM    312  C   PRO A  21       7.226   4.603   3.399  1.00  1.04           C  
ATOM    313  O   PRO A  21       6.799   4.163   4.469  1.00  1.12           O  
ATOM    314  CB  PRO A  21       9.647   5.139   3.760  1.00  1.43           C  
ATOM    315  CG  PRO A  21       9.756   6.418   3.007  1.00  1.40           C  
ATOM    316  CD  PRO A  21       9.632   6.053   1.551  1.00  1.30           C  
ATOM    317  HA  PRO A  21       8.870   3.262   3.072  1.00  1.35           H  
ATOM    318  HB2 PRO A  21       9.261   5.293   4.756  1.00  1.46           H  
ATOM    319  HB3 PRO A  21      10.596   4.630   3.807  1.00  1.61           H  
ATOM    320  HG2 PRO A  21       8.955   7.081   3.297  1.00  1.32           H  
ATOM    321  HG3 PRO A  21      10.714   6.879   3.199  1.00  1.59           H  
ATOM    322  HD2 PRO A  21       9.056   6.798   1.022  1.00  1.23           H  
ATOM    323  HD3 PRO A  21      10.609   5.944   1.105  1.00  1.47           H  
ATOM    324  N   ARG A  22       6.488   5.335   2.578  1.00  0.84           N  
ATOM    325  CA  ARG A  22       5.142   5.760   2.925  1.00  0.70           C  
ATOM    326  C   ARG A  22       4.142   5.113   1.978  1.00  0.52           C  
ATOM    327  O   ARG A  22       4.506   4.699   0.885  1.00  0.54           O  
ATOM    328  CB  ARG A  22       5.064   7.291   2.845  1.00  0.82           C  
ATOM    329  CG  ARG A  22       3.705   7.881   3.186  1.00  1.37           C  
ATOM    330  CD  ARG A  22       3.734   9.403   3.155  1.00  1.91           C  
ATOM    331  NE  ARG A  22       4.545   9.968   4.237  1.00  2.59           N  
ATOM    332  CZ  ARG A  22       5.003  11.221   4.263  1.00  3.29           C  
ATOM    333  NH1 ARG A  22       4.784  12.041   3.242  1.00  3.45           N1+
ATOM    334  NH2 ARG A  22       5.685  11.651   5.316  1.00  4.24           N  
ATOM    335  H   ARG A  22       6.852   5.583   1.696  1.00  0.84           H  
ATOM    336  HA  ARG A  22       4.933   5.439   3.936  1.00  0.71           H  
ATOM    337  HB2 ARG A  22       5.791   7.707   3.526  1.00  1.26           H  
ATOM    338  HB3 ARG A  22       5.318   7.593   1.841  1.00  0.94           H  
ATOM    339  HG2 ARG A  22       2.981   7.531   2.464  1.00  1.75           H  
ATOM    340  HG3 ARG A  22       3.417   7.554   4.175  1.00  1.90           H  
ATOM    341  HD2 ARG A  22       4.145   9.719   2.210  1.00  1.99           H  
ATOM    342  HD3 ARG A  22       2.721   9.771   3.247  1.00  2.56           H  
ATOM    343  HE  ARG A  22       4.743   9.383   5.003  1.00  2.93           H  
ATOM    344 HH11 ARG A  22       4.272  11.726   2.440  1.00  3.20           H  
ATOM    345 HH12 ARG A  22       5.131  12.983   3.271  1.00  4.13           H  
ATOM    346 HH21 ARG A  22       6.031  12.593   5.342  1.00  4.82           H  
ATOM    347 HH22 ARG A  22       5.854  11.036   6.093  1.00  4.54           H  
ATOM    348  N   TYR A  23       2.899   4.980   2.404  1.00  0.40           N  
ATOM    349  CA  TYR A  23       1.868   4.456   1.529  1.00  0.29           C  
ATOM    350  C   TYR A  23       0.510   5.046   1.865  1.00  0.24           C  
ATOM    351  O   TYR A  23       0.253   5.449   3.001  1.00  0.30           O  
ATOM    352  CB  TYR A  23       1.813   2.928   1.606  1.00  0.28           C  
ATOM    353  CG  TYR A  23       1.419   2.374   2.957  1.00  0.27           C  
ATOM    354  CD1 TYR A  23       0.087   2.124   3.264  1.00  0.26           C  
ATOM    355  CD2 TYR A  23       2.379   2.086   3.917  1.00  0.33           C  
ATOM    356  CE1 TYR A  23      -0.276   1.604   4.488  1.00  0.29           C  
ATOM    357  CE2 TYR A  23       2.023   1.567   5.147  1.00  0.37           C  
ATOM    358  CZ  TYR A  23       0.693   1.328   5.426  1.00  0.35           C  
ATOM    359  OH  TYR A  23       0.331   0.806   6.645  1.00  0.42           O  
ATOM    360  H   TYR A  23       2.673   5.224   3.326  1.00  0.41           H  
ATOM    361  HA  TYR A  23       2.122   4.741   0.521  1.00  0.32           H  
ATOM    362  HB2 TYR A  23       1.097   2.568   0.885  1.00  0.28           H  
ATOM    363  HB3 TYR A  23       2.786   2.533   1.359  1.00  0.34           H  
ATOM    364  HD1 TYR A  23      -0.672   2.348   2.527  1.00  0.26           H  
ATOM    365  HD2 TYR A  23       3.417   2.278   3.694  1.00  0.36           H  
ATOM    366  HE1 TYR A  23      -1.317   1.417   4.706  1.00  0.29           H  
ATOM    367  HE2 TYR A  23       2.784   1.352   5.882  1.00  0.44           H  
ATOM    368  HH  TYR A  23       0.850   1.230   7.338  1.00  0.90           H  
ATOM    369  N   GLU A  24      -0.339   5.105   0.858  1.00  0.20           N  
ATOM    370  CA  GLU A  24      -1.722   5.507   1.039  1.00  0.21           C  
ATOM    371  C   GLU A  24      -2.610   4.277   1.042  1.00  0.19           C  
ATOM    372  O   GLU A  24      -2.311   3.308   0.359  1.00  0.32           O  
ATOM    373  CB  GLU A  24      -2.182   6.434  -0.085  1.00  0.32           C  
ATOM    374  CG  GLU A  24      -1.561   7.815  -0.064  1.00  0.49           C  
ATOM    375  CD  GLU A  24      -2.241   8.743  -1.046  1.00  1.22           C  
ATOM    376  OE1 GLU A  24      -3.381   9.175  -0.764  1.00  1.64           O  
ATOM    377  OE2 GLU A  24      -1.656   9.036  -2.105  1.00  1.99           O1-
ATOM    378  H   GLU A  24      -0.026   4.859  -0.039  1.00  0.21           H  
ATOM    379  HA  GLU A  24      -1.810   6.014   1.986  1.00  0.27           H  
ATOM    380  HB2 GLU A  24      -1.943   5.973  -1.029  1.00  0.32           H  
ATOM    381  HB3 GLU A  24      -3.253   6.549  -0.018  1.00  0.43           H  
ATOM    382  HG2 GLU A  24      -1.654   8.228   0.929  1.00  0.85           H  
ATOM    383  HG3 GLU A  24      -0.516   7.734  -0.328  1.00  0.91           H  
HETATM  384  N   MVA A  25      -3.714   4.291   1.793  1.00  0.17           N  
HETATM  385  CN  MVA A  25      -3.984   5.450   2.675  1.00  0.28           C  
HETATM  386  CA  MVA A  25      -4.667   3.176   1.735  1.00  0.18           C  
HETATM  387  CB  MVA A  25      -4.361   2.065   2.783  1.00  0.28           C  
HETATM  388  CG1 MVA A  25      -4.200   2.613   4.192  1.00  0.51           C  
HETATM  389  CG2 MVA A  25      -5.446   1.003   2.746  1.00  0.76           C  
HETATM  390  C   MVA A  25      -6.109   3.664   1.872  1.00  0.25           C  
HETATM  391  O   MVA A  25      -6.604   3.946   2.965  1.00  0.47           O  
HETATM  392  HN1 MVA A  25      -3.935   6.361   2.098  1.00  1.20           H  
HETATM  393  HN2 MVA A  25      -3.244   5.483   3.462  1.00  0.93           H  
HETATM  394  HN3 MVA A  25      -4.967   5.353   3.107  1.00  1.04           H  
HETATM  395  HA  MVA A  25      -4.592   2.710   0.760  1.00  0.17           H  
HETATM  396  HB  MVA A  25      -3.430   1.593   2.506  1.00  0.69           H  
HETATM  397 HG11 MVA A  25      -4.043   1.794   4.879  1.00  1.16           H  
HETATM  398 HG12 MVA A  25      -5.090   3.153   4.472  1.00  1.12           H  
HETATM  399 HG13 MVA A  25      -3.348   3.277   4.222  1.00  1.28           H  
HETATM  400 HG21 MVA A  25      -6.403   1.462   2.948  1.00  1.28           H  
HETATM  401 HG22 MVA A  25      -5.240   0.253   3.494  1.00  1.27           H  
HETATM  402 HG23 MVA A  25      -5.466   0.544   1.768  1.00  1.43           H  
ATOM    403  N   HIS A  26      -6.774   3.770   0.733  1.00  0.17           N  
ATOM    404  CA  HIS A  26      -8.124   4.305   0.688  1.00  0.24           C  
ATOM    405  C   HIS A  26      -9.139   3.178   0.622  1.00  0.32           C  
ATOM    406  O   HIS A  26      -9.215   2.453  -0.371  1.00  0.43           O  
ATOM    407  CB  HIS A  26      -8.300   5.238  -0.513  1.00  0.32           C  
ATOM    408  CG  HIS A  26      -7.383   6.426  -0.502  1.00  0.44           C  
ATOM    409  ND1 HIS A  26      -7.730   7.644   0.044  1.00  0.57           N  
ATOM    410  CD2 HIS A  26      -6.121   6.575  -0.974  1.00  0.55           C  
ATOM    411  CE1 HIS A  26      -6.723   8.488  -0.094  1.00  0.72           C  
ATOM    412  NE2 HIS A  26      -5.736   7.864  -0.705  1.00  0.70           N  
ATOM    413  H   HIS A  26      -6.351   3.459  -0.100  1.00  0.22           H  
ATOM    414  HA  HIS A  26      -8.286   4.866   1.594  1.00  0.30           H  
ATOM    415  HB2 HIS A  26      -8.111   4.681  -1.417  1.00  0.33           H  
ATOM    416  HB3 HIS A  26      -9.316   5.602  -0.528  1.00  0.40           H  
ATOM    417  HD1 HIS A  26      -8.590   7.862   0.472  1.00  0.61           H  
ATOM    418  HD2 HIS A  26      -5.528   5.817  -1.469  1.00  0.59           H  
ATOM    419  HE1 HIS A  26      -6.712   9.515   0.238  1.00  0.87           H  
ATOM    420  HE2 HIS A  26      -4.856   8.266  -0.921  1.00  0.83           H  
ATOM    421  N   CYS A  27      -9.900   3.027   1.686  1.00  0.38           N  
ATOM    422  CA  CYS A  27     -10.908   1.991   1.773  1.00  0.50           C  
ATOM    423  C   CYS A  27     -12.283   2.567   1.460  1.00  0.74           C  
ATOM    424  O   CYS A  27     -13.027   2.958   2.358  1.00  1.38           O  
ATOM    425  CB  CYS A  27     -10.898   1.379   3.172  1.00  0.59           C  
ATOM    426  SG  CYS A  27      -9.263   0.766   3.699  1.00  0.75           S  
ATOM    427  H   CYS A  27      -9.778   3.634   2.445  1.00  0.41           H  
ATOM    428  HA  CYS A  27     -10.668   1.226   1.049  1.00  0.47           H  
ATOM    429  HB2 CYS A  27     -11.214   2.127   3.884  1.00  0.95           H  
ATOM    430  HB3 CYS A  27     -11.588   0.550   3.198  1.00  0.83           H  
HETATM  431  N   NH2 A  28     -12.615   2.635   0.183  1.00  0.99           N  
HETATM  432  HN1 NH2 A  28     -11.974   2.305  -0.483  1.00  1.44           H  
HETATM  433  HN2 NH2 A  28     -13.487   3.012  -0.046  1.00  1.11           H  
TER     434      NH2 A  28                                                      
ENDMDL                                                                          
MODEL        4                                                                  
ATOM      1  N   ASN A   1       8.865 -11.158  -2.427  1.00  1.83           N  
ATOM      2  CA  ASN A   1       7.752 -10.306  -1.943  1.00  1.49           C  
ATOM      3  C   ASN A   1       8.223  -8.857  -1.841  1.00  1.11           C  
ATOM      4  O   ASN A   1       9.293  -8.584  -1.301  1.00  1.38           O  
ATOM      5  CB  ASN A   1       7.274 -10.805  -0.573  1.00  1.76           C  
ATOM      6  CG  ASN A   1       5.932 -10.230  -0.154  1.00  2.41           C  
ATOM      7  OD1 ASN A   1       5.559  -9.125  -0.538  1.00  3.13           O  
ATOM      8  ND2 ASN A   1       5.198 -10.982   0.649  1.00  2.72           N  
ATOM      9  H1  ASN A   1       9.187 -10.830  -3.358  1.00  1.62           H  
ATOM     10  H2  ASN A   1       8.554 -12.144  -2.508  1.00  2.41           H  
ATOM     11  H3  ASN A   1       9.663 -11.110  -1.762  1.00  2.27           H  
ATOM     12  HA  ASN A   1       6.939 -10.366  -2.654  1.00  1.51           H  
ATOM     13  HB2 ASN A   1       7.186 -11.880  -0.602  1.00  2.07           H  
ATOM     14  HB3 ASN A   1       8.007 -10.531   0.172  1.00  1.95           H  
ATOM     15 HD21 ASN A   1       5.557 -11.854   0.926  1.00  2.63           H  
ATOM     16 HD22 ASN A   1       4.325 -10.641   0.935  1.00  3.34           H  
ATOM     17  N   ASP A   2       7.428  -7.932  -2.364  1.00  0.74           N  
ATOM     18  CA  ASP A   2       7.790  -6.518  -2.354  1.00  0.50           C  
ATOM     19  C   ASP A   2       6.891  -5.760  -1.396  1.00  0.36           C  
ATOM     20  O   ASP A   2       5.825  -6.252  -1.033  1.00  0.33           O  
ATOM     21  CB  ASP A   2       7.664  -5.906  -3.752  1.00  0.73           C  
ATOM     22  CG  ASP A   2       8.453  -6.653  -4.804  1.00  1.34           C  
ATOM     23  OD1 ASP A   2       7.862  -7.509  -5.497  1.00  2.21           O  
ATOM     24  OD2 ASP A   2       9.664  -6.388  -4.949  1.00  1.35           O1-
ATOM     25  H   ASP A   2       6.567  -8.200  -2.743  1.00  0.90           H  
ATOM     26  HA  ASP A   2       8.812  -6.435  -2.020  1.00  0.62           H  
ATOM     27  HB2 ASP A   2       6.628  -5.903  -4.043  1.00  1.22           H  
ATOM     28  HB3 ASP A   2       8.022  -4.888  -3.721  1.00  1.02           H  
HETATM   29  N   AIB A   3       7.315  -4.556  -1.010  1.00  0.36           N  
HETATM   30  CA  AIB A   3       6.536  -3.703  -0.102  1.00  0.37           C  
HETATM   31  C   AIB A   3       5.121  -3.533  -0.659  1.00  0.33           C  
HETATM   32  O   AIB A   3       4.134  -3.745   0.043  1.00  0.30           O  
HETATM   33  CB1 AIB A   3       7.194  -2.342   0.029  1.00  0.49           C  
HETATM   34  CB2 AIB A   3       6.489  -4.321   1.285  1.00  0.41           C  
HETATM   35  H   AIB A   3       8.178  -4.231  -1.343  1.00  0.41           H  
HETATM   36 HB11 AIB A   3       7.236  -1.867  -0.939  1.00  1.25           H  
HETATM   37 HB12 AIB A   3       8.195  -2.461   0.414  1.00  0.95           H  
HETATM   38 HB13 AIB A   3       6.619  -1.728   0.706  1.00  1.20           H  
HETATM   39 HB21 AIB A   3       5.865  -3.716   1.928  1.00  1.26           H  
HETATM   40 HB22 AIB A   3       7.487  -4.367   1.693  1.00  1.09           H  
HETATM   41 HB23 AIB A   3       6.081  -5.318   1.220  1.00  0.94           H  
ATOM     42  N   CYS A   4       5.038  -3.174  -1.937  1.00  0.37           N  
ATOM     43  CA  CYS A   4       3.754  -2.955  -2.591  1.00  0.40           C  
ATOM     44  C   CYS A   4       2.903  -4.219  -2.573  1.00  0.32           C  
ATOM     45  O   CYS A   4       1.699  -4.160  -2.332  1.00  0.33           O  
ATOM     46  CB  CYS A   4       3.968  -2.484  -4.028  1.00  0.49           C  
ATOM     47  SG  CYS A   4       4.876  -0.911  -4.163  1.00  1.18           S  
ATOM     48  H   CYS A   4       5.862  -3.049  -2.453  1.00  0.41           H  
ATOM     49  HA  CYS A   4       3.235  -2.183  -2.045  1.00  0.43           H  
ATOM     50  HB2 CYS A   4       4.527  -3.232  -4.567  1.00  1.21           H  
ATOM     51  HB3 CYS A   4       3.008  -2.351  -4.501  1.00  1.05           H  
ATOM     52  N   LYS A   5       3.544  -5.359  -2.798  1.00  0.30           N  
ATOM     53  CA  LYS A   5       2.851  -6.641  -2.823  1.00  0.31           C  
ATOM     54  C   LYS A   5       2.248  -6.932  -1.457  1.00  0.20           C  
ATOM     55  O   LYS A   5       1.058  -7.240  -1.341  1.00  0.20           O  
ATOM     56  CB  LYS A   5       3.824  -7.762  -3.208  1.00  0.39           C  
ATOM     57  CG  LYS A   5       4.569  -7.518  -4.513  1.00  0.80           C  
ATOM     58  CD  LYS A   5       3.720  -7.842  -5.731  1.00  1.37           C  
ATOM     59  CE  LYS A   5       4.439  -7.473  -7.020  1.00  2.05           C  
ATOM     60  NZ  LYS A   5       5.773  -8.125  -7.124  1.00  2.62           N1+
ATOM     61  H   LYS A   5       4.512  -5.340  -2.937  1.00  0.32           H  
ATOM     62  HA  LYS A   5       2.059  -6.583  -3.552  1.00  0.38           H  
ATOM     63  HB2 LYS A   5       4.553  -7.871  -2.419  1.00  0.76           H  
ATOM     64  HB3 LYS A   5       3.270  -8.686  -3.302  1.00  0.63           H  
ATOM     65  HG2 LYS A   5       4.855  -6.478  -4.561  1.00  1.40           H  
ATOM     66  HG3 LYS A   5       5.455  -8.136  -4.531  1.00  1.26           H  
ATOM     67  HD2 LYS A   5       3.507  -8.901  -5.738  1.00  1.80           H  
ATOM     68  HD3 LYS A   5       2.796  -7.288  -5.672  1.00  1.90           H  
ATOM     69  HE2 LYS A   5       3.833  -7.786  -7.856  1.00  2.44           H  
ATOM     70  HE3 LYS A   5       4.569  -6.401  -7.052  1.00  2.54           H  
ATOM     71  HZ1 LYS A   5       5.678  -9.156  -7.031  1.00  2.86           H  
ATOM     72  HZ2 LYS A   5       6.411  -7.776  -6.376  1.00  2.84           H  
ATOM     73  HZ3 LYS A   5       6.201  -7.913  -8.050  1.00  3.23           H  
HETATM   74  N   AIB A   6       3.085  -6.804  -0.430  1.00  0.16           N  
HETATM   75  CA  AIB A   6       2.689  -7.065   0.953  1.00  0.16           C  
HETATM   76  C   AIB A   6       1.536  -6.139   1.342  1.00  0.12           C  
HETATM   77  O   AIB A   6       0.563  -6.568   1.963  1.00  0.16           O  
HETATM   78  CB1 AIB A   6       3.864  -6.814   1.872  1.00  0.22           C  
HETATM   79  CB2 AIB A   6       2.286  -8.519   1.116  1.00  0.25           C  
HETATM   80  H   AIB A   6       4.009  -6.521  -0.610  1.00  0.18           H  
HETATM   81 HB11 AIB A   6       4.160  -5.777   1.802  1.00  1.10           H  
HETATM   82 HB12 AIB A   6       4.691  -7.444   1.580  1.00  1.03           H  
HETATM   83 HB13 AIB A   6       3.581  -7.039   2.890  1.00  0.90           H  
HETATM   84 HB21 AIB A   6       3.136  -9.152   0.909  1.00  1.08           H  
HETATM   85 HB22 AIB A   6       1.491  -8.749   0.425  1.00  1.03           H  
HETATM   86 HB23 AIB A   6       1.947  -8.688   2.127  1.00  1.03           H  
ATOM     87  N   LEU A   7       1.657  -4.868   0.968  1.00  0.12           N  
ATOM     88  CA  LEU A   7       0.656  -3.870   1.316  1.00  0.16           C  
ATOM     89  C   LEU A   7      -0.671  -4.163   0.639  1.00  0.17           C  
ATOM     90  O   LEU A   7      -1.715  -4.143   1.282  1.00  0.21           O  
ATOM     91  CB  LEU A   7       1.127  -2.466   0.934  1.00  0.23           C  
ATOM     92  CG  LEU A   7       2.347  -1.949   1.701  1.00  0.28           C  
ATOM     93  CD1 LEU A   7       2.820  -0.630   1.116  1.00  0.38           C  
ATOM     94  CD2 LEU A   7       2.016  -1.779   3.175  1.00  0.35           C  
ATOM     95  H   LEU A   7       2.441  -4.595   0.441  1.00  0.15           H  
ATOM     96  HA  LEU A   7       0.512  -3.911   2.383  1.00  0.19           H  
ATOM     97  HB2 LEU A   7       1.363  -2.465  -0.118  1.00  0.25           H  
ATOM     98  HB3 LEU A   7       0.311  -1.780   1.101  1.00  0.28           H  
ATOM     99  HG  LEU A   7       3.151  -2.665   1.615  1.00  0.24           H  
ATOM    100 HD11 LEU A   7       3.134  -0.779   0.095  1.00  1.02           H  
ATOM    101 HD12 LEU A   7       3.650  -0.256   1.696  1.00  0.98           H  
ATOM    102 HD13 LEU A   7       2.012   0.085   1.143  1.00  1.03           H  
ATOM    103 HD21 LEU A   7       2.881  -1.401   3.697  1.00  1.14           H  
ATOM    104 HD22 LEU A   7       1.731  -2.733   3.593  1.00  0.90           H  
ATOM    105 HD23 LEU A   7       1.198  -1.082   3.280  1.00  1.09           H  
ATOM    106  N   LYS A   8      -0.632  -4.447  -0.656  1.00  0.19           N  
ATOM    107  CA  LYS A   8      -1.855  -4.689  -1.406  1.00  0.27           C  
ATOM    108  C   LYS A   8      -2.554  -5.948  -0.919  1.00  0.25           C  
ATOM    109  O   LYS A   8      -3.774  -5.951  -0.751  1.00  0.31           O  
ATOM    110  CB  LYS A   8      -1.575  -4.775  -2.907  1.00  0.35           C  
ATOM    111  CG  LYS A   8      -1.150  -3.450  -3.519  1.00  1.12           C  
ATOM    112  CD  LYS A   8      -1.050  -3.534  -5.030  1.00  1.10           C  
ATOM    113  CE  LYS A   8      -0.616  -2.205  -5.627  1.00  2.05           C  
ATOM    114  NZ  LYS A   8      -0.611  -2.239  -7.111  1.00  2.55           N1+
ATOM    115  H   LYS A   8       0.237  -4.500  -1.114  1.00  0.20           H  
ATOM    116  HA  LYS A   8      -2.509  -3.850  -1.226  1.00  0.31           H  
ATOM    117  HB2 LYS A   8      -0.787  -5.495  -3.073  1.00  0.78           H  
ATOM    118  HB3 LYS A   8      -2.470  -5.111  -3.411  1.00  1.00           H  
ATOM    119  HG2 LYS A   8      -1.877  -2.695  -3.260  1.00  1.72           H  
ATOM    120  HG3 LYS A   8      -0.186  -3.173  -3.118  1.00  1.60           H  
ATOM    121  HD2 LYS A   8      -0.325  -4.290  -5.290  1.00  1.29           H  
ATOM    122  HD3 LYS A   8      -2.015  -3.803  -5.432  1.00  1.23           H  
ATOM    123  HE2 LYS A   8      -1.298  -1.436  -5.297  1.00  2.55           H  
ATOM    124  HE3 LYS A   8       0.380  -1.976  -5.277  1.00  2.55           H  
ATOM    125  HZ1 LYS A   8      -0.312  -1.319  -7.490  1.00  2.92           H  
ATOM    126  HZ2 LYS A   8      -1.563  -2.454  -7.468  1.00  2.95           H  
ATOM    127  HZ3 LYS A   8       0.046  -2.972  -7.452  1.00  2.82           H  
HETATM  128  N   AIB A   9      -1.773  -7.002  -0.679  1.00  0.21           N  
HETATM  129  CA  AIB A   9      -2.299  -8.269  -0.155  1.00  0.24           C  
HETATM  130  C   AIB A   9      -2.918  -8.028   1.228  1.00  0.26           C  
HETATM  131  O   AIB A   9      -4.008  -8.514   1.532  1.00  0.35           O  
HETATM  132  CB1 AIB A   9      -1.174  -9.275  -0.032  1.00  0.23           C  
HETATM  133  CB2 AIB A   9      -3.329  -8.853  -1.106  1.00  0.32           C  
HETATM  134  H   AIB A   9      -0.807  -6.928  -0.861  1.00  0.18           H  
HETATM  135 HB11 AIB A   9      -0.694  -9.398  -0.991  1.00  1.04           H  
HETATM  136 HB12 AIB A   9      -1.575 -10.223   0.295  1.00  0.97           H  
HETATM  137 HB13 AIB A   9      -0.454  -8.921   0.689  1.00  1.10           H  
HETATM  138 HB21 AIB A   9      -2.861  -9.064  -2.057  1.00  1.03           H  
HETATM  139 HB22 AIB A   9      -4.128  -8.143  -1.251  1.00  1.10           H  
HETATM  140 HB23 AIB A   9      -3.727  -9.766  -0.690  1.00  0.99           H  
ATOM    141  N   ARG A  10      -2.204  -7.267   2.054  1.00  0.21           N  
ATOM    142  CA  ARG A  10      -2.640  -6.967   3.413  1.00  0.27           C  
ATOM    143  C   ARG A  10      -3.931  -6.159   3.409  1.00  0.33           C  
ATOM    144  O   ARG A  10      -4.863  -6.442   4.162  1.00  0.44           O  
ATOM    145  CB  ARG A  10      -1.544  -6.189   4.145  1.00  0.28           C  
ATOM    146  CG  ARG A  10      -1.940  -5.710   5.524  1.00  0.37           C  
ATOM    147  CD  ARG A  10      -0.843  -4.861   6.142  1.00  0.46           C  
ATOM    148  NE  ARG A  10      -1.278  -4.206   7.374  1.00  1.04           N  
ATOM    149  CZ  ARG A  10      -0.568  -3.271   8.007  1.00  1.36           C  
ATOM    150  NH1 ARG A  10       0.617  -2.901   7.537  1.00  1.26           N1+
ATOM    151  NH2 ARG A  10      -1.043  -2.714   9.114  1.00  2.18           N  
ATOM    152  H   ARG A  10      -1.351  -6.893   1.738  1.00  0.16           H  
ATOM    153  HA  ARG A  10      -2.812  -7.900   3.923  1.00  0.33           H  
ATOM    154  HB2 ARG A  10      -0.677  -6.824   4.245  1.00  0.30           H  
ATOM    155  HB3 ARG A  10      -1.277  -5.325   3.553  1.00  0.27           H  
ATOM    156  HG2 ARG A  10      -2.840  -5.119   5.444  1.00  0.45           H  
ATOM    157  HG3 ARG A  10      -2.122  -6.568   6.154  1.00  0.42           H  
ATOM    158  HD2 ARG A  10       0.002  -5.496   6.364  1.00  0.90           H  
ATOM    159  HD3 ARG A  10      -0.546  -4.107   5.428  1.00  1.00           H  
ATOM    160  HE  ARG A  10      -2.150  -4.478   7.745  1.00  1.56           H  
ATOM    161 HH11 ARG A  10       1.153  -2.196   8.013  1.00  1.61           H  
ATOM    162 HH12 ARG A  10       0.990  -3.329   6.709  1.00  1.29           H  
ATOM    163 HH21 ARG A  10      -1.936  -2.991   9.479  1.00  2.69           H  
ATOM    164 HH22 ARG A  10      -0.508  -2.011   9.595  1.00  2.46           H  
ATOM    165  N   TYR A  11      -3.981  -5.160   2.550  1.00  0.31           N  
ATOM    166  CA  TYR A  11      -5.128  -4.278   2.465  1.00  0.39           C  
ATOM    167  C   TYR A  11      -6.105  -4.775   1.412  1.00  0.58           C  
ATOM    168  O   TYR A  11      -6.477  -4.043   0.491  1.00  0.93           O  
ATOM    169  CB  TYR A  11      -4.671  -2.854   2.164  1.00  0.32           C  
ATOM    170  CG  TYR A  11      -3.953  -2.210   3.325  1.00  0.24           C  
ATOM    171  CD1 TYR A  11      -4.651  -1.705   4.412  1.00  0.27           C  
ATOM    172  CD2 TYR A  11      -2.570  -2.095   3.322  1.00  0.24           C  
ATOM    173  CE1 TYR A  11      -3.991  -1.103   5.464  1.00  0.31           C  
ATOM    174  CE2 TYR A  11      -1.902  -1.499   4.371  1.00  0.24           C  
ATOM    175  CZ  TYR A  11      -2.650  -1.046   5.484  1.00  0.27           C  
ATOM    176  OH  TYR A  11      -1.950  -0.407   6.484  1.00  0.38           O  
ATOM    177  H   TYR A  11      -3.222  -5.014   1.942  1.00  0.29           H  
ATOM    178  HA  TYR A  11      -5.620  -4.290   3.426  1.00  0.44           H  
ATOM    179  HB2 TYR A  11      -3.996  -2.867   1.321  1.00  0.34           H  
ATOM    180  HB3 TYR A  11      -5.529  -2.251   1.926  1.00  0.37           H  
ATOM    181  HD1 TYR A  11      -5.730  -1.787   4.429  1.00  0.33           H  
ATOM    182  HD2 TYR A  11      -2.015  -2.483   2.482  1.00  0.32           H  
ATOM    183  HE1 TYR A  11      -4.552  -0.716   6.300  1.00  0.41           H  
ATOM    184  HE2 TYR A  11      -0.826  -1.421   4.350  1.00  0.29           H  
ATOM    185  HH  TYR A  11      -1.202   0.098   6.140  1.00  0.93           H  
HETATM  186  N   AIB A  12      -6.502  -6.035   1.567  1.00  0.54           N  
HETATM  187  CA  AIB A  12      -7.467  -6.685   0.680  1.00  0.73           C  
HETATM  188  C   AIB A  12      -8.714  -5.802   0.535  1.00  0.64           C  
HETATM  189  O   AIB A  12      -9.327  -5.412   1.531  1.00  1.44           O  
HETATM  190  CB1 AIB A  12      -7.866  -8.025   1.264  1.00  1.05           C  
HETATM  191  CB2 AIB A  12      -6.827  -6.955  -0.671  1.00  1.04           C  
HETATM  192  H   AIB A  12      -6.122  -6.554   2.308  1.00  0.64           H  
HETATM  193 HB11 AIB A  12      -6.993  -8.653   1.359  1.00  1.35           H  
HETATM  194 HB12 AIB A  12      -8.582  -8.501   0.611  1.00  1.34           H  
HETATM  195 HB13 AIB A  12      -8.311  -7.876   2.236  1.00  1.69           H  
HETATM  196 HB21 AIB A  12      -5.956  -7.575  -0.536  1.00  1.46           H  
HETATM  197 HB22 AIB A  12      -6.537  -6.019  -1.126  1.00  1.41           H  
HETATM  198 HB23 AIB A  12      -7.534  -7.463  -1.309  1.00  1.18           H  
ATOM    199  N   GLY A  13      -9.060  -5.466  -0.700  1.00  0.60           N  
ATOM    200  CA  GLY A  13     -10.258  -4.692  -0.950  1.00  0.84           C  
ATOM    201  C   GLY A  13     -10.004  -3.199  -0.968  1.00  0.80           C  
ATOM    202  O   GLY A  13     -10.866  -2.423  -1.381  1.00  1.24           O  
ATOM    203  H   GLY A  13      -8.496  -5.747  -1.451  1.00  1.15           H  
ATOM    204  HA2 GLY A  13     -10.667  -4.987  -1.904  1.00  0.99           H  
ATOM    205  HA3 GLY A  13     -10.980  -4.914  -0.178  1.00  1.02           H  
ATOM    206  N   CYS A  14      -8.826  -2.792  -0.528  1.00  0.33           N  
ATOM    207  CA  CYS A  14      -8.487  -1.383  -0.461  1.00  0.29           C  
ATOM    208  C   CYS A  14      -7.341  -1.067  -1.409  1.00  0.34           C  
ATOM    209  O   CYS A  14      -6.504  -1.923  -1.694  1.00  0.62           O  
ATOM    210  CB  CYS A  14      -8.093  -1.006   0.965  1.00  0.25           C  
ATOM    211  SG  CYS A  14      -9.260  -1.586   2.238  1.00  0.39           S  
ATOM    212  H   CYS A  14      -8.159  -3.457  -0.242  1.00  0.23           H  
ATOM    213  HA  CYS A  14      -9.356  -0.813  -0.752  1.00  0.35           H  
ATOM    214  HB2 CYS A  14      -7.129  -1.430   1.184  1.00  0.26           H  
ATOM    215  HB3 CYS A  14      -8.034   0.070   1.040  1.00  0.26           H  
ATOM    216  N   GLU A  15      -7.316   0.160  -1.893  1.00  0.27           N  
ATOM    217  CA  GLU A  15      -6.264   0.612  -2.784  1.00  0.27           C  
ATOM    218  C   GLU A  15      -5.119   1.178  -1.958  1.00  0.21           C  
ATOM    219  O   GLU A  15      -5.362   1.836  -0.947  1.00  0.33           O  
ATOM    220  CB  GLU A  15      -6.803   1.686  -3.728  1.00  0.31           C  
ATOM    221  CG  GLU A  15      -8.020   1.255  -4.521  1.00  0.37           C  
ATOM    222  CD  GLU A  15      -8.604   2.387  -5.335  1.00  0.84           C  
ATOM    223  OE1 GLU A  15      -9.113   3.355  -4.735  1.00  1.65           O  
ATOM    224  OE2 GLU A  15      -8.552   2.313  -6.581  1.00  0.80           O1-
ATOM    225  H   GLU A  15      -8.017   0.792  -1.626  1.00  0.38           H  
ATOM    226  HA  GLU A  15      -5.913  -0.232  -3.356  1.00  0.31           H  
ATOM    227  HB2 GLU A  15      -7.071   2.555  -3.144  1.00  0.31           H  
ATOM    228  HB3 GLU A  15      -6.024   1.959  -4.425  1.00  0.34           H  
ATOM    229  HG2 GLU A  15      -7.734   0.459  -5.192  1.00  0.85           H  
ATOM    230  HG3 GLU A  15      -8.773   0.894  -3.837  1.00  0.82           H  
HETATM  231  N   MVA A  16      -3.862   0.948  -2.357  1.00  0.25           N  
HETATM  232  CN  MVA A  16      -3.617   0.222  -3.625  1.00  0.53           C  
HETATM  233  CA  MVA A  16      -2.734   1.444  -1.557  1.00  0.19           C  
HETATM  234  CB  MVA A  16      -2.256   0.402  -0.503  1.00  0.21           C  
HETATM  235  CG1 MVA A  16      -1.870  -0.927  -1.126  1.00  0.36           C  
HETATM  236  CG2 MVA A  16      -1.097   0.958   0.304  1.00  0.21           C  
HETATM  237  C   MVA A  16      -1.556   1.921  -2.414  1.00  0.24           C  
HETATM  238  O   MVA A  16      -0.841   1.136  -3.048  1.00  0.48           O  
HETATM  239  HN1 MVA A  16      -4.267   0.610  -4.393  1.00  1.23           H  
HETATM  240  HN2 MVA A  16      -3.814  -0.830  -3.482  1.00  1.12           H  
HETATM  241  HN3 MVA A  16      -2.587   0.358  -3.924  1.00  1.12           H  
HETATM  242  HA  MVA A  16      -3.070   2.309  -0.997  1.00  0.20           H  
HETATM  243  HB  MVA A  16      -3.072   0.217   0.179  1.00  0.37           H  
HETATM  244 HG11 MVA A  16      -2.731  -1.357  -1.615  1.00  1.08           H  
HETATM  245 HG12 MVA A  16      -1.521  -1.597  -0.354  1.00  1.13           H  
HETATM  246 HG13 MVA A  16      -1.084  -0.769  -1.851  1.00  1.07           H  
HETATM  247 HG21 MVA A  16      -0.255   1.131  -0.351  1.00  1.05           H  
HETATM  248 HG22 MVA A  16      -0.818   0.250   1.071  1.00  1.05           H  
HETATM  249 HG23 MVA A  16      -1.393   1.889   0.762  1.00  0.94           H  
ATOM    250  N   ARG A  17      -1.368   3.231  -2.414  1.00  0.23           N  
ATOM    251  CA  ARG A  17      -0.274   3.861  -3.129  1.00  0.27           C  
ATOM    252  C   ARG A  17       1.004   3.682  -2.334  1.00  0.23           C  
ATOM    253  O   ARG A  17       1.204   4.335  -1.311  1.00  0.34           O  
ATOM    254  CB  ARG A  17      -0.558   5.349  -3.325  1.00  0.34           C  
ATOM    255  CG  ARG A  17      -1.920   5.633  -3.930  1.00  1.33           C  
ATOM    256  CD  ARG A  17      -2.211   7.125  -3.982  1.00  1.48           C  
ATOM    257  NE  ARG A  17      -3.548   7.404  -4.510  1.00  2.36           N  
ATOM    258  CZ  ARG A  17      -4.379   8.309  -3.999  1.00  3.00           C  
ATOM    259  NH1 ARG A  17      -4.020   9.024  -2.939  1.00  3.01           N1+
ATOM    260  NH2 ARG A  17      -5.575   8.496  -4.545  1.00  3.96           N  
ATOM    261  H   ARG A  17      -1.982   3.794  -1.896  1.00  0.34           H  
ATOM    262  HA  ARG A  17      -0.172   3.380  -4.089  1.00  0.31           H  
ATOM    263  HB2 ARG A  17      -0.501   5.843  -2.369  1.00  1.08           H  
ATOM    264  HB3 ARG A  17       0.194   5.760  -3.978  1.00  0.90           H  
ATOM    265  HG2 ARG A  17      -1.945   5.235  -4.933  1.00  2.00           H  
ATOM    266  HG3 ARG A  17      -2.675   5.147  -3.330  1.00  1.97           H  
ATOM    267  HD2 ARG A  17      -2.138   7.528  -2.981  1.00  1.68           H  
ATOM    268  HD3 ARG A  17      -1.476   7.602  -4.615  1.00  1.71           H  
ATOM    269  HE  ARG A  17      -3.837   6.884  -5.299  1.00  2.76           H  
ATOM    270 HH11 ARG A  17      -4.649   9.705  -2.557  1.00  3.63           H  
ATOM    271 HH12 ARG A  17      -3.114   8.889  -2.512  1.00  2.64           H  
ATOM    272 HH21 ARG A  17      -5.856   7.955  -5.344  1.00  4.30           H  
ATOM    273 HH22 ARG A  17      -6.206   9.180  -4.163  1.00  4.48           H  
ATOM    274  N   CYS A  18       1.849   2.781  -2.788  1.00  0.27           N  
ATOM    275  CA  CYS A  18       3.057   2.441  -2.060  1.00  0.31           C  
ATOM    276  C   CYS A  18       4.231   3.328  -2.458  1.00  0.38           C  
ATOM    277  O   CYS A  18       4.495   3.544  -3.643  1.00  0.41           O  
ATOM    278  CB  CYS A  18       3.399   0.972  -2.297  1.00  0.37           C  
ATOM    279  SG  CYS A  18       3.419   0.495  -4.056  1.00  0.47           S  
ATOM    280  H   CYS A  18       1.655   2.325  -3.632  1.00  0.40           H  
ATOM    281  HA  CYS A  18       2.856   2.585  -1.009  1.00  0.33           H  
ATOM    282  HB2 CYS A  18       4.378   0.767  -1.890  1.00  0.45           H  
ATOM    283  HB3 CYS A  18       2.669   0.354  -1.797  1.00  0.37           H  
ATOM    284  N   ASP A  19       4.914   3.852  -1.454  1.00  0.50           N  
ATOM    285  CA  ASP A  19       6.144   4.610  -1.644  1.00  0.68           C  
ATOM    286  C   ASP A  19       7.188   4.127  -0.645  1.00  0.80           C  
ATOM    287  O   ASP A  19       7.456   4.793   0.361  1.00  0.84           O  
ATOM    288  CB  ASP A  19       5.913   6.116  -1.460  1.00  0.80           C  
ATOM    289  CG  ASP A  19       5.136   6.744  -2.597  1.00  1.11           C  
ATOM    290  OD1 ASP A  19       3.918   6.981  -2.433  1.00  1.76           O  
ATOM    291  OD2 ASP A  19       5.731   6.986  -3.669  1.00  1.10           O1-
ATOM    292  H   ASP A  19       4.584   3.719  -0.538  1.00  0.49           H  
ATOM    293  HA  ASP A  19       6.500   4.423  -2.646  1.00  0.74           H  
ATOM    294  HB2 ASP A  19       5.365   6.278  -0.545  1.00  1.05           H  
ATOM    295  HB3 ASP A  19       6.872   6.610  -1.389  1.00  1.05           H  
HETATM  296  N   DPR A  20       7.787   2.954  -0.906  1.00  0.95           N  
HETATM  297  CA  DPR A  20       8.736   2.322   0.017  1.00  1.13           C  
HETATM  298  CB  DPR A  20       9.092   1.001  -0.664  1.00  1.31           C  
HETATM  299  CG  DPR A  20       8.774   1.214  -2.104  1.00  1.35           C  
HETATM  300  CD  DPR A  20       7.602   2.153  -2.128  1.00  1.02           C  
HETATM  301  C   DPR A  20       8.110   2.070   1.391  1.00  1.11           C  
HETATM  302  O   DPR A  20       7.156   1.299   1.519  1.00  1.10           O  
HETATM  303  HA  DPR A  20       9.630   2.912   0.131  1.00  1.22           H  
HETATM  304  HB2 DPR A  20      10.141   0.790  -0.516  1.00  1.44           H  
HETATM  305  HB3 DPR A  20       8.496   0.205  -0.243  1.00  1.39           H  
HETATM  306  HG2 DPR A  20       9.622   1.656  -2.607  1.00  1.54           H  
HETATM  307  HG3 DPR A  20       8.511   0.273  -2.566  1.00  1.59           H  
HETATM  308  HD2 DPR A  20       7.639   2.778  -3.007  1.00  1.05           H  
HETATM  309  HD3 DPR A  20       6.674   1.604  -2.091  1.00  0.93           H  
ATOM    310  N   PRO A  21       8.645   2.723   2.432  1.00  1.18           N  
ATOM    311  CA  PRO A  21       8.127   2.600   3.799  1.00  1.23           C  
ATOM    312  C   PRO A  21       6.807   3.342   3.998  1.00  1.04           C  
ATOM    313  O   PRO A  21       6.103   3.125   4.985  1.00  1.12           O  
ATOM    314  CB  PRO A  21       9.227   3.241   4.644  1.00  1.43           C  
ATOM    315  CG  PRO A  21       9.859   4.234   3.736  1.00  1.40           C  
ATOM    316  CD  PRO A  21       9.814   3.621   2.365  1.00  1.30           C  
ATOM    317  HA  PRO A  21       8.006   1.567   4.086  1.00  1.35           H  
ATOM    318  HB2 PRO A  21       8.790   3.716   5.510  1.00  1.46           H  
ATOM    319  HB3 PRO A  21       9.934   2.489   4.956  1.00  1.61           H  
ATOM    320  HG2 PRO A  21       9.297   5.155   3.755  1.00  1.32           H  
ATOM    321  HG3 PRO A  21      10.880   4.410   4.034  1.00  1.59           H  
ATOM    322  HD2 PRO A  21       9.671   4.382   1.614  1.00  1.23           H  
ATOM    323  HD3 PRO A  21      10.716   3.061   2.170  1.00  1.47           H  
ATOM    324  N   ARG A  22       6.476   4.216   3.059  1.00  0.84           N  
ATOM    325  CA  ARG A  22       5.256   4.999   3.147  1.00  0.70           C  
ATOM    326  C   ARG A  22       4.204   4.428   2.218  1.00  0.52           C  
ATOM    327  O   ARG A  22       4.531   3.745   1.251  1.00  0.54           O  
ATOM    328  CB  ARG A  22       5.527   6.457   2.784  1.00  0.82           C  
ATOM    329  CG  ARG A  22       6.460   7.168   3.749  1.00  1.37           C  
ATOM    330  CD  ARG A  22       6.766   8.582   3.278  1.00  1.91           C  
ATOM    331  NE  ARG A  22       7.465   8.594   1.990  1.00  2.59           N  
ATOM    332  CZ  ARG A  22       7.068   9.293   0.928  1.00  3.29           C  
ATOM    333  NH1 ARG A  22       5.957  10.018   0.976  1.00  3.45           N1+
ATOM    334  NH2 ARG A  22       7.782   9.258  -0.188  1.00  4.24           N  
ATOM    335  H   ARG A  22       7.058   4.321   2.270  1.00  0.84           H  
ATOM    336  HA  ARG A  22       4.894   4.946   4.163  1.00  0.71           H  
ATOM    337  HB2 ARG A  22       5.972   6.492   1.799  1.00  1.26           H  
ATOM    338  HB3 ARG A  22       4.589   6.990   2.764  1.00  0.94           H  
ATOM    339  HG2 ARG A  22       5.990   7.215   4.719  1.00  1.75           H  
ATOM    340  HG3 ARG A  22       7.383   6.610   3.818  1.00  1.90           H  
ATOM    341  HD2 ARG A  22       5.837   9.122   3.178  1.00  1.99           H  
ATOM    342  HD3 ARG A  22       7.386   9.069   4.018  1.00  2.56           H  
ATOM    343  HE  ARG A  22       8.291   8.056   1.920  1.00  2.93           H  
ATOM    344 HH11 ARG A  22       5.406  10.044   1.814  1.00  3.20           H  
ATOM    345 HH12 ARG A  22       5.660  10.538   0.173  1.00  4.13           H  
ATOM    346 HH21 ARG A  22       7.492   9.782  -0.994  1.00  4.82           H  
ATOM    347 HH22 ARG A  22       8.620   8.703  -0.234  1.00  4.54           H  
ATOM    348  N   TYR A  23       2.944   4.678   2.528  1.00  0.40           N  
ATOM    349  CA  TYR A  23       1.854   4.241   1.675  1.00  0.29           C  
ATOM    350  C   TYR A  23       0.579   5.009   1.982  1.00  0.24           C  
ATOM    351  O   TYR A  23       0.395   5.516   3.091  1.00  0.30           O  
ATOM    352  CB  TYR A  23       1.617   2.740   1.831  1.00  0.28           C  
ATOM    353  CG  TYR A  23       1.232   2.316   3.228  1.00  0.27           C  
ATOM    354  CD1 TYR A  23      -0.102   2.166   3.586  1.00  0.26           C  
ATOM    355  CD2 TYR A  23       2.202   2.071   4.191  1.00  0.33           C  
ATOM    356  CE1 TYR A  23      -0.456   1.786   4.863  1.00  0.29           C  
ATOM    357  CE2 TYR A  23       1.855   1.689   5.468  1.00  0.37           C  
ATOM    358  CZ  TYR A  23       0.522   1.524   5.792  1.00  0.35           C  
ATOM    359  OH  TYR A  23       0.180   1.173   7.078  1.00  0.42           O  
ATOM    360  H   TYR A  23       2.740   5.167   3.351  1.00  0.41           H  
ATOM    361  HA  TYR A  23       2.136   4.443   0.652  1.00  0.32           H  
ATOM    362  HB2 TYR A  23       0.822   2.440   1.166  1.00  0.28           H  
ATOM    363  HB3 TYR A  23       2.518   2.214   1.561  1.00  0.34           H  
ATOM    364  HD1 TYR A  23      -0.867   2.352   2.847  1.00  0.26           H  
ATOM    365  HD2 TYR A  23       3.244   2.181   3.927  1.00  0.36           H  
ATOM    366  HE1 TYR A  23      -1.498   1.673   5.121  1.00  0.29           H  
ATOM    367  HE2 TYR A  23       2.625   1.502   6.203  1.00  0.44           H  
ATOM    368  HH  TYR A  23       0.741   1.652   7.714  1.00  0.90           H  
ATOM    369  N   GLU A  24      -0.288   5.095   0.992  1.00  0.20           N  
ATOM    370  CA  GLU A  24      -1.592   5.711   1.161  1.00  0.21           C  
ATOM    371  C   GLU A  24      -2.680   4.682   0.883  1.00  0.19           C  
ATOM    372  O   GLU A  24      -2.733   4.127  -0.209  1.00  0.32           O  
ATOM    373  CB  GLU A  24      -1.753   6.896   0.213  1.00  0.32           C  
ATOM    374  CG  GLU A  24      -0.726   7.993   0.422  1.00  0.49           C  
ATOM    375  CD  GLU A  24      -0.885   9.129  -0.564  1.00  1.22           C  
ATOM    376  OE1 GLU A  24       0.019   9.983  -0.648  1.00  1.64           O  
ATOM    377  OE2 GLU A  24      -1.921   9.174  -1.264  1.00  1.99           O1-
ATOM    378  H   GLU A  24      -0.042   4.730   0.114  1.00  0.21           H  
ATOM    379  HA  GLU A  24      -1.674   6.051   2.180  1.00  0.27           H  
ATOM    380  HB2 GLU A  24      -1.669   6.542  -0.802  1.00  0.32           H  
ATOM    381  HB3 GLU A  24      -2.734   7.320   0.354  1.00  0.43           H  
ATOM    382  HG2 GLU A  24      -0.835   8.386   1.422  1.00  0.85           H  
ATOM    383  HG3 GLU A  24       0.263   7.571   0.309  1.00  0.91           H  
HETATM  384  N   MVA A  25      -3.573   4.418   1.842  1.00  0.17           N  
HETATM  385  CN  MVA A  25      -3.577   5.245   3.069  1.00  0.28           C  
HETATM  386  CA  MVA A  25      -4.570   3.344   1.641  1.00  0.18           C  
HETATM  387  CB  MVA A  25      -4.351   2.119   2.586  1.00  0.28           C  
HETATM  388  CG1 MVA A  25      -4.593   2.442   4.053  1.00  0.51           C  
HETATM  389  CG2 MVA A  25      -5.238   0.962   2.154  1.00  0.76           C  
HETATM  390  C   MVA A  25      -6.014   3.843   1.754  1.00  0.25           C  
HETATM  391  O   MVA A  25      -6.415   4.475   2.734  1.00  0.47           O  
HETATM  392  HN1 MVA A  25      -2.737   4.976   3.688  1.00  1.20           H  
HETATM  393  HN2 MVA A  25      -4.496   5.076   3.611  1.00  0.93           H  
HETATM  394  HN3 MVA A  25      -3.506   6.287   2.799  1.00  1.04           H  
HETATM  395  HA  MVA A  25      -4.461   2.969   0.631  1.00  0.17           H  
HETATM  396  HB  MVA A  25      -3.325   1.800   2.483  1.00  0.69           H  
HETATM  397 HG11 MVA A  25      -3.855   3.156   4.390  1.00  1.16           H  
HETATM  398 HG12 MVA A  25      -4.513   1.538   4.640  1.00  1.12           H  
HETATM  399 HG13 MVA A  25      -5.581   2.862   4.170  1.00  1.28           H  
HETATM  400 HG21 MVA A  25      -6.275   1.258   2.228  1.00  1.28           H  
HETATM  401 HG22 MVA A  25      -5.060   0.111   2.795  1.00  1.27           H  
HETATM  402 HG23 MVA A  25      -5.013   0.696   1.133  1.00  1.43           H  
ATOM    403  N   HIS A  26      -6.790   3.563   0.718  1.00  0.17           N  
ATOM    404  CA  HIS A  26      -8.183   3.967   0.662  1.00  0.24           C  
ATOM    405  C   HIS A  26      -9.076   2.754   0.455  1.00  0.32           C  
ATOM    406  O   HIS A  26      -8.953   2.042  -0.543  1.00  0.43           O  
ATOM    407  CB  HIS A  26      -8.414   4.968  -0.472  1.00  0.32           C  
ATOM    408  CG  HIS A  26      -7.751   6.295  -0.268  1.00  0.44           C  
ATOM    409  ND1 HIS A  26      -8.406   7.389   0.258  1.00  0.57           N  
ATOM    410  CD2 HIS A  26      -6.487   6.706  -0.527  1.00  0.55           C  
ATOM    411  CE1 HIS A  26      -7.575   8.413   0.311  1.00  0.72           C  
ATOM    412  NE2 HIS A  26      -6.405   8.026  -0.158  1.00  0.70           N  
ATOM    413  H   HIS A  26      -6.412   3.053  -0.036  1.00  0.22           H  
ATOM    414  HA  HIS A  26      -8.434   4.432   1.601  1.00  0.30           H  
ATOM    415  HB2 HIS A  26      -8.034   4.547  -1.388  1.00  0.33           H  
ATOM    416  HB3 HIS A  26      -9.473   5.136  -0.576  1.00  0.40           H  
ATOM    417  HD1 HIS A  26      -9.348   7.416   0.541  1.00  0.61           H  
ATOM    418  HD2 HIS A  26      -5.690   6.106  -0.945  1.00  0.59           H  
ATOM    419  HE1 HIS A  26      -7.813   9.400   0.680  1.00  0.87           H  
ATOM    420  HE2 HIS A  26      -5.651   8.626  -0.350  1.00  0.83           H  
ATOM    421  N   CYS A  27      -9.961   2.516   1.404  1.00  0.38           N  
ATOM    422  CA  CYS A  27     -10.889   1.404   1.317  1.00  0.50           C  
ATOM    423  C   CYS A  27     -12.221   1.867   0.747  1.00  0.74           C  
ATOM    424  O   CYS A  27     -13.186   2.091   1.476  1.00  1.38           O  
ATOM    425  CB  CYS A  27     -11.093   0.776   2.693  1.00  0.59           C  
ATOM    426  SG  CYS A  27      -9.582   0.044   3.400  1.00  0.75           S  
ATOM    427  H   CYS A  27      -9.993   3.105   2.187  1.00  0.41           H  
ATOM    428  HA  CYS A  27     -10.461   0.666   0.655  1.00  0.47           H  
ATOM    429  HB2 CYS A  27     -11.445   1.532   3.377  1.00  0.95           H  
ATOM    430  HB3 CYS A  27     -11.834  -0.004   2.615  1.00  0.83           H  
HETATM  431  N   NH2 A  28     -12.274   2.003  -0.564  1.00  0.99           N  
HETATM  432  HN1 NH2 A  28     -11.466   1.808  -1.085  1.00  1.44           H  
HETATM  433  HN2 NH2 A  28     -13.119   2.288  -0.964  1.00  1.11           H  
TER     434      NH2 A  28                                                      
ENDMDL                                                                          
MODEL        5                                                                  
ATOM      1  N   ASN A   1      10.953  -9.733  -2.681  1.00  1.83           N  
ATOM      2  CA  ASN A   1       9.603  -9.345  -2.219  1.00  1.49           C  
ATOM      3  C   ASN A   1       9.309  -7.904  -2.623  1.00  1.11           C  
ATOM      4  O   ASN A   1      10.224  -7.134  -2.914  1.00  1.38           O  
ATOM      5  CB  ASN A   1       9.499  -9.502  -0.695  1.00  1.76           C  
ATOM      6  CG  ASN A   1       8.095  -9.262  -0.171  1.00  2.41           C  
ATOM      7  OD1 ASN A   1       7.108  -9.472  -0.877  1.00  3.13           O  
ATOM      8  ND2 ASN A   1       7.997  -8.826   1.073  1.00  2.72           N  
ATOM      9  H1  ASN A   1      11.001  -9.680  -3.717  1.00  1.62           H  
ATOM     10  H2  ASN A   1      11.168 -10.704  -2.385  1.00  2.41           H  
ATOM     11  H3  ASN A   1      11.663  -9.092  -2.280  1.00  2.27           H  
ATOM     12  HA  ASN A   1       8.881  -9.994  -2.695  1.00  1.51           H  
ATOM     13  HB2 ASN A   1       9.796 -10.503  -0.420  1.00  2.07           H  
ATOM     14  HB3 ASN A   1      10.165  -8.794  -0.223  1.00  1.95           H  
ATOM     15 HD21 ASN A   1       8.827  -8.681   1.580  1.00  2.63           H  
ATOM     16 HD22 ASN A   1       7.100  -8.678   1.446  1.00  3.34           H  
ATOM     17  N   ASP A   2       8.033  -7.551  -2.651  1.00  0.74           N  
ATOM     18  CA  ASP A   2       7.615  -6.203  -2.997  1.00  0.50           C  
ATOM     19  C   ASP A   2       6.797  -5.616  -1.859  1.00  0.36           C  
ATOM     20  O   ASP A   2       5.766  -6.178  -1.482  1.00  0.33           O  
ATOM     21  CB  ASP A   2       6.782  -6.198  -4.284  1.00  0.73           C  
ATOM     22  CG  ASP A   2       7.586  -6.545  -5.520  1.00  1.34           C  
ATOM     23  OD1 ASP A   2       7.555  -7.721  -5.941  1.00  2.21           O  
ATOM     24  OD2 ASP A   2       8.262  -5.651  -6.069  1.00  1.35           O1-
ATOM     25  H   ASP A   2       7.348  -8.213  -2.411  1.00  0.90           H  
ATOM     26  HA  ASP A   2       8.499  -5.603  -3.142  1.00  0.62           H  
ATOM     27  HB2 ASP A   2       5.987  -6.919  -4.190  1.00  1.22           H  
ATOM     28  HB3 ASP A   2       6.352  -5.217  -4.421  1.00  1.02           H  
HETATM   29  N   AIB A   3       7.266  -4.498  -1.309  1.00  0.36           N  
HETATM   30  CA  AIB A   3       6.572  -3.805  -0.216  1.00  0.37           C  
HETATM   31  C   AIB A   3       5.124  -3.519  -0.633  1.00  0.33           C  
HETATM   32  O   AIB A   3       4.182  -3.764   0.127  1.00  0.30           O  
HETATM   33  CB1 AIB A   3       7.279  -2.500   0.096  1.00  0.49           C  
HETATM   34  CB2 AIB A   3       6.609  -4.650   1.046  1.00  0.41           C  
HETATM   35  H   AIB A   3       8.108  -4.123  -1.647  1.00  0.41           H  
HETATM   36 HB11 AIB A   3       6.767  -1.997   0.903  1.00  1.25           H  
HETATM   37 HB12 AIB A   3       7.275  -1.870  -0.780  1.00  0.95           H  
HETATM   38 HB13 AIB A   3       8.299  -2.703   0.389  1.00  1.20           H  
HETATM   39 HB21 AIB A   3       6.122  -5.595   0.860  1.00  1.26           H  
HETATM   40 HB22 AIB A   3       6.095  -4.130   1.841  1.00  1.09           H  
HETATM   41 HB23 AIB A   3       7.635  -4.822   1.334  1.00  0.94           H  
ATOM     42  N   CYS A   4       4.962  -3.017  -1.855  1.00  0.37           N  
ATOM     43  CA  CYS A   4       3.645  -2.684  -2.388  1.00  0.40           C  
ATOM     44  C   CYS A   4       2.761  -3.927  -2.451  1.00  0.32           C  
ATOM     45  O   CYS A   4       1.572  -3.873  -2.142  1.00  0.33           O  
ATOM     46  CB  CYS A   4       3.783  -2.073  -3.784  1.00  0.49           C  
ATOM     47  SG  CYS A   4       5.130  -0.854  -3.929  1.00  1.18           S  
ATOM     48  H   CYS A   4       5.755  -2.855  -2.413  1.00  0.41           H  
ATOM     49  HA  CYS A   4       3.191  -1.964  -1.728  1.00  0.43           H  
ATOM     50  HB2 CYS A   4       3.973  -2.860  -4.495  1.00  1.21           H  
ATOM     51  HB3 CYS A   4       2.860  -1.577  -4.043  1.00  1.05           H  
ATOM     52  N   LYS A   5       3.366  -5.046  -2.828  1.00  0.30           N  
ATOM     53  CA  LYS A   5       2.654  -6.312  -2.947  1.00  0.31           C  
ATOM     54  C   LYS A   5       2.164  -6.779  -1.585  1.00  0.20           C  
ATOM     55  O   LYS A   5       1.005  -7.160  -1.434  1.00  0.20           O  
ATOM     56  CB  LYS A   5       3.568  -7.374  -3.565  1.00  0.39           C  
ATOM     57  CG  LYS A   5       2.926  -8.746  -3.720  1.00  0.80           C  
ATOM     58  CD  LYS A   5       3.948  -9.792  -4.145  1.00  1.37           C  
ATOM     59  CE  LYS A   5       4.497  -9.524  -5.540  1.00  2.05           C  
ATOM     60  NZ  LYS A   5       3.474  -9.749  -6.593  1.00  2.62           N1+
ATOM     61  H   LYS A   5       4.325  -5.020  -3.024  1.00  0.32           H  
ATOM     62  HA  LYS A   5       1.803  -6.156  -3.592  1.00  0.38           H  
ATOM     63  HB2 LYS A   5       3.878  -7.036  -4.542  1.00  0.76           H  
ATOM     64  HB3 LYS A   5       4.443  -7.482  -2.941  1.00  0.63           H  
ATOM     65  HG2 LYS A   5       2.494  -9.042  -2.775  1.00  1.40           H  
ATOM     66  HG3 LYS A   5       2.150  -8.689  -4.470  1.00  1.26           H  
ATOM     67  HD2 LYS A   5       4.768  -9.783  -3.443  1.00  1.80           H  
ATOM     68  HD3 LYS A   5       3.476 -10.764  -4.135  1.00  1.90           H  
ATOM     69  HE2 LYS A   5       4.835  -8.500  -5.592  1.00  2.44           H  
ATOM     70  HE3 LYS A   5       5.333 -10.185  -5.716  1.00  2.54           H  
ATOM     71  HZ1 LYS A   5       2.627  -9.178  -6.399  1.00  2.86           H  
ATOM     72  HZ2 LYS A   5       3.203 -10.752  -6.621  1.00  2.84           H  
ATOM     73  HZ3 LYS A   5       3.854  -9.480  -7.524  1.00  3.23           H  
HETATM   74  N   AIB A   6       3.061  -6.732  -0.599  1.00  0.16           N  
HETATM   75  CA  AIB A   6       2.744  -7.151   0.770  1.00  0.16           C  
HETATM   76  C   AIB A   6       1.565  -6.319   1.295  1.00  0.12           C  
HETATM   77  O   AIB A   6       0.596  -6.857   1.849  1.00  0.16           O  
HETATM   78  CB1 AIB A   6       3.950  -6.936   1.658  1.00  0.22           C  
HETATM   79  CB2 AIB A   6       2.416  -8.633   0.804  1.00  0.25           C  
HETATM   80  H   AIB A   6       3.967  -6.405  -0.799  1.00  0.18           H  
HETATM   81 HB11 AIB A   6       4.195  -5.883   1.684  1.00  1.10           H  
HETATM   82 HB12 AIB A   6       4.790  -7.492   1.265  1.00  1.03           H  
HETATM   83 HB13 AIB A   6       3.728  -7.279   2.658  1.00  0.90           H  
HETATM   84 HB21 AIB A   6       2.164  -8.922   1.813  1.00  1.08           H  
HETATM   85 HB22 AIB A   6       3.275  -9.198   0.472  1.00  1.03           H  
HETATM   86 HB23 AIB A   6       1.581  -8.832   0.151  1.00  1.03           H  
ATOM     87  N   LEU A   7       1.657  -5.004   1.099  1.00  0.12           N  
ATOM     88  CA  LEU A   7       0.616  -4.090   1.550  1.00  0.16           C  
ATOM     89  C   LEU A   7      -0.695  -4.381   0.838  1.00  0.17           C  
ATOM     90  O   LEU A   7      -1.751  -4.436   1.465  1.00  0.21           O  
ATOM     91  CB  LEU A   7       1.031  -2.638   1.307  1.00  0.23           C  
ATOM     92  CG  LEU A   7       2.287  -2.176   2.051  1.00  0.28           C  
ATOM     93  CD1 LEU A   7       2.648  -0.756   1.647  1.00  0.38           C  
ATOM     94  CD2 LEU A   7       2.080  -2.256   3.557  1.00  0.35           C  
ATOM     95  H   LEU A   7       2.445  -4.640   0.633  1.00  0.15           H  
ATOM     96  HA  LEU A   7       0.475  -4.246   2.608  1.00  0.19           H  
ATOM     97  HB2 LEU A   7       1.198  -2.510   0.249  1.00  0.25           H  
ATOM     98  HB3 LEU A   7       0.212  -2.000   1.601  1.00  0.28           H  
ATOM     99  HG  LEU A   7       3.114  -2.820   1.788  1.00  0.24           H  
ATOM    100 HD11 LEU A   7       1.833  -0.095   1.902  1.00  1.02           H  
ATOM    101 HD12 LEU A   7       2.824  -0.718   0.584  1.00  0.98           H  
ATOM    102 HD13 LEU A   7       3.539  -0.448   2.174  1.00  1.03           H  
ATOM    103 HD21 LEU A   7       1.235  -1.644   3.834  1.00  1.14           H  
ATOM    104 HD22 LEU A   7       2.965  -1.898   4.061  1.00  0.90           H  
ATOM    105 HD23 LEU A   7       1.893  -3.281   3.842  1.00  1.09           H  
ATOM    106  N   LYS A   8      -0.617  -4.586  -0.467  1.00  0.19           N  
ATOM    107  CA  LYS A   8      -1.793  -4.888  -1.266  1.00  0.27           C  
ATOM    108  C   LYS A   8      -2.475  -6.147  -0.749  1.00  0.25           C  
ATOM    109  O   LYS A   8      -3.682  -6.153  -0.512  1.00  0.31           O  
ATOM    110  CB  LYS A   8      -1.403  -5.062  -2.735  1.00  0.35           C  
ATOM    111  CG  LYS A   8      -2.587  -5.247  -3.665  1.00  1.12           C  
ATOM    112  CD  LYS A   8      -2.138  -5.405  -5.107  1.00  1.10           C  
ATOM    113  CE  LYS A   8      -3.323  -5.483  -6.055  1.00  2.05           C  
ATOM    114  NZ  LYS A   8      -4.192  -4.279  -5.958  1.00  2.55           N1+
ATOM    115  H   LYS A   8       0.260  -4.530  -0.909  1.00  0.20           H  
ATOM    116  HA  LYS A   8      -2.476  -4.058  -1.177  1.00  0.31           H  
ATOM    117  HB2 LYS A   8      -0.855  -4.187  -3.054  1.00  0.78           H  
ATOM    118  HB3 LYS A   8      -0.763  -5.927  -2.824  1.00  1.00           H  
ATOM    119  HG2 LYS A   8      -3.129  -6.133  -3.369  1.00  1.72           H  
ATOM    120  HG3 LYS A   8      -3.232  -4.385  -3.589  1.00  1.60           H  
ATOM    121  HD2 LYS A   8      -1.528  -4.555  -5.379  1.00  1.29           H  
ATOM    122  HD3 LYS A   8      -1.556  -6.310  -5.196  1.00  1.23           H  
ATOM    123  HE2 LYS A   8      -2.955  -5.569  -7.066  1.00  2.55           H  
ATOM    124  HE3 LYS A   8      -3.907  -6.360  -5.811  1.00  2.55           H  
ATOM    125  HZ1 LYS A   8      -4.647  -4.241  -5.024  1.00  2.92           H  
ATOM    126  HZ2 LYS A   8      -4.930  -4.307  -6.688  1.00  2.95           H  
ATOM    127  HZ3 LYS A   8      -3.624  -3.418  -6.087  1.00  2.82           H  
HETATM  128  N   AIB A   9      -1.677  -7.192  -0.538  1.00  0.21           N  
HETATM  129  CA  AIB A   9      -2.172  -8.478  -0.036  1.00  0.24           C  
HETATM  130  C   AIB A   9      -2.833  -8.277   1.333  1.00  0.26           C  
HETATM  131  O   AIB A   9      -3.795  -8.961   1.684  1.00  0.35           O  
HETATM  132  CB1 AIB A   9      -1.019  -9.448   0.101  1.00  0.23           C  
HETATM  133  CB2 AIB A   9      -3.154  -9.083  -1.022  1.00  0.32           C  
HETATM  134  H   AIB A   9      -0.717  -7.098  -0.728  1.00  0.18           H  
HETATM  135 HB11 AIB A   9      -0.319  -9.072   0.832  1.00  1.04           H  
HETATM  136 HB12 AIB A   9      -0.523  -9.555  -0.852  1.00  0.97           H  
HETATM  137 HB13 AIB A   9      -1.394 -10.408   0.424  1.00  1.10           H  
HETATM  138 HB21 AIB A   9      -3.533 -10.014  -0.631  1.00  1.03           H  
HETATM  139 HB22 AIB A   9      -2.654  -9.263  -1.963  1.00  1.10           H  
HETATM  140 HB23 AIB A   9      -3.974  -8.397  -1.178  1.00  0.99           H  
ATOM    141  N   ARG A  10      -2.295  -7.344   2.112  1.00  0.21           N  
ATOM    142  CA  ARG A  10      -2.839  -7.052   3.431  1.00  0.27           C  
ATOM    143  C   ARG A  10      -4.185  -6.337   3.331  1.00  0.33           C  
ATOM    144  O   ARG A  10      -5.158  -6.730   3.972  1.00  0.44           O  
ATOM    145  CB  ARG A  10      -1.873  -6.184   4.241  1.00  0.28           C  
ATOM    146  CG  ARG A  10      -2.389  -5.881   5.638  1.00  0.37           C  
ATOM    147  CD  ARG A  10      -1.747  -4.643   6.238  1.00  0.46           C  
ATOM    148  NE  ARG A  10      -0.320  -4.808   6.512  1.00  1.04           N  
ATOM    149  CZ  ARG A  10       0.307  -4.209   7.523  1.00  1.36           C  
ATOM    150  NH1 ARG A  10      -0.375  -3.443   8.365  1.00  1.26           N1+
ATOM    151  NH2 ARG A  10       1.611  -4.373   7.693  1.00  2.18           N  
ATOM    152  H   ARG A  10      -1.506  -6.844   1.793  1.00  0.16           H  
ATOM    153  HA  ARG A  10      -2.981  -7.990   3.944  1.00  0.33           H  
ATOM    154  HB2 ARG A  10      -0.926  -6.697   4.328  1.00  0.30           H  
ATOM    155  HB3 ARG A  10      -1.723  -5.247   3.722  1.00  0.27           H  
ATOM    156  HG2 ARG A  10      -3.455  -5.725   5.583  1.00  0.45           H  
ATOM    157  HG3 ARG A  10      -2.184  -6.729   6.277  1.00  0.42           H  
ATOM    158  HD2 ARG A  10      -1.872  -3.821   5.548  1.00  0.90           H  
ATOM    159  HD3 ARG A  10      -2.253  -4.409   7.162  1.00  1.00           H  
ATOM    160  HE  ARG A  10       0.201  -5.384   5.903  1.00  1.56           H  
ATOM    161 HH11 ARG A  10       0.095  -2.989   9.128  1.00  1.61           H  
ATOM    162 HH12 ARG A  10      -1.363  -3.312   8.244  1.00  1.29           H  
ATOM    163 HH21 ARG A  10       2.136  -4.951   7.060  1.00  2.69           H  
ATOM    164 HH22 ARG A  10       2.079  -3.926   8.458  1.00  2.46           H  
ATOM    165  N   TYR A  11      -4.234  -5.287   2.523  1.00  0.31           N  
ATOM    166  CA  TYR A  11      -5.395  -4.404   2.486  1.00  0.39           C  
ATOM    167  C   TYR A  11      -6.488  -4.917   1.549  1.00  0.58           C  
ATOM    168  O   TYR A  11      -7.595  -4.369   1.522  1.00  0.93           O  
ATOM    169  CB  TYR A  11      -4.959  -2.988   2.107  1.00  0.32           C  
ATOM    170  CG  TYR A  11      -4.138  -2.318   3.184  1.00  0.24           C  
ATOM    171  CD1 TYR A  11      -4.736  -1.795   4.322  1.00  0.27           C  
ATOM    172  CD2 TYR A  11      -2.761  -2.197   3.055  1.00  0.24           C  
ATOM    173  CE1 TYR A  11      -3.988  -1.170   5.299  1.00  0.31           C  
ATOM    174  CE2 TYR A  11      -2.005  -1.577   4.029  1.00  0.24           C  
ATOM    175  CZ  TYR A  11      -2.632  -1.108   5.185  1.00  0.27           C  
ATOM    176  OH  TYR A  11      -1.874  -0.436   6.119  1.00  0.38           O  
ATOM    177  H   TYR A  11      -3.468  -5.099   1.934  1.00  0.29           H  
ATOM    178  HA  TYR A  11      -5.801  -4.374   3.485  1.00  0.44           H  
ATOM    179  HB2 TYR A  11      -4.362  -3.026   1.207  1.00  0.34           H  
ATOM    180  HB3 TYR A  11      -5.832  -2.387   1.931  1.00  0.37           H  
ATOM    181  HD1 TYR A  11      -5.808  -1.880   4.438  1.00  0.33           H  
ATOM    182  HD2 TYR A  11      -2.281  -2.600   2.176  1.00  0.32           H  
ATOM    183  HE1 TYR A  11      -4.474  -0.771   6.173  1.00  0.41           H  
ATOM    184  HE2 TYR A  11      -0.936  -1.495   3.909  1.00  0.29           H  
ATOM    185  HH  TYR A  11      -1.179   0.086   5.698  1.00  0.93           H  
HETATM  186  N   AIB A  12      -6.165  -5.959   0.790  1.00  0.54           N  
HETATM  187  CA  AIB A  12      -7.145  -6.685  -0.029  1.00  0.73           C  
HETATM  188  C   AIB A  12      -7.856  -5.739  -1.009  1.00  0.64           C  
HETATM  189  O   AIB A  12      -7.279  -5.326  -2.016  1.00  1.44           O  
HETATM  190  CB1 AIB A  12      -8.150  -7.379   0.876  1.00  1.05           C  
HETATM  191  CB2 AIB A  12      -6.439  -7.766  -0.817  1.00  1.04           C  
HETATM  192  H   AIB A  12      -5.229  -6.249   0.765  1.00  0.64           H  
HETATM  193 HB11 AIB A  12      -7.639  -8.116   1.479  1.00  1.35           H  
HETATM  194 HB12 AIB A  12      -8.904  -7.864   0.277  1.00  1.34           H  
HETATM  195 HB13 AIB A  12      -8.613  -6.649   1.523  1.00  1.69           H  
HETATM  196 HB21 AIB A  12      -5.928  -8.433  -0.138  1.00  1.46           H  
HETATM  197 HB22 AIB A  12      -5.724  -7.312  -1.485  1.00  1.41           H  
HETATM  198 HB23 AIB A  12      -7.164  -8.322  -1.391  1.00  1.18           H  
ATOM    199  N   GLY A  13      -9.102  -5.400  -0.703  1.00  0.60           N  
ATOM    200  CA  GLY A  13      -9.910  -4.619  -1.617  1.00  0.84           C  
ATOM    201  C   GLY A  13      -9.631  -3.133  -1.541  1.00  0.80           C  
ATOM    202  O   GLY A  13     -10.134  -2.362  -2.361  1.00  1.24           O  
ATOM    203  H   GLY A  13      -9.475  -5.674   0.159  1.00  1.15           H  
ATOM    204  HA2 GLY A  13      -9.716  -4.957  -2.624  1.00  0.99           H  
ATOM    205  HA3 GLY A  13     -10.951  -4.789  -1.389  1.00  1.02           H  
ATOM    206  N   CYS A  14      -8.842  -2.719  -0.562  1.00  0.33           N  
ATOM    207  CA  CYS A  14      -8.505  -1.312  -0.418  1.00  0.29           C  
ATOM    208  C   CYS A  14      -7.279  -0.986  -1.256  1.00  0.34           C  
ATOM    209  O   CYS A  14      -6.337  -1.778  -1.331  1.00  0.62           O  
ATOM    210  CB  CYS A  14      -8.244  -0.964   1.045  1.00  0.25           C  
ATOM    211  SG  CYS A  14      -9.603  -1.404   2.178  1.00  0.39           S  
ATOM    212  H   CYS A  14      -8.464  -3.373   0.067  1.00  0.23           H  
ATOM    213  HA  CYS A  14      -9.340  -0.730  -0.778  1.00  0.35           H  
ATOM    214  HB2 CYS A  14      -7.364  -1.482   1.376  1.00  0.26           H  
ATOM    215  HB3 CYS A  14      -8.080   0.102   1.127  1.00  0.26           H  
ATOM    216  N   GLU A  15      -7.297   0.179  -1.884  1.00  0.27           N  
ATOM    217  CA  GLU A  15      -6.212   0.596  -2.755  1.00  0.27           C  
ATOM    218  C   GLU A  15      -5.053   1.123  -1.925  1.00  0.21           C  
ATOM    219  O   GLU A  15      -5.272   1.850  -0.958  1.00  0.33           O  
ATOM    220  CB  GLU A  15      -6.689   1.683  -3.718  1.00  0.31           C  
ATOM    221  CG  GLU A  15      -7.796   1.237  -4.653  1.00  0.37           C  
ATOM    222  CD  GLU A  15      -8.238   2.343  -5.582  1.00  0.84           C  
ATOM    223  OE1 GLU A  15      -9.162   3.097  -5.218  1.00  1.65           O  
ATOM    224  OE2 GLU A  15      -7.659   2.471  -6.680  1.00  0.80           O1-
ATOM    225  H   GLU A  15      -8.052   0.790  -1.734  1.00  0.38           H  
ATOM    226  HA  GLU A  15      -5.884  -0.263  -3.318  1.00  0.31           H  
ATOM    227  HB2 GLU A  15      -7.055   2.519  -3.141  1.00  0.31           H  
ATOM    228  HB3 GLU A  15      -5.852   2.009  -4.317  1.00  0.34           H  
ATOM    229  HG2 GLU A  15      -7.438   0.410  -5.248  1.00  0.85           H  
ATOM    230  HG3 GLU A  15      -8.643   0.918  -4.064  1.00  0.82           H  
HETATM  231  N   MVA A  16      -3.807   0.787  -2.288  1.00  0.25           N  
HETATM  232  CN  MVA A  16      -3.599  -0.019  -3.513  1.00  0.53           C  
HETATM  233  CA  MVA A  16      -2.653   1.251  -1.503  1.00  0.19           C  
HETATM  234  CB  MVA A  16      -2.187   0.199  -0.448  1.00  0.21           C  
HETATM  235  CG1 MVA A  16      -1.782  -1.127  -1.074  1.00  0.36           C  
HETATM  236  CG2 MVA A  16      -1.045   0.761   0.383  1.00  0.21           C  
HETATM  237  C   MVA A  16      -1.472   1.674  -2.384  1.00  0.24           C  
HETATM  238  O   MVA A  16      -0.779   0.857  -2.998  1.00  0.48           O  
HETATM  239  HN1 MVA A  16      -3.932  -1.030  -3.339  1.00  1.23           H  
HETATM  240  HN2 MVA A  16      -2.548  -0.024  -3.765  1.00  1.12           H  
HETATM  241  HN3 MVA A  16      -4.162   0.411  -4.328  1.00  1.12           H  
HETATM  242  HA  MVA A  16      -2.949   2.131  -0.947  1.00  0.20           H  
HETATM  243  HB  MVA A  16      -3.015   0.006   0.218  1.00  0.37           H  
HETATM  244 HG11 MVA A  16      -2.628  -1.553  -1.592  1.00  1.08           H  
HETATM  245 HG12 MVA A  16      -1.454  -1.802  -0.299  1.00  1.13           H  
HETATM  246 HG13 MVA A  16      -0.975  -0.960  -1.774  1.00  1.07           H  
HETATM  247 HG21 MVA A  16      -1.367   1.669   0.869  1.00  1.05           H  
HETATM  248 HG22 MVA A  16      -0.203   0.975  -0.260  1.00  1.05           H  
HETATM  249 HG23 MVA A  16      -0.752   0.037   1.129  1.00  0.94           H  
ATOM    250  N   ARG A  17      -1.261   2.977  -2.436  1.00  0.23           N  
ATOM    251  CA  ARG A  17      -0.157   3.550  -3.175  1.00  0.27           C  
ATOM    252  C   ARG A  17       1.092   3.551  -2.313  1.00  0.23           C  
ATOM    253  O   ARG A  17       1.161   4.260  -1.312  1.00  0.34           O  
ATOM    254  CB  ARG A  17      -0.489   4.980  -3.603  1.00  0.34           C  
ATOM    255  CG  ARG A  17       0.705   5.743  -4.154  1.00  1.33           C  
ATOM    256  CD  ARG A  17       0.372   7.209  -4.395  1.00  1.48           C  
ATOM    257  NE  ARG A  17      -0.604   7.390  -5.469  1.00  2.36           N  
ATOM    258  CZ  ARG A  17      -1.547   8.332  -5.470  1.00  3.00           C  
ATOM    259  NH1 ARG A  17      -1.703   9.125  -4.418  1.00  3.01           N1+
ATOM    260  NH2 ARG A  17      -2.351   8.469  -6.517  1.00  3.96           N  
ATOM    261  H   ARG A  17      -1.862   3.575  -1.940  1.00  0.34           H  
ATOM    262  HA  ARG A  17       0.016   2.945  -4.051  1.00  0.31           H  
ATOM    263  HB2 ARG A  17      -1.250   4.946  -4.367  1.00  1.08           H  
ATOM    264  HB3 ARG A  17      -0.870   5.518  -2.750  1.00  0.90           H  
ATOM    265  HG2 ARG A  17       1.514   5.679  -3.443  1.00  2.00           H  
ATOM    266  HG3 ARG A  17       1.007   5.290  -5.086  1.00  1.97           H  
ATOM    267  HD2 ARG A  17      -0.030   7.627  -3.486  1.00  1.68           H  
ATOM    268  HD3 ARG A  17       1.280   7.733  -4.657  1.00  1.71           H  
ATOM    269  HE  ARG A  17      -0.537   6.786  -6.246  1.00  2.76           H  
ATOM    270 HH11 ARG A  17      -2.412   9.833  -4.422  1.00  3.63           H  
ATOM    271 HH12 ARG A  17      -1.118   9.016  -3.601  1.00  2.64           H  
ATOM    272 HH21 ARG A  17      -2.253   7.865  -7.314  1.00  4.30           H  
ATOM    273 HH22 ARG A  17      -3.060   9.180  -6.519  1.00  4.48           H  
ATOM    274  N   CYS A  18       2.063   2.749  -2.687  1.00  0.27           N  
ATOM    275  CA  CYS A  18       3.327   2.726  -1.978  1.00  0.31           C  
ATOM    276  C   CYS A  18       4.187   3.903  -2.421  1.00  0.38           C  
ATOM    277  O   CYS A  18       4.473   4.066  -3.608  1.00  0.41           O  
ATOM    278  CB  CYS A  18       4.046   1.400  -2.216  1.00  0.37           C  
ATOM    279  SG  CYS A  18       4.180   0.935  -3.973  1.00  0.47           S  
ATOM    280  H   CYS A  18       1.931   2.157  -3.460  1.00  0.40           H  
ATOM    281  HA  CYS A  18       3.113   2.831  -0.923  1.00  0.33           H  
ATOM    282  HB2 CYS A  18       5.046   1.462  -1.816  1.00  0.45           H  
ATOM    283  HB3 CYS A  18       3.508   0.612  -1.708  1.00  0.37           H  
ATOM    284  N   ASP A  19       4.578   4.730  -1.466  1.00  0.50           N  
ATOM    285  CA  ASP A  19       5.352   5.926  -1.753  1.00  0.68           C  
ATOM    286  C   ASP A  19       6.627   5.926  -0.918  1.00  0.80           C  
ATOM    287  O   ASP A  19       6.678   6.524   0.160  1.00  0.84           O  
ATOM    288  CB  ASP A  19       4.519   7.179  -1.463  1.00  0.80           C  
ATOM    289  CG  ASP A  19       5.221   8.458  -1.872  1.00  1.11           C  
ATOM    290  OD1 ASP A  19       5.472   9.312  -0.999  1.00  1.76           O  
ATOM    291  OD2 ASP A  19       5.556   8.607  -3.066  1.00  1.10           O1-
ATOM    292  H   ASP A  19       4.355   4.522  -0.532  1.00  0.49           H  
ATOM    293  HA  ASP A  19       5.615   5.911  -2.800  1.00  0.74           H  
ATOM    294  HB2 ASP A  19       3.586   7.116  -2.001  1.00  1.05           H  
ATOM    295  HB3 ASP A  19       4.316   7.226  -0.403  1.00  1.05           H  
HETATM  296  N   DPR A  20       7.671   5.234  -1.403  1.00  0.95           N  
HETATM  297  CA  DPR A  20       8.925   5.070  -0.664  1.00  1.13           C  
HETATM  298  CB  DPR A  20       9.766   4.161  -1.559  1.00  1.31           C  
HETATM  299  CG  DPR A  20       9.186   4.318  -2.921  1.00  1.35           C  
HETATM  300  CD  DPR A  20       7.719   4.567  -2.715  1.00  1.02           C  
HETATM  301  C   DPR A  20       8.698   4.417   0.698  1.00  1.11           C  
HETATM  302  O   DPR A  20       8.217   3.284   0.781  1.00  1.10           O  
HETATM  303  HA  DPR A  20       9.436   6.008  -0.535  1.00  1.22           H  
HETATM  304  HB2 DPR A  20      10.797   4.477  -1.527  1.00  1.44           H  
HETATM  305  HB3 DPR A  20       9.686   3.141  -1.215  1.00  1.39           H  
HETATM  306  HG2 DPR A  20       9.642   5.160  -3.422  1.00  1.54           H  
HETATM  307  HG3 DPR A  20       9.336   3.413  -3.492  1.00  1.59           H  
HETATM  308  HD2 DPR A  20       7.335   5.211  -3.490  1.00  1.05           H  
HETATM  309  HD3 DPR A  20       7.176   3.634  -2.691  1.00  0.93           H  
ATOM    310  N   PRO A  21       9.040   5.125   1.781  1.00  1.18           N  
ATOM    311  CA  PRO A  21       8.856   4.627   3.143  1.00  1.23           C  
ATOM    312  C   PRO A  21       7.418   4.780   3.639  1.00  1.04           C  
ATOM    313  O   PRO A  21       7.073   4.314   4.724  1.00  1.12           O  
ATOM    314  CB  PRO A  21       9.793   5.518   3.950  1.00  1.43           C  
ATOM    315  CG  PRO A  21       9.786   6.815   3.221  1.00  1.40           C  
ATOM    316  CD  PRO A  21       9.658   6.465   1.762  1.00  1.30           C  
ATOM    317  HA  PRO A  21       9.163   3.597   3.237  1.00  1.35           H  
ATOM    318  HB2 PRO A  21       9.416   5.625   4.957  1.00  1.46           H  
ATOM    319  HB3 PRO A  21      10.779   5.084   3.971  1.00  1.61           H  
ATOM    320  HG2 PRO A  21       8.945   7.409   3.541  1.00  1.32           H  
ATOM    321  HG3 PRO A  21      10.710   7.344   3.400  1.00  1.59           H  
ATOM    322  HD2 PRO A  21       9.023   7.175   1.258  1.00  1.23           H  
ATOM    323  HD3 PRO A  21      10.632   6.432   1.297  1.00  1.47           H  
ATOM    324  N   ARG A  22       6.584   5.435   2.843  1.00  0.84           N  
ATOM    325  CA  ARG A  22       5.205   5.692   3.228  1.00  0.70           C  
ATOM    326  C   ARG A  22       4.255   4.986   2.273  1.00  0.52           C  
ATOM    327  O   ARG A  22       4.688   4.388   1.289  1.00  0.54           O  
ATOM    328  CB  ARG A  22       4.923   7.197   3.218  1.00  0.82           C  
ATOM    329  CG  ARG A  22       5.885   8.013   4.068  1.00  1.37           C  
ATOM    330  CD  ARG A  22       5.822   7.621   5.539  1.00  1.91           C  
ATOM    331  NE  ARG A  22       4.515   7.905   6.135  1.00  2.59           N  
ATOM    332  CZ  ARG A  22       4.312   8.066   7.442  1.00  3.29           C  
ATOM    333  NH1 ARG A  22       5.327   7.962   8.293  1.00  3.45           N1+
ATOM    334  NH2 ARG A  22       3.093   8.332   7.894  1.00  4.24           N  
ATOM    335  H   ARG A  22       6.900   5.743   1.961  1.00  0.84           H  
ATOM    336  HA  ARG A  22       5.053   5.305   4.225  1.00  0.71           H  
ATOM    337  HB2 ARG A  22       4.988   7.553   2.200  1.00  1.26           H  
ATOM    338  HB3 ARG A  22       3.922   7.366   3.584  1.00  0.94           H  
ATOM    339  HG2 ARG A  22       6.889   7.851   3.708  1.00  1.75           H  
ATOM    340  HG3 ARG A  22       5.634   9.060   3.972  1.00  1.90           H  
ATOM    341  HD2 ARG A  22       6.022   6.564   5.626  1.00  1.99           H  
ATOM    342  HD3 ARG A  22       6.578   8.174   6.076  1.00  2.56           H  
ATOM    343  HE  ARG A  22       3.747   7.981   5.524  1.00  2.93           H  
ATOM    344 HH11 ARG A  22       6.252   7.762   7.956  1.00  3.20           H  
ATOM    345 HH12 ARG A  22       5.173   8.075   9.279  1.00  4.13           H  
ATOM    346 HH21 ARG A  22       2.934   8.455   8.878  1.00  4.82           H  
ATOM    347 HH22 ARG A  22       2.324   8.411   7.256  1.00  4.54           H  
ATOM    348  N   TYR A  23       2.970   5.045   2.571  1.00  0.40           N  
ATOM    349  CA  TYR A  23       1.958   4.500   1.685  1.00  0.29           C  
ATOM    350  C   TYR A  23       0.607   5.133   1.967  1.00  0.24           C  
ATOM    351  O   TYR A  23       0.339   5.588   3.080  1.00  0.30           O  
ATOM    352  CB  TYR A  23       1.869   2.977   1.818  1.00  0.28           C  
ATOM    353  CG  TYR A  23       1.458   2.487   3.187  1.00  0.27           C  
ATOM    354  CD1 TYR A  23       0.122   2.280   3.500  1.00  0.26           C  
ATOM    355  CD2 TYR A  23       2.407   2.246   4.171  1.00  0.33           C  
ATOM    356  CE1 TYR A  23      -0.257   1.848   4.755  1.00  0.29           C  
ATOM    357  CE2 TYR A  23       2.037   1.811   5.425  1.00  0.37           C  
ATOM    358  CZ  TYR A  23       0.697   1.557   5.692  1.00  0.35           C  
ATOM    359  OH  TYR A  23       0.335   1.187   6.968  1.00  0.42           O  
ATOM    360  H   TYR A  23       2.689   5.460   3.414  1.00  0.41           H  
ATOM    361  HA  TYR A  23       2.244   4.743   0.674  1.00  0.32           H  
ATOM    362  HB2 TYR A  23       1.147   2.608   1.109  1.00  0.28           H  
ATOM    363  HB3 TYR A  23       2.834   2.552   1.591  1.00  0.34           H  
ATOM    364  HD1 TYR A  23      -0.628   2.463   2.745  1.00  0.26           H  
ATOM    365  HD2 TYR A  23       3.451   2.399   3.942  1.00  0.36           H  
ATOM    366  HE1 TYR A  23      -1.302   1.693   4.979  1.00  0.29           H  
ATOM    367  HE2 TYR A  23       2.791   1.629   6.176  1.00  0.44           H  
ATOM    368  HH  TYR A  23       0.878   1.643   7.630  1.00  0.90           H  
ATOM    369  N   GLU A  24      -0.233   5.164   0.953  1.00  0.20           N  
ATOM    370  CA  GLU A  24      -1.564   5.721   1.078  1.00  0.21           C  
ATOM    371  C   GLU A  24      -2.601   4.639   0.808  1.00  0.19           C  
ATOM    372  O   GLU A  24      -2.559   3.990  -0.232  1.00  0.32           O  
ATOM    373  CB  GLU A  24      -1.747   6.884   0.103  1.00  0.32           C  
ATOM    374  CG  GLU A  24      -0.685   7.964   0.238  1.00  0.49           C  
ATOM    375  CD  GLU A  24      -0.968   9.176  -0.623  1.00  1.22           C  
ATOM    376  OE1 GLU A  24      -1.290  10.248  -0.069  1.00  1.64           O  
ATOM    377  OE2 GLU A  24      -0.875   9.059  -1.865  1.00  1.99           O1-
ATOM    378  H   GLU A  24       0.051   4.793   0.088  1.00  0.21           H  
ATOM    379  HA  GLU A  24      -1.682   6.080   2.087  1.00  0.27           H  
ATOM    380  HB2 GLU A  24      -1.716   6.500  -0.905  1.00  0.32           H  
ATOM    381  HB3 GLU A  24      -2.712   7.334   0.277  1.00  0.43           H  
ATOM    382  HG2 GLU A  24      -0.641   8.278   1.270  1.00  0.85           H  
ATOM    383  HG3 GLU A  24       0.269   7.549  -0.052  1.00  0.91           H  
HETATM  384  N   MVA A  25      -3.554   4.430   1.726  1.00  0.17           N  
HETATM  385  CN  MVA A  25      -3.649   5.348   2.885  1.00  0.28           C  
HETATM  386  CA  MVA A  25      -4.527   3.331   1.544  1.00  0.18           C  
HETATM  387  CB  MVA A  25      -4.239   2.101   2.461  1.00  0.28           C  
HETATM  388  CG1 MVA A  25      -4.281   2.443   3.944  1.00  0.51           C  
HETATM  389  CG2 MVA A  25      -5.220   0.978   2.157  1.00  0.76           C  
HETATM  390  C   MVA A  25      -5.975   3.793   1.722  1.00  0.25           C  
HETATM  391  O   MVA A  25      -6.373   4.312   2.765  1.00  0.47           O  
HETATM  392  HN1 MVA A  25      -4.571   5.163   3.414  1.00  1.20           H  
HETATM  393  HN2 MVA A  25      -3.633   6.371   2.536  1.00  0.93           H  
HETATM  394  HN3 MVA A  25      -2.815   5.179   3.550  1.00  1.04           H  
HETATM  395  HA  MVA A  25      -4.446   2.974   0.526  1.00  0.17           H  
HETATM  396  HB  MVA A  25      -3.247   1.740   2.235  1.00  0.69           H  
HETATM  397 HG11 MVA A  25      -5.235   2.887   4.183  1.00  1.16           H  
HETATM  398 HG12 MVA A  25      -3.488   3.140   4.172  1.00  1.12           H  
HETATM  399 HG13 MVA A  25      -4.146   1.542   4.523  1.00  1.28           H  
HETATM  400 HG21 MVA A  25      -5.105   0.666   1.130  1.00  1.28           H  
HETATM  401 HG22 MVA A  25      -6.229   1.329   2.315  1.00  1.27           H  
HETATM  402 HG23 MVA A  25      -5.024   0.140   2.811  1.00  1.43           H  
ATOM    403  N   HIS A  26      -6.761   3.598   0.675  1.00  0.17           N  
ATOM    404  CA  HIS A  26      -8.140   4.053   0.654  1.00  0.24           C  
ATOM    405  C   HIS A  26      -9.073   2.897   0.326  1.00  0.32           C  
ATOM    406  O   HIS A  26      -8.854   2.166  -0.641  1.00  0.43           O  
ATOM    407  CB  HIS A  26      -8.319   5.173  -0.372  1.00  0.32           C  
ATOM    408  CG  HIS A  26      -7.471   6.381  -0.103  1.00  0.44           C  
ATOM    409  ND1 HIS A  26      -7.937   7.501   0.547  1.00  0.57           N  
ATOM    410  CD2 HIS A  26      -6.174   6.632  -0.395  1.00  0.55           C  
ATOM    411  CE1 HIS A  26      -6.965   8.388   0.644  1.00  0.72           C  
ATOM    412  NE2 HIS A  26      -5.885   7.885   0.080  1.00  0.70           N  
ATOM    413  H   HIS A  26      -6.406   3.112  -0.106  1.00  0.22           H  
ATOM    414  HA  HIS A  26      -8.381   4.430   1.634  1.00  0.30           H  
ATOM    415  HB2 HIS A  26      -8.062   4.798  -1.350  1.00  0.33           H  
ATOM    416  HB3 HIS A  26      -9.351   5.486  -0.373  1.00  0.40           H  
ATOM    417  HD1 HIS A  26      -8.853   7.631   0.885  1.00  0.61           H  
ATOM    418  HD2 HIS A  26      -5.491   5.966  -0.904  1.00  0.59           H  
ATOM    419  HE1 HIS A  26      -7.041   9.359   1.110  1.00  0.87           H  
ATOM    420  HE2 HIS A  26      -5.057   8.386  -0.101  1.00  0.83           H  
ATOM    421  N   CYS A  27     -10.102   2.729   1.135  1.00  0.38           N  
ATOM    422  CA  CYS A  27     -11.062   1.657   0.938  1.00  0.50           C  
ATOM    423  C   CYS A  27     -12.320   2.176   0.254  1.00  0.74           C  
ATOM    424  O   CYS A  27     -13.392   2.237   0.854  1.00  1.38           O  
ATOM    425  CB  CYS A  27     -11.419   1.024   2.282  1.00  0.59           C  
ATOM    426  SG  CYS A  27      -9.991   0.324   3.168  1.00  0.75           S  
ATOM    427  H   CYS A  27     -10.219   3.341   1.893  1.00  0.41           H  
ATOM    428  HA  CYS A  27     -10.603   0.909   0.310  1.00  0.47           H  
ATOM    429  HB2 CYS A  27     -11.866   1.774   2.916  1.00  0.95           H  
ATOM    430  HB3 CYS A  27     -12.129   0.229   2.117  1.00  0.83           H  
HETATM  431  N   NH2 A  28     -12.192   2.535  -1.009  1.00  0.99           N  
HETATM  432  HN1 NH2 A  28     -11.306   2.462  -1.426  1.00  1.44           H  
HETATM  433  HN2 NH2 A  28     -12.985   2.862  -1.478  1.00  1.11           H  
TER     434      NH2 A  28                                                      
ENDMDL                                                                          
MODEL        6                                                                  
ATOM      1  N   ASN A   1       8.161 -10.963  -4.399  1.00  1.83           N  
ATOM      2  CA  ASN A   1       7.817 -10.310  -3.115  1.00  1.49           C  
ATOM      3  C   ASN A   1       8.208  -8.843  -3.157  1.00  1.11           C  
ATOM      4  O   ASN A   1       9.258  -8.492  -3.697  1.00  1.38           O  
ATOM      5  CB  ASN A   1       8.534 -11.003  -1.950  1.00  1.76           C  
ATOM      6  CG  ASN A   1       8.080 -12.435  -1.759  1.00  2.41           C  
ATOM      7  OD1 ASN A   1       8.590 -13.348  -2.405  1.00  3.13           O  
ATOM      8  ND2 ASN A   1       7.129 -12.644  -0.863  1.00  2.72           N  
ATOM      9  H1  ASN A   1       9.183 -10.883  -4.576  1.00  1.62           H  
ATOM     10  H2  ASN A   1       7.650 -10.506  -5.180  1.00  2.41           H  
ATOM     11  H3  ASN A   1       7.902 -11.969  -4.371  1.00  2.27           H  
ATOM     12  HA  ASN A   1       6.748 -10.386  -2.975  1.00  1.51           H  
ATOM     13  HB2 ASN A   1       9.597 -11.006  -2.140  1.00  2.07           H  
ATOM     14  HB3 ASN A   1       8.339 -10.458  -1.037  1.00  1.95           H  
ATOM     15 HD21 ASN A   1       6.774 -11.870  -0.374  1.00  2.63           H  
ATOM     16 HD22 ASN A   1       6.821 -13.565  -0.720  1.00  3.34           H  
ATOM     17  N   ASP A   2       7.367  -7.986  -2.593  1.00  0.74           N  
ATOM     18  CA  ASP A   2       7.620  -6.551  -2.599  1.00  0.50           C  
ATOM     19  C   ASP A   2       6.796  -5.869  -1.518  1.00  0.36           C  
ATOM     20  O   ASP A   2       5.705  -6.334  -1.191  1.00  0.33           O  
ATOM     21  CB  ASP A   2       7.277  -5.955  -3.968  1.00  0.73           C  
ATOM     22  CG  ASP A   2       7.583  -4.474  -4.052  1.00  1.34           C  
ATOM     23  OD1 ASP A   2       6.655  -3.658  -3.868  1.00  2.21           O  
ATOM     24  OD2 ASP A   2       8.750  -4.117  -4.293  1.00  1.35           O1-
ATOM     25  H   ASP A   2       6.556  -8.323  -2.150  1.00  0.90           H  
ATOM     26  HA  ASP A   2       8.666  -6.393  -2.395  1.00  0.62           H  
ATOM     27  HB2 ASP A   2       7.847  -6.464  -4.729  1.00  1.22           H  
ATOM     28  HB3 ASP A   2       6.224  -6.096  -4.160  1.00  1.02           H  
HETATM   29  N   AIB A   3       7.327  -4.776  -0.972  1.00  0.36           N  
HETATM   30  CA  AIB A   3       6.649  -4.005   0.076  1.00  0.37           C  
HETATM   31  C   AIB A   3       5.235  -3.633  -0.391  1.00  0.33           C  
HETATM   32  O   AIB A   3       4.248  -3.850   0.321  1.00  0.30           O  
HETATM   33  CB1 AIB A   3       7.436  -2.740   0.363  1.00  0.49           C  
HETATM   34  CB2 AIB A   3       6.591  -4.806   1.364  1.00  0.41           C  
HETATM   35  H   AIB A   3       8.205  -4.473  -1.285  1.00  0.41           H  
HETATM   36 HB11 AIB A   3       8.433  -3.002   0.686  1.00  1.25           H  
HETATM   37 HB12 AIB A   3       6.943  -2.176   1.139  1.00  0.95           H  
HETATM   38 HB13 AIB A   3       7.495  -2.142  -0.534  1.00  1.20           H  
HETATM   39 HB21 AIB A   3       6.066  -5.733   1.187  1.00  1.26           H  
HETATM   40 HB22 AIB A   3       6.069  -4.236   2.119  1.00  1.09           H  
HETATM   41 HB23 AIB A   3       7.594  -5.018   1.701  1.00  0.94           H  
ATOM     42  N   CYS A   4       5.148  -3.104  -1.606  1.00  0.37           N  
ATOM     43  CA  CYS A   4       3.885  -2.633  -2.150  1.00  0.40           C  
ATOM     44  C   CYS A   4       2.909  -3.790  -2.316  1.00  0.32           C  
ATOM     45  O   CYS A   4       1.723  -3.668  -2.005  1.00  0.33           O  
ATOM     46  CB  CYS A   4       4.112  -1.946  -3.497  1.00  0.49           C  
ATOM     47  SG  CYS A   4       5.429  -0.685  -3.485  1.00  1.18           S  
ATOM     48  H   CYS A   4       5.958  -3.044  -2.165  1.00  0.41           H  
ATOM     49  HA  CYS A   4       3.468  -1.920  -1.457  1.00  0.43           H  
ATOM     50  HB2 CYS A   4       4.378  -2.689  -4.232  1.00  1.21           H  
ATOM     51  HB3 CYS A   4       3.198  -1.462  -3.801  1.00  1.05           H  
ATOM     52  N   LYS A   5       3.423  -4.921  -2.781  1.00  0.30           N  
ATOM     53  CA  LYS A   5       2.594  -6.093  -3.020  1.00  0.31           C  
ATOM     54  C   LYS A   5       2.071  -6.650  -1.701  1.00  0.20           C  
ATOM     55  O   LYS A   5       0.900  -7.031  -1.600  1.00  0.20           O  
ATOM     56  CB  LYS A   5       3.384  -7.165  -3.780  1.00  0.39           C  
ATOM     57  CG  LYS A   5       2.543  -8.359  -4.211  1.00  0.80           C  
ATOM     58  CD  LYS A   5       1.436  -7.948  -5.171  1.00  1.37           C  
ATOM     59  CE  LYS A   5       0.625  -9.148  -5.631  1.00  2.05           C  
ATOM     60  NZ  LYS A   5      -0.480  -8.754  -6.545  1.00  2.62           N1+
ATOM     61  H   LYS A   5       4.388  -4.969  -2.960  1.00  0.32           H  
ATOM     62  HA  LYS A   5       1.755  -5.782  -3.621  1.00  0.38           H  
ATOM     63  HB2 LYS A   5       3.815  -6.717  -4.663  1.00  0.76           H  
ATOM     64  HB3 LYS A   5       4.181  -7.522  -3.145  1.00  0.63           H  
ATOM     65  HG2 LYS A   5       3.181  -9.078  -4.703  1.00  1.40           H  
ATOM     66  HG3 LYS A   5       2.099  -8.809  -3.336  1.00  1.26           H  
ATOM     67  HD2 LYS A   5       0.777  -7.255  -4.669  1.00  1.80           H  
ATOM     68  HD3 LYS A   5       1.878  -7.470  -6.031  1.00  1.90           H  
ATOM     69  HE2 LYS A   5       1.281  -9.833  -6.149  1.00  2.44           H  
ATOM     70  HE3 LYS A   5       0.207  -9.637  -4.764  1.00  2.54           H  
ATOM     71  HZ1 LYS A   5      -1.167  -8.157  -6.040  1.00  2.86           H  
ATOM     72  HZ2 LYS A   5      -0.970  -9.598  -6.898  1.00  2.84           H  
ATOM     73  HZ3 LYS A   5      -0.106  -8.221  -7.355  1.00  3.23           H  
HETATM   74  N   AIB A   6       2.944  -6.672  -0.694  1.00  0.16           N  
HETATM   75  CA  AIB A   6       2.588  -7.134   0.649  1.00  0.16           C  
HETATM   76  C   AIB A   6       1.448  -6.268   1.182  1.00  0.12           C  
HETATM   77  O   AIB A   6       0.476  -6.777   1.738  1.00  0.16           O  
HETATM   78  CB1 AIB A   6       3.787  -7.022   1.568  1.00  0.22           C  
HETATM   79  CB2 AIB A   6       2.176  -8.593   0.611  1.00  0.25           C  
HETATM   80  H   AIB A   6       3.862  -6.365  -0.860  1.00  0.18           H  
HETATM   81 HB11 AIB A   6       4.605  -7.602   1.168  1.00  1.10           H  
HETATM   82 HB12 AIB A   6       3.526  -7.395   2.548  1.00  1.03           H  
HETATM   83 HB13 AIB A   6       4.084  -5.987   1.647  1.00  0.90           H  
HETATM   84 HB21 AIB A   6       3.006  -9.193   0.275  1.00  1.08           H  
HETATM   85 HB22 AIB A   6       1.347  -8.713  -0.072  1.00  1.03           H  
HETATM   86 HB23 AIB A   6       1.877  -8.909   1.598  1.00  1.03           H  
ATOM     87  N   LEU A   7       1.568  -4.956   0.988  1.00  0.12           N  
ATOM     88  CA  LEU A   7       0.543  -4.023   1.433  1.00  0.16           C  
ATOM     89  C   LEU A   7      -0.772  -4.286   0.711  1.00  0.17           C  
ATOM     90  O   LEU A   7      -1.836  -4.310   1.329  1.00  0.21           O  
ATOM     91  CB  LEU A   7       0.985  -2.578   1.196  1.00  0.23           C  
ATOM     92  CG  LEU A   7       2.257  -2.147   1.931  1.00  0.28           C  
ATOM     93  CD1 LEU A   7       2.635  -0.728   1.546  1.00  0.38           C  
ATOM     94  CD2 LEU A   7       2.070  -2.249   3.436  1.00  0.35           C  
ATOM     95  H   LEU A   7       2.371  -4.608   0.532  1.00  0.15           H  
ATOM     96  HA  LEU A   7       0.394  -4.177   2.489  1.00  0.19           H  
ATOM     97  HB2 LEU A   7       1.145  -2.446   0.137  1.00  0.25           H  
ATOM     98  HB3 LEU A   7       0.181  -1.926   1.503  1.00  0.28           H  
ATOM     99  HG  LEU A   7       3.070  -2.801   1.645  1.00  0.24           H  
ATOM    100 HD11 LEU A   7       1.835  -0.058   1.823  1.00  1.02           H  
ATOM    101 HD12 LEU A   7       2.796  -0.674   0.479  1.00  0.98           H  
ATOM    102 HD13 LEU A   7       3.539  -0.444   2.062  1.00  1.03           H  
ATOM    103 HD21 LEU A   7       1.867  -3.274   3.708  1.00  1.14           H  
ATOM    104 HD22 LEU A   7       1.241  -1.626   3.736  1.00  0.90           H  
ATOM    105 HD23 LEU A   7       2.968  -1.915   3.934  1.00  1.09           H  
ATOM    106  N   LYS A   8      -0.689  -4.502  -0.598  1.00  0.19           N  
ATOM    107  CA  LYS A   8      -1.874  -4.781  -1.401  1.00  0.27           C  
ATOM    108  C   LYS A   8      -2.608  -5.997  -0.854  1.00  0.25           C  
ATOM    109  O   LYS A   8      -3.810  -5.938  -0.584  1.00  0.31           O  
ATOM    110  CB  LYS A   8      -1.500  -5.016  -2.868  1.00  0.35           C  
ATOM    111  CG  LYS A   8      -0.903  -3.802  -3.562  1.00  1.12           C  
ATOM    112  CD  LYS A   8      -0.466  -4.132  -4.979  1.00  1.10           C  
ATOM    113  CE  LYS A   8       0.285  -2.975  -5.620  1.00  2.05           C  
ATOM    114  NZ  LYS A   8      -0.574  -1.773  -5.790  1.00  2.55           N1+
ATOM    115  H   LYS A   8       0.194  -4.476  -1.031  1.00  0.20           H  
ATOM    116  HA  LYS A   8      -2.527  -3.925  -1.334  1.00  0.31           H  
ATOM    117  HB2 LYS A   8      -0.780  -5.820  -2.917  1.00  0.78           H  
ATOM    118  HB3 LYS A   8      -2.389  -5.311  -3.407  1.00  1.00           H  
ATOM    119  HG2 LYS A   8      -1.646  -3.018  -3.599  1.00  1.72           H  
ATOM    120  HG3 LYS A   8      -0.046  -3.460  -3.001  1.00  1.60           H  
ATOM    121  HD2 LYS A   8       0.179  -4.997  -4.956  1.00  1.29           H  
ATOM    122  HD3 LYS A   8      -1.343  -4.350  -5.570  1.00  1.23           H  
ATOM    123  HE2 LYS A   8       1.126  -2.717  -4.994  1.00  2.55           H  
ATOM    124  HE3 LYS A   8       0.644  -3.290  -6.590  1.00  2.55           H  
ATOM    125  HZ1 LYS A   8      -1.347  -1.977  -6.455  1.00  2.92           H  
ATOM    126  HZ2 LYS A   8      -0.013  -0.980  -6.164  1.00  2.95           H  
ATOM    127  HZ3 LYS A   8      -0.982  -1.489  -4.879  1.00  2.82           H  
HETATM  128  N   AIB A   9      -1.859  -7.082  -0.666  1.00  0.21           N  
HETATM  129  CA  AIB A   9      -2.405  -8.337  -0.140  1.00  0.24           C  
HETATM  130  C   AIB A   9      -2.968  -8.103   1.269  1.00  0.26           C  
HETATM  131  O   AIB A   9      -4.007  -8.650   1.638  1.00  0.35           O  
HETATM  132  CB1 AIB A   9      -1.306  -9.378  -0.077  1.00  0.23           C  
HETATM  133  CB2 AIB A   9      -3.479  -8.875  -1.065  1.00  0.32           C  
HETATM  134  H   AIB A   9      -0.901  -7.039  -0.887  1.00  0.18           H  
HETATM  135 HB11 AIB A   9      -0.543  -9.053   0.613  1.00  1.04           H  
HETATM  136 HB12 AIB A   9      -0.875  -9.505  -1.059  1.00  0.97           H  
HETATM  137 HB13 AIB A   9      -1.719 -10.317   0.260  1.00  1.10           H  
HETATM  138 HB21 AIB A   9      -3.049  -9.082  -2.033  1.00  1.03           H  
HETATM  139 HB22 AIB A   9      -4.264  -8.141  -1.169  1.00  1.10           H  
HETATM  140 HB23 AIB A   9      -3.888  -9.784  -0.652  1.00  0.99           H  
ATOM    141  N   ARG A  10      -2.270  -7.276   2.036  1.00  0.21           N  
ATOM    142  CA  ARG A  10      -2.620  -7.014   3.425  1.00  0.27           C  
ATOM    143  C   ARG A  10      -3.952  -6.279   3.545  1.00  0.33           C  
ATOM    144  O   ARG A  10      -4.765  -6.585   4.419  1.00  0.44           O  
ATOM    145  CB  ARG A  10      -1.514  -6.190   4.086  1.00  0.28           C  
ATOM    146  CG  ARG A  10      -1.743  -5.917   5.560  1.00  0.37           C  
ATOM    147  CD  ARG A  10      -0.619  -5.077   6.148  1.00  0.46           C  
ATOM    148  NE  ARG A  10       0.689  -5.721   6.005  1.00  1.04           N  
ATOM    149  CZ  ARG A  10       1.848  -5.130   6.291  1.00  1.36           C  
ATOM    150  NH1 ARG A  10       1.868  -3.900   6.794  1.00  1.26           N1+
ATOM    151  NH2 ARG A  10       2.985  -5.780   6.094  1.00  2.18           N  
ATOM    152  H   ARG A  10      -1.481  -6.827   1.656  1.00  0.16           H  
ATOM    153  HA  ARG A  10      -2.700  -7.962   3.931  1.00  0.33           H  
ATOM    154  HB2 ARG A  10      -0.579  -6.720   3.982  1.00  0.30           H  
ATOM    155  HB3 ARG A  10      -1.436  -5.240   3.575  1.00  0.27           H  
ATOM    156  HG2 ARG A  10      -2.676  -5.384   5.673  1.00  0.45           H  
ATOM    157  HG3 ARG A  10      -1.795  -6.857   6.089  1.00  0.42           H  
ATOM    158  HD2 ARG A  10      -0.596  -4.123   5.639  1.00  0.90           H  
ATOM    159  HD3 ARG A  10      -0.819  -4.916   7.197  1.00  1.00           H  
ATOM    160  HE  ARG A  10       0.705  -6.646   5.667  1.00  1.56           H  
ATOM    161 HH11 ARG A  10       2.745  -3.457   7.006  1.00  1.61           H  
ATOM    162 HH12 ARG A  10       1.011  -3.415   6.979  1.00  1.29           H  
ATOM    163 HH21 ARG A  10       2.973  -6.716   5.732  1.00  2.69           H  
ATOM    164 HH22 ARG A  10       3.862  -5.341   6.309  1.00  2.46           H  
ATOM    165  N   TYR A  11      -4.177  -5.314   2.667  1.00  0.31           N  
ATOM    166  CA  TYR A  11      -5.369  -4.484   2.750  1.00  0.39           C  
ATOM    167  C   TYR A  11      -6.531  -5.057   1.940  1.00  0.58           C  
ATOM    168  O   TYR A  11      -7.578  -4.418   1.824  1.00  0.93           O  
ATOM    169  CB  TYR A  11      -5.043  -3.053   2.331  1.00  0.32           C  
ATOM    170  CG  TYR A  11      -4.177  -2.345   3.345  1.00  0.24           C  
ATOM    171  CD1 TYR A  11      -4.718  -1.785   4.492  1.00  0.27           C  
ATOM    172  CD2 TYR A  11      -2.811  -2.217   3.135  1.00  0.24           C  
ATOM    173  CE1 TYR A  11      -3.925  -1.118   5.402  1.00  0.31           C  
ATOM    174  CE2 TYR A  11      -2.010  -1.557   4.042  1.00  0.24           C  
ATOM    175  CZ  TYR A  11      -2.597  -1.081   5.247  1.00  0.27           C  
ATOM    176  OH  TYR A  11      -1.775  -0.331   6.071  1.00  0.38           O  
ATOM    177  H   TYR A  11      -3.518  -5.147   1.953  1.00  0.29           H  
ATOM    178  HA  TYR A  11      -5.668  -4.468   3.787  1.00  0.44           H  
ATOM    179  HB2 TYR A  11      -4.518  -3.062   1.387  1.00  0.34           H  
ATOM    180  HB3 TYR A  11      -5.959  -2.497   2.231  1.00  0.37           H  
ATOM    181  HD1 TYR A  11      -5.782  -1.875   4.670  1.00  0.33           H  
ATOM    182  HD2 TYR A  11      -2.375  -2.647   2.248  1.00  0.32           H  
ATOM    183  HE1 TYR A  11      -4.366  -0.689   6.289  1.00  0.41           H  
ATOM    184  HE2 TYR A  11      -0.950  -1.469   3.861  1.00  0.29           H  
ATOM    185  HH  TYR A  11      -1.255   0.333   5.594  1.00  0.93           H  
HETATM  186  N   AIB A  12      -6.305  -6.259   1.392  1.00  0.54           N  
HETATM  187  CA  AIB A  12      -7.346  -7.119   0.777  1.00  0.73           C  
HETATM  188  C   AIB A  12      -8.567  -6.332   0.278  1.00  0.64           C  
HETATM  189  O   AIB A  12      -9.646  -6.418   0.864  1.00  1.44           O  
HETATM  190  CB1 AIB A  12      -7.799  -8.138   1.802  1.00  1.05           C  
HETATM  191  CB2 AIB A  12      -6.747  -7.902  -0.373  1.00  1.04           C  
HETATM  192  H   AIB A  12      -5.384  -6.595   1.402  1.00  0.64           H  
HETATM  193 HB11 AIB A  12      -6.945  -8.690   2.166  1.00  1.35           H  
HETATM  194 HB12 AIB A  12      -8.501  -8.821   1.345  1.00  1.34           H  
HETATM  195 HB13 AIB A  12      -8.276  -7.629   2.627  1.00  1.69           H  
HETATM  196 HB21 AIB A  12      -7.508  -8.527  -0.817  1.00  1.46           H  
HETATM  197 HB22 AIB A  12      -5.943  -8.522  -0.007  1.00  1.41           H  
HETATM  198 HB23 AIB A  12      -6.365  -7.220  -1.116  1.00  1.18           H  
ATOM    199  N   GLY A  13      -8.402  -5.568  -0.792  1.00  0.60           N  
ATOM    200  CA  GLY A  13      -9.538  -4.879  -1.369  1.00  0.84           C  
ATOM    201  C   GLY A  13      -9.364  -3.378  -1.405  1.00  0.80           C  
ATOM    202  O   GLY A  13      -9.896  -2.707  -2.293  1.00  1.24           O  
ATOM    203  H   GLY A  13      -7.511  -5.467  -1.190  1.00  1.15           H  
ATOM    204  HA2 GLY A  13      -9.683  -5.235  -2.376  1.00  0.99           H  
ATOM    205  HA3 GLY A  13     -10.415  -5.114  -0.788  1.00  1.02           H  
ATOM    206  N   CYS A  14      -8.629  -2.841  -0.449  1.00  0.33           N  
ATOM    207  CA  CYS A  14      -8.384  -1.409  -0.410  1.00  0.29           C  
ATOM    208  C   CYS A  14      -7.289  -1.049  -1.404  1.00  0.34           C  
ATOM    209  O   CYS A  14      -6.450  -1.887  -1.746  1.00  0.62           O  
ATOM    210  CB  CYS A  14      -7.969  -0.970   0.992  1.00  0.25           C  
ATOM    211  SG  CYS A  14      -9.038  -1.600   2.328  1.00  0.39           S  
ATOM    212  H   CYS A  14      -8.241  -3.417   0.249  1.00  0.23           H  
ATOM    213  HA  CYS A  14      -9.295  -0.902  -0.689  1.00  0.35           H  
ATOM    214  HB2 CYS A  14      -6.970  -1.313   1.182  1.00  0.26           H  
ATOM    215  HB3 CYS A  14      -7.985   0.110   1.040  1.00  0.26           H  
ATOM    216  N   GLU A  15      -7.310   0.183  -1.878  1.00  0.27           N  
ATOM    217  CA  GLU A  15      -6.299   0.650  -2.808  1.00  0.27           C  
ATOM    218  C   GLU A  15      -5.118   1.225  -2.039  1.00  0.21           C  
ATOM    219  O   GLU A  15      -5.304   2.074  -1.169  1.00  0.33           O  
ATOM    220  CB  GLU A  15      -6.873   1.707  -3.755  1.00  0.31           C  
ATOM    221  CG  GLU A  15      -7.936   1.173  -4.699  1.00  0.37           C  
ATOM    222  CD  GLU A  15      -8.343   2.189  -5.745  1.00  0.84           C  
ATOM    223  OE1 GLU A  15      -9.403   2.831  -5.574  1.00  1.65           O  
ATOM    224  OE2 GLU A  15      -7.607   2.354  -6.738  1.00  0.80           O1-
ATOM    225  H   GLU A  15      -8.013   0.803  -1.580  1.00  0.38           H  
ATOM    226  HA  GLU A  15      -5.963  -0.198  -3.384  1.00  0.31           H  
ATOM    227  HB2 GLU A  15      -7.312   2.499  -3.166  1.00  0.31           H  
ATOM    228  HB3 GLU A  15      -6.070   2.115  -4.347  1.00  0.34           H  
ATOM    229  HG2 GLU A  15      -7.551   0.298  -5.201  1.00  0.85           H  
ATOM    230  HG3 GLU A  15      -8.809   0.901  -4.124  1.00  0.82           H  
HETATM  231  N   MVA A  16      -3.889   0.782  -2.343  1.00  0.25           N  
HETATM  232  CN  MVA A  16      -3.715  -0.147  -3.482  1.00  0.53           C  
HETATM  233  CA  MVA A  16      -2.721   1.258  -1.585  1.00  0.19           C  
HETATM  234  CB  MVA A  16      -2.237   0.236  -0.508  1.00  0.21           C  
HETATM  235  CG1 MVA A  16      -1.825  -1.101  -1.099  1.00  0.36           C  
HETATM  236  CG2 MVA A  16      -1.091   0.823   0.298  1.00  0.21           C  
HETATM  237  C   MVA A  16      -1.555   1.659  -2.494  1.00  0.24           C  
HETATM  238  O   MVA A  16      -0.912   0.832  -3.147  1.00  0.48           O  
HETATM  239  HN1 MVA A  16      -2.662  -0.263  -3.694  1.00  1.23           H  
HETATM  240  HN2 MVA A  16      -4.216   0.253  -4.351  1.00  1.12           H  
HETATM  241  HN3 MVA A  16      -4.138  -1.109  -3.231  1.00  1.12           H  
HETATM  242  HA  MVA A  16      -3.006   2.153  -1.048  1.00  0.20           H  
HETATM  243  HB  MVA A  16      -3.056   0.053   0.172  1.00  0.37           H  
HETATM  244 HG11 MVA A  16      -1.023  -0.948  -1.806  1.00  1.08           H  
HETATM  245 HG12 MVA A  16      -2.670  -1.547  -1.601  1.00  1.13           H  
HETATM  246 HG13 MVA A  16      -1.489  -1.754  -0.307  1.00  1.07           H  
HETATM  247 HG21 MVA A  16      -1.403   1.760   0.737  1.00  1.05           H  
HETATM  248 HG22 MVA A  16      -0.243   0.993  -0.351  1.00  1.05           H  
HETATM  249 HG23 MVA A  16      -0.812   0.134   1.081  1.00  0.94           H  
ATOM    250  N   ARG A  17      -1.300   2.955  -2.523  1.00  0.23           N  
ATOM    251  CA  ARG A  17      -0.214   3.519  -3.298  1.00  0.27           C  
ATOM    252  C   ARG A  17       1.029   3.616  -2.433  1.00  0.23           C  
ATOM    253  O   ARG A  17       1.030   4.315  -1.426  1.00  0.34           O  
ATOM    254  CB  ARG A  17      -0.596   4.910  -3.797  1.00  0.34           C  
ATOM    255  CG  ARG A  17       0.534   5.627  -4.510  1.00  1.33           C  
ATOM    256  CD  ARG A  17       0.217   7.100  -4.727  1.00  1.48           C  
ATOM    257  NE  ARG A  17       1.331   7.812  -5.357  1.00  2.36           N  
ATOM    258  CZ  ARG A  17       1.814   8.979  -4.925  1.00  3.00           C  
ATOM    259  NH1 ARG A  17       1.297   9.571  -3.853  1.00  3.01           N1+
ATOM    260  NH2 ARG A  17       2.822   9.552  -5.566  1.00  3.96           N  
ATOM    261  H   ARG A  17      -1.856   3.556  -1.978  1.00  0.34           H  
ATOM    262  HA  ARG A  17      -0.020   2.872  -4.138  1.00  0.31           H  
ATOM    263  HB2 ARG A  17      -1.424   4.817  -4.480  1.00  1.08           H  
ATOM    264  HB3 ARG A  17      -0.900   5.510  -2.954  1.00  0.90           H  
ATOM    265  HG2 ARG A  17       1.430   5.544  -3.914  1.00  2.00           H  
ATOM    266  HG3 ARG A  17       0.692   5.155  -5.468  1.00  1.97           H  
ATOM    267  HD2 ARG A  17      -0.654   7.182  -5.361  1.00  1.68           H  
ATOM    268  HD3 ARG A  17       0.006   7.556  -3.770  1.00  1.71           H  
ATOM    269  HE  ARG A  17       1.740   7.392  -6.150  1.00  2.76           H  
ATOM    270 HH11 ARG A  17       1.667  10.452  -3.535  1.00  3.63           H  
ATOM    271 HH12 ARG A  17       0.538   9.142  -3.343  1.00  2.64           H  
ATOM    272 HH21 ARG A  17       3.224   9.113  -6.374  1.00  4.30           H  
ATOM    273 HH22 ARG A  17       3.195  10.427  -5.244  1.00  4.48           H  
ATOM    274  N   CYS A  18       2.077   2.922  -2.812  1.00  0.27           N  
ATOM    275  CA  CYS A  18       3.298   2.949  -2.034  1.00  0.31           C  
ATOM    276  C   CYS A  18       4.211   4.068  -2.514  1.00  0.38           C  
ATOM    277  O   CYS A  18       4.438   4.235  -3.712  1.00  0.41           O  
ATOM    278  CB  CYS A  18       4.013   1.599  -2.099  1.00  0.37           C  
ATOM    279  SG  CYS A  18       4.431   1.054  -3.785  1.00  0.47           S  
ATOM    280  H   CYS A  18       2.037   2.391  -3.636  1.00  0.40           H  
ATOM    281  HA  CYS A  18       3.023   3.147  -1.008  1.00  0.33           H  
ATOM    282  HB2 CYS A  18       4.933   1.662  -1.539  1.00  0.45           H  
ATOM    283  HB3 CYS A  18       3.377   0.845  -1.658  1.00  0.37           H  
ATOM    284  N   ASP A  19       4.713   4.843  -1.571  1.00  0.50           N  
ATOM    285  CA  ASP A  19       5.614   5.940  -1.869  1.00  0.68           C  
ATOM    286  C   ASP A  19       6.893   5.760  -1.065  1.00  0.80           C  
ATOM    287  O   ASP A  19       7.021   6.283   0.044  1.00  0.84           O  
ATOM    288  CB  ASP A  19       4.953   7.276  -1.533  1.00  0.80           C  
ATOM    289  CG  ASP A  19       5.767   8.467  -1.996  1.00  1.11           C  
ATOM    290  OD1 ASP A  19       6.531   9.031  -1.181  1.00  1.76           O  
ATOM    291  OD2 ASP A  19       5.635   8.859  -3.173  1.00  1.10           O1-
ATOM    292  H   ASP A  19       4.481   4.662  -0.634  1.00  0.49           H  
ATOM    293  HA  ASP A  19       5.845   5.909  -2.922  1.00  0.74           H  
ATOM    294  HB2 ASP A  19       3.984   7.321  -2.006  1.00  1.05           H  
ATOM    295  HB3 ASP A  19       4.828   7.345  -0.462  1.00  1.05           H  
HETATM  296  N   DPR A  20       7.849   4.990  -1.604  1.00  0.95           N  
HETATM  297  CA  DPR A  20       9.062   4.618  -0.877  1.00  1.13           C  
HETATM  298  CB  DPR A  20       9.806   3.699  -1.846  1.00  1.31           C  
HETATM  299  CG  DPR A  20       9.263   4.035  -3.189  1.00  1.35           C  
HETATM  300  CD  DPR A  20       7.833   4.431  -2.965  1.00  1.02           C  
HETATM  301  C   DPR A  20       8.727   3.873   0.416  1.00  1.11           C  
HETATM  302  O   DPR A  20       8.098   2.814   0.387  1.00  1.10           O  
HETATM  303  HA  DPR A  20       9.675   5.476  -0.657  1.00  1.22           H  
HETATM  304  HB2 DPR A  20      10.866   3.894  -1.784  1.00  1.44           H  
HETATM  305  HB3 DPR A  20       9.609   2.669  -1.589  1.00  1.39           H  
HETATM  306  HG2 DPR A  20       9.818   4.859  -3.615  1.00  1.54           H  
HETATM  307  HG3 DPR A  20       9.317   3.171  -3.834  1.00  1.59           H  
HETATM  308  HD2 DPR A  20       7.533   5.176  -3.686  1.00  1.05           H  
HETATM  309  HD3 DPR A  20       7.187   3.568  -3.020  1.00  0.93           H  
ATOM    310  N   PRO A  21       9.137   4.424   1.565  1.00  1.18           N  
ATOM    311  CA  PRO A  21       8.851   3.836   2.872  1.00  1.23           C  
ATOM    312  C   PRO A  21       7.473   4.232   3.406  1.00  1.04           C  
ATOM    313  O   PRO A  21       7.121   3.913   4.543  1.00  1.12           O  
ATOM    314  CB  PRO A  21       9.952   4.432   3.741  1.00  1.43           C  
ATOM    315  CG  PRO A  21      10.166   5.788   3.169  1.00  1.40           C  
ATOM    316  CD  PRO A  21       9.941   5.654   1.685  1.00  1.30           C  
ATOM    317  HA  PRO A  21       8.941   2.762   2.856  1.00  1.35           H  
ATOM    318  HB2 PRO A  21       9.621   4.477   4.768  1.00  1.46           H  
ATOM    319  HB3 PRO A  21      10.843   3.829   3.667  1.00  1.61           H  
ATOM    320  HG2 PRO A  21       9.456   6.480   3.596  1.00  1.32           H  
ATOM    321  HG3 PRO A  21      11.175   6.117   3.368  1.00  1.59           H  
ATOM    322  HD2 PRO A  21       9.396   6.506   1.307  1.00  1.23           H  
ATOM    323  HD3 PRO A  21      10.882   5.549   1.168  1.00  1.47           H  
ATOM    324  N   ARG A  22       6.701   4.945   2.595  1.00  0.84           N  
ATOM    325  CA  ARG A  22       5.358   5.353   2.984  1.00  0.70           C  
ATOM    326  C   ARG A  22       4.327   4.716   2.068  1.00  0.52           C  
ATOM    327  O   ARG A  22       4.681   4.067   1.086  1.00  0.54           O  
ATOM    328  CB  ARG A  22       5.216   6.877   2.930  1.00  0.82           C  
ATOM    329  CG  ARG A  22       6.229   7.620   3.783  1.00  1.37           C  
ATOM    330  CD  ARG A  22       5.912   9.107   3.855  1.00  1.91           C  
ATOM    331  NE  ARG A  22       4.683   9.372   4.610  1.00  2.59           N  
ATOM    332  CZ  ARG A  22       3.809  10.331   4.304  1.00  3.29           C  
ATOM    333  NH1 ARG A  22       3.997  11.094   3.235  1.00  3.45           N1+
ATOM    334  NH2 ARG A  22       2.737  10.515   5.064  1.00  4.24           N  
ATOM    335  H   ARG A  22       7.040   5.199   1.707  1.00  0.84           H  
ATOM    336  HA  ARG A  22       5.186   5.016   3.995  1.00  0.71           H  
ATOM    337  HB2 ARG A  22       5.337   7.198   1.906  1.00  1.26           H  
ATOM    338  HB3 ARG A  22       4.226   7.147   3.267  1.00  0.94           H  
ATOM    339  HG2 ARG A  22       6.217   7.208   4.781  1.00  1.75           H  
ATOM    340  HG3 ARG A  22       7.211   7.491   3.350  1.00  1.90           H  
ATOM    341  HD2 ARG A  22       6.735   9.616   4.335  1.00  1.99           H  
ATOM    342  HD3 ARG A  22       5.795   9.485   2.851  1.00  2.56           H  
ATOM    343  HE  ARG A  22       4.508   8.810   5.399  1.00  2.93           H  
ATOM    344 HH11 ARG A  22       4.797  10.954   2.650  1.00  3.20           H  
ATOM    345 HH12 ARG A  22       3.334  11.812   3.003  1.00  4.13           H  
ATOM    346 HH21 ARG A  22       2.076  11.238   4.837  1.00  4.82           H  
ATOM    347 HH22 ARG A  22       2.580   9.934   5.863  1.00  4.54           H  
ATOM    348  N   TYR A  23       3.056   4.884   2.400  1.00  0.40           N  
ATOM    349  CA  TYR A  23       1.980   4.393   1.556  1.00  0.29           C  
ATOM    350  C   TYR A  23       0.667   5.093   1.874  1.00  0.24           C  
ATOM    351  O   TYR A  23       0.474   5.615   2.975  1.00  0.30           O  
ATOM    352  CB  TYR A  23       1.816   2.881   1.712  1.00  0.28           C  
ATOM    353  CG  TYR A  23       1.424   2.438   3.104  1.00  0.27           C  
ATOM    354  CD1 TYR A  23       0.089   2.265   3.449  1.00  0.26           C  
ATOM    355  CD2 TYR A  23       2.388   2.201   4.074  1.00  0.33           C  
ATOM    356  CE1 TYR A  23      -0.271   1.869   4.721  1.00  0.29           C  
ATOM    357  CE2 TYR A  23       2.035   1.802   5.345  1.00  0.37           C  
ATOM    358  CZ  TYR A  23       0.700   1.614   5.655  1.00  0.35           C  
ATOM    359  OH  TYR A  23       0.356   1.245   6.936  1.00  0.42           O  
ATOM    360  H   TYR A  23       2.835   5.339   3.240  1.00  0.41           H  
ATOM    361  HA  TYR A  23       2.241   4.607   0.532  1.00  0.32           H  
ATOM    362  HB2 TYR A  23       1.053   2.538   1.033  1.00  0.28           H  
ATOM    363  HB3 TYR A  23       2.750   2.403   1.464  1.00  0.34           H  
ATOM    364  HD1 TYR A  23      -0.672   2.446   2.705  1.00  0.26           H  
ATOM    365  HD2 TYR A  23       3.432   2.328   3.821  1.00  0.36           H  
ATOM    366  HE1 TYR A  23      -1.313   1.738   4.969  1.00  0.29           H  
ATOM    367  HE2 TYR A  23       2.801   1.623   6.085  1.00  0.44           H  
ATOM    368  HH  TYR A  23       0.897   1.731   7.578  1.00  0.90           H  
ATOM    369  N   GLU A  24      -0.222   5.099   0.899  1.00  0.20           N  
ATOM    370  CA  GLU A  24      -1.559   5.641   1.054  1.00  0.21           C  
ATOM    371  C   GLU A  24      -2.572   4.532   0.822  1.00  0.19           C  
ATOM    372  O   GLU A  24      -2.467   3.810  -0.163  1.00  0.32           O  
ATOM    373  CB  GLU A  24      -1.797   6.763   0.047  1.00  0.32           C  
ATOM    374  CG  GLU A  24      -0.840   7.931   0.189  1.00  0.49           C  
ATOM    375  CD  GLU A  24      -1.105   9.015  -0.829  1.00  1.22           C  
ATOM    376  OE1 GLU A  24      -2.020   9.833  -0.605  1.00  1.64           O  
ATOM    377  OE2 GLU A  24      -0.400   9.057  -1.859  1.00  1.99           O1-
ATOM    378  H   GLU A  24       0.031   4.718   0.030  1.00  0.21           H  
ATOM    379  HA  GLU A  24      -1.660   6.022   2.057  1.00  0.27           H  
ATOM    380  HB2 GLU A  24      -1.695   6.362  -0.947  1.00  0.32           H  
ATOM    381  HB3 GLU A  24      -2.802   7.134   0.172  1.00  0.43           H  
ATOM    382  HG2 GLU A  24      -0.947   8.351   1.178  1.00  0.85           H  
ATOM    383  HG3 GLU A  24       0.170   7.570   0.057  1.00  0.91           H  
HETATM  384  N   MVA A  25      -3.571   4.377   1.698  1.00  0.17           N  
HETATM  385  CN  MVA A  25      -3.739   5.361   2.792  1.00  0.28           C  
HETATM  386  CA  MVA A  25      -4.521   3.259   1.536  1.00  0.18           C  
HETATM  387  CB  MVA A  25      -4.166   2.034   2.428  1.00  0.28           C  
HETATM  388  CG1 MVA A  25      -4.139   2.374   3.910  1.00  0.51           C  
HETATM  389  CG2 MVA A  25      -5.136   0.895   2.164  1.00  0.76           C  
HETATM  390  C   MVA A  25      -5.977   3.673   1.765  1.00  0.25           C  
HETATM  391  O   MVA A  25      -6.383   4.066   2.860  1.00  0.47           O  
HETATM  392  HN1 MVA A  25      -2.937   5.248   3.505  1.00  1.20           H  
HETATM  393  HN2 MVA A  25      -4.686   5.194   3.283  1.00  0.93           H  
HETATM  394  HN3 MVA A  25      -3.717   6.360   2.383  1.00  1.04           H  
HETATM  395  HA  MVA A  25      -4.464   2.914   0.511  1.00  0.17           H  
HETATM  396  HB  MVA A  25      -3.178   1.695   2.151  1.00  0.69           H  
HETATM  397 HG11 MVA A  25      -3.955   1.475   4.481  1.00  1.16           H  
HETATM  398 HG12 MVA A  25      -5.088   2.798   4.198  1.00  1.12           H  
HETATM  399 HG13 MVA A  25      -3.350   3.088   4.099  1.00  1.28           H  
HETATM  400 HG21 MVA A  25      -5.059   0.587   1.130  1.00  1.28           H  
HETATM  401 HG22 MVA A  25      -6.145   1.228   2.366  1.00  1.27           H  
HETATM  402 HG23 MVA A  25      -4.896   0.060   2.807  1.00  1.43           H  
ATOM    403  N   HIS A  26      -6.759   3.565   0.705  1.00  0.17           N  
ATOM    404  CA  HIS A  26      -8.154   3.967   0.726  1.00  0.24           C  
ATOM    405  C   HIS A  26      -9.045   2.753   0.503  1.00  0.32           C  
ATOM    406  O   HIS A  26      -8.929   2.069  -0.514  1.00  0.43           O  
ATOM    407  CB  HIS A  26      -8.425   5.010  -0.364  1.00  0.32           C  
ATOM    408  CG  HIS A  26      -7.614   6.269  -0.240  1.00  0.44           C  
ATOM    409  ND1 HIS A  26      -8.172   7.501   0.025  1.00  0.57           N  
ATOM    410  CD2 HIS A  26      -6.283   6.487  -0.377  1.00  0.55           C  
ATOM    411  CE1 HIS A  26      -7.225   8.419   0.046  1.00  0.72           C  
ATOM    412  NE2 HIS A  26      -6.070   7.831  -0.194  1.00  0.70           N  
ATOM    413  H   HIS A  26      -6.388   3.182  -0.122  1.00  0.22           H  
ATOM    414  HA  HIS A  26      -8.368   4.394   1.692  1.00  0.30           H  
ATOM    415  HB2 HIS A  26      -8.208   4.573  -1.325  1.00  0.33           H  
ATOM    416  HB3 HIS A  26      -9.468   5.283  -0.331  1.00  0.40           H  
ATOM    417  HD1 HIS A  26      -9.128   7.678   0.175  1.00  0.61           H  
ATOM    418  HD2 HIS A  26      -5.530   5.741  -0.591  1.00  0.59           H  
ATOM    419  HE1 HIS A  26      -7.370   9.474   0.229  1.00  0.87           H  
ATOM    420  HE2 HIS A  26      -5.198   8.288  -0.235  1.00  0.83           H  
ATOM    421  N   CYS A  27      -9.911   2.474   1.463  1.00  0.38           N  
ATOM    422  CA  CYS A  27     -10.834   1.356   1.355  1.00  0.50           C  
ATOM    423  C   CYS A  27     -12.180   1.828   0.822  1.00  0.74           C  
ATOM    424  O   CYS A  27     -12.573   1.486  -0.292  1.00  1.38           O  
ATOM    425  CB  CYS A  27     -11.010   0.666   2.709  1.00  0.59           C  
ATOM    426  SG  CYS A  27      -9.456   0.049   3.433  1.00  0.75           S  
ATOM    427  H   CYS A  27      -9.932   3.034   2.267  1.00  0.41           H  
ATOM    428  HA  CYS A  27     -10.414   0.650   0.655  1.00  0.47           H  
ATOM    429  HB2 CYS A  27     -11.444   1.363   3.408  1.00  0.95           H  
ATOM    430  HB3 CYS A  27     -11.673  -0.176   2.591  1.00  0.83           H  
HETATM  431  N   NH2 A  28     -12.884   2.619   1.615  1.00  0.99           N  
HETATM  432  HN1 NH2 A  28     -12.510   2.853   2.492  1.00  1.44           H  
HETATM  433  HN2 NH2 A  28     -13.753   2.942   1.293  1.00  1.11           H  
TER     434      NH2 A  28                                                      
ENDMDL                                                                          
MODEL        7                                                                  
ATOM      1  N   ASN A   1       9.139 -10.167  -4.713  1.00  1.83           N  
ATOM      2  CA  ASN A   1       8.125  -9.610  -3.790  1.00  1.49           C  
ATOM      3  C   ASN A   1       8.626  -8.294  -3.205  1.00  1.11           C  
ATOM      4  O   ASN A   1       9.830  -8.098  -3.045  1.00  1.38           O  
ATOM      5  CB  ASN A   1       7.824 -10.610  -2.666  1.00  1.76           C  
ATOM      6  CG  ASN A   1       6.675 -10.167  -1.779  1.00  2.41           C  
ATOM      7  OD1 ASN A   1       5.756  -9.482  -2.227  1.00  3.13           O  
ATOM      8  ND2 ASN A   1       6.713 -10.563  -0.519  1.00  2.72           N  
ATOM      9  H1  ASN A   1      10.018 -10.359  -4.197  1.00  1.62           H  
ATOM     10  H2  ASN A   1       9.337  -9.491  -5.473  1.00  2.41           H  
ATOM     11  H3  ASN A   1       8.792 -11.054  -5.132  1.00  2.27           H  
ATOM     12  HA  ASN A   1       7.220  -9.421  -4.352  1.00  1.51           H  
ATOM     13  HB2 ASN A   1       7.570 -11.566  -3.099  1.00  2.07           H  
ATOM     14  HB3 ASN A   1       8.706 -10.722  -2.051  1.00  1.95           H  
ATOM     15 HD21 ASN A   1       7.471 -11.115  -0.225  1.00  2.63           H  
ATOM     16 HD22 ASN A   1       5.979 -10.290   0.077  1.00  3.34           H  
ATOM     17  N   ASP A   2       7.703  -7.396  -2.895  1.00  0.74           N  
ATOM     18  CA  ASP A   2       8.059  -6.086  -2.372  1.00  0.50           C  
ATOM     19  C   ASP A   2       7.141  -5.720  -1.216  1.00  0.36           C  
ATOM     20  O   ASP A   2       6.033  -6.257  -1.112  1.00  0.33           O  
ATOM     21  CB  ASP A   2       7.960  -5.025  -3.475  1.00  0.73           C  
ATOM     22  CG  ASP A   2       8.491  -3.673  -3.040  1.00  1.34           C  
ATOM     23  OD1 ASP A   2       7.696  -2.837  -2.561  1.00  2.21           O  
ATOM     24  OD2 ASP A   2       9.708  -3.440  -3.178  1.00  1.35           O1-
ATOM     25  H   ASP A   2       6.755  -7.622  -3.007  1.00  0.90           H  
ATOM     26  HA  ASP A   2       9.075  -6.130  -2.013  1.00  0.62           H  
ATOM     27  HB2 ASP A   2       8.526  -5.354  -4.333  1.00  1.22           H  
ATOM     28  HB3 ASP A   2       6.924  -4.910  -3.758  1.00  1.02           H  
HETATM   29  N   AIB A   3       7.614  -4.820  -0.353  1.00  0.36           N  
HETATM   30  CA  AIB A   3       6.819  -4.302   0.763  1.00  0.37           C  
HETATM   31  C   AIB A   3       5.464  -3.824   0.231  1.00  0.33           C  
HETATM   32  O   AIB A   3       4.417  -4.082   0.830  1.00  0.30           O  
HETATM   33  CB1 AIB A   3       7.547  -3.146   1.417  1.00  0.49           C  
HETATM   34  CB2 AIB A   3       6.632  -5.376   1.814  1.00  0.41           C  
HETATM   35  H   AIB A   3       8.532  -4.496  -0.470  1.00  0.41           H  
HETATM   36 HB11 AIB A   3       6.960  -2.770   2.242  1.00  1.25           H  
HETATM   37 HB12 AIB A   3       7.697  -2.359   0.694  1.00  0.95           H  
HETATM   38 HB13 AIB A   3       8.504  -3.485   1.784  1.00  1.20           H  
HETATM   39 HB21 AIB A   3       7.593  -5.645   2.226  1.00  1.26           H  
HETATM   40 HB22 AIB A   3       6.180  -6.246   1.363  1.00  1.09           H  
HETATM   41 HB23 AIB A   3       5.995  -5.004   2.601  1.00  0.94           H  
ATOM     42  N   CYS A   4       5.502  -3.148  -0.912  1.00  0.37           N  
ATOM     43  CA  CYS A   4       4.300  -2.625  -1.541  1.00  0.40           C  
ATOM     44  C   CYS A   4       3.336  -3.747  -1.900  1.00  0.32           C  
ATOM     45  O   CYS A   4       2.134  -3.641  -1.664  1.00  0.33           O  
ATOM     46  CB  CYS A   4       4.660  -1.837  -2.797  1.00  0.49           C  
ATOM     47  SG  CYS A   4       3.223  -1.269  -3.760  1.00  1.18           S  
ATOM     48  H   CYS A   4       6.373  -3.002  -1.354  1.00  0.41           H  
ATOM     49  HA  CYS A   4       3.819  -1.964  -0.839  1.00  0.43           H  
ATOM     50  HB2 CYS A   4       5.230  -0.966  -2.514  1.00  1.21           H  
ATOM     51  HB3 CYS A   4       5.262  -2.459  -3.440  1.00  1.05           H  
ATOM     52  N   LYS A   5       3.869  -4.830  -2.454  1.00  0.30           N  
ATOM     53  CA  LYS A   5       3.039  -5.949  -2.875  1.00  0.31           C  
ATOM     54  C   LYS A   5       2.387  -6.600  -1.664  1.00  0.20           C  
ATOM     55  O   LYS A   5       1.200  -6.926  -1.690  1.00  0.20           O  
ATOM     56  CB  LYS A   5       3.867  -6.980  -3.654  1.00  0.39           C  
ATOM     57  CG  LYS A   5       3.029  -8.089  -4.276  1.00  0.80           C  
ATOM     58  CD  LYS A   5       3.892  -9.112  -4.993  1.00  1.37           C  
ATOM     59  CE  LYS A   5       3.048 -10.156  -5.707  1.00  2.05           C  
ATOM     60  NZ  LYS A   5       2.164 -10.901  -4.772  1.00  2.62           N1+
ATOM     61  H   LYS A   5       4.841  -4.880  -2.570  1.00  0.32           H  
ATOM     62  HA  LYS A   5       2.265  -5.559  -3.516  1.00  0.38           H  
ATOM     63  HB2 LYS A   5       4.400  -6.474  -4.445  1.00  0.76           H  
ATOM     64  HB3 LYS A   5       4.583  -7.433  -2.981  1.00  0.63           H  
ATOM     65  HG2 LYS A   5       2.471  -8.588  -3.498  1.00  1.40           H  
ATOM     66  HG3 LYS A   5       2.344  -7.652  -4.987  1.00  1.26           H  
ATOM     67  HD2 LYS A   5       4.504  -8.603  -5.722  1.00  1.80           H  
ATOM     68  HD3 LYS A   5       4.526  -9.605  -4.270  1.00  1.90           H  
ATOM     69  HE2 LYS A   5       2.436  -9.661  -6.445  1.00  2.44           H  
ATOM     70  HE3 LYS A   5       3.707 -10.856  -6.200  1.00  2.54           H  
ATOM     71  HZ1 LYS A   5       2.732 -11.370  -4.037  1.00  2.86           H  
ATOM     72  HZ2 LYS A   5       1.624 -11.624  -5.289  1.00  2.84           H  
ATOM     73  HZ3 LYS A   5       1.495 -10.250  -4.314  1.00  3.23           H  
HETATM   74  N   AIB A   6       3.173  -6.758  -0.599  1.00  0.16           N  
HETATM   75  CA  AIB A   6       2.679  -7.317   0.662  1.00  0.16           C  
HETATM   76  C   AIB A   6       1.526  -6.447   1.180  1.00  0.12           C  
HETATM   77  O   AIB A   6       0.491  -6.956   1.620  1.00  0.16           O  
HETATM   78  CB1 AIB A   6       3.793  -7.339   1.684  1.00  0.22           C  
HETATM   79  CB2 AIB A   6       2.222  -8.750   0.464  1.00  0.25           C  
HETATM   80  H   AIB A   6       4.118  -6.489  -0.664  1.00  0.18           H  
HETATM   81 HB11 AIB A   6       4.612  -7.934   1.309  1.00  1.10           H  
HETATM   82 HB12 AIB A   6       3.428  -7.769   2.604  1.00  1.03           H  
HETATM   83 HB13 AIB A   6       4.134  -6.331   1.868  1.00  0.90           H  
HETATM   84 HB21 AIB A   6       1.455  -8.781  -0.296  1.00  1.08           H  
HETATM   85 HB22 AIB A   6       1.828  -9.134   1.393  1.00  1.03           H  
HETATM   86 HB23 AIB A   6       3.063  -9.353   0.152  1.00  1.03           H  
ATOM     87  N   LEU A   7       1.711  -5.130   1.108  1.00  0.12           N  
ATOM     88  CA  LEU A   7       0.698  -4.193   1.573  1.00  0.16           C  
ATOM     89  C   LEU A   7      -0.553  -4.285   0.716  1.00  0.17           C  
ATOM     90  O   LEU A   7      -1.664  -4.265   1.232  1.00  0.21           O  
ATOM     91  CB  LEU A   7       1.227  -2.758   1.557  1.00  0.23           C  
ATOM     92  CG  LEU A   7       2.459  -2.502   2.426  1.00  0.28           C  
ATOM     93  CD1 LEU A   7       2.914  -1.061   2.284  1.00  0.38           C  
ATOM     94  CD2 LEU A   7       2.167  -2.818   3.884  1.00  0.35           C  
ATOM     95  H   LEU A   7       2.553  -4.781   0.733  1.00  0.15           H  
ATOM     96  HA  LEU A   7       0.441  -4.461   2.585  1.00  0.19           H  
ATOM     97  HB2 LEU A   7       1.468  -2.500   0.538  1.00  0.25           H  
ATOM     98  HB3 LEU A   7       0.436  -2.106   1.895  1.00  0.28           H  
ATOM     99  HG  LEU A   7       3.265  -3.141   2.095  1.00  0.24           H  
ATOM    100 HD11 LEU A   7       3.181  -0.866   1.256  1.00  1.02           H  
ATOM    101 HD12 LEU A   7       3.771  -0.889   2.917  1.00  0.98           H  
ATOM    102 HD13 LEU A   7       2.110  -0.403   2.579  1.00  1.03           H  
ATOM    103 HD21 LEU A   7       1.927  -3.865   3.986  1.00  1.14           H  
ATOM    104 HD22 LEU A   7       1.333  -2.221   4.219  1.00  0.90           H  
ATOM    105 HD23 LEU A   7       3.037  -2.589   4.482  1.00  1.09           H  
ATOM    106  N   LYS A   8      -0.369  -4.394  -0.592  1.00  0.19           N  
ATOM    107  CA  LYS A   8      -1.498  -4.511  -1.503  1.00  0.27           C  
ATOM    108  C   LYS A   8      -2.307  -5.761  -1.192  1.00  0.25           C  
ATOM    109  O   LYS A   8      -3.527  -5.699  -1.087  1.00  0.31           O  
ATOM    110  CB  LYS A   8      -1.034  -4.521  -2.963  1.00  0.35           C  
ATOM    111  CG  LYS A   8      -0.560  -3.165  -3.473  1.00  1.12           C  
ATOM    112  CD  LYS A   8      -0.180  -3.224  -4.944  1.00  1.10           C  
ATOM    113  CE  LYS A   8       0.254  -1.862  -5.477  1.00  2.05           C  
ATOM    114  NZ  LYS A   8      -0.843  -0.857  -5.425  1.00  2.55           N1+
ATOM    115  H   LYS A   8       0.545  -4.397  -0.949  1.00  0.20           H  
ATOM    116  HA  LYS A   8      -2.129  -3.652  -1.344  1.00  0.31           H  
ATOM    117  HB2 LYS A   8      -0.219  -5.222  -3.062  1.00  0.78           H  
ATOM    118  HB3 LYS A   8      -1.855  -4.848  -3.586  1.00  1.00           H  
ATOM    119  HG2 LYS A   8      -1.354  -2.445  -3.346  1.00  1.72           H  
ATOM    120  HG3 LYS A   8       0.301  -2.856  -2.899  1.00  1.60           H  
ATOM    121  HD2 LYS A   8       0.635  -3.922  -5.066  1.00  1.29           H  
ATOM    122  HD3 LYS A   8      -1.034  -3.566  -5.511  1.00  1.23           H  
ATOM    123  HE2 LYS A   8       1.082  -1.507  -4.881  1.00  2.55           H  
ATOM    124  HE3 LYS A   8       0.576  -1.979  -6.501  1.00  2.55           H  
ATOM    125  HZ1 LYS A   8      -0.543   0.025  -5.889  1.00  2.92           H  
ATOM    126  HZ2 LYS A   8      -1.093  -0.641  -4.438  1.00  2.95           H  
ATOM    127  HZ3 LYS A   8      -1.688  -1.220  -5.912  1.00  2.82           H  
HETATM  128  N   AIB A   9      -1.609  -6.881  -1.014  1.00  0.21           N  
HETATM  129  CA  AIB A   9      -2.246  -8.157  -0.663  1.00  0.24           C  
HETATM  130  C   AIB A   9      -2.980  -8.008   0.676  1.00  0.26           C  
HETATM  131  O   AIB A   9      -4.069  -8.555   0.868  1.00  0.35           O  
HETATM  132  CB1 AIB A   9      -1.192  -9.238  -0.541  1.00  0.23           C  
HETATM  133  CB2 AIB A   9      -3.213  -8.587  -1.751  1.00  0.32           C  
HETATM  134  H   AIB A   9      -0.633  -6.852  -1.123  1.00  0.18           H  
HETATM  135 HB11 AIB A   9      -0.647  -9.315  -1.470  1.00  1.04           H  
HETATM  136 HB12 AIB A   9      -1.668 -10.181  -0.323  1.00  0.97           H  
HETATM  137 HB13 AIB A   9      -0.511  -8.986   0.258  1.00  1.10           H  
HETATM  138 HB21 AIB A   9      -3.698  -9.507  -1.459  1.00  1.03           H  
HETATM  139 HB22 AIB A   9      -2.670  -8.745  -2.672  1.00  1.10           H  
HETATM  140 HB23 AIB A   9      -3.955  -7.818  -1.898  1.00  0.99           H  
ATOM    141  N   ARG A  10      -2.369  -7.270   1.600  1.00  0.21           N  
ATOM    142  CA  ARG A  10      -2.948  -7.051   2.920  1.00  0.27           C  
ATOM    143  C   ARG A  10      -4.210  -6.199   2.827  1.00  0.33           C  
ATOM    144  O   ARG A  10      -5.210  -6.473   3.489  1.00  0.44           O  
ATOM    145  CB  ARG A  10      -1.926  -6.374   3.841  1.00  0.28           C  
ATOM    146  CG  ARG A  10      -2.439  -6.137   5.252  1.00  0.37           C  
ATOM    147  CD  ARG A  10      -1.421  -5.402   6.114  1.00  0.46           C  
ATOM    148  NE  ARG A  10      -0.200  -6.183   6.336  1.00  1.04           N  
ATOM    149  CZ  ARG A  10       0.451  -6.240   7.501  1.00  1.36           C  
ATOM    150  NH1 ARG A  10      -0.031  -5.621   8.575  1.00  1.26           N1+
ATOM    151  NH2 ARG A  10       1.575  -6.937   7.595  1.00  2.18           N  
ATOM    152  H   ARG A  10      -1.497  -6.861   1.386  1.00  0.16           H  
ATOM    153  HA  ARG A  10      -3.208  -8.014   3.330  1.00  0.33           H  
ATOM    154  HB2 ARG A  10      -1.045  -6.995   3.902  1.00  0.30           H  
ATOM    155  HB3 ARG A  10      -1.654  -5.418   3.416  1.00  0.27           H  
ATOM    156  HG2 ARG A  10      -3.340  -5.547   5.198  1.00  0.45           H  
ATOM    157  HG3 ARG A  10      -2.661  -7.091   5.707  1.00  0.42           H  
ATOM    158  HD2 ARG A  10      -1.158  -4.476   5.622  1.00  0.90           H  
ATOM    159  HD3 ARG A  10      -1.874  -5.181   7.068  1.00  1.00           H  
ATOM    160  HE  ARG A  10       0.168  -6.680   5.567  1.00  1.56           H  
ATOM    161 HH11 ARG A  10       0.463  -5.668   9.447  1.00  1.61           H  
ATOM    162 HH12 ARG A  10      -0.896  -5.117   8.523  1.00  1.29           H  
ATOM    163 HH21 ARG A  10       2.072  -6.986   8.468  1.00  2.69           H  
ATOM    164 HH22 ARG A  10       1.933  -7.424   6.795  1.00  2.46           H  
ATOM    165  N   TYR A  11      -4.161  -5.181   1.985  1.00  0.31           N  
ATOM    166  CA  TYR A  11      -5.256  -4.234   1.853  1.00  0.39           C  
ATOM    167  C   TYR A  11      -6.082  -4.522   0.607  1.00  0.58           C  
ATOM    168  O   TYR A  11      -6.519  -3.600  -0.073  1.00  0.93           O  
ATOM    169  CB  TYR A  11      -4.712  -2.807   1.793  1.00  0.32           C  
ATOM    170  CG  TYR A  11      -4.050  -2.346   3.070  1.00  0.24           C  
ATOM    171  CD1 TYR A  11      -4.807  -1.952   4.164  1.00  0.27           C  
ATOM    172  CD2 TYR A  11      -2.669  -2.314   3.182  1.00  0.24           C  
ATOM    173  CE1 TYR A  11      -4.208  -1.536   5.334  1.00  0.31           C  
ATOM    174  CE2 TYR A  11      -2.059  -1.899   4.349  1.00  0.24           C  
ATOM    175  CZ  TYR A  11      -2.833  -1.484   5.413  1.00  0.27           C  
ATOM    176  OH  TYR A  11      -2.227  -1.097   6.589  1.00  0.38           O  
ATOM    177  H   TYR A  11      -3.361  -5.062   1.426  1.00  0.29           H  
ATOM    178  HA  TYR A  11      -5.888  -4.332   2.723  1.00  0.44           H  
ATOM    179  HB2 TYR A  11      -3.979  -2.745   1.003  1.00  0.34           H  
ATOM    180  HB3 TYR A  11      -5.523  -2.132   1.576  1.00  0.37           H  
ATOM    181  HD1 TYR A  11      -5.886  -1.971   4.090  1.00  0.33           H  
ATOM    182  HD2 TYR A  11      -2.066  -2.616   2.338  1.00  0.32           H  
ATOM    183  HE1 TYR A  11      -4.817  -1.235   6.171  1.00  0.41           H  
ATOM    184  HE2 TYR A  11      -0.982  -1.882   4.417  1.00  0.29           H  
ATOM    185  HH  TYR A  11      -1.420  -0.613   6.375  1.00  0.93           H  
HETATM  186  N   AIB A  12      -6.301  -5.803   0.331  1.00  0.54           N  
HETATM  187  CA  AIB A  12      -7.094  -6.247  -0.829  1.00  0.73           C  
HETATM  188  C   AIB A  12      -8.501  -5.632  -0.796  1.00  0.64           C  
HETATM  189  O   AIB A  12      -9.115  -5.410  -1.840  1.00  1.44           O  
HETATM  190  CB1 AIB A  12      -7.205  -7.755  -0.808  1.00  1.05           C  
HETATM  191  CB2 AIB A  12      -6.398  -5.867  -2.122  1.00  1.04           C  
HETATM  192  H   AIB A  12      -5.902  -6.481   0.918  1.00  0.64           H  
HETATM  193 HB11 AIB A  12      -7.754  -8.087  -1.677  1.00  1.35           H  
HETATM  194 HB12 AIB A  12      -7.726  -8.064   0.086  1.00  1.34           H  
HETATM  195 HB13 AIB A  12      -6.217  -8.189  -0.819  1.00  1.69           H  
HETATM  196 HB21 AIB A  12      -5.409  -6.298  -2.137  1.00  1.46           H  
HETATM  197 HB22 AIB A  12      -6.325  -4.792  -2.187  1.00  1.41           H  
HETATM  198 HB23 AIB A  12      -6.968  -6.242  -2.959  1.00  1.18           H  
ATOM    199  N   GLY A  13      -9.011  -5.365   0.400  1.00  0.60           N  
ATOM    200  CA  GLY A  13     -10.338  -4.786   0.532  1.00  0.84           C  
ATOM    201  C   GLY A  13     -10.333  -3.278   0.367  1.00  0.80           C  
ATOM    202  O   GLY A  13     -11.380  -2.632   0.435  1.00  1.24           O  
ATOM    203  H   GLY A  13      -8.483  -5.567   1.202  1.00  1.15           H  
ATOM    204  HA2 GLY A  13     -10.980  -5.216  -0.221  1.00  0.99           H  
ATOM    205  HA3 GLY A  13     -10.730  -5.028   1.506  1.00  1.02           H  
ATOM    206  N   CYS A  14      -9.155  -2.725   0.149  1.00  0.33           N  
ATOM    207  CA  CYS A  14      -8.985  -1.293  -0.012  1.00  0.29           C  
ATOM    208  C   CYS A  14      -8.070  -1.026  -1.205  1.00  0.34           C  
ATOM    209  O   CYS A  14      -7.701  -1.949  -1.930  1.00  0.62           O  
ATOM    210  CB  CYS A  14      -8.373  -0.704   1.263  1.00  0.25           C  
ATOM    211  SG  CYS A  14      -9.268  -1.128   2.797  1.00  0.39           S  
ATOM    212  H   CYS A  14      -8.363  -3.300   0.085  1.00  0.23           H  
ATOM    213  HA  CYS A  14      -9.950  -0.847  -0.190  1.00  0.35           H  
ATOM    214  HB2 CYS A  14      -7.364  -1.066   1.364  1.00  0.26           H  
ATOM    215  HB3 CYS A  14      -8.353   0.373   1.180  1.00  0.26           H  
ATOM    216  N   GLU A  15      -7.725   0.227  -1.424  1.00  0.27           N  
ATOM    217  CA  GLU A  15      -6.772   0.582  -2.461  1.00  0.27           C  
ATOM    218  C   GLU A  15      -5.529   1.188  -1.825  1.00  0.21           C  
ATOM    219  O   GLU A  15      -5.642   2.100  -1.012  1.00  0.33           O  
ATOM    220  CB  GLU A  15      -7.391   1.569  -3.449  1.00  0.31           C  
ATOM    221  CG  GLU A  15      -8.547   0.994  -4.248  1.00  0.37           C  
ATOM    222  CD  GLU A  15      -9.105   1.987  -5.241  1.00  0.84           C  
ATOM    223  OE1 GLU A  15     -10.079   2.691  -4.902  1.00  1.65           O  
ATOM    224  OE2 GLU A  15      -8.579   2.063  -6.372  1.00  0.80           O1-
ATOM    225  H   GLU A  15      -8.120   0.939  -0.875  1.00  0.38           H  
ATOM    226  HA  GLU A  15      -6.495  -0.322  -2.982  1.00  0.31           H  
ATOM    227  HB2 GLU A  15      -7.752   2.427  -2.902  1.00  0.31           H  
ATOM    228  HB3 GLU A  15      -6.628   1.890  -4.142  1.00  0.34           H  
ATOM    229  HG2 GLU A  15      -8.202   0.125  -4.786  1.00  0.85           H  
ATOM    230  HG3 GLU A  15      -9.332   0.707  -3.566  1.00  0.82           H  
HETATM  231  N   MVA A  16      -4.329   0.711  -2.183  1.00  0.25           N  
HETATM  232  CN  MVA A  16      -4.240  -0.285  -3.274  1.00  0.53           C  
HETATM  233  CA  MVA A  16      -3.108   1.216  -1.526  1.00  0.19           C  
HETATM  234  CB  MVA A  16      -2.596   0.272  -0.392  1.00  0.21           C  
HETATM  235  CG1 MVA A  16      -2.273  -1.125  -0.888  1.00  0.36           C  
HETATM  236  CG2 MVA A  16      -1.378   0.874   0.291  1.00  0.21           C  
HETATM  237  C   MVA A  16      -1.976   1.505  -2.513  1.00  0.24           C  
HETATM  238  O   MVA A  16      -1.415   0.611  -3.156  1.00  0.48           O  
HETATM  239  HN1 MVA A  16      -4.664  -1.222  -2.945  1.00  1.23           H  
HETATM  240  HN2 MVA A  16      -3.203  -0.433  -3.541  1.00  1.12           H  
HETATM  241  HN3 MVA A  16      -4.784   0.072  -4.135  1.00  1.12           H  
HETATM  242  HA  MVA A  16      -3.343   2.160  -1.050  1.00  0.20           H  
HETATM  243  HB  MVA A  16      -3.378   0.185   0.347  1.00  0.37           H  
HETATM  244 HG11 MVA A  16      -3.169  -1.585  -1.275  1.00  1.08           H  
HETATM  245 HG12 MVA A  16      -1.886  -1.714  -0.071  1.00  1.13           H  
HETATM  246 HG13 MVA A  16      -1.531  -1.063  -1.671  1.00  1.07           H  
HETATM  247 HG21 MVA A  16      -1.051   0.220   1.087  1.00  1.05           H  
HETATM  248 HG22 MVA A  16      -1.634   1.840   0.700  1.00  1.05           H  
HETATM  249 HG23 MVA A  16      -0.582   0.988  -0.431  1.00  0.94           H  
ATOM    250  N   ARG A  17      -1.643   2.780  -2.613  1.00  0.23           N  
ATOM    251  CA  ARG A  17      -0.555   3.231  -3.460  1.00  0.27           C  
ATOM    252  C   ARG A  17       0.726   3.228  -2.656  1.00  0.23           C  
ATOM    253  O   ARG A  17       0.696   3.432  -1.448  1.00  0.34           O  
ATOM    254  CB  ARG A  17      -0.834   4.633  -3.989  1.00  0.34           C  
ATOM    255  CG  ARG A  17      -1.989   4.697  -4.971  1.00  1.33           C  
ATOM    256  CD  ARG A  17      -2.309   6.132  -5.359  1.00  1.48           C  
ATOM    257  NE  ARG A  17      -1.157   6.829  -5.934  1.00  2.36           N  
ATOM    258  CZ  ARG A  17      -1.188   8.096  -6.339  1.00  3.00           C  
ATOM    259  NH1 ARG A  17      -2.307   8.805  -6.231  1.00  3.01           N1+
ATOM    260  NH2 ARG A  17      -0.098   8.658  -6.846  1.00  3.96           N  
ATOM    261  H   ARG A  17      -2.128   3.440  -2.067  1.00  0.34           H  
ATOM    262  HA  ARG A  17      -0.459   2.544  -4.286  1.00  0.31           H  
ATOM    263  HB2 ARG A  17      -1.063   5.278  -3.154  1.00  1.08           H  
ATOM    264  HB3 ARG A  17       0.051   5.001  -4.483  1.00  0.90           H  
ATOM    265  HG2 ARG A  17      -1.726   4.140  -5.859  1.00  2.00           H  
ATOM    266  HG3 ARG A  17      -2.861   4.253  -4.512  1.00  1.97           H  
ATOM    267  HD2 ARG A  17      -3.109   6.127  -6.084  1.00  1.68           H  
ATOM    268  HD3 ARG A  17      -2.632   6.664  -4.476  1.00  1.71           H  
ATOM    269  HE  ARG A  17      -0.315   6.326  -6.016  1.00  2.76           H  
ATOM    270 HH11 ARG A  17      -2.329   9.761  -6.539  1.00  3.63           H  
ATOM    271 HH12 ARG A  17      -3.132   8.391  -5.837  1.00  2.64           H  
ATOM    272 HH21 ARG A  17       0.753   8.129  -6.925  1.00  4.30           H  
ATOM    273 HH22 ARG A  17      -0.119   9.615  -7.147  1.00  4.48           H  
ATOM    274  N   CYS A  18       1.842   2.997  -3.306  1.00  0.27           N  
ATOM    275  CA  CYS A  18       3.103   2.920  -2.598  1.00  0.31           C  
ATOM    276  C   CYS A  18       4.170   3.789  -3.243  1.00  0.38           C  
ATOM    277  O   CYS A  18       4.300   3.836  -4.470  1.00  0.41           O  
ATOM    278  CB  CYS A  18       3.575   1.471  -2.539  1.00  0.37           C  
ATOM    279  SG  CYS A  18       3.668   0.664  -4.168  1.00  0.47           S  
ATOM    280  H   CYS A  18       1.822   2.866  -4.278  1.00  0.40           H  
ATOM    281  HA  CYS A  18       2.933   3.268  -1.591  1.00  0.33           H  
ATOM    282  HB2 CYS A  18       4.560   1.436  -2.097  1.00  0.45           H  
ATOM    283  HB3 CYS A  18       2.890   0.902  -1.928  1.00  0.37           H  
ATOM    284  N   ASP A  19       4.919   4.480  -2.404  1.00  0.50           N  
ATOM    285  CA  ASP A  19       6.076   5.236  -2.838  1.00  0.68           C  
ATOM    286  C   ASP A  19       7.280   4.771  -2.032  1.00  0.80           C  
ATOM    287  O   ASP A  19       7.520   5.255  -0.920  1.00  0.84           O  
ATOM    288  CB  ASP A  19       5.861   6.739  -2.652  1.00  0.80           C  
ATOM    289  CG  ASP A  19       6.911   7.560  -3.376  1.00  1.11           C  
ATOM    290  OD1 ASP A  19       7.863   8.024  -2.714  1.00  1.76           O  
ATOM    291  OD2 ASP A  19       6.794   7.752  -4.607  1.00  1.10           O1-
ATOM    292  H   ASP A  19       4.695   4.466  -1.448  1.00  0.49           H  
ATOM    293  HA  ASP A  19       6.242   5.022  -3.882  1.00  0.74           H  
ATOM    294  HB2 ASP A  19       4.889   7.009  -3.034  1.00  1.05           H  
ATOM    295  HB3 ASP A  19       5.909   6.974  -1.599  1.00  1.05           H  
HETATM  296  N   DPR A  20       8.035   3.800  -2.562  1.00  0.95           N  
HETATM  297  CA  DPR A  20       9.124   3.160  -1.823  1.00  1.13           C  
HETATM  298  CB  DPR A  20       9.685   2.132  -2.805  1.00  1.31           C  
HETATM  299  CG  DPR A  20       9.218   2.581  -4.146  1.00  1.35           C  
HETATM  300  CD  DPR A  20       7.897   3.250  -3.919  1.00  1.02           C  
HETATM  301  C   DPR A  20       8.605   2.467  -0.562  1.00  1.11           C  
HETATM  302  O   DPR A  20       7.794   1.542  -0.643  1.00  1.10           O  
HETATM  303  HA  DPR A  20       9.897   3.864  -1.561  1.00  1.22           H  
HETATM  304  HB2 DPR A  20      10.763   2.124  -2.741  1.00  1.44           H  
HETATM  305  HB3 DPR A  20       9.300   1.155  -2.562  1.00  1.39           H  
HETATM  306  HG2 DPR A  20       9.925   3.281  -4.568  1.00  1.54           H  
HETATM  307  HG3 DPR A  20       9.100   1.729  -4.798  1.00  1.59           H  
HETATM  308  HD2 DPR A  20       7.746   4.037  -4.641  1.00  1.05           H  
HETATM  309  HD3 DPR A  20       7.093   2.532  -3.964  1.00  0.93           H  
ATOM    310  N   PRO A  21       9.066   2.904   0.616  1.00  1.18           N  
ATOM    311  CA  PRO A  21       8.609   2.357   1.895  1.00  1.23           C  
ATOM    312  C   PRO A  21       7.282   2.959   2.364  1.00  1.04           C  
ATOM    313  O   PRO A  21       6.676   2.473   3.320  1.00  1.12           O  
ATOM    314  CB  PRO A  21       9.733   2.750   2.849  1.00  1.43           C  
ATOM    315  CG  PRO A  21      10.254   4.030   2.296  1.00  1.40           C  
ATOM    316  CD  PRO A  21      10.103   3.936   0.799  1.00  1.30           C  
ATOM    317  HA  PRO A  21       8.523   1.282   1.860  1.00  1.35           H  
ATOM    318  HB2 PRO A  21       9.335   2.878   3.844  1.00  1.46           H  
ATOM    319  HB3 PRO A  21      10.492   1.984   2.853  1.00  1.61           H  
ATOM    320  HG2 PRO A  21       9.672   4.854   2.678  1.00  1.32           H  
ATOM    321  HG3 PRO A  21      11.293   4.149   2.561  1.00  1.59           H  
ATOM    322  HD2 PRO A  21       9.781   4.881   0.394  1.00  1.23           H  
ATOM    323  HD3 PRO A  21      11.034   3.628   0.345  1.00  1.47           H  
ATOM    324  N   ARG A  22       6.830   4.005   1.681  1.00  0.84           N  
ATOM    325  CA  ARG A  22       5.625   4.720   2.085  1.00  0.70           C  
ATOM    326  C   ARG A  22       4.421   4.232   1.297  1.00  0.52           C  
ATOM    327  O   ARG A  22       4.571   3.658   0.219  1.00  0.54           O  
ATOM    328  CB  ARG A  22       5.808   6.222   1.875  1.00  0.82           C  
ATOM    329  CG  ARG A  22       6.890   6.829   2.751  1.00  1.37           C  
ATOM    330  CD  ARG A  22       7.123   8.293   2.415  1.00  1.91           C  
ATOM    331  NE  ARG A  22       5.914   9.099   2.569  1.00  2.59           N  
ATOM    332  CZ  ARG A  22       5.874  10.418   2.398  1.00  3.29           C  
ATOM    333  NH1 ARG A  22       6.975  11.086   2.073  1.00  3.45           N1+
ATOM    334  NH2 ARG A  22       4.735  11.070   2.557  1.00  4.24           N  
ATOM    335  H   ARG A  22       7.308   4.292   0.870  1.00  0.84           H  
ATOM    336  HA  ARG A  22       5.458   4.526   3.134  1.00  0.71           H  
ATOM    337  HB2 ARG A  22       6.068   6.401   0.843  1.00  1.26           H  
ATOM    338  HB3 ARG A  22       4.876   6.721   2.094  1.00  0.94           H  
ATOM    339  HG2 ARG A  22       6.590   6.749   3.785  1.00  1.75           H  
ATOM    340  HG3 ARG A  22       7.809   6.282   2.597  1.00  1.90           H  
ATOM    341  HD2 ARG A  22       7.887   8.683   3.072  1.00  1.99           H  
ATOM    342  HD3 ARG A  22       7.463   8.364   1.392  1.00  2.56           H  
ATOM    343  HE  ARG A  22       5.083   8.628   2.815  1.00  2.93           H  
ATOM    344 HH11 ARG A  22       7.844  10.598   1.953  1.00  3.20           H  
ATOM    345 HH12 ARG A  22       6.945  12.080   1.948  1.00  4.13           H  
ATOM    346 HH21 ARG A  22       4.697  12.065   2.429  1.00  4.82           H  
ATOM    347 HH22 ARG A  22       3.898  10.572   2.809  1.00  4.54           H  
ATOM    348  N   TYR A  23       3.231   4.462   1.833  1.00  0.40           N  
ATOM    349  CA  TYR A  23       2.012   4.041   1.167  1.00  0.29           C  
ATOM    350  C   TYR A  23       0.816   4.878   1.603  1.00  0.24           C  
ATOM    351  O   TYR A  23       0.813   5.472   2.682  1.00  0.30           O  
ATOM    352  CB  TYR A  23       1.737   2.561   1.443  1.00  0.28           C  
ATOM    353  CG  TYR A  23       1.473   2.241   2.899  1.00  0.27           C  
ATOM    354  CD1 TYR A  23       0.178   2.074   3.364  1.00  0.26           C  
ATOM    355  CD2 TYR A  23       2.517   2.112   3.805  1.00  0.33           C  
ATOM    356  CE1 TYR A  23      -0.072   1.787   4.690  1.00  0.29           C  
ATOM    357  CE2 TYR A  23       2.277   1.824   5.134  1.00  0.37           C  
ATOM    358  CZ  TYR A  23       0.995   1.643   5.569  1.00  0.35           C  
ATOM    359  OH  TYR A  23       0.735   1.381   6.896  1.00  0.42           O  
ATOM    360  H   TYR A  23       3.171   4.917   2.700  1.00  0.41           H  
ATOM    361  HA  TYR A  23       2.154   4.173   0.106  1.00  0.32           H  
ATOM    362  HB2 TYR A  23       0.874   2.253   0.876  1.00  0.28           H  
ATOM    363  HB3 TYR A  23       2.590   1.984   1.125  1.00  0.34           H  
ATOM    364  HD1 TYR A  23      -0.645   2.170   2.671  1.00  0.26           H  
ATOM    365  HD2 TYR A  23       3.533   2.238   3.458  1.00  0.36           H  
ATOM    366  HE1 TYR A  23      -1.088   1.659   5.031  1.00  0.29           H  
ATOM    367  HE2 TYR A  23       3.102   1.727   5.823  1.00  0.44           H  
ATOM    368  HH  TYR A  23       1.263   1.967   7.451  1.00  0.90           H  
ATOM    369  N   GLU A  24      -0.189   4.916   0.744  1.00  0.20           N  
ATOM    370  CA  GLU A  24      -1.457   5.558   1.045  1.00  0.21           C  
ATOM    371  C   GLU A  24      -2.580   4.557   0.813  1.00  0.19           C  
ATOM    372  O   GLU A  24      -2.654   3.950  -0.256  1.00  0.32           O  
ATOM    373  CB  GLU A  24      -1.672   6.789   0.162  1.00  0.32           C  
ATOM    374  CG  GLU A  24      -0.675   7.906   0.414  1.00  0.49           C  
ATOM    375  CD  GLU A  24      -0.926   9.117  -0.461  1.00  1.22           C  
ATOM    376  OE1 GLU A  24      -1.732   9.988  -0.065  1.00  1.64           O  
ATOM    377  OE2 GLU A  24      -0.317   9.207  -1.547  1.00  1.99           O1-
ATOM    378  H   GLU A  24      -0.077   4.483  -0.130  1.00  0.21           H  
ATOM    379  HA  GLU A  24      -1.449   5.851   2.081  1.00  0.27           H  
ATOM    380  HB2 GLU A  24      -1.594   6.492  -0.873  1.00  0.32           H  
ATOM    381  HB3 GLU A  24      -2.664   7.174   0.340  1.00  0.43           H  
ATOM    382  HG2 GLU A  24      -0.744   8.207   1.448  1.00  0.85           H  
ATOM    383  HG3 GLU A  24       0.319   7.534   0.212  1.00  0.91           H  
HETATM  384  N   MVA A  25      -3.480   4.370   1.788  1.00  0.17           N  
HETATM  385  CN  MVA A  25      -3.451   5.254   2.975  1.00  0.28           C  
HETATM  386  CA  MVA A  25      -4.519   3.335   1.640  1.00  0.18           C  
HETATM  387  CB  MVA A  25      -4.263   2.071   2.520  1.00  0.28           C  
HETATM  388  CG1 MVA A  25      -4.204   2.377   4.011  1.00  0.51           C  
HETATM  389  CG2 MVA A  25      -5.324   1.017   2.245  1.00  0.76           C  
HETATM  390  C   MVA A  25      -5.930   3.872   1.886  1.00  0.25           C  
HETATM  391  O   MVA A  25      -6.282   4.321   2.978  1.00  0.47           O  
HETATM  392  HN1 MVA A  25      -2.604   5.000   3.594  1.00  1.20           H  
HETATM  393  HN2 MVA A  25      -4.362   5.125   3.540  1.00  0.93           H  
HETATM  394  HN3 MVA A  25      -3.368   6.281   2.657  1.00  1.04           H  
HETATM  395  HA  MVA A  25      -4.506   2.993   0.613  1.00  0.17           H  
HETATM  396  HB  MVA A  25      -3.308   1.655   2.234  1.00  0.69           H  
HETATM  397 HG11 MVA A  25      -3.353   3.008   4.214  1.00  1.16           H  
HETATM  398 HG12 MVA A  25      -4.110   1.454   4.565  1.00  1.12           H  
HETATM  399 HG13 MVA A  25      -5.109   2.885   4.308  1.00  1.28           H  
HETATM  400 HG21 MVA A  25      -5.140   0.151   2.862  1.00  1.28           H  
HETATM  401 HG22 MVA A  25      -5.289   0.732   1.205  1.00  1.27           H  
HETATM  402 HG23 MVA A  25      -6.300   1.422   2.474  1.00  1.43           H  
ATOM    403  N   HIS A  26      -6.735   3.809   0.839  1.00  0.17           N  
ATOM    404  CA  HIS A  26      -8.105   4.278   0.882  1.00  0.24           C  
ATOM    405  C   HIS A  26      -9.052   3.092   0.948  1.00  0.32           C  
ATOM    406  O   HIS A  26      -9.022   2.220   0.083  1.00  0.43           O  
ATOM    407  CB  HIS A  26      -8.423   5.114  -0.357  1.00  0.32           C  
ATOM    408  CG  HIS A  26      -7.616   6.369  -0.476  1.00  0.44           C  
ATOM    409  ND1 HIS A  26      -8.120   7.617  -0.183  1.00  0.57           N  
ATOM    410  CD2 HIS A  26      -6.339   6.565  -0.875  1.00  0.55           C  
ATOM    411  CE1 HIS A  26      -7.188   8.525  -0.398  1.00  0.72           C  
ATOM    412  NE2 HIS A  26      -6.099   7.913  -0.818  1.00  0.70           N  
ATOM    413  H   HIS A  26      -6.398   3.407   0.009  1.00  0.22           H  
ATOM    414  HA  HIS A  26      -8.229   4.882   1.765  1.00  0.30           H  
ATOM    415  HB2 HIS A  26      -8.238   4.519  -1.237  1.00  0.33           H  
ATOM    416  HB3 HIS A  26      -9.464   5.390  -0.331  1.00  0.40           H  
ATOM    417  HD1 HIS A  26      -9.027   7.807   0.144  1.00  0.61           H  
ATOM    418  HD2 HIS A  26      -5.636   5.800  -1.177  1.00  0.59           H  
ATOM    419  HE1 HIS A  26      -7.298   9.590  -0.253  1.00  0.87           H  
ATOM    420  HE2 HIS A  26      -5.221   8.343  -0.945  1.00  0.83           H  
ATOM    421  N   CYS A  27      -9.876   3.057   1.973  1.00  0.38           N  
ATOM    422  CA  CYS A  27     -10.831   1.979   2.140  1.00  0.50           C  
ATOM    423  C   CYS A  27     -12.241   2.466   1.842  1.00  0.74           C  
ATOM    424  O   CYS A  27     -12.943   2.962   2.722  1.00  1.38           O  
ATOM    425  CB  CYS A  27     -10.747   1.411   3.554  1.00  0.59           C  
ATOM    426  SG  CYS A  27      -9.173   0.565   3.914  1.00  0.75           S  
ATOM    427  H   CYS A  27      -9.851   3.778   2.635  1.00  0.41           H  
ATOM    428  HA  CYS A  27     -10.576   1.203   1.436  1.00  0.47           H  
ATOM    429  HB2 CYS A  27     -10.858   2.217   4.262  1.00  0.95           H  
ATOM    430  HB3 CYS A  27     -11.546   0.701   3.696  1.00  0.83           H  
HETATM  431  N   NH2 A  28     -12.649   2.335   0.594  1.00  0.99           N  
HETATM  432  HN1 NH2 A  28     -12.034   1.930  -0.056  1.00  1.44           H  
HETATM  433  HN2 NH2 A  28     -13.547   2.647   0.365  1.00  1.11           H  
TER     434      NH2 A  28                                                      
ENDMDL                                                                          
MODEL        8                                                                  
ATOM      1  N   ASN A   1       8.817 -11.632  -3.309  1.00  1.83           N  
ATOM      2  CA  ASN A   1       8.134 -10.777  -2.314  1.00  1.49           C  
ATOM      3  C   ASN A   1       8.497  -9.318  -2.545  1.00  1.11           C  
ATOM      4  O   ASN A   1       9.556  -9.020  -3.095  1.00  1.38           O  
ATOM      5  CB  ASN A   1       8.526 -11.195  -0.893  1.00  1.76           C  
ATOM      6  CG  ASN A   1       7.969 -12.552  -0.512  1.00  2.41           C  
ATOM      7  OD1 ASN A   1       7.811 -13.434  -1.358  1.00  3.13           O  
ATOM      8  ND2 ASN A   1       7.658 -12.725   0.762  1.00  2.72           N  
ATOM      9  H1  ASN A   1       9.846 -11.531  -3.221  1.00  1.62           H  
ATOM     10  H2  ASN A   1       8.535 -11.356  -4.269  1.00  2.41           H  
ATOM     11  H3  ASN A   1       8.562 -12.631  -3.160  1.00  2.27           H  
ATOM     12  HA  ASN A   1       7.068 -10.897  -2.441  1.00  1.51           H  
ATOM     13  HB2 ASN A   1       9.602 -11.240  -0.823  1.00  2.07           H  
ATOM     14  HB3 ASN A   1       8.156 -10.462  -0.191  1.00  1.95           H  
ATOM     15 HD21 ASN A   1       7.805 -11.976   1.382  1.00  2.63           H  
ATOM     16 HD22 ASN A   1       7.283 -13.589   1.035  1.00  3.34           H  
ATOM     17  N   ASP A   2       7.617  -8.416  -2.138  1.00  0.74           N  
ATOM     18  CA  ASP A   2       7.848  -6.988  -2.305  1.00  0.50           C  
ATOM     19  C   ASP A   2       7.046  -6.215  -1.271  1.00  0.36           C  
ATOM     20  O   ASP A   2       5.937  -6.620  -0.929  1.00  0.33           O  
ATOM     21  CB  ASP A   2       7.451  -6.543  -3.716  1.00  0.73           C  
ATOM     22  CG  ASP A   2       7.770  -5.086  -3.979  1.00  1.34           C  
ATOM     23  OD1 ASP A   2       6.865  -4.240  -3.826  1.00  2.21           O  
ATOM     24  OD2 ASP A   2       8.927  -4.780  -4.337  1.00  1.35           O1-
ATOM     25  H   ASP A   2       6.788  -8.713  -1.700  1.00  0.90           H  
ATOM     26  HA  ASP A   2       8.899  -6.796  -2.152  1.00  0.62           H  
ATOM     27  HB2 ASP A   2       7.980  -7.143  -4.439  1.00  1.22           H  
ATOM     28  HB3 ASP A   2       6.390  -6.688  -3.844  1.00  1.02           H  
HETATM   29  N   AIB A   3       7.614  -5.116  -0.774  1.00  0.36           N  
HETATM   30  CA  AIB A   3       6.961  -4.279   0.244  1.00  0.37           C  
HETATM   31  C   AIB A   3       5.558  -3.875  -0.231  1.00  0.33           C  
HETATM   32  O   AIB A   3       4.567  -4.007   0.498  1.00  0.30           O  
HETATM   33  CB1 AIB A   3       7.793  -3.034   0.484  1.00  0.49           C  
HETATM   34  CB2 AIB A   3       6.883  -5.027   1.563  1.00  0.41           C  
HETATM   35  H   AIB A   3       8.501  -4.857  -1.099  1.00  0.41           H  
HETATM   36 HB11 AIB A   3       7.894  -2.485  -0.440  1.00  1.25           H  
HETATM   37 HB12 AIB A   3       8.771  -3.317   0.842  1.00  0.95           H  
HETATM   38 HB13 AIB A   3       7.306  -2.413   1.221  1.00  1.20           H  
HETATM   39 HB21 AIB A   3       7.880  -5.271   1.898  1.00  1.26           H  
HETATM   40 HB22 AIB A   3       6.316  -5.937   1.426  1.00  1.09           H  
HETATM   41 HB23 AIB A   3       6.396  -4.408   2.301  1.00  0.94           H  
ATOM     42  N   CYS A   4       5.481  -3.406  -1.468  1.00  0.37           N  
ATOM     43  CA  CYS A   4       4.225  -2.935  -2.025  1.00  0.40           C  
ATOM     44  C   CYS A   4       3.266  -4.095  -2.241  1.00  0.32           C  
ATOM     45  O   CYS A   4       2.056  -3.942  -2.099  1.00  0.33           O  
ATOM     46  CB  CYS A   4       4.463  -2.200  -3.341  1.00  0.49           C  
ATOM     47  SG  CYS A   4       2.953  -1.516  -4.099  1.00  1.18           S  
ATOM     48  H   CYS A   4       6.290  -3.389  -2.027  1.00  0.41           H  
ATOM     49  HA  CYS A   4       3.787  -2.252  -1.317  1.00  0.43           H  
ATOM     50  HB2 CYS A   4       5.139  -1.379  -3.166  1.00  1.21           H  
ATOM     51  HB3 CYS A   4       4.907  -2.881  -4.049  1.00  1.05           H  
ATOM     52  N   LYS A   5       3.813  -5.259  -2.568  1.00  0.30           N  
ATOM     53  CA  LYS A   5       2.995  -6.443  -2.776  1.00  0.31           C  
ATOM     54  C   LYS A   5       2.386  -6.893  -1.455  1.00  0.20           C  
ATOM     55  O   LYS A   5       1.219  -7.272  -1.404  1.00  0.20           O  
ATOM     56  CB  LYS A   5       3.819  -7.575  -3.392  1.00  0.39           C  
ATOM     57  CG  LYS A   5       2.987  -8.788  -3.788  1.00  0.80           C  
ATOM     58  CD  LYS A   5       3.858  -9.914  -4.314  1.00  1.37           C  
ATOM     59  CE  LYS A   5       3.020 -11.074  -4.829  1.00  2.05           C  
ATOM     60  NZ  LYS A   5       2.145 -11.647  -3.772  1.00  2.62           N1+
ATOM     61  H   LYS A   5       4.787  -5.320  -2.666  1.00  0.32           H  
ATOM     62  HA  LYS A   5       2.197  -6.175  -3.451  1.00  0.38           H  
ATOM     63  HB2 LYS A   5       4.319  -7.203  -4.274  1.00  0.76           H  
ATOM     64  HB3 LYS A   5       4.562  -7.894  -2.676  1.00  0.63           H  
ATOM     65  HG2 LYS A   5       2.445  -9.142  -2.923  1.00  1.40           H  
ATOM     66  HG3 LYS A   5       2.286  -8.497  -4.559  1.00  1.26           H  
ATOM     67  HD2 LYS A   5       4.468  -9.536  -5.121  1.00  1.80           H  
ATOM     68  HD3 LYS A   5       4.494 -10.266  -3.515  1.00  1.90           H  
ATOM     69  HE2 LYS A   5       2.400 -10.720  -5.640  1.00  2.44           H  
ATOM     70  HE3 LYS A   5       3.683 -11.843  -5.192  1.00  2.54           H  
ATOM     71  HZ1 LYS A   5       2.719 -11.967  -2.965  1.00  2.86           H  
ATOM     72  HZ2 LYS A   5       1.617 -12.460  -4.146  1.00  2.84           H  
ATOM     73  HZ3 LYS A   5       1.468 -10.932  -3.439  1.00  3.23           H  
HETATM   74  N   AIB A   6       3.190  -6.831  -0.393  1.00  0.16           N  
HETATM   75  CA  AIB A   6       2.737  -7.159   0.961  1.00  0.16           C  
HETATM   76  C   AIB A   6       1.563  -6.248   1.323  1.00  0.12           C  
HETATM   77  O   AIB A   6       0.525  -6.709   1.798  1.00  0.16           O  
HETATM   78  CB1 AIB A   6       3.865  -6.942   1.947  1.00  0.22           C  
HETATM   79  CB2 AIB A   6       2.331  -8.622   1.048  1.00  0.25           C  
HETATM   80  H   AIB A   6       4.124  -6.557  -0.523  1.00  0.18           H  
HETATM   81 HB11 AIB A   6       3.529  -7.198   2.940  1.00  1.10           H  
HETATM   82 HB12 AIB A   6       4.168  -5.905   1.924  1.00  1.03           H  
HETATM   83 HB13 AIB A   6       4.703  -7.567   1.677  1.00  0.90           H  
HETATM   84 HB21 AIB A   6       1.567  -8.826   0.315  1.00  1.08           H  
HETATM   85 HB22 AIB A   6       1.949  -8.831   2.036  1.00  1.03           H  
HETATM   86 HB23 AIB A   6       3.191  -9.246   0.856  1.00  1.03           H  
ATOM     87  N   LEU A   7       1.734  -4.950   1.080  1.00  0.12           N  
ATOM     88  CA  LEU A   7       0.689  -3.979   1.379  1.00  0.16           C  
ATOM     89  C   LEU A   7      -0.545  -4.233   0.525  1.00  0.17           C  
ATOM     90  O   LEU A   7      -1.672  -4.165   1.007  1.00  0.21           O  
ATOM     91  CB  LEU A   7       1.190  -2.553   1.143  1.00  0.23           C  
ATOM     92  CG  LEU A   7       2.391  -2.125   1.989  1.00  0.28           C  
ATOM     93  CD1 LEU A   7       2.826  -0.719   1.614  1.00  0.38           C  
ATOM     94  CD2 LEU A   7       2.054  -2.192   3.470  1.00  0.35           C  
ATOM     95  H   LEU A   7       2.586  -4.640   0.692  1.00  0.15           H  
ATOM     96  HA  LEU A   7       0.420  -4.091   2.417  1.00  0.19           H  
ATOM     97  HB2 LEU A   7       1.457  -2.460   0.103  1.00  0.25           H  
ATOM     98  HB3 LEU A   7       0.377  -1.874   1.347  1.00  0.28           H  
ATOM     99  HG  LEU A   7       3.218  -2.795   1.798  1.00  0.24           H  
ATOM    100 HD11 LEU A   7       3.689  -0.440   2.201  1.00  1.02           H  
ATOM    101 HD12 LEU A   7       2.019  -0.031   1.812  1.00  0.98           H  
ATOM    102 HD13 LEU A   7       3.079  -0.686   0.565  1.00  1.03           H  
ATOM    103 HD21 LEU A   7       1.207  -1.555   3.671  1.00  1.14           H  
ATOM    104 HD22 LEU A   7       2.903  -1.856   4.047  1.00  0.90           H  
ATOM    105 HD23 LEU A   7       1.813  -3.209   3.742  1.00  1.09           H  
ATOM    106  N   LYS A   8      -0.318  -4.539  -0.742  1.00  0.19           N  
ATOM    107  CA  LYS A   8      -1.401  -4.777  -1.682  1.00  0.27           C  
ATOM    108  C   LYS A   8      -2.231  -5.978  -1.242  1.00  0.25           C  
ATOM    109  O   LYS A   8      -3.455  -5.896  -1.171  1.00  0.31           O  
ATOM    110  CB  LYS A   8      -0.830  -4.997  -3.084  1.00  0.35           C  
ATOM    111  CG  LYS A   8      -1.874  -5.029  -4.188  1.00  1.12           C  
ATOM    112  CD  LYS A   8      -1.215  -5.156  -5.552  1.00  1.10           C  
ATOM    113  CE  LYS A   8      -2.227  -5.048  -6.682  1.00  2.05           C  
ATOM    114  NZ  LYS A   8      -3.202  -6.170  -6.676  1.00  2.55           N1+
ATOM    115  H   LYS A   8       0.609  -4.602  -1.056  1.00  0.20           H  
ATOM    116  HA  LYS A   8      -2.032  -3.904  -1.689  1.00  0.31           H  
ATOM    117  HB2 LYS A   8      -0.136  -4.200  -3.303  1.00  0.78           H  
ATOM    118  HB3 LYS A   8      -0.297  -5.936  -3.097  1.00  1.00           H  
ATOM    119  HG2 LYS A   8      -2.527  -5.875  -4.031  1.00  1.72           H  
ATOM    120  HG3 LYS A   8      -2.447  -4.115  -4.157  1.00  1.60           H  
ATOM    121  HD2 LYS A   8      -0.485  -4.368  -5.662  1.00  1.29           H  
ATOM    122  HD3 LYS A   8      -0.721  -6.115  -5.613  1.00  1.23           H  
ATOM    123  HE2 LYS A   8      -2.765  -4.119  -6.576  1.00  2.55           H  
ATOM    124  HE3 LYS A   8      -1.697  -5.049  -7.623  1.00  2.55           H  
ATOM    125  HZ1 LYS A   8      -3.869  -6.069  -7.468  1.00  2.92           H  
ATOM    126  HZ2 LYS A   8      -3.740  -6.174  -5.787  1.00  2.95           H  
ATOM    127  HZ3 LYS A   8      -2.706  -7.078  -6.771  1.00  2.82           H  
HETATM  128  N   AIB A   9      -1.541  -7.075  -0.922  1.00  0.21           N  
HETATM  129  CA  AIB A   9      -2.179  -8.308  -0.443  1.00  0.24           C  
HETATM  130  C   AIB A   9      -2.922  -8.013   0.866  1.00  0.26           C  
HETATM  131  O   AIB A   9      -4.024  -8.515   1.103  1.00  0.35           O  
HETATM  132  CB1 AIB A   9      -1.121  -9.361  -0.190  1.00  0.23           C  
HETATM  133  CB2 AIB A   9      -3.124  -8.859  -1.496  1.00  0.32           C  
HETATM  134  H   AIB A   9      -0.562  -7.054  -1.005  1.00  0.18           H  
HETATM  135 HB11 AIB A   9      -0.560  -9.534  -1.096  1.00  1.04           H  
HETATM  136 HB12 AIB A   9      -1.596 -10.280   0.121  1.00  0.97           H  
HETATM  137 HB13 AIB A   9      -0.454  -9.021   0.588  1.00  1.10           H  
HETATM  138 HB21 AIB A   9      -3.695  -9.674  -1.077  1.00  1.03           H  
HETATM  139 HB22 AIB A   9      -2.551  -9.217  -2.339  1.00  1.10           H  
HETATM  140 HB23 AIB A   9      -3.791  -8.080  -1.823  1.00  0.99           H  
ATOM    141  N   ARG A  10      -2.293  -7.200   1.708  1.00  0.21           N  
ATOM    142  CA  ARG A  10      -2.844  -6.838   3.006  1.00  0.27           C  
ATOM    143  C   ARG A  10      -4.162  -6.089   2.848  1.00  0.33           C  
ATOM    144  O   ARG A  10      -5.152  -6.393   3.512  1.00  0.44           O  
ATOM    145  CB  ARG A  10      -1.835  -5.972   3.767  1.00  0.28           C  
ATOM    146  CG  ARG A  10      -2.287  -5.556   5.156  1.00  0.37           C  
ATOM    147  CD  ARG A  10      -1.217  -4.735   5.863  1.00  0.46           C  
ATOM    148  NE  ARG A  10       0.054  -5.457   5.954  1.00  1.04           N  
ATOM    149  CZ  ARG A  10       1.183  -4.945   6.442  1.00  1.36           C  
ATOM    150  NH1 ARG A  10       1.210  -3.712   6.936  1.00  1.26           N1+
ATOM    151  NH2 ARG A  10       2.286  -5.683   6.448  1.00  2.18           N  
ATOM    152  H   ARG A  10      -1.419  -6.830   1.446  1.00  0.16           H  
ATOM    153  HA  ARG A  10      -3.019  -7.745   3.559  1.00  0.33           H  
ATOM    154  HB2 ARG A  10      -0.912  -6.522   3.865  1.00  0.30           H  
ATOM    155  HB3 ARG A  10      -1.647  -5.074   3.193  1.00  0.27           H  
ATOM    156  HG2 ARG A  10      -3.183  -4.961   5.067  1.00  0.45           H  
ATOM    157  HG3 ARG A  10      -2.496  -6.442   5.738  1.00  0.42           H  
ATOM    158  HD2 ARG A  10      -1.062  -3.818   5.312  1.00  0.90           H  
ATOM    159  HD3 ARG A  10      -1.560  -4.500   6.861  1.00  1.00           H  
ATOM    160  HE  ARG A  10       0.067  -6.384   5.617  1.00  1.56           H  
ATOM    161 HH11 ARG A  10       2.066  -3.336   7.301  1.00  1.61           H  
ATOM    162 HH12 ARG A  10       0.377  -3.152   6.952  1.00  1.29           H  
ATOM    163 HH21 ARG A  10       2.267  -6.621   6.089  1.00  2.69           H  
ATOM    164 HH22 ARG A  10       3.145  -5.306   6.807  1.00  2.46           H  
ATOM    165  N   TYR A  11      -4.168  -5.123   1.947  1.00  0.31           N  
ATOM    166  CA  TYR A  11      -5.328  -4.276   1.735  1.00  0.39           C  
ATOM    167  C   TYR A  11      -6.149  -4.772   0.549  1.00  0.58           C  
ATOM    168  O   TYR A  11      -6.495  -4.003  -0.344  1.00  0.93           O  
ATOM    169  CB  TYR A  11      -4.871  -2.833   1.516  1.00  0.32           C  
ATOM    170  CG  TYR A  11      -4.171  -2.241   2.718  1.00  0.24           C  
ATOM    171  CD1 TYR A  11      -4.885  -1.891   3.856  1.00  0.27           C  
ATOM    172  CD2 TYR A  11      -2.798  -2.035   2.717  1.00  0.24           C  
ATOM    173  CE1 TYR A  11      -4.250  -1.353   4.958  1.00  0.31           C  
ATOM    174  CE2 TYR A  11      -2.157  -1.497   3.814  1.00  0.24           C  
ATOM    175  CZ  TYR A  11      -2.886  -1.156   4.933  1.00  0.27           C  
ATOM    176  OH  TYR A  11      -2.251  -0.622   6.031  1.00  0.38           O  
ATOM    177  H   TYR A  11      -3.364  -4.979   1.396  1.00  0.29           H  
ATOM    178  HA  TYR A  11      -5.938  -4.319   2.624  1.00  0.44           H  
ATOM    179  HB2 TYR A  11      -4.183  -2.803   0.684  1.00  0.34           H  
ATOM    180  HB3 TYR A  11      -5.726  -2.222   1.293  1.00  0.37           H  
ATOM    181  HD1 TYR A  11      -5.953  -2.045   3.873  1.00  0.33           H  
ATOM    182  HD2 TYR A  11      -2.227  -2.305   1.839  1.00  0.32           H  
ATOM    183  HE1 TYR A  11      -4.824  -1.087   5.833  1.00  0.41           H  
ATOM    184  HE2 TYR A  11      -1.088  -1.346   3.792  1.00  0.29           H  
ATOM    185  HH  TYR A  11      -1.646   0.072   5.748  1.00  0.93           H  
HETATM  186  N   AIB A  12      -6.468  -6.062   0.578  1.00  0.54           N  
HETATM  187  CA  AIB A  12      -7.201  -6.738  -0.506  1.00  0.73           C  
HETATM  188  C   AIB A  12      -8.528  -6.029  -0.808  1.00  0.64           C  
HETATM  189  O   AIB A  12      -8.957  -5.962  -1.963  1.00  1.44           O  
HETATM  190  CB1 AIB A  12      -7.479  -8.172  -0.104  1.00  1.05           C  
HETATM  191  CB2 AIB A  12      -6.354  -6.781  -1.758  1.00  1.04           C  
HETATM  192  H   AIB A  12      -6.190  -6.590   1.357  1.00  0.64           H  
HETATM  193 HB11 AIB A  12      -8.105  -8.183   0.776  1.00  1.35           H  
HETATM  194 HB12 AIB A  12      -6.548  -8.673   0.110  1.00  1.34           H  
HETATM  195 HB13 AIB A  12      -7.985  -8.680  -0.911  1.00  1.69           H  
HETATM  196 HB21 AIB A  12      -5.417  -7.263  -1.537  1.00  1.46           H  
HETATM  197 HB22 AIB A  12      -6.170  -5.775  -2.102  1.00  1.41           H  
HETATM  198 HB23 AIB A  12      -6.872  -7.335  -2.526  1.00  1.18           H  
ATOM    199  N   GLY A  13      -9.171  -5.510   0.223  1.00  0.60           N  
ATOM    200  CA  GLY A  13     -10.452  -4.860   0.036  1.00  0.84           C  
ATOM    201  C   GLY A  13     -10.341  -3.350   0.009  1.00  0.80           C  
ATOM    202  O   GLY A  13     -11.346  -2.648   0.104  1.00  1.24           O  
ATOM    203  H   GLY A  13      -8.777  -5.569   1.117  1.00  1.15           H  
ATOM    204  HA2 GLY A  13     -10.879  -5.195  -0.896  1.00  0.99           H  
ATOM    205  HA3 GLY A  13     -11.109  -5.147   0.843  1.00  1.02           H  
ATOM    206  N   CYS A  14      -9.122  -2.849  -0.114  1.00  0.33           N  
ATOM    207  CA  CYS A  14      -8.885  -1.415  -0.141  1.00  0.29           C  
ATOM    208  C   CYS A  14      -7.885  -1.086  -1.250  1.00  0.34           C  
ATOM    209  O   CYS A  14      -7.467  -1.969  -1.998  1.00  0.62           O  
ATOM    210  CB  CYS A  14      -8.343  -0.947   1.216  1.00  0.25           C  
ATOM    211  SG  CYS A  14      -9.091  -1.770   2.667  1.00  0.39           S  
ATOM    212  H   CYS A  14      -8.356  -3.459  -0.201  1.00  0.23           H  
ATOM    213  HA  CYS A  14      -9.821  -0.918  -0.346  1.00  0.35           H  
ATOM    214  HB2 CYS A  14      -7.285  -1.129   1.248  1.00  0.26           H  
ATOM    215  HB3 CYS A  14      -8.518   0.115   1.316  1.00  0.26           H  
ATOM    216  N   GLU A  15      -7.517   0.180  -1.363  1.00  0.27           N  
ATOM    217  CA  GLU A  15      -6.530   0.612  -2.344  1.00  0.27           C  
ATOM    218  C   GLU A  15      -5.292   1.150  -1.639  1.00  0.21           C  
ATOM    219  O   GLU A  15      -5.417   1.859  -0.639  1.00  0.33           O  
ATOM    220  CB  GLU A  15      -7.110   1.700  -3.245  1.00  0.31           C  
ATOM    221  CG  GLU A  15      -8.340   1.267  -4.012  1.00  0.37           C  
ATOM    222  CD  GLU A  15      -8.778   2.305  -5.015  1.00  0.84           C  
ATOM    223  OE1 GLU A  15      -9.555   3.209  -4.642  1.00  1.65           O  
ATOM    224  OE2 GLU A  15      -8.347   2.222  -6.182  1.00  0.80           O1-
ATOM    225  H   GLU A  15      -7.920   0.849  -0.771  1.00  0.38           H  
ATOM    226  HA  GLU A  15      -6.253  -0.240  -2.943  1.00  0.31           H  
ATOM    227  HB2 GLU A  15      -7.375   2.550  -2.636  1.00  0.31           H  
ATOM    228  HB3 GLU A  15      -6.355   2.001  -3.956  1.00  0.34           H  
ATOM    229  HG2 GLU A  15      -8.120   0.351  -4.537  1.00  0.85           H  
ATOM    230  HG3 GLU A  15      -9.145   1.099  -3.313  1.00  0.82           H  
HETATM  231  N   MVA A  16      -4.085   0.853  -2.155  1.00  0.25           N  
HETATM  232  CN  MVA A  16      -4.006   0.107  -3.433  1.00  0.53           C  
HETATM  233  CA  MVA A  16      -2.850   1.298  -1.483  1.00  0.19           C  
HETATM  234  CB  MVA A  16      -2.271   0.210  -0.526  1.00  0.21           C  
HETATM  235  CG1 MVA A  16      -1.967  -1.098  -1.238  1.00  0.36           C  
HETATM  236  CG2 MVA A  16      -1.023   0.731   0.167  1.00  0.21           C  
HETATM  237  C   MVA A  16      -1.763   1.760  -2.465  1.00  0.24           C  
HETATM  238  O   MVA A  16      -1.197   0.980  -3.237  1.00  0.48           O  
HETATM  239  HN1 MVA A  16      -4.294  -0.920  -3.271  1.00  1.23           H  
HETATM  240  HN2 MVA A  16      -2.991   0.142  -3.806  1.00  1.12           H  
HETATM  241  HN3 MVA A  16      -4.670   0.557  -4.154  1.00  1.12           H  
HETATM  242  HA  MVA A  16      -3.087   2.154  -0.863  1.00  0.20           H  
HETATM  243  HB  MVA A  16      -3.009   0.005   0.235  1.00  0.37           H  
HETATM  244 HG11 MVA A  16      -1.505  -1.784  -0.544  1.00  1.08           H  
HETATM  245 HG12 MVA A  16      -1.295  -0.911  -2.063  1.00  1.13           H  
HETATM  246 HG13 MVA A  16      -2.887  -1.526  -1.609  1.00  1.07           H  
HETATM  247 HG21 MVA A  16      -0.265   0.946  -0.572  1.00  1.05           H  
HETATM  248 HG22 MVA A  16      -0.653  -0.017   0.853  1.00  1.05           H  
HETATM  249 HG23 MVA A  16      -1.264   1.632   0.708  1.00  0.94           H  
ATOM    250  N   ARG A  17      -1.472   3.052  -2.410  1.00  0.23           N  
ATOM    251  CA  ARG A  17      -0.435   3.649  -3.233  1.00  0.27           C  
ATOM    252  C   ARG A  17       0.893   3.565  -2.502  1.00  0.23           C  
ATOM    253  O   ARG A  17       1.120   4.292  -1.534  1.00  0.34           O  
ATOM    254  CB  ARG A  17      -0.753   5.113  -3.528  1.00  0.34           C  
ATOM    255  CG  ARG A  17      -2.121   5.344  -4.142  1.00  1.33           C  
ATOM    256  CD  ARG A  17      -2.421   6.832  -4.258  1.00  1.48           C  
ATOM    257  NE  ARG A  17      -3.792   7.091  -4.687  1.00  2.36           N  
ATOM    258  CZ  ARG A  17      -4.492   8.168  -4.333  1.00  3.00           C  
ATOM    259  NH1 ARG A  17      -3.952   9.090  -3.538  1.00  3.01           N1+
ATOM    260  NH2 ARG A  17      -5.731   8.323  -4.778  1.00  3.96           N  
ATOM    261  H   ARG A  17      -1.961   3.619  -1.774  1.00  0.34           H  
ATOM    262  HA  ARG A  17      -0.373   3.097  -4.158  1.00  0.31           H  
ATOM    263  HB2 ARG A  17      -0.699   5.668  -2.607  1.00  1.08           H  
ATOM    264  HB3 ARG A  17      -0.008   5.495  -4.210  1.00  0.90           H  
ATOM    265  HG2 ARG A  17      -2.142   4.900  -5.127  1.00  2.00           H  
ATOM    266  HG3 ARG A  17      -2.870   4.880  -3.518  1.00  1.97           H  
ATOM    267  HD2 ARG A  17      -2.264   7.294  -3.294  1.00  1.68           H  
ATOM    268  HD3 ARG A  17      -1.741   7.268  -4.976  1.00  1.71           H  
ATOM    269  HE  ARG A  17      -4.214   6.424  -5.282  1.00  2.76           H  
ATOM    270 HH11 ARG A  17      -4.478   9.900  -3.273  1.00  3.63           H  
ATOM    271 HH12 ARG A  17      -3.005   8.982  -3.201  1.00  2.64           H  
ATOM    272 HH21 ARG A  17      -6.141   7.633  -5.382  1.00  4.30           H  
ATOM    273 HH22 ARG A  17      -6.266   9.129  -4.517  1.00  4.48           H  
ATOM    274  N   CYS A  18       1.752   2.675  -2.949  1.00  0.27           N  
ATOM    275  CA  CYS A  18       3.030   2.453  -2.294  1.00  0.31           C  
ATOM    276  C   CYS A  18       4.093   3.425  -2.797  1.00  0.38           C  
ATOM    277  O   CYS A  18       4.250   3.624  -4.000  1.00  0.41           O  
ATOM    278  CB  CYS A  18       3.478   1.012  -2.518  1.00  0.37           C  
ATOM    279  SG  CYS A  18       3.358   0.464  -4.252  1.00  0.47           S  
ATOM    280  H   CYS A  18       1.527   2.149  -3.747  1.00  0.40           H  
ATOM    281  HA  CYS A  18       2.887   2.615  -1.235  1.00  0.33           H  
ATOM    282  HB2 CYS A  18       4.507   0.911  -2.211  1.00  0.45           H  
ATOM    283  HB3 CYS A  18       2.864   0.354  -1.921  1.00  0.37           H  
ATOM    284  N   ASP A  19       4.813   4.029  -1.866  1.00  0.50           N  
ATOM    285  CA  ASP A  19       5.896   4.943  -2.195  1.00  0.68           C  
ATOM    286  C   ASP A  19       7.028   4.762  -1.188  1.00  0.80           C  
ATOM    287  O   ASP A  19       7.094   5.466  -0.176  1.00  0.84           O  
ATOM    288  CB  ASP A  19       5.394   6.389  -2.180  1.00  0.80           C  
ATOM    289  CG  ASP A  19       6.384   7.365  -2.785  1.00  1.11           C  
ATOM    290  OD1 ASP A  19       7.023   8.126  -2.027  1.00  1.76           O  
ATOM    291  OD2 ASP A  19       6.508   7.394  -4.028  1.00  1.10           O1-
ATOM    292  H   ASP A  19       4.610   3.860  -0.918  1.00  0.49           H  
ATOM    293  HA  ASP A  19       6.255   4.697  -3.182  1.00  0.74           H  
ATOM    294  HB2 ASP A  19       4.474   6.447  -2.739  1.00  1.05           H  
ATOM    295  HB3 ASP A  19       5.206   6.683  -1.157  1.00  1.05           H  
HETATM  296  N   DPR A  20       7.931   3.804  -1.445  1.00  0.95           N  
HETATM  297  CA  DPR A  20       8.986   3.437  -0.495  1.00  1.13           C  
HETATM  298  CB  DPR A  20       9.688   2.257  -1.164  1.00  1.31           C  
HETATM  299  CG  DPR A  20       9.384   2.405  -2.615  1.00  1.35           C  
HETATM  300  CD  DPR A  20       8.012   3.012  -2.684  1.00  1.02           C  
HETATM  301  C   DPR A  20       8.402   3.023   0.857  1.00  1.11           C  
HETATM  302  O   DPR A  20       7.575   2.111   0.931  1.00  1.10           O  
HETATM  303  HA  DPR A  20       9.692   4.239  -0.355  1.00  1.22           H  
HETATM  304  HB2 DPR A  20      10.750   2.312  -0.972  1.00  1.44           H  
HETATM  305  HB3 DPR A  20       9.294   1.332  -0.773  1.00  1.39           H  
HETATM  306  HG2 DPR A  20      10.106   3.061  -3.079  1.00  1.54           H  
HETATM  307  HG3 DPR A  20       9.391   1.437  -3.093  1.00  1.59           H  
HETATM  308  HD2 DPR A  20       7.926   3.646  -3.552  1.00  1.05           H  
HETATM  309  HD3 DPR A  20       7.256   2.241  -2.697  1.00  0.93           H  
ATOM    310  N   PRO A  21       8.816   3.697   1.940  1.00  1.18           N  
ATOM    311  CA  PRO A  21       8.299   3.425   3.282  1.00  1.23           C  
ATOM    312  C   PRO A  21       6.907   4.013   3.502  1.00  1.04           C  
ATOM    313  O   PRO A  21       6.226   3.674   4.469  1.00  1.12           O  
ATOM    314  CB  PRO A  21       9.317   4.111   4.191  1.00  1.43           C  
ATOM    315  CG  PRO A  21       9.840   5.240   3.375  1.00  1.40           C  
ATOM    316  CD  PRO A  21       9.838   4.761   1.947  1.00  1.30           C  
ATOM    317  HA  PRO A  21       8.280   2.369   3.493  1.00  1.35           H  
ATOM    318  HB2 PRO A  21       8.826   4.461   5.086  1.00  1.46           H  
ATOM    319  HB3 PRO A  21      10.101   3.417   4.449  1.00  1.61           H  
ATOM    320  HG2 PRO A  21       9.194   6.098   3.484  1.00  1.32           H  
ATOM    321  HG3 PRO A  21      10.845   5.485   3.687  1.00  1.59           H  
ATOM    322  HD2 PRO A  21       9.562   5.563   1.281  1.00  1.23           H  
ATOM    323  HD3 PRO A  21      10.804   4.364   1.682  1.00  1.47           H  
ATOM    324  N   ARG A  22       6.481   4.876   2.592  1.00  0.84           N  
ATOM    325  CA  ARG A  22       5.204   5.557   2.729  1.00  0.70           C  
ATOM    326  C   ARG A  22       4.160   4.889   1.852  1.00  0.52           C  
ATOM    327  O   ARG A  22       4.499   4.226   0.874  1.00  0.54           O  
ATOM    328  CB  ARG A  22       5.337   7.029   2.330  1.00  0.82           C  
ATOM    329  CG  ARG A  22       6.356   7.801   3.154  1.00  1.37           C  
ATOM    330  CD  ARG A  22       6.472   9.247   2.687  1.00  1.91           C  
ATOM    331  NE  ARG A  22       5.221   9.993   2.859  1.00  2.59           N  
ATOM    332  CZ  ARG A  22       4.829  10.991   2.063  1.00  3.29           C  
ATOM    333  NH1 ARG A  22       5.577  11.361   1.030  1.00  3.45           N1+
ATOM    334  NH2 ARG A  22       3.684  11.616   2.301  1.00  4.24           N  
ATOM    335  H   ARG A  22       7.025   5.038   1.789  1.00  0.84           H  
ATOM    336  HA  ARG A  22       4.893   5.490   3.760  1.00  0.71           H  
ATOM    337  HB2 ARG A  22       5.633   7.080   1.293  1.00  1.26           H  
ATOM    338  HB3 ARG A  22       4.376   7.507   2.443  1.00  0.94           H  
ATOM    339  HG2 ARG A  22       6.050   7.790   4.190  1.00  1.75           H  
ATOM    340  HG3 ARG A  22       7.318   7.322   3.056  1.00  1.90           H  
ATOM    341  HD2 ARG A  22       7.250   9.735   3.257  1.00  1.99           H  
ATOM    342  HD3 ARG A  22       6.740   9.252   1.640  1.00  2.56           H  
ATOM    343  HE  ARG A  22       4.647   9.740   3.615  1.00  2.93           H  
ATOM    344 HH11 ARG A  22       6.444  10.891   0.838  1.00  3.20           H  
ATOM    345 HH12 ARG A  22       5.277  12.112   0.435  1.00  4.13           H  
ATOM    346 HH21 ARG A  22       3.387  12.368   1.705  1.00  4.82           H  
ATOM    347 HH22 ARG A  22       3.109  11.340   3.075  1.00  4.54           H  
ATOM    348  N   TYR A  23       2.898   5.047   2.210  1.00  0.40           N  
ATOM    349  CA  TYR A  23       1.816   4.552   1.382  1.00  0.29           C  
ATOM    350  C   TYR A  23       0.508   5.245   1.720  1.00  0.24           C  
ATOM    351  O   TYR A  23       0.306   5.719   2.838  1.00  0.30           O  
ATOM    352  CB  TYR A  23       1.664   3.033   1.520  1.00  0.28           C  
ATOM    353  CG  TYR A  23       1.289   2.551   2.904  1.00  0.27           C  
ATOM    354  CD1 TYR A  23      -0.039   2.354   3.254  1.00  0.26           C  
ATOM    355  CD2 TYR A  23       2.263   2.321   3.866  1.00  0.33           C  
ATOM    356  CE1 TYR A  23      -0.386   1.942   4.525  1.00  0.29           C  
ATOM    357  CE2 TYR A  23       1.924   1.902   5.136  1.00  0.37           C  
ATOM    358  CZ  TYR A  23       0.599   1.616   5.427  1.00  0.35           C  
ATOM    359  OH  TYR A  23       0.262   1.314   6.735  1.00  0.42           O  
ATOM    360  H   TYR A  23       2.688   5.496   3.056  1.00  0.41           H  
ATOM    361  HA  TYR A  23       2.064   4.779   0.356  1.00  0.32           H  
ATOM    362  HB2 TYR A  23       0.899   2.698   0.839  1.00  0.28           H  
ATOM    363  HB3 TYR A  23       2.599   2.567   1.250  1.00  0.34           H  
ATOM    364  HD1 TYR A  23      -0.808   2.529   2.515  1.00  0.26           H  
ATOM    365  HD2 TYR A  23       3.301   2.464   3.608  1.00  0.36           H  
ATOM    366  HE1 TYR A  23      -1.424   1.791   4.777  1.00  0.29           H  
ATOM    367  HE2 TYR A  23       2.697   1.727   5.869  1.00  0.44           H  
ATOM    368  HH  TYR A  23      -0.375   0.591   6.681  1.00  0.90           H  
ATOM    369  N   GLU A  24      -0.366   5.317   0.735  1.00  0.20           N  
ATOM    370  CA  GLU A  24      -1.699   5.854   0.934  1.00  0.21           C  
ATOM    371  C   GLU A  24      -2.709   4.726   0.844  1.00  0.19           C  
ATOM    372  O   GLU A  24      -2.635   3.911  -0.069  1.00  0.32           O  
ATOM    373  CB  GLU A  24      -2.032   6.913  -0.118  1.00  0.32           C  
ATOM    374  CG  GLU A  24      -1.103   8.111  -0.112  1.00  0.49           C  
ATOM    375  CD  GLU A  24      -1.651   9.258  -0.931  1.00  1.22           C  
ATOM    376  OE1 GLU A  24      -2.276  10.163  -0.341  1.00  1.64           O  
ATOM    377  OE2 GLU A  24      -1.472   9.256  -2.168  1.00  1.99           O1-
ATOM    378  H   GLU A  24      -0.109   4.986  -0.153  1.00  0.21           H  
ATOM    379  HA  GLU A  24      -1.743   6.296   1.917  1.00  0.27           H  
ATOM    380  HB2 GLU A  24      -1.987   6.457  -1.094  1.00  0.32           H  
ATOM    381  HB3 GLU A  24      -3.037   7.265   0.054  1.00  0.43           H  
ATOM    382  HG2 GLU A  24      -0.971   8.445   0.907  1.00  0.85           H  
ATOM    383  HG3 GLU A  24      -0.149   7.816  -0.522  1.00  0.91           H  
HETATM  384  N   MVA A  25      -3.670   4.654   1.765  1.00  0.17           N  
HETATM  385  CN  MVA A  25      -3.759   5.701   2.809  1.00  0.28           C  
HETATM  386  CA  MVA A  25      -4.652   3.560   1.706  1.00  0.18           C  
HETATM  387  CB  MVA A  25      -4.342   2.400   2.703  1.00  0.28           C  
HETATM  388  CG1 MVA A  25      -4.290   2.861   4.152  1.00  0.51           C  
HETATM  389  CG2 MVA A  25      -5.363   1.283   2.541  1.00  0.76           C  
HETATM  390  C   MVA A  25      -6.090   4.045   1.891  1.00  0.25           C  
HETATM  391  O   MVA A  25      -6.477   4.577   2.934  1.00  0.47           O  
HETATM  392  HN1 MVA A  25      -3.741   6.676   2.344  1.00  1.20           H  
HETATM  393  HN2 MVA A  25      -2.921   5.610   3.485  1.00  0.93           H  
HETATM  394  HN3 MVA A  25      -4.681   5.584   3.358  1.00  1.04           H  
HETATM  395  HA  MVA A  25      -4.608   3.124   0.716  1.00  0.17           H  
HETATM  396  HB  MVA A  25      -3.372   1.996   2.452  1.00  0.69           H  
HETATM  397 HG11 MVA A  25      -5.220   3.344   4.408  1.00  1.16           H  
HETATM  398 HG12 MVA A  25      -3.474   3.555   4.279  1.00  1.12           H  
HETATM  399 HG13 MVA A  25      -4.140   2.005   4.795  1.00  1.28           H  
HETATM  400 HG21 MVA A  25      -6.356   1.677   2.705  1.00  1.28           H  
HETATM  401 HG22 MVA A  25      -5.162   0.503   3.261  1.00  1.27           H  
HETATM  402 HG23 MVA A  25      -5.297   0.875   1.543  1.00  1.43           H  
ATOM    403  N   HIS A  26      -6.880   3.851   0.849  1.00  0.17           N  
ATOM    404  CA  HIS A  26      -8.283   4.225   0.861  1.00  0.24           C  
ATOM    405  C   HIS A  26      -9.130   2.974   0.941  1.00  0.32           C  
ATOM    406  O   HIS A  26      -8.878   2.009   0.225  1.00  0.43           O  
ATOM    407  CB  HIS A  26      -8.653   5.007  -0.399  1.00  0.32           C  
ATOM    408  CG  HIS A  26      -8.119   6.406  -0.444  1.00  0.44           C  
ATOM    409  ND1 HIS A  26      -8.922   7.516  -0.329  1.00  0.57           N  
ATOM    410  CD2 HIS A  26      -6.859   6.873  -0.612  1.00  0.55           C  
ATOM    411  CE1 HIS A  26      -8.186   8.604  -0.425  1.00  0.72           C  
ATOM    412  NE2 HIS A  26      -6.929   8.245  -0.596  1.00  0.70           N  
ATOM    413  H   HIS A  26      -6.509   3.407   0.051  1.00  0.22           H  
ATOM    414  HA  HIS A  26      -8.465   4.835   1.731  1.00  0.30           H  
ATOM    415  HB2 HIS A  26      -8.271   4.481  -1.257  1.00  0.33           H  
ATOM    416  HB3 HIS A  26      -9.728   5.061  -0.472  1.00  0.40           H  
ATOM    417  HD1 HIS A  26      -9.896   7.507  -0.196  1.00  0.61           H  
ATOM    418  HD2 HIS A  26      -5.966   6.277  -0.737  1.00  0.59           H  
ATOM    419  HE1 HIS A  26      -8.551   9.619  -0.372  1.00  0.87           H  
ATOM    420  HE2 HIS A  26      -6.158   8.846  -0.483  1.00  0.83           H  
ATOM    421  N   CYS A  27     -10.117   2.973   1.810  1.00  0.38           N  
ATOM    422  CA  CYS A  27     -10.963   1.813   1.969  1.00  0.50           C  
ATOM    423  C   CYS A  27     -12.394   2.242   2.270  1.00  0.74           C  
ATOM    424  O   CYS A  27     -12.837   2.228   3.422  1.00  1.38           O  
ATOM    425  CB  CYS A  27     -10.419   0.927   3.086  1.00  0.59           C  
ATOM    426  SG  CYS A  27     -10.873  -0.830   2.934  1.00  0.75           S  
ATOM    427  H   CYS A  27     -10.281   3.770   2.361  1.00  0.41           H  
ATOM    428  HA  CYS A  27     -10.949   1.259   1.043  1.00  0.47           H  
ATOM    429  HB2 CYS A  27      -9.343   0.990   3.090  1.00  0.95           H  
ATOM    430  HB3 CYS A  27     -10.799   1.284   4.030  1.00  0.83           H  
HETATM  431  N   NH2 A  28     -13.111   2.639   1.236  1.00  0.99           N  
HETATM  432  HN1 NH2 A  28     -12.692   2.626   0.346  1.00  1.44           H  
HETATM  433  HN2 NH2 A  28     -14.030   2.931   1.395  1.00  1.11           H  
TER     434      NH2 A  28                                                      
ENDMDL                                                                          
MODEL        9                                                                  
ATOM      1  N   ASN A   1      10.834 -10.626  -0.296  1.00  1.83           N  
ATOM      2  CA  ASN A   1       9.446 -10.119  -0.193  1.00  1.49           C  
ATOM      3  C   ASN A   1       9.390  -8.677  -0.684  1.00  1.11           C  
ATOM      4  O   ASN A   1      10.373  -7.945  -0.578  1.00  1.38           O  
ATOM      5  CB  ASN A   1       8.960 -10.209   1.260  1.00  1.76           C  
ATOM      6  CG  ASN A   1       9.669  -9.230   2.176  1.00  2.41           C  
ATOM      7  OD1 ASN A   1      10.780  -9.488   2.634  1.00  3.13           O  
ATOM      8  ND2 ASN A   1       9.016  -8.117   2.477  1.00  2.72           N  
ATOM      9  H1  ASN A   1      11.156 -10.585  -1.282  1.00  1.62           H  
ATOM     10  H2  ASN A   1      10.881 -11.612   0.033  1.00  2.41           H  
ATOM     11  H3  ASN A   1      11.469 -10.046   0.289  1.00  2.27           H  
ATOM     12  HA  ASN A   1       8.814 -10.729  -0.820  1.00  1.51           H  
ATOM     13  HB2 ASN A   1       7.903 -10.002   1.294  1.00  2.07           H  
ATOM     14  HB3 ASN A   1       9.137 -11.209   1.629  1.00  1.95           H  
ATOM     15 HD21 ASN A   1       8.119  -7.990   2.102  1.00  2.63           H  
ATOM     16 HD22 ASN A   1       9.461  -7.460   3.057  1.00  3.34           H  
ATOM     17  N   ASP A   2       8.249  -8.273  -1.228  1.00  0.74           N  
ATOM     18  CA  ASP A   2       8.103  -6.932  -1.785  1.00  0.50           C  
ATOM     19  C   ASP A   2       7.156  -6.086  -0.946  1.00  0.36           C  
ATOM     20  O   ASP A   2       6.074  -6.545  -0.565  1.00  0.33           O  
ATOM     21  CB  ASP A   2       7.595  -7.001  -3.225  1.00  0.73           C  
ATOM     22  CG  ASP A   2       7.445  -5.630  -3.847  1.00  1.34           C  
ATOM     23  OD1 ASP A   2       6.307  -5.126  -3.918  1.00  2.21           O  
ATOM     24  OD2 ASP A   2       8.467  -5.048  -4.264  1.00  1.35           O1-
ATOM     25  H   ASP A   2       7.484  -8.889  -1.255  1.00  0.90           H  
ATOM     26  HA  ASP A   2       9.075  -6.467  -1.781  1.00  0.62           H  
ATOM     27  HB2 ASP A   2       8.293  -7.571  -3.820  1.00  1.22           H  
ATOM     28  HB3 ASP A   2       6.634  -7.491  -3.238  1.00  1.02           H  
HETATM   29  N   AIB A   3       7.576  -4.850  -0.671  1.00  0.36           N  
HETATM   30  CA  AIB A   3       6.809  -3.903   0.149  1.00  0.37           C  
HETATM   31  C   AIB A   3       5.414  -3.685  -0.454  1.00  0.33           C  
HETATM   32  O   AIB A   3       4.398  -3.895   0.213  1.00  0.30           O  
HETATM   33  CB1 AIB A   3       7.543  -2.578   0.210  1.00  0.49           C  
HETATM   34  CB2 AIB A   3       6.697  -4.417   1.577  1.00  0.41           C  
HETATM   35  H   AIB A   3       8.441  -4.559  -1.036  1.00  0.41           H  
HETATM   36 HB11 AIB A   3       7.664  -2.187  -0.789  1.00  1.25           H  
HETATM   37 HB12 AIB A   3       8.513  -2.725   0.660  1.00  0.95           H  
HETATM   38 HB13 AIB A   3       6.973  -1.878   0.804  1.00  1.20           H  
HETATM   39 HB21 AIB A   3       6.138  -3.710   2.173  1.00  1.26           H  
HETATM   40 HB22 AIB A   3       7.685  -4.537   1.993  1.00  1.09           H  
HETATM   41 HB23 AIB A   3       6.188  -5.369   1.576  1.00  0.94           H  
ATOM     42  N   CYS A   4       5.370  -3.286  -1.722  1.00  0.37           N  
ATOM     43  CA  CYS A   4       4.110  -2.937  -2.368  1.00  0.40           C  
ATOM     44  C   CYS A   4       3.183  -4.143  -2.462  1.00  0.32           C  
ATOM     45  O   CYS A   4       1.978  -4.025  -2.232  1.00  0.33           O  
ATOM     46  CB  CYS A   4       4.357  -2.353  -3.758  1.00  0.49           C  
ATOM     47  SG  CYS A   4       5.294  -0.788  -3.758  1.00  1.18           S  
ATOM     48  H   CYS A   4       6.203  -3.239  -2.242  1.00  0.41           H  
ATOM     49  HA  CYS A   4       3.632  -2.187  -1.758  1.00  0.43           H  
ATOM     50  HB2 CYS A   4       4.912  -3.065  -4.344  1.00  1.21           H  
ATOM     51  HB3 CYS A   4       3.407  -2.168  -4.234  1.00  1.05           H  
ATOM     52  N   LYS A   5       3.746  -5.301  -2.783  1.00  0.30           N  
ATOM     53  CA  LYS A   5       2.960  -6.521  -2.875  1.00  0.31           C  
ATOM     54  C   LYS A   5       2.383  -6.890  -1.512  1.00  0.20           C  
ATOM     55  O   LYS A   5       1.215  -7.266  -1.409  1.00  0.20           O  
ATOM     56  CB  LYS A   5       3.810  -7.669  -3.423  1.00  0.39           C  
ATOM     57  CG  LYS A   5       3.029  -8.959  -3.637  1.00  0.80           C  
ATOM     58  CD  LYS A   5       3.897 -10.037  -4.265  1.00  1.37           C  
ATOM     59  CE  LYS A   5       3.120 -11.328  -4.468  1.00  2.05           C  
ATOM     60  NZ  LYS A   5       2.664 -11.911  -3.180  1.00  2.62           N1+
ATOM     61  H   LYS A   5       4.714  -5.331  -2.974  1.00  0.32           H  
ATOM     62  HA  LYS A   5       2.143  -6.332  -3.554  1.00  0.38           H  
ATOM     63  HB2 LYS A   5       4.235  -7.367  -4.370  1.00  0.76           H  
ATOM     64  HB3 LYS A   5       4.611  -7.872  -2.728  1.00  0.63           H  
ATOM     65  HG2 LYS A   5       2.666  -9.312  -2.684  1.00  1.40           H  
ATOM     66  HG3 LYS A   5       2.192  -8.758  -4.291  1.00  1.26           H  
ATOM     67  HD2 LYS A   5       4.253  -9.687  -5.223  1.00  1.80           H  
ATOM     68  HD3 LYS A   5       4.737 -10.229  -3.615  1.00  1.90           H  
ATOM     69  HE2 LYS A   5       2.259 -11.123  -5.084  1.00  2.44           H  
ATOM     70  HE3 LYS A   5       3.757 -12.043  -4.969  1.00  2.54           H  
ATOM     71  HZ1 LYS A   5       2.156 -12.802  -3.351  1.00  2.86           H  
ATOM     72  HZ2 LYS A   5       2.024 -11.252  -2.694  1.00  2.84           H  
ATOM     73  HZ3 LYS A   5       3.479 -12.102  -2.562  1.00  3.23           H  
HETATM   74  N   AIB A   6       3.210  -6.757  -0.472  1.00  0.16           N  
HETATM   75  CA  AIB A   6       2.794  -7.039   0.907  1.00  0.16           C  
HETATM   76  C   AIB A   6       1.620  -6.136   1.273  1.00  0.12           C  
HETATM   77  O   AIB A   6       0.619  -6.587   1.832  1.00  0.16           O  
HETATM   78  CB1 AIB A   6       3.941  -6.766   1.856  1.00  0.22           C  
HETATM   79  CB2 AIB A   6       2.412  -8.502   1.060  1.00  0.25           C  
HETATM   80  H   AIB A   6       4.130  -6.449  -0.635  1.00  0.18           H  
HETATM   81 HB11 AIB A   6       3.665  -7.070   2.854  1.00  1.10           H  
HETATM   82 HB12 AIB A   6       4.164  -5.709   1.852  1.00  1.03           H  
HETATM   83 HB13 AIB A   6       4.811  -7.317   1.539  1.00  0.90           H  
HETATM   84 HB21 AIB A   6       2.086  -8.685   2.073  1.00  1.08           H  
HETATM   85 HB22 AIB A   6       3.266  -9.123   0.839  1.00  1.03           H  
HETATM   86 HB23 AIB A   6       1.611  -8.737   0.376  1.00  1.03           H  
ATOM     87  N   LEU A   7       1.753  -4.857   0.942  1.00  0.12           N  
ATOM     88  CA  LEU A   7       0.728  -3.877   1.260  1.00  0.16           C  
ATOM     89  C   LEU A   7      -0.551  -4.177   0.500  1.00  0.17           C  
ATOM     90  O   LEU A   7      -1.645  -4.084   1.048  1.00  0.21           O  
ATOM     91  CB  LEU A   7       1.213  -2.468   0.927  1.00  0.23           C  
ATOM     92  CG  LEU A   7       2.478  -2.026   1.664  1.00  0.28           C  
ATOM     93  CD1 LEU A   7       2.923  -0.661   1.174  1.00  0.38           C  
ATOM     94  CD2 LEU A   7       2.242  -1.998   3.165  1.00  0.35           C  
ATOM     95  H   LEU A   7       2.564  -4.566   0.466  1.00  0.15           H  
ATOM     96  HA  LEU A   7       0.526  -3.939   2.317  1.00  0.19           H  
ATOM     97  HB2 LEU A   7       1.399  -2.416  -0.134  1.00  0.25           H  
ATOM     98  HB3 LEU A   7       0.422  -1.774   1.169  1.00  0.28           H  
ATOM     99  HG  LEU A   7       3.272  -2.730   1.460  1.00  0.24           H  
ATOM    100 HD11 LEU A   7       3.797  -0.348   1.725  1.00  1.02           H  
ATOM    101 HD12 LEU A   7       2.126   0.048   1.329  1.00  0.98           H  
ATOM    102 HD13 LEU A   7       3.159  -0.714   0.122  1.00  1.03           H  
ATOM    103 HD21 LEU A   7       3.128  -1.630   3.662  1.00  1.14           H  
ATOM    104 HD22 LEU A   7       2.021  -2.994   3.515  1.00  0.90           H  
ATOM    105 HD23 LEU A   7       1.410  -1.346   3.385  1.00  1.09           H  
ATOM    106  N   LYS A   8      -0.406  -4.556  -0.758  1.00  0.19           N  
ATOM    107  CA  LYS A   8      -1.555  -4.896  -1.577  1.00  0.27           C  
ATOM    108  C   LYS A   8      -2.293  -6.083  -0.975  1.00  0.25           C  
ATOM    109  O   LYS A   8      -3.494  -6.015  -0.754  1.00  0.31           O  
ATOM    110  CB  LYS A   8      -1.125  -5.205  -3.010  1.00  0.35           C  
ATOM    111  CG  LYS A   8      -2.294  -5.473  -3.946  1.00  1.12           C  
ATOM    112  CD  LYS A   8      -1.824  -5.770  -5.360  1.00  1.10           C  
ATOM    113  CE  LYS A   8      -0.999  -7.044  -5.422  1.00  2.05           C  
ATOM    114  NZ  LYS A   8      -0.501  -7.314  -6.796  1.00  2.55           N1+
ATOM    115  H   LYS A   8       0.496  -4.603  -1.147  1.00  0.20           H  
ATOM    116  HA  LYS A   8      -2.216  -4.046  -1.582  1.00  0.31           H  
ATOM    117  HB2 LYS A   8      -0.568  -4.364  -3.394  1.00  0.78           H  
ATOM    118  HB3 LYS A   8      -0.489  -6.077  -3.003  1.00  1.00           H  
ATOM    119  HG2 LYS A   8      -2.850  -6.323  -3.578  1.00  1.72           H  
ATOM    120  HG3 LYS A   8      -2.934  -4.604  -3.964  1.00  1.60           H  
ATOM    121  HD2 LYS A   8      -2.688  -5.882  -5.997  1.00  1.29           H  
ATOM    122  HD3 LYS A   8      -1.223  -4.942  -5.709  1.00  1.23           H  
ATOM    123  HE2 LYS A   8      -0.154  -6.946  -4.758  1.00  2.55           H  
ATOM    124  HE3 LYS A   8      -1.614  -7.872  -5.103  1.00  2.55           H  
ATOM    125  HZ1 LYS A   8       0.138  -6.550  -7.103  1.00  2.92           H  
ATOM    126  HZ2 LYS A   8      -1.299  -7.371  -7.461  1.00  2.95           H  
ATOM    127  HZ3 LYS A   8       0.018  -8.212  -6.818  1.00  2.82           H  
HETATM  128  N   AIB A   9      -1.554  -7.151  -0.676  1.00  0.21           N  
HETATM  129  CA  AIB A   9      -2.130  -8.358  -0.069  1.00  0.24           C  
HETATM  130  C   AIB A   9      -2.789  -7.988   1.265  1.00  0.26           C  
HETATM  131  O   AIB A   9      -3.818  -8.548   1.648  1.00  0.35           O  
HETATM  132  CB1 AIB A   9      -1.039  -9.378   0.172  1.00  0.23           C  
HETATM  133  CB2 AIB A   9      -3.143  -8.988  -1.008  1.00  0.32           C  
HETATM  134  H   AIB A   9      -0.589  -7.127  -0.865  1.00  0.18           H  
HETATM  135 HB11 AIB A   9      -0.531  -9.590  -0.756  1.00  1.04           H  
HETATM  136 HB12 AIB A   9      -1.476 -10.287   0.557  1.00  0.97           H  
HETATM  137 HB13 AIB A   9      -0.333  -8.988   0.890  1.00  1.10           H  
HETATM  138 HB21 AIB A   9      -3.562  -9.871  -0.548  1.00  1.03           H  
HETATM  139 HB22 AIB A   9      -2.654  -9.261  -1.931  1.00  1.10           H  
HETATM  140 HB23 AIB A   9      -3.931  -8.280  -1.215  1.00  0.99           H  
ATOM    141  N   ARG A  10      -2.181  -7.038   1.963  1.00  0.21           N  
ATOM    142  CA  ARG A  10      -2.677  -6.589   3.254  1.00  0.27           C  
ATOM    143  C   ARG A  10      -3.967  -5.784   3.095  1.00  0.33           C  
ATOM    144  O   ARG A  10      -4.847  -5.823   3.956  1.00  0.44           O  
ATOM    145  CB  ARG A  10      -1.608  -5.734   3.943  1.00  0.28           C  
ATOM    146  CG  ARG A  10      -1.888  -5.445   5.407  1.00  0.37           C  
ATOM    147  CD  ARG A  10      -0.784  -4.593   6.024  1.00  0.46           C  
ATOM    148  NE  ARG A  10       0.544  -5.185   5.841  1.00  1.04           N  
ATOM    149  CZ  ARG A  10       1.691  -4.524   6.018  1.00  1.36           C  
ATOM    150  NH1 ARG A  10       1.685  -3.261   6.427  1.00  1.26           N1+
ATOM    151  NH2 ARG A  10       2.849  -5.132   5.800  1.00  2.18           N  
ATOM    152  H   ARG A  10      -1.360  -6.633   1.601  1.00  0.16           H  
ATOM    153  HA  ARG A  10      -2.877  -7.459   3.857  1.00  0.33           H  
ATOM    154  HB2 ARG A  10      -0.661  -6.244   3.876  1.00  0.30           H  
ATOM    155  HB3 ARG A  10      -1.534  -4.791   3.422  1.00  0.27           H  
ATOM    156  HG2 ARG A  10      -2.826  -4.915   5.484  1.00  0.45           H  
ATOM    157  HG3 ARG A  10      -1.955  -6.379   5.944  1.00  0.42           H  
ATOM    158  HD2 ARG A  10      -0.798  -3.619   5.557  1.00  0.90           H  
ATOM    159  HD3 ARG A  10      -0.980  -4.486   7.080  1.00  1.00           H  
ATOM    160  HE  ARG A  10       0.583  -6.130   5.562  1.00  1.56           H  
ATOM    161 HH11 ARG A  10       2.552  -2.769   6.556  1.00  1.61           H  
ATOM    162 HH12 ARG A  10       0.818  -2.795   6.621  1.00  1.29           H  
ATOM    163 HH21 ARG A  10       2.868  -6.091   5.501  1.00  2.69           H  
ATOM    164 HH22 ARG A  10       3.713  -4.638   5.939  1.00  2.46           H  
ATOM    165  N   TYR A  11      -4.077  -5.062   1.987  1.00  0.31           N  
ATOM    166  CA  TYR A  11      -5.206  -4.168   1.763  1.00  0.39           C  
ATOM    167  C   TYR A  11      -5.949  -4.503   0.470  1.00  0.58           C  
ATOM    168  O   TYR A  11      -6.356  -3.607  -0.260  1.00  0.93           O  
ATOM    169  CB  TYR A  11      -4.713  -2.723   1.707  1.00  0.32           C  
ATOM    170  CG  TYR A  11      -4.017  -2.271   2.968  1.00  0.24           C  
ATOM    171  CD1 TYR A  11      -4.729  -2.088   4.146  1.00  0.27           C  
ATOM    172  CD2 TYR A  11      -2.651  -2.023   2.980  1.00  0.24           C  
ATOM    173  CE1 TYR A  11      -4.100  -1.672   5.301  1.00  0.31           C  
ATOM    174  CE2 TYR A  11      -2.014  -1.606   4.132  1.00  0.24           C  
ATOM    175  CZ  TYR A  11      -2.731  -1.445   5.289  1.00  0.27           C  
ATOM    176  OH  TYR A  11      -2.112  -1.015   6.442  1.00  0.38           O  
ATOM    177  H   TYR A  11      -3.370  -5.122   1.303  1.00  0.29           H  
ATOM    178  HA  TYR A  11      -5.885  -4.273   2.594  1.00  0.44           H  
ATOM    179  HB2 TYR A  11      -4.013  -2.621   0.890  1.00  0.34           H  
ATOM    180  HB3 TYR A  11      -5.553  -2.071   1.538  1.00  0.37           H  
ATOM    181  HD1 TYR A  11      -5.794  -2.275   4.151  1.00  0.33           H  
ATOM    182  HD2 TYR A  11      -2.086  -2.159   2.071  1.00  0.32           H  
ATOM    183  HE1 TYR A  11      -4.674  -1.537   6.206  1.00  0.41           H  
ATOM    184  HE2 TYR A  11      -0.950  -1.419   4.122  1.00  0.29           H  
ATOM    185  HH  TYR A  11      -1.586  -0.225   6.250  1.00  0.93           H  
HETATM  186  N   AIB A  12      -6.142  -5.796   0.216  1.00  0.54           N  
HETATM  187  CA  AIB A  12      -6.849  -6.275  -0.988  1.00  0.73           C  
HETATM  188  C   AIB A  12      -8.256  -5.669  -1.069  1.00  0.64           C  
HETATM  189  O   AIB A  12      -8.795  -5.467  -2.161  1.00  1.44           O  
HETATM  190  CB1 AIB A  12      -6.960  -7.783  -0.939  1.00  1.05           C  
HETATM  191  CB2 AIB A  12      -6.066  -5.925  -2.239  1.00  1.04           C  
HETATM  192  H   AIB A  12      -5.788  -6.455   0.848  1.00  0.64           H  
HETATM  193 HB11 AIB A  12      -5.977  -8.214  -0.824  1.00  1.35           H  
HETATM  194 HB12 AIB A  12      -7.404  -8.141  -1.856  1.00  1.34           H  
HETATM  195 HB13 AIB A  12      -7.579  -8.070  -0.105  1.00  1.69           H  
HETATM  196 HB21 AIB A  12      -5.999  -4.850  -2.332  1.00  1.46           H  
HETATM  197 HB22 AIB A  12      -6.568  -6.331  -3.105  1.00  1.41           H  
HETATM  198 HB23 AIB A  12      -5.072  -6.342  -2.171  1.00  1.18           H  
ATOM    199  N   GLY A  13      -8.844  -5.387   0.085  1.00  0.60           N  
ATOM    200  CA  GLY A  13     -10.178  -4.818   0.120  1.00  0.84           C  
ATOM    201  C   GLY A  13     -10.169  -3.301   0.098  1.00  0.80           C  
ATOM    202  O   GLY A  13     -11.183  -2.663   0.376  1.00  1.24           O  
ATOM    203  H   GLY A  13      -8.369  -5.569   0.923  1.00  1.15           H  
ATOM    204  HA2 GLY A  13     -10.728  -5.175  -0.736  1.00  0.99           H  
ATOM    205  HA3 GLY A  13     -10.676  -5.151   1.018  1.00  1.02           H  
ATOM    206  N   CYS A  14      -9.020  -2.724  -0.223  1.00  0.33           N  
ATOM    207  CA  CYS A  14      -8.868  -1.279  -0.282  1.00  0.29           C  
ATOM    208  C   CYS A  14      -7.895  -0.911  -1.402  1.00  0.34           C  
ATOM    209  O   CYS A  14      -7.356  -1.788  -2.077  1.00  0.62           O  
ATOM    210  CB  CYS A  14      -8.346  -0.754   1.062  1.00  0.25           C  
ATOM    211  SG  CYS A  14      -9.350  -1.242   2.509  1.00  0.39           S  
ATOM    212  H   CYS A  14      -8.240  -3.289  -0.425  1.00  0.23           H  
ATOM    213  HA  CYS A  14      -9.832  -0.842  -0.488  1.00  0.35           H  
ATOM    214  HB2 CYS A  14      -7.348  -1.127   1.217  1.00  0.26           H  
ATOM    215  HB3 CYS A  14      -8.317   0.326   1.031  1.00  0.26           H  
ATOM    216  N   GLU A  15      -7.697   0.381  -1.619  1.00  0.27           N  
ATOM    217  CA  GLU A  15      -6.710   0.853  -2.579  1.00  0.27           C  
ATOM    218  C   GLU A  15      -5.444   1.286  -1.849  1.00  0.21           C  
ATOM    219  O   GLU A  15      -5.527   1.979  -0.837  1.00  0.33           O  
ATOM    220  CB  GLU A  15      -7.267   2.026  -3.388  1.00  0.31           C  
ATOM    221  CG  GLU A  15      -8.348   1.630  -4.374  1.00  0.37           C  
ATOM    222  CD  GLU A  15      -7.821   0.742  -5.479  1.00  0.84           C  
ATOM    223  OE1 GLU A  15      -8.030  -0.486  -5.417  1.00  1.65           O  
ATOM    224  OE2 GLU A  15      -7.187   1.260  -6.419  1.00  0.80           O1-
ATOM    225  H   GLU A  15      -8.232   1.039  -1.125  1.00  0.38           H  
ATOM    226  HA  GLU A  15      -6.476   0.040  -3.245  1.00  0.31           H  
ATOM    227  HB2 GLU A  15      -7.681   2.754  -2.706  1.00  0.31           H  
ATOM    228  HB3 GLU A  15      -6.457   2.481  -3.938  1.00  0.34           H  
ATOM    229  HG2 GLU A  15      -9.124   1.098  -3.845  1.00  0.85           H  
ATOM    230  HG3 GLU A  15      -8.761   2.524  -4.815  1.00  0.82           H  
HETATM  231  N   MVA A  16      -4.257   0.900  -2.346  1.00  0.25           N  
HETATM  232  CN  MVA A  16      -4.214   0.137  -3.614  1.00  0.53           C  
HETATM  233  CA  MVA A  16      -3.006   1.266  -1.652  1.00  0.19           C  
HETATM  234  CB  MVA A  16      -2.470   0.115  -0.741  1.00  0.21           C  
HETATM  235  CG1 MVA A  16      -2.104  -1.138  -1.522  1.00  0.36           C  
HETATM  236  CG2 MVA A  16      -1.277   0.595   0.069  1.00  0.21           C  
HETATM  237  C   MVA A  16      -1.904   1.735  -2.613  1.00  0.24           C  
HETATM  238  O   MVA A  16      -1.405   0.988  -3.457  1.00  0.48           O  
HETATM  239  HN1 MVA A  16      -3.193   0.071  -3.960  1.00  1.23           H  
HETATM  240  HN2 MVA A  16      -4.814   0.640  -4.358  1.00  1.12           H  
HETATM  241  HN3 MVA A  16      -4.601  -0.858  -3.449  1.00  1.12           H  
HETATM  242  HA  MVA A  16      -3.213   2.102  -0.995  1.00  0.20           H  
HETATM  243  HB  MVA A  16      -3.253  -0.151  -0.046  1.00  0.37           H  
HETATM  244 HG11 MVA A  16      -2.986  -1.532  -2.004  1.00  1.08           H  
HETATM  245 HG12 MVA A  16      -1.702  -1.876  -0.843  1.00  1.13           H  
HETATM  246 HG13 MVA A  16      -1.362  -0.891  -2.267  1.00  1.07           H  
HETATM  247 HG21 MVA A  16      -0.494   0.920  -0.602  1.00  1.05           H  
HETATM  248 HG22 MVA A  16      -0.910  -0.212   0.685  1.00  1.05           H  
HETATM  249 HG23 MVA A  16      -1.577   1.421   0.696  1.00  0.94           H  
ATOM    250  N   ARG A  17      -1.531   2.995  -2.464  1.00  0.23           N  
ATOM    251  CA  ARG A  17      -0.482   3.594  -3.271  1.00  0.27           C  
ATOM    252  C   ARG A  17       0.816   3.597  -2.484  1.00  0.23           C  
ATOM    253  O   ARG A  17       0.991   4.402  -1.569  1.00  0.34           O  
ATOM    254  CB  ARG A  17      -0.844   5.031  -3.653  1.00  0.34           C  
ATOM    255  CG  ARG A  17      -2.183   5.171  -4.360  1.00  1.33           C  
ATOM    256  CD  ARG A  17      -2.512   6.636  -4.628  1.00  1.48           C  
ATOM    257  NE  ARG A  17      -3.841   6.813  -5.217  1.00  2.36           N  
ATOM    258  CZ  ARG A  17      -4.377   8.001  -5.498  1.00  3.00           C  
ATOM    259  NH1 ARG A  17      -3.703   9.116  -5.233  1.00  3.01           N1+
ATOM    260  NH2 ARG A  17      -5.593   8.071  -6.031  1.00  3.96           N  
ATOM    261  H   ARG A  17      -1.963   3.537  -1.768  1.00  0.34           H  
ATOM    262  HA  ARG A  17      -0.358   3.002  -4.164  1.00  0.31           H  
ATOM    263  HB2 ARG A  17      -0.873   5.628  -2.755  1.00  1.08           H  
ATOM    264  HB3 ARG A  17      -0.076   5.418  -4.305  1.00  0.90           H  
ATOM    265  HG2 ARG A  17      -2.139   4.641  -5.299  1.00  2.00           H  
ATOM    266  HG3 ARG A  17      -2.955   4.744  -3.738  1.00  1.97           H  
ATOM    267  HD2 ARG A  17      -2.472   7.176  -3.694  1.00  1.68           H  
ATOM    268  HD3 ARG A  17      -1.773   7.039  -5.305  1.00  1.71           H  
ATOM    269  HE  ARG A  17      -4.364   6.001  -5.407  1.00  2.76           H  
ATOM    270 HH11 ARG A  17      -4.104  10.010  -5.445  1.00  3.63           H  
ATOM    271 HH12 ARG A  17      -2.791   9.068  -4.816  1.00  2.64           H  
ATOM    272 HH21 ARG A  17      -6.111   7.232  -6.221  1.00  4.30           H  
ATOM    273 HH22 ARG A  17      -5.999   8.963  -6.248  1.00  4.48           H  
ATOM    274  N   CYS A  18       1.714   2.689  -2.818  1.00  0.27           N  
ATOM    275  CA  CYS A  18       2.971   2.586  -2.096  1.00  0.31           C  
ATOM    276  C   CYS A  18       3.962   3.643  -2.572  1.00  0.38           C  
ATOM    277  O   CYS A  18       4.216   3.788  -3.770  1.00  0.41           O  
ATOM    278  CB  CYS A  18       3.566   1.181  -2.233  1.00  0.37           C  
ATOM    279  SG  CYS A  18       3.863   0.640  -3.948  1.00  0.47           S  
ATOM    280  H   CYS A  18       1.531   2.080  -3.561  1.00  0.40           H  
ATOM    281  HA  CYS A  18       2.757   2.769  -1.054  1.00  0.33           H  
ATOM    282  HB2 CYS A  18       4.513   1.149  -1.714  1.00  0.45           H  
ATOM    283  HB3 CYS A  18       2.892   0.469  -1.777  1.00  0.37           H  
ATOM    284  N   ASP A  19       4.499   4.385  -1.617  1.00  0.50           N  
ATOM    285  CA  ASP A  19       5.472   5.429  -1.887  1.00  0.68           C  
ATOM    286  C   ASP A  19       6.721   5.164  -1.055  1.00  0.80           C  
ATOM    287  O   ASP A  19       6.783   5.518   0.129  1.00  0.84           O  
ATOM    288  CB  ASP A  19       4.888   6.806  -1.554  1.00  0.80           C  
ATOM    289  CG  ASP A  19       5.818   7.946  -1.923  1.00  1.11           C  
ATOM    290  OD1 ASP A  19       6.442   8.538  -1.014  1.00  1.76           O  
ATOM    291  OD2 ASP A  19       5.928   8.264  -3.125  1.00  1.10           O1-
ATOM    292  H   ASP A  19       4.248   4.210  -0.685  1.00  0.49           H  
ATOM    293  HA  ASP A  19       5.726   5.390  -2.934  1.00  0.74           H  
ATOM    294  HB2 ASP A  19       3.961   6.936  -2.093  1.00  1.05           H  
ATOM    295  HB3 ASP A  19       4.692   6.855  -0.495  1.00  1.05           H  
HETATM  296  N   DPR A  20       7.727   4.514  -1.650  1.00  0.95           N  
HETATM  297  CA  DPR A  20       8.897   4.049  -0.912  1.00  1.13           C  
HETATM  298  CB  DPR A  20       9.780   3.395  -1.975  1.00  1.31           C  
HETATM  299  CG  DPR A  20       9.275   3.911  -3.279  1.00  1.35           C  
HETATM  300  CD  DPR A  20       7.812   4.185  -3.080  1.00  1.02           C  
HETATM  301  C   DPR A  20       8.481   3.034   0.149  1.00  1.11           C  
HETATM  302  O   DPR A  20       7.768   2.073  -0.150  1.00  1.10           O  
HETATM  303  HA  DPR A  20       9.429   4.864  -0.452  1.00  1.22           H  
HETATM  304  HB2 DPR A  20      10.809   3.677  -1.809  1.00  1.44           H  
HETATM  305  HB3 DPR A  20       9.683   2.324  -1.912  1.00  1.39           H  
HETATM  306  HG2 DPR A  20       9.793   4.823  -3.541  1.00  1.54           H  
HETATM  307  HG3 DPR A  20       9.416   3.166  -4.049  1.00  1.59           H  
HETATM  308  HD2 DPR A  20       7.500   5.019  -3.688  1.00  1.05           H  
HETATM  309  HD3 DPR A  20       7.227   3.307  -3.308  1.00  0.93           H  
ATOM    310  N   PRO A  21       8.908   3.235   1.401  1.00  1.18           N  
ATOM    311  CA  PRO A  21       8.496   2.388   2.517  1.00  1.23           C  
ATOM    312  C   PRO A  21       7.131   2.789   3.074  1.00  1.04           C  
ATOM    313  O   PRO A  21       6.585   2.126   3.956  1.00  1.12           O  
ATOM    314  CB  PRO A  21       9.588   2.640   3.549  1.00  1.43           C  
ATOM    315  CG  PRO A  21      10.002   4.050   3.309  1.00  1.40           C  
ATOM    316  CD  PRO A  21       9.854   4.286   1.826  1.00  1.30           C  
ATOM    317  HA  PRO A  21       8.485   1.344   2.244  1.00  1.35           H  
ATOM    318  HB2 PRO A  21       9.187   2.505   4.542  1.00  1.46           H  
ATOM    319  HB3 PRO A  21      10.407   1.956   3.387  1.00  1.61           H  
ATOM    320  HG2 PRO A  21       9.357   4.718   3.860  1.00  1.32           H  
ATOM    321  HG3 PRO A  21      11.029   4.187   3.609  1.00  1.59           H  
ATOM    322  HD2 PRO A  21       9.450   5.267   1.637  1.00  1.23           H  
ATOM    323  HD3 PRO A  21      10.806   4.168   1.329  1.00  1.47           H  
ATOM    324  N   ARG A  22       6.579   3.878   2.550  1.00  0.84           N  
ATOM    325  CA  ARG A  22       5.306   4.392   3.025  1.00  0.70           C  
ATOM    326  C   ARG A  22       4.202   4.038   2.047  1.00  0.52           C  
ATOM    327  O   ARG A  22       4.471   3.486   0.983  1.00  0.54           O  
ATOM    328  CB  ARG A  22       5.387   5.906   3.219  1.00  0.82           C  
ATOM    329  CG  ARG A  22       6.378   6.315   4.295  1.00  1.37           C  
ATOM    330  CD  ARG A  22       6.407   7.822   4.491  1.00  1.91           C  
ATOM    331  NE  ARG A  22       7.332   8.217   5.554  1.00  2.59           N  
ATOM    332  CZ  ARG A  22       7.315   9.406   6.154  1.00  3.29           C  
ATOM    333  NH1 ARG A  22       6.438  10.330   5.783  1.00  3.45           N1+
ATOM    334  NH2 ARG A  22       8.182   9.672   7.122  1.00  4.24           N  
ATOM    335  H   ARG A  22       7.029   4.332   1.800  1.00  0.84           H  
ATOM    336  HA  ARG A  22       5.093   3.925   3.974  1.00  0.71           H  
ATOM    337  HB2 ARG A  22       5.687   6.361   2.287  1.00  1.26           H  
ATOM    338  HB3 ARG A  22       4.412   6.277   3.496  1.00  0.94           H  
ATOM    339  HG2 ARG A  22       6.094   5.848   5.226  1.00  1.75           H  
ATOM    340  HG3 ARG A  22       7.363   5.978   4.007  1.00  1.90           H  
ATOM    341  HD2 ARG A  22       6.717   8.287   3.566  1.00  1.99           H  
ATOM    342  HD3 ARG A  22       5.414   8.160   4.748  1.00  2.56           H  
ATOM    343  HE  ARG A  22       8.003   7.551   5.841  1.00  2.93           H  
ATOM    344 HH11 ARG A  22       5.783  10.141   5.049  1.00  3.20           H  
ATOM    345 HH12 ARG A  22       6.424  11.225   6.238  1.00  4.13           H  
ATOM    346 HH21 ARG A  22       8.171  10.568   7.576  1.00  4.82           H  
ATOM    347 HH22 ARG A  22       8.853   8.983   7.406  1.00  4.54           H  
ATOM    348  N   TYR A  23       2.962   4.329   2.408  1.00  0.40           N  
ATOM    349  CA  TYR A  23       1.840   4.018   1.540  1.00  0.29           C  
ATOM    350  C   TYR A  23       0.607   4.826   1.897  1.00  0.24           C  
ATOM    351  O   TYR A  23       0.455   5.296   3.025  1.00  0.30           O  
ATOM    352  CB  TYR A  23       1.511   2.529   1.613  1.00  0.28           C  
ATOM    353  CG  TYR A  23       1.123   2.047   2.993  1.00  0.27           C  
ATOM    354  CD1 TYR A  23      -0.212   1.948   3.363  1.00  0.26           C  
ATOM    355  CD2 TYR A  23       2.089   1.696   3.924  1.00  0.33           C  
ATOM    356  CE1 TYR A  23      -0.571   1.515   4.622  1.00  0.29           C  
ATOM    357  CE2 TYR A  23       1.738   1.260   5.184  1.00  0.37           C  
ATOM    358  CZ  TYR A  23       0.409   1.155   5.525  1.00  0.35           C  
ATOM    359  OH  TYR A  23       0.059   0.741   6.791  1.00  0.42           O  
ATOM    360  H   TYR A  23       2.796   4.749   3.277  1.00  0.41           H  
ATOM    361  HA  TYR A  23       2.126   4.258   0.529  1.00  0.32           H  
ATOM    362  HB2 TYR A  23       0.689   2.316   0.947  1.00  0.28           H  
ATOM    363  HB3 TYR A  23       2.376   1.967   1.297  1.00  0.34           H  
ATOM    364  HD1 TYR A  23      -0.976   2.216   2.647  1.00  0.26           H  
ATOM    365  HD2 TYR A  23       3.131   1.766   3.649  1.00  0.36           H  
ATOM    366  HE1 TYR A  23      -1.615   1.444   4.891  1.00  0.29           H  
ATOM    367  HE2 TYR A  23       2.505   0.993   5.894  1.00  0.44           H  
ATOM    368  HH  TYR A  23       0.597   1.206   7.451  1.00  0.90           H  
ATOM    369  N   GLU A  24      -0.249   4.990   0.910  1.00  0.20           N  
ATOM    370  CA  GLU A  24      -1.571   5.551   1.101  1.00  0.21           C  
ATOM    371  C   GLU A  24      -2.600   4.444   0.955  1.00  0.19           C  
ATOM    372  O   GLU A  24      -2.519   3.658   0.020  1.00  0.32           O  
ATOM    373  CB  GLU A  24      -1.841   6.642   0.067  1.00  0.32           C  
ATOM    374  CG  GLU A  24      -1.257   7.992   0.430  1.00  0.49           C  
ATOM    375  CD  GLU A  24      -2.031   8.670   1.538  1.00  1.22           C  
ATOM    376  OE1 GLU A  24      -1.482   8.808   2.655  1.00  1.64           O  
ATOM    377  OE2 GLU A  24      -3.193   9.053   1.308  1.00  1.99           O1-
ATOM    378  H   GLU A  24       0.018   4.714   0.006  1.00  0.21           H  
ATOM    379  HA  GLU A  24      -1.625   5.969   2.094  1.00  0.27           H  
ATOM    380  HB2 GLU A  24      -1.421   6.336  -0.879  1.00  0.32           H  
ATOM    381  HB3 GLU A  24      -2.907   6.755  -0.045  1.00  0.43           H  
ATOM    382  HG2 GLU A  24      -0.238   7.853   0.758  1.00  0.85           H  
ATOM    383  HG3 GLU A  24      -1.272   8.628  -0.442  1.00  0.91           H  
HETATM  384  N   MVA A  25      -3.580   4.351   1.858  1.00  0.17           N  
HETATM  385  CN  MVA A  25      -3.666   5.359   2.940  1.00  0.28           C  
HETATM  386  CA  MVA A  25      -4.584   3.278   1.742  1.00  0.18           C  
HETATM  387  CB  MVA A  25      -4.287   2.055   2.661  1.00  0.28           C  
HETATM  388  CG1 MVA A  25      -4.169   2.433   4.128  1.00  0.51           C  
HETATM  389  CG2 MVA A  25      -5.358   0.990   2.475  1.00  0.76           C  
HETATM  390  C   MVA A  25      -6.006   3.783   1.977  1.00  0.25           C  
HETATM  391  O   MVA A  25      -6.400   4.149   3.089  1.00  0.47           O  
HETATM  392  HN1 MVA A  25      -2.848   5.219   3.629  1.00  1.20           H  
HETATM  393  HN2 MVA A  25      -4.603   5.241   3.465  1.00  0.93           H  
HETATM  394  HN3 MVA A  25      -3.613   6.351   2.515  1.00  1.04           H  
HETATM  395  HA  MVA A  25      -4.561   2.906   0.726  1.00  0.17           H  
HETATM  396  HB  MVA A  25      -3.343   1.629   2.354  1.00  0.69           H  
HETATM  397 HG11 MVA A  25      -5.071   2.933   4.445  1.00  1.16           H  
HETATM  398 HG12 MVA A  25      -3.324   3.092   4.262  1.00  1.12           H  
HETATM  399 HG13 MVA A  25      -4.026   1.539   4.718  1.00  1.28           H  
HETATM  400 HG21 MVA A  25      -5.365   0.664   1.445  1.00  1.28           H  
HETATM  401 HG22 MVA A  25      -6.324   1.404   2.728  1.00  1.27           H  
HETATM  402 HG23 MVA A  25      -5.145   0.150   3.118  1.00  1.43           H  
ATOM    403  N   HIS A  26      -6.774   3.792   0.903  1.00  0.17           N  
ATOM    404  CA  HIS A  26      -8.132   4.301   0.926  1.00  0.24           C  
ATOM    405  C   HIS A  26      -9.099   3.204   0.509  1.00  0.32           C  
ATOM    406  O   HIS A  26      -9.005   2.670  -0.594  1.00  0.43           O  
ATOM    407  CB  HIS A  26      -8.271   5.510  -0.004  1.00  0.32           C  
ATOM    408  CG  HIS A  26      -7.454   6.698   0.416  1.00  0.44           C  
ATOM    409  ND1 HIS A  26      -8.010   7.886   0.841  1.00  0.57           N  
ATOM    410  CD2 HIS A  26      -6.112   6.876   0.468  1.00  0.55           C  
ATOM    411  CE1 HIS A  26      -7.045   8.740   1.135  1.00  0.72           C  
ATOM    412  NE2 HIS A  26      -5.885   8.150   0.917  1.00  0.70           N  
ATOM    413  H   HIS A  26      -6.420   3.419   0.062  1.00  0.22           H  
ATOM    414  HA  HIS A  26      -8.357   4.603   1.936  1.00  0.30           H  
ATOM    415  HB2 HIS A  26      -7.955   5.225  -0.995  1.00  0.33           H  
ATOM    416  HB3 HIS A  26      -9.305   5.810  -0.037  1.00  0.40           H  
ATOM    417  HD1 HIS A  26      -8.971   8.077   0.913  1.00  0.61           H  
ATOM    418  HD2 HIS A  26      -5.361   6.143   0.211  1.00  0.59           H  
ATOM    419  HE1 HIS A  26      -7.182   9.747   1.494  1.00  0.87           H  
ATOM    420  HE2 HIS A  26      -5.000   8.535   1.126  1.00  0.83           H  
ATOM    421  N   CYS A  27     -10.004   2.854   1.400  1.00  0.38           N  
ATOM    422  CA  CYS A  27     -10.954   1.789   1.140  1.00  0.50           C  
ATOM    423  C   CYS A  27     -12.204   2.337   0.465  1.00  0.74           C  
ATOM    424  O   CYS A  27     -13.188   2.680   1.120  1.00  1.38           O  
ATOM    425  CB  CYS A  27     -11.313   1.086   2.447  1.00  0.59           C  
ATOM    426  SG  CYS A  27      -9.861   0.514   3.393  1.00  0.75           S  
ATOM    427  H   CYS A  27     -10.037   3.323   2.260  1.00  0.41           H  
ATOM    428  HA  CYS A  27     -10.484   1.078   0.480  1.00  0.47           H  
ATOM    429  HB2 CYS A  27     -11.867   1.768   3.071  1.00  0.95           H  
ATOM    430  HB3 CYS A  27     -11.925   0.226   2.227  1.00  0.83           H  
HETATM  431  N   NH2 A  28     -12.159   2.435  -0.851  1.00  0.99           N  
HETATM  432  HN1 NH2 A  28     -11.341   2.144  -1.313  1.00  1.44           H  
HETATM  433  HN2 NH2 A  28     -12.943   2.793  -1.316  1.00  1.11           H  
TER     434      NH2 A  28                                                      
ENDMDL                                                                          
MODEL       10                                                                  
ATOM      1  N   ASN A   1      11.548  -9.452  -1.334  1.00  1.83           N  
ATOM      2  CA  ASN A   1      10.506  -8.797  -0.511  1.00  1.49           C  
ATOM      3  C   ASN A   1       9.960  -7.580  -1.245  1.00  1.11           C  
ATOM      4  O   ASN A   1      10.687  -6.621  -1.502  1.00  1.38           O  
ATOM      5  CB  ASN A   1      11.091  -8.376   0.845  1.00  1.76           C  
ATOM      6  CG  ASN A   1      10.038  -7.905   1.841  1.00  2.41           C  
ATOM      7  OD1 ASN A   1       9.002  -7.354   1.472  1.00  3.13           O  
ATOM      8  ND2 ASN A   1      10.300  -8.123   3.121  1.00  2.72           N  
ATOM      9  H1  ASN A   1      11.928 -10.285  -0.841  1.00  1.62           H  
ATOM     10  H2  ASN A   1      12.325  -8.788  -1.518  1.00  2.41           H  
ATOM     11  H3  ASN A   1      11.149  -9.753  -2.246  1.00  2.27           H  
ATOM     12  HA  ASN A   1       9.703  -9.501  -0.352  1.00  1.51           H  
ATOM     13  HB2 ASN A   1      11.612  -9.215   1.280  1.00  2.07           H  
ATOM     14  HB3 ASN A   1      11.791  -7.568   0.688  1.00  1.95           H  
ATOM     15 HD21 ASN A   1      11.145  -8.564   3.353  1.00  2.63           H  
ATOM     16 HD22 ASN A   1       9.641  -7.832   3.786  1.00  3.34           H  
ATOM     17  N   ASP A   2       8.680  -7.627  -1.588  1.00  0.74           N  
ATOM     18  CA  ASP A   2       8.037  -6.526  -2.286  1.00  0.50           C  
ATOM     19  C   ASP A   2       7.079  -5.816  -1.347  1.00  0.36           C  
ATOM     20  O   ASP A   2       5.974  -6.304  -1.095  1.00  0.33           O  
ATOM     21  CB  ASP A   2       7.283  -7.022  -3.524  1.00  0.73           C  
ATOM     22  CG  ASP A   2       8.193  -7.635  -4.568  1.00  1.34           C  
ATOM     23  OD1 ASP A   2       8.366  -8.871  -4.554  1.00  2.21           O  
ATOM     24  OD2 ASP A   2       8.731  -6.888  -5.410  1.00  1.35           O1-
ATOM     25  H   ASP A   2       8.148  -8.414  -1.346  1.00  0.90           H  
ATOM     26  HA  ASP A   2       8.804  -5.832  -2.595  1.00  0.62           H  
ATOM     27  HB2 ASP A   2       6.566  -7.769  -3.222  1.00  1.22           H  
ATOM     28  HB3 ASP A   2       6.759  -6.192  -3.972  1.00  1.02           H  
HETATM   29  N   AIB A   3       7.519  -4.674  -0.825  1.00  0.36           N  
HETATM   30  CA  AIB A   3       6.741  -3.887   0.139  1.00  0.37           C  
HETATM   31  C   AIB A   3       5.338  -3.623  -0.415  1.00  0.33           C  
HETATM   32  O   AIB A   3       4.332  -3.841   0.264  1.00  0.30           O  
HETATM   33  CB1 AIB A   3       7.442  -2.567   0.398  1.00  0.49           C  
HETATM   34  CB2 AIB A   3       6.659  -4.623   1.464  1.00  0.41           C  
HETATM   35  H   AIB A   3       8.402  -4.344  -1.097  1.00  0.41           H  
HETATM   36 HB11 AIB A   3       7.532  -2.019  -0.528  1.00  1.25           H  
HETATM   37 HB12 AIB A   3       8.426  -2.753   0.804  1.00  0.95           H  
HETATM   38 HB13 AIB A   3       6.866  -1.986   1.104  1.00  1.20           H  
HETATM   39 HB21 AIB A   3       7.655  -4.781   1.850  1.00  1.26           H  
HETATM   40 HB22 AIB A   3       6.175  -5.576   1.316  1.00  1.09           H  
HETATM   41 HB23 AIB A   3       6.088  -4.035   2.168  1.00  0.94           H  
ATOM     42  N   CYS A   4       5.286  -3.181  -1.665  1.00  0.37           N  
ATOM     43  CA  CYS A   4       4.027  -2.827  -2.303  1.00  0.40           C  
ATOM     44  C   CYS A   4       3.122  -4.044  -2.447  1.00  0.32           C  
ATOM     45  O   CYS A   4       1.902  -3.940  -2.309  1.00  0.33           O  
ATOM     46  CB  CYS A   4       4.284  -2.201  -3.673  1.00  0.49           C  
ATOM     47  SG  CYS A   4       2.809  -1.461  -4.437  1.00  1.18           S  
ATOM     48  H   CYS A   4       6.122  -3.088  -2.173  1.00  0.41           H  
ATOM     49  HA  CYS A   4       3.533  -2.103  -1.677  1.00  0.43           H  
ATOM     50  HB2 CYS A   4       5.025  -1.424  -3.574  1.00  1.21           H  
ATOM     51  HB3 CYS A   4       4.653  -2.960  -4.345  1.00  1.05           H  
ATOM     52  N   LYS A   5       3.720  -5.199  -2.708  1.00  0.30           N  
ATOM     53  CA  LYS A   5       2.953  -6.427  -2.864  1.00  0.31           C  
ATOM     54  C   LYS A   5       2.353  -6.835  -1.526  1.00  0.20           C  
ATOM     55  O   LYS A   5       1.170  -7.158  -1.445  1.00  0.20           O  
ATOM     56  CB  LYS A   5       3.832  -7.557  -3.404  1.00  0.39           C  
ATOM     57  CG  LYS A   5       3.065  -8.838  -3.710  1.00  0.80           C  
ATOM     58  CD  LYS A   5       3.999 -10.001  -4.008  1.00  1.37           C  
ATOM     59  CE  LYS A   5       4.799 -10.403  -2.778  1.00  2.05           C  
ATOM     60  NZ  LYS A   5       5.616 -11.622  -3.016  1.00  2.62           N1+
ATOM     61  H   LYS A   5       4.695  -5.226  -2.786  1.00  0.32           H  
ATOM     62  HA  LYS A   5       2.153  -6.232  -3.560  1.00  0.38           H  
ATOM     63  HB2 LYS A   5       4.311  -7.223  -4.312  1.00  0.76           H  
ATOM     64  HB3 LYS A   5       4.591  -7.786  -2.671  1.00  0.63           H  
ATOM     65  HG2 LYS A   5       2.454  -9.092  -2.856  1.00  1.40           H  
ATOM     66  HG3 LYS A   5       2.430  -8.670  -4.569  1.00  1.26           H  
ATOM     67  HD2 LYS A   5       3.412 -10.847  -4.335  1.00  1.80           H  
ATOM     68  HD3 LYS A   5       4.681  -9.709  -4.792  1.00  1.90           H  
ATOM     69  HE2 LYS A   5       5.457  -9.590  -2.509  1.00  2.44           H  
ATOM     70  HE3 LYS A   5       4.113 -10.592  -1.965  1.00  2.54           H  
ATOM     71  HZ1 LYS A   5       6.334 -11.436  -3.743  1.00  2.86           H  
ATOM     72  HZ2 LYS A   5       5.011 -12.403  -3.335  1.00  2.84           H  
ATOM     73  HZ3 LYS A   5       6.094 -11.909  -2.139  1.00  3.23           H  
HETATM   74  N   AIB A   6       3.185  -6.794  -0.485  1.00  0.16           N  
HETATM   75  CA  AIB A   6       2.763  -7.148   0.875  1.00  0.16           C  
HETATM   76  C   AIB A   6       1.590  -6.255   1.284  1.00  0.12           C  
HETATM   77  O   AIB A   6       0.577  -6.732   1.797  1.00  0.16           O  
HETATM   78  CB1 AIB A   6       3.916  -6.943   1.837  1.00  0.22           C  
HETATM   79  CB2 AIB A   6       2.372  -8.614   0.942  1.00  0.25           C  
HETATM   80  H   AIB A   6       4.115  -6.510  -0.633  1.00  0.18           H  
HETATM   81 HB11 AIB A   6       3.615  -7.248   2.828  1.00  1.10           H  
HETATM   82 HB12 AIB A   6       4.190  -5.898   1.851  1.00  1.03           H  
HETATM   83 HB13 AIB A   6       4.761  -7.534   1.519  1.00  0.90           H  
HETATM   84 HB21 AIB A   6       3.230  -9.228   0.713  1.00  1.08           H  
HETATM   85 HB22 AIB A   6       1.589  -8.810   0.224  1.00  1.03           H  
HETATM   86 HB23 AIB A   6       2.016  -8.848   1.934  1.00  1.03           H  
ATOM     87  N   LEU A   7       1.732  -4.955   1.037  1.00  0.12           N  
ATOM     88  CA  LEU A   7       0.704  -3.991   1.398  1.00  0.16           C  
ATOM     89  C   LEU A   7      -0.567  -4.223   0.597  1.00  0.17           C  
ATOM     90  O   LEU A   7      -1.667  -4.186   1.142  1.00  0.21           O  
ATOM     91  CB  LEU A   7       1.200  -2.564   1.167  1.00  0.23           C  
ATOM     92  CG  LEU A   7       2.422  -2.155   1.991  1.00  0.28           C  
ATOM     93  CD1 LEU A   7       2.927  -0.794   1.545  1.00  0.38           C  
ATOM     94  CD2 LEU A   7       2.080  -2.130   3.471  1.00  0.35           C  
ATOM     95  H   LEU A   7       2.556  -4.638   0.599  1.00  0.15           H  
ATOM     96  HA  LEU A   7       0.483  -4.121   2.445  1.00  0.19           H  
ATOM     97  HB2 LEU A   7       1.442  -2.458   0.121  1.00  0.25           H  
ATOM     98  HB3 LEU A   7       0.394  -1.885   1.402  1.00  0.28           H  
ATOM     99  HG  LEU A   7       3.213  -2.876   1.837  1.00  0.24           H  
ATOM    100 HD11 LEU A   7       3.775  -0.509   2.150  1.00  1.02           H  
ATOM    101 HD12 LEU A   7       2.138  -0.065   1.663  1.00  0.98           H  
ATOM    102 HD13 LEU A   7       3.224  -0.839   0.508  1.00  1.03           H  
ATOM    103 HD21 LEU A   7       1.807  -3.123   3.795  1.00  1.14           H  
ATOM    104 HD22 LEU A   7       1.251  -1.459   3.634  1.00  0.90           H  
ATOM    105 HD23 LEU A   7       2.935  -1.789   4.033  1.00  1.09           H  
ATOM    106  N   LYS A   8      -0.407  -4.470  -0.695  1.00  0.19           N  
ATOM    107  CA  LYS A   8      -1.544  -4.709  -1.572  1.00  0.27           C  
ATOM    108  C   LYS A   8      -2.336  -5.922  -1.104  1.00  0.25           C  
ATOM    109  O   LYS A   8      -3.560  -5.858  -0.972  1.00  0.31           O  
ATOM    110  CB  LYS A   8      -1.068  -4.912  -3.012  1.00  0.35           C  
ATOM    111  CG  LYS A   8      -2.187  -5.223  -3.992  1.00  1.12           C  
ATOM    112  CD  LYS A   8      -1.653  -5.409  -5.402  1.00  1.10           C  
ATOM    113  CE  LYS A   8      -2.767  -5.740  -6.384  1.00  2.05           C  
ATOM    114  NZ  LYS A   8      -3.402  -7.051  -6.087  1.00  2.55           N1+
ATOM    115  H   LYS A   8       0.503  -4.489  -1.070  1.00  0.20           H  
ATOM    116  HA  LYS A   8      -2.181  -3.840  -1.530  1.00  0.31           H  
ATOM    117  HB2 LYS A   8      -0.570  -4.014  -3.344  1.00  0.78           H  
ATOM    118  HB3 LYS A   8      -0.363  -5.731  -3.034  1.00  1.00           H  
ATOM    119  HG2 LYS A   8      -2.680  -6.132  -3.683  1.00  1.72           H  
ATOM    120  HG3 LYS A   8      -2.895  -4.407  -3.989  1.00  1.60           H  
ATOM    121  HD2 LYS A   8      -1.169  -4.497  -5.716  1.00  1.29           H  
ATOM    122  HD3 LYS A   8      -0.935  -6.217  -5.400  1.00  1.23           H  
ATOM    123  HE2 LYS A   8      -3.519  -4.968  -6.330  1.00  2.55           H  
ATOM    124  HE3 LYS A   8      -2.353  -5.769  -7.380  1.00  2.55           H  
ATOM    125  HZ1 LYS A   8      -4.146  -7.253  -6.782  1.00  2.92           H  
ATOM    126  HZ2 LYS A   8      -3.825  -7.041  -5.137  1.00  2.95           H  
ATOM    127  HZ3 LYS A   8      -2.692  -7.810  -6.128  1.00  2.82           H  
HETATM  128  N   AIB A   9      -1.617  -7.008  -0.838  1.00  0.21           N  
HETATM  129  CA  AIB A   9      -2.211  -8.265  -0.373  1.00  0.24           C  
HETATM  130  C   AIB A   9      -2.868  -8.045   0.995  1.00  0.26           C  
HETATM  131  O   AIB A   9      -3.926  -8.603   1.293  1.00  0.35           O  
HETATM  132  CB1 AIB A   9      -1.123  -9.311  -0.250  1.00  0.23           C  
HETATM  133  CB2 AIB A   9      -3.226  -8.781  -1.379  1.00  0.32           C  
HETATM  134  H   AIB A   9      -0.641  -6.965  -0.957  1.00  0.18           H  
HETATM  135 HB11 AIB A   9      -1.561 -10.259   0.010  1.00  1.04           H  
HETATM  136 HB12 AIB A   9      -0.426  -9.014   0.520  1.00  0.97           H  
HETATM  137 HB13 AIB A   9      -0.601  -9.401  -1.191  1.00  1.10           H  
HETATM  138 HB21 AIB A   9      -4.002  -8.043  -1.517  1.00  1.03           H  
HETATM  139 HB22 AIB A   9      -3.662  -9.698  -1.012  1.00  1.10           H  
HETATM  140 HB23 AIB A   9      -2.736  -8.967  -2.322  1.00  0.99           H  
ATOM    141  N   ARG A  10      -2.218  -7.233   1.823  1.00  0.21           N  
ATOM    142  CA  ARG A  10      -2.693  -6.953   3.171  1.00  0.27           C  
ATOM    143  C   ARG A  10      -4.011  -6.188   3.135  1.00  0.33           C  
ATOM    144  O   ARG A  10      -4.971  -6.548   3.816  1.00  0.44           O  
ATOM    145  CB  ARG A  10      -1.633  -6.151   3.928  1.00  0.28           C  
ATOM    146  CG  ARG A  10      -1.958  -5.904   5.390  1.00  0.37           C  
ATOM    147  CD  ARG A  10      -0.811  -5.190   6.088  1.00  0.46           C  
ATOM    148  NE  ARG A  10       0.446  -5.938   5.983  1.00  1.04           N  
ATOM    149  CZ  ARG A  10       1.654  -5.402   6.154  1.00  1.36           C  
ATOM    150  NH1 ARG A  10       1.782  -4.115   6.449  1.00  1.26           N1+
ATOM    151  NH2 ARG A  10       2.734  -6.161   6.028  1.00  2.18           N  
ATOM    152  H   ARG A  10      -1.383  -6.810   1.518  1.00  0.16           H  
ATOM    153  HA  ARG A  10      -2.849  -7.893   3.671  1.00  0.33           H  
ATOM    154  HB2 ARG A  10      -0.696  -6.684   3.878  1.00  0.30           H  
ATOM    155  HB3 ARG A  10      -1.512  -5.192   3.444  1.00  0.27           H  
ATOM    156  HG2 ARG A  10      -2.845  -5.292   5.451  1.00  0.45           H  
ATOM    157  HG3 ARG A  10      -2.135  -6.851   5.877  1.00  0.42           H  
ATOM    158  HD2 ARG A  10      -0.678  -4.220   5.632  1.00  0.90           H  
ATOM    159  HD3 ARG A  10      -1.061  -5.065   7.131  1.00  1.00           H  
ATOM    160  HE  ARG A  10       0.383  -6.899   5.772  1.00  1.56           H  
ATOM    161 HH11 ARG A  10       2.698  -3.714   6.576  1.00  1.61           H  
ATOM    162 HH12 ARG A  10       0.971  -3.538   6.555  1.00  1.29           H  
ATOM    163 HH21 ARG A  10       2.645  -7.137   5.808  1.00  2.69           H  
ATOM    164 HH22 ARG A  10       3.648  -5.764   6.157  1.00  2.46           H  
ATOM    165  N   TYR A  11      -4.056  -5.148   2.320  1.00  0.31           N  
ATOM    166  CA  TYR A  11      -5.241  -4.317   2.198  1.00  0.39           C  
ATOM    167  C   TYR A  11      -6.165  -4.874   1.123  1.00  0.58           C  
ATOM    168  O   TYR A  11      -6.471  -4.209   0.135  1.00  0.93           O  
ATOM    169  CB  TYR A  11      -4.835  -2.875   1.896  1.00  0.32           C  
ATOM    170  CG  TYR A  11      -4.137  -2.214   3.062  1.00  0.24           C  
ATOM    171  CD1 TYR A  11      -4.867  -1.609   4.074  1.00  0.27           C  
ATOM    172  CD2 TYR A  11      -2.751  -2.218   3.166  1.00  0.24           C  
ATOM    173  CE1 TYR A  11      -4.241  -1.026   5.156  1.00  0.31           C  
ATOM    174  CE2 TYR A  11      -2.116  -1.633   4.244  1.00  0.24           C  
ATOM    175  CZ  TYR A  11      -2.866  -1.040   5.238  1.00  0.27           C  
ATOM    176  OH  TYR A  11      -2.244  -0.465   6.325  1.00  0.38           O  
ATOM    177  H   TYR A  11      -3.268  -4.937   1.771  1.00  0.29           H  
ATOM    178  HA  TYR A  11      -5.758  -4.342   3.145  1.00  0.44           H  
ATOM    179  HB2 TYR A  11      -4.161  -2.863   1.052  1.00  0.34           H  
ATOM    180  HB3 TYR A  11      -5.713  -2.299   1.661  1.00  0.37           H  
ATOM    181  HD1 TYR A  11      -5.944  -1.598   4.008  1.00  0.33           H  
ATOM    182  HD2 TYR A  11      -2.167  -2.682   2.384  1.00  0.32           H  
ATOM    183  HE1 TYR A  11      -4.828  -0.561   5.930  1.00  0.41           H  
ATOM    184  HE2 TYR A  11      -1.038  -1.646   4.304  1.00  0.29           H  
ATOM    185  HH  TYR A  11      -2.730  -0.694   7.128  1.00  0.93           H  
HETATM  186  N   AIB A  12      -6.606  -6.106   1.354  1.00  0.54           N  
HETATM  187  CA  AIB A  12      -7.418  -6.872   0.396  1.00  0.73           C  
HETATM  188  C   AIB A  12      -8.657  -6.084  -0.046  1.00  0.64           C  
HETATM  189  O   AIB A  12      -9.123  -6.232  -1.177  1.00  1.44           O  
HETATM  190  CB1 AIB A  12      -7.856  -8.170   1.041  1.00  1.05           C  
HETATM  191  CB2 AIB A  12      -6.579  -7.236  -0.809  1.00  1.04           C  
HETATM  192  H   AIB A  12      -6.367  -6.527   2.208  1.00  0.64           H  
HETATM  193 HB11 AIB A  12      -6.988  -8.724   1.366  1.00  1.35           H  
HETATM  194 HB12 AIB A  12      -8.410  -8.758   0.324  1.00  1.34           H  
HETATM  195 HB13 AIB A  12      -8.485  -7.954   1.892  1.00  1.69           H  
HETATM  196 HB21 AIB A  12      -5.718  -7.801  -0.489  1.00  1.46           H  
HETATM  197 HB22 AIB A  12      -6.255  -6.334  -1.306  1.00  1.41           H  
HETATM  198 HB23 AIB A  12      -7.168  -7.831  -1.491  1.00  1.18           H  
ATOM    199  N   GLY A  13      -9.192  -5.264   0.842  1.00  0.60           N  
ATOM    200  CA  GLY A  13     -10.408  -4.544   0.535  1.00  0.84           C  
ATOM    201  C   GLY A  13     -10.199  -3.052   0.389  1.00  0.80           C  
ATOM    202  O   GLY A  13     -11.157  -2.281   0.444  1.00  1.24           O  
ATOM    203  H   GLY A  13      -8.760  -5.148   1.716  1.00  1.15           H  
ATOM    204  HA2 GLY A  13     -10.815  -4.928  -0.388  1.00  0.99           H  
ATOM    205  HA3 GLY A  13     -11.121  -4.718   1.326  1.00  1.02           H  
ATOM    206  N   CYS A  14      -8.956  -2.634   0.206  1.00  0.33           N  
ATOM    207  CA  CYS A  14      -8.651  -1.217   0.078  1.00  0.29           C  
ATOM    208  C   CYS A  14      -7.551  -0.994  -0.952  1.00  0.34           C  
ATOM    209  O   CYS A  14      -6.724  -1.871  -1.197  1.00  0.62           O  
ATOM    210  CB  CYS A  14      -8.214  -0.645   1.431  1.00  0.25           C  
ATOM    211  SG  CYS A  14      -9.361  -0.982   2.811  1.00  0.39           S  
ATOM    212  H   CYS A  14      -8.224  -3.291   0.147  1.00  0.23           H  
ATOM    213  HA  CYS A  14      -9.546  -0.711  -0.247  1.00  0.35           H  
ATOM    214  HB2 CYS A  14      -7.259  -1.062   1.693  1.00  0.26           H  
ATOM    215  HB3 CYS A  14      -8.116   0.428   1.339  1.00  0.26           H  
ATOM    216  N   GLU A  15      -7.552   0.182  -1.561  1.00  0.27           N  
ATOM    217  CA  GLU A  15      -6.501   0.555  -2.491  1.00  0.27           C  
ATOM    218  C   GLU A  15      -5.303   1.075  -1.712  1.00  0.21           C  
ATOM    219  O   GLU A  15      -5.478   1.690  -0.662  1.00  0.33           O  
ATOM    220  CB  GLU A  15      -6.998   1.632  -3.458  1.00  0.31           C  
ATOM    221  CG  GLU A  15      -8.124   1.174  -4.364  1.00  0.37           C  
ATOM    222  CD  GLU A  15      -8.607   2.277  -5.276  1.00  0.84           C  
ATOM    223  OE1 GLU A  15      -9.497   3.051  -4.865  1.00  1.65           O  
ATOM    224  OE2 GLU A  15      -8.112   2.366  -6.421  1.00  0.80           O1-
ATOM    225  H   GLU A  15      -8.275   0.820  -1.372  1.00  0.38           H  
ATOM    226  HA  GLU A  15      -6.210  -0.322  -3.046  1.00  0.31           H  
ATOM    227  HB2 GLU A  15      -7.350   2.477  -2.885  1.00  0.31           H  
ATOM    228  HB3 GLU A  15      -6.173   1.950  -4.079  1.00  0.34           H  
ATOM    229  HG2 GLU A  15      -7.771   0.354  -4.970  1.00  0.85           H  
ATOM    230  HG3 GLU A  15      -8.949   0.841  -3.754  1.00  0.82           H  
HETATM  231  N   MVA A  16      -4.074   0.853  -2.196  1.00  0.25           N  
HETATM  232  CN  MVA A  16      -3.916   0.165  -3.499  1.00  0.53           C  
HETATM  233  CA  MVA A  16      -2.889   1.314  -1.453  1.00  0.19           C  
HETATM  234  CB  MVA A  16      -2.368   0.241  -0.447  1.00  0.21           C  
HETATM  235  CG1 MVA A  16      -2.120  -1.105  -1.105  1.00  0.36           C  
HETATM  236  CG2 MVA A  16      -1.103   0.729   0.238  1.00  0.21           C  
HETATM  237  C   MVA A  16      -1.752   1.770  -2.372  1.00  0.24           C  
HETATM  238  O   MVA A  16      -1.103   0.973  -3.055  1.00  0.48           O  
HETATM  239  HN1 MVA A  16      -4.575   0.614  -4.226  1.00  1.23           H  
HETATM  240  HN2 MVA A  16      -4.161  -0.881  -3.387  1.00  1.12           H  
HETATM  241  HN3 MVA A  16      -2.894   0.261  -3.835  1.00  1.12           H  
HETATM  242  HA  MVA A  16      -3.170   2.178  -0.861  1.00  0.20           H  
HETATM  243  HB  MVA A  16      -3.122   0.101   0.313  1.00  0.37           H  
HETATM  244 HG11 MVA A  16      -1.716  -1.790  -0.375  1.00  1.08           H  
HETATM  245 HG12 MVA A  16      -1.417  -0.984  -1.915  1.00  1.13           H  
HETATM  246 HG13 MVA A  16      -3.051  -1.493  -1.488  1.00  1.07           H  
HETATM  247 HG21 MVA A  16      -1.295   1.680   0.712  1.00  1.05           H  
HETATM  248 HG22 MVA A  16      -0.319   0.846  -0.498  1.00  1.05           H  
HETATM  249 HG23 MVA A  16      -0.795   0.010   0.983  1.00  0.94           H  
ATOM    250  N   ARG A  17      -1.519   3.074  -2.372  1.00  0.23           N  
ATOM    251  CA  ARG A  17      -0.456   3.662  -3.162  1.00  0.27           C  
ATOM    252  C   ARG A  17       0.851   3.495  -2.416  1.00  0.23           C  
ATOM    253  O   ARG A  17       1.028   4.046  -1.327  1.00  0.34           O  
ATOM    254  CB  ARG A  17      -0.725   5.144  -3.417  1.00  0.34           C  
ATOM    255  CG  ARG A  17      -2.153   5.440  -3.834  1.00  1.33           C  
ATOM    256  CD  ARG A  17      -2.574   4.622  -5.046  1.00  1.48           C  
ATOM    257  NE  ARG A  17      -3.996   4.784  -5.340  1.00  2.36           N  
ATOM    258  CZ  ARG A  17      -4.735   3.887  -5.983  1.00  3.00           C  
ATOM    259  NH1 ARG A  17      -4.188   2.766  -6.441  1.00  3.01           N1+
ATOM    260  NH2 ARG A  17      -6.026   4.117  -6.171  1.00  3.96           N  
ATOM    261  H   ARG A  17      -2.069   3.655  -1.802  1.00  0.34           H  
ATOM    262  HA  ARG A  17      -0.402   3.136  -4.102  1.00  0.31           H  
ATOM    263  HB2 ARG A  17      -0.516   5.695  -2.514  1.00  1.08           H  
ATOM    264  HB3 ARG A  17      -0.064   5.488  -4.198  1.00  0.90           H  
ATOM    265  HG2 ARG A  17      -2.809   5.206  -3.010  1.00  2.00           H  
ATOM    266  HG3 ARG A  17      -2.233   6.491  -4.072  1.00  1.97           H  
ATOM    267  HD2 ARG A  17      -1.998   4.939  -5.903  1.00  1.68           H  
ATOM    268  HD3 ARG A  17      -2.374   3.579  -4.847  1.00  1.71           H  
ATOM    269  HE  ARG A  17      -4.427   5.614  -5.026  1.00  2.76           H  
ATOM    270 HH11 ARG A  17      -4.753   2.090  -6.926  1.00  3.63           H  
ATOM    271 HH12 ARG A  17      -3.207   2.595  -6.315  1.00  2.64           H  
ATOM    272 HH21 ARG A  17      -6.441   4.966  -5.829  1.00  4.30           H  
ATOM    273 HH22 ARG A  17      -6.603   3.438  -6.641  1.00  4.48           H  
ATOM    274  N   CYS A  18       1.749   2.727  -2.987  1.00  0.27           N  
ATOM    275  CA  CYS A  18       2.984   2.377  -2.317  1.00  0.31           C  
ATOM    276  C   CYS A  18       4.127   3.296  -2.725  1.00  0.38           C  
ATOM    277  O   CYS A  18       4.314   3.599  -3.904  1.00  0.41           O  
ATOM    278  CB  CYS A  18       3.334   0.928  -2.632  1.00  0.37           C  
ATOM    279  SG  CYS A  18       3.216   0.524  -4.404  1.00  0.47           S  
ATOM    280  H   CYS A  18       1.584   2.388  -3.892  1.00  0.40           H  
ATOM    281  HA  CYS A  18       2.821   2.475  -1.254  1.00  0.33           H  
ATOM    282  HB2 CYS A  18       4.347   0.732  -2.316  1.00  0.45           H  
ATOM    283  HB3 CYS A  18       2.659   0.275  -2.098  1.00  0.37           H  
ATOM    284  N   ASP A  19       4.874   3.744  -1.734  1.00  0.50           N  
ATOM    285  CA  ASP A  19       6.076   4.526  -1.956  1.00  0.68           C  
ATOM    286  C   ASP A  19       7.167   4.014  -1.025  1.00  0.80           C  
ATOM    287  O   ASP A  19       7.409   4.581   0.047  1.00  0.84           O  
ATOM    288  CB  ASP A  19       5.809   6.012  -1.713  1.00  0.80           C  
ATOM    289  CG  ASP A  19       6.968   6.890  -2.142  1.00  1.11           C  
ATOM    290  OD1 ASP A  19       7.531   7.602  -1.284  1.00  1.76           O  
ATOM    291  OD2 ASP A  19       7.342   6.856  -3.333  1.00  1.10           O1-
ATOM    292  H   ASP A  19       4.613   3.535  -0.809  1.00  0.49           H  
ATOM    293  HA  ASP A  19       6.386   4.380  -2.980  1.00  0.74           H  
ATOM    294  HB2 ASP A  19       4.933   6.310  -2.267  1.00  1.05           H  
ATOM    295  HB3 ASP A  19       5.634   6.171  -0.659  1.00  1.05           H  
HETATM  296  N   DPR A  20       7.812   2.900  -1.408  1.00  0.95           N  
HETATM  297  CA  DPR A  20       8.793   2.221  -0.561  1.00  1.13           C  
HETATM  298  CB  DPR A  20       9.240   1.019  -1.396  1.00  1.31           C  
HETATM  299  CG  DPR A  20       8.865   1.354  -2.797  1.00  1.35           C  
HETATM  300  CD  DPR A  20       7.643   2.218  -2.701  1.00  1.02           C  
HETATM  301  C   DPR A  20       8.166   1.754   0.750  1.00  1.11           C  
HETATM  302  O   DPR A  20       7.215   0.970   0.747  1.00  1.10           O  
HETATM  303  HA  DPR A  20       9.645   2.848  -0.354  1.00  1.22           H  
HETATM  304  HB2 DPR A  20      10.307   0.885  -1.293  1.00  1.44           H  
HETATM  305  HB3 DPR A  20       8.727   0.133  -1.054  1.00  1.39           H  
HETATM  306  HG2 DPR A  20       9.668   1.895  -3.276  1.00  1.54           H  
HETATM  307  HG3 DPR A  20       8.643   0.450  -3.344  1.00  1.59           H  
HETATM  308  HD2 DPR A  20       7.621   2.928  -3.512  1.00  1.05           H  
HETATM  309  HD3 DPR A  20       6.749   1.613  -2.701  1.00  0.93           H  
ATOM    310  N   PRO A  21       8.686   2.236   1.884  1.00  1.18           N  
ATOM    311  CA  PRO A  21       8.163   1.890   3.205  1.00  1.23           C  
ATOM    312  C   PRO A  21       6.895   2.665   3.556  1.00  1.04           C  
ATOM    313  O   PRO A  21       6.249   2.391   4.569  1.00  1.12           O  
ATOM    314  CB  PRO A  21       9.302   2.290   4.137  1.00  1.43           C  
ATOM    315  CG  PRO A  21       9.970   3.423   3.442  1.00  1.40           C  
ATOM    316  CD  PRO A  21       9.846   3.143   1.969  1.00  1.30           C  
ATOM    317  HA  PRO A  21       7.975   0.832   3.293  1.00  1.35           H  
ATOM    318  HB2 PRO A  21       8.898   2.592   5.092  1.00  1.46           H  
ATOM    319  HB3 PRO A  21       9.974   1.458   4.269  1.00  1.61           H  
ATOM    320  HG2 PRO A  21       9.472   4.348   3.690  1.00  1.32           H  
ATOM    321  HG3 PRO A  21      11.009   3.468   3.727  1.00  1.59           H  
ATOM    322  HD2 PRO A  21       9.659   4.056   1.424  1.00  1.23           H  
ATOM    323  HD3 PRO A  21      10.737   2.659   1.600  1.00  1.47           H  
ATOM    324  N   ARG A  22       6.543   3.635   2.720  1.00  0.84           N  
ATOM    325  CA  ARG A  22       5.375   4.466   2.967  1.00  0.70           C  
ATOM    326  C   ARG A  22       4.242   4.055   2.041  1.00  0.52           C  
ATOM    327  O   ARG A  22       4.484   3.474   0.985  1.00  0.54           O  
ATOM    328  CB  ARG A  22       5.719   5.941   2.760  1.00  0.82           C  
ATOM    329  CG  ARG A  22       6.909   6.410   3.580  1.00  1.37           C  
ATOM    330  CD  ARG A  22       6.678   6.225   5.074  1.00  1.91           C  
ATOM    331  NE  ARG A  22       7.864   6.575   5.859  1.00  2.59           N  
ATOM    332  CZ  ARG A  22       7.911   6.549   7.191  1.00  3.29           C  
ATOM    333  NH1 ARG A  22       6.844   6.195   7.897  1.00  3.45           N1+
ATOM    334  NH2 ARG A  22       9.031   6.880   7.818  1.00  4.24           N  
ATOM    335  H   ARG A  22       7.072   3.782   1.900  1.00  0.84           H  
ATOM    336  HA  ARG A  22       5.065   4.312   3.991  1.00  0.71           H  
ATOM    337  HB2 ARG A  22       5.944   6.101   1.715  1.00  1.26           H  
ATOM    338  HB3 ARG A  22       4.863   6.541   3.029  1.00  0.94           H  
ATOM    339  HG2 ARG A  22       7.778   5.841   3.288  1.00  1.75           H  
ATOM    340  HG3 ARG A  22       7.080   7.458   3.378  1.00  1.90           H  
ATOM    341  HD2 ARG A  22       5.858   6.857   5.382  1.00  1.99           H  
ATOM    342  HD3 ARG A  22       6.426   5.192   5.262  1.00  2.56           H  
ATOM    343  HE  ARG A  22       8.671   6.845   5.363  1.00  2.93           H  
ATOM    344 HH11 ARG A  22       5.990   5.945   7.432  1.00  3.20           H  
ATOM    345 HH12 ARG A  22       6.884   6.183   8.899  1.00  4.13           H  
ATOM    346 HH21 ARG A  22       9.070   6.860   8.822  1.00  4.82           H  
ATOM    347 HH22 ARG A  22       9.843   7.152   7.294  1.00  4.54           H  
ATOM    348  N   TYR A  23       3.013   4.339   2.435  1.00  0.40           N  
ATOM    349  CA  TYR A  23       1.863   3.943   1.643  1.00  0.29           C  
ATOM    350  C   TYR A  23       0.626   4.746   2.023  1.00  0.24           C  
ATOM    351  O   TYR A  23       0.472   5.176   3.165  1.00  0.30           O  
ATOM    352  CB  TYR A  23       1.595   2.451   1.822  1.00  0.28           C  
ATOM    353  CG  TYR A  23       1.220   2.063   3.234  1.00  0.27           C  
ATOM    354  CD1 TYR A  23      -0.109   1.977   3.611  1.00  0.26           C  
ATOM    355  CD2 TYR A  23       2.192   1.788   4.185  1.00  0.33           C  
ATOM    356  CE1 TYR A  23      -0.464   1.627   4.893  1.00  0.29           C  
ATOM    357  CE2 TYR A  23       1.846   1.436   5.476  1.00  0.37           C  
ATOM    358  CZ  TYR A  23       0.514   1.358   5.824  1.00  0.35           C  
ATOM    359  OH  TYR A  23       0.151   1.004   7.102  1.00  0.42           O  
ATOM    360  H   TYR A  23       2.874   4.829   3.273  1.00  0.41           H  
ATOM    361  HA  TYR A  23       2.094   4.132   0.606  1.00  0.32           H  
ATOM    362  HB2 TYR A  23       0.787   2.158   1.172  1.00  0.28           H  
ATOM    363  HB3 TYR A  23       2.484   1.903   1.552  1.00  0.34           H  
ATOM    364  HD1 TYR A  23      -0.875   2.189   2.879  1.00  0.26           H  
ATOM    365  HD2 TYR A  23       3.234   1.854   3.906  1.00  0.36           H  
ATOM    366  HE1 TYR A  23      -1.508   1.566   5.166  1.00  0.29           H  
ATOM    367  HE2 TYR A  23       2.615   1.226   6.202  1.00  0.44           H  
ATOM    368  HH  TYR A  23      -0.581   0.370   7.056  1.00  0.90           H  
ATOM    369  N   GLU A  24      -0.257   4.930   1.059  1.00  0.20           N  
ATOM    370  CA  GLU A  24      -1.509   5.638   1.285  1.00  0.21           C  
ATOM    371  C   GLU A  24      -2.687   4.731   0.935  1.00  0.19           C  
ATOM    372  O   GLU A  24      -2.743   4.199  -0.173  1.00  0.32           O  
ATOM    373  CB  GLU A  24      -1.560   6.906   0.431  1.00  0.32           C  
ATOM    374  CG  GLU A  24      -0.444   7.895   0.728  1.00  0.49           C  
ATOM    375  CD  GLU A  24      -0.490   8.432   2.145  1.00  1.22           C  
ATOM    376  OE1 GLU A  24      -1.479   9.107   2.501  1.00  1.64           O  
ATOM    377  OE2 GLU A  24       0.463   8.178   2.915  1.00  1.99           O1-
ATOM    378  H   GLU A  24      -0.065   4.575   0.164  1.00  0.21           H  
ATOM    379  HA  GLU A  24      -1.559   5.904   2.328  1.00  0.27           H  
ATOM    380  HB2 GLU A  24      -1.493   6.623  -0.609  1.00  0.32           H  
ATOM    381  HB3 GLU A  24      -2.504   7.399   0.597  1.00  0.43           H  
ATOM    382  HG2 GLU A  24       0.503   7.398   0.583  1.00  0.85           H  
ATOM    383  HG3 GLU A  24      -0.523   8.724   0.041  1.00  0.91           H  
HETATM  384  N   MVA A  25      -3.649   4.537   1.852  1.00  0.17           N  
HETATM  385  CN  MVA A  25      -3.601   5.297   3.123  1.00  0.28           C  
HETATM  386  CA  MVA A  25      -4.759   3.600   1.561  1.00  0.18           C  
HETATM  387  CB  MVA A  25      -4.916   2.454   2.610  1.00  0.28           C  
HETATM  388  CG1 MVA A  25      -3.573   1.828   2.933  1.00  0.51           C  
HETATM  389  CG2 MVA A  25      -5.627   2.906   3.881  1.00  0.76           C  
HETATM  390  C   MVA A  25      -6.104   4.309   1.412  1.00  0.25           C  
HETATM  391  O   MVA A  25      -6.378   5.330   2.047  1.00  0.47           O  
HETATM  392  HN1 MVA A  25      -4.575   5.286   3.585  1.00  1.20           H  
HETATM  393  HN2 MVA A  25      -3.313   6.318   2.921  1.00  0.93           H  
HETATM  394  HN3 MVA A  25      -2.882   4.845   3.788  1.00  1.04           H  
HETATM  395  HA  MVA A  25      -4.559   3.120   0.612  1.00  0.17           H  
HETATM  396  HB  MVA A  25      -5.524   1.683   2.154  1.00  0.69           H  
HETATM  397 HG11 MVA A  25      -3.708   1.045   3.666  1.00  1.16           H  
HETATM  398 HG12 MVA A  25      -2.912   2.582   3.329  1.00  1.12           H  
HETATM  399 HG13 MVA A  25      -3.146   1.409   2.034  1.00  1.28           H  
HETATM  400 HG21 MVA A  25      -5.840   2.046   4.499  1.00  1.28           H  
HETATM  401 HG22 MVA A  25      -6.551   3.400   3.619  1.00  1.27           H  
HETATM  402 HG23 MVA A  25      -4.994   3.590   4.425  1.00  1.43           H  
ATOM    403  N   HIS A  26      -6.930   3.760   0.537  1.00  0.17           N  
ATOM    404  CA  HIS A  26      -8.276   4.262   0.314  1.00  0.24           C  
ATOM    405  C   HIS A  26      -9.249   3.097   0.215  1.00  0.32           C  
ATOM    406  O   HIS A  26      -9.256   2.359  -0.774  1.00  0.43           O  
ATOM    407  CB  HIS A  26      -8.348   5.107  -0.958  1.00  0.32           C  
ATOM    408  CG  HIS A  26      -7.665   6.437  -0.848  1.00  0.44           C  
ATOM    409  ND1 HIS A  26      -8.321   7.591  -0.486  1.00  0.57           N  
ATOM    410  CD2 HIS A  26      -6.376   6.791  -1.059  1.00  0.55           C  
ATOM    411  CE1 HIS A  26      -7.470   8.597  -0.481  1.00  0.72           C  
ATOM    412  NE2 HIS A  26      -6.282   8.140  -0.826  1.00  0.70           N  
ATOM    413  H   HIS A  26      -6.624   2.978   0.025  1.00  0.22           H  
ATOM    414  HA  HIS A  26      -8.545   4.873   1.159  1.00  0.30           H  
ATOM    415  HB2 HIS A  26      -7.883   4.564  -1.763  1.00  0.33           H  
ATOM    416  HB3 HIS A  26      -9.384   5.284  -1.202  1.00  0.40           H  
ATOM    417  HD1 HIS A  26      -9.277   7.662  -0.257  1.00  0.61           H  
ATOM    418  HD2 HIS A  26      -5.570   6.132  -1.353  1.00  0.59           H  
ATOM    419  HE1 HIS A  26      -7.706   9.621  -0.236  1.00  0.87           H  
ATOM    420  HE2 HIS A  26      -5.518   8.705  -1.075  1.00  0.83           H  
ATOM    421  N   CYS A  27     -10.045   2.921   1.251  1.00  0.38           N  
ATOM    422  CA  CYS A  27     -11.010   1.836   1.304  1.00  0.50           C  
ATOM    423  C   CYS A  27     -12.320   2.262   0.656  1.00  0.74           C  
ATOM    424  O   CYS A  27     -12.807   1.616  -0.273  1.00  1.38           O  
ATOM    425  CB  CYS A  27     -11.240   1.405   2.752  1.00  0.59           C  
ATOM    426  SG  CYS A  27      -9.728   0.849   3.608  1.00  0.75           S  
ATOM    427  H   CYS A  27      -9.989   3.544   2.006  1.00  0.41           H  
ATOM    428  HA  CYS A  27     -10.601   1.006   0.750  1.00  0.47           H  
ATOM    429  HB2 CYS A  27     -11.644   2.238   3.307  1.00  0.95           H  
ATOM    430  HB3 CYS A  27     -11.947   0.590   2.769  1.00  0.83           H  
HETATM  431  N   NH2 A  28     -12.888   3.352   1.142  1.00  0.99           N  
HETATM  432  HN1 NH2 A  28     -12.445   3.817   1.884  1.00  1.44           H  
HETATM  433  HN2 NH2 A  28     -13.731   3.653   0.742  1.00  1.11           H  
TER     434      NH2 A  28                                                      
ENDMDL                                                                          
CONECT   19   29                                                                
CONECT   29   19   30   35                                                      
CONECT   30   29   31   33   34                                                 
CONECT   31   30   32   42                                                      
CONECT   32   31                                                                
CONECT   33   30   36   37   38                                                 
CONECT   34   30   39   40   41                                                 
CONECT   35   29                                                                
CONECT   36   33                                                                
CONECT   37   33                                                                
CONECT   38   33                                                                
CONECT   39   34                                                                
CONECT   40   34                                                                
CONECT   41   34                                                                
CONECT   42   31                                                                
CONECT   47  279                                                                
CONECT   54   74                                                                
CONECT   74   54   75   80                                                      
CONECT   75   74   76   78   79                                                 
CONECT   76   75   77   87                                                      
CONECT   77   76                                                                
CONECT   78   75   81   82   83                                                 
CONECT   79   75   84   85   86                                                 
CONECT   80   74                                                                
CONECT   81   78                                                                
CONECT   82   78                                                                
CONECT   83   78                                                                
CONECT   84   79                                                                
CONECT   85   79                                                                
CONECT   86   79                                                                
CONECT   87   76                                                                
CONECT  108  128                                                                
CONECT  128  108  129  134                                                      
CONECT  129  128  130  132  133                                                 
CONECT  130  129  131  141                                                      
CONECT  131  130                                                                
CONECT  132  129  135  136  137                                                 
CONECT  133  129  138  139  140                                                 
CONECT  134  128                                                                
CONECT  135  132                                                                
CONECT  136  132                                                                
CONECT  137  132                                                                
CONECT  138  133                                                                
CONECT  139  133                                                                
CONECT  140  133                                                                
CONECT  141  130                                                                
CONECT  167  186                                                                
CONECT  186  167  187  192                                                      
CONECT  187  186  188  190  191                                                 
CONECT  188  187  189  199                                                      
CONECT  189  188                                                                
CONECT  190  187  193  194  195                                                 
CONECT  191  187  196  197  198                                                 
CONECT  192  186                                                                
CONECT  193  190                                                                
CONECT  194  190                                                                
CONECT  195  190                                                                
CONECT  196  191                                                                
CONECT  197  191                                                                
CONECT  198  191                                                                
CONECT  199  188                                                                
CONECT  211  426                                                                
CONECT  218  231                                                                
CONECT  231  218  232  233                                                      
CONECT  232  231  239  240  241                                                 
CONECT  233  231  234  237  242                                                 
CONECT  234  233  235  236  243                                                 
CONECT  235  234  244  245  246                                                 
CONECT  236  234  247  248  249                                                 
CONECT  237  233  238  250                                                      
CONECT  238  237                                                                
CONECT  239  232                                                                
CONECT  240  232                                                                
CONECT  241  232                                                                
CONECT  242  233                                                                
CONECT  243  234                                                                
CONECT  244  235                                                                
CONECT  245  235                                                                
CONECT  246  235                                                                
CONECT  247  236                                                                
CONECT  248  236                                                                
CONECT  249  236                                                                
CONECT  250  237                                                                
CONECT  279   47                                                                
CONECT  286  296                                                                
CONECT  296  286  297  300                                                      
CONECT  297  296  298  301  303                                                 
CONECT  298  297  299  304  305                                                 
CONECT  299  298  300  306  307                                                 
CONECT  300  296  299  308  309                                                 
CONECT  301  297  302  310                                                      
CONECT  302  301                                                                
CONECT  303  297                                                                
CONECT  304  298                                                                
CONECT  305  298                                                                
CONECT  306  299                                                                
CONECT  307  299                                                                
CONECT  308  300                                                                
CONECT  309  300                                                                
CONECT  310  301                                                                
CONECT  371  384                                                                
CONECT  384  371  385  386                                                      
CONECT  385  384  392  393  394                                                 
CONECT  386  384  387  390  395                                                 
CONECT  387  386  388  389  396                                                 
CONECT  388  387  397  398  399                                                 
CONECT  389  387  400  401  402                                                 
CONECT  390  386  391  403                                                      
CONECT  391  390                                                                
CONECT  392  385                                                                
CONECT  393  385                                                                
CONECT  394  385                                                                
CONECT  395  386                                                                
CONECT  396  387                                                                
CONECT  397  388                                                                
CONECT  398  388                                                                
CONECT  399  388                                                                
CONECT  400  389                                                                
CONECT  401  389                                                                
CONECT  402  389                                                                
CONECT  403  390                                                                
CONECT  423  431                                                                
CONECT  426  211                                                                
CONECT  431  423  432  433                                                      
CONECT  432  431                                                                
CONECT  433  431                                                                
MASTER       95    0    8    1    2    0    0    6  218    1  126    3          
END