*HEADER    STRUCTURAL PROTEIN                      25-JUL-02   1M8M              
*TITLE     SOLID-STATE MAS NMR STRUCTURE OF THE A-SPECTRIN SH3 DOMAIN            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: SPECTRIN ALPHA CHAIN, BRAIN;                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SRC HOMOLOGY 3 DOMAIN (RESIDUES 965-1025);                 
*COMPND   5 SYNONYM: SPECTRIN, NON-ERYTHROID ALPHA CHAIN, FODRIN ALPHA           
*COMPND   6 CHAIN;                                                               
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: GALLUS GALLUS;                                  
*SOURCE   3 ORGANISM_COMMON: CHICKEN;                                            
*SOURCE   4 ORGAN: BRAIN;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3);                                
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET3D                                     
*KEYWDS    SOLID-STATE MAS NMR STRUCTURE                                         
*EXPDTA    NMR, 12 STRUCTURES                                                    
*AUTHOR    F.CASTELLANI, B.VAN ROSSUM, A.DIEHL, M.SCHUBERT, K.REHBEIN,           
*AUTHOR   2 H.OSCHKINAT                                                          
*REVDAT   1   20-NOV-02 1M8M    0                                                

Carbon-carbon restraints

assi (resid 12 and name   CA ) (resid 11 and name    C )  6.50  4.00  1.00 
assi (resid 12 and name   CA ) (resid 57 and name   CZ )  6.50  4.00  1.00 
assi (resid 12 and name  CD2 ) (resid 57 and name   CZ )  6.50  4.00  1.00 
assi (resid 16 and name   CA ) (resid 15 and name   CZ )  6.50  4.00  1.00 
assi (resid 16 and name   CB ) (resid 15 and name   CZ )  6.50  4.00  1.00 
assi (resid 16 and name   CG ) (resid 15 and name   CZ )  6.50  4.00  1.00 
assi (resid 20 and name   CA ) (resid 19 and name    C )  6.50  4.00  1.00 
assi (resid 23 and name  CG1 ) (resid 49 and name   CZ )  6.50  4.00  1.00 
assi (resid 23 and name  CG2 ) (resid 49 and name   CZ )  6.50  4.00  1.00 
assi (resid 24 and name   CA ) (resid 23 and name    C )  6.50  4.00  1.00 
assi (resid 24 and name   CB ) (resid 23 and name    C )  6.50  4.00  1.00 
assi (resid 26 and name   CB ) (resid 27 and name    C )  6.50  4.00  1.00 
assi (resid 32 and name   CB ) (resid 44 and name    C )  6.50  4.00  1.00 
assi (resid 36 and name   CB ) (resid 37 and name    C )  6.50  4.00  1.00 
assi (resid 36 and name   CB ) (resid 42 and name  CZ2 )  6.50  4.00  1.00
assi (resid 36 and name   CB ) (resid 42 and name   CG )  6.50  4.00  1.00
assi (resid 37 and name   CA ) (resid 36 and name    C )  6.50  4.00  1.00 
assi (resid 40 and name   CA ) (resid 41 and name  CZ2 )  6.50  4.00  1.00 
assi (resid 41 and name  CH2 ) (resid 42 and name  CE2 )  6.50  4.00  1.00 
assi (resid 41 and name  CZ2 ) (resid 42 and name  CE3 )  6.50  4.00  1.00 
assi (resid 42 and name  CE2 ) (resid 41 and name  CZ2 )  6.50  4.00  1.00 
assi (resid 43 and name   CA ) (resid 51 and name    C )  6.50  4.00  1.00 
assi (resid 43 and name   CB ) (resid 51 and name    C )  6.50  4.00  1.00 
assi (resid 43 and name   CB ) (resid 52 and name  CE1 )  6.50  4.00  1.00 
assi (resid 43 and name   CD ) (resid 51 and name    C )  6.50  4.00  1.00 
assi (resid 43 and name   CD ) (resid 52 and name  CE1 )  6.50  4.00  1.00 
assi (resid 43 and name   CG ) (resid 52 and name  CE1 )  6.50  4.00  1.00 
assi (resid 50 and name   CG ) (resid 51 and name    C )  6.50  4.00  1.00 
assi (resid 52 and name   CB ) (resid 51 and name    C )  6.50  4.00  1.00 
assi (resid 52 and name   CB ) (resid 53 and name    C )  6.50  4.00  1.00 
assi (resid 54 and name   CA ) (resid 41 and name  CE2 )  6.50  4.00  1.00 
assi (resid 54 and name   CA ) (resid 41 and name  CZ2 )  6.50  4.00  1.00 
assi (resid 54 and name   CA ) (resid 53 and name    C )  6.50  4.00  1.00 
assi (resid 56 and name   CB ) (resid 55 and name    C )  6.50  4.00  1.00 
assi (resid 56 and name   CB ) (resid 57 and name  CD1 )  6.50  4.00  1.00 
assi (resid 56 and name   CB ) (resid 57 and name   CZ )  6.50  4.00  1.00 
assi (resid 57 and name   CB ) (resid 56 and name    C )  6.50  4.00  1.00 
assi (resid 58 and name  CG2 ) (resid 57 and name  CD1 )  6.50  4.00  1.00 
assi (resid 58 and name  CG2 ) (resid 57 and name   CZ )  6.50  4.00  1.00 
assi (resid  8 and name   CA ) (resid  7 and name   CG )  5.50  3.00  1.00 
assi (resid  7 and name   CG ) (resid  8 and name  CD1 )  6.50  4.00  1.00 
assi (resid  8 and name  CD1 ) (resid 30 and name  CD1 )  6.50  4.00  1.00 
assi (resid  8 and name  CD2 ) (resid  7 and name   CG )  6.50  4.00  1.00 
assi (resid  8 and name  CD2 ) (resid 30 and name  CD1 )  6.50  4.00  1.00 
assi (resid  9 and name  CG1 ) (resid 31 and name  CD1 )  6.50  4.00  1.00 
assi (resid  9 and name  CG1 ) (resid 31 and name  CD2 )  6.50  4.00  1.00 
assi (resid  9 and name  CG1 ) (resid 58 and name  CG1 )  6.50  4.00  1.00 
assi (resid  9 and name  CG1 ) (resid 59 and name   CD )  6.50  4.00  1.00 
assi (resid  9 and name  CG1 ) (resid 61 and name   CA )  6.50  4.00  1.00 
assi (resid  8 and name   CA ) (resid  9 and name  CG2 )  4.50  2.00  1.00 
assi (resid  9 and name  CG2 ) (resid 31 and name  CD1 )  6.50  4.00  1.00 
assi (resid  9 and name  CG2 ) (resid 31 and name  CD2 )  5.50  3.00  1.00 
assi (resid  9 and name  CG2 ) (resid 33 and name   CA )  6.50  4.00  1.00 
assi (resid  9 and name  CG2 ) (resid 33 and name  CD1 )  5.50  3.00  1.00 
assi (resid  9 and name  CG2 ) (resid 58 and name  CG1 )  6.50  4.00  1.00 
assi (resid  9 and name  CG2 ) (resid 59 and name   CB )  6.50  4.00  1.00 
assi (resid  9 and name  CG2 ) (resid 59 and name   CD )  6.50  4.00  1.00 
assi (resid  9 and name  CG2 ) (resid 61 and name   CA )  6.50  4.00  1.00 
assi (resid 10 and name   CA ) (resid 12 and name  CD1 )  5.50  3.00  1.00 
assi (resid 10 and name   CA ) (resid 12 and name  CD2 )  6.50  4.00  1.00 
assi (resid 10 and name   CA ) (resid 30 and name   CA )  5.50  3.00  1.00 
assi (resid 10 and name  CD1 ) (resid 59 and name   CD )  6.50  4.00  1.00 
assi (resid 10 and name  CD2 ) (resid 12 and name   CA )  6.50  4.00  1.00 
assi (resid 10 and name  CD2 ) (resid 59 and name   CD )  6.50  4.00  1.00 
assi (resid 12 and name   CA ) (resid 10 and name  CD1 )  5.50  3.00  1.00 
assi (resid 12 and name  CD1 ) (resid 10 and name  CD1 )  6.50  4.00  1.00 
assi (resid 12 and name  CD1 ) (resid 57 and name   CB )  6.50  4.00  1.00 
assi (resid 12 and name  CD2 ) (resid 10 and name  CD1 )  5.50  3.00  1.00 
assi (resid 12 and name  CD2 ) (resid 10 and name  CD2 )  6.50  4.00  1.00 
assi (resid 12 and name  CD2 ) (resid 57 and name   CB )  6.50  4.00  1.00 
assi (resid 13 and name   CB ) (resid 12 and name   CA )  6.50  4.00  1.00 
assi (resid 15 and name   CB ) (resid 16 and name   CA )  6.50  4.00  1.00 
assi (resid 16 and name   CA ) (resid 24 and name   CA )  6.50  4.00  1.00 
assi (resid 16 and name   CA ) (resid 24 and name   CB )  6.50  4.00  1.00 
assi (resid 16 and name   CB ) (resid 15 and name   CB )  6.50  4.00  1.00 
assi (resid 16 and name   CG ) (resid 15 and name   CB )  6.50  4.00  1.00 
assi (resid 16 and name   CG ) (resid 24 and name   CB )  6.50  4.00  1.00 
assi (resid 19 and name   CB ) (resid 20 and name   CB )  6.50  4.00  1.00 
assi (resid 20 and name   CA ) (resid 19 and name   CB )  5.50  3.00  1.00 
assi (resid 23 and name  CG1 ) (resid 17 and name   CB )  6.50  4.00  1.00 
assi (resid 23 and name  CG2 ) (resid 17 and name   CB )  6.50  4.00  1.00 
assi (resid 23 and name  CG2 ) (resid 53 and name  CG1 )  6.50  4.00  1.00 
assi (resid 24 and name   CA ) (resid 16 and name   CB )  6.50  4.00  1.00 
assi (resid 24 and name   CB ) (resid 16 and name   CB )  6.50  4.00  1.00 
assi (resid 24 and name   CB ) (resid 23 and name  CG2 )  6.50  4.00  1.00 
assi (resid 24 and name   CA ) (resid 25 and name   CE )  6.50  4.00  1.00 
assi (resid 25 and name   CE ) (resid 24 and name   CA )  6.50  4.00  1.00 
assi (resid 26 and name   CD ) (resid 14 and name   CB )  3.50  1.00  1.00 
assi (resid 26 and name   CG ) (resid 14 and name   CB )  4.50  2.00  1.00 
assi (resid 30 and name  CD1 ) (resid  8 and name   CA )  5.50  3.00  1.00 
assi (resid 30 and name  CD1 ) (resid 10 and name   CA )  5.50  3.00  1.00 
assi (resid 30 and name  CD1 ) (resid 29 and name   CB )  6.50  4.00  1.00 
assi (resid 30 and name  CD1 ) (resid 31 and name  CD1 )  6.50  4.00  1.00 
assi (resid 30 and name  CG1 ) (resid  8 and name  CD2 )  6.50  4.00  1.00 
assi (resid 30 and name  CG1 ) (resid 29 and name   CB )  6.50  4.00  1.00 
assi (resid 30 and name  CG2 ) (resid  8 and name   CA )  4.50  2.00  1.00 
assi (resid  8 and name  CD1 ) (resid 30 and name  CG2 )  5.50  3.00  1.00 
assi (resid 30 and name  CG2 ) (resid  8 and name  CD2 )  4.50  2.00  1.00 
assi (resid 30 and name  CG2 ) (resid 10 and name   CA )  5.50  3.00  1.00 
assi (resid 30 and name  CG2 ) (resid 10 and name  CD1 )  6.50  4.00  1.00 
assi (resid 30 and name  CG2 ) (resid 10 and name  CD2 )  5.50  3.00  1.00 
assi (resid 30 and name  CG2 ) (resid 29 and name   CB )  6.50  4.00  1.00 
assi (resid 30 and name  CG2 ) (resid 31 and name  CD1 )  3.50  1.00  1.00 
assi (resid 31 and name   CA ) (resid 32 and name   CB )  6.50  4.00  1.00 
assi (resid 31 and name   CA ) (resid 46 and name  CG1 )  6.50  4.00  1.00 
assi (resid 31 and name  CD2 ) (resid 44 and name  CG2 )  6.50  4.00  1.00 
assi (resid 32 and name   CA ) (resid 33 and name  CD2 )  6.50  4.00  1.00 
assi (resid 32 and name   CB ) (resid 33 and name   CA )  5.50  3.00  1.00 
assi (resid 33 and name  CD1 ) (resid 32 and name   CA )  6.50  4.00  1.00 
assi (resid 33 and name  CD1 ) (resid 32 and name   CB )  6.50  4.00  1.00 
assi (resid 33 and name  CD1 ) (resid 36 and name   CB )  6.50  4.00  1.00 
assi (resid 33 and name  CD2 ) (resid 32 and name   CB )  6.50  4.00  1.00 
assi (resid 33 and name  CD2 ) (resid 36 and name   CB )  6.50  4.00  1.00 
assi (resid 33 and name  CD2 ) (resid 44 and name  CG1 )  6.50  4.00  1.00 
assi (resid 34 and name  CD1 ) (resid 43 and name   CB )  6.50  4.00  1.00 
assi (resid 34 and name  CD1 ) (resid 43 and name   CD )  6.50  4.00  1.00 
assi (resid 34 and name  CD2 ) (resid 43 and name   CB )  6.50  4.00  1.00 
assi (resid 34 and name  CD2 ) (resid 43 and name   CD )  5.50  3.00  1.00 
assi (resid 38 and name   CB ) (resid 39 and name   CB )  4.50  2.00  1.00 
assi (resid 43 and name   CB ) (resid 34 and name   CA )  6.50  4.00  1.00 
assi (resid 43 and name   CD ) (resid 34 and name   CA )  6.50  4.00  1.00 
assi (resid 44 and name  CG1 ) (resid 31 and name   CA )  6.50  4.00  1.00 
assi (resid 33 and name   CA ) (resid 44 and name  CG1 )  5.50  3.00  1.00 
assi (resid 44 and name  CG1 ) (resid 53 and name  CG1 )  6.50  4.00  1.00 
assi (resid 44 and name  CG2 ) (resid 31 and name   CA )  6.50  4.00  1.00 
assi (resid 44 and name  CG2 ) (resid 33 and name   CA )  6.50  4.00  1.00 
assi (resid 44 and name  CG2 ) (resid 33 and name  CD1 )  6.50  4.00  1.00 
assi (resid 44 and name  CG2 ) (resid 33 and name  CD2 )  5.50  3.00  1.00 
assi (resid 44 and name  CG2 ) (resid 53 and name  CG1 )  3.50  1.00  1.00 
assi (resid 46 and name  CG1 ) (resid 31 and name  CD1 )  5.50  3.00  1.00 
assi (resid 46 and name  CG1 ) (resid 31 and name  CD2 )  5.50  3.00  1.00 
assi (resid 46 and name  CG2 ) (resid 31 and name   CA )  6.50  4.00  1.00 
assi (resid 46 and name  CG2 ) (resid 31 and name  CD1 )  5.50  3.00  1.00 
assi (resid 46 and name  CG2 ) (resid 31 and name  CD2 )  5.50  3.00  1.00 
assi (resid 53 and name  CG1 ) (resid 25 and name   CB )  6.50  4.00  1.00 
assi (resid 53 and name  CG1 ) (resid 25 and name   CG )  6.50  4.00  1.00 
assi (resid 53 and name  CG2 ) (resid 23 and name  CG1 )  6.50  4.00  1.00 
assi (resid 53 and name  CG2 ) (resid 23 and name  CG2 )  6.50  4.00  1.00 
assi (resid 53 and name  CG2 ) (resid 25 and name   CE )  4.50  2.00  1.00 
assi (resid 53 and name  CG2 ) (resid 44 and name  CG1 )  3.50  1.00  1.00 
assi (resid 53 and name  CG2 ) (resid 44 and name  CG2 )  3.50  1.00  1.00 
assi (resid 54 and name   CA ) (resid 53 and name  CG1 )  6.50  4.00  1.00 
assi (resid 55 and name   CB ) (resid 56 and name   CB )  5.50  3.00  1.00 
assi (resid 55 and name   CB ) (resid 58 and name  CG2 )  6.50  4.00  1.00 
assi (resid 58 and name  CG1 ) (resid 12 and name   CA )  6.50  4.00  1.00 
assi (resid 58 and name  CG1 ) (resid 12 and name  CD1 )  6.50  4.00  1.00 
assi (resid 58 and name  CG1 ) (resid 55 and name   CB )  6.50  4.00  1.00 
assi (resid 58 and name  CG1 ) (resid 59 and name   CD )  5.50  3.00  1.00 
assi (resid 58 and name  CG2 ) (resid  9 and name  CG1 )  4.50  2.00  1.00 
assi (resid 58 and name  CG2 ) (resid 10 and name   CA )  5.50  3.00  1.00 
assi (resid 12 and name   CA ) (resid 58 and name  CG2 )  5.50  3.00  1.00 
assi (resid 58 and name  CG2 ) (resid 12 and name  CD1 )  6.50  4.00  1.00 
assi (resid 58 and name  CG2 ) (resid 59 and name   CD )  6.50  4.00  1.00 
assi (resid 59 and name   CB ) (resid 10 and name   CA )  6.50  4.00  1.00 
assi (resid 59 and name   CB ) (resid 10 and name  CD1 )  6.50  4.00  1.00 
assi (resid 59 and name   CB ) (resid 58 and name  CG1 )  6.50  4.00  1.00 
assi (resid 59 and name   CB ) (resid 58 and name  CG2 )  6.50  4.00  1.00 
assi (resid 59 and name   CD ) (resid 10 and name   CA )  5.50  3.00  1.00 
assi (resid  8 and name   CB ) (resid  7 and name    C )  6.50  4.00  1.00 
assi (resid  9 and name   CA ) (resid  8 and name    C )  6.50  4.00  1.00 
assi (resid  9 and name   CA ) (resid 10 and name    C )  6.50  4.00  1.00 
assi (resid 11 and name   CA ) (resid 10 and name    C )  6.50  4.00  1.00 
assi (resid 15 and name   CA ) (resid 14 and name    C )  6.50  4.00  1.00 
assi (resid 15 and name   CA ) (resid 16 and name    C )  6.50  4.00  1.00 
assi (resid 23 and name   CB ) (resid 49 and name   CZ )  6.50  4.00  1.00 
assi (resid 32 and name   CA ) (resid 31 and name    C )  6.50  4.00  1.00 
assi (resid 36 and name   CA ) (resid 35 and name    C )  6.50  4.00  1.00 
assi (resid 36 and name   CA ) (resid 37 and name    C )  6.50  4.00  1.00 
assi (resid 36 and name   CA ) (resid 42 and name   CG )  6.50  4.00  1.00
assi (resid 36 and name   CA ) (resid 42 and name  CZ3 )  6.50  4.00  1.00
assi (resid 43 and name   CA ) (resid 52 and name   CG )  6.50  4.00  1.00 
assi (resid 51 and name   CA ) (resid 50 and name    C )  6.50  4.00  1.00 
assi (resid  9 and name   CA ) (resid  8 and name   CB )  6.50  4.00  1.00 
assi (resid  8 and name   CB ) (resid  9 and name   CA )  5.50  3.00  1.00 
assi (resid  8 and name   CB ) (resid 30 and name   CB )  6.50  4.00  1.00 
assi (resid  8 and name   CG ) (resid  9 and name   CA )  4.50  2.00  1.00 
assi (resid  8 and name   CG ) (resid 30 and name  CD1 )  6.50  4.00  1.00 
assi (resid  9 and name   CA ) (resid 10 and name   CB )  6.50  4.00  1.00 
assi (resid  9 and name   CA ) (resid 31 and name   CB )  6.50  4.00  1.00 
assi (resid  9 and name   CA ) (resid 59 and name   CE )  6.50  4.00  1.00 
assi (resid  9 and name   CB ) (resid  8 and name   CB )  5.50  3.00  1.00 
assi (resid  9 and name   CB ) (resid 10 and name   CB )  5.50  3.00  1.00 
assi (resid  9 and name   CB ) (resid 10 and name   CG )  5.50  3.00  1.00 
assi (resid  9 and name   CB ) (resid 31 and name   CB )  6.50  4.00  1.00 
assi (resid  9 and name   CB ) (resid 61 and name   CB )  6.50  4.00  1.00 
assi (resid 10 and name   CB ) (resid 11 and name   CA )  6.50  4.00  1.00 
assi (resid 10 and name   CG ) (resid 11 and name   CA )  6.50  4.00  1.00 
assi (resid 10 and name   CG ) (resid 28 and name   CA )  6.50  4.00  1.00 
assi (resid 10 and name   CG ) (resid 59 and name   CA )  5.50  3.00  1.00 
assi (resid 11 and name   CA ) (resid 58 and name   CA )  5.50  3.00  1.00 
assi (resid 12 and name   CB ) (resid 11 and name   CA )  6.50  4.00  1.00 
assi (resid 12 and name   CB ) (resid 13 and name   CA )  4.50  2.00  1.00 
assi (resid 12 and name   CB ) (resid 57 and name   CA )  5.50  3.00  1.00 
assi (resid 12 and name   CG ) (resid 11 and name   CA )  5.50  3.00  1.00 
assi (resid 13 and name   CA ) (resid 12 and name   CG )  6.50  4.00  1.00 
assi (resid 14 and name   CB ) (resid 13 and name   CA )  4.50  2.00  1.00 
assi (resid 14 and name   CB ) (resid 15 and name   CA )  4.50  2.00  1.00 
assi (resid 15 and name   CA ) (resid 24 and name   CA )  6.50  4.00  1.00 
assi (resid 15 and name   CA ) (resid 54 and name   CA )  6.50  4.00  1.00 
assi (resid 16 and name   CB ) (resid 15 and name   CA )  6.50  4.00  1.00 
assi (resid 17 and name   CA ) (resid 23 and name   CA )  4.50  2.00  1.00 
assi (resid 17 and name   CB ) (resid 23 and name   CB )  5.50  3.00  1.00 
assi (resid 18 and name   CG ) (resid 19 and name   CA )  6.50  4.00  1.00 
assi (resid 20 and name   CB ) (resid 19 and name   CA )  4.50  2.00  1.00 
assi (resid 20 and name   CD ) (resid 19 and name   CA )  3.50  1.00  1.00 
assi (resid 23 and name   CA ) (resid 17 and name   CB )  6.50  4.00  1.00 
assi (resid 23 and name   CB ) (resid 17 and name   CA )  6.50  4.00  1.00 
assi (resid 23 and name   CB ) (resid 24 and name   CA )  4.50  2.00  1.00 
assi (resid 23 and name   CB ) (resid 49 and name   CD )  6.50  4.00  1.00 
assi (resid 23 and name   CB ) (resid 51 and name   CA )  6.50  4.00  1.00 
assi (resid 24 and name   CB ) (resid 16 and name   CB )  6.50  4.00  1.00 
assi (resid 15 and name   CA ) (resid 24 and name  CG2 )  6.50  4.00  1.00 
assi (resid 24 and name  CG2 ) (resid 15 and name   CA )  6.50  4.00  1.00 
assi (resid 24 and name  CG2 ) (resid 23 and name   CA )  6.50  4.00  1.00 
assi (resid 24 and name  CG2 ) (resid 23 and name   CB )  6.50  4.00  1.00 
assi (resid 24 and name  CG2 ) (resid 25 and name   CA )  6.50  4.00  1.00 
assi (resid 25 and name   CA ) (resid 15 and name   CA )  4.50  2.00  1.00 
assi (resid 25 and name   CA ) (resid 24 and name   CB )  6.50  4.00  1.00 
assi (resid 25 and name   CB ) (resid 26 and name   CA )  6.50  4.00  1.00 
assi (resid 25 and name   CG ) (resid 15 and name   CA )  6.50  4.00  1.00 
assi (resid 25 and name   CG ) (resid 53 and name   CB )  6.50  4.00  1.00 
assi (resid 27 and name   CE ) (resid 28 and name   CA )  6.50  4.00  1.00 
assi (resid 27 and name   CG ) (resid 28 and name   CA )  6.50  4.00  1.00 
assi (resid 28 and name   CA ) (resid 10 and name   CB )  3.50  1.00  1.00 
assi (resid 29 and name   CB ) (resid 30 and name  CD1 )  6.50  4.00  1.00 
assi (resid 30 and name   CB ) (resid  8 and name   CG )  5.50  3.00  1.00 
assi (resid 30 and name   CB ) (resid 29 and name   CA )  6.50  4.00  1.00 
assi (resid 30 and name   CB ) (resid 31 and name   CB )  6.50  4.00  1.00 
assi (resid 30 and name  CD1 ) (resid 10 and name   CG )  6.50  4.00  1.00 
assi (resid 30 and name  CD1 ) (resid 29 and name   CA )  6.50  4.00  1.00 
assi (resid 30 and name  CD1 ) (resid 31 and name   CG )  6.50  4.00  1.00 
assi (resid 31 and name   CB ) (resid 32 and name   CA )  6.50  4.00  1.00 
assi (resid 31 and name   CB ) (resid 44 and name   CA )  5.50  3.00  1.00 
assi (resid 31 and name   CG ) (resid  9 and name   CA )  6.50  4.00  1.00 
assi (resid 31 and name   CG ) (resid  9 and name   CB )  6.50  4.00  1.00 
assi (resid 31 and name   CG ) (resid 32 and name   CA )  6.50  4.00  1.00 
assi (resid 31 and name   CG ) (resid 44 and name   CA )  6.50  4.00  1.00 
assi (resid 32 and name  CG2 ) (resid 31 and name   CG )  6.50  4.00  1.00 
assi (resid 32 and name  CG2 ) (resid 33 and name   CB )  6.50  4.00  1.00 
assi (resid 32 and name  CG2 ) (resid 33 and name   CG )  4.50  2.00  1.00 
assi (resid 33 and name   CB ) (resid 32 and name   CA )  6.50  4.00  1.00 
assi (resid 33 and name   CB ) (resid 32 and name   CB )  6.50  4.00  1.00 
assi (resid 33 and name   CB ) (resid 36 and name   CA )  6.50  4.00  1.00 
assi (resid 33 and name   CB ) (resid 44 and name   CA )  6.50  4.00  1.00 
assi (resid 33 and name   CG ) (resid  9 and name   CA )  5.50  3.00  1.00 
assi (resid 33 and name   CG ) (resid  9 and name   CB )  4.50  2.00  1.00 
assi (resid 33 and name   CG ) (resid 32 and name   CA )  6.50  4.00  1.00 
assi (resid 33 and name   CG ) (resid 44 and name   CA )  5.50  3.00  1.00 
assi (resid 33 and name   CG ) (resid 44 and name   CB )  6.50  4.00  1.00 
assi (resid 36 and name   CA ) (resid 37 and name   CB )  6.50  4.00  1.00 
assi (resid 37 and name  CG2 ) (resid 36 and name   CA )  5.50  3.00  1.00 
assi (resid 38 and name   CB ) (resid 39 and name   CA )  4.50  2.00  1.00 
assi (resid 40 and name   CB ) (resid 41 and name   CA )  6.50  4.00  1.00 
assi (resid 41 and name   CA ) (resid 54 and name   CA )  6.50  4.00  1.00 
assi (resid 43 and name   CE ) (resid 51 and name   CA )  6.50  4.00  1.00 
assi (resid 44 and name   CB ) (resid 33 and name   CB )  6.50  4.00  1.00 
assi (resid 44 and name   CB ) (resid 43 and name   CA )  6.50  4.00  1.00 
assi (resid 49 and name   CD ) (resid 23 and name   CA )  6.50  4.00  1.00 
assi (resid 50 and name   CB ) (resid 51 and name   CA )  6.50  4.00  1.00 
assi (resid 51 and name   CA ) (resid 23 and name   CA )  6.50  4.00  1.00 
assi (resid 43 and name   CA ) (resid 51 and name   CA )  3.50  1.00  1.00 
assi (resid 53 and name   CA ) (resid 23 and name   CA )  6.50  4.00  1.00 
assi (resid 53 and name   CB ) (resid 23 and name   CB )  6.50  4.00  1.00 
assi (resid 53 and name   CB ) (resid 52 and name   CA )  6.50  4.00  1.00 
assi (resid 53 and name   CB ) (resid 54 and name   CA )  4.50  2.00  1.00 
assi (resid 53 and name   CB ) (resid 54 and name   CD )  3.50  1.00  1.00 
assi (resid 54 and name   CA ) (resid 56 and name   CA )  6.50  4.00  1.00 
assi (resid 54 and name   CB ) (resid 53 and name   CB )  6.50  4.00  1.00 
assi (resid 54 and name   CD ) (resid 15 and name   CA )  6.50  4.00  1.00 
assi (resid 54 and name   CD ) (resid 41 and name   CA )  6.50  4.00  1.00 
assi (resid 54 and name   CD ) (resid 53 and name   CA )  3.50  1.00  1.00 
assi (resid 54 and name   CD ) (resid 56 and name   CA )  6.50  4.00  1.00 
assi (resid 58 and name   CB ) (resid 11 and name   CA )  5.50  3.00  1.00 
assi (resid 58 and name   CB ) (resid 55 and name   CA )  6.50  4.00  1.00 
assi (resid 58 and name   CB ) (resid 57 and name   CA )  4.50  2.00  1.00 
assi (resid 58 and name   CB ) (resid 59 and name   CA )  4.50  2.00  1.00 
assi (resid 59 and name   CA ) (resid 10 and name   CB )  6.50  4.00  1.00 
assi (resid 59 and name   CE ) (resid  9 and name   CB )  6.50  4.00  1.00 
assi (resid 59 and name   CE ) (resid 10 and name   CB )  6.50  4.00  1.00 
assi (resid 59 and name   CE ) (resid 58 and name   CA )  6.50  4.00  1.00 
assi (resid 59 and name   CG ) (resid  9 and name   CA )  6.50  4.00  1.00 
assi (resid 59 and name   CG ) (resid  9 and name   CB )  6.50  4.00  1.00 
assi (resid 59 and name   CG ) (resid 58 and name   CA )  6.50  4.00  1.00 
assi (resid 59 and name   CG ) (resid 58 and name   CB )  6.50  4.00  1.00 
assi (resid 60 and name   CG ) (resid 59 and name   CA )  5.50  3.00  1.00 
assi (resid 61 and name   CB ) (resid  9 and name   CA )  6.50  4.00  1.00 

Nitrogen-nitrogen restraints

assi (resid 14 and name  N ) (resid  27 and name  N or resid  29 and name  N or resid  44 and name  N  )  4.00  1.00  2.00 
assi (resid 23 and name  N ) (resid  15 and name  N or  resid  52 and name  N  )  4.00  1.00  2.00
assi (resid 19 and name  N ) (resid  17 and name  N or resid  22 and name  N  )  4.00  1.00  2.00
assi (resid 25 and name  N or resid  39 and name  N) (resid  16 and name  N or resid  60 and name  N )  4.00  1.00  2.00
assi (resid 25 and name  N or resid  39 and name  N) (resid  41 and name  N )  4.00  1.00  2.00
assi (resid 44 and name  N or resid  27 and name  N ) (resid  15 and name  N or resid  52 and name  N ) 4.00  1.00  2.00









  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    GLU   7           H        GLU   7  -3.256   8.335  -7.748
    2    HA   GLU   7           HA       GLU   7  -0.538   9.318  -7.542
    3   1HB   GLU   7          1HB       GLU   7  -1.475  10.805  -9.238
    4   1HG   GLU   7          1HG       GLU   7  -1.337  12.240  -6.596
    5    H    LEU   8           H        LEU   8  -0.414   8.603  -5.460
    6    HA   LEU   8           HA       LEU   8  -1.374  10.234  -3.403
    7   1HB   LEU   8          1HB       LEU   8  -3.346   8.499  -4.300
    8    HG   LEU   8           HG       LEU   8  -3.136   9.758  -1.564
    9   1HD1  LEU   8          1HD1      LEU   8  -4.488  10.708  -4.085
   10   2HD1  LEU   8          2HD1      LEU   8  -3.009  11.372  -3.391
   11   3HD1  LEU   8          3HD1      LEU   8  -4.533  11.512  -2.515
   12   1HD2  LEU   8          1HD2      LEU   8  -5.236   8.154  -2.889
   13   2HD2  LEU   8          2HD2      LEU   8  -5.762   9.599  -2.026
   14   3HD2  LEU   8          3HD2      LEU   8  -4.861   8.345  -1.176
   15    H    VAL   9           H        VAL   9  -1.134   6.683  -3.558
   16    HA   VAL   9           HA       VAL   9   1.510   6.637  -2.469
   17    HB   VAL   9           HB       VAL   9   0.712   5.268  -0.415
   18   1HG1  VAL   9          1HG1      VAL   9   0.176   8.202  -0.176
   19   2HG1  VAL   9          2HG1      VAL   9   1.793   7.615  -0.564
   20   3HG1  VAL   9          3HG1      VAL   9   1.014   7.123   0.940
   21   1HG2  VAL   9          1HG2      VAL   9  -1.698   7.046  -0.667
   22   2HG2  VAL   9          2HG2      VAL   9  -1.416   5.729   0.471
   23   3HG2  VAL   9          3HG2      VAL   9  -1.701   5.375  -1.232
   24    H    LEU  10           H        LEU  10   1.166   5.475  -4.655
   25    HA   LEU  10           HA       LEU  10  -0.095   2.974  -4.786
   26   1HB   LEU  10          1HB       LEU  10   1.511   2.562  -6.697
   27    HG   LEU  10           HG       LEU  10   2.794   4.938  -5.601
   28   1HD1  LEU  10          1HD1      LEU  10   3.435   2.765  -7.552
   29   2HD1  LEU  10          2HD1      LEU  10   4.181   3.129  -5.996
   30   3HD1  LEU  10          3HD1      LEU  10   4.493   4.167  -7.386
   31   1HD2  LEU  10          1HD2      LEU  10   3.199   5.991  -7.815
   32   2HD2  LEU  10          2HD2      LEU  10   1.537   6.150  -7.248
   33   3HD2  LEU  10          3HD2      LEU  10   1.934   4.964  -8.490
   34    H    ALA  11           H        ALA  11   0.922   0.850  -4.945
   35    HA   ALA  11           HA       ALA  11   2.581   0.317  -2.687
   36   1HB   ALA  11          1HB       ALA  11   1.172  -1.272  -4.730
   37   2HB   ALA  11          2HB       ALA  11   1.255  -1.483  -2.981
   38   3HB   ALA  11          3HB       ALA  11   2.586  -2.031  -3.999
   39    H    LEU  12           H        LEU  12   3.211   0.999  -5.999
   40    HA   LEU  12           HA       LEU  12   5.178   1.350  -7.103
   41   1HB   LEU  12          1HB       LEU  12   6.720   0.325  -4.742
   42    HG   LEU  12           HG       LEU  12   4.935   2.331  -4.325
   43   1HD1  LEU  12          1HD1      LEU  12   5.880   2.342  -2.304
   44   2HD1  LEU  12          2HD1      LEU  12   7.458   2.802  -2.941
   45   3HD1  LEU  12          3HD1      LEU  12   6.963   1.110  -2.948
   46   1HD2  LEU  12          1HD2      LEU  12   7.488   3.810  -4.830
   47   2HD2  LEU  12          2HD2      LEU  12   5.854   4.439  -4.625
   48   3HD2  LEU  12          3HD2      LEU  12   6.297   3.609  -6.115
   49    H    TYR  13           H        TYR  13   3.774  -1.371  -6.615
   50    HA   TYR  13           HA       TYR  13   5.186  -2.859  -8.480
   51   1HB   TYR  13          1HB       TYR  13   6.486  -2.929  -5.987
   52    HD1  TYR  13           HD1      TYR  13   7.451  -5.957  -6.515
   53    HD2  TYR  13           HD2      TYR  13   7.145  -2.417  -8.855
   54    HE1  TYR  13           HE1      TYR  13   9.259  -6.769  -7.970
   55    HE2  TYR  13           HE2      TYR  13   8.952  -3.220 -10.316
   56    HH   TYR  13           HH       TYR  13  11.066  -5.426  -9.586
   57    H    ASP  14           H        ASP  14   3.935  -4.104  -5.394
   58    HA   ASP  14           HA       ASP  14   1.295  -4.500  -5.999
   59   1HB   ASP  14          1HB       ASP  14   1.373  -6.986  -6.673
   60    H    TYR  15           H        TYR  15   4.193  -5.929  -4.645
   61    HA   TYR  15           HA       TYR  15   4.659  -6.787  -2.593
   62   1HB   TYR  15          1HB       TYR  15   3.387  -4.916  -1.665
   63    HD1  TYR  15           HD1      TYR  15   1.074  -6.236   0.266
   64    HD2  TYR  15           HD2      TYR  15   5.198  -6.896  -0.538
   65    HE1  TYR  15           HE1      TYR  15   1.349  -7.215   2.505
   66    HE2  TYR  15           HE2      TYR  15   5.484  -7.877   1.698
   67    HH   TYR  15           HH       TYR  15   2.923  -8.829   3.629
   68    H    GLN  16           H        GLN  16   1.188  -7.463  -3.101
   69    HA   GLN  16           HA       GLN  16  -0.012  -9.385  -2.839
   70   1HB   GLN  16          1HB       GLN  16   0.899 -11.311  -4.190
   71   1HG   GLN  16          1HG       GLN  16   3.082  -9.371  -4.907
   72   1HE2  GLN  16          1HE2      GLN  16   3.990 -12.537  -4.938
   73   2HE2  GLN  16          2HE2      GLN  16   3.781 -12.876  -6.619
   74    H    GLU  17           H        GLU  17   0.092  -9.666  -0.611
   75    HA   GLU  17           HA       GLU  17   2.192 -10.826   0.815
   76   1HB   GLU  17          1HB       GLU  17   0.347  -9.649   1.902
   77   1HG   GLU  17          1HG       GLU  17  -0.200 -11.194   3.720
   78    H    LYS  18           H        LYS  18  -0.869 -12.429  -0.085
   79    HA   LYS  18           HA       LYS  18   0.324 -14.728  -1.161
   80   1HB   LYS  18          1HB       LYS  18   0.657 -14.721   1.545
   81   1HG   LYS  18          1HG       LYS  18   1.674 -16.316  -0.051
   82   1HD   LYS  18          1HD       LYS  18  -0.694 -16.966  -0.937
   83   1HE   LYS  18          1HE       LYS  18  -1.236 -19.274   0.072
   84   1HZ   LYS  18          1HZ       LYS  18  -2.942 -18.323   1.166
   85   2HZ   LYS  18          2HZ       LYS  18  -2.382 -16.913   0.418
   86   3HZ   LYS  18          3HZ       LYS  18  -1.961 -17.242   2.022
   87    H    SER  19           H        SER  19  -1.219 -14.983  -2.649
   88    HA   SER  19           HA       SER  19  -3.237 -15.392  -3.613
   89   1HB   SER  19          1HB       SER  19  -4.560 -16.225  -1.102
   90    HG   SER  19           HG       SER  19  -2.401 -17.757  -2.099
   91    HA   PRO  20           HA       PRO  20  -5.875 -11.925  -2.961
   92   1HB   PRO  20          1HB       PRO  20  -8.313 -12.838  -3.731
   93   1HG   PRO  20          1HG       PRO  20  -7.889 -15.120  -3.714
   94   1HD   PRO  20          1HD       PRO  20  -5.743 -15.960  -3.672
   95    H    ARG  21           H        ARG  21  -5.381 -12.691  -0.534
   96    HA   ARG  21           HA       ARG  21  -8.002 -12.754   0.788
   97   1HB   ARG  21          1HB       ARG  21  -6.628 -14.991   0.779
   98   1HG   ARG  21          1HG       ARG  21  -8.609 -14.111   2.381
   99   1HD   ARG  21          1HD       ARG  21  -6.150 -14.187   3.992
  100    HE   ARG  21           HE       ARG  21  -6.889 -15.820   5.386
  101   1HH1  ARG  21          1HH1      ARG  21  -9.679 -14.191   4.068
  102   2HH1  ARG  21          2HH1      ARG  21 -10.813 -15.116   4.995
  103   1HH2  ARG  21          1HH2      ARG  21  -8.376 -17.038   6.607
  104   2HH2  ARG  21          2HH2      ARG  21 -10.074 -16.732   6.436
  105    H    GLU  22           H        GLU  22  -4.535 -12.475   1.595
  106    HA   GLU  22           HA       GLU  22  -5.147 -10.419   3.554
  107   1HB   GLU  22          1HB       GLU  22  -3.302 -12.402   3.543
  108   1HG   GLU  22          1HG       GLU  22  -1.982 -10.629   5.106
  109    H    VAL  23           H        VAL  23  -2.970  -8.790   3.479
  110    HA   VAL  23           HA       VAL  23  -3.658  -6.888   1.550
  111    HB   VAL  23           HB       VAL  23  -1.373  -5.870   2.130
  112   1HG1  VAL  23          1HG1      VAL  23  -3.000  -6.332   4.587
  113   2HG1  VAL  23          2HG1      VAL  23  -3.724  -5.503   3.209
  114   3HG1  VAL  23          3HG1      VAL  23  -2.281  -4.841   3.977
  115   1HG2  VAL  23          1HG2      VAL  23  -1.390  -7.802   4.414
  116   2HG2  VAL  23          2HG2      VAL  23  -0.082  -6.776   3.828
  117   3HG2  VAL  23          3HG2      VAL  23  -0.562  -8.205   2.912
  118    H    THR  24           H        THR  24  -3.572  -7.432  -0.561
  119    HA   THR  24           HA       THR  24  -0.924  -8.070  -1.661
  120    HB   THR  24           HB       THR  24  -1.943  -9.650  -3.246
  121    HG1  THR  24           HG1      THR  24  -4.010  -9.649  -3.468
  122   1HG2  THR  24          1HG2      THR  24  -2.996 -11.173  -1.222
  123   2HG2  THR  24          2HG2      THR  24  -1.857 -10.117  -0.385
  124   3HG2  THR  24          3HG2      THR  24  -1.304 -11.128  -1.720
  125    H    MET  25           H        MET  25  -0.456  -6.245  -2.732
  126    HA   MET  25           HA       MET  25  -2.526  -4.799  -4.166
  127   1HB   MET  25          1HB       MET  25   0.093  -4.188  -3.080
  128   1HG   MET  25          1HG       MET  25  -0.692  -1.900  -3.139
  129   1HE   MET  25          1HE       MET  25  -1.020  -2.198  -0.119
  130   2HE   MET  25          2HE       MET  25  -0.130  -3.338  -1.126
  131   3HE   MET  25          3HE       MET  25  -1.306  -3.929   0.048
  132    H    LYS  26           H        LYS  26  -1.894  -3.968  -6.418
  133    HA   LYS  26           HA       LYS  26  -0.280  -5.764  -8.000
  134   1HB   LYS  26          1HB       LYS  26  -2.696  -6.736  -7.665
  135   1HG   LYS  26          1HG       LYS  26  -2.749  -7.476 -10.099
  136   1HD   LYS  26          1HD       LYS  26  -0.290  -7.869  -8.402
  137   1HE   LYS  26          1HE       LYS  26  -0.234  -8.439 -10.980
  138   1HZ   LYS  26          1HZ       LYS  26  -1.950  -9.842 -11.387
  139   2HZ   LYS  26          2HZ       LYS  26  -1.980 -10.473  -9.819
  140   3HZ   LYS  26          3HZ       LYS  26  -0.804 -10.994 -10.916
  141    H    LYS  27           H        LYS  27   0.662  -4.653  -9.577
  142    HA   LYS  27           HA       LYS  27   1.168  -3.010 -11.059
  143   1HB   LYS  27          1HB       LYS  27  -0.904  -3.648 -12.158
  144   1HG   LYS  27          1HG       LYS  27   0.018  -0.895 -12.177
  145   1HD   LYS  27          1HD       LYS  27  -2.348  -0.424 -11.759
  146   1HE   LYS  27          1HE       LYS  27  -2.833  -2.073 -14.237
  147   1HZ   LYS  27          1HZ       LYS  27  -5.228  -1.615 -13.316
  148   2HZ   LYS  27          2HZ       LYS  27  -4.478  -0.526 -14.371
  149   3HZ   LYS  27          3HZ       LYS  27  -4.499  -0.214 -12.709
  150    H    GLY  28           H        GLY  28  -1.633  -1.358  -9.631
  151   1HA   GLY  28          1HA       GLY  28  -0.236   0.191  -7.758
  152   2HA   GLY  28          2HA       GLY  28  -0.265   1.072  -9.277
  153    H    ASP  29           H        ASP  29  -2.549  -0.819  -7.291
  154    HA   ASP  29           HA       ASP  29  -4.725   0.925  -8.063
  155   1HB   ASP  29          1HB       ASP  29  -4.745  -1.334  -6.052
  156    H    ILE  30           H        ILE  30  -2.296   1.381  -5.987
  157    HA   ILE  30           HA       ILE  30  -1.932   2.675  -4.163
  158    HB   ILE  30           HB       ILE  30  -4.627   3.937  -4.408
  159   1HG1  ILE  30          1HG1      ILE  30  -3.857   3.632  -6.736
  160   1HG2  ILE  30          1HG2      ILE  30  -3.512   5.102  -2.829
  161   2HG2  ILE  30          2HG2      ILE  30  -2.836   5.929  -4.232
  162   3HG2  ILE  30          3HG2      ILE  30  -1.928   4.638  -3.448
  163   1HD1  ILE  30          1HD1      ILE  30  -1.626   3.559  -6.994
  164   2HD1  ILE  30          2HD1      ILE  30  -1.324   4.658  -5.648
  165   3HD1  ILE  30          3HD1      ILE  30  -1.821   5.298  -7.214
  166    H    LEU  31           H        LEU  31  -2.919   3.396  -1.990
  167    HA   LEU  31           HA       LEU  31  -5.117   2.005  -0.902
  168   1HB   LEU  31          1HB       LEU  31  -3.961   0.387   0.492
  169    HG   LEU  31           HG       LEU  31  -1.579  -0.277  -0.241
  170   1HD1  LEU  31          1HD1      LEU  31  -1.485   1.372  -2.113
  171   2HD1  LEU  31          2HD1      LEU  31  -0.129   1.461  -0.992
  172   3HD1  LEU  31          3HD1      LEU  31  -1.420   2.656  -0.905
  173   1HD2  LEU  31          1HD2      LEU  31  -1.646   2.237   1.370
  174   2HD2  LEU  31          2HD2      LEU  31  -0.703   0.769   1.620
  175   3HD2  LEU  31          3HD2      LEU  31  -2.433   0.772   1.958
  176    H    THR  32           H        THR  32  -5.482   2.531   1.299
  177    HA   THR  32           HA       THR  32  -4.208   4.983   2.124
  178    HB   THR  32           HB       THR  32  -6.108   3.481   3.881
  179    HG1  THR  32           HG1      THR  32  -6.865   4.901   1.546
  180   1HG2  THR  32          1HG2      THR  32  -5.158   6.172   3.675
  181   2HG2  THR  32          2HG2      THR  32  -6.156   5.425   4.923
  182   3HG2  THR  32          3HG2      THR  32  -6.911   6.128   3.492
  183    H    LEU  33           H        LEU  33  -3.736   5.112   4.637
  184    HA   LEU  33           HA       LEU  33  -2.710   2.819   5.923
  185   1HB   LEU  33          1HB       LEU  33  -0.255   3.734   5.781
  186    HG   LEU  33           HG       LEU  33  -1.398   4.653   3.143
  187   1HD1  LEU  33          1HD1      LEU  33   0.166   6.638   3.885
  188   2HD1  LEU  33          2HD1      LEU  33  -0.165   5.991   5.492
  189   3HD1  LEU  33          3HD1      LEU  33  -1.496   6.513   4.460
  190   1HD2  LEU  33          1HD2      LEU  33   1.200   5.154   2.883
  191   2HD2  LEU  33          2HD2      LEU  33   0.474   3.636   2.354
  192   3HD2  LEU  33          3HD2      LEU  33   1.310   3.722   3.905
  193    H    LEU  34           H        LEU  34  -1.166   3.485   7.768
  194    HA   LEU  34           HA       LEU  34  -1.829   6.166   8.765
  195   1HB   LEU  34          1HB       LEU  34  -3.277   4.175   9.657
  196    HG   LEU  34           HG       LEU  34  -3.520   6.334  10.700
  197   1HD1  LEU  34          1HD1      LEU  34  -4.301   5.625  12.739
  198   2HD1  LEU  34          2HD1      LEU  34  -2.919   4.567  13.024
  199   3HD1  LEU  34          3HD1      LEU  34  -4.170   4.092  11.875
  200   1HD2  LEU  34          1HD2      LEU  34  -0.821   5.713  11.821
  201   2HD2  LEU  34          2HD2      LEU  34  -1.916   6.786  12.694
  202   3HD2  LEU  34          3HD2      LEU  34  -1.403   7.190  11.056
  203    H    ASN  35           H        ASN  35   0.216   6.978   8.579
  204    HA   ASN  35           HA       ASN  35   2.385   7.395   9.123
  205   1HB   ASN  35          1HB       ASN  35   2.007   5.470  11.420
  206   1HD2  ASN  35          1HD2      ASN  35   1.340   6.420  13.416
  207   2HD2  ASN  35          2HD2      ASN  35   0.232   7.745  13.416
  208    H    SER  36           H        SER  36   4.393   5.767  10.195
  209    HA   SER  36           HA       SER  36   5.877   4.119   9.677
  210   1HB   SER  36          1HB       SER  36   3.682   2.708   8.158
  211    HG   SER  36           HG       SER  36   2.718   2.330   9.973
  212    H    THR  37           H        THR  37   5.814   6.387   8.114
  213    HA   THR  37           HA       THR  37   6.283   5.383   5.386
  214    HB   THR  37           HB       THR  37   5.771   8.222   6.293
  215    HG1  THR  37           HG1      THR  37   4.091   6.301   5.067
  216   1HG2  THR  37          1HG2      THR  37   6.665   8.747   4.320
  217   2HG2  THR  37          2HG2      THR  37   5.155   8.128   3.652
  218   3HG2  THR  37          3HG2      THR  37   6.578   7.088   3.726
  219    H    ASN  38           H        ASN  38   7.663   7.140   8.076
  220    HA   ASN  38           HA       ASN  38  10.224   7.291   6.628
  221   1HB   ASN  38          1HB       ASN  38   9.300   9.486   7.304
  222   1HD2  ASN  38          1HD2      ASN  38  11.457   9.303   6.191
  223   2HD2  ASN  38          2HD2      ASN  38  12.843   9.792   7.100
  224    H    LYS  39           H        LYS  39   8.872   6.846   9.894
  225    HA   LYS  39           HA       LYS  39  11.296   5.653  10.875
  226   1HB   LYS  39          1HB       LYS  39   9.278   6.946  12.101
  227   1HG   LYS  39          1HG       LYS  39  10.520   4.806  13.740
  228   1HD   LYS  39          1HD       LYS  39   9.179   7.030  14.388
  229   1HE   LYS  39          1HE       LYS  39  11.983   7.856  13.849
  230   1HZ   LYS  39          1HZ       LYS  39  10.525   9.472  15.773
  231   2HZ   LYS  39          2HZ       LYS  39  12.189   9.204  15.622
  232   3HZ   LYS  39          3HZ       LYS  39  11.211   8.047  16.375
  233    H    ASP  40           H        ASP  40   7.971   4.418  10.465
  234    HA   ASP  40           HA       ASP  40   9.084   1.701  10.312
  235   1HB   ASP  40          1HB       ASP  40   6.188   2.453  10.730
  236    H    TRP  41           H        TRP  41   7.287   0.287   8.993
  237    HA   TRP  41           HA       TRP  41   6.127   1.416   6.706
  238   1HB   TRP  41          1HB       TRP  41   7.762   0.580   4.993
  239    HD1  TRP  41           HD1      TRP  41  10.015   1.161   8.100
  240    HE1  TRP  41           HE1      TRP  41  11.878  -0.613   8.063
  241    HE3  TRP  41           HE3      TRP  41   8.532  -1.488   3.986
  242    HZ2  TRP  41           HZ2      TRP  41  12.622  -2.842   6.499
  243    HZ3  TRP  41           HZ3      TRP  41   9.876  -3.427   3.286
  244    HH2  TRP  41           HH2      TRP  41  11.877  -4.088   4.516
  245    H    TRP  42           H        TRP  42   4.993  -0.302   8.266
  246    HA   TRP  42           HA       TRP  42   4.731  -2.688   6.642
  247   1HB   TRP  42          1HB       TRP  42   5.141  -3.099   9.590
  248    HD1  TRP  42           HD1      TRP  42   7.470  -4.176   6.711
  249    HE1  TRP  42           HE1      TRP  42   9.870  -3.475   7.320
  250    HE3  TRP  42           HE3      TRP  42   6.495  -1.587  11.011
  251    HZ2  TRP  42           HZ2      TRP  42  11.178  -2.016   9.353
  252    HZ3  TRP  42           HZ3      TRP  42   8.377  -0.571  12.227
  253    HH2  TRP  42           HH2      TRP  42  10.669  -0.782  11.415
  254    H    LYS  43           H        LYS  43   3.088  -0.361   7.364
  255    HA   LYS  43           HA       LYS  43   0.730  -1.842   8.220
  256   1HB   LYS  43          1HB       LYS  43   1.937  -0.619  10.195
  257   1HG   LYS  43          1HG       LYS  43  -0.973  -0.642   9.585
  258   1HD   LYS  43          1HD       LYS  43  -0.211   0.247  12.288
  259   1HE   LYS  43          1HE       LYS  43  -2.244   1.582  12.045
  260   1HZ   LYS  43          1HZ       LYS  43  -3.703  -0.469  11.242
  261   2HZ   LYS  43          2HZ       LYS  43  -2.981  -0.407  12.770
  262   3HZ   LYS  43          3HZ       LYS  43  -2.245  -1.281  11.522
  263    H    VAL  44           H        VAL  44  -1.078  -1.226   7.188
  264    HA   VAL  44           HA       VAL  44  -1.348   1.405   6.035
  265    HB   VAL  44           HB       VAL  44  -1.667   0.675   3.740
  266   1HG1  VAL  44          1HG1      VAL  44   0.983  -0.362   4.724
  267   2HG1  VAL  44          2HG1      VAL  44   0.595   1.350   4.570
  268   3HG1  VAL  44          3HG1      VAL  44   0.615   0.318   3.139
  269   1HG2  VAL  44          1HG2      VAL  44  -1.202  -1.567   2.997
  270   2HG2  VAL  44          2HG2      VAL  44  -2.418  -1.630   4.272
  271   3HG2  VAL  44          3HG2      VAL  44  -0.743  -2.054   4.629
  272    H    GLU  45           H        GLU  45  -3.449   1.162   4.423
  273    HA   GLU  45           HA       GLU  45  -5.433  -0.565   5.681
  274   1HB   GLU  45          1HB       GLU  45  -5.508   1.501   6.996
  275   1HG   GLU  45          1HG       GLU  45  -7.852   1.149   5.149
  276    H    VAL  46           H        VAL  46  -5.491  -1.636   3.679
  277    HA   VAL  46           HA       VAL  46  -6.129  -0.199   1.265
  278    HB   VAL  46           HB       VAL  46  -6.246  -3.183   1.697
  279   1HG1  VAL  46          1HG1      VAL  46  -5.802  -3.255  -0.728
  280   2HG1  VAL  46          2HG1      VAL  46  -5.897  -1.494  -0.778
  281   3HG1  VAL  46          3HG1      VAL  46  -7.319  -2.442  -0.341
  282   1HG2  VAL  46          1HG2      VAL  46  -4.056  -2.960   2.195
  283   2HG2  VAL  46          2HG2      VAL  46  -3.946  -1.356   1.470
  284   3HG2  VAL  46          3HG2      VAL  46  -3.888  -2.791   0.448
  285    H    ASN  47           H        ASN  47  -7.861  -1.981   3.719
  286    HA   ASN  47           HA       ASN  47 -10.371  -0.956   2.761
  287   1HB   ASN  47          1HB       ASN  47 -11.457  -3.157   2.507
  288   1HD2  ASN  47          1HD2      ASN  47  -8.161  -3.998   1.681
  289   2HD2  ASN  47          2HD2      ASN  47  -8.099  -5.453   2.610
  290    H    ASP  48           H        ASP  48  -9.165  -0.372   5.088
  291    HA   ASP  48           HA       ASP  48  -9.506  -0.252   7.334
  292   1HB   ASP  48          1HB       ASP  48 -12.069  -1.360   6.311
  293    H    ARG  49           H        ARG  49  -7.670  -1.624   7.647
  294    HA   ARG  49           HA       ARG  49  -8.142  -3.788   9.367
  295   1HB   ARG  49          1HB       ARG  49  -8.607  -4.654   6.883
  296   1HG   ARG  49          1HG       ARG  49  -7.692  -5.957   9.307
  297   1HD   ARG  49          1HD       ARG  49  -6.250  -6.723   7.078
  298    HE   ARG  49           HE       ARG  49  -7.934  -9.037   7.405
  299   1HH1  ARG  49          1HH1      ARG  49  -7.300  -6.186   5.492
  300   2HH1  ARG  49          2HH1      ARG  49  -8.070  -6.815   4.075
  301   1HH2  ARG  49          1HH2      ARG  49  -8.946  -9.863   5.540
  302   2HH2  ARG  49          2HH2      ARG  49  -9.004  -8.901   4.102
  303    H    GLN  50           H        GLN  50  -6.112  -4.903  10.000
  304    HA   GLN  50           HA       GLN  50  -4.007  -3.014  10.287
  305   1HB   GLN  50          1HB       GLN  50  -2.801  -4.975  11.352
  306   1HG   GLN  50          1HG       GLN  50  -5.314  -6.466  11.554
  307   1HE2  GLN  50          1HE2      GLN  50  -4.084  -8.763  10.326
  308   2HE2  GLN  50          2HE2      GLN  50  -2.830  -9.286  11.394
  309    H    GLY  51           H        GLY  51  -3.363  -2.518   8.148
  310   1HA   GLY  51          1HA       GLY  51  -2.575  -4.362   6.200
  311   2HA   GLY  51          2HA       GLY  51  -2.010  -2.701   6.303
  312    H    PHE  52           H        PHE  52  -0.527  -5.049   5.483
  313    HA   PHE  52           HA       PHE  52   1.678  -4.815   7.396
  314   1HB   PHE  52          1HB       PHE  52   0.296  -7.320   6.564
  315    HD1  PHE  52           HD1      PHE  52   2.543  -5.660   9.025
  316    HD2  PHE  52           HD2      PHE  52  -0.626  -8.422   8.360
  317    HE1  PHE  52           HE1      PHE  52   2.274  -5.932  11.456
  318    HE2  PHE  52           HE2      PHE  52  -0.902  -8.698  10.790
  319    HZ   PHE  52           HZ       PHE  52   0.549  -7.452  12.342
  320    H    VAL  53           H        VAL  53   1.119  -3.659   4.759
  321    HA   VAL  53           HA       VAL  53   2.967  -5.018   2.971
  322    HB   VAL  53           HB       VAL  53   2.355  -3.345   1.317
  323   1HG1  VAL  53          1HG1      VAL  53   0.672  -5.258   2.378
  324   2HG1  VAL  53          2HG1      VAL  53   0.466  -4.427   0.837
  325   3HG1  VAL  53          3HG1      VAL  53  -0.345  -3.821   2.281
  326   1HG2  VAL  53          1HG2      VAL  53   2.146  -1.335   2.499
  327   2HG2  VAL  53          2HG2      VAL  53   0.991  -2.023   3.641
  328   3HG2  VAL  53          3HG2      VAL  53   0.502  -1.702   1.978
  329    HA   PRO  54           HA       PRO  54   6.645  -2.716   3.683
  330   1HB   PRO  54          1HB       PRO  54   6.606  -1.856   0.836
  331   1HG   PRO  54          1HG       PRO  54   6.384  -4.008  -0.022
  332   1HD   PRO  54          1HD       PRO  54   4.229  -3.624   0.717
  333    H    ALA  55           H        ALA  55   4.924  -0.862   1.165
  334    HA   ALA  55           HA       ALA  55   4.226   1.301   1.070
  335   1HB   ALA  55          1HB       ALA  55   4.477   1.558   4.040
  336   2HB   ALA  55          2HB       ALA  55   3.209   0.559   3.330
  337   3HB   ALA  55          3HB       ALA  55   3.292   2.279   2.951
  338    H    ALA  56           H        ALA  56   7.130   0.513   1.212
  339    HA   ALA  56           HA       ALA  56   8.369   2.903   2.331
  340   1HB   ALA  56          1HB       ALA  56   9.463   0.360   1.164
  341   2HB   ALA  56          2HB       ALA  56   9.595   0.961   2.817
  342   3HB   ALA  56          3HB       ALA  56  10.492   1.747   1.518
  343    H    TYR  57           H        TYR  57   9.498   4.424   1.125
  344    HA   TYR  57           HA       TYR  57   9.644   5.906  -0.612
  345   1HB   TYR  57          1HB       TYR  57  10.671   4.900  -2.675
  346    HD1  TYR  57           HD1      TYR  57   9.497   3.182  -3.921
  347    HD2  TYR  57           HD2      TYR  57  11.495   2.254  -0.281
  348    HE1  TYR  57           HE1      TYR  57   9.341   0.785  -4.453
  349    HE2  TYR  57           HE2      TYR  57  11.346  -0.144  -0.803
  350    HH   TYR  57           HH       TYR  57  11.115  -1.495  -3.202
  351    H    VAL  58           H        VAL  58   7.006   5.099  -0.196
  352    HA   VAL  58           HA       VAL  58   5.754   4.360  -2.656
  353    HB   VAL  58           HB       VAL  58   4.606   5.497  -0.104
  354   1HG1  VAL  58          1HG1      VAL  58   3.388   5.248  -2.681
  355   2HG1  VAL  58          2HG1      VAL  58   2.694   5.840  -1.172
  356   3HG1  VAL  58          3HG1      VAL  58   2.625   4.122  -1.560
  357   1HG2  VAL  58          1HG2      VAL  58   4.224   3.353   0.589
  358   2HG2  VAL  58          2HG2      VAL  58   5.704   3.112  -0.339
  359   3HG2  VAL  58          3HG2      VAL  58   4.141   2.718  -1.055
  360    H    LYS  59           H        LYS  59   4.924   7.278  -0.820
  361    HA   LYS  59           HA       LYS  59   5.545   8.957  -3.114
  362   1HB   LYS  59          1HB       LYS  59   2.758   8.562  -2.034
  363   1HG   LYS  59          1HG       LYS  59   3.616   7.201  -4.013
  364   1HD   LYS  59          1HD       LYS  59   3.290   9.883  -5.357
  365   1HE   LYS  59          1HE       LYS  59   4.173   7.311  -6.628
  366   1HZ   LYS  59          1HZ       LYS  59   4.611   9.456  -7.747
  367   2HZ   LYS  59          2HZ       LYS  59   2.945   9.745  -7.801
  368   3HZ   LYS  59          3HZ       LYS  59   3.603   8.431  -8.639
  369    H    LYS  60           H        LYS  60   6.385   8.618  -0.263
  370    HA   LYS  60           HA       LYS  60   6.757   9.835   1.639
  371   1HB   LYS  60          1HB       LYS  60   7.778  11.973   1.222
  372   1HG   LYS  60          1HG       LYS  60   5.867  12.597  -0.511
  373   1HD   LYS  60          1HD       LYS  60   7.281  10.848  -2.055
  374   1HE   LYS  60          1HE       LYS  60   8.271  12.453  -3.802
  375   1HZ   LYS  60          1HZ       LYS  60  10.317  11.938  -3.043
  376   2HZ   LYS  60          2HZ       LYS  60   9.450  10.960  -1.971
  377   3HZ   LYS  60          3HZ       LYS  60  10.010  12.473  -1.467
  378    H    LEU  61           H        LEU  61   3.971   9.576   1.057
  379    HA   LEU  61           HA       LEU  61   2.534  11.967   1.236
  380   1HB   LEU  61          1HB       LEU  61   1.831   9.404   0.948
  381    HG   LEU  61           HG       LEU  61   0.173  11.718   1.848
  382   1HD1  LEU  61          1HD1      LEU  61  -0.467  11.817  -0.313
  383   2HD1  LEU  61          2HD1      LEU  61  -0.488  10.064  -0.502
  384   3HD1  LEU  61          3HD1      LEU  61   1.041  10.940  -0.571
  385   1HD2  LEU  61          1HD2      LEU  61  -1.172  10.265   2.943
  386   2HD2  LEU  61          2HD2      LEU  61  -0.570   8.865   2.055
  387   3HD2  LEU  61          3HD2      LEU  61  -1.754   9.939   1.309
  388    H    ASP  62           H        ASP  62   2.245  13.393   2.818
  389    HA   ASP  62           HA       ASP  62   3.656  13.257   5.244
  390   1HB   ASP  62          1HB       ASP  62   2.471  15.259   3.880
  Start of MODEL    2
    1    H    GLU   7           H        GLU   7  -1.499  11.757  -3.784
    2    HA   GLU   7           HA       GLU   7  -1.491  12.355  -0.904
    3   1HB   GLU   7          1HB       GLU   7  -2.643  14.036  -2.668
    4   1HG   GLU   7          1HG       GLU   7  -4.471  14.268  -0.689
    5    H    LEU   8           H        LEU   8  -1.311   9.834  -2.405
    6    HA   LEU   8           HA       LEU   8  -3.063   8.275  -0.863
    7   1HB   LEU   8          1HB       LEU   8  -4.284   7.342  -3.003
    8    HG   LEU   8           HG       LEU   8  -3.964  10.253  -3.746
    9   1HD1  LEU   8          1HD1      LEU   8  -2.127   9.452  -4.769
   10   2HD1  LEU   8          2HD1      LEU   8  -3.295   8.861  -5.952
   11   3HD1  LEU   8          3HD1      LEU   8  -2.685   7.779  -4.699
   12   1HD2  LEU   8          1HD2      LEU   8  -5.284   9.058  -5.789
   13   2HD2  LEU   8          2HD2      LEU   8  -6.064   9.948  -4.482
   14   3HD2  LEU   8          3HD2      LEU   8  -5.947   8.191  -4.403
   15    H    VAL   9           H        VAL   9  -3.030   5.932  -1.571
   16    HA   VAL   9           HA       VAL   9  -0.479   5.347  -2.933
   17    HB   VAL   9           HB       VAL   9  -1.755   3.653  -0.787
   18   1HG1  VAL   9          1HG1      VAL   9   0.750   3.507  -2.389
   19   2HG1  VAL   9          2HG1      VAL   9  -0.360   2.224  -1.910
   20   3HG1  VAL   9          3HG1      VAL   9   0.763   2.903  -0.732
   21   1HG2  VAL   9          1HG2      VAL   9  -0.134   4.541   0.765
   22   2HG2  VAL   9          2HG2      VAL   9  -1.086   5.865   0.089
   23   3HG2  VAL   9          3HG2      VAL   9   0.554   5.570  -0.492
   24    H    LEU  10           H        LEU  10  -0.416   3.725  -4.431
   25    HA   LEU  10           HA       LEU  10  -3.015   2.708  -5.321
   26   1HB   LEU  10          1HB       LEU  10  -0.394   2.551  -6.795
   27    HG   LEU  10           HG       LEU  10  -1.498   4.967  -6.245
   28   1HD1  LEU  10          1HD1      LEU  10  -0.083   4.025  -8.727
   29   2HD1  LEU  10          2HD1      LEU  10   0.624   4.746  -7.282
   30   3HD1  LEU  10          3HD1      LEU  10  -0.374   5.725  -8.358
   31   1HD2  LEU  10          1HD2      LEU  10  -2.859   5.712  -8.045
   32   2HD2  LEU  10          2HD2      LEU  10  -3.590   4.232  -7.423
   33   3HD2  LEU  10          3HD2      LEU  10  -2.652   4.192  -8.916
   34    H    ALA  11           H        ALA  11   0.037   1.696  -4.013
   35    HA   ALA  11           HA       ALA  11   0.784  -0.304  -3.228
   36   1HB   ALA  11          1HB       ALA  11  -0.731  -1.640  -2.218
   37   2HB   ALA  11          2HB       ALA  11  -1.759  -1.739  -3.647
   38   3HB   ALA  11          3HB       ALA  11  -1.832  -0.318  -2.605
   39    H    LEU  12           H        LEU  12   1.485   0.151  -5.749
   40    HA   LEU  12           HA       LEU  12   0.675  -1.633  -7.733
   41   1HB   LEU  12          1HB       LEU  12   3.095   0.002  -7.217
   42    HG   LEU  12           HG       LEU  12   1.013  -0.163  -9.319
   43   1HD1  LEU  12          1HD1      LEU  12   2.597   2.219  -8.425
   44   2HD1  LEU  12          2HD1      LEU  12   1.271   1.578  -7.456
   45   3HD1  LEU  12          3HD1      LEU  12   0.966   2.157  -9.095
   46   1HD2  LEU  12          1HD2      LEU  12   3.125  -0.668 -10.527
   47   2HD2  LEU  12          2HD2      LEU  12   3.779   0.860  -9.938
   48   3HD2  LEU  12          3HD2      LEU  12   2.378   0.855 -11.009
   49    H    TYR  13           H        TYR  13   0.876  -3.759  -7.958
   50    HA   TYR  13           HA       TYR  13   1.538  -5.915  -7.664
   51   1HB   TYR  13          1HB       TYR  13   4.061  -4.374  -7.366
   52    HD1  TYR  13           HD1      TYR  13   5.255  -7.275  -8.393
   53    HD2  TYR  13           HD2      TYR  13   2.382  -4.436  -9.727
   54    HE1  TYR  13           HE1      TYR  13   5.593  -8.030 -10.708
   55    HE2  TYR  13           HE2      TYR  13   2.711  -5.184 -12.046
   56    HH   TYR  13           HH       TYR  13   5.211  -6.765 -13.133
   57    H    ASP  14           H        ASP  14  -0.039  -5.439  -5.759
   58    HA   ASP  14           HA       ASP  14   0.906  -5.242  -3.128
   59   1HB   ASP  14          1HB       ASP  14  -1.631  -6.367  -4.302
   60    H    TYR  15           H        TYR  15  -0.705  -8.195  -4.247
   61    HA   TYR  15           HA       TYR  15  -0.266 -10.401  -3.909
   62   1HB   TYR  15          1HB       TYR  15   2.103  -9.298  -4.851
   63    HD1  TYR  15           HD1      TYR  15   0.340 -12.331  -3.760
   64    HD2  TYR  15           HD2      TYR  15   3.292 -10.737  -6.378
   65    HE1  TYR  15           HE1      TYR  15   0.308 -14.418  -5.059
   66    HE2  TYR  15           HE2      TYR  15   3.266 -12.820  -7.684
   67    HH   TYR  15           HH       TYR  15   2.303 -15.575  -6.734
   68    H    GLN  16           H        GLN  16   1.577 -11.732  -2.313
   69    HA   GLN  16           HA       GLN  16   0.419 -11.383   0.260
   70   1HB   GLN  16          1HB       GLN  16   2.881 -12.998  -0.404
   71   1HG   GLN  16          1HG       GLN  16   0.525 -13.370  -1.696
   72   1HE2  GLN  16          1HE2      GLN  16   1.407 -15.179   1.226
   73   2HE2  GLN  16          2HE2      GLN  16  -0.188 -15.750   1.562
   74    H    GLU  17           H        GLU  17   2.392 -11.717   2.091
   75    HA   GLU  17           HA       GLU  17   3.770  -9.127   1.980
   76   1HB   GLU  17          1HB       GLU  17   2.218 -10.345   3.976
   77   1HG   GLU  17          1HG       GLU  17   3.097  -7.831   3.439
   78    H    LYS  18           H        LYS  18   5.796  -9.278   3.623
   79    HA   LYS  18           HA       LYS  18   7.751 -10.760   2.233
   80   1HB   LYS  18          1HB       LYS  18   9.222 -10.105   4.208
   81   1HG   LYS  18          1HG       LYS  18   7.574  -8.000   5.150
   82   1HD   LYS  18          1HD       LYS  18   7.941  -9.370   7.339
   83   1HE   LYS  18          1HE       LYS  18  10.552  -8.699   6.132
   84   1HZ   LYS  18          1HZ       LYS  18  10.745  -7.387   8.126
   85   2HZ   LYS  18          2HZ       LYS  18  10.220  -8.943   8.532
   86   3HZ   LYS  18          3HZ       LYS  18   9.121  -7.658   8.517
   87    H    SER  19           H        SER  19   5.876 -11.418   5.110
   88    HA   SER  19           HA       SER  19   6.244 -14.185   4.986
   89   1HB   SER  19          1HB       SER  19   8.253 -12.706   6.593
   90    HG   SER  19           HG       SER  19   9.456 -14.030   5.513
   91    HA   PRO  20           HA       PRO  20   4.100 -13.165   9.169
   92   1HB   PRO  20          1HB       PRO  20   4.146 -10.618  10.082
   93   1HG   PRO  20          1HG       PRO  20   5.364  -9.616   8.378
   94   1HD   PRO  20          1HD       PRO  20   6.589 -10.854   6.872
   95    H    ARG  21           H        ARG  21   1.934 -12.976   9.174
   96    HA   ARG  21           HA       ARG  21  -0.178 -12.380   8.582
   97   1HB   ARG  21          1HB       ARG  21   1.078  -9.736   7.826
   98   1HG   ARG  21          1HG       ARG  21   1.334 -10.572  10.261
   99   1HD   ARG  21          1HD       ARG  21  -0.624  -9.942  11.652
  100    HE   ARG  21           HE       ARG  21  -1.784 -12.056  10.140
  101   1HH1  ARG  21          1HH1      ARG  21   0.955 -11.241  12.143
  102   2HH1  ARG  21          2HH1      ARG  21   1.228 -12.874  12.651
  103   1HH2  ARG  21          1HH2      ARG  21  -1.426 -14.204  10.805
  104   2HH2  ARG  21          2HH2      ARG  21  -0.124 -14.557  11.891
  105    H    GLU  22           H        GLU  22  -1.316 -12.984   6.857
  106    HA   GLU  22           HA       GLU  22   0.001 -13.222   4.304
  107   1HB   GLU  22          1HB       GLU  22  -2.199 -14.257   3.616
  108   1HG   GLU  22          1HG       GLU  22  -3.258 -13.018   5.800
  109    H    VAL  23           H        VAL  23  -0.648 -12.274   2.358
  110    HA   VAL  23           HA       VAL  23  -2.603 -10.098   2.510
  111    HB   VAL  23           HB       VAL  23   0.071  -9.681   1.184
  112   1HG1  VAL  23          1HG1      VAL  23  -2.370  -8.069   1.642
  113   2HG1  VAL  23          2HG1      VAL  23  -1.252  -8.074   0.279
  114   3HG1  VAL  23          3HG1      VAL  23  -0.821  -7.237   1.769
  115   1HG2  VAL  23          1HG2      VAL  23   0.267 -10.056   3.673
  116   2HG2  VAL  23          2HG2      VAL  23  -0.705  -8.599   3.882
  117   3HG2  VAL  23          3HG2      VAL  23   0.864  -8.505   3.082
  118    H    THR  24           H        THR  24  -3.258  -9.305   0.362
  119    HA   THR  24           HA       THR  24  -2.652 -11.031  -1.899
  120    HB   THR  24           HB       THR  24  -4.516 -12.165  -0.740
  121    HG1  THR  24           HG1      THR  24  -5.751 -12.411  -2.558
  122   1HG2  THR  24          1HG2      THR  24  -5.607  -9.507  -0.593
  123   2HG2  THR  24          2HG2      THR  24  -6.110 -10.984   0.231
  124   3HG2  THR  24          3HG2      THR  24  -6.727 -10.619  -1.380
  125    H    MET  25           H        MET  25  -4.796 -10.179  -3.529
  126    HA   MET  25           HA       MET  25  -5.564  -8.447  -4.800
  127   1HB   MET  25          1HB       MET  25  -4.291  -6.479  -2.912
  128   1HG   MET  25          1HG       MET  25  -7.049  -6.799  -2.327
  129   1HE   MET  25          1HE       MET  25  -4.789  -4.601   0.021
  130   2HE   MET  25          2HE       MET  25  -5.672  -4.637  -1.506
  131   3HE   MET  25          3HE       MET  25  -3.986  -5.156  -1.447
  132    H    LYS  26           H        LYS  26  -4.652  -6.426  -6.001
  133    HA   LYS  26           HA       LYS  26  -1.885  -6.036  -6.236
  134   1HB   LYS  26          1HB       LYS  26  -2.507  -8.476  -7.239
  135   1HG   LYS  26          1HG       LYS  26  -0.524  -7.847  -8.956
  136   1HD   LYS  26          1HD       LYS  26   0.893  -8.085  -6.655
  137   1HE   LYS  26          1HE       LYS  26   1.150  -9.705  -8.325
  138   1HZ   LYS  26          1HZ       LYS  26  -1.746 -10.221  -8.004
  139   2HZ   LYS  26          2HZ       LYS  26  -0.719 -11.320  -8.778
  140   3HZ   LYS  26          3HZ       LYS  26  -0.912  -9.761  -9.402
  141    H    LYS  27           H        LYS  27  -1.640  -5.469  -8.949
  142    HA   LYS  27           HA       LYS  27  -2.079  -3.855 -10.489
  143   1HB   LYS  27          1HB       LYS  27  -4.777  -4.709  -9.606
  144   1HG   LYS  27          1HG       LYS  27  -4.113  -4.155 -12.432
  145   1HD   LYS  27          1HD       LYS  27  -5.102  -6.610 -12.410
  146   1HE   LYS  27          1HE       LYS  27  -6.116  -4.543 -13.393
  147   1HZ   LYS  27          1HZ       LYS  27  -6.937  -4.198 -10.622
  148   2HZ   LYS  27          2HZ       LYS  27  -8.109  -3.872 -11.798
  149   3HZ   LYS  27          3HZ       LYS  27  -6.638  -3.037 -11.817
  150    H    GLY  28           H        GLY  28  -2.843  -1.560 -10.740
  151   1HA   GLY  28          1HA       GLY  28  -1.928  -0.009  -8.574
  152   2HA   GLY  28          2HA       GLY  28  -2.756   0.610  -9.995
  153    H    ASP  29           H        ASP  29  -4.497   1.743  -9.501
  154    HA   ASP  29           HA       ASP  29  -6.417   2.440  -8.503
  155   1HB   ASP  29          1HB       ASP  29  -6.452  -0.496  -8.085
  156    H    ILE  30           H        ILE  30  -7.089   3.379  -6.585
  157    HA   ILE  30           HA       ILE  30  -5.113   3.372  -4.466
  158    HB   ILE  30           HB       ILE  30  -7.679   4.943  -4.454
  159   1HG1  ILE  30          1HG1      ILE  30  -6.517   5.290  -6.623
  160   1HG2  ILE  30          1HG2      ILE  30  -6.607   5.114  -2.384
  161   2HG2  ILE  30          2HG2      ILE  30  -6.105   6.565  -3.250
  162   3HG2  ILE  30          3HG2      ILE  30  -5.006   5.193  -3.117
  163   1HD1  ILE  30          1HD1      ILE  30  -4.275   6.580  -5.127
  164   2HD1  ILE  30          2HD1      ILE  30  -4.383   6.170  -6.840
  165   3HD1  ILE  30          3HD1      ILE  30  -4.190   4.894  -5.638
  166    H    LEU  31           H        LEU  31  -5.823   3.298  -2.175
  167    HA   LEU  31           HA       LEU  31  -8.106   1.500  -1.767
  168   1HB   LEU  31          1HB       LEU  31  -6.406   0.650   0.178
  169    HG   LEU  31           HG       LEU  31  -4.672   1.001  -2.271
  170   1HD1  LEU  31          1HD1      LEU  31  -3.813   2.030   0.358
  171   2HD1  LEU  31          2HD1      LEU  31  -5.073   2.940  -0.470
  172   3HD1  LEU  31          3HD1      LEU  31  -3.524   2.662  -1.261
  173   1HD2  LEU  31          1HD2      LEU  31  -3.326   0.071   0.083
  174   2HD2  LEU  31          2HD2      LEU  31  -3.447  -0.682  -1.508
  175   3HD2  LEU  31          3HD2      LEU  31  -4.685  -0.989  -0.291
  176    H    THR  32           H        THR  32  -6.124   2.143   0.992
  177    HA   THR  32           HA       THR  32  -7.284   4.611   1.776
  178    HB   THR  32           HB       THR  32  -8.432   2.088   2.982
  179    HG1  THR  32           HG1      THR  32  -9.701   4.295   1.738
  180   1HG2  THR  32          1HG2      THR  32  -8.738   4.935   3.894
  181   2HG2  THR  32          2HG2      THR  32  -8.075   3.581   4.808
  182   3HG2  THR  32          3HG2      THR  32  -9.789   3.610   4.391
  183    H    LEU  33           H        LEU  33  -6.705   5.186   4.021
  184    HA   LEU  33           HA       LEU  33  -4.696   3.519   5.298
  185   1HB   LEU  33          1HB       LEU  33  -3.919   6.354   4.790
  186    HG   LEU  33           HG       LEU  33  -3.678   4.144   2.776
  187   1HD1  LEU  33          1HD1      LEU  33  -3.838   6.966   1.987
  188   2HD1  LEU  33          2HD1      LEU  33  -5.242   6.355   2.861
  189   3HD1  LEU  33          3HD1      LEU  33  -4.714   5.562   1.376
  190   1HD2  LEU  33          1HD2      LEU  33  -1.436   5.323   3.688
  191   2HD2  LEU  33          2HD2      LEU  33  -1.918   6.483   2.449
  192   3HD2  LEU  33          3HD2      LEU  33  -1.657   4.791   2.021
  193    H    LEU  34           H        LEU  34  -3.684   5.251   7.125
  194    HA   LEU  34           HA       LEU  34  -5.864   6.716   8.364
  195   1HB   LEU  34          1HB       LEU  34  -5.412   5.470  10.552
  196    HG   LEU  34           HG       LEU  34  -3.938   3.718   8.685
  197   1HD1  LEU  34          1HD1      LEU  34  -3.795   4.672  11.457
  198   2HD1  LEU  34          2HD1      LEU  34  -2.506   4.319  10.307
  199   3HD1  LEU  34          3HD1      LEU  34  -3.266   3.008  11.210
  200   1HD2  LEU  34          1HD2      LEU  34  -5.654   2.184   8.874
  201   2HD2  LEU  34          2HD2      LEU  34  -6.091   2.715  10.498
  202   3HD2  LEU  34          3HD2      LEU  34  -4.631   1.758  10.245
  203    H    ASN  35           H        ASN  35  -4.800   8.607   8.492
  204    HA   ASN  35           HA       ASN  35  -3.335  10.193   9.198
  205   1HB   ASN  35          1HB       ASN  35  -2.656   8.016  11.180
  206   1HD2  ASN  35          1HD2      ASN  35  -4.104   7.854  12.721
  207   2HD2  ASN  35          2HD2      ASN  35  -5.299   9.034  13.125
  208    H    SER  36           H        SER  36  -1.239   7.421   9.907
  209    HA   SER  36           HA       SER  36   0.776   6.769   9.075
  210   1HB   SER  36          1HB       SER  36   0.230   8.211   6.501
  211    HG   SER  36           HG       SER  36  -1.011   6.264   5.955
  212    H    THR  37           H        THR  37   2.901   7.508   8.763
  213    HA   THR  37           HA       THR  37   3.347  10.381   8.529
  214    HB   THR  37           HB       THR  37   3.197  10.250  10.884
  215    HG1  THR  37           HG1      THR  37   5.032  11.355  10.431
  216   1HG2  THR  37          1HG2      THR  37   5.126   7.970  11.035
  217   2HG2  THR  37          2HG2      THR  37   3.386   7.704  10.927
  218   3HG2  THR  37          3HG2      THR  37   4.057   8.609  12.283
  219    H    ASN  38           H        ASN  38   4.854   7.208   9.051
  220    HA   ASN  38           HA       ASN  38   7.163   8.066   7.461
  221   1HB   ASN  38          1HB       ASN  38   8.327   6.149   8.379
  222   1HD2  ASN  38          1HD2      ASN  38   8.330   4.505  10.143
  223   2HD2  ASN  38          2HD2      ASN  38   6.958   3.461  10.256
  224    H    LYS  39           H        LYS  39   7.978   5.480   6.617
  225    HA   LYS  39           HA       LYS  39   6.836   5.242   4.140
  226   1HB   LYS  39          1HB       LYS  39   7.651   2.814   4.240
  227   1HG   LYS  39          1HG       LYS  39   7.577   3.095   6.934
  228   1HD   LYS  39          1HD       LYS  39   9.754   4.601   6.350
  229   1HE   LYS  39          1HE       LYS  39  11.529   2.829   7.355
  230   1HZ   LYS  39          1HZ       LYS  39  11.453   4.327   5.199
  231   2HZ   LYS  39          2HZ       LYS  39  11.283   2.820   4.447
  232   3HZ   LYS  39          3HZ       LYS  39  12.632   3.133   5.418
  233    H    ASP  40           H        ASP  40   4.644   5.277   3.984
  234    HA   ASP  40           HA       ASP  40   2.903   3.739   5.612
  235   1HB   ASP  40          1HB       ASP  40   1.191   4.356   3.843
  236    H    TRP  41           H        TRP  41   2.439   1.657   5.505
  237    HA   TRP  41           HA       TRP  41   1.899   0.237   3.152
  238   1HB   TRP  41          1HB       TRP  41   3.825  -1.246   3.002
  239    HD1  TRP  41           HD1      TRP  41   6.127   1.338   4.450
  240    HE1  TRP  41           HE1      TRP  41   7.423   0.330   6.431
  241    HE3  TRP  41           HE3      TRP  41   3.497  -3.009   5.011
  242    HZ2  TRP  41           HZ2      TRP  41   7.341  -2.000   8.023
  243    HZ3  TRP  41           HZ3      TRP  41   4.171  -4.574   6.788
  244    HH2  TRP  41           HH2      TRP  41   6.054  -4.078   8.261
  245    H    TRP  42           H        TRP  42   2.952   0.118   6.506
  246    HA   TRP  42           HA       TRP  42   2.416  -2.461   7.215
  247   1HB   TRP  42          1HB       TRP  42   1.479  -1.243   9.430
  248    HD1  TRP  42           HD1      TRP  42   3.985   0.741  10.275
  249    HE1  TRP  42           HE1      TRP  42   3.673   3.258   9.861
  250    HE3  TRP  42           HE3      TRP  42   0.256   0.557   6.761
  251    HZ2  TRP  42           HZ2      TRP  42   2.074   4.941   8.271
  252    HZ3  TRP  42           HZ3      TRP  42  -0.605   2.668   5.855
  253    HH2  TRP  42           HH2      TRP  42   0.286   4.816   6.593
  254    H    LYS  43           H        LYS  43  -0.026  -0.375   8.600
  255    HA   LYS  43           HA       LYS  43  -2.059  -2.277   7.771
  256   1HB   LYS  43          1HB       LYS  43  -1.897  -1.466  10.129
  257   1HG   LYS  43          1HG       LYS  43  -4.487  -0.680   8.813
  258   1HD   LYS  43          1HD       LYS  43  -3.590  -0.928  11.587
  259   1HE   LYS  43          1HE       LYS  43  -5.554  -1.978  12.446
  260   1HZ   LYS  43          1HZ       LYS  43  -3.665  -3.375  11.223
  261   2HZ   LYS  43          2HZ       LYS  43  -5.005  -3.902  10.337
  262   3HZ   LYS  43          3HZ       LYS  43  -4.974  -4.096  12.017
  263    H    VAL  44           H        VAL  44  -3.484  -1.944   6.195
  264    HA   VAL  44           HA       VAL  44  -3.668   0.762   5.038
  265    HB   VAL  44           HB       VAL  44  -4.170  -1.861   3.625
  266   1HG1  VAL  44          1HG1      VAL  44  -5.288   0.384   2.896
  267   2HG1  VAL  44          2HG1      VAL  44  -4.553  -0.671   1.692
  268   3HG1  VAL  44          3HG1      VAL  44  -3.682   0.752   2.264
  269   1HG2  VAL  44          1HG2      VAL  44  -1.973  -2.058   3.371
  270   2HG2  VAL  44          2HG2      VAL  44  -1.705  -0.569   4.278
  271   3HG2  VAL  44          3HG2      VAL  44  -1.946  -0.506   2.532
  272    H    GLU  45           H        GLU  45  -5.444  -2.042   6.149
  273    HA   GLU  45           HA       GLU  45  -7.628  -2.358   6.691
  274   1HB   GLU  45          1HB       GLU  45  -7.198  -0.107   7.819
  275   1HG   GLU  45          1HG       GLU  45  -9.524  -1.560   7.625
  276    H    VAL  46           H        VAL  46  -6.806  -2.430   3.932
  277    HA   VAL  46           HA       VAL  46  -8.951  -1.238   2.398
  278    HB   VAL  46           HB       VAL  46  -6.702  -1.375   1.428
  279   1HG1  VAL  46          1HG1      VAL  46  -5.463  -3.240   1.311
  280   2HG1  VAL  46          2HG1      VAL  46  -6.836  -4.245   0.847
  281   3HG1  VAL  46          3HG1      VAL  46  -6.563  -3.853   2.546
  282   1HG2  VAL  46          1HG2      VAL  46  -8.656  -3.124  -0.062
  283   2HG2  VAL  46          2HG2      VAL  46  -7.330  -2.194  -0.756
  284   3HG2  VAL  46          3HG2      VAL  46  -8.702  -1.361  -0.026
  285    H    ASN  47           H        ASN  47 -10.478  -2.416   1.160
  286    HA   ASN  47           HA       ASN  47 -11.709  -4.544   2.523
  287   1HB   ASN  47          1HB       ASN  47 -12.630  -2.815   0.749
  288   1HD2  ASN  47          1HD2      ASN  47 -14.060  -3.354   2.530
  289   2HD2  ASN  47          2HD2      ASN  47 -15.284  -4.549   2.291
  290    H    ASP  48           H        ASP  48 -12.265  -6.667   1.468
  291    HA   ASP  48           HA       ASP  48 -11.620  -8.715   0.724
  292   1HB   ASP  48          1HB       ASP  48 -10.309  -6.858  -1.204
  293    H    ARG  49           H        ARG  49 -10.087  -7.273   2.862
  294    HA   ARG  49           HA       ARG  49  -8.228  -9.240   3.477
  295   1HB   ARG  49          1HB       ARG  49  -7.223  -7.267   1.614
  296   1HG   ARG  49          1HG       ARG  49  -6.843  -9.786   1.648
  297   1HD   ARG  49          1HD       ARG  49  -4.572 -10.254   2.801
  298    HE   ARG  49           HE       ARG  49  -7.069 -10.860   3.623
  299   1HH1  ARG  49          1HH1      ARG  49  -4.180  -9.899   5.327
  300   2HH1  ARG  49          2HH1      ARG  49  -4.585 -10.779   6.764
  301   1HH2  ARG  49          1HH2      ARG  49  -7.603 -12.017   5.510
  302   2HH2  ARG  49          2HH2      ARG  49  -6.527 -11.982   6.868
  303    H    GLN  50           H        GLN  50  -6.348  -7.969   4.968
  304    HA   GLN  50           HA       GLN  50  -8.000  -6.544   6.935
  305   1HB   GLN  50          1HB       GLN  50  -6.526  -8.740   7.342
  306   1HG   GLN  50          1HG       GLN  50  -6.265  -6.790   9.547
  307   1HE2  GLN  50          1HE2      GLN  50  -8.178  -9.630   8.607
  308   2HE2  GLN  50          2HE2      GLN  50  -7.657 -10.627   9.919
  309    H    GLY  51           H        GLY  51  -4.634  -6.525   5.735
  310   1HA   GLY  51          1HA       GLY  51  -4.212  -4.103   4.803
  311   2HA   GLY  51          2HA       GLY  51  -4.410  -3.706   6.504
  312    H    PHE  52           H        PHE  52  -2.377  -5.247   4.126
  313    HA   PHE  52           HA       PHE  52  -0.043  -4.758   5.699
  314   1HB   PHE  52          1HB       PHE  52  -1.150  -7.530   5.497
  315    HD1  PHE  52           HD1      PHE  52  -2.154  -7.931   7.511
  316    HD2  PHE  52           HD2      PHE  52   1.417  -5.616   7.418
  317    HE1  PHE  52           HE1      PHE  52  -2.189  -7.786   9.967
  318    HE2  PHE  52           HE2      PHE  52   1.388  -5.468   9.874
  319    HZ   PHE  52           HZ       PHE  52  -0.416  -6.554  11.152
  320    H    VAL  53           H        VAL  53  -1.110  -4.143   3.061
  321    HA   VAL  53           HA       VAL  53   0.117  -5.651   1.037
  322    HB   VAL  53           HB       VAL  53  -0.125  -3.606  -0.370
  323   1HG1  VAL  53          1HG1      VAL  53  -2.580  -4.268   1.251
  324   2HG1  VAL  53          2HG1      VAL  53  -1.947  -5.255  -0.067
  325   3HG1  VAL  53          3HG1      VAL  53  -2.535  -3.624  -0.389
  326   1HG2  VAL  53          1HG2      VAL  53  -0.369  -2.376   2.243
  327   2HG2  VAL  53          2HG2      VAL  53  -1.720  -1.960   1.189
  328   3HG2  VAL  53          3HG2      VAL  53  -0.065  -1.637   0.672
  329    HA   PRO  54           HA       PRO  54   4.435  -4.752   1.699
  330   1HB   PRO  54          1HB       PRO  54   4.591  -5.187  -1.239
  331   1HG   PRO  54          1HG       PRO  54   3.586  -7.283  -1.189
  332   1HD   PRO  54          1HD       PRO  54   1.739  -5.922  -0.916
  333    H    ALA  55           H        ALA  55   2.934  -3.487  -1.277
  334    HA   ALA  55           HA       ALA  55   2.950  -1.419  -2.229
  335   1HB   ALA  55          1HB       ALA  55   2.826  -0.887   0.435
  336   2HB   ALA  55          2HB       ALA  55   2.750   0.330  -0.838
  337   3HB   ALA  55          3HB       ALA  55   4.283  -0.007  -0.031
  338    H    ALA  56           H        ALA  56   5.847  -1.236  -0.163
  339    HA   ALA  56           HA       ALA  56   8.052  -0.962  -0.645
  340   1HB   ALA  56          1HB       ALA  56   8.301  -2.931  -1.765
  341   2HB   ALA  56          2HB       ALA  56   8.675  -1.811  -3.074
  342   3HB   ALA  56          3HB       ALA  56   7.070  -2.535  -2.965
  343    H    TYR  57           H        TYR  57   6.898  -0.491  -3.963
  344    HA   TYR  57           HA       TYR  57   7.544   2.369  -3.732
  345   1HB   TYR  57          1HB       TYR  57   8.613   2.315  -5.931
  346    HD1  TYR  57           HD1      TYR  57   8.902  -1.262  -4.988
  347    HD2  TYR  57           HD2      TYR  57   7.733   1.540  -7.968
  348    HE1  TYR  57           HE1      TYR  57   8.617  -3.100  -6.596
  349    HE2  TYR  57           HE2      TYR  57   7.444  -0.289  -9.585
  350    HH   TYR  57           HH       TYR  57   6.943  -3.136  -9.072
  351    H    VAL  58           H        VAL  58   6.011   3.680  -4.501
  352    HA   VAL  58           HA       VAL  58   4.258   2.826  -6.645
  353    HB   VAL  58           HB       VAL  58   3.067   3.633  -3.989
  354   1HG1  VAL  58          1HG1      VAL  58   1.324   4.172  -5.277
  355   2HG1  VAL  58          2HG1      VAL  58   1.116   2.438  -5.515
  356   3HG1  VAL  58          3HG1      VAL  58   2.021   3.387  -6.694
  357   1HG2  VAL  58          1HG2      VAL  58   3.316   0.924  -5.283
  358   2HG2  VAL  58          2HG2      VAL  58   2.226   1.278  -3.943
  359   3HG2  VAL  58          3HG2      VAL  58   3.968   1.438  -3.726
  360    H    LYS  59           H        LYS  59   4.046   5.311  -4.093
  361    HA   LYS  59           HA       LYS  59   4.603   7.382  -6.073
  362   1HB   LYS  59          1HB       LYS  59   2.119   7.444  -4.352
  363   1HG   LYS  59          1HG       LYS  59   2.536   6.543  -7.136
  364   1HD   LYS  59          1HD       LYS  59   1.180   8.823  -6.976
  365   1HE   LYS  59          1HE       LYS  59  -0.603   6.755  -5.854
  366   1HZ   LYS  59          1HZ       LYS  59  -1.382   7.491  -8.233
  367   2HZ   LYS  59          2HZ       LYS  59  -1.908   8.868  -7.402
  368   3HZ   LYS  59          3HZ       LYS  59  -2.486   7.342  -6.957
  369    H    LYS  60           H        LYS  60   3.299   7.249  -2.754
  370    HA   LYS  60           HA       LYS  60   5.615   8.856  -1.891
  371   1HB   LYS  60          1HB       LYS  60   4.040   9.789  -0.134
  372   1HG   LYS  60          1HG       LYS  60   1.772   9.204  -1.943
  373   1HD   LYS  60          1HD       LYS  60   1.720   9.176   1.039
  374   1HE   LYS  60          1HE       LYS  60  -0.175  10.576  -0.802
  375   1HZ   LYS  60          1HZ       LYS  60  -0.395   9.252   1.839
  376   2HZ   LYS  60          2HZ       LYS  60  -1.743   9.741   0.945
  377   3HZ   LYS  60          3HZ       LYS  60  -0.621  10.889   1.478
  378    H    LEU  61           H        LEU  61   6.784   7.047  -1.214
  379    HA   LEU  61           HA       LEU  61   6.391   6.243   1.445
  380   1HB   LEU  61          1HB       LEU  61   5.772   3.941   1.229
  381    HG   LEU  61           HG       LEU  61   6.805   3.467  -1.002
  382   1HD1  LEU  61          1HD1      LEU  61   3.929   2.637  -1.038
  383   2HD1  LEU  61          2HD1      LEU  61   5.023   2.060   0.221
  384   3HD1  LEU  61          3HD1      LEU  61   5.365   1.710  -1.473
  385   1HD2  LEU  61          1HD2      LEU  61   4.910   3.854  -2.851
  386   2HD2  LEU  61          2HD2      LEU  61   6.209   5.007  -2.550
  387   3HD2  LEU  61          3HD2      LEU  61   4.615   5.267  -1.839
  388    H    ASP  62           H        ASP  62   8.312   5.658   2.242
  389    HA   ASP  62           HA       ASP  62  10.230   4.210   0.629
  390   1HB   ASP  62          1HB       ASP  62  10.906   6.964   1.684
  Start of MODEL    3
    1    H    GLU   7           H        GLU   7  -0.528  12.512  -5.277
    2    HA   GLU   7           HA       GLU   7  -1.543  12.437  -3.230
    3   1HB   GLU   7          1HB       GLU   7  -3.867  13.110  -3.265
    4   1HG   GLU   7          1HG       GLU   7  -4.013  12.743  -6.223
    5    H    LEU   8           H        LEU   8  -0.881   9.865  -4.063
    6    HA   LEU   8           HA       LEU   8  -2.716   8.327  -2.475
    7   1HB   LEU   8          1HB       LEU   8  -2.707   8.141  -5.427
    8    HG   LEU   8           HG       LEU   8  -4.770   8.799  -4.327
    9   1HD1  LEU   8          1HD1      LEU   8  -6.060   6.515  -5.032
   10   2HD1  LEU   8          2HD1      LEU   8  -4.537   6.338  -5.902
   11   3HD1  LEU   8          3HD1      LEU   8  -5.540   7.766  -6.161
   12   1HD2  LEU   8          1HD2      LEU   8  -5.759   6.564  -3.071
   13   2HD2  LEU   8          2HD2      LEU   8  -5.111   7.995  -2.272
   14   3HD2  LEU   8          3HD2      LEU   8  -4.074   6.596  -2.551
   15    H    VAL   9           H        VAL   9  -1.978   5.814  -2.890
   16    HA   VAL   9           HA       VAL   9   0.928   5.668  -3.113
   17    HB   VAL   9           HB       VAL   9  -0.439   4.540  -0.674
   18   1HG1  VAL   9          1HG1      VAL   9   2.451   4.971  -1.418
   19   2HG1  VAL   9          2HG1      VAL   9   1.614   3.428  -1.244
   20   3HG1  VAL   9          3HG1      VAL   9   1.895   4.444   0.170
   21   1HG2  VAL   9          1HG2      VAL   9   0.860   7.217  -1.074
   22   2HG2  VAL   9          2HG2      VAL   9   0.793   6.447   0.511
   23   3HG2  VAL   9          3HG2      VAL   9  -0.699   6.841  -0.342
   24    H    LEU  10           H        LEU  10   0.305   4.466  -5.027
   25    HA   LEU  10           HA       LEU  10  -1.266   2.140  -4.964
   26   1HB   LEU  10          1HB       LEU  10  -0.005   1.548  -7.079
   27    HG   LEU  10           HG       LEU  10   1.686   3.757  -6.221
   28   1HD1  LEU  10          1HD1      LEU  10   1.764   1.496  -8.160
   29   2HD1  LEU  10          2HD1      LEU  10   2.839   1.864  -6.812
   30   3HD1  LEU  10          3HD1      LEU  10   2.944   2.798  -8.303
   31   1HD2  LEU  10          1HD2      LEU  10  -0.054   4.726  -7.953
   32   2HD2  LEU  10          2HD2      LEU  10   0.999   3.912  -9.110
   33   3HD2  LEU  10          3HD2      LEU  10   1.656   5.146  -8.034
   34    H    ALA  11           H        ALA  11  -0.034   0.000  -5.868
   35    HA   ALA  11           HA       ALA  11   1.570  -0.850  -3.602
   36   1HB   ALA  11          1HB       ALA  11  -0.248  -2.282  -4.327
   37   2HB   ALA  11          2HB       ALA  11   1.297  -3.106  -4.540
   38   3HB   ALA  11          3HB       ALA  11   0.467  -2.413  -5.934
   39    H    LEU  12           H        LEU  12   1.985  -0.090  -6.971
   40    HA   LEU  12           HA       LEU  12   3.884   0.259  -8.194
   41   1HB   LEU  12          1HB       LEU  12   4.789   0.546  -5.625
   42    HG   LEU  12           HG       LEU  12   6.615   0.638  -8.028
   43   1HD1  LEU  12          1HD1      LEU  12   4.734   1.965  -8.585
   44   2HD1  LEU  12          2HD1      LEU  12   5.983   3.077  -8.025
   45   3HD1  LEU  12          3HD1      LEU  12   4.646   2.644  -6.961
   46   1HD2  LEU  12          1HD2      LEU  12   8.111   1.741  -6.751
   47   2HD2  LEU  12          2HD2      LEU  12   7.318   0.861  -5.443
   48   3HD2  LEU  12          3HD2      LEU  12   6.865   2.531  -5.784
   49    H    TYR  13           H        TYR  13   4.577  -2.542  -6.089
   50    HA   TYR  13           HA       TYR  13   4.637  -4.235  -8.483
   51   1HB   TYR  13          1HB       TYR  13   6.629  -5.422  -7.236
   52    HD1  TYR  13           HD1      TYR  13   8.821  -3.039  -7.327
   53    HD2  TYR  13           HD2      TYR  13   5.565  -4.099  -4.802
   54    HE1  TYR  13           HE1      TYR  13   9.905  -1.879  -5.452
   55    HE2  TYR  13           HE2      TYR  13   6.640  -2.940  -2.919
   56    HH   TYR  13           HH       TYR  13   8.560  -0.815  -2.921
   57    H    ASP  14           H        ASP  14   2.625  -3.904  -6.476
   58    HA   ASP  14           HA       ASP  14   1.326  -5.048  -4.995
   59   1HB   ASP  14          1HB       ASP  14   0.791  -7.302  -5.655
   60    H    TYR  15           H        TYR  15   1.343  -7.372  -3.704
   61    HA   TYR  15           HA       TYR  15   3.892  -7.384  -2.222
   62   1HB   TYR  15          1HB       TYR  15   2.275  -6.394  -0.788
   63    HD1  TYR  15           HD1      TYR  15   4.606  -8.141  -0.234
   64    HD2  TYR  15           HD2      TYR  15   0.512  -8.576   0.839
   65    HE1  TYR  15           HE1      TYR  15   5.267  -9.497   1.706
   66    HE2  TYR  15           HE2      TYR  15   1.162  -9.934   2.784
   67    HH   TYR  15           HH       TYR  15   3.177 -11.410   3.409
   68    H    GLN  16           H        GLN  16   1.371  -9.273  -3.698
   69    HA   GLN  16           HA       GLN  16   1.226 -11.477  -4.231
   70   1HB   GLN  16          1HB       GLN  16   3.498 -11.278  -5.056
   71   1HG   GLN  16          1HG       GLN  16   3.648 -13.735  -3.370
   72   1HE2  GLN  16          1HE2      GLN  16   5.742 -12.339  -4.557
   73   2HE2  GLN  16          2HE2      GLN  16   6.334 -13.259  -5.894
   74    H    GLU  17           H        GLU  17   0.056 -12.822  -3.050
   75    HA   GLU  17           HA       GLU  17   0.921 -13.391  -0.289
   76   1HB   GLU  17          1HB       GLU  17  -1.411 -13.619   0.335
   77   1HG   GLU  17          1HG       GLU  17  -2.056 -12.912  -2.519
   78    H    LYS  18           H        LYS  18   1.100 -15.473   0.326
   79    HA   LYS  18           HA       LYS  18   0.892 -17.506  -1.718
   80   1HB   LYS  18          1HB       LYS  18   2.813 -17.445  -0.167
   81   1HG   LYS  18          1HG       LYS  18   2.311 -19.877   0.866
   82   1HD   LYS  18          1HD       LYS  18   2.688 -19.657  -2.092
   83   1HE   LYS  18          1HE       LYS  18   2.907 -21.853  -1.206
   84   1HZ   LYS  18          1HZ       LYS  18   4.467 -20.542   0.917
   85   2HZ   LYS  18          2HZ       LYS  18   4.767 -22.162   0.534
   86   3HZ   LYS  18          3HZ       LYS  18   3.228 -21.688   1.051
   87    H    SER  19           H        SER  19  -0.642 -19.048  -1.891
   88    HA   SER  19           HA       SER  19  -2.583 -20.188  -1.555
   89   1HB   SER  19          1HB       SER  19  -2.853 -19.740   1.321
   90    HG   SER  19           HG       SER  19  -0.855 -19.966   1.883
   91    HA   PRO  20           HA       PRO  20  -6.033 -17.459  -1.557
   92   1HB   PRO  20          1HB       PRO  20  -7.823 -18.691   0.185
   93   1HG   PRO  20          1HG       PRO  20  -6.505 -20.467   0.844
   94   1HD   PRO  20          1HD       PRO  20  -4.504 -20.972  -0.216
   95    H    ARG  21           H        ARG  21  -4.680 -18.376   1.514
   96    HA   ARG  21           HA       ARG  21  -6.045 -16.351   3.029
   97   1HB   ARG  21          1HB       ARG  21  -4.297 -18.581   3.571
   98   1HG   ARG  21          1HG       ARG  21  -6.609 -17.515   4.642
   99   1HD   ARG  21          1HD       ARG  21  -5.088 -17.756   7.079
  100    HE   ARG  21           HE       ARG  21  -6.387 -15.282   6.720
  101   1HH1  ARG  21          1HH1      ARG  21  -7.074 -18.699   6.895
  102   2HH1  ARG  21          2HH1      ARG  21  -8.683 -18.471   7.492
  103   1HH2  ARG  21          1HH2      ARG  21  -8.501 -14.980   7.509
  104   2HH2  ARG  21          2HH2      ARG  21  -9.495 -16.361   7.841
  105    H    GLU  22           H        GLU  22  -4.087 -15.209   4.568
  106    HA   GLU  22           HA       GLU  22  -2.662 -13.440   4.659
  107   1HB   GLU  22          1HB       GLU  22  -1.663 -14.607   2.057
  108   1HG   GLU  22          1HG       GLU  22  -1.308 -16.147   3.868
  109    H    VAL  23           H        VAL  23  -1.777 -11.538   3.100
  110    HA   VAL  23           HA       VAL  23  -4.086 -10.629   1.508
  111    HB   VAL  23           HB       VAL  23  -2.339  -8.818   3.172
  112   1HG1  VAL  23          1HG1      VAL  23  -4.523  -7.401   2.832
  113   2HG1  VAL  23          2HG1      VAL  23  -4.728  -8.451   1.430
  114   3HG1  VAL  23          3HG1      VAL  23  -3.278  -7.457   1.583
  115   1HG2  VAL  23          1HG2      VAL  23  -3.479 -10.177   4.747
  116   2HG2  VAL  23          2HG2      VAL  23  -4.986 -10.092   3.834
  117   3HG2  VAL  23          3HG2      VAL  23  -4.372  -8.659   4.658
  118    H    THR  24           H        THR  24  -3.639  -9.268  -0.268
  119    HA   THR  24           HA       THR  24  -0.831  -8.936  -1.027
  120    HB   THR  24           HB       THR  24  -1.573 -11.047  -2.051
  121    HG1  THR  24           HG1      THR  24  -0.863 -10.550  -4.073
  122   1HG2  THR  24          1HG2      THR  24  -3.421 -11.348  -3.295
  123   2HG2  THR  24          2HG2      THR  24  -3.383  -9.709  -3.946
  124   3HG2  THR  24          3HG2      THR  24  -4.020 -10.001  -2.328
  125    H    MET  25           H        MET  25  -1.143  -7.931  -3.545
  126    HA   MET  25           HA       MET  25  -3.223  -6.002  -3.745
  127   1HB   MET  25          1HB       MET  25  -1.565  -4.025  -3.613
  128   1HG   MET  25          1HG       MET  25  -0.159  -5.806  -1.655
  129   1HE   MET  25          1HE       MET  25   0.219  -2.778   0.204
  130   2HE   MET  25          2HE       MET  25  -1.015  -3.914  -0.337
  131   3HE   MET  25          3HE       MET  25  -1.003  -2.264  -0.958
  132    H    LYS  26           H        LYS  26  -2.823  -7.611  -5.650
  133    HA   LYS  26           HA       LYS  26  -0.720  -7.179  -7.457
  134   1HB   LYS  26          1HB       LYS  26  -3.534  -8.132  -8.015
  135   1HG   LYS  26          1HG       LYS  26  -1.993  -9.444  -6.370
  136   1HD   LYS  26          1HD       LYS  26  -1.015 -10.780  -8.829
  137   1HE   LYS  26          1HE       LYS  26   0.709 -10.278  -6.494
  138   1HZ   LYS  26          1HZ       LYS  26   0.054 -12.952  -7.432
  139   2HZ   LYS  26          2HZ       LYS  26   1.555 -12.279  -7.042
  140   3HZ   LYS  26          3HZ       LYS  26   0.845 -11.947  -8.540
  141    H    LYS  27           H        LYS  27  -1.023  -6.297  -9.704
  142    HA   LYS  27           HA       LYS  27  -1.346  -4.517 -11.082
  143   1HB   LYS  27          1HB       LYS  27  -3.836  -5.328 -10.348
  144   1HG   LYS  27          1HG       LYS  27  -3.831  -2.834 -11.923
  145   1HD   LYS  27          1HD       LYS  27  -4.979  -4.401 -13.533
  146   1HE   LYS  27          1HE       LYS  27  -6.321  -4.506 -10.859
  147   1HZ   LYS  27          1HZ       LYS  27  -7.781  -5.236 -12.446
  148   2HZ   LYS  27          2HZ       LYS  27  -7.157  -4.241 -13.662
  149   3HZ   LYS  27          3HZ       LYS  27  -8.133  -3.580 -12.448
  150    H    GLY  28           H        GLY  28  -2.401  -2.023 -10.797
  151   1HA   GLY  28          1HA       GLY  28  -0.592  -0.876  -8.798
  152   2HA   GLY  28          2HA       GLY  28  -1.306  -0.021 -10.158
  153    H    ASP  29           H        ASP  29  -3.050  -2.050  -7.864
  154    HA   ASP  29           HA       ASP  29  -5.099  -0.209  -7.436
  155   1HB   ASP  29          1HB       ASP  29  -5.614  -1.623  -5.401
  156    H    ILE  30           H        ILE  30  -5.679   0.585  -5.135
  157    HA   ILE  30           HA       ILE  30  -3.286   1.813  -3.927
  158    HB   ILE  30           HB       ILE  30  -5.798   3.313  -3.610
  159   1HG1  ILE  30          1HG1      ILE  30  -6.021   2.567  -5.962
  160   1HG2  ILE  30          1HG2      ILE  30  -3.886   5.015  -4.563
  161   2HG2  ILE  30          2HG2      ILE  30  -2.916   3.771  -3.776
  162   3HG2  ILE  30          3HG2      ILE  30  -4.153   4.633  -2.862
  163   1HD1  ILE  30          1HD1      ILE  30  -3.305   2.759  -6.141
  164   2HD1  ILE  30          2HD1      ILE  30  -3.848   4.213  -6.977
  165   3HD1  ILE  30          3HD1      ILE  30  -4.418   2.630  -7.502
  166    H    LEU  31           H        LEU  31  -4.321   3.003  -1.749
  167    HA   LEU  31           HA       LEU  31  -5.999   1.119  -0.314
  168   1HB   LEU  31          1HB       LEU  31  -4.165   1.274   1.585
  169    HG   LEU  31           HG       LEU  31  -1.915   1.092   0.873
  170   1HD1  LEU  31          1HD1      LEU  31  -1.181   0.675  -1.223
  171   2HD1  LEU  31          2HD1      LEU  31  -2.424   1.673  -1.977
  172   3HD1  LEU  31          3HD1      LEU  31  -2.818   0.049  -1.414
  173   1HD2  LEU  31          1HD2      LEU  31  -2.634   3.394  -0.838
  174   2HD2  LEU  31          2HD2      LEU  31  -1.470   3.277   0.479
  175   3HD2  LEU  31          3HD2      LEU  31  -3.188   3.434   0.836
  176    H    THR  32           H        THR  32  -5.921   1.960   2.179
  177    HA   THR  32           HA       THR  32  -6.622   4.807   1.986
  178    HB   THR  32           HB       THR  32  -8.403   3.228   2.698
  179    HG1  THR  32           HG1      THR  32  -8.938   5.061   3.580
  180   1HG2  THR  32          1HG2      THR  32  -6.910   2.906   5.276
  181   2HG2  THR  32          2HG2      THR  32  -6.831   1.711   3.982
  182   3HG2  THR  32          3HG2      THR  32  -8.379   2.089   4.739
  183    H    LEU  33           H        LEU  33  -4.989   2.481   4.117
  184    HA   LEU  33           HA       LEU  33  -3.265   2.716   5.582
  185   1HB   LEU  33          1HB       LEU  33  -2.726   5.517   4.729
  186    HG   LEU  33           HG       LEU  33  -2.921   3.360   2.808
  187   1HD1  LEU  33          1HD1      LEU  33  -2.032   5.519   1.449
  188   2HD1  LEU  33          2HD1      LEU  33  -2.684   6.288   2.895
  189   3HD1  LEU  33          3HD1      LEU  33  -3.715   5.258   1.902
  190   1HD2  LEU  33          1HD2      LEU  33  -0.232   4.167   3.649
  191   2HD2  LEU  33          2HD2      LEU  33  -0.527   4.291   1.914
  192   3HD2  LEU  33          3HD2      LEU  33  -0.764   2.751   2.742
  193    H    LEU  34           H        LEU  34  -2.766   3.652   7.623
  194    HA   LEU  34           HA       LEU  34  -4.965   4.590   9.061
  195   1HB   LEU  34          1HB       LEU  34  -2.852   3.464   9.930
  196    HG   LEU  34           HG       LEU  34  -3.980   5.851  11.381
  197   1HD1  LEU  34          1HD1      LEU  34  -4.282   2.899  11.899
  198   2HD1  LEU  34          2HD1      LEU  34  -5.427   3.866  10.968
  199   3HD1  LEU  34          3HD1      LEU  34  -5.155   4.220  12.675
  200   1HD2  LEU  34          1HD2      LEU  34  -1.766   4.003  12.150
  201   2HD2  LEU  34          2HD2      LEU  34  -2.868   4.608  13.386
  202   3HD2  LEU  34          3HD2      LEU  34  -1.925   5.739  12.415
  203    H    ASN  35           H        ASN  35  -1.996   6.422   8.304
  204    HA   ASN  35           HA       ASN  35  -3.600   8.799   7.807
  205   1HB   ASN  35          1HB       ASN  35  -3.152   8.923  10.208
  206   1HD2  ASN  35          1HD2      ASN  35  -0.246  10.486   9.728
  207   2HD2  ASN  35          2HD2      ASN  35  -0.847  12.080   9.440
  208    H    SER  36           H        SER  36  -0.140   8.375   8.518
  209    HA   SER  36           HA       SER  36   0.863   8.126   5.965
  210   1HB   SER  36          1HB       SER  36   1.635  10.694   5.840
  211    HG   SER  36           HG       SER  36  -0.888  11.417   6.309
  212    H    THR  37           H        THR  37   2.926   7.575   6.210
  213    HA   THR  37           HA       THR  37   4.863   8.965   7.657
  214    HB   THR  37           HB       THR  37   3.758   8.342   9.685
  215    HG1  THR  37           HG1      THR  37   6.059   8.046   9.626
  216   1HG2  THR  37          1HG2      THR  37   3.747   5.714  10.109
  217   2HG2  THR  37          2HG2      THR  37   3.429   5.721   8.374
  218   3HG2  THR  37          3HG2      THR  37   2.357   6.591   9.472
  219    H    ASN  38           H        ASN  38   6.753   8.373   6.811
  220    HA   ASN  38           HA       ASN  38   6.989   6.309   4.939
  221   1HB   ASN  38          1HB       ASN  38   9.075   7.876   6.459
  222   1HD2  ASN  38          1HD2      ASN  38   7.866   9.734   5.875
  223   2HD2  ASN  38          2HD2      ASN  38   7.894  10.329   4.254
  224    H    LYS  39           H        LYS  39   9.128   6.366   7.761
  225    HA   LYS  39           HA       LYS  39  10.025   4.649   8.974
  226   1HB   LYS  39          1HB       LYS  39   7.399   4.957   9.612
  227   1HG   LYS  39          1HG       LYS  39   8.657   2.688  11.001
  228   1HD   LYS  39          1HD       LYS  39   7.532   5.362  11.815
  229   1HE   LYS  39          1HE       LYS  39   7.603   4.000  14.105
  230   1HZ   LYS  39          1HZ       LYS  39   8.701   6.227  13.354
  231   2HZ   LYS  39          2HZ       LYS  39  10.119   5.307  13.362
  232   3HZ   LYS  39          3HZ       LYS  39   9.205   5.461  14.776
  233    H    ASP  40           H        ASP  40   9.384   1.986   9.286
  234    HA   ASP  40           HA       ASP  40  10.175   0.926   6.677
  235   1HB   ASP  40          1HB       ASP  40  11.262   0.478   9.103
  236    H    TRP  41           H        TRP  41   8.114   0.984   5.706
  237    HA   TRP  41           HA       TRP  41   6.350  -0.196   4.852
  238   1HB   TRP  41          1HB       TRP  41   6.386  -2.380   5.289
  239    HD1  TRP  41           HD1      TRP  41   4.493  -3.919   5.929
  240    HE1  TRP  41           HE1      TRP  41   2.904  -4.189   7.932
  241    HE3  TRP  41           HE3      TRP  41   6.342  -0.228   8.966
  242    HZ2  TRP  41           HZ2      TRP  41   2.489  -3.011  10.455
  243    HZ3  TRP  41           HZ3      TRP  41   5.291   0.126  11.157
  244    HH2  TRP  41           HH2      TRP  41   3.402  -1.236  11.884
  245    H    TRP  42           H        TRP  42   3.985  -0.654   5.503
  246    HA   TRP  42           HA       TRP  42   3.062   0.783   7.832
  247   1HB   TRP  42          1HB       TRP  42   3.525   2.473   5.911
  248    HD1  TRP  42           HD1      TRP  42   0.192   3.490   5.583
  249    HE1  TRP  42           HE1      TRP  42  -0.672   4.850   7.589
  250    HE3  TRP  42           HE3      TRP  42   3.754   2.218   9.023
  251    HZ2  TRP  42           HZ2      TRP  42   0.059   5.321  10.274
  252    HZ3  TRP  42           HZ3      TRP  42   3.600   3.167  11.288
  253    HH2  TRP  42           HH2      TRP  42   1.789   4.688  11.898
  254    H    LYS  43           H        LYS  43   1.013   0.202   8.440
  255    HA   LYS  43           HA       LYS  43  -0.025  -2.221   7.519
  256   1HB   LYS  43          1HB       LYS  43  -1.149  -0.016   9.219
  257   1HG   LYS  43          1HG       LYS  43  -0.730  -2.904   9.920
  258   1HD   LYS  43          1HD       LYS  43  -1.042  -0.375  11.531
  259   1HE   LYS  43          1HE       LYS  43  -1.176  -2.391  13.324
  260   1HZ   LYS  43          1HZ       LYS  43   0.161  -0.344  13.483
  261   2HZ   LYS  43          2HZ       LYS  43   1.359  -1.067  12.531
  262   3HZ   LYS  43          3HZ       LYS  43   0.984  -1.709  14.051
  263    H    VAL  44           H        VAL  44  -0.840  -2.595   5.571
  264    HA   VAL  44           HA       VAL  44  -2.339  -0.482   4.203
  265    HB   VAL  44           HB       VAL  44  -1.407  -3.118   3.065
  266   1HG1  VAL  44          1HG1      VAL  44  -2.913  -2.461   1.513
  267   2HG1  VAL  44          2HG1      VAL  44  -1.574  -1.445   0.973
  268   3HG1  VAL  44          3HG1      VAL  44  -2.838  -0.767   1.998
  269   1HG2  VAL  44          1HG2      VAL  44   0.374  -1.705   1.980
  270   2HG2  VAL  44          2HG2      VAL  44   0.562  -1.964   3.716
  271   3HG2  VAL  44          3HG2      VAL  44  -0.059  -0.427   3.114
  272    H    GLU  45           H        GLU  45  -4.171  -0.832   5.677
  273    HA   GLU  45           HA       GLU  45  -5.597  -3.272   5.745
  274   1HB   GLU  45          1HB       GLU  45  -5.745  -1.080   7.229
  275   1HG   GLU  45          1HG       GLU  45  -7.205  -3.387   7.150
  276    H    VAL  46           H        VAL  46  -6.359  -0.230   4.038
  277    HA   VAL  46           HA       VAL  46  -7.405   0.172   2.054
  278    HB   VAL  46           HB       VAL  46  -7.371  -2.748   1.365
  279   1HG1  VAL  46          1HG1      VAL  46  -7.756  -2.053  -0.725
  280   2HG1  VAL  46          2HG1      VAL  46  -6.554  -0.768  -0.616
  281   3HG1  VAL  46          3HG1      VAL  46  -8.183  -0.508   0.009
  282   1HG2  VAL  46          1HG2      VAL  46  -5.167  -2.757   1.857
  283   2HG2  VAL  46          2HG2      VAL  46  -5.042  -1.000   1.816
  284   3HG2  VAL  46          3HG2      VAL  46  -5.032  -1.919   0.312
  285    H    ASN  47           H        ASN  47  -8.850  -0.566   4.489
  286    HA   ASN  47           HA       ASN  47 -10.998  -0.870   5.169
  287   1HB   ASN  47          1HB       ASN  47 -11.757  -0.813   2.246
  288   1HD2  ASN  47          1HD2      ASN  47 -12.462   1.518   4.732
  289   2HD2  ASN  47          2HD2      ASN  47 -11.619   2.840   4.007
  290    H    ASP  48           H        ASP  48  -9.337  -3.153   4.684
  291    HA   ASP  48           HA       ASP  48 -11.194  -5.217   4.991
  292   1HB   ASP  48          1HB       ASP  48 -11.210  -4.570   2.392
  293    H    ARG  49           H        ARG  49 -10.126  -7.412   4.910
  294    HA   ARG  49           HA       ARG  49  -8.495  -8.788   5.702
  295   1HB   ARG  49          1HB       ARG  49  -6.526  -6.974   4.319
  296   1HG   ARG  49          1HG       ARG  49  -8.281  -7.340   2.702
  297   1HD   ARG  49          1HD       ARG  49  -9.209  -9.386   3.830
  298    HE   ARG  49           HE       ARG  49  -6.745 -10.563   2.991
  299   1HH1  ARG  49          1HH1      ARG  49 -10.131 -11.212   3.535
  300   2HH1  ARG  49          2HH1      ARG  49  -9.888 -12.902   3.824
  301   1HH2  ARG  49          1HH2      ARG  49  -6.424 -12.785   3.370
  302   2HH2  ARG  49          2HH2      ARG  49  -7.784 -13.796   3.731
  303    H    GLN  50           H        GLN  50  -5.880  -8.379   6.511
  304    HA   GLN  50           HA       GLN  50  -6.313  -7.066   9.039
  305   1HB   GLN  50          1HB       GLN  50  -4.110  -8.711   7.848
  306   1HG   GLN  50          1HG       GLN  50  -6.215  -9.475   9.305
  307   1HE2  GLN  50          1HE2      GLN  50  -6.806  -8.118  11.012
  308   2HE2  GLN  50          2HE2      GLN  50  -6.030  -8.206  12.553
  309    H    GLY  51           H        GLY  51  -3.470  -6.829   6.909
  310   1HA   GLY  51          1HA       GLY  51  -3.457  -4.307   6.024
  311   2HA   GLY  51          2HA       GLY  51  -3.105  -4.061   7.728
  312    H    PHE  52           H        PHE  52  -1.652  -6.731   7.708
  313    HA   PHE  52           HA       PHE  52   0.945  -5.775   7.461
  314   1HB   PHE  52          1HB       PHE  52  -0.139  -8.590   7.369
  315    HD1  PHE  52           HD1      PHE  52   2.130  -6.342   9.305
  316    HD2  PHE  52           HD2      PHE  52  -0.978  -9.248   9.387
  317    HE1  PHE  52           HE1      PHE  52   2.088  -6.221  11.763
  318    HE2  PHE  52           HE2      PHE  52  -1.025  -9.133  11.845
  319    HZ   PHE  52           HZ       PHE  52   0.508  -7.617  13.034
  320    H    VAL  53           H        VAL  53   1.432  -4.764   5.560
  321    HA   VAL  53           HA       VAL  53   1.931  -6.496   3.282
  322    HB   VAL  53           HB       VAL  53   0.372  -3.952   2.852
  323   1HG1  VAL  53          1HG1      VAL  53   1.336  -4.366   0.834
  324   2HG1  VAL  53          2HG1      VAL  53  -0.081  -5.403   0.674
  325   3HG1  VAL  53          3HG1      VAL  53   1.475  -6.099   1.128
  326   1HG2  VAL  53          1HG2      VAL  53  -1.037  -5.497   4.097
  327   2HG2  VAL  53          2HG2      VAL  53  -0.676  -6.781   2.945
  328   3HG2  VAL  53          3HG2      VAL  53  -1.591  -5.364   2.428
  329    HA   PRO  54           HA       PRO  54   5.495  -3.695   4.090
  330   1HB   PRO  54          1HB       PRO  54   6.613  -5.642   2.131
  331   1HG   PRO  54          1HG       PRO  54   6.284  -7.492   3.505
  332   1HD   PRO  54          1HD       PRO  54   4.128  -7.136   2.761
  333    H    ALA  55           H        ALA  55   4.386  -2.006   2.929
  334    HA   ALA  55           HA       ALA  55   4.091  -1.903   0.147
  335   1HB   ALA  55          1HB       ALA  55   3.488   0.312   0.414
  336   2HB   ALA  55          2HB       ALA  55   4.618   0.567   1.746
  337   3HB   ALA  55          3HB       ALA  55   3.142  -0.362   2.007
  338    H    ALA  56           H        ALA  56   6.864  -1.433   2.169
  339    HA   ALA  56           HA       ALA  56   9.063  -1.085   1.710
  340   1HB   ALA  56          1HB       ALA  56   9.329  -2.676   0.122
  341   2HB   ALA  56          2HB       ALA  56   9.565  -1.268  -0.913
  342   3HB   ALA  56          3HB       ALA  56   7.997  -2.074  -0.865
  343    H    TYR  57           H        TYR  57   7.772   0.232  -1.324
  344    HA   TYR  57           HA       TYR  57   7.986   2.951  -0.439
  345   1HB   TYR  57          1HB       TYR  57   9.783   3.641  -1.926
  346    HD1  TYR  57           HD1      TYR  57  11.094   0.264  -1.621
  347    HD2  TYR  57           HD2      TYR  57   9.413   3.106  -4.303
  348    HE1  TYR  57           HE1      TYR  57  11.890  -1.072  -3.526
  349    HE2  TYR  57           HE2      TYR  57  10.204   1.778  -6.216
  350    HH   TYR  57           HH       TYR  57  12.019   0.095  -6.664
  351    H    VAL  58           H        VAL  58   6.552   4.125  -1.526
  352    HA   VAL  58           HA       VAL  58   5.964   3.514  -4.317
  353    HB   VAL  58           HB       VAL  58   3.744   3.716  -2.280
  354   1HG1  VAL  58          1HG1      VAL  58   2.277   3.655  -3.990
  355   2HG1  VAL  58          2HG1      VAL  58   3.284   2.574  -4.955
  356   3HG1  VAL  58          3HG1      VAL  58   3.635   4.302  -4.911
  357   1HG2  VAL  58          1HG2      VAL  58   5.032   1.631  -2.009
  358   2HG2  VAL  58          2HG2      VAL  58   4.750   1.257  -3.709
  359   3HG2  VAL  58          3HG2      VAL  58   3.392   1.340  -2.587
  360    H    LYS  59           H        LYS  59   5.810   5.333  -5.458
  361    HA   LYS  59           HA       LYS  59   5.636   7.535  -6.002
  362   1HB   LYS  59          1HB       LYS  59   3.869   7.804  -3.569
  363   1HG   LYS  59          1HG       LYS  59   3.412   6.108  -5.777
  364   1HD   LYS  59          1HD       LYS  59   2.146   8.757  -6.030
  365   1HE   LYS  59          1HE       LYS  59   0.488   6.446  -6.887
  366   1HZ   LYS  59          1HZ       LYS  59   0.054   8.855  -7.440
  367   2HZ   LYS  59          2HZ       LYS  59  -0.360   9.068  -5.814
  368   3HZ   LYS  59          3HZ       LYS  59  -1.244   7.996  -6.778
  369    H    LYS  60           H        LYS  60   5.487   9.857  -4.541
  370    HA   LYS  60           HA       LYS  60   8.121  10.236  -3.706
  371   1HB   LYS  60          1HB       LYS  60   5.600  11.811  -3.498
  372   1HG   LYS  60          1HG       LYS  60   8.308  12.227  -4.704
  373   1HD   LYS  60          1HD       LYS  60   6.223  14.365  -4.737
  374   1HE   LYS  60          1HE       LYS  60   9.082  14.056  -5.413
  375   1HZ   LYS  60          1HZ       LYS  60   8.876  15.779  -3.551
  376   2HZ   LYS  60          2HZ       LYS  60   8.099  16.743  -4.704
  377   3HZ   LYS  60          3HZ       LYS  60   9.687  16.229  -4.966
  378    H    LEU  61           H        LEU  61   5.391  10.768  -1.501
  379    HA   LEU  61           HA       LEU  61   5.082  10.293   0.697
  380   1HB   LEU  61          1HB       LEU  61   5.225   7.976   0.026
  381    HG   LEU  61           HG       LEU  61   6.682   8.608   2.570
  382   1HD1  LEU  61          1HD1      LEU  61   4.633   7.403   3.466
  383   2HD1  LEU  61          2HD1      LEU  61   3.983   7.522   1.831
  384   3HD1  LEU  61          3HD1      LEU  61   4.372   8.986   2.735
  385   1HD2  LEU  61          1HD2      LEU  61   7.290   6.484   2.974
  386   2HD2  LEU  61          2HD2      LEU  61   7.271   6.336   1.216
  387   3HD2  LEU  61          3HD2      LEU  61   5.874   5.815   2.160
  388    H    ASP  62           H        ASP  62   8.463   9.223   0.509
  389    HA   ASP  62           HA       ASP  62   9.252  10.595   2.822
  390   1HB   ASP  62          1HB       ASP  62  10.456   8.655   1.797
  Start of MODEL    4
    1    H    GLU   7           H        GLU   7  -4.850   8.050  -0.651
    2    HA   GLU   7           HA       GLU   7  -2.962  10.283  -0.486
    3   1HB   GLU   7          1HB       GLU   7  -3.086   8.063   1.027
    4   1HG   GLU   7          1HG       GLU   7  -0.335   8.423   0.839
    5    H    LEU   8           H        LEU   8  -0.691   9.437  -1.491
    6    HA   LEU   8           HA       LEU   8  -1.236   8.486  -4.218
    7   1HB   LEU   8          1HB       LEU   8  -0.839  11.088  -3.773
    8    HG   LEU   8           HG       LEU   8   0.086  11.384  -6.016
    9   1HD1  LEU   8          1HD1      LEU   8   0.881   9.595  -7.345
   10   2HD1  LEU   8          2HD1      LEU   8   0.366   8.392  -6.163
   11   3HD1  LEU   8          3HD1      LEU   8   1.713   9.471  -5.796
   12   1HD2  LEU   8          1HD2      LEU   8  -1.790   9.078  -6.277
   13   2HD2  LEU   8          2HD2      LEU   8  -1.757  10.607  -7.156
   14   3HD2  LEU   8          3HD2      LEU   8  -2.334  10.560  -5.489
   15    H    VAL   9           H        VAL   9  -0.427   6.467  -3.347
   16    HA   VAL   9           HA       VAL   9   2.455   6.273  -3.648
   17    HB   VAL   9           HB       VAL   9   2.654   4.847  -1.586
   18   1HG1  VAL   9          1HG1      VAL   9   1.974   7.765  -1.261
   19   2HG1  VAL   9          2HG1      VAL   9   3.562   7.070  -1.587
   20   3HG1  VAL   9          3HG1      VAL   9   2.776   6.785  -0.034
   21   1HG2  VAL   9          1HG2      VAL   9   0.677   4.228  -0.716
   22   2HG2  VAL   9          2HG2      VAL   9  -0.170   5.622  -1.388
   23   3HG2  VAL   9          3HG2      VAL   9   0.749   5.786   0.108
   24    H    LEU  10           H        LEU  10   0.498   5.413  -5.380
   25    HA   LEU  10           HA       LEU  10  -0.519   2.867  -5.114
   26   1HB   LEU  10          1HB       LEU  10  -0.439   2.728  -7.573
   27    HG   LEU  10           HG       LEU  10   1.738   4.545  -7.381
   28   1HD1  LEU  10          1HD1      LEU  10   2.210   3.716  -9.418
   29   2HD1  LEU  10          2HD1      LEU  10   0.578   3.991 -10.026
   30   3HD1  LEU  10          3HD1      LEU  10   0.923   2.574  -9.034
   31   1HD2  LEU  10          1HD2      LEU  10   0.347   6.437  -7.450
   32   2HD2  LEU  10          2HD2      LEU  10  -0.739   5.701  -8.628
   33   3HD2  LEU  10          3HD2      LEU  10   0.881   6.200  -9.114
   34    H    ALA  11           H        ALA  11   0.473   1.052  -4.551
   35    HA   ALA  11           HA       ALA  11   3.219   0.597  -4.561
   36   1HB   ALA  11          1HB       ALA  11   2.322  -0.947  -3.206
   37   2HB   ALA  11          2HB       ALA  11   2.206  -1.931  -4.665
   38   3HB   ALA  11          3HB       ALA  11   0.810  -1.007  -4.112
   39    H    LEU  12           H        LEU  12   4.204   1.043  -6.505
   40    HA   LEU  12           HA       LEU  12   3.383   0.275  -9.043
   41   1HB   LEU  12          1HB       LEU  12   6.020   0.949  -7.825
   42    HG   LEU  12           HG       LEU  12   4.117   2.498  -9.069
   43   1HD1  LEU  12          1HD1      LEU  12   6.904   2.775  -8.213
   44   2HD1  LEU  12          2HD1      LEU  12   5.505   3.796  -7.885
   45   3HD1  LEU  12          3HD1      LEU  12   6.384   3.965  -9.405
   46   1HD2  LEU  12          1HD2      LEU  12   5.631   3.202 -11.132
   47   2HD2  LEU  12          2HD2      LEU  12   4.365   1.983 -11.271
   48   3HD2  LEU  12          3HD2      LEU  12   6.046   1.488 -11.082
   49    H    TYR  13           H        TYR  13   4.825  -1.623  -6.531
   50    HA   TYR  13           HA       TYR  13   4.704  -3.964  -8.289
   51   1HB   TYR  13          1HB       TYR  13   7.101  -2.844  -7.035
   52    HD1  TYR  13           HD1      TYR  13   5.847  -5.743  -9.037
   53    HD2  TYR  13           HD2      TYR  13   8.679  -2.588  -8.691
   54    HE1  TYR  13           HE1      TYR  13   6.781  -6.347 -11.231
   55    HE2  TYR  13           HE2      TYR  13   9.620  -3.183 -10.884
   56    HH   TYR  13           HH       TYR  13   8.141  -4.939 -13.105
   57    H    ASP  14           H        ASP  14   2.749  -4.453  -7.195
   58    HA   ASP  14           HA       ASP  14   2.771  -4.884  -4.340
   59   1HB   ASP  14          1HB       ASP  14   0.623  -5.767  -6.267
   60    H    TYR  15           H        TYR  15   1.153  -7.232  -4.242
   61    HA   TYR  15           HA       TYR  15   1.227  -9.515  -4.284
   62   1HB   TYR  15          1HB       TYR  15   2.298  -8.928  -6.706
   63    HD1  TYR  15           HD1      TYR  15   3.827 -11.967  -6.520
   64    HD2  TYR  15           HD2      TYR  15  -0.048 -10.267  -6.075
   65    HE1  TYR  15           HE1      TYR  15   2.817 -14.144  -7.051
   66    HE2  TYR  15           HE2      TYR  15  -1.068 -12.441  -6.606
   67    HH   TYR  15           HH       TYR  15   0.295 -15.215  -6.388
   68    H    GLN  16           H        GLN  16   3.398 -11.257  -4.255
   69    HA   GLN  16           HA       GLN  16   5.144 -12.019  -3.001
   70   1HB   GLN  16          1HB       GLN  16   5.500  -9.281  -1.804
   71   1HG   GLN  16          1HG       GLN  16   6.009 -10.108  -4.579
   72   1HE2  GLN  16          1HE2      GLN  16   7.487  -7.578  -4.949
   73   2HE2  GLN  16          2HE2      GLN  16   9.132  -7.950  -4.576
   74    H    GLU  17           H        GLU  17   3.703  -9.456  -0.978
   75    HA   GLU  17           HA       GLU  17   2.672  -9.512   1.045
   76   1HB   GLU  17          1HB       GLU  17   1.067 -10.976  -0.068
   77   1HG   GLU  17          1HG       GLU  17   1.772 -11.515   2.756
   78    H    LYS  18           H        LYS  18   3.756 -12.895   1.045
   79    HA   LYS  18           HA       LYS  18   5.131 -14.049   2.440
   80   1HB   LYS  18          1HB       LYS  18   6.622 -12.019   1.438
   81   1HG   LYS  18          1HG       LYS  18   8.606 -13.067   2.447
   82   1HD   LYS  18          1HD       LYS  18   6.487 -14.537   1.040
   83   1HE   LYS  18          1HE       LYS  18   7.120 -16.169   2.785
   84   1HZ   LYS  18          1HZ       LYS  18   9.274 -15.897   3.396
   85   2HZ   LYS  18          2HZ       LYS  18   9.804 -15.499   1.840
   86   3HZ   LYS  18          3HZ       LYS  18   9.498 -17.113   2.241
   87    H    SER  19           H        SER  19   2.840 -13.290   3.652
   88    HA   SER  19           HA       SER  19   3.456 -13.454   6.377
   89   1HB   SER  19          1HB       SER  19   4.120 -11.196   6.441
   90    HG   SER  19           HG       SER  19   2.805 -10.709   7.992
   91    HA   PRO  20           HA       PRO  20  -0.749 -14.799   6.359
   92   1HB   PRO  20          1HB       PRO  20  -1.382 -14.524   8.991
   93   1HG   PRO  20          1HG       PRO  20   0.417 -13.227   9.678
   94   1HD   PRO  20          1HD       PRO  20   2.323 -13.006   8.396
   95    H    ARG  21           H        ARG  21  -0.014 -11.740   7.965
   96    HA   ARG  21           HA       ARG  21  -2.745 -10.812   7.391
   97   1HB   ARG  21          1HB       ARG  21  -1.499 -10.719   9.758
   98   1HG   ARG  21          1HG       ARG  21  -2.796  -8.264   9.790
   99   1HD   ARG  21          1HD       ARG  21  -4.712  -9.602  10.671
  100    HE   ARG  21           HE       ARG  21  -2.178  -9.452  11.830
  101   1HH1  ARG  21          1HH1      ARG  21  -5.082 -11.370  12.087
  102   2HH1  ARG  21          2HH1      ARG  21  -4.838 -11.741  13.761
  103   1HH2  ARG  21          1HH2      ARG  21  -1.856  -9.939  14.032
  104   2HH2  ARG  21          2HH2      ARG  21  -3.007 -10.928  14.865
  105    H    GLU  22           H        GLU  22  -1.762 -10.726   5.113
  106    HA   GLU  22           HA       GLU  22  -1.017  -7.962   4.614
  107   1HB   GLU  22          1HB       GLU  22   0.777 -10.282   4.144
  108   1HG   GLU  22          1HG       GLU  22   1.003  -7.506   5.078
  109    H    VAL  23           H        VAL  23  -0.645  -7.851   2.019
  110    HA   VAL  23           HA       VAL  23  -2.802  -9.396   0.750
  111    HB   VAL  23           HB       VAL  23  -2.375  -6.467   0.180
  112   1HG1  VAL  23          1HG1      VAL  23  -4.595  -6.627  -0.826
  113   2HG1  VAL  23          2HG1      VAL  23  -4.675  -8.334  -0.391
  114   3HG1  VAL  23          3HG1      VAL  23  -3.480  -7.779  -1.561
  115   1HG2  VAL  23          1HG2      VAL  23  -4.111  -7.777   2.242
  116   2HG2  VAL  23          2HG2      VAL  23  -4.578  -6.242   1.507
  117   3HG2  VAL  23          3HG2      VAL  23  -3.063  -6.368   2.402
  118    H    THR  24           H        THR  24  -2.633  -9.584  -1.559
  119    HA   THR  24           HA       THR  24   0.146  -9.351  -2.489
  120    HB   THR  24           HB       THR  24  -0.948 -10.971  -4.323
  121    HG1  THR  24           HG1      THR  24  -2.821 -11.647  -3.723
  122   1HG2  THR  24          1HG2      THR  24   0.268 -12.619  -3.422
  123   2HG2  THR  24          2HG2      THR  24  -0.458 -12.425  -1.826
  124   3HG2  THR  24          3HG2      THR  24   0.838 -11.346  -2.342
  125    H    MET  25           H        MET  25  -2.894  -9.612  -4.300
  126    HA   MET  25           HA       MET  25  -3.616  -8.527  -6.166
  127   1HB   MET  25          1HB       MET  25  -4.066  -6.219  -5.876
  128   1HG   MET  25          1HG       MET  25  -1.526  -5.856  -5.007
  129   1HE   MET  25          1HE       MET  25  -2.795  -3.365  -2.947
  130   2HE   MET  25          2HE       MET  25  -2.971  -3.945  -1.291
  131   3HE   MET  25          3HE       MET  25  -4.227  -4.284  -2.481
  132    H    LYS  26           H        LYS  26  -2.937  -6.404  -7.631
  133    HA   LYS  26           HA       LYS  26  -0.216  -5.931  -8.070
  134   1HB   LYS  26          1HB       LYS  26  -1.157  -8.458  -9.090
  135   1HG   LYS  26          1HG       LYS  26   1.030  -8.101  -8.016
  136   1HD   LYS  26          1HD       LYS  26   1.267  -5.935  -9.668
  137   1HE   LYS  26          1HE       LYS  26   3.055  -6.319 -11.201
  138   1HZ   LYS  26          1HZ       LYS  26   2.048  -7.839 -12.770
  139   2HZ   LYS  26          2HZ       LYS  26   0.857  -6.872 -12.059
  140   3HZ   LYS  26          3HZ       LYS  26   1.047  -8.477 -11.564
  141    H    LYS  27           H        LYS  27  -0.610  -3.888  -8.670
  142    HA   LYS  27           HA       LYS  27  -1.410  -3.236 -11.255
  143   1HB   LYS  27          1HB       LYS  27  -3.580  -2.063 -10.715
  144   1HG   LYS  27          1HG       LYS  27  -3.588  -3.877  -8.314
  145   1HD   LYS  27          1HD       LYS  27  -5.664  -2.420  -7.849
  146   1HE   LYS  27          1HE       LYS  27  -7.102  -3.894  -9.240
  147   1HZ   LYS  27          1HZ       LYS  27  -5.648  -4.599  -7.135
  148   2HZ   LYS  27          2HZ       LYS  27  -5.067  -5.720  -8.261
  149   3HZ   LYS  27          3HZ       LYS  27  -6.721  -5.651  -7.913
  150    H    GLY  28           H        GLY  28  -1.712  -0.846 -11.545
  151   1HA   GLY  28          1HA       GLY  28   0.062   0.534  -9.669
  152   2HA   GLY  28          2HA       GLY  28  -0.357   1.077 -11.287
  153    H    ASP  29           H        ASP  29  -2.887  -0.013  -9.193
  154    HA   ASP  29           HA       ASP  29  -4.203   2.516  -9.324
  155   1HB   ASP  29          1HB       ASP  29  -4.797  -0.161  -8.174
  156    H    ILE  30           H        ILE  30  -5.054   3.613  -7.337
  157    HA   ILE  30           HA       ILE  30  -2.829   4.127  -5.548
  158    HB   ILE  30           HB       ILE  30  -5.502   5.467  -5.312
  159   1HG1  ILE  30          1HG1      ILE  30  -5.005   5.580  -7.684
  160   1HG2  ILE  30          1HG2      ILE  30  -2.685   6.041  -4.550
  161   2HG2  ILE  30          2HG2      ILE  30  -4.172   6.248  -3.624
  162   3HG2  ILE  30          3HG2      ILE  30  -3.758   7.397  -4.896
  163   1HD1  ILE  30          1HD1      ILE  30  -2.892   5.365  -8.337
  164   2HD1  ILE  30          2HD1      ILE  30  -2.260   5.923  -6.790
  165   3HD1  ILE  30          3HD1      ILE  30  -2.755   7.093  -8.012
  166    H    LEU  31           H        LEU  31  -3.332   4.462  -3.186
  167    HA   LEU  31           HA       LEU  31  -5.432   2.802  -2.089
  168   1HB   LEU  31          1HB       LEU  31  -4.018   1.297  -0.897
  169    HG   LEU  31           HG       LEU  31  -1.516   1.210  -1.491
  170   1HD1  LEU  31          1HD1      LEU  31  -1.879   4.173  -1.844
  171   2HD1  LEU  31          2HD1      LEU  31  -1.734   3.055  -3.200
  172   3HD1  LEU  31          3HD1      LEU  31  -0.411   3.219  -2.045
  173   1HD2  LEU  31          1HD2      LEU  31  -2.170   3.500   0.310
  174   2HD2  LEU  31          2HD2      LEU  31  -0.988   2.208   0.519
  175   3HD2  LEU  31          3HD2      LEU  31  -2.707   1.871   0.720
  176    H    THR  32           H        THR  32  -5.388   2.866   0.352
  177    HA   THR  32           HA       THR  32  -4.553   5.553   1.200
  178    HB   THR  32           HB       THR  32  -6.603   3.697   2.427
  179    HG1  THR  32           HG1      THR  32  -6.823   5.932   0.713
  180   1HG2  THR  32          1HG2      THR  32  -7.357   5.819   3.561
  181   2HG2  THR  32          2HG2      THR  32  -5.795   6.503   3.112
  182   3HG2  THR  32          3HG2      THR  32  -5.870   5.093   4.169
  183    H    LEU  33           H        LEU  33  -3.815   5.818   3.431
  184    HA   LEU  33           HA       LEU  33  -2.361   3.449   4.411
  185   1HB   LEU  33          1HB       LEU  33  -1.313   6.209   4.866
  186    HG   LEU  33           HG       LEU  33  -1.609   6.096   2.407
  187   1HD1  LEU  33          1HD1      LEU  33   0.338   7.226   3.552
  188   2HD1  LEU  33          2HD1      LEU  33   0.581   6.789   1.861
  189   3HD1  LEU  33          3HD1      LEU  33   1.292   5.801   3.137
  190   1HD2  LEU  33          1HD2      LEU  33  -0.596   4.442   1.081
  191   2HD2  LEU  33          2HD2      LEU  33  -1.404   3.559   2.376
  192   3HD2  LEU  33          3HD2      LEU  33   0.340   3.810   2.435
  193    H    LEU  34           H        LEU  34  -1.364   4.414   6.745
  194    HA   LEU  34           HA       LEU  34  -3.363   5.768   8.294
  195   1HB   LEU  34          1HB       LEU  34  -4.309   3.475   8.079
  196    HG   LEU  34           HG       LEU  34  -3.421   4.025  10.912
  197   1HD1  LEU  34          1HD1      LEU  34  -5.794   5.067  10.958
  198   2HD1  LEU  34          2HD1      LEU  34  -5.569   5.223   9.215
  199   3HD1  LEU  34          3HD1      LEU  34  -4.445   6.011  10.323
  200   1HD2  LEU  34          1HD2      LEU  34  -5.996   2.746  10.113
  201   2HD2  LEU  34          2HD2      LEU  34  -5.092   2.608  11.621
  202   3HD2  LEU  34          3HD2      LEU  34  -4.523   1.779  10.172
  203    H    ASN  35           H        ASN  35  -1.559   7.091   8.749
  204    HA   ASN  35           HA       ASN  35   0.183   7.835  10.008
  205   1HB   ASN  35          1HB       ASN  35  -0.921   5.595  11.624
  206   1HD2  ASN  35          1HD2      ASN  35   0.672   7.766  13.502
  207   2HD2  ASN  35          2HD2      ASN  35  -0.608   8.892  13.790
  208    H    SER  36           H        SER  36   1.591   7.406   8.213
  209    HA   SER  36           HA       SER  36   3.458   5.189   8.743
  210   1HB   SER  36          1HB       SER  36   3.876   5.211   6.227
  211    HG   SER  36           HG       SER  36   2.761   6.552   5.075
  212    H    THR  37           H        THR  37   3.567   7.840   6.390
  213    HA   THR  37           HA       THR  37   5.061   9.519   6.039
  214    HB   THR  37           HB       THR  37   5.599   9.257   9.004
  215    HG1  THR  37           HG1      THR  37   3.720  10.819   7.570
  216   1HG2  THR  37          1HG2      THR  37   6.778  10.956   7.056
  217   2HG2  THR  37          2HG2      THR  37   7.037  10.915   8.801
  218   3HG2  THR  37          3HG2      THR  37   5.762  11.926   8.122
  219    H    ASN  38           H        ASN  38   7.206   9.800   5.482
  220    HA   ASN  38           HA       ASN  38   9.292   9.145   4.880
  221   1HB   ASN  38          1HB       ASN  38  10.633   9.101   6.675
  222   1HD2  ASN  38          1HD2      ASN  38  12.020   7.727   7.500
  223   2HD2  ASN  38          2HD2      ASN  38  11.667   6.131   8.057
  224    H    LYS  39           H        LYS  39  10.771   7.205   4.571
  225    HA   LYS  39           HA       LYS  39  11.108   5.181   3.607
  226   1HB   LYS  39          1HB       LYS  39   8.911   4.404   5.533
  227   1HG   LYS  39          1HG       LYS  39  11.406   5.200   6.183
  228   1HD   LYS  39          1HD       LYS  39  11.756   2.294   6.490
  229   1HE   LYS  39          1HE       LYS  39  13.273   4.413   7.071
  230   1HZ   LYS  39          1HZ       LYS  39  15.123   4.305   5.350
  231   2HZ   LYS  39          2HZ       LYS  39  13.754   5.216   4.954
  232   3HZ   LYS  39          3HZ       LYS  39  13.961   3.673   4.296
  233    H    ASP  40           H        ASP  40   8.023   3.776   3.848
  234    HA   ASP  40           HA       ASP  40   6.651   4.944   1.714
  235   1HB   ASP  40          1HB       ASP  40   8.620   4.119   0.417
  236    H    TRP  41           H        TRP  41   7.398   1.535   2.448
  237    HA   TRP  41           HA       TRP  41   4.630   0.825   2.496
  238   1HB   TRP  41          1HB       TRP  41   5.408  -1.406   3.075
  239    HD1  TRP  41           HD1      TRP  41   6.562  -1.846   5.424
  240    HE1  TRP  41           HE1      TRP  41   9.028  -1.955   6.156
  241    HE3  TRP  41           HE3      TRP  41   8.726   0.307   1.321
  242    HZ2  TRP  41           HZ2      TRP  41  11.554  -1.226   5.131
  243    HZ3  TRP  41           HZ3      TRP  41  11.172   0.565   1.276
  244    HH2  TRP  41           HH2      TRP  41  12.556  -0.186   3.143
  245    H    TRP  42           H        TRP  42   3.253   0.927   4.140
  246    HA   TRP  42           HA       TRP  42   3.992   0.425   6.840
  247   1HB   TRP  42          1HB       TRP  42   3.777   3.245   5.906
  248    HD1  TRP  42           HD1      TRP  42   6.011   4.401   6.385
  249    HE1  TRP  42           HE1      TRP  42   8.072   3.887   7.838
  250    HE3  TRP  42           HE3      TRP  42   4.284   0.240   8.805
  251    HZ2  TRP  42           HZ2      TRP  42   8.863   1.972   9.755
  252    HZ3  TRP  42           HZ3      TRP  42   5.757  -0.873  10.433
  253    HH2  TRP  42           HH2      TRP  42   7.999  -0.024  10.896
  254    H    LYS  43           H        LYS  43   2.267  -1.067   6.395
  255    HA   LYS  43           HA       LYS  43   0.123  -1.810   6.532
  256   1HB   LYS  43          1HB       LYS  43  -0.355   0.869   7.850
  257   1HG   LYS  43          1HG       LYS  43  -0.162  -1.582   9.469
  258   1HD   LYS  43          1HD       LYS  43   1.283   0.201  10.769
  259   1HE   LYS  43          1HE       LYS  43  -0.956   1.230  11.566
  260   1HZ   LYS  43          1HZ       LYS  43  -1.438  -0.698  12.824
  261   2HZ   LYS  43          2HZ       LYS  43   0.239  -0.677  12.607
  262   3HZ   LYS  43          3HZ       LYS  43  -0.719  -1.723  11.685
  263    H    VAL  44           H        VAL  44  -0.313  -1.870   4.327
  264    HA   VAL  44           HA       VAL  44  -1.427   0.492   3.041
  265    HB   VAL  44           HB       VAL  44  -1.106  -2.262   1.849
  266   1HG1  VAL  44          1HG1      VAL  44  -0.902   0.176   0.208
  267   2HG1  VAL  44          2HG1      VAL  44  -2.498  -0.170   0.874
  268   3HG1  VAL  44          3HG1      VAL  44  -1.687  -1.365  -0.137
  269   1HG2  VAL  44          1HG2      VAL  44   0.867  -0.049   2.219
  270   2HG2  VAL  44          2HG2      VAL  44   0.959  -1.074   0.786
  271   3HG2  VAL  44          3HG2      VAL  44   1.086  -1.791   2.394
  272    H    GLU  45           H        GLU  45  -3.526   0.747   2.425
  273    HA   GLU  45           HA       GLU  45  -5.434  -1.395   2.551
  274   1HB   GLU  45          1HB       GLU  45  -6.882  -0.202   4.245
  275   1HG   GLU  45          1HG       GLU  45  -4.507   1.517   4.372
  276    H    VAL  46           H        VAL  46  -7.184  -0.983   1.293
  277    HA   VAL  46           HA       VAL  46  -7.950   1.718   0.622
  278    HB   VAL  46           HB       VAL  46  -6.089   1.338  -0.941
  279   1HG1  VAL  46          1HG1      VAL  46  -6.116  -0.369  -2.596
  280   2HG1  VAL  46          2HG1      VAL  46  -7.744  -0.874  -2.137
  281   3HG1  VAL  46          3HG1      VAL  46  -6.392  -1.150  -1.039
  282   1HG2  VAL  46          1HG2      VAL  46  -7.267   1.929  -2.987
  283   2HG2  VAL  46          2HG2      VAL  46  -7.984   2.751  -1.601
  284   3HG2  VAL  46          3HG2      VAL  46  -8.782   1.343  -2.301
  285    H    ASN  47           H        ASN  47  -8.278  -1.721  -0.205
  286    HA   ASN  47           HA       ASN  47 -11.013  -1.842   0.380
  287   1HB   ASN  47          1HB       ASN  47 -10.779  -0.441  -1.890
  288   1HD2  ASN  47          1HD2      ASN  47 -12.666   0.412  -1.277
  289   2HD2  ASN  47          2HD2      ASN  47 -14.179  -0.419  -1.302
  290    H    ASP  48           H        ASP  48  -8.684  -3.381   0.823
  291    HA   ASP  48           HA       ASP  48  -9.552  -5.922  -0.358
  292   1HB   ASP  48          1HB       ASP  48  -6.671  -5.029  -0.111
  293    H    ARG  49           H        ARG  49  -6.965  -4.877   1.859
  294    HA   ARG  49           HA       ARG  49  -8.288  -6.063   4.127
  295   1HB   ARG  49          1HB       ARG  49  -6.039  -7.424   2.730
  296   1HG   ARG  49          1HG       ARG  49  -8.335  -8.398   4.412
  297   1HD   ARG  49          1HD       ARG  49  -7.666 -10.613   3.933
  298    HE   ARG  49           HE       ARG  49  -5.001  -9.831   4.557
  299   1HH1  ARG  49          1HH1      ARG  49  -8.264  -9.843   5.792
  300   2HH1  ARG  49          2HH1      ARG  49  -7.769  -9.829   7.452
  301   1HH2  ARG  49          1HH2      ARG  49  -4.348  -9.812   6.739
  302   2HH2  ARG  49          2HH2      ARG  49  -5.546  -9.810   7.989
  303    H    GLN  50           H        GLN  50  -6.449  -6.176   5.992
  304    HA   GLN  50           HA       GLN  50  -5.157  -3.530   5.933
  305   1HB   GLN  50          1HB       GLN  50  -6.101  -5.092   8.343
  306   1HG   GLN  50          1HG       GLN  50  -7.742  -3.769   6.619
  307   1HE2  GLN  50          1HE2      GLN  50  -9.136  -1.920   6.869
  308   2HE2  GLN  50          2HE2      GLN  50  -8.493  -0.442   7.493
  309    H    GLY  51           H        GLY  51  -3.037  -3.322   6.526
  310   1HA   GLY  51          1HA       GLY  51  -1.257  -4.524   7.949
  311   2HA   GLY  51          2HA       GLY  51  -1.551  -5.848   6.832
  312    H    PHE  52           H        PHE  52   0.934  -4.455   7.305
  313    HA   PHE  52           HA       PHE  52   1.533  -2.561   5.339
  314   1HB   PHE  52          1HB       PHE  52   3.925  -3.457   5.630
  315    HD1  PHE  52           HD1      PHE  52   2.692  -4.127   8.950
  316    HD2  PHE  52           HD2      PHE  52   4.113  -5.920   5.362
  317    HE1  PHE  52           HE1      PHE  52   3.110  -6.223  10.169
  318    HE2  PHE  52           HE2      PHE  52   4.534  -8.020   6.575
  319    HZ   PHE  52           HZ       PHE  52   4.033  -8.173   8.981
  320    H    VAL  53           H        VAL  53   2.852  -2.827   3.405
  321    HA   VAL  53           HA       VAL  53   2.769  -5.446   2.133
  322    HB   VAL  53           HB       VAL  53   1.542  -3.050   0.768
  323   1HG1  VAL  53          1HG1      VAL  53   0.858  -4.621  -0.928
  324   2HG1  VAL  53          2HG1      VAL  53   1.540  -5.963  -0.008
  325   3HG1  VAL  53          3HG1      VAL  53   2.602  -4.734  -0.695
  326   1HG2  VAL  53          1HG2      VAL  53   0.112  -3.741   2.605
  327   2HG2  VAL  53          2HG2      VAL  53   0.182  -5.415   2.056
  328   3HG2  VAL  53          3HG2      VAL  53  -0.614  -4.194   1.064
  329    HA   PRO  54           HA       PRO  54   6.775  -4.217   0.684
  330   1HB   PRO  54          1HB       PRO  54   6.016  -5.722  -1.770
  331   1HG   PRO  54          1HG       PRO  54   5.494  -7.684  -0.629
  332   1HD   PRO  54          1HD       PRO  54   3.624  -6.414  -0.160
  333    H    ALA  55           H        ALA  55   6.612  -2.038   0.286
  334    HA   ALA  55           HA       ALA  55   5.062  -0.781  -1.646
  335   1HB   ALA  55          1HB       ALA  55   7.648   0.016  -0.337
  336   2HB   ALA  55          2HB       ALA  55   6.014   0.572   0.029
  337   3HB   ALA  55          3HB       ALA  55   6.800   1.067  -1.471
  338    H    ALA  56           H        ALA  56   8.351  -2.069  -1.875
  339    HA   ALA  56           HA       ALA  56   9.741  -2.430  -3.645
  340   1HB   ALA  56          1HB       ALA  56   8.057  -4.069  -4.200
  341   2HB   ALA  56          2HB       ALA  56   8.661  -3.322  -5.680
  342   3HB   ALA  56          3HB       ALA  56   7.093  -2.846  -5.026
  343    H    TYR  57           H        TYR  57   9.683   0.169  -3.195
  344    HA   TYR  57           HA       TYR  57  10.114   2.200  -4.104
  345   1HB   TYR  57          1HB       TYR  57  11.460   2.067  -5.893
  346    HD1  TYR  57           HD1      TYR  57  10.027  -0.597  -7.783
  347    HD2  TYR  57           HD2      TYR  57   9.969   3.625  -7.270
  348    HE1  TYR  57           HE1      TYR  57   9.048  -0.345 -10.025
  349    HE2  TYR  57           HE2      TYR  57   8.989   3.890  -9.510
  350    HH   TYR  57           HH       TYR  57   7.751   2.629 -11.140
  351    H    VAL  58           H        VAL  58   8.633   3.737  -4.178
  352    HA   VAL  58           HA       VAL  58   6.384   3.448  -6.050
  353    HB   VAL  58           HB       VAL  58   5.955   3.026  -3.464
  354   1HG1  VAL  58          1HG1      VAL  58   6.900   5.440  -3.082
  355   2HG1  VAL  58          2HG1      VAL  58   5.539   4.844  -2.134
  356   3HG1  VAL  58          3HG1      VAL  58   5.256   5.922  -3.500
  357   1HG2  VAL  58          1HG2      VAL  58   3.835   4.741  -4.512
  358   2HG2  VAL  58          2HG2      VAL  58   3.801   3.038  -4.060
  359   3HG2  VAL  58          3HG2      VAL  58   4.391   3.515  -5.651
  360    H    LYS  59           H        LYS  59   5.104   5.838  -5.585
  361    HA   LYS  59           HA       LYS  59   6.456   7.648  -7.146
  362   1HB   LYS  59          1HB       LYS  59   4.171   7.812  -5.268
  363   1HG   LYS  59          1HG       LYS  59   3.276   9.137  -7.298
  364   1HD   LYS  59          1HD       LYS  59   3.632   6.272  -6.860
  365   1HE   LYS  59          1HE       LYS  59   4.413   6.444  -9.204
  366   1HZ   LYS  59          1HZ       LYS  59   2.382   6.904 -10.762
  367   2HZ   LYS  59          2HZ       LYS  59   3.378   8.167 -10.244
  368   3HZ   LYS  59          3HZ       LYS  59   1.890   7.901  -9.486
  369    H    LYS  60           H        LYS  60   5.843   8.438  -3.735
  370    HA   LYS  60           HA       LYS  60   8.513   8.730  -2.947
  371   1HB   LYS  60          1HB       LYS  60   7.803  10.733  -4.715
  372   1HG   LYS  60          1HG       LYS  60  10.097  10.189  -4.138
  373   1HD   LYS  60          1HD       LYS  60  10.128  11.898  -1.744
  374   1HE   LYS  60          1HE       LYS  60  11.264   9.161  -1.854
  375   1HZ   LYS  60          1HZ       LYS  60  11.690  10.670   0.007
  376   2HZ   LYS  60          2HZ       LYS  60  12.411  11.778  -1.048
  377   3HZ   LYS  60          3HZ       LYS  60  13.116  10.261  -0.806
  378    H    LEU  61           H        LEU  61   5.753  10.944  -2.533
  379    HA   LEU  61           HA       LEU  61   4.518  11.512  -0.710
  380   1HB   LEU  61          1HB       LEU  61   3.993   9.071  -0.787
  381    HG   LEU  61           HG       LEU  61   3.950  10.559   1.797
  382   1HD1  LEU  61          1HD1      LEU  61   1.865   9.340  -0.004
  383   2HD1  LEU  61          2HD1      LEU  61   2.246  11.052   0.179
  384   3HD1  LEU  61          3HD1      LEU  61   1.518  10.164   1.515
  385   1HD2  LEU  61          1HD2      LEU  61   2.533   8.413   2.506
  386   2HD2  LEU  61          2HD2      LEU  61   4.246   8.592   2.883
  387   3HD2  LEU  61          3HD2      LEU  61   3.744   7.622   1.497
  388    H    ASP  62           H        ASP  62   5.625  13.176   0.186
  389    HA   ASP  62           HA       ASP  62   7.385  12.512   2.438
  390   1HB   ASP  62          1HB       ASP  62   8.888  14.382   1.811
  Start of MODEL    5
    1    H    GLU   7           H        GLU   7  -2.537  14.485  -0.934
    2    HA   GLU   7           HA       GLU   7  -1.268  11.982  -0.571
    3   1HB   GLU   7          1HB       GLU   7  -2.231  13.247   1.293
    4   1HG   GLU   7          1HG       GLU   7  -3.940  10.811   1.197
    5    H    LEU   8           H        LEU   8  -1.496  10.422  -2.051
    6    HA   LEU   8           HA       LEU   8  -4.228   9.574  -2.717
    7   1HB   LEU   8          1HB       LEU   8  -2.652  10.832  -4.530
    8    HG   LEU   8           HG       LEU   8  -3.933   9.716  -6.349
    9   1HD1  LEU   8          1HD1      LEU   8  -4.885   8.001  -4.069
   10   2HD1  LEU   8          2HD1      LEU   8  -4.109   7.485  -5.566
   11   3HD1  LEU   8          3HD1      LEU   8  -5.746   8.143  -5.601
   12   1HD2  LEU   8          1HD2      LEU   8  -4.852  11.641  -5.160
   13   2HD2  LEU   8          2HD2      LEU   8  -5.563  10.566  -3.957
   14   3HD2  LEU   8          3HD2      LEU   8  -6.123  10.513  -5.628
   15    H    VAL   9           H        VAL   9  -0.911   8.480  -3.443
   16    HA   VAL   9           HA       VAL   9   0.158   6.499  -3.091
   17    HB   VAL   9           HB       VAL   9  -1.888   5.841  -0.982
   18   1HG1  VAL   9          1HG1      VAL   9  -0.503   4.196  -0.405
   19   2HG1  VAL   9          2HG1      VAL   9   0.893   5.272  -0.412
   20   3HG1  VAL   9          3HG1      VAL   9   0.362   4.507  -1.910
   21   1HG2  VAL   9          1HG2      VAL   9   0.158   7.975  -0.998
   22   2HG2  VAL   9          2HG2      VAL   9   0.052   6.992   0.464
   23   3HG2  VAL   9          3HG2      VAL   9  -1.365   7.868  -0.115
   24    H    LEU  10           H        LEU  10   0.109   4.589  -4.133
   25    HA   LEU  10           HA       LEU  10  -2.511   3.385  -4.709
   26   1HB   LEU  10          1HB       LEU  10  -1.365   2.727  -6.960
   27    HG   LEU  10           HG       LEU  10   0.825   3.915  -6.296
   28   1HD1  LEU  10          1HD1      LEU  10   0.513   3.083  -8.505
   29   2HD1  LEU  10          2HD1      LEU  10   1.126   4.733  -8.643
   30   3HD1  LEU  10          3HD1      LEU  10  -0.586   4.402  -8.909
   31   1HD2  LEU  10          1HD2      LEU  10   0.381   6.013  -5.562
   32   2HD2  LEU  10          2HD2      LEU  10  -1.060   6.180  -6.566
   33   3HD2  LEU  10          3HD2      LEU  10   0.541   6.381  -7.278
   34    H    ALA  11           H        ALA  11  -2.576   1.151  -4.824
   35    HA   ALA  11           HA       ALA  11  -0.718  -0.259  -3.256
   36   1HB   ALA  11          1HB       ALA  11  -2.820  -1.207  -3.245
   37   2HB   ALA  11          2HB       ALA  11  -1.943  -2.294  -4.322
   38   3HB   ALA  11          3HB       ALA  11  -3.010  -1.060  -4.992
   39    H    LEU  12           H        LEU  12   1.311   0.279  -4.278
   40    HA   LEU  12           HA       LEU  12   1.831  -1.142  -6.796
   41   1HB   LEU  12          1HB       LEU  12   2.782   1.337  -5.643
   42    HG   LEU  12           HG       LEU  12   1.905   1.053  -7.981
   43   1HD1  LEU  12          1HD1      LEU  12   3.561   2.581  -8.988
   44   2HD1  LEU  12          2HD1      LEU  12   4.642   2.264  -7.631
   45   3HD1  LEU  12          3HD1      LEU  12   3.091   3.058  -7.355
   46   1HD2  LEU  12          1HD2      LEU  12   3.157   0.041  -9.655
   47   2HD2  LEU  12          2HD2      LEU  12   3.330  -1.071  -8.298
   48   3HD2  LEU  12          3HD2      LEU  12   4.635   0.050  -8.692
   49    H    TYR  13           H        TYR  13   1.554  -2.524  -4.260
   50    HA   TYR  13           HA       TYR  13   4.259  -3.281  -3.521
   51   1HB   TYR  13          1HB       TYR  13   2.360  -5.064  -2.356
   52    HD1  TYR  13           HD1      TYR  13   0.044  -4.639  -2.964
   53    HD2  TYR  13           HD2      TYR  13   2.378  -1.670  -1.005
   54    HE1  TYR  13           HE1      TYR  13  -2.005  -3.393  -2.420
   55    HE2  TYR  13           HE2      TYR  13   0.335  -0.417  -0.456
   56    HH   TYR  13           HH       TYR  13  -2.768  -1.738  -0.765
   57    H    ASP  14           H        ASP  14   1.369  -5.064  -4.638
   58    HA   ASP  14           HA       ASP  14   1.170  -7.030  -5.785
   59   1HB   ASP  14          1HB       ASP  14   1.891  -5.576  -7.608
   60    H    TYR  15           H        TYR  15   1.622  -8.480  -4.103
   61    HA   TYR  15           HA       TYR  15   4.272  -9.737  -4.306
   62   1HB   TYR  15          1HB       TYR  15   3.485  -8.319  -2.106
   63    HD1  TYR  15           HD1      TYR  15   5.932  -8.124  -3.086
   64    HD2  TYR  15           HD2      TYR  15   4.556 -11.314  -0.630
   65    HE1  TYR  15           HE1      TYR  15   8.255  -8.632  -2.454
   66    HE2  TYR  15           HE2      TYR  15   6.874 -11.832   0.009
   67    HH   TYR  15           HH       TYR  15   9.136 -11.500  -0.845
   68    H    GLN  16           H        GLN  16   1.412 -10.550  -2.354
   69    HA   GLN  16           HA       GLN  16   0.140 -12.408  -3.854
   70   1HB   GLN  16          1HB       GLN  16   1.214 -14.580  -2.963
   71   1HG   GLN  16          1HG       GLN  16   3.092 -12.700  -1.936
   72   1HE2  GLN  16          1HE2      GLN  16   3.756 -15.583  -3.896
   73   2HE2  GLN  16          2HE2      GLN  16   5.215 -14.980  -4.598
   74    H    GLU  17           H        GLU  17  -0.762 -14.327  -2.414
   75    HA   GLU  17           HA       GLU  17  -1.356 -13.175   0.234
   76   1HB   GLU  17          1HB       GLU  17  -3.164 -14.978  -1.379
   77   1HG   GLU  17          1HG       GLU  17  -3.477 -12.010  -1.022
   78    H    LYS  18           H        LYS  18  -0.491 -16.039  -1.559
   79    HA   LYS  18           HA       LYS  18  -0.854 -17.889   0.576
   80   1HB   LYS  18          1HB       LYS  18   0.440 -19.438  -0.835
   81   1HG   LYS  18          1HG       LYS  18   0.592 -17.529  -3.073
   82   1HD   LYS  18          1HD       LYS  18   1.221 -20.022  -3.022
   83   1HE   LYS  18          1HE       LYS  18   2.711 -19.403  -0.894
   84   1HZ   LYS  18          1HZ       LYS  18   4.729 -19.440  -3.053
   85   2HZ   LYS  18          2HZ       LYS  18   4.953 -19.105  -1.412
   86   3HZ   LYS  18          3HZ       LYS  18   4.157 -17.987  -2.402
   87    H    SER  19           H        SER  19   1.675 -15.695  -0.315
   88    HA   SER  19           HA       SER  19   3.907 -16.877   0.820
   89   1HB   SER  19          1HB       SER  19   3.079 -14.111   0.188
   90    HG   SER  19           HG       SER  19   5.663 -14.680  -0.189
   91    HA   PRO  20           HA       PRO  20   2.999 -16.868   5.162
   92   1HB   PRO  20          1HB       PRO  20   5.455 -17.337   6.142
   93   1HG   PRO  20          1HG       PRO  20   6.755 -16.751   4.311
   94   1HD   PRO  20          1HD       PRO  20   5.832 -16.479   2.233
   95    H    ARG  21           H        ARG  21   2.846 -14.320   4.374
   96    HA   ARG  21           HA       ARG  21   4.654 -12.850   6.178
   97   1HB   ARG  21          1HB       ARG  21   3.654 -12.262   3.463
   98   1HG   ARG  21          1HG       ARG  21   5.814 -10.607   4.294
   99   1HD   ARG  21          1HD       ARG  21   5.365 -12.841   2.371
  100    HE   ARG  21           HE       ARG  21   7.591 -13.326   2.477
  101   1HH1  ARG  21          1HH1      ARG  21   7.190  -9.883   2.880
  102   2HH1  ARG  21          2HH1      ARG  21   8.889  -9.555   2.846
  103   1HH2  ARG  21          1HH2      ARG  21   9.827 -12.896   2.430
  104   2HH2  ARG  21          2HH2      ARG  21  10.387 -11.265   2.589
  105    H    GLU  22           H        GLU  22   1.456 -12.364   4.666
  106    HA   GLU  22           HA       GLU  22   0.005 -12.379   7.067
  107   1HB   GLU  22          1HB       GLU  22   1.315  -9.852   6.390
  108   1HG   GLU  22          1HG       GLU  22   0.951 -11.274   8.669
  109    H    VAL  23           H        VAL  23  -0.075 -10.197   4.242
  110    HA   VAL  23           HA       VAL  23  -2.327 -11.670   3.142
  111    HB   VAL  23           HB       VAL  23  -2.797  -8.740   3.343
  112   1HG1  VAL  23          1HG1      VAL  23  -4.475  -9.727   2.152
  113   2HG1  VAL  23          2HG1      VAL  23  -5.159  -9.832   3.774
  114   3HG1  VAL  23          3HG1      VAL  23  -4.379 -11.239   3.053
  115   1HG2  VAL  23          1HG2      VAL  23  -3.978  -9.066   5.520
  116   2HG2  VAL  23          2HG2      VAL  23  -2.222  -9.166   5.625
  117   3HG2  VAL  23          3HG2      VAL  23  -3.191 -10.638   5.651
  118    H    THR  24           H        THR  24  -0.959  -8.401   2.731
  119    HA   THR  24           HA       THR  24  -0.131  -7.312   0.916
  120    HB   THR  24           HB       THR  24   0.788  -9.712  -0.504
  121    HG1  THR  24           HG1      THR  24   1.261 -10.746   1.264
  122   1HG2  THR  24          1HG2      THR  24   3.022  -8.580  -0.026
  123   2HG2  THR  24          2HG2      THR  24   2.060  -7.234   0.583
  124   3HG2  THR  24          3HG2      THR  24   1.888  -7.753  -1.094
  125    H    MET  25           H        MET  25  -0.037  -7.492  -1.656
  126    HA   MET  25           HA       MET  25  -2.003  -8.937  -3.028
  127   1HB   MET  25          1HB       MET  25  -3.709  -7.203  -3.380
  128   1HG   MET  25          1HG       MET  25  -1.890  -5.410  -2.435
  129   1HE   MET  25          1HE       MET  25  -5.070  -6.610  -0.648
  130   2HE   MET  25          2HE       MET  25  -5.339  -4.877  -0.457
  131   3HE   MET  25          3HE       MET  25  -4.973  -5.873   0.951
  132    H    LYS  26           H        LYS  26  -2.734  -7.383  -5.075
  133    HA   LYS  26           HA       LYS  26  -0.355  -5.937  -5.987
  134   1HB   LYS  26          1HB       LYS  26  -1.304  -7.332  -8.245
  135   1HG   LYS  26          1HG       LYS  26  -2.196  -8.945  -6.403
  136   1HD   LYS  26          1HD       LYS  26   0.609  -8.931  -5.846
  137   1HE   LYS  26          1HE       LYS  26   1.181 -11.219  -5.979
  138   1HZ   LYS  26          1HZ       LYS  26   0.914  -9.798  -8.203
  139   2HZ   LYS  26          2HZ       LYS  26  -0.087 -11.106  -8.589
  140   3HZ   LYS  26          3HZ       LYS  26   1.532 -11.373  -8.181
  141    H    LYS  27           H        LYS  27  -1.026  -5.284  -8.491
  142    HA   LYS  27           HA       LYS  27  -2.258  -3.849  -9.753
  143   1HB   LYS  27          1HB       LYS  27  -3.964  -5.750  -9.319
  144   1HG   LYS  27          1HG       LYS  27  -5.342  -3.163  -9.875
  145   1HD   LYS  27          1HD       LYS  27  -6.287  -4.557 -11.729
  146   1HE   LYS  27          1HE       LYS  27  -7.202  -4.312  -9.279
  147   1HZ   LYS  27          1HZ       LYS  27  -6.387  -5.970  -8.016
  148   2HZ   LYS  27          2HZ       LYS  27  -6.072  -6.988  -9.328
  149   3HZ   LYS  27          3HZ       LYS  27  -7.643  -6.865  -8.714
  150    H    GLY  28           H        GLY  28  -2.124  -1.721  -9.531
  151   1HA   GLY  28          1HA       GLY  28  -2.026  -0.387  -7.074
  152   2HA   GLY  28          2HA       GLY  28  -2.252   0.388  -8.635
  153    H    ASP  29           H        ASP  29  -4.390   0.720  -9.418
  154    HA   ASP  29           HA       ASP  29  -6.504   1.531  -9.131
  155   1HB   ASP  29          1HB       ASP  29  -6.599  -1.129  -8.882
  156    H    ILE  30           H        ILE  30  -4.487   2.371  -7.161
  157    HA   ILE  30           HA       ILE  30  -4.341   3.605  -5.261
  158    HB   ILE  30           HB       ILE  30  -7.322   3.866  -5.142
  159   1HG1  ILE  30          1HG1      ILE  30  -6.824   4.093  -7.512
  160   1HG2  ILE  30          1HG2      ILE  30  -6.410   6.316  -4.769
  161   2HG2  ILE  30          2HG2      ILE  30  -4.934   5.449  -4.348
  162   3HG2  ILE  30          3HG2      ILE  30  -6.427   5.130  -3.464
  163   1HD1  ILE  30          1HD1      ILE  30  -4.723   4.645  -8.042
  164   2HD1  ILE  30          2HD1      ILE  30  -4.478   5.563  -6.558
  165   3HD1  ILE  30          3HD1      ILE  30  -5.324   6.297  -7.919
  166    H    LEU  31           H        LEU  31  -5.088   3.749  -2.931
  167    HA   LEU  31           HA       LEU  31  -6.483   1.458  -1.874
  168   1HB   LEU  31          1HB       LEU  31  -4.672   0.528  -0.629
  169    HG   LEU  31           HG       LEU  31  -2.269   1.313  -1.241
  170   1HD1  LEU  31          1HD1      LEU  31  -1.977   3.646  -1.624
  171   2HD1  LEU  31          2HD1      LEU  31  -3.709   3.945  -1.488
  172   3HD1  LEU  31          3HD1      LEU  31  -3.076   3.036  -2.859
  173   1HD2  LEU  31          1HD2      LEU  31  -3.530   1.364   0.996
  174   2HD2  LEU  31          2HD2      LEU  31  -3.727   3.088   0.679
  175   3HD2  LEU  31          3HD2      LEU  31  -2.111   2.394   0.808
  176    H    THR  32           H        THR  32  -5.926   1.517   0.716
  177    HA   THR  32           HA       THR  32  -6.164   4.339   1.534
  178    HB   THR  32           HB       THR  32  -7.736   2.002   2.638
  179    HG1  THR  32           HG1      THR  32  -9.503   3.130   1.715
  180   1HG2  THR  32          1HG2      THR  32  -7.458   3.496   4.430
  181   2HG2  THR  32          2HG2      THR  32  -9.053   3.834   3.757
  182   3HG2  THR  32          3HG2      THR  32  -7.699   4.904   3.393
  183    H    LEU  33           H        LEU  33  -5.662   4.715   3.833
  184    HA   LEU  33           HA       LEU  33  -3.754   2.750   4.909
  185   1HB   LEU  33          1HB       LEU  33  -3.268   5.670   5.285
  186    HG   LEU  33           HG       LEU  33  -3.486   5.196   2.764
  187   1HD1  LEU  33          1HD1      LEU  33  -2.020   6.875   2.375
  188   2HD1  LEU  33          2HD1      LEU  33  -0.736   6.123   3.321
  189   3HD1  LEU  33          3HD1      LEU  33  -2.046   6.977   4.136
  190   1HD2  LEU  33          1HD2      LEU  33  -0.909   3.744   3.345
  191   2HD2  LEU  33          2HD2      LEU  33  -1.522   4.153   1.743
  192   3HD2  LEU  33          3HD2      LEU  33  -2.404   3.016   2.762
  193    H    LEU  34           H        LEU  34  -3.051   3.965   7.228
  194    HA   LEU  34           HA       LEU  34  -5.131   5.135   8.708
  195   1HB   LEU  34          1HB       LEU  34  -6.170   2.909   8.323
  196    HG   LEU  34           HG       LEU  34  -6.499   4.245  10.531
  197   1HD1  LEU  34          1HD1      LEU  34  -8.154   2.779  11.110
  198   2HD1  LEU  34          2HD1      LEU  34  -7.135   1.359  10.867
  199   3HD1  LEU  34          3HD1      LEU  34  -7.802   2.215   9.476
  200   1HD2  LEU  34          1HD2      LEU  34  -5.827   2.547  12.434
  201   2HD2  LEU  34          2HD2      LEU  34  -4.714   3.800  11.886
  202   3HD2  LEU  34          3HD2      LEU  34  -4.538   2.147  11.299
  203    H    ASN  35           H        ASN  35  -3.449   6.369   9.511
  204    HA   ASN  35           HA       ASN  35  -1.798   6.974  10.953
  205   1HB   ASN  35          1HB       ASN  35  -3.246   5.829  12.602
  206   1HD2  ASN  35          1HD2      ASN  35  -0.088   4.278  12.724
  207   2HD2  ASN  35          2HD2      ASN  35   0.526   5.220  14.036
  208    H    SER  36           H        SER  36  -0.144   6.906   9.420
  209    HA   SER  36           HA       SER  36   1.989   5.124   9.993
  210   1HB   SER  36          1HB       SER  36   0.924   3.480   8.681
  211    HG   SER  36           HG       SER  36   2.140   3.592   6.626
  212    H    THR  37           H        THR  37   3.716   6.376   9.811
  213    HA   THR  37           HA       THR  37   3.803   8.359   7.631
  214    HB   THR  37           HB       THR  37   5.407   9.546   9.381
  215    HG1  THR  37           HG1      THR  37   4.558   9.248  11.491
  216   1HG2  THR  37          1HG2      THR  37   3.423  10.613   8.501
  217   2HG2  THR  37          2HG2      THR  37   3.541  10.861  10.243
  218   3HG2  THR  37          3HG2      THR  37   2.410   9.672   9.597
  219    H    ASN  38           H        ASN  38   6.126   9.114   7.228
  220    HA   ASN  38           HA       ASN  38   8.235   8.647   6.523
  221   1HB   ASN  38          1HB       ASN  38   7.969   7.039   8.995
  222   1HD2  ASN  38          1HD2      ASN  38   8.144   8.887  10.150
  223   2HD2  ASN  38          2HD2      ASN  38   9.542   9.901  10.142
  224    H    LYS  39           H        LYS  39   7.382   5.333   7.458
  225    HA   LYS  39           HA       LYS  39   8.168   4.317   4.906
  226   1HB   LYS  39          1HB       LYS  39   7.104   3.162   7.439
  227   1HG   LYS  39          1HG       LYS  39   8.989   1.455   6.533
  228   1HD   LYS  39          1HD       LYS  39  10.564   3.231   7.820
  229   1HE   LYS  39          1HE       LYS  39   8.419   1.585   9.155
  230   1HZ   LYS  39          1HZ       LYS  39  10.415   1.314  10.753
  231   2HZ   LYS  39          2HZ       LYS  39   9.455   2.704  10.856
  232   3HZ   LYS  39          3HZ       LYS  39  10.952   2.766  10.070
  233    H    ASP  40           H        ASP  40   6.651   2.742   3.738
  234    HA   ASP  40           HA       ASP  40   3.915   3.807   3.640
  235   1HB   ASP  40          1HB       ASP  40   4.057   3.531   1.113
  236    H    TRP  41           H        TRP  41   4.757   1.471   4.952
  237    HA   TRP  41           HA       TRP  41   3.051  -0.454   3.666
  238   1HB   TRP  41          1HB       TRP  41   4.777  -2.263   3.658
  239    HD1  TRP  41           HD1      TRP  41   7.082   0.783   3.126
  240    HE1  TRP  41           HE1      TRP  41   9.224   0.419   4.507
  241    HE3  TRP  41           HE3      TRP  41   5.754  -3.506   5.574
  242    HZ2  TRP  41           HZ2      TRP  41  10.218  -1.439   6.384
  243    HZ3  TRP  41           HZ3      TRP  41   7.358  -4.512   7.145
  244    HH2  TRP  41           HH2      TRP  41   9.544  -3.499   7.541
  245    H    TRP  42           H        TRP  42   3.158   1.038   6.153
  246    HA   TRP  42           HA       TRP  42   3.951  -0.685   8.274
  247   1HB   TRP  42          1HB       TRP  42   2.556   1.911   8.016
  248    HD1  TRP  42           HD1      TRP  42   4.860   3.131   7.928
  249    HE1  TRP  42           HE1      TRP  42   6.810   3.392   9.589
  250    HE3  TRP  42           HE3      TRP  42   3.465  -0.379  11.375
  251    HZ2  TRP  42           HZ2      TRP  42   7.645   2.259  12.036
  252    HZ3  TRP  42           HZ3      TRP  42   4.896  -0.729  13.345
  253    HH2  TRP  42           HH2      TRP  42   6.942   0.563  13.668
  254    H    LYS  43           H        LYS  43   0.789   0.121   6.847
  255    HA   LYS  43           HA       LYS  43  -0.225  -2.491   7.356
  256   1HB   LYS  43          1HB       LYS  43  -0.403  -1.649   9.629
  257   1HG   LYS  43          1HG       LYS  43  -3.221  -1.289   9.023
  258   1HD   LYS  43          1HD       LYS  43  -3.280  -3.471  10.346
  259   1HE   LYS  43          1HE       LYS  43  -3.579  -1.174  11.304
  260   1HZ   LYS  43          1HZ       LYS  43  -1.640  -0.491  12.754
  261   2HZ   LYS  43          2HZ       LYS  43  -1.490  -0.176  11.098
  262   3HZ   LYS  43          3HZ       LYS  43  -0.678  -1.491  11.785
  263    H    VAL  44           H        VAL  44  -0.742  -2.398   5.164
  264    HA   VAL  44           HA       VAL  44  -2.708  -0.391   4.326
  265    HB   VAL  44           HB       VAL  44  -1.307  -2.431   2.596
  266   1HG1  VAL  44          1HG1      VAL  44  -2.956  -1.772   1.213
  267   2HG1  VAL  44          2HG1      VAL  44  -1.932  -0.354   0.986
  268   3HG1  VAL  44          3HG1      VAL  44  -3.276  -0.298   2.126
  269   1HG2  VAL  44          1HG2      VAL  44   0.324  -0.946   3.656
  270   2HG2  VAL  44          2HG2      VAL  44  -0.573   0.455   3.071
  271   3HG2  VAL  44          3HG2      VAL  44   0.201  -0.639   1.925
  272    H    GLU  45           H        GLU  45  -4.777  -0.901   3.806
  273    HA   GLU  45           HA       GLU  45  -5.570  -3.712   4.171
  274   1HB   GLU  45          1HB       GLU  45  -7.912  -2.373   4.417
  275   1HG   GLU  45          1HG       GLU  45  -6.544  -0.188   4.327
  276    H    VAL  46           H        VAL  46  -6.963  -0.853   2.550
  277    HA   VAL  46           HA       VAL  46  -7.685  -0.543   0.402
  278    HB   VAL  46           HB       VAL  46  -6.722  -3.296  -0.338
  279   1HG1  VAL  46          1HG1      VAL  46  -6.191  -1.699  -2.437
  280   2HG1  VAL  46          2HG1      VAL  46  -7.587  -0.861  -1.757
  281   3HG1  VAL  46          3HG1      VAL  46  -7.717  -2.558  -2.223
  282   1HG2  VAL  46          1HG2      VAL  46  -4.653  -2.700   0.251
  283   2HG2  VAL  46          2HG2      VAL  46  -5.132  -1.027   0.542
  284   3HG2  VAL  46          3HG2      VAL  46  -4.713  -1.554  -1.088
  285    H    ASN  47           H        ASN  47  -9.761  -0.734   1.548
  286    HA   ASN  47           HA       ASN  47 -11.938  -1.397   1.552
  287   1HB   ASN  47          1HB       ASN  47 -11.187  -3.461  -0.523
  288   1HD2  ASN  47          1HD2      ASN  47 -10.702  -2.828  -2.510
  289   2HD2  ASN  47          2HD2      ASN  47 -10.718  -1.194  -3.072
  290    H    ASP  48           H        ASP  48 -10.193  -4.440   0.897
  291    HA   ASP  48           HA       ASP  48 -11.248  -5.474   3.446
  292   1HB   ASP  48          1HB       ASP  48 -11.975  -6.400   0.993
  293    H    ARG  49           H        ARG  49  -9.872  -7.899   3.447
  294    HA   ARG  49           HA       ARG  49  -7.881  -8.857   3.995
  295   1HB   ARG  49          1HB       ARG  49  -6.490  -6.589   2.578
  296   1HG   ARG  49          1HG       ARG  49  -8.382  -8.179   1.345
  297   1HD   ARG  49          1HD       ARG  49  -7.168  -9.654  -0.117
  298    HE   ARG  49           HE       ARG  49  -7.280 -10.194   2.639
  299   1HH1  ARG  49          1HH1      ARG  49  -5.719 -11.340  -0.264
  300   2HH1  ARG  49          2HH1      ARG  49  -5.556 -12.963   0.313
  301   1HH2  ARG  49          1HH2      ARG  49  -7.065 -12.330   3.402
  302   2HH2  ARG  49          2HH2      ARG  49  -6.320 -13.526   2.396
  303    H    GLN  50           H        GLN  50  -6.548  -8.799   5.750
  304    HA   GLN  50           HA       GLN  50  -6.919  -6.695   7.620
  305   1HB   GLN  50          1HB       GLN  50  -6.237  -9.304   7.836
  306   1HG   GLN  50          1HG       GLN  50  -5.151  -7.775  10.075
  307   1HE2  GLN  50          1HE2      GLN  50  -5.426  -8.926  11.871
  308   2HE2  GLN  50          2HE2      GLN  50  -6.435 -10.319  12.017
  309    H    GLY  51           H        GLY  51  -4.517  -6.277   8.843
  310   1HA   GLY  51          1HA       GLY  51  -3.304  -4.355   7.063
  311   2HA   GLY  51          2HA       GLY  51  -2.900  -4.614   8.754
  312    H    PHE  52           H        PHE  52  -0.674  -4.399   8.105
  313    HA   PHE  52           HA       PHE  52   1.384  -5.230   7.607
  314   1HB   PHE  52          1HB       PHE  52  -0.212  -7.557   8.408
  315    HD1  PHE  52           HD1      PHE  52   0.059  -6.803  10.647
  316    HD2  PHE  52           HD2      PHE  52   3.452  -7.417   8.151
  317    HE1  PHE  52           HE1      PHE  52   1.530  -6.636  12.613
  318    HE2  PHE  52           HE2      PHE  52   4.929  -7.251  10.111
  319    HZ   PHE  52           HZ       PHE  52   3.968  -6.861  12.346
  320    H    VAL  53           H        VAL  53   2.052  -4.698   5.630
  321    HA   VAL  53           HA       VAL  53   1.413  -6.499   3.419
  322    HB   VAL  53           HB       VAL  53   1.108  -3.499   3.224
  323   1HG1  VAL  53          1HG1      VAL  53   0.226  -4.099   0.923
  324   2HG1  VAL  53          2HG1      VAL  53   0.964  -5.683   1.163
  325   3HG1  VAL  53          3HG1      VAL  53   1.969  -4.234   1.155
  326   1HG2  VAL  53          1HG2      VAL  53  -0.881  -4.084   4.170
  327   2HG2  VAL  53          2HG2      VAL  53  -0.812  -5.737   3.561
  328   3HG2  VAL  53          3HG2      VAL  53  -1.271  -4.418   2.483
  329    HA   PRO  54           HA       PRO  54   5.932  -5.875   3.439
  330   1HB   PRO  54          1HB       PRO  54   5.697  -8.028   1.412
  331   1HG   PRO  54          1HG       PRO  54   4.577  -9.532   2.782
  332   1HD   PRO  54          1HD       PRO  54   2.888  -8.037   2.246
  333    H    ALA  55           H        ALA  55   7.106  -6.647   0.869
  334    HA   ALA  55           HA       ALA  55   7.451  -5.886  -1.266
  335   1HB   ALA  55          1HB       ALA  55   4.736  -5.411  -0.990
  336   2HB   ALA  55          2HB       ALA  55   5.683  -5.245  -2.468
  337   3HB   ALA  55          3HB       ALA  55   5.398  -3.839  -1.441
  338    H    ALA  56           H        ALA  56   6.545  -3.547   1.215
  339    HA   ALA  56           HA       ALA  56   7.588  -1.689   1.989
  340   1HB   ALA  56          1HB       ALA  56   9.986  -1.687   0.394
  341   2HB   ALA  56          2HB       ALA  56   9.668  -3.297   1.038
  342   3HB   ALA  56          3HB       ALA  56   9.794  -1.919   2.132
  343    H    TYR  57           H        TYR  57   8.942  -1.751  -1.298
  344    HA   TYR  57           HA       TYR  57   8.541   0.935  -1.846
  345   1HB   TYR  57          1HB       TYR  57   9.111   0.454  -4.074
  346    HD1  TYR  57           HD1      TYR  57   9.005  -0.697  -6.155
  347    HD2  TYR  57           HD2      TYR  57   7.379  -2.482  -2.653
  348    HE1  TYR  57           HE1      TYR  57   7.895  -2.398  -7.542
  349    HE2  TYR  57           HE2      TYR  57   6.269  -4.187  -4.030
  350    HH   TYR  57           HH       TYR  57   6.811  -5.200  -6.498
  351    H    VAL  58           H        VAL  58   7.056   1.927  -3.417
  352    HA   VAL  58           HA       VAL  58   4.662   0.770  -4.254
  353    HB   VAL  58           HB       VAL  58   4.065   0.561  -1.923
  354   1HG1  VAL  58          1HG1      VAL  58   5.612   2.596  -1.346
  355   2HG1  VAL  58          2HG1      VAL  58   4.231   2.191  -0.326
  356   3HG1  VAL  58          3HG1      VAL  58   4.109   3.506  -1.496
  357   1HG2  VAL  58          1HG2      VAL  58   1.985   1.004  -2.553
  358   2HG2  VAL  58          2HG2      VAL  58   2.575   2.075  -3.822
  359   3HG2  VAL  58          3HG2      VAL  58   2.253   2.712  -2.211
  360    H    LYS  59           H        LYS  59   5.966   3.790  -2.892
  361    HA   LYS  59           HA       LYS  59   5.950   5.186  -5.299
  362   1HB   LYS  59          1HB       LYS  59   3.977   6.323  -5.446
  363   1HG   LYS  59          1HG       LYS  59   4.082   7.472  -3.299
  364   1HD   LYS  59          1HD       LYS  59   2.893   4.929  -2.198
  365   1HE   LYS  59          1HE       LYS  59   3.410   7.606  -0.914
  366   1HZ   LYS  59          1HZ       LYS  59   3.875   6.250   0.826
  367   2HZ   LYS  59          2HZ       LYS  59   2.978   4.950   0.223
  368   3HZ   LYS  59          3HZ       LYS  59   2.187   6.251   0.962
  369    H    LYS  60           H        LYS  60   5.902   7.713  -4.798
  370    HA   LYS  60           HA       LYS  60   7.350   8.131  -2.266
  371   1HB   LYS  60          1HB       LYS  60   8.678   8.100  -4.540
  372   1HG   LYS  60          1HG       LYS  60   9.016  10.234  -2.449
  373   1HD   LYS  60          1HD       LYS  60  11.483   9.906  -3.435
  374   1HE   LYS  60          1HE       LYS  60  10.828  11.909  -5.008
  375   1HZ   LYS  60          1HZ       LYS  60  10.477  12.121  -2.067
  376   2HZ   LYS  60          2HZ       LYS  60  10.895  13.373  -3.126
  377   3HZ   LYS  60          3HZ       LYS  60  11.974  12.099  -2.859
  378    H    LEU  61           H        LEU  61   5.582   9.016  -1.215
  379    HA   LEU  61           HA       LEU  61   3.847  10.948  -2.273
  380   1HB   LEU  61          1HB       LEU  61   3.874   9.514  -0.010
  381    HG   LEU  61           HG       LEU  61   2.095  10.960   0.943
  382   1HD1  LEU  61          1HD1      LEU  61   2.971  13.133   0.364
  383   2HD1  LEU  61          2HD1      LEU  61   1.377  12.926  -0.361
  384   3HD1  LEU  61          3HD1      LEU  61   2.825  12.768  -1.356
  385   1HD2  LEU  61          1HD2      LEU  61   0.512  10.578  -0.794
  386   2HD2  LEU  61          2HD2      LEU  61   1.693   9.267  -0.861
  387   3HD2  LEU  61          3HD2      LEU  61   1.773  10.588  -2.028
  388    H    ASP  62           H        ASP  62   4.821  12.653  -3.274
  389    HA   ASP  62           HA       ASP  62   6.265  14.514  -1.521
  390   1HB   ASP  62          1HB       ASP  62   7.817  13.198  -3.064
  Start of MODEL    6
    1    H    GLU   7           H        GLU   7  -6.621   9.232  -4.679
    2    HA   GLU   7           HA       GLU   7  -5.444  10.514  -2.484
    3   1HB   GLU   7          1HB       GLU   7  -6.621   8.255  -1.595
    4   1HG   GLU   7          1HG       GLU   7  -4.309   8.253  -0.080
    5    H    LEU   8           H        LEU   8  -3.150   9.027  -2.095
    6    HA   LEU   8           HA       LEU   8  -2.095   8.309  -4.706
    7   1HB   LEU   8          1HB       LEU   8  -1.689  10.892  -3.526
    8    HG   LEU   8           HG       LEU   8  -1.996  10.526  -5.947
    9   1HD1  LEU   8          1HD1      LEU   8  -0.721  12.317  -6.550
   10   2HD1  LEU   8          2HD1      LEU   8   0.711  11.724  -5.711
   11   3HD1  LEU   8          3HD1      LEU   8  -0.608  12.452  -4.796
   12   1HD2  LEU   8          1HD2      LEU   8  -0.724   8.469  -6.183
   13   2HD2  LEU   8          2HD2      LEU   8   0.769   9.329  -5.805
   14   3HD2  LEU   8          3HD2      LEU   8  -0.115   9.704  -7.286
   15    H    VAL   9           H        VAL   9   0.592   8.309  -4.087
   16    HA   VAL   9           HA       VAL   9   2.257   7.238  -2.985
   17    HB   VAL   9           HB       VAL   9   2.239   6.880  -0.722
   18   1HG1  VAL   9          1HG1      VAL   9   1.313   8.745   0.252
   19   2HG1  VAL   9          2HG1      VAL   9  -0.171   8.638  -0.698
   20   3HG1  VAL   9          3HG1      VAL   9   1.324   9.194  -1.453
   21   1HG2  VAL   9          1HG2      VAL   9  -0.373   6.657   0.243
   22   2HG2  VAL   9          2HG2      VAL   9   0.839   5.382   0.136
   23   3HG2  VAL   9          3HG2      VAL   9  -0.314   5.612  -1.176
   24    H    LEU  10           H        LEU  10   0.526   5.983  -4.875
   25    HA   LEU  10           HA       LEU  10  -0.412   3.478  -4.351
   26   1HB   LEU  10          1HB       LEU  10   0.322   2.868  -6.666
   27    HG   LEU  10           HG       LEU  10   2.329   4.663  -6.459
   28   1HD1  LEU  10          1HD1      LEU  10   2.578   3.248  -8.213
   29   2HD1  LEU  10          2HD1      LEU  10   2.060   4.676  -9.110
   30   3HD1  LEU  10          3HD1      LEU  10   0.897   3.408  -8.725
   31   1HD2  LEU  10          1HD2      LEU  10   1.418   6.416  -8.265
   32   2HD2  LEU  10          2HD2      LEU  10   1.376   6.714  -6.528
   33   3HD2  LEU  10          3HD2      LEU  10  -0.069   6.139  -7.358
   34    H    ALA  11           H        ALA  11   0.469   1.916  -3.174
   35    HA   ALA  11           HA       ALA  11   3.133   1.604  -2.503
   36   1HB   ALA  11          1HB       ALA  11   2.329  -0.918  -2.237
   37   2HB   ALA  11          2HB       ALA  11   0.750  -0.159  -2.441
   38   3HB   ALA  11          3HB       ALA  11   1.815   0.357  -1.134
   39    H    LEU  12           H        LEU  12   4.633   1.644  -4.110
   40    HA   LEU  12           HA       LEU  12   4.492   0.524  -6.629
   41   1HB   LEU  12          1HB       LEU  12   6.809   1.092  -4.809
   42    HG   LEU  12           HG       LEU  12   5.386   2.651  -6.730
   43   1HD1  LEU  12          1HD1      LEU  12   7.405   4.231  -5.981
   44   2HD1  LEU  12          2HD1      LEU  12   7.541   2.990  -4.736
   45   3HD1  LEU  12          3HD1      LEU  12   6.027   3.872  -4.939
   46   1HD2  LEU  12          1HD2      LEU  12   8.231   2.010  -7.480
   47   2HD2  LEU  12          2HD2      LEU  12   7.368   3.440  -8.046
   48   3HD2  LEU  12          3HD2      LEU  12   6.784   1.831  -8.472
   49    H    TYR  13           H        TYR  13   5.532  -1.375  -7.530
   50    HA   TYR  13           HA       TYR  13   5.961  -3.604  -7.662
   51   1HB   TYR  13          1HB       TYR  13   6.945  -2.870  -5.017
   52    HD1  TYR  13           HD1      TYR  13   8.924  -2.167  -6.167
   53    HD2  TYR  13           HD2      TYR  13   7.469  -6.137  -6.633
   54    HE1  TYR  13           HE1      TYR  13  11.045  -2.813  -7.229
   55    HE2  TYR  13           HE2      TYR  13   9.586  -6.795  -7.696
   56    HH   TYR  13           HH       TYR  13  12.357  -5.041  -7.517
   57    H    ASP  14           H        ASP  14   4.452  -3.381  -4.438
   58    HA   ASP  14           HA       ASP  14   2.594  -4.361  -3.563
   59   1HB   ASP  14          1HB       ASP  14   1.825  -3.379  -6.215
   60    H    TYR  15           H        TYR  15   3.045  -6.389  -2.935
   61    HA   TYR  15           HA       TYR  15   3.248  -8.512  -4.935
   62   1HB   TYR  15          1HB       TYR  15   4.763  -8.031  -2.745
   63    HD1  TYR  15           HD1      TYR  15   4.541 -11.257  -1.890
   64    HD2  TYR  15           HD2      TYR  15   5.321  -8.955  -5.382
   65    HE1  TYR  15           HE1      TYR  15   5.807 -13.138  -2.840
   66    HE2  TYR  15           HE2      TYR  15   6.588 -10.830  -6.342
   67    HH   TYR  15           HH       TYR  15   6.506 -13.968  -5.031
   68    H    GLN  16           H        GLN  16   2.427 -10.727  -3.758
   69    HA   GLN  16           HA       GLN  16  -0.386 -10.242  -3.029
   70   1HB   GLN  16          1HB       GLN  16  -0.958 -12.322  -4.230
   71   1HG   GLN  16          1HG       GLN  16   1.946 -12.283  -4.988
   72   1HE2  GLN  16          1HE2      GLN  16  -0.447 -14.756  -5.554
   73   2HE2  GLN  16          2HE2      GLN  16  -0.321 -14.760  -7.276
   74    H    GLU  17           H        GLU  17  -1.328 -12.465  -2.148
   75    HA   GLU  17           HA       GLU  17   0.297 -14.263  -0.771
   76   1HB   GLU  17          1HB       GLU  17  -0.223 -13.319   1.590
   77   1HG   GLU  17          1HG       GLU  17  -0.191 -10.923   1.770
   78    H    LYS  18           H        LYS  18  -0.898 -15.678   0.644
   79    HA   LYS  18           HA       LYS  18  -3.691 -15.826  -0.119
   80   1HB   LYS  18          1HB       LYS  18  -1.709 -17.671   1.114
   81   1HG   LYS  18          1HG       LYS  18  -2.206 -17.787  -1.289
   82   1HD   LYS  18          1HD       LYS  18  -4.578 -19.096  -1.515
   83   1HE   LYS  18          1HE       LYS  18  -3.627 -16.361  -2.042
   84   1HZ   LYS  18          1HZ       LYS  18  -6.453 -16.969  -1.646
   85   2HZ   LYS  18          2HZ       LYS  18  -6.045 -16.053  -3.008
   86   3HZ   LYS  18          3HZ       LYS  18  -5.626 -15.506  -1.464
   87    H    SER  19           H        SER  19  -1.772 -15.354   2.799
   88    HA   SER  19           HA       SER  19  -3.727 -13.842   4.108
   89   1HB   SER  19          1HB       SER  19  -5.116 -15.627   4.571
   90    HG   SER  19           HG       SER  19  -3.283 -16.045   6.680
   91    HA   PRO  20           HA       PRO  20  -0.268 -14.894   7.313
   92   1HB   PRO  20          1HB       PRO  20   1.574 -16.772   6.608
   93   1HG   PRO  20          1HG       PRO  20   0.677 -17.425   4.569
   94   1HD   PRO  20          1HD       PRO  20  -1.496 -16.926   3.971
   95    H    ARG  21           H        ARG  21   2.199 -14.573   7.366
   96    HA   ARG  21           HA       ARG  21   4.002 -13.339   6.731
   97   1HB   ARG  21          1HB       ARG  21   3.258 -13.973   3.879
   98   1HG   ARG  21          1HG       ARG  21   3.181 -16.085   5.054
   99   1HD   ARG  21          1HD       ARG  21   4.665 -15.225   6.959
  100    HE   ARG  21           HE       ARG  21   6.669 -15.395   4.982
  101   1HH1  ARG  21          1HH1      ARG  21   6.087 -16.175   8.333
  102   2HH1  ARG  21          2HH1      ARG  21   7.754 -16.043   8.784
  103   1HH2  ARG  21          1HH2      ARG  21   8.863 -15.222   5.573
  104   2HH2  ARG  21          2HH2      ARG  21   9.330 -15.501   7.217
  105    H    GLU  22           H        GLU  22   1.477 -12.023   7.066
  106    HA   GLU  22           HA       GLU  22   0.562  -9.954   6.824
  107   1HB   GLU  22          1HB       GLU  22   2.991  -9.172   5.221
  108   1HG   GLU  22          1HG       GLU  22   3.902 -10.217   7.175
  109    H    VAL  23           H        VAL  23  -1.083  -9.466   5.541
  110    HA   VAL  23           HA       VAL  23  -1.480 -10.592   3.023
  111    HB   VAL  23           HB       VAL  23  -3.356  -8.990   2.774
  112   1HG1  VAL  23          1HG1      VAL  23  -4.180 -10.781   3.882
  113   2HG1  VAL  23          2HG1      VAL  23  -4.317  -9.617   5.199
  114   3HG1  VAL  23          3HG1      VAL  23  -2.940 -10.716   5.134
  115   1HG2  VAL  23          1HG2      VAL  23  -2.105  -7.784   5.224
  116   2HG2  VAL  23          2HG2      VAL  23  -3.807  -7.547   4.830
  117   3HG2  VAL  23          3HG2      VAL  23  -2.557  -6.993   3.715
  118    H    THR  24           H        THR  24  -2.201  -8.978   1.129
  119    HA   THR  24           HA       THR  24  -0.656  -6.651   0.697
  120    HB   THR  24           HB       THR  24   0.287  -8.701  -1.217
  121    HG1  THR  24           HG1      THR  24   1.718  -9.624   0.149
  122   1HG2  THR  24          1HG2      THR  24   1.485  -6.865  -1.659
  123   2HG2  THR  24          2HG2      THR  24   2.487  -7.431  -0.322
  124   3HG2  THR  24          3HG2      THR  24   1.258  -6.197  -0.043
  125    H    MET  25           H        MET  25  -0.448  -6.676  -2.071
  126    HA   MET  25           HA       MET  25  -2.667  -7.698  -3.443
  127   1HB   MET  25          1HB       MET  25  -3.976  -5.586  -3.705
  128   1HG   MET  25          1HG       MET  25  -3.604  -4.197  -1.416
  129   1HE   MET  25          1HE       MET  25  -3.913  -1.141  -2.563
  130   2HE   MET  25          2HE       MET  25  -2.150  -1.072  -2.551
  131   3HE   MET  25          3HE       MET  25  -3.003  -2.022  -1.334
  132    H    LYS  26           H        LYS  26  -1.863  -7.819  -5.425
  133    HA   LYS  26           HA       LYS  26   0.347  -6.383  -6.345
  134   1HB   LYS  26          1HB       LYS  26  -1.404  -8.411  -7.348
  135   1HG   LYS  26          1HG       LYS  26   0.984  -8.728  -7.157
  136   1HD   LYS  26          1HD       LYS  26   1.336  -6.227  -8.020
  137   1HE   LYS  26          1HE       LYS  26   1.702  -7.972 -10.446
  138   1HZ   LYS  26          1HZ       LYS  26   3.618  -6.573 -10.269
  139   2HZ   LYS  26          2HZ       LYS  26   2.669  -5.211  -9.945
  140   3HZ   LYS  26          3HZ       LYS  26   2.610  -5.938 -11.471
  141    H    LYS  27           H        LYS  27  -0.256  -5.474  -8.891
  142    HA   LYS  27           HA       LYS  27  -0.926  -3.630 -10.040
  143   1HB   LYS  27          1HB       LYS  27  -3.237  -3.573  -8.091
  144   1HG   LYS  27          1HG       LYS  27  -2.916  -5.714  -9.480
  145   1HD   LYS  27          1HD       LYS  27  -4.319  -4.361 -11.679
  146   1HE   LYS  27          1HE       LYS  27  -2.123  -6.420 -11.516
  147   1HZ   LYS  27          1HZ       LYS  27  -2.333  -6.733 -13.794
  148   2HZ   LYS  27          2HZ       LYS  27  -2.309  -5.049 -13.642
  149   3HZ   LYS  27          3HZ       LYS  27  -3.776  -5.852 -13.896
  150    H    GLY  28           H        GLY  28  -0.820  -1.343  -9.969
  151   1HA   GLY  28          1HA       GLY  28   0.453  -0.361  -7.525
  152   2HA   GLY  28          2HA       GLY  28   0.498   0.414  -9.102
  153    H    ASP  29           H        ASP  29  -2.336  -0.724  -7.308
  154    HA   ASP  29           HA       ASP  29  -3.870   1.551  -7.822
  155   1HB   ASP  29          1HB       ASP  29  -4.429  -0.870  -6.799
  156    H    ILE  30           H        ILE  30  -4.926   2.662  -5.675
  157    HA   ILE  30           HA       ILE  30  -2.643   4.005  -4.405
  158    HB   ILE  30           HB       ILE  30  -5.326   5.194  -4.081
  159   1HG1  ILE  30          1HG1      ILE  30  -5.447   4.423  -6.421
  160   1HG2  ILE  30          1HG2      ILE  30  -3.662   7.127  -4.996
  161   2HG2  ILE  30          2HG2      ILE  30  -2.511   6.008  -4.265
  162   3HG2  ILE  30          3HG2      ILE  30  -3.829   6.674  -3.300
  163   1HD1  ILE  30          1HD1      ILE  30  -3.652   6.108  -7.735
  164   2HD1  ILE  30          2HD1      ILE  30  -3.649   4.345  -7.700
  165   3HD1  ILE  30          3HD1      ILE  30  -2.708   5.253  -6.516
  166    H    LEU  31           H        LEU  31  -3.500   5.074  -2.194
  167    HA   LEU  31           HA       LEU  31  -5.045   3.184  -0.622
  168   1HB   LEU  31          1HB       LEU  31  -2.362   3.887   0.463
  169    HG   LEU  31           HG       LEU  31  -2.821   1.671  -1.521
  170   1HD1  LEU  31          1HD1      LEU  31  -1.578   2.902  -2.881
  171   2HD1  LEU  31          2HD1      LEU  31  -0.291   2.990  -1.680
  172   3HD1  LEU  31          3HD1      LEU  31  -1.579   4.194  -1.682
  173   1HD2  LEU  31          1HD2      LEU  31  -0.501   1.931   0.381
  174   2HD2  LEU  31          2HD2      LEU  31  -0.783   0.649  -0.796
  175   3HD2  LEU  31          3HD2      LEU  31  -1.844   0.809   0.603
  176    H    THR  32           H        THR  32  -4.114   4.197   1.915
  177    HA   THR  32           HA       THR  32  -4.872   7.037   1.751
  178    HB   THR  32           HB       THR  32  -6.848   5.718   2.383
  179    HG1  THR  32           HG1      THR  32  -7.172   7.484   3.460
  180   1HG2  THR  32          1HG2      THR  32  -5.522   3.886   3.527
  181   2HG2  THR  32          2HG2      THR  32  -7.008   4.418   4.318
  182   3HG2  THR  32          3HG2      THR  32  -5.442   4.966   4.919
  183    H    LEU  33           H        LEU  33  -3.706   4.531   4.015
  184    HA   LEU  33           HA       LEU  33  -2.082   4.551   5.599
  185   1HB   LEU  33          1HB       LEU  33  -1.044   6.932   4.067
  186    HG   LEU  33           HG       LEU  33   0.602   5.277   3.124
  187   1HD1  LEU  33          1HD1      LEU  33  -1.348   3.098   3.546
  188   2HD1  LEU  33          2HD1      LEU  33  -0.332   3.538   4.919
  189   3HD1  LEU  33          3HD1      LEU  33   0.408   3.043   3.397
  190   1HD2  LEU  33          1HD2      LEU  33  -2.216   4.688   2.268
  191   2HD2  LEU  33          2HD2      LEU  33  -0.753   4.725   1.286
  192   3HD2  LEU  33          3HD2      LEU  33  -1.422   6.226   1.928
  193    H    LEU  34           H        LEU  34  -1.880   5.306   7.643
  194    HA   LEU  34           HA       LEU  34  -3.671   7.318   8.528
  195   1HB   LEU  34          1HB       LEU  34  -1.662   5.533   9.775
  196    HG   LEU  34           HG       LEU  34  -4.518   6.253  10.405
  197   1HD1  LEU  34          1HD1      LEU  34  -5.047   4.103   9.752
  198   2HD1  LEU  34          2HD1      LEU  34  -3.403   3.512   9.990
  199   3HD1  LEU  34          3HD1      LEU  34  -3.779   4.537   8.606
  200   1HD2  LEU  34          1HD2      LEU  34  -2.741   4.426  12.012
  201   2HD2  LEU  34          2HD2      LEU  34  -4.419   4.858  12.345
  202   3HD2  LEU  34          3HD2      LEU  34  -3.149   6.075  12.484
  203    H    ASN  35           H        ASN  35  -0.179   7.241   9.195
  204    HA   ASN  35           HA       ASN  35   0.179   9.911   8.147
  205   1HB   ASN  35          1HB       ASN  35   0.969  10.874  10.265
  206   1HD2  ASN  35          1HD2      ASN  35  -1.256   8.553  11.599
  207   2HD2  ASN  35          2HD2      ASN  35  -0.185   7.918  12.797
  208    H    SER  36           H        SER  36   1.247   7.246   7.659
  209    HA   SER  36           HA       SER  36   3.870   7.045   8.746
  210   1HB   SER  36          1HB       SER  36   2.363   5.681   6.554
  211    HG   SER  36           HG       SER  36   2.278   4.239   8.062
  212    H    THR  37           H        THR  37   5.817   7.705   7.958
  213    HA   THR  37           HA       THR  37   6.127   8.796   5.324
  214    HB   THR  37           HB       THR  37   6.363  10.688   7.673
  215    HG1  THR  37           HG1      THR  37   4.436  10.547   5.599
  216   1HG2  THR  37          1HG2      THR  37   7.632  11.913   6.341
  217   2HG2  THR  37          2HG2      THR  37   6.220  12.132   5.310
  218   3HG2  THR  37          3HG2      THR  37   7.361  10.830   4.976
  219    H    ASN  38           H        ASN  38   7.586   6.877   5.748
  220    HA   ASN  38           HA       ASN  38  10.243   7.868   6.250
  221   1HB   ASN  38          1HB       ASN  38   8.831   6.171   8.222
  222   1HD2  ASN  38          1HD2      ASN  38  11.881   7.868   7.573
  223   2HD2  ASN  38          2HD2      ASN  38  11.828   8.853   8.992
  224    H    LYS  39           H        LYS  39  11.738   5.679   6.290
  225    HA   LYS  39           HA       LYS  39  11.476   4.642   3.661
  226   1HB   LYS  39          1HB       LYS  39  13.473   3.363   4.156
  227   1HG   LYS  39          1HG       LYS  39  12.871   4.030   7.017
  228   1HD   LYS  39          1HD       LYS  39  15.425   2.711   6.355
  229   1HE   LYS  39          1HE       LYS  39  14.240   4.374   8.476
  230   1HZ   LYS  39          1HZ       LYS  39  16.236   5.648   7.563
  231   2HZ   LYS  39          2HZ       LYS  39  17.180   4.396   8.197
  232   3HZ   LYS  39          3HZ       LYS  39  16.206   5.322   9.223
  233    H    ASP  40           H        ASP  40  12.105   2.022   3.716
  234    HA   ASP  40           HA       ASP  40  11.052   0.007   3.605
  235   1HB   ASP  40          1HB       ASP  40  10.559  -1.004   5.766
  236    H    TRP  41           H        TRP  41   8.932  -1.208   4.612
  237    HA   TRP  41           HA       TRP  41   6.763   0.041   3.279
  238   1HB   TRP  41          1HB       TRP  41   5.712  -1.968   3.469
  239    HD1  TRP  41           HD1      TRP  41   4.083  -3.231   4.963
  240    HE1  TRP  41           HE1      TRP  41   3.945  -3.826   7.463
  241    HE3  TRP  41           HE3      TRP  41   8.593  -1.368   6.498
  242    HZ2  TRP  41           HZ2      TRP  41   5.533  -3.545   9.777
  243    HZ3  TRP  41           HZ3      TRP  41   9.206  -1.572   8.871
  244    HH2  TRP  41           HH2      TRP  41   7.706  -2.637  10.477
  245    H    TRP  42           H        TRP  42   4.523  -0.327   4.739
  246    HA   TRP  42           HA       TRP  42   4.676   0.748   7.373
  247   1HB   TRP  42          1HB       TRP  42   4.208   2.591   5.076
  248    HD1  TRP  42           HD1      TRP  42   6.054   4.364   5.114
  249    HE1  TRP  42           HE1      TRP  42   7.784   5.186   6.834
  250    HE3  TRP  42           HE3      TRP  42   4.533   1.634   9.160
  251    HZ2  TRP  42           HZ2      TRP  42   8.419   4.735   9.548
  252    HZ3  TRP  42           HZ3      TRP  42   5.757   1.887  11.280
  253    HH2  TRP  42           HH2      TRP  42   7.659   3.405  11.468
  254    H    LYS  43           H        LYS  43   2.607   0.932   8.385
  255    HA   LYS  43           HA       LYS  43   0.755  -1.020   7.557
  256   1HB   LYS  43          1HB       LYS  43   1.213  -0.029   9.915
  257   1HG   LYS  43          1HG       LYS  43  -1.366  -0.982   8.826
  258   1HD   LYS  43          1HD       LYS  43  -1.080   0.587  11.332
  259   1HE   LYS  43          1HE       LYS  43  -2.990  -0.641  12.318
  260   1HZ   LYS  43          1HZ       LYS  43  -0.996  -2.731  12.037
  261   2HZ   LYS  43          2HZ       LYS  43  -1.640  -2.028  13.434
  262   3HZ   LYS  43          3HZ       LYS  43  -0.414  -1.237  12.578
  263    H    VAL  44           H        VAL  44  -0.557  -0.875   5.863
  264    HA   VAL  44           HA       VAL  44  -1.619   1.757   5.109
  265    HB   VAL  44           HB       VAL  44  -2.082   0.847   2.925
  266   1HG1  VAL  44          1HG1      VAL  44   0.472   1.147   4.002
  267   2HG1  VAL  44          2HG1      VAL  44   0.023   1.183   2.297
  268   3HG1  VAL  44          3HG1      VAL  44   0.550  -0.327   3.038
  269   1HG2  VAL  44          1HG2      VAL  44  -2.742  -1.418   3.663
  270   2HG2  VAL  44          2HG2      VAL  44  -1.042  -1.798   3.937
  271   3HG2  VAL  44          3HG2      VAL  44  -1.615  -1.442   2.308
  272    H    GLU  45           H        GLU  45  -3.850   1.226   3.759
  273    HA   GLU  45           HA       GLU  45  -5.608  -0.665   4.859
  274   1HB   GLU  45          1HB       GLU  45  -7.020   0.779   6.252
  275   1HG   GLU  45          1HG       GLU  45  -4.991   2.842   5.554
  276    H    VAL  46           H        VAL  46  -6.252  -0.889   2.741
  277    HA   VAL  46           HA       VAL  46  -7.925   1.296   1.707
  278    HB   VAL  46           HB       VAL  46  -5.818   1.284   0.448
  279   1HG1  VAL  46          1HG1      VAL  46  -6.519  -1.429  -0.616
  280   2HG1  VAL  46          2HG1      VAL  46  -5.506  -1.240   0.816
  281   3HG1  VAL  46          3HG1      VAL  46  -4.992  -0.553  -0.725
  282   1HG2  VAL  46          1HG2      VAL  46  -8.260   0.348  -1.047
  283   2HG2  VAL  46          2HG2      VAL  46  -6.813   0.980  -1.833
  284   3HG2  VAL  46          3HG2      VAL  46  -7.749   2.009  -0.747
  285    H    ASN  47           H        ASN  47  -7.146  -2.163   1.512
  286    HA   ASN  47           HA       ASN  47  -9.917  -2.682   0.671
  287   1HB   ASN  47          1HB       ASN  47  -9.116  -4.843  -0.147
  288   1HD2  ASN  47          1HD2      ASN  47  -8.062  -6.445   0.795
  289   2HD2  ASN  47          2HD2      ASN  47  -6.388  -6.434   1.221
  290    H    ASP  48           H        ASP  48 -10.282  -5.252   1.385
  291    HA   ASP  48           HA       ASP  48 -11.005  -5.117   4.072
  292   1HB   ASP  48          1HB       ASP  48 -10.586  -7.503   2.264
  293    H    ARG  49           H        ARG  49  -8.670  -7.522   2.886
  294    HA   ARG  49           HA       ARG  49  -7.368  -7.581   5.456
  295   1HB   ARG  49          1HB       ARG  49  -7.336  -9.190   2.994
  296   1HG   ARG  49          1HG       ARG  49  -8.360  -9.963   5.103
  297   1HD   ARG  49          1HD       ARG  49  -5.745 -10.654   6.258
  298    HE   ARG  49           HE       ARG  49  -7.803  -9.464   7.878
  299   1HH1  ARG  49          1HH1      ARG  49  -6.687 -12.404   6.364
  300   2HH1  ARG  49          2HH1      ARG  49  -7.536 -13.438   7.462
  301   1HH2  ARG  49          1HH2      ARG  49  -8.920 -10.824   9.323
  302   2HH2  ARG  49          2HH2      ARG  49  -8.804 -12.542   9.141
  303    H    GLN  50           H        GLN  50  -6.042  -5.966   5.978
  304    HA   GLN  50           HA       GLN  50  -3.730  -5.442   4.347
  305   1HB   GLN  50          1HB       GLN  50  -4.220  -2.904   4.450
  306   1HG   GLN  50          1HG       GLN  50  -6.550  -2.282   4.225
  307   1HE2  GLN  50          1HE2      GLN  50  -4.622  -1.876   6.094
  308   2HE2  GLN  50          2HE2      GLN  50  -5.300  -1.977   7.678
  309    H    GLY  51           H        GLY  51  -2.563  -3.374   5.454
  310   1HA   GLY  51          1HA       GLY  51  -2.497  -2.363   7.797
  311   2HA   GLY  51          2HA       GLY  51  -2.503  -4.036   8.329
  312    H    PHE  52           H        PHE  52  -0.779  -4.241   5.616
  313    HA   PHE  52           HA       PHE  52   1.744  -3.336   6.800
  314   1HB   PHE  52          1HB       PHE  52   1.209  -6.115   5.730
  315    HD1  PHE  52           HD1      PHE  52   3.627  -5.600   8.306
  316    HD2  PHE  52           HD2      PHE  52  -0.517  -6.241   7.578
  317    HE1  PHE  52           HE1      PHE  52   3.332  -6.321  10.640
  318    HE2  PHE  52           HE2      PHE  52  -0.820  -6.963   9.910
  319    HZ   PHE  52           HZ       PHE  52   1.106  -7.003  11.445
  320    H    VAL  53           H        VAL  53   1.125  -5.361   3.953
  321    HA   VAL  53           HA       VAL  53   1.729  -5.098   1.770
  322    HB   VAL  53           HB       VAL  53   0.845  -2.246   2.207
  323   1HG1  VAL  53          1HG1      VAL  53   1.391  -3.924  -0.180
  324   2HG1  VAL  53          2HG1      VAL  53   1.658  -2.200   0.080
  325   3HG1  VAL  53          3HG1      VAL  53   0.034  -2.799  -0.255
  326   1HG2  VAL  53          1HG2      VAL  53  -0.928  -3.552   3.027
  327   2HG2  VAL  53          2HG2      VAL  53  -0.731  -4.764   1.760
  328   3HG2  VAL  53          3HG2      VAL  53  -1.374  -3.171   1.363
  329    HA   PRO  54           HA       PRO  54   6.036  -3.756   2.600
  330   1HB   PRO  54          1HB       PRO  54   6.156  -4.957  -0.135
  331   1HG   PRO  54          1HG       PRO  54   5.511  -7.063   0.620
  332   1HD   PRO  54          1HD       PRO  54   3.463  -6.022   0.677
  333    H    ALA  55           H        ALA  55   4.786  -3.597  -0.743
  334    HA   ALA  55           HA       ALA  55   4.705  -1.910  -2.266
  335   1HB   ALA  55          1HB       ALA  55   4.276   0.323  -1.506
  336   2HB   ALA  55          2HB       ALA  55   4.918  -0.049   0.095
  337   3HB   ALA  55          3HB       ALA  55   3.418  -0.799  -0.451
  338    H    ALA  56           H        ALA  56   7.343  -2.908  -0.991
  339    HA   ALA  56           HA       ALA  56   9.573  -2.541  -1.210
  340   1HB   ALA  56          1HB       ALA  56   9.586  -2.656  -3.465
  341   2HB   ALA  56          2HB       ALA  56  10.017  -0.952  -3.330
  342   3HB   ALA  56          3HB       ALA  56   8.346  -1.415  -3.645
  343    H    TYR  57           H        TYR  57   8.871   0.630  -2.570
  344    HA   TYR  57           HA       TYR  57   9.912   1.854  -0.103
  345   1HB   TYR  57          1HB       TYR  57  11.126   3.477  -1.423
  346    HD1  TYR  57           HD1      TYR  57  10.460   0.913  -4.035
  347    HD2  TYR  57           HD2      TYR  57  10.356   5.035  -2.985
  348    HE1  TYR  57           HE1      TYR  57   9.911   1.486  -6.363
  349    HE2  TYR  57           HE2      TYR  57   9.806   5.619  -5.309
  350    HH   TYR  57           HH       TYR  57   8.872   4.622  -7.288
  351    H    VAL  58           H        VAL  58   7.560   1.924  -2.632
  352    HA   VAL  58           HA       VAL  58   5.754   3.212  -3.077
  353    HB   VAL  58           HB       VAL  58   5.202   2.354  -0.780
  354   1HG1  VAL  58          1HG1      VAL  58   5.073   4.310   0.937
  355   2HG1  VAL  58          2HG1      VAL  58   6.405   4.975  -0.009
  356   3HG1  VAL  58          3HG1      VAL  58   6.568   3.393   0.752
  357   1HG2  VAL  58          1HG2      VAL  58   3.201   3.492  -0.718
  358   2HG2  VAL  58          2HG2      VAL  58   3.737   3.801  -2.369
  359   3HG2  VAL  58          3HG2      VAL  58   3.943   5.038  -1.129
  360    H    LYS  59           H        LYS  59   4.819   5.422  -3.087
  361    HA   LYS  59           HA       LYS  59   6.873   7.328  -3.629
  362   1HB   LYS  59          1HB       LYS  59   3.988   8.097  -3.391
  363   1HG   LYS  59          1HG       LYS  59   3.746   6.061  -4.596
  364   1HD   LYS  59          1HD       LYS  59   6.188   5.842  -5.174
  365   1HE   LYS  59          1HE       LYS  59   5.412   8.031  -6.985
  366   1HZ   LYS  59          1HZ       LYS  59   7.530   6.340  -8.030
  367   2HZ   LYS  59          2HZ       LYS  59   6.410   7.306  -8.851
  368   3HZ   LYS  59          3HZ       LYS  59   5.952   5.783  -8.277
  369    H    LYS  60           H        LYS  60   4.306   7.118  -1.177
  370    HA   LYS  60           HA       LYS  60   4.076   8.074   0.872
  371   1HB   LYS  60          1HB       LYS  60   6.618   7.172   0.811
  372   1HG   LYS  60          1HG       LYS  60   6.812   8.138   3.219
  373   1HD   LYS  60          1HD       LYS  60   5.082   6.053   2.085
  374   1HE   LYS  60          1HE       LYS  60   4.768   6.449   5.006
  375   1HZ   LYS  60          1HZ       LYS  60   3.222   5.236   2.808
  376   2HZ   LYS  60          2HZ       LYS  60   2.471   5.606   4.278
  377   3HZ   LYS  60          3HZ       LYS  60   3.771   4.524   4.242
  378    H    LEU  61           H        LEU  61   2.904   9.885   0.684
  379    HA   LEU  61           HA       LEU  61   4.271  12.422   0.650
  380   1HB   LEU  61          1HB       LEU  61   3.659  11.516  -1.799
  381    HG   LEU  61           HG       LEU  61   3.438  13.850  -2.616
  382   1HD1  LEU  61          1HD1      LEU  61   3.055  15.639  -1.279
  383   2HD1  LEU  61          2HD1      LEU  61   3.853  14.912   0.115
  384   3HD1  LEU  61          3HD1      LEU  61   2.215  14.422  -0.319
  385   1HD2  LEU  61          1HD2      LEU  61   5.583  13.634  -0.518
  386   2HD2  LEU  61          2HD2      LEU  61   5.637  14.517  -2.044
  387   3HD2  LEU  61          3HD2      LEU  61   5.634  12.753  -2.044
  388    H    ASP  62           H        ASP  62   3.173  13.933   1.779
  389    HA   ASP  62           HA       ASP  62   0.723  13.115   3.075
  390   1HB   ASP  62          1HB       ASP  62   2.532  15.510   3.363
  Start of MODEL    7
    1    H    GLU   7           H        GLU   7  -5.696  11.483  -5.038
    2    HA   GLU   7           HA       GLU   7  -4.262   8.932  -5.292
    3   1HB   GLU   7          1HB       GLU   7  -2.232  10.226  -5.449
    4   1HG   GLU   7          1HG       GLU   7  -3.885  12.388  -4.369
    5    H    LEU   8           H        LEU   8  -2.775   8.286  -3.656
    6    HA   LEU   8           HA       LEU   8  -2.302   9.535  -1.233
    7   1HB   LEU   8          1HB       LEU   8  -3.851   8.120   0.227
    8    HG   LEU   8           HG       LEU   8  -5.047   7.569  -2.422
    9   1HD1  LEU   8          1HD1      LEU   8  -6.017   5.696  -0.875
   10   2HD1  LEU   8          2HD1      LEU   8  -4.745   6.234   0.224
   11   3HD1  LEU   8          3HD1      LEU   8  -4.330   5.652  -1.388
   12   1HD2  LEU   8          1HD2      LEU   8  -7.318   7.529  -1.551
   13   2HD2  LEU   8          2HD2      LEU   8  -6.655   9.163  -1.483
   14   3HD2  LEU   8          3HD2      LEU   8  -6.756   8.189  -0.015
   15    H    VAL   9           H        VAL   9  -0.537   8.264  -2.530
   16    HA   VAL   9           HA       VAL   9   1.102   6.687  -2.343
   17    HB   VAL   9           HB       VAL   9  -0.477   5.389  -0.127
   18   1HG1  VAL   9          1HG1      VAL   9   2.365   5.301  -1.056
   19   2HG1  VAL   9          2HG1      VAL   9   1.274   3.972  -0.664
   20   3HG1  VAL   9          3HG1      VAL   9   1.967   4.955   0.626
   21   1HG2  VAL   9          1HG2      VAL   9  -0.341   7.459   0.810
   22   2HG2  VAL   9          2HG2      VAL   9   1.070   7.921  -0.143
   23   3HG2  VAL   9          3HG2      VAL   9   1.256   6.853   1.250
   24    H    LEU  10           H        LEU  10   1.508   4.390  -2.774
   25    HA   LEU  10           HA       LEU  10  -0.802   2.828  -3.624
   26   1HB   LEU  10          1HB       LEU  10   1.198   2.571  -5.660
   27    HG   LEU  10           HG       LEU  10   0.392   5.397  -5.090
   28   1HD1  LEU  10          1HD1      LEU  10   2.634   4.839  -4.533
   29   2HD1  LEU  10          2HD1      LEU  10   2.684   5.774  -6.028
   30   3HD1  LEU  10          3HD1      LEU  10   2.879   4.021  -6.076
   31   1HD2  LEU  10          1HD2      LEU  10   0.433   4.036  -7.727
   32   2HD2  LEU  10          2HD2      LEU  10   1.145   5.647  -7.620
   33   3HD2  LEU  10          3HD2      LEU  10  -0.541   5.396  -7.167
   34    H    ALA  11           H        ALA  11   0.605   0.819  -4.964
   35    HA   ALA  11           HA       ALA  11   2.613  -0.100  -3.034
   36   1HB   ALA  11          1HB       ALA  11   0.754  -1.203  -2.170
   37   2HB   ALA  11          2HB       ALA  11   1.483  -2.406  -3.233
   38   3HB   ALA  11          3HB       ALA  11   0.067  -1.501  -3.767
   39    H    LEU  12           H        LEU  12   2.326   0.787  -6.007
   40    HA   LEU  12           HA       LEU  12   3.414   0.341  -7.953
   41   1HB   LEU  12          1HB       LEU  12   4.818  -1.851  -6.422
   42    HG   LEU  12           HG       LEU  12   6.737  -0.104  -6.426
   43   1HD1  LEU  12          1HD1      LEU  12   4.507   1.865  -6.159
   44   2HD1  LEU  12          2HD1      LEU  12   5.197   1.511  -7.743
   45   3HD1  LEU  12          3HD1      LEU  12   6.223   2.146  -6.457
   46   1HD2  LEU  12          1HD2      LEU  12   4.793   0.711  -4.388
   47   2HD2  LEU  12          2HD2      LEU  12   6.412   0.036  -4.211
   48   3HD2  LEU  12          3HD2      LEU  12   5.044  -1.030  -4.519
   49    H    TYR  13           H        TYR  13   3.100  -2.874  -6.455
   50    HA   TYR  13           HA       TYR  13   1.041  -3.646  -8.319
   51   1HB   TYR  13          1HB       TYR  13   2.292  -5.557  -9.245
   52    HD1  TYR  13           HD1      TYR  13   3.645  -7.253  -8.448
   53    HD2  TYR  13           HD2      TYR  13   4.943  -3.222  -8.030
   54    HE1  TYR  13           HE1      TYR  13   5.787  -8.043  -7.538
   55    HE2  TYR  13           HE2      TYR  13   7.089  -4.002  -7.117
   56    HH   TYR  13           HH       TYR  13   7.645  -6.792  -5.852
   57    H    ASP  14           H        ASP  14   0.460  -6.029  -7.941
   58    HA   ASP  14           HA       ASP  14  -0.351  -6.458  -5.366
   59   1HB   ASP  14          1HB       ASP  14  -0.671  -8.810  -5.965
   60    H    TYR  15           H        TYR  15   0.327  -8.049  -3.747
   61    HA   TYR  15           HA       TYR  15   3.265  -8.248  -3.597
   62   1HB   TYR  15          1HB       TYR  15   2.156  -6.730  -1.921
   63    HD1  TYR  15           HD1      TYR  15   4.858  -7.732  -2.463
   64    HD2  TYR  15           HD2      TYR  15   2.295  -8.456   0.855
   65    HE1  TYR  15           HE1      TYR  15   6.822  -8.165  -1.048
   66    HE2  TYR  15           HE2      TYR  15   4.252  -8.890   2.279
   67    HH   TYR  15           HH       TYR  15   7.084  -7.967   1.845
   68    H    GLN  16           H        GLN  16   0.214  -9.894  -3.021
   69    HA   GLN  16           HA       GLN  16  -0.322 -12.091  -2.842
   70   1HB   GLN  16          1HB       GLN  16   0.720 -13.413  -4.325
   71   1HG   GLN  16          1HG       GLN  16   3.245 -12.886  -2.807
   72   1HE2  GLN  16          1HE2      GLN  16   4.117 -15.536  -3.725
   73   2HE2  GLN  16          2HE2      GLN  16   4.797 -15.286  -5.293
   74    H    GLU  17           H        GLU  17  -0.307 -13.685  -1.287
   75    HA   GLU  17           HA       GLU  17   0.846 -13.081   1.188
   76   1HB   GLU  17          1HB       GLU  17   0.098 -15.334   1.875
   77   1HG   GLU  17          1HG       GLU  17  -0.266 -15.703  -1.065
   78    H    LYS  18           H        LYS  18   2.943 -13.098   1.650
   79    HA   LYS  18           HA       LYS  18   4.514 -15.467   0.957
   80   1HB   LYS  18          1HB       LYS  18   5.044 -12.676   0.077
   81   1HG   LYS  18          1HG       LYS  18   6.178 -15.144  -1.155
   82   1HD   LYS  18          1HD       LYS  18   5.798 -13.852  -3.215
   83   1HE   LYS  18          1HE       LYS  18   7.245 -11.758  -2.304
   84   1HZ   LYS  18          1HZ       LYS  18   8.999 -12.858  -3.168
   85   2HZ   LYS  18          2HZ       LYS  18   7.795 -13.903  -3.732
   86   3HZ   LYS  18          3HZ       LYS  18   8.671 -14.296  -2.340
   87    H    SER  19           H        SER  19   5.477 -12.325   2.292
   88    HA   SER  19           HA       SER  19   6.806 -13.583   4.492
   89   1HB   SER  19          1HB       SER  19   6.680 -10.885   5.110
   90    HG   SER  19           HG       SER  19   6.664  -9.762   3.287
   91    HA   PRO  20           HA       PRO  20   3.388 -11.527   7.193
   92   1HB   PRO  20          1HB       PRO  20   1.283 -10.355   5.946
   93   1HG   PRO  20          1HG       PRO  20   1.918 -10.684   3.736
   94   1HD   PRO  20          1HD       PRO  20   4.076 -11.251   3.160
   95    H    ARG  21           H        ARG  21   1.042 -12.049   7.718
   96    HA   ARG  21           HA       ARG  21   0.540 -14.754   7.193
   97   1HB   ARG  21          1HB       ARG  21  -1.256 -12.582   8.279
   98   1HG   ARG  21          1HG       ARG  21   0.677 -14.445   9.478
   99   1HD   ARG  21          1HD       ARG  21  -1.508 -13.770  11.308
  100    HE   ARG  21           HE       ARG  21  -0.706 -16.470  11.271
  101   1HH1  ARG  21          1HH1      ARG  21   0.547 -13.285  11.958
  102   2HH1  ARG  21          2HH1      ARG  21   1.722 -13.857  13.095
  103   1HH2  ARG  21          1HH2      ARG  21   0.836 -17.222  12.768
  104   2HH2  ARG  21          2HH2      ARG  21   1.887 -16.092  13.554
  105    H    GLU  22           H        GLU  22  -1.197 -11.872   6.013
  106    HA   GLU  22           HA       GLU  22  -1.685 -13.146   3.474
  107   1HB   GLU  22          1HB       GLU  22  -3.936 -12.619   5.411
  108   1HG   GLU  22          1HG       GLU  22  -3.121 -14.868   5.535
  109    H    VAL  23           H        VAL  23  -2.060 -11.690   1.860
  110    HA   VAL  23           HA       VAL  23  -2.831  -8.964   2.468
  111    HB   VAL  23           HB       VAL  23  -0.175  -9.473   1.121
  112   1HG1  VAL  23          1HG1      VAL  23  -1.144  -6.851   2.190
  113   2HG1  VAL  23          2HG1      VAL  23  -1.631  -7.401   0.586
  114   3HG1  VAL  23          3HG1      VAL  23   0.077  -7.173   0.959
  115   1HG2  VAL  23          1HG2      VAL  23   0.042 -10.046   3.448
  116   2HG2  VAL  23          2HG2      VAL  23  -0.772  -8.557   3.931
  117   3HG2  VAL  23          3HG2      VAL  23   0.816  -8.486   3.169
  118    H    THR  24           H        THR  24  -1.507 -11.132  -0.021
  119    HA   THR  24           HA       THR  24  -2.103 -11.532  -2.176
  120    HB   THR  24           HB       THR  24  -4.698 -10.246  -1.301
  121    HG1  THR  24           HG1      THR  24  -3.772 -12.912  -1.385
  122   1HG2  THR  24          1HG2      THR  24  -3.885 -11.408  -3.879
  123   2HG2  THR  24          2HG2      THR  24  -5.145 -10.231  -3.503
  124   3HG2  THR  24          3HG2      THR  24  -5.434 -11.950  -3.232
  125    H    MET  25           H        MET  25  -3.983  -8.543  -1.836
  126    HA   MET  25           HA       MET  25  -3.847  -6.529  -2.881
  127   1HB   MET  25          1HB       MET  25  -1.019  -7.317  -2.489
  128   1HG   MET  25          1HG       MET  25  -2.860  -5.322  -1.492
  129   1HE   MET  25          1HE       MET  25  -1.875  -2.370  -3.573
  130   2HE   MET  25          2HE       MET  25  -2.928  -3.775  -3.414
  131   3HE   MET  25          3HE       MET  25  -1.462  -3.878  -4.387
  132    H    LYS  26           H        LYS  26  -3.858  -5.595  -4.958
  133    HA   LYS  26           HA       LYS  26  -3.031  -7.302  -7.188
  134   1HB   LYS  26          1HB       LYS  26  -5.809  -6.503  -6.505
  135   1HG   LYS  26          1HG       LYS  26  -5.194  -8.847  -6.392
  136   1HD   LYS  26          1HD       LYS  26  -4.995  -9.463  -9.169
  137   1HE   LYS  26          1HE       LYS  26  -2.567 -10.066  -8.133
  138   1HZ   LYS  26          1HZ       LYS  26  -3.351 -12.184  -8.002
  139   2HZ   LYS  26          2HZ       LYS  26  -4.588 -11.498  -8.930
  140   3HZ   LYS  26          3HZ       LYS  26  -4.811 -11.737  -7.270
  141    H    LYS  27           H        LYS  27  -1.546  -5.997  -8.085
  142    HA   LYS  27           HA       LYS  27  -0.629  -4.231  -9.185
  143   1HB   LYS  27          1HB       LYS  27  -3.419  -3.143  -9.523
  144   1HG   LYS  27          1HG       LYS  27  -2.092  -5.300 -11.152
  145   1HD   LYS  27          1HD       LYS  27  -4.609  -5.031 -12.130
  146   1HE   LYS  27          1HE       LYS  27  -3.314  -3.444 -13.852
  147   1HZ   LYS  27          1HZ       LYS  27  -3.140  -6.343 -13.407
  148   2HZ   LYS  27          2HZ       LYS  27  -2.216  -5.639 -14.637
  149   3HZ   LYS  27          3HZ       LYS  27  -3.901  -5.494 -14.657
  150    H    GLY  28           H        GLY  28   0.009  -2.041  -8.895
  151   1HA   GLY  28          1HA       GLY  28  -0.100  -1.133  -6.231
  152   2HA   GLY  28          2HA       GLY  28   0.504  -0.209  -7.599
  153    H    ASP  29           H        ASP  29  -1.007   1.034  -8.847
  154    HA   ASP  29           HA       ASP  29  -2.612   2.640  -8.978
  155   1HB   ASP  29          1HB       ASP  29  -4.165   0.284  -7.921
  156    H    ILE  30           H        ILE  30  -4.200   1.280  -6.147
  157    HA   ILE  30           HA       ILE  30  -3.100   3.351  -4.421
  158    HB   ILE  30           HB       ILE  30  -6.032   3.189  -4.208
  159   1HG1  ILE  30          1HG1      ILE  30  -5.587   3.231  -6.723
  160   1HG2  ILE  30          1HG2      ILE  30  -3.856   5.040  -3.660
  161   2HG2  ILE  30          2HG2      ILE  30  -5.425   4.865  -2.875
  162   3HG2  ILE  30          3HG2      ILE  30  -5.278   5.829  -4.344
  163   1HD1  ILE  30          1HD1      ILE  30  -3.848   5.330  -6.061
  164   2HD1  ILE  30          2HD1      ILE  30  -5.227   6.054  -6.890
  165   3HD1  ILE  30          3HD1      ILE  30  -4.311   4.763  -7.666
  166    H    LEU  31           H        LEU  31  -4.638   3.140  -2.241
  167    HA   LEU  31           HA       LEU  31  -5.361   0.465  -1.583
  168   1HB   LEU  31          1HB       LEU  31  -3.452   0.714   0.368
  169    HG   LEU  31           HG       LEU  31  -2.076   1.435  -2.223
  170   1HD1  LEU  31          1HD1      LEU  31  -1.682   3.549  -1.455
  171   2HD1  LEU  31          2HD1      LEU  31  -1.869   3.093   0.236
  172   3HD1  LEU  31          3HD1      LEU  31  -3.290   3.274  -0.791
  173   1HD2  LEU  31          1HD2      LEU  31  -0.371   0.332  -1.311
  174   2HD2  LEU  31          2HD2      LEU  31  -1.203   0.163   0.233
  175   3HD2  LEU  31          3HD2      LEU  31  -0.289   1.629  -0.120
  176    H    THR  32           H        THR  32  -3.841   2.410   0.894
  177    HA   THR  32           HA       THR  32  -6.077   4.007   1.545
  178    HB   THR  32           HB       THR  32  -5.722   1.441   3.092
  179    HG1  THR  32           HG1      THR  32  -7.903   1.211   2.624
  180   1HG2  THR  32          1HG2      THR  32  -6.171   2.585   4.953
  181   2HG2  THR  32          2HG2      THR  32  -7.806   2.704   4.303
  182   3HG2  THR  32          3HG2      THR  32  -6.665   4.027   4.065
  183    H    LEU  33           H        LEU  33  -4.358   2.422   4.140
  184    HA   LEU  33           HA       LEU  33  -1.995   3.659   4.415
  185   1HB   LEU  33          1HB       LEU  33  -4.174   5.607   4.774
  186    HG   LEU  33           HG       LEU  33  -1.939   5.653   3.274
  187   1HD1  LEU  33          1HD1      LEU  33  -2.235   8.242   3.452
  188   2HD1  LEU  33          2HD1      LEU  33  -3.625   7.813   4.451
  189   3HD1  LEU  33          3HD1      LEU  33  -3.526   7.242   2.784
  190   1HD2  LEU  33          1HD2      LEU  33  -0.374   5.703   5.075
  191   2HD2  LEU  33          2HD2      LEU  33  -1.241   7.022   5.863
  192   3HD2  LEU  33          3HD2      LEU  33  -0.399   7.306   4.340
  193    H    LEU  34           H        LEU  34  -4.852   3.965   6.528
  194    HA   LEU  34           HA       LEU  34  -5.343   3.091   8.569
  195   1HB   LEU  34          1HB       LEU  34  -3.900   1.007   7.182
  196    HG   LEU  34           HG       LEU  34  -5.946   0.734   9.386
  197   1HD1  LEU  34          1HD1      LEU  34  -7.098   1.983   7.825
  198   2HD1  LEU  34          2HD1      LEU  34  -7.442   0.335   7.301
  199   3HD1  LEU  34          3HD1      LEU  34  -6.218   1.288   6.463
  200   1HD2  LEU  34          1HD2      LEU  34  -6.393  -1.419   8.110
  201   2HD2  LEU  34          2HD2      LEU  34  -4.910  -1.351   9.062
  202   3HD2  LEU  34          3HD2      LEU  34  -4.845  -1.140   7.313
  203    H    ASN  35           H        ASN  35  -3.883   1.975  10.577
  204    HA   ASN  35           HA       ASN  35  -2.574   4.153  11.714
  205   1HB   ASN  35          1HB       ASN  35  -2.624   1.220  12.351
  206   1HD2  ASN  35          1HD2      ASN  35  -2.461   2.853  15.111
  207   2HD2  ASN  35          2HD2      ASN  35  -4.134   3.180  15.393
  208    H    SER  36           H        SER  36  -0.612   4.994  11.469
  209    HA   SER  36           HA       SER  36   1.699   3.389  10.907
  210   1HB   SER  36          1HB       SER  36   0.443   5.056   8.750
  211    HG   SER  36           HG       SER  36   1.781   2.557   8.840
  212    H    THR  37           H        THR  37   0.319   6.658  10.909
  213    HA   THR  37           HA       THR  37   1.080   8.647  11.712
  214    HB   THR  37           HB       THR  37   2.094   8.637  13.848
  215    HG1  THR  37           HG1      THR  37   3.732   7.405  14.193
  216   1HG2  THR  37          1HG2      THR  37  -0.016   6.874  13.356
  217   2HG2  THR  37          2HG2      THR  37   0.448   7.603  14.893
  218   3HG2  THR  37          3HG2      THR  37   1.087   6.024  14.437
  219    H    ASN  38           H        ASN  38   2.511   7.420   9.499
  220    HA   ASN  38           HA       ASN  38   4.640   9.225   9.256
  221   1HB   ASN  38          1HB       ASN  38   5.304   6.627  10.471
  222   1HD2  ASN  38          1HD2      ASN  38   6.090   7.223  12.342
  223   2HD2  ASN  38          2HD2      ASN  38   7.063   8.616  12.647
  224    H    LYS  39           H        LYS  39   6.268   8.171   7.432
  225    HA   LYS  39           HA       LYS  39   4.447   7.188   5.334
  226   1HB   LYS  39          1HB       LYS  39   5.408   9.521   5.077
  227   1HG   LYS  39          1HG       LYS  39   4.893   7.673   3.145
  228   1HD   LYS  39          1HD       LYS  39   7.272   7.097   2.943
  229   1HE   LYS  39          1HE       LYS  39   8.419   9.215   1.629
  230   1HZ   LYS  39          1HZ       LYS  39   8.703   7.991   4.245
  231   2HZ   LYS  39          2HZ       LYS  39   9.404   9.521   4.078
  232   3HZ   LYS  39          3HZ       LYS  39   9.863   8.264   3.044
  233    H    ASP  40           H        ASP  40   4.865   4.999   5.831
  234    HA   ASP  40           HA       ASP  40   6.935   3.813   4.361
  235   1HB   ASP  40          1HB       ASP  40   8.345   4.669   6.213
  236    H    TRP  41           H        TRP  41   4.450   3.212   4.129
  237    HA   TRP  41           HA       TRP  41   2.756   1.704   4.377
  238   1HB   TRP  41          1HB       TRP  41   3.929  -0.735   4.699
  239    HD1  TRP  41           HD1      TRP  41   6.034   1.778   2.608
  240    HE1  TRP  41           HE1      TRP  41   8.511   1.119   2.852
  241    HE3  TRP  41           HE3      TRP  41   5.517  -2.150   5.843
  242    HZ2  TRP  41           HZ2      TRP  41  10.041  -0.811   4.231
  243    HZ3  TRP  41           HZ3      TRP  41   7.537  -3.349   6.574
  244    HH2  TRP  41           HH2      TRP  41   9.752  -2.693   5.782
  245    H    TRP  42           H        TRP  42   4.859  -0.227   6.440
  246    HA   TRP  42           HA       TRP  42   4.708  -0.874   8.612
  247   1HB   TRP  42          1HB       TRP  42   3.760   1.871   8.629
  248    HD1  TRP  42           HD1      TRP  42   5.030  -0.749  11.215
  249    HE1  TRP  42           HE1      TRP  42   7.154   0.203  12.311
  250    HE3  TRP  42           HE3      TRP  42   5.292   3.715   8.736
  251    HZ2  TRP  42           HZ2      TRP  42   8.732   2.538  12.149
  252    HZ3  TRP  42           HZ3      TRP  42   7.140   5.250   9.266
  253    HH2  TRP  42           HH2      TRP  42   8.823   4.673  10.938
  254    H    LYS  43           H        LYS  43   1.493   0.605   8.191
  255    HA   LYS  43           HA       LYS  43   0.303  -2.071   8.265
  256   1HB   LYS  43          1HB       LYS  43   0.394  -0.619  10.537
  257   1HG   LYS  43          1HG       LYS  43  -2.104  -2.133   9.849
  258   1HD   LYS  43          1HD       LYS  43  -1.404  -2.932  12.297
  259   1HE   LYS  43          1HE       LYS  43  -2.969  -0.529  11.434
  260   1HZ   LYS  43          1HZ       LYS  43  -1.993  -0.387  13.814
  261   2HZ   LYS  43          2HZ       LYS  43  -3.161  -1.553  14.182
  262   3HZ   LYS  43          3HZ       LYS  43  -3.632  -0.051  13.563
  263    H    VAL  44           H        VAL  44   0.354  -1.114   5.927
  264    HA   VAL  44           HA       VAL  44  -2.007   0.561   5.451
  265    HB   VAL  44           HB       VAL  44  -0.179   1.451   4.271
  266   1HG1  VAL  44          1HG1      VAL  44   0.470  -1.382   3.508
  267   2HG1  VAL  44          2HG1      VAL  44   1.446  -0.249   4.441
  268   3HG1  VAL  44          3HG1      VAL  44   1.201   0.013   2.715
  269   1HG2  VAL  44          1HG2      VAL  44  -2.217   1.243   2.903
  270   2HG2  VAL  44          2HG2      VAL  44  -1.620  -0.291   2.271
  271   3HG2  VAL  44          3HG2      VAL  44  -0.750   1.204   1.926
  272    H    GLU  45           H        GLU  45  -3.759  -0.147   4.324
  273    HA   GLU  45           HA       GLU  45  -3.756  -2.982   3.513
  274   1HB   GLU  45          1HB       GLU  45  -6.130  -3.064   4.121
  275   1HG   GLU  45          1HG       GLU  45  -5.911  -0.460   5.544
  276    H    VAL  46           H        VAL  46  -5.486  -3.491   1.873
  277    HA   VAL  46           HA       VAL  46  -5.877  -1.246   0.007
  278    HB   VAL  46           HB       VAL  46  -5.226  -4.055  -0.878
  279   1HG1  VAL  46          1HG1      VAL  46  -5.392  -3.314  -3.007
  280   2HG1  VAL  46          2HG1      VAL  46  -4.778  -1.709  -2.610
  281   3HG1  VAL  46          3HG1      VAL  46  -6.460  -2.118  -2.271
  282   1HG2  VAL  46          1HG2      VAL  46  -3.103  -3.659  -0.333
  283   2HG2  VAL  46          2HG2      VAL  46  -3.457  -1.988   0.104
  284   3HG2  VAL  46          3HG2      VAL  46  -3.095  -2.404  -1.571
  285    H    ASN  47           H        ASN  47  -8.027  -1.078   0.802
  286    HA   ASN  47           HA       ASN  47 -10.269  -1.458   0.773
  287   1HB   ASN  47          1HB       ASN  47  -9.404  -1.965  -1.751
  288   1HD2  ASN  47          1HD2      ASN  47 -12.373  -3.439  -0.557
  289   2HD2  ASN  47          2HD2      ASN  47 -13.437  -2.229  -1.181
  290    H    ASP  48           H        ASP  48 -10.949  -2.472   2.544
  291    HA   ASP  48           HA       ASP  48 -11.303  -4.106   4.106
  292   1HB   ASP  48          1HB       ASP  48 -12.571  -6.024   3.234
  293    H    ARG  49           H        ARG  49  -8.939  -4.231   4.482
  294    HA   ARG  49           HA       ARG  49  -8.062  -6.992   4.171
  295   1HB   ARG  49          1HB       ARG  49  -6.671  -4.617   3.013
  296   1HG   ARG  49          1HG       ARG  49  -7.746  -6.132   1.471
  297   1HD   ARG  49          1HD       ARG  49  -7.845  -8.194   2.599
  298    HE   ARG  49           HE       ARG  49  -5.078  -7.785   3.258
  299   1HH1  ARG  49          1HH1      ARG  49  -7.629 -10.147   2.966
  300   2HH1  ARG  49          2HH1      ARG  49  -6.898 -11.259   4.075
  301   1HH2  ARG  49          1HH2      ARG  49  -4.114  -9.245   4.718
  302   2HH2  ARG  49          2HH2      ARG  49  -4.903 -10.746   5.070
  303    H    GLN  50           H        GLN  50  -5.705  -7.057   5.315
  304    HA   GLN  50           HA       GLN  50  -6.253  -6.207   8.031
  305   1HB   GLN  50          1HB       GLN  50  -5.126  -8.458   7.015
  306   1HG   GLN  50          1HG       GLN  50  -4.147  -8.847   9.308
  307   1HE2  GLN  50          1HE2      GLN  50  -5.981 -10.116   8.082
  308   2HE2  GLN  50          2HE2      GLN  50  -7.500 -10.125   8.907
  309    H    GLY  51           H        GLY  51  -3.245  -6.121   6.106
  310   1HA   GLY  51          1HA       GLY  51  -2.755  -3.444   5.982
  311   2HA   GLY  51          2HA       GLY  51  -2.267  -3.869   7.615
  312    H    PHE  52           H        PHE  52  -0.240  -2.933   6.469
  313    HA   PHE  52           HA       PHE  52   1.882  -3.271   5.722
  314   1HB   PHE  52          1HB       PHE  52   1.102  -5.747   7.071
  315    HD1  PHE  52           HD1      PHE  52   1.895  -5.550   9.203
  316    HD2  PHE  52           HD2      PHE  52   4.135  -3.845   6.011
  317    HE1  PHE  52           HE1      PHE  52   3.557  -4.722  10.817
  318    HE2  PHE  52           HE2      PHE  52   5.802  -3.014   7.619
  319    HZ   PHE  52           HZ       PHE  52   5.513  -3.453  10.026
  320    H    VAL  53           H        VAL  53   2.026  -2.864   3.594
  321    HA   VAL  53           HA       VAL  53   1.611  -5.120   1.765
  322    HB   VAL  53           HB       VAL  53   0.545  -3.737   0.100
  323   1HG1  VAL  53          1HG1      VAL  53  -0.665  -3.790   2.828
  324   2HG1  VAL  53          2HG1      VAL  53  -1.100  -4.708   1.388
  325   3HG1  VAL  53          3HG1      VAL  53  -1.521  -2.999   1.504
  326   1HG2  VAL  53          1HG2      VAL  53   1.618  -1.585   1.613
  327   2HG2  VAL  53          2HG2      VAL  53  -0.133  -1.388   1.541
  328   3HG2  VAL  53          3HG2      VAL  53   0.799  -1.532   0.053
  329    HA   PRO  54           HA       PRO  54   5.680  -2.912   1.080
  330   1HB   PRO  54          1HB       PRO  54   6.964  -5.479   1.546
  331   1HG   PRO  54          1HG       PRO  54   5.988  -6.144   3.510
  332   1HD   PRO  54          1HD       PRO  54   4.116  -6.321   2.146
  333    H    ALA  55           H        ALA  55   4.004  -3.604  -0.941
  334    HA   ALA  55           HA       ALA  55   4.797  -5.710  -2.602
  335   1HB   ALA  55          1HB       ALA  55   3.318  -3.156  -3.022
  336   2HB   ALA  55          2HB       ALA  55   2.768  -4.822  -3.212
  337   3HB   ALA  55          3HB       ALA  55   3.826  -4.097  -4.423
  338    H    ALA  56           H        ALA  56   6.108  -2.520  -2.107
  339    HA   ALA  56           HA       ALA  56   8.598  -3.122  -3.219
  340   1HB   ALA  56          1HB       ALA  56   8.404  -2.756  -5.400
  341   2HB   ALA  56          2HB       ALA  56   7.745  -1.149  -5.102
  342   3HB   ALA  56          3HB       ALA  56   6.667  -2.541  -5.191
  343    H    TYR  57           H        TYR  57   9.385  -0.602  -4.164
  344    HA   TYR  57           HA       TYR  57   9.903   0.758  -1.783
  345   1HB   TYR  57          1HB       TYR  57  10.723   2.596  -3.241
  346    HD1  TYR  57           HD1      TYR  57  10.629  -0.044  -5.781
  347    HD2  TYR  57           HD2      TYR  57   9.179   3.799  -4.669
  348    HE1  TYR  57           HE1      TYR  57   9.818   0.308  -8.075
  349    HE2  TYR  57           HE2      TYR  57   8.363   4.160  -6.960
  350    HH   TYR  57           HH       TYR  57   9.271   2.882  -9.460
  351    H    VAL  58           H        VAL  58   7.596   1.561  -4.376
  352    HA   VAL  58           HA       VAL  58   5.625   2.713  -4.321
  353    HB   VAL  58           HB       VAL  58   5.930   3.048  -1.341
  354   1HG1  VAL  58          1HG1      VAL  58   3.538   2.954  -3.174
  355   2HG1  VAL  58          2HG1      VAL  58   4.185   4.376  -2.354
  356   3HG1  VAL  58          3HG1      VAL  58   3.464   3.069  -1.415
  357   1HG2  VAL  58          1HG2      VAL  58   4.354   0.788  -2.462
  358   2HG2  VAL  58          2HG2      VAL  58   5.156   0.943  -0.899
  359   3HG2  VAL  58          3HG2      VAL  58   6.104   0.612  -2.348
  360    H    LYS  59           H        LYS  59   4.864   4.907  -4.177
  361    HA   LYS  59           HA       LYS  59   6.831   6.827  -4.636
  362   1HB   LYS  59          1HB       LYS  59   5.003   8.478  -4.489
  363   1HG   LYS  59          1HG       LYS  59   3.484   6.169  -3.334
  364   1HD   LYS  59          1HD       LYS  59   2.517   7.733  -5.411
  365   1HE   LYS  59          1HE       LYS  59   1.483   8.744  -2.766
  366   1HZ   LYS  59          1HZ       LYS  59   0.568   9.518  -5.476
  367   2HZ   LYS  59          2HZ       LYS  59  -0.097   9.973  -3.989
  368   3HZ   LYS  59          3HZ       LYS  59  -0.237   8.374  -4.523
  369    H    LYS  60           H        LYS  60   6.727   9.026  -3.350
  370    HA   LYS  60           HA       LYS  60   7.240   8.358  -0.529
  371   1HB   LYS  60          1HB       LYS  60   8.414  10.554  -2.246
  372   1HG   LYS  60          1HG       LYS  60   9.450   8.423  -2.725
  373   1HD   LYS  60          1HD       LYS  60   9.310   8.135   0.200
  374   1HE   LYS  60          1HE       LYS  60  11.838   8.307  -0.737
  375   1HZ   LYS  60          1HZ       LYS  60  12.119   6.536  -2.085
  376   2HZ   LYS  60          2HZ       LYS  60  10.863   5.642  -1.389
  377   3HZ   LYS  60          3HZ       LYS  60  12.368   5.725  -0.621
  378    H    LEU  61           H        LEU  61   5.693  10.619  -2.717
  379    HA   LEU  61           HA       LEU  61   4.044  12.154  -2.428
  380   1HB   LEU  61          1HB       LEU  61   2.836  10.373  -1.329
  381    HG   LEU  61           HG       LEU  61   2.589  12.866   0.359
  382   1HD1  LEU  61          1HD1      LEU  61   1.536  12.095  -2.320
  383   2HD1  LEU  61          2HD1      LEU  61   2.133  13.653  -1.747
  384   3HD1  LEU  61          3HD1      LEU  61   0.537  13.085  -1.253
  385   1HD2  LEU  61          1HD2      LEU  61   0.142  11.829   0.362
  386   2HD2  LEU  61          2HD2      LEU  61   1.351  11.393   1.571
  387   3HD2  LEU  61          3HD2      LEU  61   1.058  10.331   0.194
  388    H    ASP  62           H        ASP  62   4.976  11.892   0.989
  389    HA   ASP  62           HA       ASP  62   5.812  13.411   2.459
  390   1HB   ASP  62          1HB       ASP  62   7.173  14.167  -0.094
  Start of MODEL    8
    1    H    GLU   7           H        GLU   7  -1.132  12.504  -6.972
    2    HA   GLU   7           HA       GLU   7  -3.057  11.305  -7.114
    3   1HB   GLU   7          1HB       GLU   7  -0.963   9.447  -7.748
    4   1HG   GLU   7          1HG       GLU   7  -3.686   8.731  -8.538
    5    H    LEU   8           H        LEU   8  -1.302   8.942  -5.133
    6    HA   LEU   8           HA       LEU   8  -2.176   9.783  -2.623
    7   1HB   LEU   8          1HB       LEU   8  -4.299   8.796  -4.115
    8    HG   LEU   8           HG       LEU   8  -4.080   8.902  -1.105
    9   1HD1  LEU   8          1HD1      LEU   8  -5.183  11.058  -1.320
   10   2HD1  LEU   8          2HD1      LEU   8  -5.184  10.898  -3.077
   11   3HD1  LEU   8          3HD1      LEU   8  -3.658  11.047  -2.204
   12   1HD2  LEU   8          1HD2      LEU   8  -6.549   8.828  -2.833
   13   2HD2  LEU   8          2HD2      LEU   8  -6.487   8.896  -1.072
   14   3HD2  LEU   8          3HD2      LEU   8  -5.918   7.458  -1.919
   15    H    VAL   9           H        VAL   9  -2.415   6.530  -4.055
   16    HA   VAL   9           HA       VAL   9   0.140   5.623  -3.388
   17    HB   VAL   9           HB       VAL   9  -0.871   4.039  -1.458
   18   1HG1  VAL   9          1HG1      VAL   9   1.091   5.905  -1.643
   19   2HG1  VAL   9          2HG1      VAL   9   0.725   4.972  -0.191
   20   3HG1  VAL   9          3HG1      VAL   9   0.072   6.600  -0.383
   21   1HG2  VAL   9          1HG2      VAL   9  -2.959   5.672  -1.657
   22   2HG2  VAL   9          2HG2      VAL   9  -1.990   6.627  -0.535
   23   3HG2  VAL   9          3HG2      VAL   9  -2.453   4.976  -0.118
   24    H    LEU  10           H        LEU  10   0.421   3.914  -4.652
   25    HA   LEU  10           HA       LEU  10  -1.855   2.100  -5.102
   26   1HB   LEU  10          1HB       LEU  10  -0.443   1.815  -7.398
   27    HG   LEU  10           HG       LEU  10   0.953   3.878  -6.749
   28   1HD1  LEU  10          1HD1      LEU  10  -0.393   4.365  -9.344
   29   2HD1  LEU  10          2HD1      LEU  10   0.374   2.795  -9.102
   30   3HD1  LEU  10          3HD1      LEU  10   1.325   4.272  -8.954
   31   1HD2  LEU  10          1HD2      LEU  10  -1.176   5.572  -7.863
   32   2HD2  LEU  10          2HD2      LEU  10   0.013   5.916  -6.607
   33   3HD2  LEU  10          3HD2      LEU  10  -1.445   5.005  -6.214
   34    H    ALA  11           H        ALA  11  -1.407  -0.079  -5.194
   35    HA   ALA  11           HA       ALA  11   0.683  -1.102  -3.707
   36   1HB   ALA  11          1HB       ALA  11  -0.340  -2.854  -5.853
   37   2HB   ALA  11          2HB       ALA  11  -1.542  -2.165  -4.763
   38   3HB   ALA  11          3HB       ALA  11  -0.219  -3.136  -4.116
   39    H    LEU  12           H        LEU  12   0.632  -0.163  -7.043
   40    HA   LEU  12           HA       LEU  12   2.272   0.036  -8.602
   41   1HB   LEU  12          1HB       LEU  12   3.697  -0.041  -6.083
   42    HG   LEU  12           HG       LEU  12   5.259   1.522  -7.245
   43   1HD1  LEU  12          1HD1      LEU  12   5.140   2.015  -9.455
   44   2HD1  LEU  12          2HD1      LEU  12   3.407   1.698  -9.548
   45   3HD1  LEU  12          3HD1      LEU  12   4.549   0.355  -9.528
   46   1HD2  LEU  12          1HD2      LEU  12   3.809   3.330  -7.122
   47   2HD2  LEU  12          2HD2      LEU  12   3.021   2.125  -6.107
   48   3HD2  LEU  12          3HD2      LEU  12   2.444   2.406  -7.750
   49    H    TYR  13           H        TYR  13   3.511  -2.642  -6.597
   50    HA   TYR  13           HA       TYR  13   4.068  -4.237  -8.899
   51   1HB   TYR  13          1HB       TYR  13   5.009  -4.221  -6.343
   52    HD1  TYR  13           HD1      TYR  13   5.350  -7.449  -6.213
   53    HD2  TYR  13           HD2      TYR  13   6.036  -4.409  -9.111
   54    HE1  TYR  13           HE1      TYR  13   7.074  -8.850  -7.265
   55    HE2  TYR  13           HE2      TYR  13   7.762  -5.803 -10.172
   56    HH   TYR  13           HH       TYR  13   9.351  -7.948  -9.033
   57    H    ASP  14           H        ASP  14   2.046  -5.122  -6.094
   58    HA   ASP  14           HA       ASP  14  -0.381  -5.478  -7.271
   59   1HB   ASP  14          1HB       ASP  14  -0.273  -8.057  -7.658
   60    H    TYR  15           H        TYR  15   1.769  -7.717  -5.495
   61    HA   TYR  15           HA       TYR  15   0.636  -7.222  -2.971
   62   1HB   TYR  15          1HB       TYR  15  -0.767  -9.134  -2.624
   63    HD1  TYR  15           HD1      TYR  15   0.171 -11.346  -2.691
   64    HD2  TYR  15           HD2      TYR  15  -0.893  -9.352  -6.295
   65    HE1  TYR  15           HE1      TYR  15   0.402 -13.460  -3.923
   66    HE2  TYR  15           HE2      TYR  15  -0.668 -11.461  -7.535
   67    HH   TYR  15           HH       TYR  15  -0.795 -14.288  -6.396
   68    H    GLN  16           H        GLN  16   0.884  -9.748  -1.787
   69    HA   GLN  16           HA       GLN  16   3.583 -10.648  -2.484
   70   1HB   GLN  16          1HB       GLN  16   4.252 -10.606  -0.119
   71   1HG   GLN  16          1HG       GLN  16   1.665  -9.137   0.332
   72   1HE2  GLN  16          1HE2      GLN  16   1.320  -8.747   2.670
   73   2HE2  GLN  16          2HE2      GLN  16   2.666  -8.195   3.601
   74    H    GLU  17           H        GLU  17   0.752 -11.186  -0.399
   75    HA   GLU  17           HA       GLU  17  -0.222 -13.086   0.397
   76   1HB   GLU  17          1HB       GLU  17  -0.535 -13.239  -2.137
   77   1HG   GLU  17          1HG       GLU  17  -1.322 -14.969  -0.165
   78    H    LYS  18           H        LYS  18   2.610 -12.645   1.053
   79    HA   LYS  18           HA       LYS  18   3.484 -15.431   1.429
   80   1HB   LYS  18          1HB       LYS  18   5.057 -14.001   0.173
   81   1HG   LYS  18          1HG       LYS  18   7.053 -14.183   1.754
   82   1HD   LYS  18          1HD       LYS  18   5.329 -16.430   0.819
   83   1HE   LYS  18          1HE       LYS  18   7.246 -17.959   1.432
   84   1HZ   LYS  18          1HZ       LYS  18   5.026 -17.623   2.706
   85   2HZ   LYS  18          2HZ       LYS  18   6.018 -16.954   3.903
   86   3HZ   LYS  18          3HZ       LYS  18   6.263 -18.549   3.397
   87    H    SER  19           H        SER  19   3.332 -12.273   3.057
   88    HA   SER  19           HA       SER  19   4.112 -13.116   5.600
   89   1HB   SER  19          1HB       SER  19   2.052 -11.037   5.646
   90    HG   SER  19           HG       SER  19   4.271 -10.126   4.311
   91    HA   PRO  20           HA       PRO  20   0.810 -15.361   7.443
   92   1HB   PRO  20          1HB       PRO  20   0.280 -13.956   9.758
   93   1HG   PRO  20          1HG       PRO  20   1.632 -12.117   9.379
   94   1HD   PRO  20          1HD       PRO  20   3.238 -12.092   7.710
   95    H    ARG  21           H        ARG  21  -1.415 -14.949   8.663
   96    HA   ARG  21           HA       ARG  21  -3.571 -14.270   8.473
   97   1HB   ARG  21          1HB       ARG  21  -2.185 -11.675   7.802
   98   1HG   ARG  21          1HG       ARG  21  -2.033 -12.555  10.146
   99   1HD   ARG  21          1HD       ARG  21  -4.481 -13.408  10.012
  100    HE   ARG  21           HE       ARG  21  -5.235 -10.869  11.216
  101   1HH1  ARG  21          1HH1      ARG  21  -5.437 -12.997   8.452
  102   2HH1  ARG  21          2HH1      ARG  21  -6.846 -12.227   7.810
  103   1HH2  ARG  21          1HH2      ARG  21  -7.086  -9.860  10.368
  104   2HH2  ARG  21          2HH2      ARG  21  -7.783 -10.448   8.894
  105    H    GLU  22           H        GLU  22  -2.665 -12.030   5.918
  106    HA   GLU  22           HA       GLU  22  -2.766 -13.519   3.648
  107   1HB   GLU  22          1HB       GLU  22  -5.392 -13.419   4.927
  108   1HG   GLU  22          1HG       GLU  22  -4.932 -14.868   2.391
  109    H    VAL  23           H        VAL  23  -3.806 -12.246   1.727
  110    HA   VAL  23           HA       VAL  23  -4.353  -9.524   1.919
  111    HB   VAL  23           HB       VAL  23  -2.217  -8.975   2.648
  112   1HG1  VAL  23          1HG1      VAL  23  -0.302 -10.066   0.961
  113   2HG1  VAL  23          2HG1      VAL  23  -1.429 -11.386   1.273
  114   3HG1  VAL  23          3HG1      VAL  23  -0.657 -10.549   2.620
  115   1HG2  VAL  23          1HG2      VAL  23  -1.589  -7.472   1.101
  116   2HG2  VAL  23          2HG2      VAL  23  -2.995  -8.067   0.218
  117   3HG2  VAL  23          3HG2      VAL  23  -1.389  -8.692  -0.157
  118    H    THR  24           H        THR  24  -1.970 -10.569  -0.462
  119    HA   THR  24           HA       THR  24  -2.137 -10.554  -2.747
  120    HB   THR  24           HB       THR  24  -2.492 -12.858  -2.344
  121    HG1  THR  24           HG1      THR  24  -4.652 -12.070  -3.998
  122   1HG2  THR  24          1HG2      THR  24  -4.150 -12.791  -0.598
  123   2HG2  THR  24          2HG2      THR  24  -4.698 -13.836  -1.907
  124   3HG2  THR  24          3HG2      THR  24  -5.366 -12.212  -1.736
  125    H    MET  25           H        MET  25  -2.907  -8.374  -2.988
  126    HA   MET  25           HA       MET  25  -5.781  -8.089  -3.452
  127   1HB   MET  25          1HB       MET  25  -5.143  -5.617  -3.691
  128   1HG   MET  25          1HG       MET  25  -2.552  -6.580  -3.568
  129   1HE   MET  25          1HE       MET  25  -0.265  -6.548  -1.251
  130   2HE   MET  25          2HE       MET  25  -0.430  -4.807  -1.022
  131   3HE   MET  25          3HE       MET  25  -0.605  -5.505  -2.632
  132    H    LYS  26           H        LYS  26  -2.761  -8.204  -5.143
  133    HA   LYS  26           HA       LYS  26  -2.226  -8.212  -7.348
  134   1HB   LYS  26          1HB       LYS  26  -4.905  -9.272  -7.189
  135   1HG   LYS  26          1HG       LYS  26  -2.669 -10.411  -7.804
  136   1HD   LYS  26          1HD       LYS  26  -2.714  -8.682  -9.904
  137   1HE   LYS  26          1HE       LYS  26  -3.633 -11.337 -10.989
  138   1HZ   LYS  26          1HZ       LYS  26  -2.169 -10.084 -12.448
  139   2HZ   LYS  26          2HZ       LYS  26  -3.165  -8.723 -12.318
  140   3HZ   LYS  26          3HZ       LYS  26  -3.743 -10.124 -13.071
  141    H    LYS  27           H        LYS  27  -2.157  -6.887  -9.220
  142    HA   LYS  27           HA       LYS  27  -2.240  -4.925 -10.366
  143   1HB   LYS  27          1HB       LYS  27  -4.862  -4.333  -9.009
  144   1HG   LYS  27          1HG       LYS  27  -4.488  -6.072 -11.438
  145   1HD   LYS  27          1HD       LYS  27  -6.505  -4.535 -11.326
  146   1HE   LYS  27          1HE       LYS  27  -7.551  -6.487  -9.311
  147   1HZ   LYS  27          1HZ       LYS  27  -8.888  -4.801 -10.779
  148   2HZ   LYS  27          2HZ       LYS  27  -8.420  -3.704  -9.581
  149   3HZ   LYS  27          3HZ       LYS  27  -9.315  -5.077  -9.166
  150    H    GLY  28           H        GLY  28  -2.003  -2.610 -10.133
  151   1HA   GLY  28          1HA       GLY  28  -1.129  -1.912  -7.417
  152   2HA   GLY  28          2HA       GLY  28  -0.619  -1.115  -8.898
  153    H    ASP  29           H        ASP  29  -3.945  -1.878  -8.030
  154    HA   ASP  29           HA       ASP  29  -4.909   0.681  -8.641
  155   1HB   ASP  29          1HB       ASP  29  -6.084  -1.554  -6.985
  156    H    ILE  30           H        ILE  30  -6.233   1.981  -6.953
  157    HA   ILE  30           HA       ILE  30  -4.354   2.771  -4.886
  158    HB   ILE  30           HB       ILE  30  -7.038   4.034  -5.401
  159   1HG1  ILE  30          1HG1      ILE  30  -5.758   3.884  -7.527
  160   1HG2  ILE  30          1HG2      ILE  30  -6.227   4.975  -3.474
  161   2HG2  ILE  30          2HG2      ILE  30  -5.521   6.054  -4.678
  162   3HG2  ILE  30          3HG2      ILE  30  -4.543   4.778  -3.956
  163   1HD1  ILE  30          1HD1      ILE  30  -3.648   4.592  -7.845
  164   2HD1  ILE  30          2HD1      ILE  30  -3.496   4.170  -6.140
  165   3HD1  ILE  30          3HD1      ILE  30  -3.764   5.847  -6.612
  166    H    LEU  31           H        LEU  31  -5.270   3.373  -2.704
  167    HA   LEU  31           HA       LEU  31  -7.546   1.884  -1.782
  168   1HB   LEU  31          1HB       LEU  31  -5.666   0.931   0.011
  169    HG   LEU  31           HG       LEU  31  -4.608   0.279  -2.738
  170   1HD1  LEU  31          1HD1      LEU  31  -3.196   1.989  -2.703
  171   2HD1  LEU  31          2HD1      LEU  31  -2.707   1.628  -1.047
  172   3HD1  LEU  31          3HD1      LEU  31  -4.108   2.652  -1.350
  173   1HD2  LEU  31          1HD2      LEU  31  -4.307  -0.851  -0.105
  174   2HD2  LEU  31          2HD2      LEU  31  -2.751  -0.321  -0.742
  175   3HD2  LEU  31          3HD2      LEU  31  -3.738  -1.456  -1.662
  176    H    THR  32           H        THR  32  -4.819   2.506   0.337
  177    HA   THR  32           HA       THR  32  -5.321   5.148   1.053
  178    HB   THR  32           HB       THR  32  -7.527   4.021   1.759
  179    HG1  THR  32           HG1      THR  32  -6.785   6.076   2.524
  180   1HG2  THR  32          1HG2      THR  32  -6.535   3.369   4.379
  181   2HG2  THR  32          2HG2      THR  32  -5.850   2.303   3.151
  182   3HG2  THR  32          3HG2      THR  32  -7.600   2.452   3.312
  183    H    LEU  33           H        LEU  33  -4.950   4.774   3.941
  184    HA   LEU  33           HA       LEU  33  -2.742   3.065   4.415
  185   1HB   LEU  33          1HB       LEU  33  -1.248   5.238   4.883
  186    HG   LEU  33           HG       LEU  33  -2.765   5.952   2.369
  187   1HD1  LEU  33          1HD1      LEU  33  -2.480   7.349   5.022
  188   2HD1  LEU  33          2HD1      LEU  33  -3.958   6.712   4.302
  189   3HD1  LEU  33          3HD1      LEU  33  -3.144   8.095   3.569
  190   1HD2  LEU  33          1HD2      LEU  33  -0.187   6.166   2.440
  191   2HD2  LEU  33          2HD2      LEU  33  -0.496   7.512   3.538
  192   3HD2  LEU  33          3HD2      LEU  33  -1.149   7.541   1.900
  193    H    LEU  34           H        LEU  34  -3.098   2.536   6.451
  194    HA   LEU  34           HA       LEU  34  -4.649   4.001   8.259
  195   1HB   LEU  34          1HB       LEU  34  -3.881   1.497   8.244
  196    HG   LEU  34           HG       LEU  34  -4.415   1.164  10.549
  197   1HD1  LEU  34          1HD1      LEU  34  -4.200   4.089  11.126
  198   2HD1  LEU  34          2HD1      LEU  34  -2.787   3.041  11.256
  199   3HD1  LEU  34          3HD1      LEU  34  -4.213   2.726  12.245
  200   1HD2  LEU  34          1HD2      LEU  34  -6.103   2.285   8.860
  201   2HD2  LEU  34          2HD2      LEU  34  -6.005   3.618  10.012
  202   3HD2  LEU  34          3HD2      LEU  34  -6.531   2.023  10.551
  203    H    ASN  35           H        ASN  35  -4.131   5.994   8.911
  204    HA   ASN  35           HA       ASN  35  -3.023   7.697   9.935
  205   1HB   ASN  35          1HB       ASN  35  -2.309   5.505  11.382
  206   1HD2  ASN  35          1HD2      ASN  35  -0.616   6.287  13.270
  207   2HD2  ASN  35          2HD2      ASN  35  -1.079   7.812  13.938
  208    H    SER  36           H        SER  36  -0.355   8.302  10.234
  209    HA   SER  36           HA       SER  36   0.364   9.130   7.643
  210   1HB   SER  36          1HB       SER  36   1.725   9.147  10.311
  211    HG   SER  36           HG       SER  36   0.198  10.794   9.447
  212    H    THR  37           H        THR  37   2.605   8.683   6.711
  213    HA   THR  37           HA       THR  37   3.015   5.769   6.661
  214    HB   THR  37           HB       THR  37   2.324   6.760   4.519
  215    HG1  THR  37           HG1      THR  37   3.763   5.642   3.379
  216   1HG2  THR  37          1HG2      THR  37   3.403   8.995   4.890
  217   2HG2  THR  37          2HG2      THR  37   3.635   8.288   3.292
  218   3HG2  THR  37          3HG2      THR  37   4.938   8.234   4.478
  219    H    ASN  38           H        ASN  38   4.769   8.858   6.545
  220    HA   ASN  38           HA       ASN  38   6.833   9.464   7.272
  221   1HB   ASN  38          1HB       ASN  38   6.127   8.400   9.384
  222   1HD2  ASN  38          1HD2      ASN  38   8.125   6.800  10.627
  223   2HD2  ASN  38          2HD2      ASN  38   9.575   7.737  10.678
  224    H    LYS  39           H        LYS  39   7.270   5.930   7.171
  225    HA   LYS  39           HA       LYS  39   8.551   5.833   4.678
  226   1HB   LYS  39          1HB       LYS  39  10.900   5.402   5.567
  227   1HG   LYS  39          1HG       LYS  39  10.992   7.198   7.660
  228   1HD   LYS  39          1HD       LYS  39  11.194   4.217   7.467
  229   1HE   LYS  39          1HE       LYS  39  12.380   4.782   9.842
  230   1HZ   LYS  39          1HZ       LYS  39  10.786   2.956   9.249
  231   2HZ   LYS  39          2HZ       LYS  39   9.528   4.010   9.657
  232   3HZ   LYS  39          3HZ       LYS  39  10.657   3.548  10.829
  233    H    ASP  40           H        ASP  40   6.665   4.312   6.118
  234    HA   ASP  40           HA       ASP  40   8.085   1.740   6.278
  235   1HB   ASP  40          1HB       ASP  40   6.213   2.981   8.225
  236    H    TRP  41           H        TRP  41   6.854  -0.112   5.676
  237    HA   TRP  41           HA       TRP  41   5.291   0.217   3.390
  238   1HB   TRP  41          1HB       TRP  41   4.980  -2.143   3.416
  239    HD1  TRP  41           HD1      TRP  41   3.181  -3.283   4.948
  240    HE1  TRP  41           HE1      TRP  41   3.265  -4.350   7.288
  241    HE3  TRP  41           HE3      TRP  41   7.775  -1.604   6.446
  242    HZ2  TRP  41           HZ2      TRP  41   5.039  -4.463   9.478
  243    HZ3  TRP  41           HZ3      TRP  41   8.588  -2.235   8.679
  244    HH2  TRP  41           HH2      TRP  41   7.249  -3.636  10.163
  245    H    TRP  42           H        TRP  42   4.307  -0.565   6.715
  246    HA   TRP  42           HA       TRP  42   2.330  -0.365   7.810
  247   1HB   TRP  42          1HB       TRP  42   1.858   1.644   5.606
  248    HD1  TRP  42           HD1      TRP  42   3.485   3.568   6.009
  249    HE1  TRP  42           HE1      TRP  42   4.511   4.724   8.067
  250    HE3  TRP  42           HE3      TRP  42   1.420   0.673   9.682
  251    HZ2  TRP  42           HZ2      TRP  42   4.453   4.446  10.875
  252    HZ3  TRP  42           HZ3      TRP  42   1.958   1.184  12.029
  253    HH2  TRP  42           HH2      TRP  42   3.444   3.031  12.612
  254    H    LYS  43           H        LYS  43   0.419  -1.446   7.914
  255    HA   LYS  43           HA       LYS  43  -0.151  -3.420   6.042
  256   1HB   LYS  43          1HB       LYS  43  -2.372  -3.586   7.254
  257   1HG   LYS  43          1HG       LYS  43  -1.468  -1.035   8.323
  258   1HD   LYS  43          1HD       LYS  43  -2.458  -1.607  10.603
  259   1HE   LYS  43          1HE       LYS  43   0.143  -3.020  10.191
  260   1HZ   LYS  43          1HZ       LYS  43  -0.749  -1.010  12.186
  261   2HZ   LYS  43          2HZ       LYS  43   0.724  -1.841  12.194
  262   3HZ   LYS  43          3HZ       LYS  43  -0.723  -2.683  12.438
  263    H    VAL  44           H        VAL  44  -1.062  -0.095   6.066
  264    HA   VAL  44           HA       VAL  44  -2.243   1.191   4.612
  265    HB   VAL  44           HB       VAL  44  -1.909  -1.254   2.878
  266   1HG1  VAL  44          1HG1      VAL  44  -3.506   1.186   2.412
  267   2HG1  VAL  44          2HG1      VAL  44  -3.679  -0.432   1.734
  268   3HG1  VAL  44          3HG1      VAL  44  -2.462   0.669   1.088
  269   1HG2  VAL  44          1HG2      VAL  44   0.171  -0.291   3.066
  270   2HG2  VAL  44          2HG2      VAL  44  -0.479   1.340   3.222
  271   3HG2  VAL  44          3HG2      VAL  44  -0.463   0.544   1.649
  272    H    GLU  45           H        GLU  45  -3.654  -1.928   3.671
  273    HA   GLU  45           HA       GLU  45  -5.744  -2.801   3.918
  274   1HB   GLU  45          1HB       GLU  45  -6.371  -0.594   5.875
  275   1HG   GLU  45          1HG       GLU  45  -5.252  -3.260   6.662
  276    H    VAL  46           H        VAL  46  -8.018  -2.334   3.386
  277    HA   VAL  46           HA       VAL  46  -8.880   0.204   2.524
  278    HB   VAL  46           HB       VAL  46  -7.206  -0.111   0.757
  279   1HG1  VAL  46          1HG1      VAL  46  -8.825  -2.437  -0.239
  280   2HG1  VAL  46          2HG1      VAL  46  -7.411  -2.640   0.795
  281   3HG1  VAL  46          3HG1      VAL  46  -7.244  -1.884  -0.789
  282   1HG2  VAL  46          1HG2      VAL  46 -10.067   0.221   0.289
  283   2HG2  VAL  46          2HG2      VAL  46  -9.171  -0.267  -1.150
  284   3HG2  VAL  46          3HG2      VAL  46  -8.704   1.190  -0.274
  285    H    ASN  47           H        ASN  47  -9.115  -3.268   1.763
  286    HA   ASN  47           HA       ASN  47 -11.616  -3.719   2.784
  287   1HB   ASN  47          1HB       ASN  47 -12.971  -3.762   0.589
  288   1HD2  ASN  47          1HD2      ASN  47 -11.291  -4.339  -1.072
  289   2HD2  ASN  47          2HD2      ASN  47 -10.777  -3.073  -2.129
  290    H    ASP  48           H        ASP  48 -12.380  -5.811   2.394
  291    HA   ASP  48           HA       ASP  48 -12.145  -8.035   1.979
  292   1HB   ASP  48          1HB       ASP  48 -11.248  -6.877  -0.659
  293    H    ARG  49           H        ARG  49  -9.838  -6.526   3.130
  294    HA   ARG  49           HA       ARG  49  -7.976  -8.686   3.123
  295   1HB   ARG  49          1HB       ARG  49  -7.569  -6.538   1.233
  296   1HG   ARG  49          1HG       ARG  49  -5.375  -8.096   0.993
  297   1HD   ARG  49          1HD       ARG  49  -7.939  -7.864  -0.246
  298    HE   ARG  49           HE       ARG  49  -7.710 -10.439   0.530
  299   1HH1  ARG  49          1HH1      ARG  49  -7.467  -8.860  -2.572
  300   2HH1  ARG  49          2HH1      ARG  49  -8.039 -10.235  -3.456
  301   1HH2  ARG  49          1HH2      ARG  49  -8.461 -12.249  -0.631
  302   2HH2  ARG  49          2HH2      ARG  49  -8.604 -12.158  -2.355
  303    H    GLN  50           H        GLN  50  -7.234  -5.241   3.475
  304    HA   GLN  50           HA       GLN  50  -6.461  -4.043   5.246
  305   1HB   GLN  50          1HB       GLN  50  -8.868  -4.268   5.826
  306   1HG   GLN  50          1HG       GLN  50  -6.766  -3.905   7.854
  307   1HE2  GLN  50          1HE2      GLN  50 -10.277  -4.363   7.791
  308   2HE2  GLN  50          2HE2      GLN  50 -10.431  -4.758   9.465
  309    H    GLY  51           H        GLY  51  -4.347  -4.730   5.444
  310   1HA   GLY  51          1HA       GLY  51  -3.071  -5.418   7.552
  311   2HA   GLY  51          2HA       GLY  51  -3.862  -6.966   7.307
  312    H    PHE  52           H        PHE  52  -1.006  -5.608   7.069
  313    HA   PHE  52           HA       PHE  52   0.925  -6.061   5.970
  314   1HB   PHE  52          1HB       PHE  52  -0.649  -8.461   5.022
  315    HD1  PHE  52           HD1      PHE  52   1.779  -7.072   7.458
  316    HD2  PHE  52           HD2      PHE  52  -0.796 -10.305   6.439
  317    HE1  PHE  52           HE1      PHE  52   2.151  -8.062   9.678
  318    HE2  PHE  52           HE2      PHE  52  -0.429 -11.301   8.660
  319    HZ   PHE  52           HZ       PHE  52   1.045 -10.179  10.282
  320    H    VAL  53           H        VAL  53   1.498  -4.686   4.453
  321    HA   VAL  53           HA       VAL  53   0.769  -5.138   1.704
  322    HB   VAL  53           HB       VAL  53  -0.079  -2.585   3.085
  323   1HG1  VAL  53          1HG1      VAL  53   0.290  -3.212   0.176
  324   2HG1  VAL  53          2HG1      VAL  53   0.824  -1.800   1.085
  325   3HG1  VAL  53          3HG1      VAL  53  -0.885  -2.010   0.710
  326   1HG2  VAL  53          1HG2      VAL  53  -1.611  -4.698   1.575
  327   2HG2  VAL  53          2HG2      VAL  53  -2.291  -3.161   2.111
  328   3HG2  VAL  53          3HG2      VAL  53  -1.717  -4.333   3.296
  329    HA   PRO  54           HA       PRO  54   5.133  -3.791   2.290
  330   1HB   PRO  54          1HB       PRO  54   5.295  -5.075  -0.379
  331   1HG   PRO  54          1HG       PRO  54   4.540  -7.160   0.309
  332   1HD   PRO  54          1HD       PRO  54   2.560  -5.956   0.261
  333    H    ALA  55           H        ALA  55   5.944  -1.898   1.653
  334    HA   ALA  55           HA       ALA  55   4.685  -0.539  -0.618
  335   1HB   ALA  55          1HB       ALA  55   5.657   1.517   0.344
  336   2HB   ALA  55          2HB       ALA  55   6.345   0.554   1.651
  337   3HB   ALA  55          3HB       ALA  55   4.594   0.675   1.471
  338    H    ALA  56           H        ALA  56   6.129  -2.210  -1.823
  339    HA   ALA  56           HA       ALA  56   8.854  -2.111  -2.021
  340   1HB   ALA  56          1HB       ALA  56   7.856  -3.733  -3.333
  341   2HB   ALA  56          2HB       ALA  56   8.419  -2.573  -4.537
  342   3HB   ALA  56          3HB       ALA  56   6.722  -2.593  -4.060
  343    H    TYR  57           H        TYR  57   6.553   0.258  -3.135
  344    HA   TYR  57           HA       TYR  57   8.661   2.176  -3.548
  345   1HB   TYR  57          1HB       TYR  57   6.987   2.274  -5.915
  346    HD1  TYR  57           HD1      TYR  57   9.865   0.476  -6.739
  347    HD2  TYR  57           HD2      TYR  57   5.840  -0.090  -5.477
  348    HE1  TYR  57           HE1      TYR  57   9.904  -1.807  -7.653
  349    HE2  TYR  57           HE2      TYR  57   5.869  -2.374  -6.385
  350    HH   TYR  57           HH       TYR  57   7.998  -4.136  -6.865
  351    H    VAL  58           H        VAL  58   5.359   1.952  -4.847
  352    HA   VAL  58           HA       VAL  58   3.545   3.310  -4.603
  353    HB   VAL  58           HB       VAL  58   4.135   3.961  -1.781
  354   1HG1  VAL  58          1HG1      VAL  58   1.909   3.943  -1.622
  355   2HG1  VAL  58          2HG1      VAL  58   1.774   2.379  -2.424
  356   3HG1  VAL  58          3HG1      VAL  58   1.906   3.851  -3.382
  357   1HG2  VAL  58          1HG2      VAL  58   3.494   1.535  -1.181
  358   2HG2  VAL  58          2HG2      VAL  58   5.167   1.880  -1.618
  359   3HG2  VAL  58          3HG2      VAL  58   4.082   1.141  -2.796
  360    H    LYS  59           H        LYS  59   2.843   5.543  -3.465
  361    HA   LYS  59           HA       LYS  59   4.693   7.491  -4.543
  362   1HB   LYS  59          1HB       LYS  59   2.089   8.134  -3.183
  363   1HG   LYS  59          1HG       LYS  59   1.763   6.322  -4.924
  364   1HD   LYS  59          1HD       LYS  59   1.639   7.610  -7.258
  365   1HE   LYS  59          1HE       LYS  59   3.265   5.625  -6.124
  366   1HZ   LYS  59          1HZ       LYS  59   5.388   6.055  -6.656
  367   2HZ   LYS  59          2HZ       LYS  59   4.926   7.676  -6.517
  368   3HZ   LYS  59          3HZ       LYS  59   4.990   6.945  -8.040
  369    H    LYS  60           H        LYS  60   5.459   9.326  -3.382
  370    HA   LYS  60           HA       LYS  60   6.514   8.734  -0.848
  371   1HB   LYS  60          1HB       LYS  60   7.112  10.551  -2.743
  372   1HG   LYS  60          1HG       LYS  60   7.881  10.325   0.100
  373   1HD   LYS  60          1HD       LYS  60   9.250  12.487  -1.345
  374   1HE   LYS  60          1HE       LYS  60   8.160  12.859   1.366
  375   1HZ   LYS  60          1HZ       LYS  60   9.744  14.401   0.960
  376   2HZ   LYS  60          2HZ       LYS  60  10.615  13.418  -0.104
  377   3HZ   LYS  60          3HZ       LYS  60  10.760  13.192   1.566
  378    H    LEU  61           H        LEU  61   3.671  10.550  -1.847
  379    HA   LEU  61           HA       LEU  61   1.889  11.366  -0.698
  380   1HB   LEU  61          1HB       LEU  61   2.166   8.909   0.205
  381    HG   LEU  61           HG       LEU  61   0.225   9.071   1.600
  382   1HD1  LEU  61          1HD1      LEU  61  -0.635  11.151   2.458
  383   2HD1  LEU  61          2HD1      LEU  61   0.660  12.052   1.672
  384   3HD1  LEU  61          3HD1      LEU  61   1.032  10.945   2.994
  385   1HD2  LEU  61          1HD2      LEU  61  -1.222   9.765   0.002
  386   2HD2  LEU  61          2HD2      LEU  61   0.249   9.814  -0.969
  387   3HD2  LEU  61          3HD2      LEU  61  -0.383  11.296  -0.250
  388    H    ASP  62           H        ASP  62   2.198  13.456  -0.229
  389    HA   ASP  62           HA       ASP  62   3.902  14.144   2.066
  390   1HB   ASP  62          1HB       ASP  62   3.972  16.417   1.106
  Start of MODEL    9
    1    H    GLU   7           H        GLU   7  -3.326  10.554  -5.330
    2    HA   GLU   7           HA       GLU   7  -3.119  13.193  -4.418
    3   1HB   GLU   7          1HB       GLU   7  -5.566  13.204  -4.604
    4   1HG   GLU   7          1HG       GLU   7  -5.943  13.241  -1.905
    5    H    LEU   8           H        LEU   8  -3.980   9.896  -3.442
    6    HA   LEU   8           HA       LEU   8  -2.362  10.184  -1.020
    7   1HB   LEU   8          1HB       LEU   8  -4.251   8.019  -1.938
    8    HG   LEU   8           HG       LEU   8  -5.503   8.583   0.123
    9   1HD1  LEU   8          1HD1      LEU   8  -4.212  11.235   0.270
   10   2HD1  LEU   8          2HD1      LEU   8  -3.312   9.878   0.947
   11   3HD1  LEU   8          3HD1      LEU   8  -4.931  10.246   1.543
   12   1HD2  LEU   8          1HD2      LEU   8  -5.302  11.034  -1.586
   13   2HD2  LEU   8          2HD2      LEU   8  -6.731  10.290  -0.866
   14   3HD2  LEU   8          3HD2      LEU   8  -5.933   9.523  -2.239
   15    H    VAL   9           H        VAL   9  -2.875   7.317  -3.015
   16    HA   VAL   9           HA       VAL   9  -0.095   7.223  -3.800
   17    HB   VAL   9           HB       VAL   9   0.359   5.051  -2.802
   18   1HG1  VAL   9          1HG1      VAL   9   0.790   7.210  -1.563
   19   2HG1  VAL   9          2HG1      VAL   9   0.720   5.750  -0.577
   20   3HG1  VAL   9          3HG1      VAL   9  -0.657   6.851  -0.620
   21   1HG2  VAL   9          1HG2      VAL   9  -2.408   5.318  -1.638
   22   2HG2  VAL   9          2HG2      VAL   9  -1.212   4.151  -1.075
   23   3HG2  VAL   9          3HG2      VAL   9  -1.818   4.064  -2.728
   24    H    LEU  10           H        LEU  10  -0.395   4.243  -4.251
   25    HA   LEU  10           HA       LEU  10  -2.622   3.843  -5.958
   26   1HB   LEU  10          1HB       LEU  10  -1.584   3.898  -8.100
   27    HG   LEU  10           HG       LEU  10   0.821   3.381  -7.008
   28   1HD1  LEU  10          1HD1      LEU  10   0.038   4.582  -9.630
   29   2HD1  LEU  10          2HD1      LEU  10   0.545   2.934  -9.260
   30   3HD1  LEU  10          3HD1      LEU  10   1.731   4.238  -9.274
   31   1HD2  LEU  10          1HD2      LEU  10   0.578   6.335  -7.245
   32   2HD2  LEU  10          2HD2      LEU  10   2.112   5.569  -7.656
   33   3HD2  LEU  10          3HD2      LEU  10   1.429   5.368  -6.042
   34    H    ALA  11           H        ALA  11  -1.150   2.497  -3.837
   35    HA   ALA  11           HA       ALA  11  -0.510   0.397  -3.245
   36   1HB   ALA  11          1HB       ALA  11  -1.856  -0.134  -5.869
   37   2HB   ALA  11          2HB       ALA  11  -2.416  -0.498  -4.236
   38   3HB   ALA  11          3HB       ALA  11  -1.104  -1.437  -4.949
   39    H    LEU  12           H        LEU  12   0.085  -0.069  -6.705
   40    HA   LEU  12           HA       LEU  12   1.975  -0.480  -7.899
   41   1HB   LEU  12          1HB       LEU  12   2.679   1.593  -6.082
   42    HG   LEU  12           HG       LEU  12   2.733   1.927  -8.489
   43   1HD1  LEU  12          1HD1      LEU  12   4.078   3.529  -7.591
   44   2HD1  LEU  12          2HD1      LEU  12   5.261   2.691  -8.596
   45   3HD1  LEU  12          3HD1      LEU  12   5.180   2.359  -6.866
   46   1HD2  LEU  12          1HD2      LEU  12   4.948   0.898  -9.554
   47   2HD2  LEU  12          2HD2      LEU  12   3.398   0.055  -9.582
   48   3HD2  LEU  12          3HD2      LEU  12   4.607  -0.360  -8.367
   49    H    TYR  13           H        TYR  13   3.428  -0.644  -4.662
   50    HA   TYR  13           HA       TYR  13   4.146  -3.435  -5.227
   51   1HB   TYR  13          1HB       TYR  13   5.510  -1.210  -3.920
   52    HD1  TYR  13           HD1      TYR  13   5.853  -1.921  -6.608
   53    HD2  TYR  13           HD2      TYR  13   7.529  -3.824  -3.191
   54    HE1  TYR  13           HE1      TYR  13   7.695  -2.776  -7.995
   55    HE2  TYR  13           HE2      TYR  13   9.376  -4.682  -4.568
   56    HH   TYR  13           HH       TYR  13   9.340  -4.910  -7.758
   57    H    ASP  14           H        ASP  14   1.709  -3.637  -4.641
   58    HA   ASP  14           HA       ASP  14   1.551  -4.244  -1.764
   59   1HB   ASP  14          1HB       ASP  14  -0.393  -2.829  -3.536
   60    H    TYR  15           H        TYR  15   2.389  -6.339  -2.703
   61    HA   TYR  15           HA       TYR  15   0.108  -8.089  -3.203
   62   1HB   TYR  15          1HB       TYR  15   0.974  -7.512  -5.439
   63    HD1  TYR  15           HD1      TYR  15  -0.946  -9.171  -5.489
   64    HD2  TYR  15           HD2      TYR  15   3.126 -10.367  -5.179
   65    HE1  TYR  15           HE1      TYR  15  -1.557 -11.431  -6.242
   66    HE2  TYR  15           HE2      TYR  15   2.524 -12.629  -5.931
   67    HH   TYR  15           HH       TYR  15  -0.525 -13.372  -7.273
   68    H    GLN  16           H        GLN  16   0.964  -8.226  -0.840
   69    HA   GLN  16           HA       GLN  16   2.046 -10.763  -0.451
   70   1HB   GLN  16          1HB       GLN  16   4.031  -8.649  -0.778
   71   1HG   GLN  16          1HG       GLN  16   4.851 -11.423  -0.219
   72   1HE2  GLN  16          1HE2      GLN  16   6.850 -11.668  -0.926
   73   2HE2  GLN  16          2HE2      GLN  16   7.661 -10.632  -2.045
   74    H    GLU  17           H        GLU  17   2.746 -11.085   1.907
   75    HA   GLU  17           HA       GLU  17   2.112  -9.219   3.898
   76   1HB   GLU  17          1HB       GLU  17  -0.179  -9.401   3.127
   77   1HG   GLU  17          1HG       GLU  17  -1.337 -10.035   5.085
   78    H    LYS  18           H        LYS  18   1.155 -12.638   3.657
   79    HA   LYS  18           HA       LYS  18   3.274 -13.279   5.604
   80   1HB   LYS  18          1HB       LYS  18   0.580 -13.354   6.140
   81   1HG   LYS  18          1HG       LYS  18   1.246 -15.070   7.950
   82   1HD   LYS  18          1HD       LYS  18   2.586 -13.317   9.154
   83   1HE   LYS  18          1HE       LYS  18   0.781 -11.801   9.394
   84   1HZ   LYS  18          1HZ       LYS  18  -1.047 -13.222   9.684
   85   2HZ   LYS  18          2HZ       LYS  18   0.309 -14.203   9.920
   86   3HZ   LYS  18          3HZ       LYS  18  -0.544 -14.278   8.461
   87    H    SER  19           H        SER  19   3.278 -15.907   5.707
   88    HA   SER  19           HA       SER  19   4.479 -16.715   3.307
   89   1HB   SER  19          1HB       SER  19   5.233 -17.942   5.115
   90    HG   SER  19           HG       SER  19   4.729 -20.002   4.682
   91    HA   PRO  20           HA       PRO  20   0.547 -19.414   2.404
   92   1HB   PRO  20          1HB       PRO  20  -1.700 -18.727   3.840
   93   1HG   PRO  20          1HG       PRO  20  -0.751 -17.308   5.396
   94   1HD   PRO  20          1HD       PRO  20   1.530 -17.119   5.637
   95    H    ARG  21           H        ARG  21  -1.217 -16.612   3.680
   96    HA   ARG  21           HA       ARG  21  -1.044 -14.926   1.480
   97   1HB   ARG  21          1HB       ARG  21  -2.790 -17.201   1.054
   98   1HG   ARG  21          1HG       ARG  21  -1.688 -14.974  -0.588
   99   1HD   ARG  21          1HD       ARG  21  -4.231 -15.649  -1.059
  100    HE   ARG  21           HE       ARG  21  -2.944 -18.004  -1.793
  101   1HH1  ARG  21          1HH1      ARG  21  -5.103 -15.659  -3.212
  102   2HH1  ARG  21          2HH1      ARG  21  -5.845 -16.803  -4.281
  103   1HH2  ARG  21          1HH2      ARG  21  -3.918 -19.510  -3.197
  104   2HH2  ARG  21          2HH2      ARG  21  -5.173 -18.990  -4.271
  105    H    GLU  22           H        GLU  22  -2.676 -13.194   1.517
  106    HA   GLU  22           HA       GLU  22  -4.673 -12.997   3.477
  107   1HB   GLU  22          1HB       GLU  22  -2.802 -13.046   5.056
  108   1HG   GLU  22          1HG       GLU  22  -3.880 -10.243   4.863
  109    H    VAL  23           H        VAL  23  -2.155 -10.659   2.531
  110    HA   VAL  23           HA       VAL  23  -4.272  -9.004   1.336
  111    HB   VAL  23           HB       VAL  23  -1.503  -8.111   2.139
  112   1HG1  VAL  23          1HG1      VAL  23  -2.173  -6.450   0.745
  113   2HG1  VAL  23          2HG1      VAL  23  -2.993  -5.898   2.206
  114   3HG1  VAL  23          3HG1      VAL  23  -3.887  -6.794   0.979
  115   1HG2  VAL  23          1HG2      VAL  23  -3.972  -8.457   3.722
  116   2HG2  VAL  23          2HG2      VAL  23  -3.095  -6.946   3.959
  117   3HG2  VAL  23          3HG2      VAL  23  -2.284  -8.489   4.229
  118    H    THR  24           H        THR  24  -4.003  -8.092  -0.709
  119    HA   THR  24           HA       THR  24  -1.711  -8.262  -2.304
  120    HB   THR  24           HB       THR  24  -1.871 -10.604  -2.416
  121    HG1  THR  24           HG1      THR  24  -2.561 -10.988  -4.569
  122   1HG2  THR  24          1HG2      THR  24  -4.367 -11.302  -3.398
  123   2HG2  THR  24          2HG2      THR  24  -4.700 -10.184  -2.075
  124   3HG2  THR  24          3HG2      THR  24  -3.728 -11.626  -1.787
  125    H    MET  25           H        MET  25  -2.116  -6.401  -3.313
  126    HA   MET  25           HA       MET  25  -4.245  -6.258  -5.226
  127   1HB   MET  25          1HB       MET  25  -5.400  -4.337  -4.349
  128   1HG   MET  25          1HG       MET  25  -3.475  -3.296  -3.157
  129   1HE   MET  25          1HE       MET  25  -2.967  -3.841   0.879
  130   2HE   MET  25          2HE       MET  25  -4.549  -3.375   0.252
  131   3HE   MET  25          3HE       MET  25  -3.094  -2.584  -0.351
  132    H    LYS  26           H        LYS  26  -3.497  -5.212  -6.946
  133    HA   LYS  26           HA       LYS  26  -1.441  -3.143  -6.553
  134   1HB   LYS  26          1HB       LYS  26  -1.438  -5.129  -8.827
  135   1HG   LYS  26          1HG       LYS  26  -0.916  -5.990  -6.380
  136   1HD   LYS  26          1HD       LYS  26   0.920  -4.041  -6.421
  137   1HE   LYS  26          1HE       LYS  26   2.071  -5.088  -8.370
  138   1HZ   LYS  26          1HZ       LYS  26   3.047  -7.123  -8.260
  139   2HZ   LYS  26          2HZ       LYS  26   1.700  -7.430  -7.285
  140   3HZ   LYS  26          3HZ       LYS  26   3.201  -7.104  -6.576
  141    H    LYS  27           H        LYS  27  -1.134  -2.559  -9.315
  142    HA   LYS  27           HA       LYS  27  -2.087  -1.474 -11.086
  143   1HB   LYS  27          1HB       LYS  27  -4.076  -3.174 -10.475
  144   1HG   LYS  27          1HG       LYS  27  -4.939  -0.951 -12.230
  145   1HD   LYS  27          1HD       LYS  27  -4.626  -3.862 -12.885
  146   1HE   LYS  27          1HE       LYS  27  -5.190  -2.567 -14.776
  147   1HZ   LYS  27          1HZ       LYS  27  -5.851  -0.506 -13.955
  148   2HZ   LYS  27          2HZ       LYS  27  -7.058  -1.161 -12.970
  149   3HZ   LYS  27          3HZ       LYS  27  -7.265  -1.125 -14.647
  150    H    GLY  28           H        GLY  28  -3.793   0.457 -11.403
  151   1HA   GLY  28          1HA       GLY  28  -2.803   2.611  -9.940
  152   2HA   GLY  28          2HA       GLY  28  -4.270   2.643 -10.902
  153    H    ASP  29           H        ASP  29  -5.285   0.383  -9.075
  154    HA   ASP  29           HA       ASP  29  -6.986   1.821  -7.485
  155   1HB   ASP  29          1HB       ASP  29  -6.660  -0.808  -7.964
  156    H    ILE  30           H        ILE  30  -6.925   2.815  -5.550
  157    HA   ILE  30           HA       ILE  30  -4.331   2.884  -4.168
  158    HB   ILE  30           HB       ILE  30  -6.332   4.853  -3.310
  159   1HG1  ILE  30          1HG1      ILE  30  -5.220   4.998  -6.123
  160   1HG2  ILE  30          1HG2      ILE  30  -3.444   4.620  -3.739
  161   2HG2  ILE  30          2HG2      ILE  30  -4.343   5.500  -2.504
  162   3HG2  ILE  30          3HG2      ILE  30  -4.113   6.212  -4.100
  163   1HD1  ILE  30          1HD1      ILE  30  -6.855   7.002  -6.164
  164   2HD1  ILE  30          2HD1      ILE  30  -5.233   7.210  -5.505
  165   3HD1  ILE  30          3HD1      ILE  30  -6.608   7.008  -4.418
  166    H    LEU  31           H        LEU  31  -5.078   3.850  -1.713
  167    HA   LEU  31           HA       LEU  31  -7.071   2.032  -0.621
  168   1HB   LEU  31          1HB       LEU  31  -4.821   1.894   1.125
  169    HG   LEU  31           HG       LEU  31  -4.182   1.180  -1.726
  170   1HD1  LEU  31          1HD1      LEU  31  -3.459   3.364  -0.638
  171   2HD1  LEU  31          2HD1      LEU  31  -2.199   2.379  -1.381
  172   3HD1  LEU  31          3HD1      LEU  31  -2.401   2.377   0.371
  173   1HD2  LEU  31          1HD2      LEU  31  -3.914  -0.613   0.326
  174   2HD2  LEU  31          2HD2      LEU  31  -2.342   0.186   0.311
  175   3HD2  LEU  31          3HD2      LEU  31  -2.949  -0.593  -1.150
  176    H    THR  32           H        THR  32  -4.457   3.748   1.050
  177    HA   THR  32           HA       THR  32  -5.565   6.156   1.649
  178    HB   THR  32           HB       THR  32  -7.551   5.308   2.569
  179    HG1  THR  32           HG1      THR  32  -5.881   5.521   4.843
  180   1HG2  THR  32          1HG2      THR  32  -7.859   3.314   3.490
  181   2HG2  THR  32          2HG2      THR  32  -6.522   3.531   4.619
  182   3HG2  THR  32          3HG2      THR  32  -6.211   2.949   2.983
  183    H    LEU  33           H        LEU  33  -4.382   3.422   3.612
  184    HA   LEU  33           HA       LEU  33  -2.591   3.196   4.990
  185   1HB   LEU  33          1HB       LEU  33  -1.196   5.460   3.635
  186    HG   LEU  33           HG       LEU  33  -2.340   3.228   2.177
  187   1HD1  LEU  33          1HD1      LEU  33  -0.592   5.089   0.767
  188   2HD1  LEU  33          2HD1      LEU  33  -1.819   5.880   1.755
  189   3HD1  LEU  33          3HD1      LEU  33  -2.297   4.721   0.517
  190   1HD2  LEU  33          1HD2      LEU  33   0.078   3.106   0.963
  191   2HD2  LEU  33          2HD2      LEU  33  -0.514   1.918   2.125
  192   3HD2  LEU  33          3HD2      LEU  33   0.559   3.213   2.657
  193    H    LEU  34           H        LEU  34  -3.324   3.836   6.953
  194    HA   LEU  34           HA       LEU  34  -3.952   6.433   7.745
  195   1HB   LEU  34          1HB       LEU  34  -4.053   5.619   9.948
  196    HG   LEU  34           HG       LEU  34  -1.843   4.679  10.294
  197   1HD1  LEU  34          1HD1      LEU  34  -2.474   2.606  11.480
  198   2HD1  LEU  34          2HD1      LEU  34  -4.057   2.677  10.704
  199   3HD1  LEU  34          3HD1      LEU  34  -3.563   3.953  11.817
  200   1HD2  LEU  34          1HD2      LEU  34  -2.760   2.547   8.373
  201   2HD2  LEU  34          2HD2      LEU  34  -1.340   2.397   9.410
  202   3HD2  LEU  34          3HD2      LEU  34  -1.404   3.660   8.181
  203    H    ASN  35           H        ASN  35  -2.556   7.001  10.049
  204    HA   ASN  35           HA       ASN  35  -0.381   8.474   9.096
  205   1HB   ASN  35          1HB       ASN  35   0.183   8.799  11.510
  206   1HD2  ASN  35          1HD2      ASN  35   0.658   7.298  12.993
  207   2HD2  ASN  35          2HD2      ASN  35  -0.506   6.306  13.798
  208    H    SER  36           H        SER  36   0.995   7.107   7.931
  209    HA   SER  36           HA       SER  36   2.127   4.725   8.871
  210   1HB   SER  36          1HB       SER  36   2.329   5.138   6.556
  211    HG   SER  36           HG       SER  36   4.908   5.835   6.831
  212    H    THR  37           H        THR  37   4.383   4.336   9.482
  213    HA   THR  37           HA       THR  37   5.701   6.574  10.835
  214    HB   THR  37           HB       THR  37   4.501   5.655  12.648
  215    HG1  THR  37           HG1      THR  37   6.158   4.681  13.898
  216   1HG2  THR  37          1HG2      THR  37   4.694   3.198  13.214
  217   2HG2  THR  37          2HG2      THR  37   5.239   2.965  11.554
  218   3HG2  THR  37          3HG2      THR  37   3.633   3.622  11.872
  219    H    ASN  38           H        ASN  38   7.714   6.653  10.115
  220    HA   ASN  38           HA       ASN  38   8.954   4.633   8.619
  221   1HB   ASN  38          1HB       ASN  38  10.351   6.854  10.122
  222   1HD2  ASN  38          1HD2      ASN  38   8.746   8.398   9.894
  223   2HD2  ASN  38          2HD2      ASN  38   8.323   9.069   8.360
  224    H    LYS  39           H        LYS  39   8.888   2.687   9.752
  225    HA   LYS  39           HA       LYS  39  11.133   2.064  11.307
  226   1HB   LYS  39          1HB       LYS  39   9.443   3.391  12.893
  227   1HG   LYS  39          1HG       LYS  39  11.574   2.564  13.682
  228   1HD   LYS  39          1HD       LYS  39  10.197  -0.072  13.474
  229   1HE   LYS  39          1HE       LYS  39  10.731  -0.115  15.781
  230   1HZ   LYS  39          1HZ       LYS  39  12.116   1.622  16.265
  231   2HZ   LYS  39          2HZ       LYS  39  13.154   1.325  14.964
  232   3HZ   LYS  39          3HZ       LYS  39  13.217   0.339  16.335
  233    H    ASP  40           H        ASP  40   7.774   1.257  10.582
  234    HA   ASP  40           HA       ASP  40   8.620  -1.527  10.150
  235   1HB   ASP  40          1HB       ASP  40   6.459  -2.304  11.036
  236    H    TRP  41           H        TRP  41   6.483  -2.652   9.075
  237    HA   TRP  41           HA       TRP  41   6.278  -1.347   6.514
  238   1HB   TRP  41          1HB       TRP  41   5.846  -4.021   7.585
  239    HD1  TRP  41           HD1      TRP  41   5.406  -5.205   4.553
  240    HE1  TRP  41           HE1      TRP  41   7.436  -5.188   2.972
  241    HE3  TRP  41           HE3      TRP  41   8.234  -1.646   6.895
  242    HZ2  TRP  41           HZ2      TRP  41   9.908  -3.846   2.745
  243    HZ3  TRP  41           HZ3      TRP  41  10.420  -1.055   5.931
  244    HH2  TRP  41           HH2      TRP  41  11.238  -2.133   3.899
  245    H    TRP  42           H        TRP  42   4.632  -0.908   9.321
  246    HA   TRP  42           HA       TRP  42   2.555  -0.192   9.923
  247   1HB   TRP  42          1HB       TRP  42   1.657   1.616   8.455
  248    HD1  TRP  42           HD1      TRP  42   1.114   0.793   5.899
  249    HE1  TRP  42           HE1      TRP  42   2.433   1.185   3.723
  250    HE3  TRP  42           HE3      TRP  42   5.638   2.067   7.909
  251    HZ2  TRP  42           HZ2      TRP  42   5.045   1.936   2.961
  252    HZ3  TRP  42           HZ3      TRP  42   7.496   2.608   6.388
  253    HH2  TRP  42           HH2      TRP  42   7.204   2.542   3.965
  254    H    LYS  43           H        LYS  43   0.220   0.372   8.719
  255    HA   LYS  43           HA       LYS  43  -0.485  -2.081   7.252
  256   1HB   LYS  43          1HB       LYS  43  -2.616  -2.138   8.483
  257   1HG   LYS  43          1HG       LYS  43  -2.331  -0.771  10.775
  258   1HD   LYS  43          1HD       LYS  43  -3.709   1.064   9.347
  259   1HE   LYS  43          1HE       LYS  43  -4.337  -0.838  11.127
  260   1HZ   LYS  43          1HZ       LYS  43  -5.504  -1.717   8.551
  261   2HZ   LYS  43          2HZ       LYS  43  -6.192  -2.118  10.043
  262   3HZ   LYS  43          3HZ       LYS  43  -4.628  -2.640   9.667
  263    H    VAL  44           H        VAL  44  -2.546  -1.911   6.048
  264    HA   VAL  44           HA       VAL  44  -3.325   0.810   5.324
  265    HB   VAL  44           HB       VAL  44  -2.622  -1.183   3.174
  266   1HG1  VAL  44          1HG1      VAL  44  -3.649   1.589   3.264
  267   2HG1  VAL  44          2HG1      VAL  44  -3.964   0.298   2.105
  268   3HG1  VAL  44          3HG1      VAL  44  -2.464   1.219   2.012
  269   1HG2  VAL  44          1HG2      VAL  44  -0.552  -0.015   2.811
  270   2HG2  VAL  44          2HG2      VAL  44  -0.611  -0.550   4.492
  271   3HG2  VAL  44          3HG2      VAL  44  -0.929   1.138   4.092
  272    H    GLU  45           H        GLU  45  -5.321   0.901   4.098
  273    HA   GLU  45           HA       GLU  45  -7.059  -1.375   4.731
  274   1HB   GLU  45          1HB       GLU  45  -7.971   1.368   3.882
  275   1HG   GLU  45          1HG       GLU  45  -6.504   1.532   5.905
  276    H    VAL  46           H        VAL  46  -9.159  -0.830   3.000
  277    HA   VAL  46           HA       VAL  46  -9.905  -1.001   0.848
  278    HB   VAL  46           HB       VAL  46  -7.588   0.388   0.434
  279   1HG1  VAL  46          1HG1      VAL  46  -6.213  -0.594  -1.167
  280   2HG1  VAL  46          2HG1      VAL  46  -7.389  -1.852  -1.548
  281   3HG1  VAL  46          3HG1      VAL  46  -6.502  -1.907  -0.026
  282   1HG2  VAL  46          1HG2      VAL  46  -9.405   1.084  -0.769
  283   2HG2  VAL  46          2HG2      VAL  46  -9.795  -0.541  -1.333
  284   3HG2  VAL  46          3HG2      VAL  46  -8.443   0.338  -2.046
  285    H    ASN  47           H        ASN  47  -8.310  -3.149   2.575
  286    HA   ASN  47           HA       ASN  47  -8.323  -5.214   0.475
  287   1HB   ASN  47          1HB       ASN  47  -6.180  -4.618   1.908
  288   1HD2  ASN  47          1HD2      ASN  47  -6.629  -5.753  -0.437
  289   2HD2  ASN  47          2HD2      ASN  47  -5.983  -7.354  -0.502
  290    H    ASP  48           H        ASP  48  -9.341  -4.388   3.734
  291    HA   ASP  48           HA       ASP  48 -11.088  -5.123   4.989
  292   1HB   ASP  48          1HB       ASP  48 -12.907  -5.692   3.817
  293    H    ARG  49           H        ARG  49  -8.417  -6.740   4.319
  294    HA   ARG  49           HA       ARG  49  -9.124  -9.308   5.471
  295   1HB   ARG  49          1HB       ARG  49  -7.174  -8.486   3.692
  296   1HG   ARG  49          1HG       ARG  49  -6.147 -10.849   4.420
  297   1HD   ARG  49          1HD       ARG  49  -8.828 -10.706   3.070
  298    HE   ARG  49           HE       ARG  49  -7.172 -12.824   3.308
  299   1HH1  ARG  49          1HH1      ARG  49  -8.118 -10.846   0.592
  300   2HH1  ARG  49          2HH1      ARG  49  -7.945 -12.128  -0.560
  301   1HH2  ARG  49          1HH2      ARG  49  -6.945 -14.509   1.794
  302   2HH2  ARG  49          2HH2      ARG  49  -7.281 -14.207   0.122
  303    H    GLN  50           H        GLN  50  -6.490  -7.030   6.236
  304    HA   GLN  50           HA       GLN  50  -7.280  -6.771   8.970
  305   1HB   GLN  50          1HB       GLN  50  -6.318  -9.058   8.985
  306   1HG   GLN  50          1HG       GLN  50  -4.194  -7.641  10.412
  307   1HE2  GLN  50          1HE2      GLN  50  -4.721 -10.326   9.871
  308   2HE2  GLN  50          2HE2      GLN  50  -5.156 -11.110  11.347
  309    H    GLY  51           H        GLY  51  -4.121  -6.873   7.305
  310   1HA   GLY  51          1HA       GLY  51  -3.802  -4.164   6.830
  311   2HA   GLY  51          2HA       GLY  51  -3.254  -4.426   8.479
  312    H    PHE  52           H        PHE  52  -1.134  -3.824   7.892
  313    HA   PHE  52           HA       PHE  52   1.026  -4.212   7.290
  314   1HB   PHE  52          1HB       PHE  52  -0.071  -7.013   7.320
  315    HD1  PHE  52           HD1      PHE  52  -0.790  -5.658   9.555
  316    HD2  PHE  52           HD2      PHE  52   3.136  -6.960   8.555
  317    HE1  PHE  52           HE1      PHE  52  -0.176  -5.627  11.938
  318    HE2  PHE  52           HE2      PHE  52   3.756  -6.931  10.935
  319    HZ   PHE  52           HZ       PHE  52   2.098  -6.264  12.630
  320    H    VAL  53           H        VAL  53   1.676  -3.374   5.423
  321    HA   VAL  53           HA       VAL  53   1.155  -4.858   2.957
  322    HB   VAL  53           HB       VAL  53   0.761  -1.872   3.117
  323   1HG1  VAL  53          1HG1      VAL  53  -0.291  -2.253   0.873
  324   2HG1  VAL  53          2HG1      VAL  53   0.333  -3.902   0.934
  325   3HG1  VAL  53          3HG1      VAL  53   1.449  -2.537   0.936
  326   1HG2  VAL  53          1HG2      VAL  53  -1.114  -4.107   3.568
  327   2HG2  VAL  53          2HG2      VAL  53  -1.684  -2.814   2.513
  328   3HG2  VAL  53          3HG2      VAL  53  -1.162  -2.444   4.156
  329    HA   PRO  54           HA       PRO  54   5.501  -4.200   2.312
  330   1HB   PRO  54          1HB       PRO  54   4.764  -4.154  -0.567
  331   1HG   PRO  54          1HG       PRO  54   3.613  -6.173  -0.526
  332   1HD   PRO  54          1HD       PRO  54   2.066  -4.787   0.486
  333    H    ALA  55           H        ALA  55   3.473  -2.466  -0.064
  334    HA   ALA  55           HA       ALA  55   3.377  -0.265  -0.655
  335   1HB   ALA  55          1HB       ALA  55   4.056   1.425   0.832
  336   2HB   ALA  55          2HB       ALA  55   5.275   0.392   1.580
  337   3HB   ALA  55          3HB       ALA  55   3.561   0.078   1.857
  338    H    ALA  56           H        ALA  56   6.702  -0.791   0.546
  339    HA   ALA  56           HA       ALA  56   8.721  -0.706  -0.507
  340   1HB   ALA  56          1HB       ALA  56   7.251  -0.536  -3.130
  341   2HB   ALA  56          2HB       ALA  56   7.530  -2.051  -2.270
  342   3HB   ALA  56          3HB       ALA  56   8.899  -1.096  -2.840
  343    H    TYR  57           H        TYR  57   6.714   1.291  -2.680
  344    HA   TYR  57           HA       TYR  57   7.952   3.702  -1.642
  345   1HB   TYR  57          1HB       TYR  57   8.441   4.383  -4.113
  346    HD1  TYR  57           HD1      TYR  57   9.271   0.783  -3.552
  347    HD2  TYR  57           HD2      TYR  57   7.746   3.727  -6.218
  348    HE1  TYR  57           HE1      TYR  57   9.140  -0.906  -5.333
  349    HE2  TYR  57           HE2      TYR  57   7.610   2.046  -8.007
  350    HH   TYR  57           HH       TYR  57   8.801  -0.179  -8.535
  351    H    VAL  58           H        VAL  58   6.099   2.661  -4.510
  352    HA   VAL  58           HA       VAL  58   4.303   3.638  -5.541
  353    HB   VAL  58           HB       VAL  58   3.357   2.148  -3.774
  354   1HG1  VAL  58          1HG1      VAL  58   3.573   2.920  -1.677
  355   2HG1  VAL  58          2HG1      VAL  58   2.071   3.772  -2.028
  356   3HG1  VAL  58          3HG1      VAL  58   3.612   4.606  -2.185
  357   1HG2  VAL  58          1HG2      VAL  58   1.569   4.503  -4.265
  358   2HG2  VAL  58          2HG2      VAL  58   1.143   2.795  -4.176
  359   3HG2  VAL  58          3HG2      VAL  58   2.055   3.406  -5.555
  360    H    LYS  59           H        LYS  59   6.051   5.639  -5.229
  361    HA   LYS  59           HA       LYS  59   6.121   7.915  -5.392
  362   1HB   LYS  59          1HB       LYS  59   3.262   8.037  -4.445
  363   1HG   LYS  59          1HG       LYS  59   4.215   7.710  -7.282
  364   1HD   LYS  59          1HD       LYS  59   1.369   7.836  -6.363
  365   1HE   LYS  59          1HE       LYS  59   2.472   7.195  -8.755
  366   1HZ   LYS  59          1HZ       LYS  59   2.125  10.114  -8.681
  367   2HZ   LYS  59          2HZ       LYS  59   1.775   9.270 -10.104
  368   3HZ   LYS  59          3HZ       LYS  59   3.328   9.197  -9.438
  369    H    LYS  60           H        LYS  60   6.711   6.389  -2.984
  370    HA   LYS  60           HA       LYS  60   7.373   6.754  -0.841
  371   1HB   LYS  60          1HB       LYS  60   7.076   9.550  -1.870
  372   1HG   LYS  60          1HG       LYS  60   9.137   7.871  -2.073
  373   1HD   LYS  60          1HD       LYS  60   9.126   8.193   0.622
  374   1HE   LYS  60          1HE       LYS  60   9.681  10.632   0.252
  375   1HZ   LYS  60          1HZ       LYS  60  12.200  10.890  -0.070
  376   2HZ   LYS  60          2HZ       LYS  60  11.233  10.692  -1.442
  377   3HZ   LYS  60          3HZ       LYS  60  12.121   9.385  -0.839
  378    H    LEU  61           H        LEU  61   5.083   9.458  -0.990
  379    HA   LEU  61           HA       LEU  61   2.867   8.156   0.110
  380   1HB   LEU  61          1HB       LEU  61   4.254   7.809   2.068
  381    HG   LEU  61           HG       LEU  61   2.069   9.833   2.402
  382   1HD1  LEU  61          1HD1      LEU  61   1.302   7.634   1.986
  383   2HD1  LEU  61          2HD1      LEU  61   1.113   7.908   3.718
  384   3HD1  LEU  61          3HD1      LEU  61   2.460   6.939   3.119
  385   1HD2  LEU  61          1HD2      LEU  61   4.134   9.942   4.101
  386   2HD2  LEU  61          2HD2      LEU  61   3.225   8.621   4.838
  387   3HD2  LEU  61          3HD2      LEU  61   2.461  10.193   4.601
  388    H    ASP  62           H        ASP  62   2.149   9.594  -1.600
  389    HA   ASP  62           HA       ASP  62   2.277  12.434  -1.235
  390   1HB   ASP  62          1HB       ASP  62   0.456  10.859  -3.065
  Start of MODEL   10
    1    H    GLU   7           H        GLU   7  -2.573  14.179  -4.257
    2    HA   GLU   7           HA       GLU   7  -2.347  13.186  -6.302
    3   1HB   GLU   7          1HB       GLU   7  -0.071  12.889  -6.999
    4   1HG   GLU   7          1HG       GLU   7   0.497  11.588  -4.759
    5    H    LEU   8           H        LEU   8  -3.462  11.414  -4.438
    6    HA   LEU   8           HA       LEU   8  -3.952   9.214  -4.124
    7   1HB   LEU   8          1HB       LEU   8  -2.487   8.453  -6.603
    8    HG   LEU   8           HG       LEU   8  -3.674  10.675  -7.063
    9   1HD1  LEU   8          1HD1      LEU   8  -3.002   8.830  -8.706
   10   2HD1  LEU   8          2HD1      LEU   8  -4.221   9.993  -9.226
   11   3HD1  LEU   8          3HD1      LEU   8  -4.710   8.383  -8.697
   12   1HD2  LEU   8          1HD2      LEU   8  -5.697   9.722  -5.652
   13   2HD2  LEU   8          2HD2      LEU   8  -6.180   9.089  -7.226
   14   3HD2  LEU   8          3HD2      LEU   8  -5.949  10.823  -7.008
   15    H    VAL   9           H        VAL   9  -2.553   6.894  -4.913
   16    HA   VAL   9           HA       VAL   9   0.107   7.150  -3.744
   17    HB   VAL   9           HB       VAL   9  -1.875   5.137  -2.680
   18   1HG1  VAL   9          1HG1      VAL   9   0.594   5.857  -1.224
   19   2HG1  VAL   9          2HG1      VAL   9   0.795   4.918  -2.704
   20   3HG1  VAL   9          3HG1      VAL   9  -0.211   4.298  -1.395
   21   1HG2  VAL   9          1HG2      VAL   9  -0.874   7.643  -1.332
   22   2HG2  VAL   9          2HG2      VAL   9  -2.004   6.462  -0.669
   23   3HG2  VAL   9          3HG2      VAL   9  -2.475   7.454  -2.047
   24    H    LEU  10           H        LEU  10  -2.307   5.099  -5.312
   25    HA   LEU  10           HA       LEU  10  -2.121   3.490  -6.909
   26   1HB   LEU  10          1HB       LEU  10   0.819   3.920  -7.180
   27    HG   LEU  10           HG       LEU  10   0.089   6.220  -7.125
   28   1HD1  LEU  10          1HD1      LEU  10   1.715   5.560  -8.842
   29   2HD1  LEU  10          2HD1      LEU  10   0.707   6.910  -9.364
   30   3HD1  LEU  10          3HD1      LEU  10   0.391   5.286  -9.975
   31   1HD2  LEU  10          1HD2      LEU  10  -2.149   5.166  -8.790
   32   2HD2  LEU  10          2HD2      LEU  10  -1.626   6.836  -9.005
   33   3HD2  LEU  10          3HD2      LEU  10  -2.188   6.284  -7.428
   34    H    ALA  11           H        ALA  11  -1.248   1.327  -7.261
   35    HA   ALA  11           HA       ALA  11  -0.097   0.237  -4.779
   36   1HB   ALA  11          1HB       ALA  11  -1.077  -1.954  -5.892
   37   2HB   ALA  11          2HB       ALA  11  -2.120  -0.783  -6.698
   38   3HB   ALA  11          3HB       ALA  11  -2.085  -0.866  -4.937
   39    H    LEU  12           H        LEU  12   0.326   0.552  -8.199
   40    HA   LEU  12           HA       LEU  12   1.927  -0.145  -9.656
   41   1HB   LEU  12          1HB       LEU  12   3.437   0.062  -7.069
   42    HG   LEU  12           HG       LEU  12   2.830   2.200  -8.073
   43   1HD1  LEU  12          1HD1      LEU  12   5.273   1.505  -7.184
   44   2HD1  LEU  12          2HD1      LEU  12   4.835   3.142  -7.673
   45   3HD1  LEU  12          3HD1      LEU  12   5.680   2.081  -8.801
   46   1HD2  LEU  12          1HD2      LEU  12   4.017   0.958 -10.524
   47   2HD2  LEU  12          2HD2      LEU  12   4.000   2.710 -10.319
   48   3HD2  LEU  12          3HD2      LEU  12   2.484   1.809 -10.333
   49    H    TYR  13           H        TYR  13   0.293  -2.175  -9.104
   50    HA   TYR  13           HA       TYR  13   0.153  -4.424  -9.458
   51   1HB   TYR  13          1HB       TYR  13   2.530  -3.953 -10.542
   52    HD1  TYR  13           HD1      TYR  13   1.381  -5.036 -12.344
   53    HD2  TYR  13           HD2      TYR  13   2.421  -7.218  -8.843
   54    HE1  TYR  13           HE1      TYR  13   0.873  -7.140 -13.511
   55    HE2  TYR  13           HE2      TYR  13   1.916  -9.328  -9.999
   56    HH   TYR  13           HH       TYR  13   1.832  -9.800 -13.012
   57    H    ASP  14           H        ASP  14   0.110  -6.340  -8.221
   58    HA   ASP  14           HA       ASP  14  -0.257  -6.106  -5.531
   59   1HB   ASP  14          1HB       ASP  14   0.805  -8.615  -6.834
   60    H    TYR  15           H        TYR  15   0.927  -6.813  -3.677
   61    HA   TYR  15           HA       TYR  15   3.609  -5.872  -3.640
   62   1HB   TYR  15          1HB       TYR  15   2.325  -5.523  -1.670
   63    HD1  TYR  15           HD1      TYR  15   4.947  -5.107  -1.532
   64    HD2  TYR  15           HD2      TYR  15   2.952  -8.563  -0.057
   65    HE1  TYR  15           HE1      TYR  15   6.834  -5.544  -0.017
   66    HE2  TYR  15           HE2      TYR  15   4.832  -9.009   1.463
   67    HH   TYR  15           HH       TYR  15   7.189  -8.491   1.676
   68    H    GLN  16           H        GLN  16   2.353  -9.071  -2.662
   69    HA   GLN  16           HA       GLN  16   4.083 -10.576  -4.275
   70   1HB   GLN  16          1HB       GLN  16   5.885  -9.682  -2.951
   71   1HG   GLN  16          1HG       GLN  16   5.606 -12.295  -1.589
   72   1HE2  GLN  16          1HE2      GLN  16   7.641 -13.333  -3.399
   73   2HE2  GLN  16          2HE2      GLN  16   9.113 -12.537  -2.972
   74    H    GLU  17           H        GLU  17   2.279 -10.362  -1.271
   75    HA   GLU  17           HA       GLU  17   0.609 -11.713  -0.476
   76   1HB   GLU  17          1HB       GLU  17   1.382 -13.807  -2.511
   77   1HG   GLU  17          1HG       GLU  17  -0.770 -11.728  -2.817
   78    H    LYS  18           H        LYS  18   0.427 -13.713   0.818
   79    HA   LYS  18           HA       LYS  18   3.068 -14.443   1.865
   80   1HB   LYS  18          1HB       LYS  18   1.170 -13.431   3.310
   81   1HG   LYS  18          1HG       LYS  18   1.650 -15.116   5.201
   82   1HD   LYS  18          1HD       LYS  18   2.943 -12.907   4.354
   83   1HE   LYS  18          1HE       LYS  18   4.708 -15.212   3.825
   84   1HZ   LYS  18          1HZ       LYS  18   5.858 -12.722   4.941
   85   2HZ   LYS  18          2HZ       LYS  18   6.670 -14.147   4.525
   86   3HZ   LYS  18          3HZ       LYS  18   5.640 -14.122   5.866
   87    H    SER  19           H        SER  19  -0.087 -16.111   1.698
   88    HA   SER  19           HA       SER  19   0.631 -18.165  -0.006
   89   1HB   SER  19          1HB       SER  19   2.302 -19.033   1.362
   90    HG   SER  19           HG       SER  19   0.923 -20.688   2.751
   91    HA   PRO  20           HA       PRO  20  -3.072 -19.778   2.816
   92   1HB   PRO  20          1HB       PRO  20  -3.957 -17.697   4.472
   93   1HG   PRO  20          1HG       PRO  20  -2.056 -16.401   4.439
   94   1HD   PRO  20          1HD       PRO  20  -0.080 -17.142   3.477
   95    H    ARG  21           H        ARG  21  -3.667 -16.285   3.012
   96    HA   ARG  21           HA       ARG  21  -5.821 -16.616   1.068
   97   1HB   ARG  21          1HB       ARG  21  -5.408 -14.975   3.401
   98   1HG   ARG  21          1HG       ARG  21  -7.939 -14.575   2.076
   99   1HD   ARG  21          1HD       ARG  21  -6.944 -15.764   4.635
  100    HE   ARG  21           HE       ARG  21  -9.773 -15.658   4.535
  101   1HH1  ARG  21          1HH1      ARG  21  -7.064 -17.657   3.618
  102   2HH1  ARG  21          2HH1      ARG  21  -7.970 -19.132   3.681
  103   1HH2  ARG  21          1HH2      ARG  21 -10.967 -17.596   4.619
  104   2HH2  ARG  21          2HH2      ARG  21 -10.185 -19.096   4.249
  105    H    GLU  22           H        GLU  22  -3.892 -13.700   1.650
  106    HA   GLU  22           HA       GLU  22  -2.356 -13.779  -0.687
  107   1HB   GLU  22          1HB       GLU  22  -4.517 -13.673  -1.842
  108   1HG   GLU  22          1HG       GLU  22  -2.711 -11.313  -2.030
  109    H    VAL  23           H        VAL  23  -4.348 -11.072   0.491
  110    HA   VAL  23           HA       VAL  23  -3.792  -9.080   1.446
  111    HB   VAL  23           HB       VAL  23  -1.385 -10.545   2.536
  112   1HG1  VAL  23          1HG1      VAL  23  -1.537  -8.892   4.354
  113   2HG1  VAL  23          2HG1      VAL  23  -2.849  -8.088   3.491
  114   3HG1  VAL  23          3HG1      VAL  23  -1.233  -8.141   2.787
  115   1HG2  VAL  23          1HG2      VAL  23  -3.252 -10.436   4.551
  116   2HG2  VAL  23          2HG2      VAL  23  -2.874 -11.852   3.572
  117   3HG2  VAL  23          3HG2      VAL  23  -4.227 -10.811   3.130
  118    H    THR  24           H        THR  24  -3.380  -8.294  -0.744
  119    HA   THR  24           HA       THR  24  -0.742  -7.153  -0.955
  120    HB   THR  24           HB       THR  24  -0.387  -8.012  -3.284
  121    HG1  THR  24           HG1      THR  24  -2.690  -9.439  -2.615
  122   1HG2  THR  24          1HG2      THR  24  -0.530 -10.337  -1.415
  123   2HG2  THR  24          2HG2      THR  24   0.660  -9.052  -1.207
  124   3HG2  THR  24          3HG2      THR  24   0.639 -10.004  -2.691
  125    H    MET  25           H        MET  25  -0.608  -5.939  -3.179
  126    HA   MET  25           HA       MET  25  -3.082  -4.391  -3.408
  127   1HB   MET  25          1HB       MET  25  -0.573  -3.520  -4.756
  128   1HG   MET  25          1HG       MET  25   0.108  -4.285  -2.439
  129   1HE   MET  25          1HE       MET  25  -0.758  -0.760  -0.020
  130   2HE   MET  25          2HE       MET  25   0.217  -0.907  -1.481
  131   3HE   MET  25          3HE       MET  25   0.626  -1.853  -0.049
  132    H    LYS  26           H        LYS  26  -2.536  -3.248  -5.955
  133    HA   LYS  26           HA       LYS  26  -2.387  -5.475  -7.817
  134   1HB   LYS  26          1HB       LYS  26  -4.860  -3.806  -7.412
  135   1HG   LYS  26          1HG       LYS  26  -4.918  -5.875  -6.206
  136   1HD   LYS  26          1HD       LYS  26  -3.529  -6.887  -8.533
  137   1HE   LYS  26          1HE       LYS  26  -4.757  -9.193  -8.126
  138   1HZ   LYS  26          1HZ       LYS  26  -6.059  -7.242  -9.925
  139   2HZ   LYS  26          2HZ       LYS  26  -5.844  -8.903 -10.156
  140   3HZ   LYS  26          3HZ       LYS  26  -4.518  -7.859 -10.249
  141    H    LYS  27           H        LYS  27  -2.762  -4.575 -10.148
  142    HA   LYS  27           HA       LYS  27  -0.735  -2.744 -10.693
  143   1HB   LYS  27          1HB       LYS  27  -3.088  -3.279 -12.502
  144   1HG   LYS  27          1HG       LYS  27  -0.834  -5.063 -11.749
  145   1HD   LYS  27          1HD       LYS  27  -0.376  -4.564 -14.095
  146   1HE   LYS  27          1HE       LYS  27  -2.764  -3.898 -14.611
  147   1HZ   LYS  27          1HZ       LYS  27  -3.212  -6.703 -15.353
  148   2HZ   LYS  27          2HZ       LYS  27  -4.339  -5.472 -15.079
  149   3HZ   LYS  27          3HZ       LYS  27  -3.558  -6.212 -13.772
  150    H    GLY  28           H        GLY  28  -0.786  -0.748  -9.818
  151   1HA   GLY  28          1HA       GLY  28  -1.527   1.364  -9.271
  152   2HA   GLY  28          2HA       GLY  28  -2.113   1.358 -10.925
  153    H    ASP  29           H        ASP  29  -3.290  -0.676  -8.290
  154    HA   ASP  29           HA       ASP  29  -5.972   0.356  -8.751
  155   1HB   ASP  29          1HB       ASP  29  -5.474  -2.111  -8.573
  156    H    ILE  30           H        ILE  30  -3.670   1.713  -7.168
  157    HA   ILE  30           HA       ILE  30  -3.427   3.029  -5.334
  158    HB   ILE  30           HB       ILE  30  -6.377   3.155  -4.919
  159   1HG1  ILE  30          1HG1      ILE  30  -6.210   3.103  -7.346
  160   1HG2  ILE  30          1HG2      ILE  30  -4.022   4.762  -4.380
  161   2HG2  ILE  30          2HG2      ILE  30  -5.621   4.817  -3.642
  162   3HG2  ILE  30          3HG2      ILE  30  -5.310   5.695  -5.139
  163   1HD1  ILE  30          1HD1      ILE  30  -4.223   3.683  -8.204
  164   2HD1  ILE  30          2HD1      ILE  30  -3.876   4.827  -6.908
  165   3HD1  ILE  30          3HD1      ILE  30  -4.937   5.296  -8.236
  166    H    LEU  31           H        LEU  31  -4.228   3.347  -2.962
  167    HA   LEU  31           HA       LEU  31  -5.431   1.250  -1.550
  168   1HB   LEU  31          1HB       LEU  31  -3.511   0.160  -0.554
  169    HG   LEU  31           HG       LEU  31  -1.262   0.452  -1.848
  170   1HD1  LEU  31          1HD1      LEU  31  -2.120   2.122  -3.440
  171   2HD1  LEU  31          2HD1      LEU  31  -0.753   2.719  -2.501
  172   3HD1  LEU  31          3HD1      LEU  31  -2.391   3.234  -2.098
  173   1HD2  LEU  31          1HD2      LEU  31  -1.777   0.853   0.595
  174   2HD2  LEU  31          2HD2      LEU  31  -1.964   2.556   0.175
  175   3HD2  LEU  31          3HD2      LEU  31  -0.417   1.750  -0.079
  176    H    THR  32           H        THR  32  -4.213   1.332   0.880
  177    HA   THR  32           HA       THR  32  -4.069   4.208   1.509
  178    HB   THR  32           HB       THR  32  -5.367   2.037   3.163
  179    HG1  THR  32           HG1      THR  32  -6.405   4.160   1.611
  180   1HG2  THR  32          1HG2      THR  32  -6.208   3.980   4.508
  181   2HG2  THR  32          2HG2      THR  32  -4.992   4.966   3.697
  182   3HG2  THR  32          3HG2      THR  32  -4.496   3.602   4.699
  183    H    LEU  33           H        LEU  33  -2.974   4.696   3.574
  184    HA   LEU  33           HA       LEU  33  -0.799   2.783   4.105
  185   1HB   LEU  33          1HB       LEU  33  -0.584   5.780   4.304
  186    HG   LEU  33           HG       LEU  33   0.844   5.664   2.259
  187   1HD1  LEU  33          1HD1      LEU  33   1.081   3.137   2.430
  188   2HD1  LEU  33          2HD1      LEU  33   0.821   3.813   0.822
  189   3HD1  LEU  33          3HD1      LEU  33  -0.514   3.051   1.684
  190   1HD2  LEU  33          1HD2      LEU  33  -1.779   4.794   1.263
  191   2HD2  LEU  33          2HD2      LEU  33  -0.892   6.292   0.979
  192   3HD2  LEU  33          3HD2      LEU  33  -1.822   6.086   2.463
  193    H    LEU  34           H        LEU  34  -2.274   5.695   5.551
  194    HA   LEU  34           HA       LEU  34  -2.903   6.184   7.681
  195   1HB   LEU  34          1HB       LEU  34  -4.033   3.820   7.187
  196    HG   LEU  34           HG       LEU  34  -4.716   5.697   8.904
  197   1HD1  LEU  34          1HD1      LEU  34  -5.803   3.076   9.707
  198   2HD1  LEU  34          2HD1      LEU  34  -5.891   3.466   7.989
  199   3HD1  LEU  34          3HD1      LEU  34  -6.632   4.539   9.176
  200   1HD2  LEU  34          1HD2      LEU  34  -4.719   4.345  11.197
  201   2HD2  LEU  34          2HD2      LEU  34  -3.426   5.461  10.759
  202   3HD2  LEU  34          3HD2      LEU  34  -3.210   3.728  10.525
  203    H    ASN  35           H        ASN  35  -1.463   7.061   8.998
  204    HA   ASN  35           HA       ASN  35   0.303   7.344  10.402
  205   1HB   ASN  35          1HB       ASN  35  -0.168   4.388  10.795
  206   1HD2  ASN  35          1HD2      ASN  35  -1.413   3.895  12.567
  207   2HD2  ASN  35          2HD2      ASN  35  -2.362   5.073  13.401
  208    H    SER  36           H        SER  36   1.722   7.958   8.739
  209    HA   SER  36           HA       SER  36   4.028   6.285   8.474
  210   1HB   SER  36          1HB       SER  36   2.179   6.667   6.134
  211    HG   SER  36           HG       SER  36   3.774   4.421   6.646
  212    H    THR  37           H        THR  37   5.734   7.364   7.116
  213    HA   THR  37           HA       THR  37   5.365  10.236   6.767
  214    HB   THR  37           HB       THR  37   7.704   9.225   8.374
  215    HG1  THR  37           HG1      THR  37   6.532   9.966  10.206
  216   1HG2  THR  37          1HG2      THR  37   7.073  11.736   7.286
  217   2HG2  THR  37          2HG2      THR  37   8.387  11.321   8.386
  218   3HG2  THR  37          3HG2      THR  37   6.834  11.855   9.030
  219    H    ASN  38           H        ASN  38   8.068   7.906   6.889
  220    HA   ASN  38           HA       ASN  38   8.565   8.383   4.049
  221   1HB   ASN  38          1HB       ASN  38  11.035   8.623   4.566
  222   1HD2  ASN  38          1HD2      ASN  38  12.340   9.987   6.189
  223   2HD2  ASN  38          2HD2      ASN  38  12.249   9.462   7.833
  224    H    LYS  39           H        LYS  39   9.659   6.638   6.951
  225    HA   LYS  39           HA       LYS  39   9.941   4.231   5.273
  226   1HB   LYS  39          1HB       LYS  39  12.013   5.491   6.519
  227   1HG   LYS  39          1HG       LYS  39  12.119   3.582   4.892
  228   1HD   LYS  39          1HD       LYS  39  12.488   1.688   7.114
  229   1HE   LYS  39          1HE       LYS  39  11.338   0.190   5.502
  230   1HZ   LYS  39          1HZ       LYS  39  13.120   0.756   3.623
  231   2HZ   LYS  39          2HZ       LYS  39  13.519  -0.034   5.063
  232   3HZ   LYS  39          3HZ       LYS  39  13.790   1.628   4.909
  233    H    ASP  40           H        ASP  40   7.922   3.404   5.745
  234    HA   ASP  40           HA       ASP  40   7.670   1.835   8.052
  235   1HB   ASP  40          1HB       ASP  40   5.668   3.053   9.052
  236    H    TRP  41           H        TRP  41   5.465   0.834   8.225
  237    HA   TRP  41           HA       TRP  41   3.982   0.950   5.694
  238   1HB   TRP  41          1HB       TRP  41   3.831  -1.501   5.642
  239    HD1  TRP  41           HD1      TRP  41   3.322  -3.295   7.405
  240    HE1  TRP  41           HE1      TRP  41   4.566  -4.278   9.431
  241    HE3  TRP  41           HE3      TRP  41   7.338  -0.132   7.506
  242    HZ2  TRP  41           HZ2      TRP  41   6.936  -3.780  10.882
  243    HZ3  TRP  41           HZ3      TRP  41   9.048  -0.454   9.245
  244    HH2  TRP  41           HH2      TRP  41   8.850  -2.241  10.897
  245    H    TRP  42           H        TRP  42   4.019  -0.320   9.012
  246    HA   TRP  42           HA       TRP  42   2.396  -0.521  10.587
  247   1HB   TRP  42          1HB       TRP  42   1.571   1.803   8.979
  248    HD1  TRP  42           HD1      TRP  42  -0.090   2.333  12.056
  249    HE1  TRP  42           HE1      TRP  42   1.423   3.408  13.841
  250    HE3  TRP  42           HE3      TRP  42   4.466   1.408   9.927
  251    HZ2  TRP  42           HZ2      TRP  42   4.181   3.809  14.288
  252    HZ3  TRP  42           HZ3      TRP  42   6.492   2.170  11.098
  253    HH2  TRP  42           HH2      TRP  42   6.351   3.346  13.232
  254    H    LYS  43           H        LYS  43   0.168   0.132   7.909
  255    HA   LYS  43           HA       LYS  43  -0.417  -2.517   7.230
  256   1HB   LYS  43          1HB       LYS  43  -2.568  -2.840   8.372
  257   1HG   LYS  43          1HG       LYS  43  -1.994  -0.151   9.438
  258   1HD   LYS  43          1HD       LYS  43  -3.414  -2.208  11.118
  259   1HE   LYS  43          1HE       LYS  43  -3.040   0.707  11.230
  260   1HZ   LYS  43          1HZ       LYS  43  -1.593  -0.124  13.056
  261   2HZ   LYS  43          2HZ       LYS  43  -2.949  -0.867  13.742
  262   3HZ   LYS  43          3HZ       LYS  43  -2.899   0.816  13.583
  263    H    VAL  44           H        VAL  44  -0.752  -1.913   5.166
  264    HA   VAL  44           HA       VAL  44  -1.879   0.397   4.191
  265    HB   VAL  44           HB       VAL  44  -1.759  -2.387   3.063
  266   1HG1  VAL  44          1HG1      VAL  44  -3.736  -1.600   2.044
  267   2HG1  VAL  44          2HG1      VAL  44  -2.451  -1.339   0.865
  268   3HG1  VAL  44          3HG1      VAL  44  -3.069   0.013   1.812
  269   1HG2  VAL  44          1HG2      VAL  44   0.035  -1.628   1.844
  270   2HG2  VAL  44          2HG2      VAL  44   0.198  -0.667   3.315
  271   3HG2  VAL  44          3HG2      VAL  44  -0.516   0.046   1.870
  272    H    GLU  45           H        GLU  45  -3.526  -2.593   5.128
  273    HA   GLU  45           HA       GLU  45  -5.709  -3.080   5.533
  274   1HB   GLU  45          1HB       GLU  45  -5.382  -1.183   7.133
  275   1HG   GLU  45          1HG       GLU  45  -7.969  -2.001   6.035
  276    H    VAL  46           H        VAL  46  -5.039  -2.835   2.834
  277    HA   VAL  46           HA       VAL  46  -7.349  -1.467   1.644
  278    HB   VAL  46           HB       VAL  46  -5.129  -0.913   0.699
  279   1HG1  VAL  46          1HG1      VAL  46  -3.780  -2.462  -0.433
  280   2HG1  VAL  46          2HG1      VAL  46  -5.043  -3.692  -0.434
  281   3HG1  VAL  46          3HG1      VAL  46  -4.227  -3.269   1.071
  282   1HG2  VAL  46          1HG2      VAL  46  -6.953  -2.390  -1.195
  283   2HG2  VAL  46          2HG2      VAL  46  -5.749  -1.184  -1.648
  284   3HG2  VAL  46          3HG2      VAL  46  -7.140  -0.717  -0.670
  285    H    ASN  47           H        ASN  47  -6.001  -4.580   2.289
  286    HA   ASN  47           HA       ASN  47  -7.939  -5.892   0.523
  287   1HB   ASN  47          1HB       ASN  47  -6.662  -7.944   0.953
  288   1HD2  ASN  47          1HD2      ASN  47  -4.295  -5.541   1.912
  289   2HD2  ASN  47          2HD2      ASN  47  -3.793  -6.340   3.358
  290    H    ASP  48           H        ASP  48  -8.405  -8.244   1.785
  291    HA   ASP  48           HA       ASP  48  -9.836  -7.394   4.212
  292   1HB   ASP  48          1HB       ASP  48 -11.152  -8.208   2.178
  293    H    ARG  49           H        ARG  49  -7.504  -7.835   5.057
  294    HA   ARG  49           HA       ARG  49  -7.610 -10.106   6.697
  295   1HB   ARG  49          1HB       ARG  49  -7.014 -11.085   4.371
  296   1HG   ARG  49          1HG       ARG  49  -5.170 -11.723   6.664
  297   1HD   ARG  49          1HD       ARG  49  -6.161 -13.420   4.379
  298    HE   ARG  49           HE       ARG  49  -5.553 -15.045   5.873
  299   1HH1  ARG  49          1HH1      ARG  49  -3.195 -12.475   5.974
  300   2HH1  ARG  49          2HH1      ARG  49  -2.098 -13.351   6.988
  301   1HH2  ARG  49          1HH2      ARG  49  -4.111 -16.200   7.205
  302   2HH2  ARG  49          2HH2      ARG  49  -2.618 -15.466   7.685
  303    H    GLN  50           H        GLN  50  -6.902  -8.982   8.405
  304    HA   GLN  50           HA       GLN  50  -5.510  -7.877   9.817
  305   1HB   GLN  50          1HB       GLN  50  -3.920  -9.629   9.303
  306   1HG   GLN  50          1HG       GLN  50  -1.736  -8.392   9.401
  307   1HE2  GLN  50          1HE2      GLN  50  -3.927  -6.259  11.033
  308   2HE2  GLN  50          2HE2      GLN  50  -3.766  -6.961  12.603
  309    H    GLY  51           H        GLY  51  -3.641  -7.125   6.894
  310   1HA   GLY  51          1HA       GLY  51  -4.264  -4.982   5.717
  311   2HA   GLY  51          2HA       GLY  51  -4.320  -4.281   7.326
  312    H    PHE  52           H        PHE  52  -1.857  -6.440   7.460
  313    HA   PHE  52           HA       PHE  52   0.185  -4.679   7.817
  314   1HB   PHE  52          1HB       PHE  52   0.027  -7.538   7.100
  315    HD1  PHE  52           HD1      PHE  52  -0.812  -6.207   9.555
  316    HD2  PHE  52           HD2      PHE  52   3.045  -7.535   8.344
  317    HE1  PHE  52           HE1      PHE  52  -0.157  -6.446  11.914
  318    HE2  PHE  52           HE2      PHE  52   3.706  -7.777  10.702
  319    HZ   PHE  52           HZ       PHE  52   2.105  -7.232  12.491
  320    H    VAL  53           H        VAL  53   0.389  -6.674   4.895
  321    HA   VAL  53           HA       VAL  53   1.239  -6.212   2.826
  322    HB   VAL  53           HB       VAL  53  -0.157  -3.556   2.963
  323   1HG1  VAL  53          1HG1      VAL  53  -0.788  -4.702   0.590
  324   2HG1  VAL  53          2HG1      VAL  53   0.805  -5.395   0.886
  325   3HG1  VAL  53          3HG1      VAL  53   0.599  -3.645   0.848
  326   1HG2  VAL  53          1HG2      VAL  53  -1.538  -6.193   2.483
  327   2HG2  VAL  53          2HG2      VAL  53  -2.273  -4.590   2.501
  328   3HG2  VAL  53          3HG2      VAL  53  -1.629  -5.282   3.990
  329    HA   PRO  54           HA       PRO  54   4.791  -3.751   4.536
  330   1HB   PRO  54          1HB       PRO  54   6.030  -5.370   2.362
  331   1HG   PRO  54          1HG       PRO  54   5.565  -7.410   3.380
  332   1HD   PRO  54          1HD       PRO  54   3.469  -6.895   2.573
  333    H    ALA  55           H        ALA  55   5.568  -1.867   3.733
  334    HA   ALA  55           HA       ALA  55   4.599  -1.022   1.134
  335   1HB   ALA  55          1HB       ALA  55   5.654   1.189   1.863
  336   2HB   ALA  55          2HB       ALA  55   5.898   0.414   3.428
  337   3HB   ALA  55          3HB       ALA  55   4.267   0.605   2.781
  338    H    ALA  56           H        ALA  56   6.288  -2.901   0.500
  339    HA   ALA  56           HA       ALA  56   8.940  -1.750   0.050
  340   1HB   ALA  56          1HB       ALA  56   8.347  -4.224   0.784
  341   2HB   ALA  56          2HB       ALA  56   9.726  -3.873  -0.257
  342   3HB   ALA  56          3HB       ALA  56   8.216  -4.450  -0.961
  343    H    TYR  57           H        TYR  57   6.737  -0.565  -1.289
  344    HA   TYR  57           HA       TYR  57   7.710  -0.459  -3.927
  345   1HB   TYR  57          1HB       TYR  57   5.939  -2.617  -3.426
  346    HD1  TYR  57           HD1      TYR  57   6.294  -4.326  -4.973
  347    HD2  TYR  57           HD2      TYR  57   7.255  -0.320  -6.027
  348    HE1  TYR  57           HE1      TYR  57   7.381  -5.133  -7.023
  349    HE2  TYR  57           HE2      TYR  57   8.345  -1.116  -8.080
  350    HH   TYR  57           HH       TYR  57   9.329  -4.112  -8.594
  351    H    VAL  58           H        VAL  58   5.530   0.388  -5.328
  352    HA   VAL  58           HA       VAL  58   4.146   2.161  -5.662
  353    HB   VAL  58           HB       VAL  58   3.711   2.015  -2.678
  354   1HG1  VAL  58          1HG1      VAL  58   2.087   3.279  -4.879
  355   2HG1  VAL  58          2HG1      VAL  58   2.910   4.105  -3.556
  356   3HG1  VAL  58          3HG1      VAL  58   1.529   3.061  -3.220
  357   1HG2  VAL  58          1HG2      VAL  58   2.781   0.359  -4.926
  358   2HG2  VAL  58          2HG2      VAL  58   1.536   0.857  -3.783
  359   3HG2  VAL  58          3HG2      VAL  58   2.947  -0.036  -3.215
  360    H    LYS  59           H        LYS  59   3.962   4.464  -5.408
  361    HA   LYS  59           HA       LYS  59   6.390   5.790  -5.152
  362   1HB   LYS  59          1HB       LYS  59   4.895   7.876  -4.954
  363   1HG   LYS  59          1HG       LYS  59   2.711   5.979  -5.741
  364   1HD   LYS  59          1HD       LYS  59   1.304   7.936  -5.174
  365   1HE   LYS  59          1HE       LYS  59   3.293   9.021  -7.085
  366   1HZ   LYS  59          1HZ       LYS  59   1.126  10.015  -6.949
  367   2HZ   LYS  59          2HZ       LYS  59   0.369   8.523  -7.199
  368   3HZ   LYS  59          3HZ       LYS  59   1.272   9.230  -8.441
  369    H    LYS  60           H        LYS  60   7.573   6.274  -3.436
  370    HA   LYS  60           HA       LYS  60   6.610   5.915  -0.779
  371   1HB   LYS  60          1HB       LYS  60   8.842   6.698  -0.095
  372   1HG   LYS  60          1HG       LYS  60   8.970   7.628  -2.898
  373   1HD   LYS  60          1HD       LYS  60  11.598   7.513  -2.358
  374   1HE   LYS  60          1HE       LYS  60  10.307   6.748  -4.404
  375   1HZ   LYS  60          1HZ       LYS  60   9.018   4.973  -3.939
  376   2HZ   LYS  60          2HZ       LYS  60  10.018   4.410  -2.696
  377   3HZ   LYS  60          3HZ       LYS  60  10.427   4.109  -4.309
  378    H    LEU  61           H        LEU  61   4.985   7.315  -0.262
  379    HA   LEU  61           HA       LEU  61   5.651   9.881   0.650
  380   1HB   LEU  61          1HB       LEU  61   4.154  11.163  -0.962
  381    HG   LEU  61           HG       LEU  61   4.669   8.745  -2.695
  382   1HD1  LEU  61          1HD1      LEU  61   2.644   8.256  -1.827
  383   2HD1  LEU  61          2HD1      LEU  61   2.095   9.382  -3.066
  384   3HD1  LEU  61          3HD1      LEU  61   2.295   9.932  -1.402
  385   1HD2  LEU  61          1HD2      LEU  61   3.269  11.088  -3.799
  386   2HD2  LEU  61          2HD2      LEU  61   4.406   9.977  -4.563
  387   3HD2  LEU  61          3HD2      LEU  61   5.001  11.284  -3.541
  388    H    ASP  62           H        ASP  62   3.559  11.188   1.130
  389    HA   ASP  62           HA       ASP  62   1.594  11.301   2.270
  390   1HB   ASP  62          1HB       ASP  62   0.874  10.236   0.004
  Start of MODEL   11
    1    H    GLU   7           H        GLU   7  -5.012  11.742   0.886
    2    HA   GLU   7           HA       GLU   7  -3.004  11.958  -1.142
    3   1HB   GLU   7          1HB       GLU   7  -3.139  10.926   1.645
    4   1HG   GLU   7          1HG       GLU   7  -1.190  12.272   1.988
    5    H    LEU   8           H        LEU   8  -1.766  10.128  -1.978
    6    HA   LEU   8           HA       LEU   8  -2.997   7.521  -1.961
    7   1HB   LEU   8          1HB       LEU   8  -3.014   7.562  -4.558
    8    HG   LEU   8           HG       LEU   8  -3.601   9.568  -5.651
    9   1HD1  LEU   8          1HD1      LEU   8  -3.304  11.322  -3.291
   10   2HD1  LEU   8          2HD1      LEU   8  -4.776  10.358  -3.396
   11   3HD1  LEU   8          3HD1      LEU   8  -4.357  11.475  -4.696
   12   1HD2  LEU   8          1HD2      LEU   8  -1.612  10.769  -5.617
   13   2HD2  LEU   8          2HD2      LEU   8  -1.139   9.180  -5.015
   14   3HD2  LEU   8          3HD2      LEU   8  -1.375  10.516  -3.887
   15    H    VAL   9           H        VAL   9  -1.654   5.883  -2.833
   16    HA   VAL   9           HA       VAL   9   1.127   6.751  -3.252
   17    HB   VAL   9           HB       VAL   9   0.125   4.138  -2.107
   18   1HG1  VAL   9          1HG1      VAL   9   2.568   3.782  -1.604
   19   2HG1  VAL   9          2HG1      VAL   9   2.909   5.118  -2.703
   20   3HG1  VAL   9          3HG1      VAL   9   2.121   3.660  -3.305
   21   1HG2  VAL   9          1HG2      VAL   9   1.204   4.926  -0.039
   22   2HG2  VAL   9          2HG2      VAL   9  -0.119   5.976  -0.550
   23   3HG2  VAL   9          3HG2      VAL   9   1.552   6.465  -0.828
   24    H    LEU  10           H        LEU  10   0.081   3.451  -3.836
   25    HA   LEU  10           HA       LEU  10  -0.655   3.414  -6.455
   26   1HB   LEU  10          1HB       LEU  10   2.090   4.254  -6.209
   27    HG   LEU  10           HG       LEU  10   0.565   5.272  -7.828
   28   1HD1  LEU  10          1HD1      LEU  10   2.632   3.919  -9.494
   29   2HD1  LEU  10          2HD1      LEU  10   3.141   4.948  -8.156
   30   3HD1  LEU  10          3HD1      LEU  10   2.149   5.614  -9.452
   31   1HD2  LEU  10          1HD2      LEU  10  -0.577   4.149  -9.411
   32   2HD2  LEU  10          2HD2      LEU  10  -0.326   2.775  -8.333
   33   3HD2  LEU  10          3HD2      LEU  10   0.745   3.021  -9.713
   34    H    ALA  11           H        ALA  11   1.969   1.933  -4.556
   35    HA   ALA  11           HA       ALA  11   2.372  -0.211  -3.908
   36   1HB   ALA  11          1HB       ALA  11   0.417  -0.600  -2.831
   37   2HB   ALA  11          2HB       ALA  11   0.204  -1.751  -4.150
   38   3HB   ALA  11          3HB       ALA  11  -0.569  -0.169  -4.228
   39    H    LEU  12           H        LEU  12   3.123   0.483  -6.469
   40    HA   LEU  12           HA       LEU  12   2.241  -1.168  -8.532
   41   1HB   LEU  12          1HB       LEU  12   4.608  -0.843  -9.455
   42    HG   LEU  12           HG       LEU  12   6.138   0.569  -8.532
   43   1HD1  LEU  12          1HD1      LEU  12   5.414   2.581  -7.961
   44   2HD1  LEU  12          2HD1      LEU  12   5.064   1.928  -6.362
   45   3HD1  LEU  12          3HD1      LEU  12   3.802   1.971  -7.590
   46   1HD2  LEU  12          1HD2      LEU  12   6.567  -0.010  -6.248
   47   2HD2  LEU  12          2HD2      LEU  12   5.908  -1.424  -7.068
   48   3HD2  LEU  12          3HD2      LEU  12   4.884  -0.470  -5.995
   49    H    TYR  13           H        TYR  13   3.233  -3.029  -9.500
   50    HA   TYR  13           HA       TYR  13   4.247  -5.076  -9.530
   51   1HB   TYR  13          1HB       TYR  13   5.914  -3.680  -7.847
   52    HD1  TYR  13           HD1      TYR  13   8.170  -4.233  -8.244
   53    HD2  TYR  13           HD2      TYR  13   5.131  -7.102  -9.037
   54    HE1  TYR  13           HE1      TYR  13   9.820  -5.658  -9.380
   55    HE2  TYR  13           HE2      TYR  13   6.774  -8.536 -10.173
   56    HH   TYR  13           HH       TYR  13   9.149  -7.980 -11.426
   57    H    ASP  14           H        ASP  14   1.973  -4.028  -7.339
   58    HA   ASP  14           HA       ASP  14   0.542  -5.035  -5.872
   59   1HB   ASP  14          1HB       ASP  14  -0.591  -6.991  -6.814
   60    H    TYR  15           H        TYR  15   1.628  -5.410  -3.990
   61    HA   TYR  15           HA       TYR  15   3.417  -7.617  -3.662
   62   1HB   TYR  15          1HB       TYR  15   3.366  -5.374  -2.363
   63    HD1  TYR  15           HD1      TYR  15   5.667  -5.901  -2.106
   64    HD2  TYR  15           HD2      TYR  15   2.722  -8.224  -0.098
   65    HE1  TYR  15           HE1      TYR  15   7.432  -6.984  -0.781
   66    HE2  TYR  15           HE2      TYR  15   4.480  -9.314   1.233
   67    HH   TYR  15           HH       TYR  15   6.888  -9.769   1.080
   68    H    GLN  16           H        GLN  16   2.824  -9.654  -3.491
   69    HA   GLN  16           HA       GLN  16   0.118 -10.341  -2.688
   70   1HB   GLN  16          1HB       GLN  16   0.635 -12.568  -3.446
   71   1HG   GLN  16          1HG       GLN  16   3.443 -11.684  -3.193
   72   1HE2  GLN  16          1HE2      GLN  16   1.983 -14.443  -4.856
   73   2HE2  GLN  16          2HE2      GLN  16   2.979 -14.346  -6.264
   74    H    GLU  17           H        GLU  17   0.509 -12.824  -1.519
   75    HA   GLU  17           HA       GLU  17   1.574 -12.027   1.094
   76   1HB   GLU  17          1HB       GLU  17   0.180 -13.764   2.037
   77   1HG   GLU  17          1HG       GLU  17   0.023 -14.710  -0.732
   78    H    LYS  18           H        LYS  18   3.607 -12.644   1.442
   79    HA   LYS  18           HA       LYS  18   4.323 -15.430   1.122
   80   1HB   LYS  18          1HB       LYS  18   4.836 -14.414  -1.090
   81   1HG   LYS  18          1HG       LYS  18   6.504 -16.053   0.398
   82   1HD   LYS  18          1HD       LYS  18   7.886 -13.756   0.369
   83   1HE   LYS  18          1HE       LYS  18   9.239 -15.095  -1.885
   84   1HZ   LYS  18          1HZ       LYS  18   8.761 -12.241  -1.219
   85   2HZ   LYS  18          2HZ       LYS  18   9.781 -12.815  -2.440
   86   3HZ   LYS  18          3HZ       LYS  18  10.148 -13.122  -0.818
   87    H    SER  19           H        SER  19   4.057 -13.309   3.242
   88    HA   SER  19           HA       SER  19   6.020 -14.136   4.982
   89   1HB   SER  19          1HB       SER  19   7.823 -13.165   3.907
   90    HG   SER  19           HG       SER  19   7.939 -12.211   5.878
   91    HA   PRO  20           HA       PRO  20   4.195 -10.017   6.799
   92   1HB   PRO  20          1HB       PRO  20   2.464  -8.678   5.120
   93   1HG   PRO  20          1HG       PRO  20   2.887  -9.808   3.152
   94   1HD   PRO  20          1HD       PRO  20   4.655 -11.273   2.941
   95    H    ARG  21           H        ARG  21   1.749 -10.814   4.330
   96    HA   ARG  21           HA       ARG  21   0.298 -12.663   5.832
   97   1HB   ARG  21          1HB       ARG  21   0.047 -10.210   7.001
   98   1HG   ARG  21          1HG       ARG  21  -2.432 -11.786   7.100
   99   1HD   ARG  21          1HD       ARG  21  -0.581 -11.410   9.388
  100    HE   ARG  21           HE       ARG  21  -3.252 -12.030   9.180
  101   1HH1  ARG  21          1HH1      ARG  21  -1.356  -9.597  10.810
  102   2HH1  ARG  21          2HH1      ARG  21  -2.471  -9.428  12.123
  103   1HH2  ARG  21          1HH2      ARG  21  -4.720 -11.811  10.907
  104   2HH2  ARG  21          2HH2      ARG  21  -4.381 -10.686  12.179
  105    H    GLU  22           H        GLU  22  -2.308 -12.129   5.099
  106    HA   GLU  22           HA       GLU  22  -2.189 -12.660   2.274
  107   1HB   GLU  22          1HB       GLU  22  -4.579 -12.377   4.100
  108   1HG   GLU  22          1HG       GLU  22  -4.482 -14.990   3.476
  109    H    VAL  23           H        VAL  23  -1.360 -10.610   1.538
  110    HA   VAL  23           HA       VAL  23  -3.503  -8.626   1.222
  111    HB   VAL  23           HB       VAL  23  -1.858  -6.797   1.425
  112   1HG1  VAL  23          1HG1      VAL  23  -1.728  -8.410   3.946
  113   2HG1  VAL  23          2HG1      VAL  23  -3.263  -7.774   3.353
  114   3HG1  VAL  23          3HG1      VAL  23  -1.944  -6.672   3.745
  115   1HG2  VAL  23          1HG2      VAL  23   0.272  -7.595   2.771
  116   2HG2  VAL  23          2HG2      VAL  23   0.250  -7.579   1.008
  117   3HG2  VAL  23          3HG2      VAL  23  -0.017  -9.088   1.880
  118    H    THR  24           H        THR  24  -3.735  -7.835  -0.790
  119    HA   THR  24           HA       THR  24  -1.604  -8.345  -2.753
  120    HB   THR  24           HB       THR  24  -4.551  -8.700  -3.317
  121    HG1  THR  24           HG1      THR  24  -2.562 -10.637  -2.757
  122   1HG2  THR  24          1HG2      THR  24  -2.114  -8.886  -4.954
  123   2HG2  THR  24          2HG2      THR  24  -3.770  -8.498  -5.414
  124   3HG2  THR  24          3HG2      THR  24  -3.295 -10.177  -5.162
  125    H    MET  25           H        MET  25  -1.598  -6.915  -4.581
  126    HA   MET  25           HA       MET  25  -3.345  -4.598  -4.490
  127   1HB   MET  25          1HB       MET  25  -0.373  -4.126  -4.443
  128   1HG   MET  25          1HG       MET  25  -2.245  -4.178  -2.093
  129   1HE   MET  25          1HE       MET  25   1.728  -4.185  -1.724
  130   2HE   MET  25          2HE       MET  25   2.034  -2.485  -2.080
  131   3HE   MET  25          3HE       MET  25   1.345  -3.535  -3.318
  132    H    LYS  26           H        LYS  26  -3.601  -6.265  -6.429
  133    HA   LYS  26           HA       LYS  26  -2.014  -6.504  -8.595
  134   1HB   LYS  26          1HB       LYS  26  -4.628  -7.002  -8.117
  135   1HG   LYS  26          1HG       LYS  26  -4.836  -7.779 -10.447
  136   1HD   LYS  26          1HD       LYS  26  -2.418  -8.977 -10.354
  137   1HE   LYS  26          1HE       LYS  26  -4.618  -9.603  -8.393
  138   1HZ   LYS  26          1HZ       LYS  26  -3.937 -11.917  -9.049
  139   2HZ   LYS  26          2HZ       LYS  26  -2.823 -11.070  -8.101
  140   3HZ   LYS  26          3HZ       LYS  26  -2.562 -11.236  -9.763
  141    H    LYS  27           H        LYS  27  -0.900  -5.178  -9.842
  142    HA   LYS  27           HA       LYS  27  -0.148  -3.298 -10.880
  143   1HB   LYS  27          1HB       LYS  27  -3.062  -3.384 -11.378
  144   1HG   LYS  27          1HG       LYS  27  -2.391  -3.239 -13.704
  145   1HD   LYS  27          1HD       LYS  27  -1.017  -5.214 -11.931
  146   1HE   LYS  27          1HE       LYS  27  -0.652  -4.886 -14.889
  147   1HZ   LYS  27          1HZ       LYS  27  -0.299  -7.385 -13.328
  148   2HZ   LYS  27          2HZ       LYS  27   0.203  -7.150 -14.926
  149   3HZ   LYS  27          3HZ       LYS  27  -1.445  -7.132 -14.545
  150    H    GLY  28           H        GLY  28  -0.413  -0.795 -10.977
  151   1HA   GLY  28          1HA       GLY  28  -0.320   0.120  -8.234
  152   2HA   GLY  28          2HA       GLY  28   0.080   1.059  -9.665
  153    H    ASP  29           H        ASP  29  -2.798  -0.523  -8.270
  154    HA   ASP  29           HA       ASP  29  -4.420   1.733  -9.186
  155   1HB   ASP  29          1HB       ASP  29  -5.111  -1.027  -8.186
  156    H    ILE  30           H        ILE  30  -2.570   1.959  -6.933
  157    HA   ILE  30           HA       ILE  30  -2.454   2.743  -4.805
  158    HB   ILE  30           HB       ILE  30  -5.205   3.805  -4.769
  159   1HG1  ILE  30          1HG1      ILE  30  -4.841   3.973  -7.155
  160   1HG2  ILE  30          1HG2      ILE  30  -2.827   4.330  -3.505
  161   2HG2  ILE  30          2HG2      ILE  30  -4.241   5.384  -3.518
  162   3HG2  ILE  30          3HG2      ILE  30  -2.941   5.638  -4.680
  163   1HD1  ILE  30          1HD1      ILE  30  -2.107   4.788  -6.386
  164   2HD1  ILE  30          2HD1      ILE  30  -2.835   5.578  -7.784
  165   3HD1  ILE  30          3HD1      ILE  30  -2.664   3.823  -7.751
  166    H    LEU  31           H        LEU  31  -3.833   2.937  -2.639
  167    HA   LEU  31           HA       LEU  31  -5.768   0.872  -2.229
  168   1HB   LEU  31          1HB       LEU  31  -4.337  -0.435  -0.638
  169    HG   LEU  31           HG       LEU  31  -1.928  -0.489  -0.950
  170   1HD1  LEU  31          1HD1      LEU  31  -2.133   0.572  -3.301
  171   2HD1  LEU  31          2HD1      LEU  31  -0.711   0.912  -2.319
  172   3HD1  LEU  31          3HD1      LEU  31  -2.004   2.102  -2.435
  173   1HD2  LEU  31          1HD2      LEU  31  -1.389   1.257   0.457
  174   2HD2  LEU  31          2HD2      LEU  31  -3.121   1.074   0.730
  175   3HD2  LEU  31          3HD2      LEU  31  -2.524   2.365  -0.311
  176    H    THR  32           H        THR  32  -5.021   3.794  -1.580
  177    HA   THR  32           HA       THR  32  -5.279   5.283   0.125
  178    HB   THR  32           HB       THR  32  -6.984   3.315   1.588
  179    HG1  THR  32           HG1      THR  32  -8.537   3.379   0.071
  180   1HG2  THR  32          1HG2      THR  32  -7.495   5.235   2.591
  181   2HG2  THR  32          2HG2      THR  32  -8.461   5.553   1.150
  182   3HG2  THR  32          3HG2      THR  32  -6.830   6.211   1.280
  183    H    LEU  33           H        LEU  33  -5.330   5.421   2.705
  184    HA   LEU  33           HA       LEU  33  -4.021   3.491   4.237
  185   1HB   LEU  33          1HB       LEU  33  -1.798   4.826   4.421
  186    HG   LEU  33           HG       LEU  33  -2.785   5.709   1.724
  187   1HD1  LEU  33          1HD1      LEU  33  -1.787   7.828   2.411
  188   2HD1  LEU  33          2HD1      LEU  33  -1.264   7.095   3.928
  189   3HD1  LEU  33          3HD1      LEU  33  -2.984   7.273   3.583
  190   1HD2  LEU  33          1HD2      LEU  33  -0.834   4.758   0.985
  191   2HD2  LEU  33          2HD2      LEU  33  -0.020   4.957   2.537
  192   3HD2  LEU  33          3HD2      LEU  33  -0.253   6.348   1.479
  193    H    LEU  34           H        LEU  34  -3.217   4.361   6.328
  194    HA   LEU  34           HA       LEU  34  -4.803   6.710   7.081
  195   1HB   LEU  34          1HB       LEU  34  -3.581   4.587   8.848
  196    HG   LEU  34           HG       LEU  34  -6.348   4.820   7.708
  197   1HD1  LEU  34          1HD1      LEU  34  -6.000   2.294   7.679
  198   2HD1  LEU  34          2HD1      LEU  34  -4.310   2.642   8.037
  199   3HD1  LEU  34          3HD1      LEU  34  -5.040   3.255   6.553
  200   1HD2  LEU  34          1HD2      LEU  34  -7.039   3.192   9.490
  201   2HD2  LEU  34          2HD2      LEU  34  -6.779   4.845  10.045
  202   3HD2  LEU  34          3HD2      LEU  34  -5.556   3.612  10.349
  203    H    ASN  35           H        ASN  35  -2.295   7.033   5.755
  204    HA   ASN  35           HA       ASN  35  -0.433   8.333   5.881
  205   1HB   ASN  35          1HB       ASN  35  -1.446   9.120   8.621
  206   1HD2  ASN  35          1HD2      ASN  35  -1.729  11.793   7.938
  207   2HD2  ASN  35          2HD2      ASN  35  -3.094  11.957   6.891
  208    H    SER  36           H        SER  36   1.650   7.895   6.326
  209    HA   SER  36           HA       SER  36   2.184   5.911   8.426
  210   1HB   SER  36          1HB       SER  36   4.044   6.670   6.171
  211    HG   SER  36           HG       SER  36   3.011   4.421   5.535
  212    H    THR  37           H        THR  37   4.814   6.168   8.886
  213    HA   THR  37           HA       THR  37   5.820   8.763   9.224
  214    HB   THR  37           HB       THR  37   5.524   8.446  11.914
  215    HG1  THR  37           HG1      THR  37   3.895   7.202  12.278
  216   1HG2  THR  37          1HG2      THR  37   4.825  10.356  10.125
  217   2HG2  THR  37          2HG2      THR  37   4.484  10.418  11.854
  218   3HG2  THR  37          3HG2      THR  37   3.248   9.848  10.732
  219    H    ASN  38           H        ASN  38   7.350   7.060   8.314
  220    HA   ASN  38           HA       ASN  38   9.374   6.567  10.208
  221   1HB   ASN  38          1HB       ASN  38   7.995   4.745  10.978
  222   1HD2  ASN  38          1HD2      ASN  38   8.547   2.195  10.600
  223   2HD2  ASN  38          2HD2      ASN  38  10.249   1.903  10.595
  224    H    LYS  39           H        LYS  39   8.816   4.169   7.708
  225    HA   LYS  39           HA       LYS  39   9.871   5.405   5.481
  226   1HB   LYS  39          1HB       LYS  39  11.862   5.164   7.445
  227   1HG   LYS  39          1HG       LYS  39  12.710   5.349   4.618
  228   1HD   LYS  39          1HD       LYS  39  13.247   6.807   7.185
  229   1HE   LYS  39          1HE       LYS  39  13.000   8.331   5.114
  230   1HZ   LYS  39          1HZ       LYS  39  14.282   6.876   3.620
  231   2HZ   LYS  39          2HZ       LYS  39  15.667   7.160   4.546
  232   3HZ   LYS  39          3HZ       LYS  39  14.928   8.437   3.719
  233    H    ASP  40           H        ASP  40   8.012   3.369   6.127
  234    HA   ASP  40           HA       ASP  40   8.436   1.537   4.090
  235   1HB   ASP  40          1HB       ASP  40   8.800  -0.550   5.514
  236    H    TRP  41           H        TRP  41   6.260   2.121   3.821
  237    HA   TRP  41           HA       TRP  41   3.998   2.063   4.118
  238   1HB   TRP  41          1HB       TRP  41   3.120  -0.226   4.608
  239    HD1  TRP  41           HD1      TRP  41   6.657  -1.390   3.819
  240    HE1  TRP  41           HE1      TRP  41   7.399  -3.077   5.615
  241    HE3  TRP  41           HE3      TRP  41   2.763  -0.859   7.091
  242    HZ2  TRP  41           HZ2      TRP  41   6.460  -4.053   8.092
  243    HZ3  TRP  41           HZ3      TRP  41   2.762  -2.206   9.149
  244    HH2  TRP  41           HH2      TRP  41   4.572  -3.770   9.637
  245    H    TRP  42           H        TRP  42   2.226   1.020   5.801
  246    HA   TRP  42           HA       TRP  42   2.752   0.959   8.518
  247   1HB   TRP  42          1HB       TRP  42   2.887   3.628   7.441
  248    HD1  TRP  42           HD1      TRP  42   5.180   4.087   8.485
  249    HE1  TRP  42           HE1      TRP  42   6.185   3.944  10.849
  250    HE3  TRP  42           HE3      TRP  42   1.221   1.961  10.922
  251    HZ2  TRP  42           HZ2      TRP  42   5.403   3.047  13.409
  252    HZ3  TRP  42           HZ3      TRP  42   1.432   1.492  13.328
  253    HH2  TRP  42           HH2      TRP  42   3.481   2.023  14.545
  254    H    LYS  43           H        LYS  43   1.138  -0.620   8.231
  255    HA   LYS  43           HA       LYS  43  -0.971  -1.461   8.307
  256   1HB   LYS  43          1HB       LYS  43  -1.152   1.190   9.567
  257   1HG   LYS  43          1HG       LYS  43  -1.852  -1.612  10.246
  258   1HD   LYS  43          1HD       LYS  43  -2.800   0.526  12.072
  259   1HE   LYS  43          1HE       LYS  43  -4.349  -1.131  12.777
  260   1HZ   LYS  43          1HZ       LYS  43  -2.922  -2.634  13.673
  261   2HZ   LYS  43          2HZ       LYS  43  -1.788  -1.496  13.142
  262   3HZ   LYS  43          3HZ       LYS  43  -2.078  -2.890  12.229
  263    H    VAL  44           H        VAL  44  -0.422  -1.302   5.842
  264    HA   VAL  44           HA       VAL  44  -2.026   0.538   4.326
  265    HB   VAL  44           HB       VAL  44  -0.486  -1.922   3.476
  266   1HG1  VAL  44          1HG1      VAL  44  -2.314  -0.156   1.999
  267   2HG1  VAL  44          2HG1      VAL  44  -1.794  -1.804   1.649
  268   3HG1  VAL  44          3HG1      VAL  44  -0.756  -0.445   1.222
  269   1HG2  VAL  44          1HG2      VAL  44   0.178   0.932   3.823
  270   2HG2  VAL  44          2HG2      VAL  44   0.795   0.161   2.361
  271   3HG2  VAL  44          3HG2      VAL  44   1.204  -0.498   3.945
  272    H    GLU  45           H        GLU  45  -4.123   0.105   5.197
  273    HA   GLU  45           HA       GLU  45  -5.274  -2.501   4.494
  274   1HB   GLU  45          1HB       GLU  45  -6.335  -0.291   6.263
  275   1HG   GLU  45          1HG       GLU  45  -6.155  -2.713   7.652
  276    H    VAL  46           H        VAL  46  -5.867  -2.439   2.399
  277    HA   VAL  46           HA       VAL  46  -6.762  -0.203   0.979
  278    HB   VAL  46           HB       VAL  46  -7.604  -3.033   0.372
  279   1HG1  VAL  46          1HG1      VAL  46  -7.473  -2.234  -1.962
  280   2HG1  VAL  46          2HG1      VAL  46  -7.097  -0.618  -1.362
  281   3HG1  VAL  46          3HG1      VAL  46  -8.661  -1.352  -1.002
  282   1HG2  VAL  46          1HG2      VAL  46  -4.935  -1.941   0.517
  283   2HG2  VAL  46          2HG2      VAL  46  -5.319  -2.463  -1.122
  284   3HG2  VAL  46          3HG2      VAL  46  -5.457  -3.599   0.221
  285    H    ASN  47           H        ASN  47  -8.460  -2.447   3.039
  286    HA   ASN  47           HA       ASN  47 -10.800  -0.733   2.985
  287   1HB   ASN  47          1HB       ASN  47 -10.826  -3.590   2.037
  288   1HD2  ASN  47          1HD2      ASN  47 -10.911  -3.627  -0.079
  289   2HD2  ASN  47          2HD2      ASN  47 -11.506  -2.368  -1.101
  290    H    ASP  48           H        ASP  48  -9.717  -3.940   4.114
  291    HA   ASP  48           HA       ASP  48  -9.568  -3.259   6.819
  292   1HB   ASP  48          1HB       ASP  48 -11.597  -4.397   7.687
  293    H    ARG  49           H        ARG  49  -8.917  -4.994   8.123
  294    HA   ARG  49           HA       ARG  49  -8.119  -7.052   8.656
  295   1HB   ARG  49          1HB       ARG  49  -9.583  -8.610   8.038
  296   1HG   ARG  49          1HG       ARG  49  -7.657  -9.371   6.537
  297   1HD   ARG  49          1HD       ARG  49  -9.516  -8.126   4.528
  298    HE   ARG  49           HE       ARG  49  -9.029  -9.925   3.224
  299   1HH1  ARG  49          1HH1      ARG  49  -6.221  -9.188   5.164
  300   2HH1  ARG  49          2HH1      ARG  49  -5.220 -10.365   4.382
  301   1HH2  ARG  49          1HH2      ARG  49  -7.713 -11.474   2.198
  302   2HH2  ARG  49          2HH2      ARG  49  -6.066 -11.662   2.698
  303    H    GLN  50           H        GLN  50  -7.252  -5.308   5.923
  304    HA   GLN  50           HA       GLN  50  -5.017  -7.054   5.240
  305   1HB   GLN  50          1HB       GLN  50  -5.657  -4.379   4.005
  306   1HG   GLN  50          1HG       GLN  50  -7.595  -6.051   3.897
  307   1HE2  GLN  50          1HE2      GLN  50  -8.333  -7.357   1.774
  308   2HE2  GLN  50          2HE2      GLN  50  -7.394  -8.782   1.507
  309    H    GLY  51           H        GLY  51  -3.085  -5.256   4.502
  310   1HA   GLY  51          1HA       GLY  51  -2.138  -3.174   5.656
  311   2HA   GLY  51          2HA       GLY  51  -2.311  -4.132   7.117
  312    H    PHE  52           H        PHE  52   0.123  -3.105   6.473
  313    HA   PHE  52           HA       PHE  52   2.315  -3.673   6.291
  314   1HB   PHE  52          1HB       PHE  52   1.178  -6.462   6.537
  315    HD1  PHE  52           HD1      PHE  52  -0.202  -4.883   8.245
  316    HD2  PHE  52           HD2      PHE  52   3.883  -6.011   8.616
  317    HE1  PHE  52           HE1      PHE  52  -0.316  -4.485  10.670
  318    HE2  PHE  52           HE2      PHE  52   3.777  -5.616  11.042
  319    HZ   PHE  52           HZ       PHE  52   1.675  -4.852  12.073
  320    H    VAL  53           H        VAL  53   3.115  -3.109   4.371
  321    HA   VAL  53           HA       VAL  53   3.262  -5.089   2.274
  322    HB   VAL  53           HB       VAL  53   2.351  -3.681   0.503
  323   1HG1  VAL  53          1HG1      VAL  53   0.897  -5.293   1.704
  324   2HG1  VAL  53          2HG1      VAL  53   0.014  -3.934   1.007
  325   3HG1  VAL  53          3HG1      VAL  53   0.350  -3.974   2.738
  326   1HG2  VAL  53          1HG2      VAL  53   2.174  -1.710   2.692
  327   2HG2  VAL  53          2HG2      VAL  53   0.820  -1.741   1.564
  328   3HG2  VAL  53          3HG2      VAL  53   2.458  -1.473   0.967
  329    HA   PRO  54           HA       PRO  54   7.228  -2.881   2.535
  330   1HB   PRO  54          1HB       PRO  54   7.928  -4.964   0.540
  331   1HG   PRO  54          1HG       PRO  54   7.341  -6.773   1.877
  332   1HD   PRO  54          1HD       PRO  54   5.261  -6.003   1.196
  333    H    ALA  55           H        ALA  55   6.537  -1.006   1.450
  334    HA   ALA  55           HA       ALA  55   5.914  -0.847  -1.282
  335   1HB   ALA  55          1HB       ALA  55   5.309   0.934   0.217
  336   2HB   ALA  55          2HB       ALA  55   6.378   1.577  -1.029
  337   3HB   ALA  55          3HB       ALA  55   7.004   1.254   0.589
  338    H    ALA  56           H        ALA  56   7.428  -2.024  -2.472
  339    HA   ALA  56           HA       ALA  56  10.184  -1.879  -2.340
  340   1HB   ALA  56          1HB       ALA  56   9.181  -3.568  -3.671
  341   2HB   ALA  56          2HB       ALA  56  10.131  -2.560  -4.763
  342   3HB   ALA  56          3HB       ALA  56   8.379  -2.379  -4.696
  343    H    TYR  57           H        TYR  57   8.543  -0.428  -5.128
  344    HA   TYR  57           HA       TYR  57  10.082   2.038  -4.708
  345   1HB   TYR  57          1HB       TYR  57  10.453   2.093  -7.216
  346    HD1  TYR  57           HD1      TYR  57  10.752  -1.505  -6.464
  347    HD2  TYR  57           HD2      TYR  57   8.841   1.452  -8.854
  348    HE1  TYR  57           HE1      TYR  57   9.888  -3.268  -7.944
  349    HE2  TYR  57           HE2      TYR  57   7.969  -0.303 -10.339
  350    HH   TYR  57           HH       TYR  57   7.479  -2.680 -10.293
  351    H    VAL  58           H        VAL  58   8.372   3.303  -4.158
  352    HA   VAL  58           HA       VAL  58   6.336   3.703  -6.243
  353    HB   VAL  58           HB       VAL  58   5.544   4.027  -3.383
  354   1HG1  VAL  58          1HG1      VAL  58   3.498   2.891  -4.870
  355   2HG1  VAL  58          2HG1      VAL  58   4.290   3.995  -5.989
  356   3HG1  VAL  58          3HG1      VAL  58   3.677   4.592  -4.449
  357   1HG2  VAL  58          1HG2      VAL  58   4.596   1.558  -3.830
  358   2HG2  VAL  58          2HG2      VAL  58   6.126   1.868  -3.010
  359   3HG2  VAL  58          3HG2      VAL  58   6.112   1.454  -4.724
  360    H    LYS  59           H        LYS  59   5.123   5.798  -5.898
  361    HA   LYS  59           HA       LYS  59   7.045   7.913  -5.565
  362   1HB   LYS  59          1HB       LYS  59   5.253   9.387  -6.317
  363   1HG   LYS  59          1HG       LYS  59   3.535   7.059  -5.693
  364   1HD   LYS  59          1HD       LYS  59   3.456   8.524  -8.240
  365   1HE   LYS  59          1HE       LYS  59   0.802   8.048  -7.947
  366   1HZ   LYS  59          1HZ       LYS  59   0.579  10.258  -8.295
  367   2HZ   LYS  59          2HZ       LYS  59   2.238  10.151  -8.608
  368   3HZ   LYS  59          3HZ       LYS  59   1.697  10.692  -7.100
  369    H    LYS  60           H        LYS  60   6.941   9.618  -4.084
  370    HA   LYS  60           HA       LYS  60   6.618  10.622  -2.073
  371   1HB   LYS  60          1HB       LYS  60   4.279  10.788  -2.777
  372   1HG   LYS  60          1HG       LYS  60   3.256  10.276  -0.334
  373   1HD   LYS  60          1HD       LYS  60   3.962  12.484  -1.743
  374   1HE   LYS  60          1HE       LYS  60   5.823  12.211   0.564
  375   1HZ   LYS  60          1HZ       LYS  60   4.171  14.265   0.682
  376   2HZ   LYS  60          2HZ       LYS  60   5.307  14.911  -0.392
  377   3HZ   LYS  60          3HZ       LYS  60   5.798  14.379   1.136
  378    H    LEU  61           H        LEU  61   4.845   7.605  -1.425
  379    HA   LEU  61           HA       LEU  61   5.162   5.957   0.109
  380   1HB   LEU  61          1HB       LEU  61   7.432   6.037  -1.268
  381    HG   LEU  61           HG       LEU  61   6.377   4.084   0.179
  382   1HD1  LEU  61          1HD1      LEU  61   7.913   3.820  -1.709
  383   2HD1  LEU  61          2HD1      LEU  61   8.298   2.708  -0.396
  384   3HD1  LEU  61          3HD1      LEU  61   9.277   4.155  -0.643
  385   1HD2  LEU  61          1HD2      LEU  61   7.009   4.542   2.343
  386   2HD2  LEU  61          2HD2      LEU  61   8.573   5.200   1.862
  387   3HD2  LEU  61          3HD2      LEU  61   8.300   3.457   1.831
  388    H    ASP  62           H        ASP  62   4.610   8.635   1.026
  389    HA   ASP  62           HA       ASP  62   6.171   9.372   3.241
  390   1HB   ASP  62          1HB       ASP  62   4.154  10.562   1.958
  Start of MODEL   12
    1    H    GLU   7           H        GLU   7  -1.887  13.923  -7.625
    2    HA   GLU   7           HA       GLU   7  -3.469  11.770  -6.793
    3   1HB   GLU   7          1HB       GLU   7  -1.325  11.998  -8.401
    4   1HG   GLU   7          1HG       GLU   7  -1.478   9.314  -7.217
    5    H    LEU   8           H        LEU   8  -2.188   9.961  -5.391
    6    HA   LEU   8           HA       LEU   8  -1.141  11.154  -2.945
    7   1HB   LEU   8          1HB       LEU   8  -2.761   9.491  -1.713
    8    HG   LEU   8           HG       LEU   8  -3.811   8.983  -4.137
    9   1HD1  LEU   8          1HD1      LEU   8  -6.014   8.617  -2.763
   10   2HD1  LEU   8          2HD1      LEU   8  -4.976   9.028  -1.397
   11   3HD1  LEU   8          3HD1      LEU   8  -4.572   7.657  -2.431
   12   1HD2  LEU   8          1HD2      LEU   8  -5.870  10.871  -3.189
   13   2HD2  LEU   8          2HD2      LEU   8  -5.429  10.396  -4.828
   14   3HD2  LEU   8          3HD2      LEU   8  -4.456  11.584  -3.964
   15    H    VAL   9           H        VAL   9  -2.075   8.152  -4.596
   16    HA   VAL   9           HA       VAL   9   0.510   7.002  -4.173
   17    HB   VAL   9           HB       VAL   9  -0.565   4.929  -3.004
   18   1HG1  VAL   9          1HG1      VAL   9  -0.266   7.118  -1.050
   19   2HG1  VAL   9          2HG1      VAL   9   1.073   6.892  -2.176
   20   3HG1  VAL   9          3HG1      VAL   9   0.551   5.559  -1.147
   21   1HG2  VAL   9          1HG2      VAL   9  -2.785   6.616  -3.039
   22   2HG2  VAL   9          2HG2      VAL   9  -2.215   6.649  -1.372
   23   3HG2  VAL   9          3HG2      VAL   9  -2.608   5.111  -2.137
   24    H    LEU  10           H        LEU  10   0.470   4.605  -4.889
   25    HA   LEU  10           HA       LEU  10  -1.538   4.214  -7.004
   26   1HB   LEU  10          1HB       LEU  10   1.356   3.516  -7.395
   27    HG   LEU  10           HG       LEU  10   0.510   6.163  -7.262
   28   1HD1  LEU  10          1HD1      LEU  10   2.692   6.555  -8.514
   29   2HD1  LEU  10          2HD1      LEU  10   2.842   4.799  -8.568
   30   3HD1  LEU  10          3HD1      LEU  10   2.780   5.631  -7.015
   31   1HD2  LEU  10          1HD2      LEU  10   0.966   6.668  -9.813
   32   2HD2  LEU  10          2HD2      LEU  10  -0.662   6.361  -9.208
   33   3HD2  LEU  10          3HD2      LEU  10   0.238   5.074 -10.011
   34    H    ALA  11           H        ALA  11   0.887   2.764  -4.894
   35    HA   ALA  11           HA       ALA  11   0.940   0.730  -3.853
   36   1HB   ALA  11          1HB       ALA  11  -1.707   1.102  -4.101
   37   2HB   ALA  11          2HB       ALA  11  -0.997  -0.375  -3.447
   38   3HB   ALA  11          3HB       ALA  11  -1.513  -0.317  -5.132
   39    H    LEU  12           H        LEU  12   2.680   0.727  -5.591
   40    HA   LEU  12           HA       LEU  12   2.231  -0.957  -7.882
   41   1HB   LEU  12          1HB       LEU  12   4.521   0.578  -6.764
   42    HG   LEU  12           HG       LEU  12   2.949   0.589  -9.259
   43   1HD1  LEU  12          1HD1      LEU  12   4.606   2.755  -7.991
   44   2HD1  LEU  12          2HD1      LEU  12   2.975   2.351  -7.455
   45   3HD1  LEU  12          3HD1      LEU  12   3.245   2.928  -9.100
   46   1HD2  LEU  12          1HD2      LEU  12   4.668   1.234 -10.717
   47   2HD2  LEU  12          2HD2      LEU  12   5.290  -0.200  -9.902
   48   3HD2  LEU  12          3HD2      LEU  12   5.835   1.402  -9.407
   49    H    TYR  13           H        TYR  13   2.198  -1.888  -4.865
   50    HA   TYR  13           HA       TYR  13   4.207  -3.698  -4.370
   51   1HB   TYR  13          1HB       TYR  13   2.303  -5.031  -3.189
   52    HD1  TYR  13           HD1      TYR  13   0.562  -3.169  -1.515
   53    HD2  TYR  13           HD2      TYR  13   0.816  -3.820  -5.712
   54    HE1  TYR  13           HE1      TYR  13  -1.781  -2.464  -1.763
   55    HE2  TYR  13           HE2      TYR  13  -1.523  -3.115  -5.969
   56    HH   TYR  13           HH       TYR  13  -3.136  -1.414  -4.220
   57    H    ASP  14           H        ASP  14   3.671  -6.198  -4.250
   58    HA   ASP  14           HA       ASP  14   2.220  -7.379  -6.362
   59   1HB   ASP  14          1HB       ASP  14   4.247  -8.219  -7.647
   60    H    TYR  15           H        TYR  15   2.605  -7.757  -3.573
   61    HA   TYR  15           HA       TYR  15   4.252 -10.108  -3.225
   62   1HB   TYR  15          1HB       TYR  15   3.784  -8.237  -1.488
   63    HD1  TYR  15           HD1      TYR  15   5.764  -8.929  -0.448
   64    HD2  TYR  15           HD2      TYR  15   2.424 -11.564  -0.537
   65    HE1  TYR  15           HE1      TYR  15   6.935 -10.456   1.083
   66    HE2  TYR  15           HE2      TYR  15   3.586 -13.097   0.994
   67    HH   TYR  15           HH       TYR  15   6.880 -12.869   1.675
   68    H    GLN  16           H        GLN  16   3.468 -12.156  -2.531
   69    HA   GLN  16           HA       GLN  16   0.631 -12.709  -2.908
   70   1HB   GLN  16          1HB       GLN  16   2.650 -14.406  -4.356
   71   1HG   GLN  16          1HG       GLN  16   1.600 -13.220  -6.426
   72   1HE2  GLN  16          1HE2      GLN  16   3.012 -11.810  -7.586
   73   2HE2  GLN  16          2HE2      GLN  16   4.647 -11.595  -7.066
   74    H    GLU  17           H        GLU  17   0.551 -13.205  -0.712
   75    HA   GLU  17           HA       GLU  17   2.245 -15.395   0.240
   76   1HB   GLU  17          1HB       GLU  17   1.645 -13.096   1.472
   77   1HG   GLU  17          1HG       GLU  17   1.666 -15.538   3.192
   78    H    LYS  18           H        LYS  18  -0.011 -15.777  -1.636
   79    HA   LYS  18           HA       LYS  18  -1.757 -17.194  -1.985
   80   1HB   LYS  18          1HB       LYS  18   0.153 -18.570  -0.551
   81   1HG   LYS  18          1HG       LYS  18  -0.976 -20.620  -1.230
   82   1HD   LYS  18          1HD       LYS  18  -1.488 -18.750  -3.492
   83   1HE   LYS  18          1HE       LYS  18  -1.355 -21.405  -3.404
   84   1HZ   LYS  18          1HZ       LYS  18   1.414 -20.499  -3.376
   85   2HZ   LYS  18          2HZ       LYS  18   1.029 -21.715  -4.486
   86   3HZ   LYS  18          3HZ       LYS  18   0.745 -21.957  -2.838
   87    H    SER  19           H        SER  19  -3.379 -18.652  -0.234
   88    HA   SER  19           HA       SER  19  -5.215 -18.469   1.095
   89   1HB   SER  19          1HB       SER  19  -4.279 -15.966   2.401
   90    HG   SER  19           HG       SER  19  -3.030 -18.142   3.429
   91    HA   PRO  20           HA       PRO  20  -7.858 -15.660  -1.042
   92   1HB   PRO  20          1HB       PRO  20 -10.001 -15.598   0.628
   93   1HG   PRO  20          1HG       PRO  20  -9.044 -16.560   2.511
   94   1HD   PRO  20          1HD       PRO  20  -7.053 -17.717   2.410
   95    H    ARG  21           H        ARG  21  -7.719 -15.066   2.473
   96    HA   ARG  21           HA       ARG  21  -7.463 -12.194   1.888
   97   1HB   ARG  21          1HB       ARG  21  -8.780 -11.782   4.002
   98   1HG   ARG  21          1HG       ARG  21 -10.175 -14.347   3.715
   99   1HD   ARG  21          1HD       ARG  21  -9.491 -12.385   5.846
  100    HE   ARG  21           HE       ARG  21 -10.710 -14.781   6.853
  101   1HH1  ARG  21          1HH1      ARG  21  -7.681 -13.134   6.307
  102   2HH1  ARG  21          2HH1      ARG  21  -6.842 -14.005   7.546
  103   1HH2  ARG  21          1HH2      ARG  21  -9.608 -15.925   8.483
  104   2HH2  ARG  21          2HH2      ARG  21  -7.934 -15.589   8.783
  105    H    GLU  22           H        GLU  22  -5.431 -11.717   2.425
  106    HA   GLU  22           HA       GLU  22  -4.544 -11.753   5.084
  107   1HB   GLU  22          1HB       GLU  22  -3.902 -14.141   3.480
  108   1HG   GLU  22          1HG       GLU  22  -4.396 -13.452   6.277
  109    H    VAL  23           H        VAL  23  -2.580 -12.552   2.243
  110    HA   VAL  23           HA       VAL  23  -1.747  -9.775   1.961
  111    HB   VAL  23           HB       VAL  23   0.288 -11.954   2.445
  112   1HG1  VAL  23          1HG1      VAL  23   1.702  -9.755   2.729
  113   2HG1  VAL  23          2HG1      VAL  23   0.447  -9.079   1.692
  114   3HG1  VAL  23          3HG1      VAL  23   1.408 -10.449   1.134
  115   1HG2  VAL  23          1HG2      VAL  23  -0.892  -9.892   4.266
  116   2HG2  VAL  23          2HG2      VAL  23   0.755 -10.473   4.513
  117   3HG2  VAL  23          3HG2      VAL  23  -0.598 -11.605   4.563
  118    H    THR  24           H        THR  24  -2.088  -9.449  -0.145
  119    HA   THR  24           HA       THR  24  -0.562 -10.670  -2.144
  120    HB   THR  24           HB       THR  24  -1.852 -12.659  -1.883
  121    HG1  THR  24           HG1      THR  24  -3.021 -11.251  -4.046
  122   1HG2  THR  24          1HG2      THR  24  -4.488 -11.823  -2.559
  123   2HG2  THR  24          2HG2      THR  24  -3.953 -10.957  -1.120
  124   3HG2  THR  24          3HG2      THR  24  -3.929 -12.721  -1.148
  125    H    MET  25           H        MET  25  -0.282  -8.772  -3.151
  126    HA   MET  25           HA       MET  25  -2.638  -7.526  -4.359
  127   1HB   MET  25          1HB       MET  25  -0.841  -6.304  -2.369
  128   1HG   MET  25          1HG       MET  25  -2.785  -4.665  -2.282
  129   1HE   MET  25          1HE       MET  25  -1.107  -7.047  -0.480
  130   2HE   MET  25          2HE       MET  25  -2.190  -6.815   0.891
  131   3HE   MET  25          3HE       MET  25  -1.676  -5.429  -0.068
  132    H    LYS  26           H        LYS  26  -1.922  -5.810  -6.000
  133    HA   LYS  26           HA       LYS  26   0.656  -5.848  -7.112
  134   1HB   LYS  26          1HB       LYS  26  -0.705  -8.194  -7.665
  135   1HG   LYS  26          1HG       LYS  26   1.667  -6.842  -8.787
  136   1HD   LYS  26          1HD       LYS  26   0.005  -8.696 -10.333
  137   1HE   LYS  26          1HE       LYS  26   1.537 -10.379  -9.751
  138   1HZ   LYS  26          1HZ       LYS  26   4.052  -9.619 -10.270
  139   2HZ   LYS  26          2HZ       LYS  26   3.371  -9.655  -8.723
  140   3HZ   LYS  26          3HZ       LYS  26   3.430  -8.201  -9.585
  141    H    LYS  27           H        LYS  27   0.438  -5.172  -9.612
  142    HA   LYS  27           HA       LYS  27  -0.278  -3.633 -11.134
  143   1HB   LYS  27          1HB       LYS  27  -2.851  -3.380  -9.584
  144   1HG   LYS  27          1HG       LYS  27  -2.477  -5.766  -9.996
  145   1HD   LYS  27          1HD       LYS  27  -1.129  -5.085 -12.205
  146   1HE   LYS  27          1HE       LYS  27  -3.688  -6.122 -13.363
  147   1HZ   LYS  27          1HZ       LYS  27  -1.258  -5.905 -14.425
  148   2HZ   LYS  27          2HZ       LYS  27  -1.888  -4.389 -14.837
  149   3HZ   LYS  27          3HZ       LYS  27  -2.684  -5.797 -15.331
  150    H    GLY  28           H        GLY  28  -1.637  -1.281 -10.944
  151   1HA   GLY  28          1HA       GLY  28  -0.137   0.143  -8.831
  152   2HA   GLY  28          2HA       GLY  28  -0.437   0.804 -10.431
  153    H    ASP  29           H        ASP  29  -2.949  -0.948  -8.789
  154    HA   ASP  29           HA       ASP  29  -4.763   1.212  -8.957
  155   1HB   ASP  29          1HB       ASP  29  -5.402  -1.209  -8.916
  156    H    ILE  30           H        ILE  30  -4.916   2.947  -7.706
  157    HA   ILE  30           HA       ILE  30  -3.314   3.399  -5.459
  158    HB   ILE  30           HB       ILE  30  -5.907   4.844  -5.961
  159   1HG1  ILE  30          1HG1      ILE  30  -3.248   5.111  -7.368
  160   1HG2  ILE  30          1HG2      ILE  30  -5.023   5.624  -3.970
  161   2HG2  ILE  30          2HG2      ILE  30  -4.343   6.755  -5.137
  162   3HG2  ILE  30          3HG2      ILE  30  -3.357   5.433  -4.513
  163   1HD1  ILE  30          1HD1      ILE  30  -3.506   7.293  -7.527
  164   2HD1  ILE  30          2HD1      ILE  30  -5.058   7.227  -6.690
  165   3HD1  ILE  30          3HD1      ILE  30  -4.987   6.993  -8.437
  166    H    LEU  31           H        LEU  31  -4.166   4.002  -3.263
  167    HA   LEU  31           HA       LEU  31  -6.469   2.450  -2.388
  168   1HB   LEU  31          1HB       LEU  31  -4.469   1.867  -0.500
  169    HG   LEU  31           HG       LEU  31  -3.510   1.222  -3.293
  170   1HD1  LEU  31          1HD1      LEU  31  -2.803   3.285  -1.368
  171   2HD1  LEU  31          2HD1      LEU  31  -2.393   3.140  -3.076
  172   3HD1  LEU  31          3HD1      LEU  31  -1.423   2.305  -1.862
  173   1HD2  LEU  31          1HD2      LEU  31  -1.579   0.316  -1.670
  174   2HD2  LEU  31          2HD2      LEU  31  -2.902  -0.692  -2.256
  175   3HD2  LEU  31          3HD2      LEU  31  -2.984   0.023  -0.646
  176    H    THR  32           H        THR  32  -6.102   2.593   0.325
  177    HA   THR  32           HA       THR  32  -6.243   5.490   0.789
  178    HB   THR  32           HB       THR  32  -8.233   4.118   1.358
  179    HG1  THR  32           HG1      THR  32  -6.873   5.359   3.511
  180   1HG2  THR  32          1HG2      THR  32  -8.272   2.597   3.154
  181   2HG2  THR  32          2HG2      THR  32  -6.610   2.975   3.608
  182   3HG2  THR  32          3HG2      THR  32  -6.940   2.100   2.111
  183    H    LEU  33           H        LEU  33  -4.946   2.514   2.244
  184    HA   LEU  33           HA       LEU  33  -3.125   2.131   3.550
  185   1HB   LEU  33          1HB       LEU  33  -2.108   4.898   3.063
  186    HG   LEU  33           HG       LEU  33  -2.984   3.493   0.874
  187   1HD1  LEU  33          1HD1      LEU  33  -1.210   4.908  -0.336
  188   2HD1  LEU  33          2HD1      LEU  33  -0.810   5.514   1.272
  189   3HD1  LEU  33          3HD1      LEU  33  -2.436   5.737   0.623
  190   1HD2  LEU  33          1HD2      LEU  33  -1.593   1.735   0.662
  191   2HD2  LEU  33          2HD2      LEU  33  -0.346   2.461   1.676
  192   3HD2  LEU  33          3HD2      LEU  33  -0.499   2.940  -0.015
  193    H    LEU  34           H        LEU  34  -1.906   3.032   5.520
  194    HA   LEU  34           HA       LEU  34  -3.901   4.240   7.270
  195   1HB   LEU  34          1HB       LEU  34  -2.892   2.204   8.065
  196    HG   LEU  34           HG       LEU  34  -2.791   4.557   9.610
  197   1HD1  LEU  34          1HD1      LEU  34  -3.298   3.131  11.390
  198   2HD1  LEU  34          2HD1      LEU  34  -2.420   1.778  10.676
  199   3HD1  LEU  34          3HD1      LEU  34  -3.945   2.310   9.971
  200   1HD2  LEU  34          1HD2      LEU  34  -0.797   4.714  10.620
  201   2HD2  LEU  34          2HD2      LEU  34  -0.191   3.838   9.214
  202   3HD2  LEU  34          3HD2      LEU  34  -0.587   2.964  10.693
  203    H    ASN  35           H        ASN  35  -0.364   4.536   7.357
  204    HA   ASN  35           HA       ASN  35  -0.624   7.448   7.148
  205   1HB   ASN  35          1HB       ASN  35  -0.581   6.859   9.557
  206   1HD2  ASN  35          1HD2      ASN  35  -0.618   9.177   8.758
  207   2HD2  ASN  35          2HD2      ASN  35   0.761  10.140   9.149
  208    H    SER  36           H        SER  36   1.575   4.667   7.277
  209    HA   SER  36           HA       SER  36   3.430   4.145   6.065
  210   1HB   SER  36          1HB       SER  36   1.957   5.197   4.190
  211    HG   SER  36           HG       SER  36   3.618   4.875   2.760
  212    H    THR  37           H        THR  37   5.247   4.406   7.168
  213    HA   THR  37           HA       THR  37   6.896   6.659   6.923
  214    HB   THR  37           HB       THR  37   5.255   7.728   8.403
  215    HG1  THR  37           HG1      THR  37   7.643   7.158   9.817
  216   1HG2  THR  37          1HG2      THR  37   6.031   5.746  10.520
  217   2HG2  THR  37          2HG2      THR  37   4.539   5.640   9.585
  218   3HG2  THR  37          3HG2      THR  37   4.834   7.036  10.622
  219    H    ASN  38           H        ASN  38   8.873   6.484   8.230
  220    HA   ASN  38           HA       ASN  38  10.639   5.292   9.025
  221   1HB   ASN  38          1HB       ASN  38   8.348   3.894  10.387
  222   1HD2  ASN  38          1HD2      ASN  38  11.309   4.468  11.969
  223   2HD2  ASN  38          2HD2      ASN  38  10.834   5.880  12.844
  224    H    LYS  39           H        LYS  39  11.587   2.971   9.119
  225    HA   LYS  39           HA       LYS  39  10.706   1.548   6.693
  226   1HB   LYS  39          1HB       LYS  39  13.054   2.745   6.889
  227   1HG   LYS  39          1HG       LYS  39  12.170   1.118   5.073
  228   1HD   LYS  39          1HD       LYS  39  12.931  -0.786   6.865
  229   1HE   LYS  39          1HE       LYS  39  14.884  -1.857   5.499
  230   1HZ   LYS  39          1HZ       LYS  39  15.674   0.378   7.254
  231   2HZ   LYS  39          2HZ       LYS  39  16.366  -1.159   7.115
  232   3HZ   LYS  39          3HZ       LYS  39  14.871  -0.973   7.882
  233    H    ASP  40           H        ASP  40   9.586  -0.190   7.301
  234    HA   ASP  40           HA       ASP  40  10.785  -2.370   8.579
  235   1HB   ASP  40          1HB       ASP  40   9.454  -0.447  10.361
  236    H    TRP  41           H        TRP  41   9.801  -3.170   6.631
  237    HA   TRP  41           HA       TRP  41   8.238  -4.381   5.519
  238   1HB   TRP  41          1HB       TRP  41   7.404  -5.856   6.988
  239    HD1  TRP  41           HD1      TRP  41   4.997  -5.753   5.646
  240    HE1  TRP  41           HE1      TRP  41   2.659  -5.124   6.516
  241    HE3  TRP  41           HE3      TRP  41   6.346  -3.328   9.943
  242    HZ2  TRP  41           HZ2      TRP  41   1.540  -3.776   8.725
  243    HZ3  TRP  41           HZ3      TRP  41   4.580  -2.393  11.373
  244    HH2  TRP  41           HH2      TRP  41   2.225  -2.616  10.775
  245    H    TRP  42           H        TRP  42   6.303  -2.287   7.669
  246    HA   TRP  42           HA       TRP  42   4.653  -0.797   7.267
  247   1HB   TRP  42          1HB       TRP  42   6.317   0.555   6.223
  248    HD1  TRP  42           HD1      TRP  42   5.554   1.389   3.050
  249    HE1  TRP  42           HE1      TRP  42   3.425   2.797   2.737
  250    HE3  TRP  42           HE3      TRP  42   3.241   0.387   7.506
  251    HZ2  TRP  42           HZ2      TRP  42   1.080   3.403   4.180
  252    HZ3  TRP  42           HZ3      TRP  42   1.057   1.421   7.956
  253    HH2  TRP  42           HH2      TRP  42  -0.001   2.900   6.325
  254    H    LYS  43           H        LYS  43   2.633  -1.446   6.987
  255    HA   LYS  43           HA       LYS  43   1.893  -3.395   5.035
  256   1HB   LYS  43          1HB       LYS  43  -0.466  -2.806   5.839
  257   1HG   LYS  43          1HG       LYS  43   0.921  -1.435   8.105
  258   1HD   LYS  43          1HD       LYS  43  -1.559  -0.440   8.009
  259   1HE   LYS  43          1HE       LYS  43  -2.147  -2.614   9.420
  260   1HZ   LYS  43          1HZ       LYS  43  -0.158  -0.553  10.193
  261   2HZ   LYS  43          2HZ       LYS  43  -0.896  -1.614  11.283
  262   3HZ   LYS  43          3HZ       LYS  43  -1.832  -0.490  10.432
  263    H    VAL  44           H        VAL  44  -0.382  -2.757   3.865
  264    HA   VAL  44           HA       VAL  44   0.212  -0.315   2.328
  265    HB   VAL  44           HB       VAL  44   0.289  -2.820   1.302
  266   1HG1  VAL  44          1HG1      VAL  44  -2.462  -1.820   0.588
  267   2HG1  VAL  44          2HG1      VAL  44  -2.142  -3.131   1.723
  268   3HG1  VAL  44          3HG1      VAL  44  -1.685  -3.300   0.028
  269   1HG2  VAL  44          1HG2      VAL  44  -0.643  -1.179  -0.797
  270   2HG2  VAL  44          2HG2      VAL  44   1.021  -1.570  -0.368
  271   3HG2  VAL  44          3HG2      VAL  44   0.242  -0.148   0.326
  272    H    GLU  45           H        GLU  45  -2.337  -2.416   3.579
  273    HA   GLU  45           HA       GLU  45  -4.501  -2.024   4.151
  274   1HB   GLU  45          1HB       GLU  45  -3.073   0.287   4.882
  275   1HG   GLU  45          1HG       GLU  45  -5.476  -1.117   5.750
  276    H    VAL  46           H        VAL  46  -5.999  -2.465   2.688
  277    HA   VAL  46           HA       VAL  46  -6.597  -0.480   0.621
  278    HB   VAL  46           HB       VAL  46  -6.381  -3.419  -0.027
  279   1HG1  VAL  46          1HG1      VAL  46  -6.307  -2.250  -2.391
  280   2HG1  VAL  46          2HG1      VAL  46  -7.167  -0.975  -1.526
  281   3HG1  VAL  46          3HG1      VAL  46  -7.838  -2.606  -1.588
  282   1HG2  VAL  46          1HG2      VAL  46  -4.446  -2.240  -1.512
  283   2HG2  VAL  46          2HG2      VAL  46  -4.162  -3.047   0.031
  284   3HG2  VAL  46          3HG2      VAL  46  -4.351  -1.294  -0.026
  285    H    ASN  47           H        ASN  47  -7.595  -3.702   1.785
  286    HA   ASN  47           HA       ASN  47 -10.345  -2.678   1.982
  287   1HB   ASN  47          1HB       ASN  47  -9.330  -5.016   0.484
  288   1HD2  ASN  47          1HD2      ASN  47  -9.489  -3.971  -1.398
  289   2HD2  ASN  47          2HD2      ASN  47 -10.942  -3.275  -2.022
  290    H    ASP  48           H        ASP  48 -11.645  -4.693   3.127
  291    HA   ASP  48           HA       ASP  48 -10.702  -4.658   5.802
  292   1HB   ASP  48          1HB       ASP  48 -12.835  -6.476   4.670
  293    H    ARG  49           H        ARG  49  -8.539  -5.570   5.277
  294    HA   ARG  49           HA       ARG  49  -8.505  -8.380   5.935
  295   1HB   ARG  49          1HB       ARG  49  -6.871  -8.845   4.020
  296   1HG   ARG  49          1HG       ARG  49  -8.298  -6.859   2.384
  297   1HD   ARG  49          1HD       ARG  49  -6.400  -8.649   1.854
  298    HE   ARG  49           HE       ARG  49  -4.421  -7.918   2.720
  299   1HH1  ARG  49          1HH1      ARG  49  -6.184  -5.161   1.507
  300   2HH1  ARG  49          2HH1      ARG  49  -4.877  -4.055   1.764
  301   1HH2  ARG  49          1HH2      ARG  49  -2.700  -6.464   3.058
  302   2HH2  ARG  49          2HH2      ARG  49  -2.900  -4.794   2.644
  303    H    GLN  50           H        GLN  50  -7.630  -5.772   7.049
  304    HA   GLN  50           HA       GLN  50  -5.879  -4.885   8.198
  305   1HB   GLN  50          1HB       GLN  50  -5.891  -7.564   8.728
  306   1HG   GLN  50          1HG       GLN  50  -3.925  -6.950  10.357
  307   1HE2  GLN  50          1HE2      GLN  50  -6.245  -8.177  10.599
  308   2HE2  GLN  50          2HE2      GLN  50  -7.280  -7.379  11.729
  309    H    GLY  51           H        GLY  51  -3.158  -5.286   8.168
  310   1HA   GLY  51          1HA       GLY  51  -2.492  -4.231   5.527
  311   2HA   GLY  51          2HA       GLY  51  -1.474  -4.170   6.959
  312    H    PHE  52           H        PHE  52   0.160  -5.572   7.103
  313    HA   PHE  52           HA       PHE  52   1.630  -7.210   6.516
  314   1HB   PHE  52          1HB       PHE  52  -0.878  -8.778   5.881
  315    HD1  PHE  52           HD1      PHE  52   1.579  -7.912   8.535
  316    HD2  PHE  52           HD2      PHE  52  -2.249  -9.510   7.587
  317    HE1  PHE  52           HE1      PHE  52   1.034  -8.020  10.933
  318    HE2  PHE  52           HE2      PHE  52  -2.802  -9.621   9.983
  319    HZ   PHE  52           HZ       PHE  52  -1.158  -8.874  11.658
  320    H    VAL  53           H        VAL  53   2.309  -5.889   4.712
  321    HA   VAL  53           HA       VAL  53   2.513  -7.283   2.305
  322    HB   VAL  53           HB       VAL  53   0.268  -6.859   1.753
  323   1HG1  VAL  53          1HG1      VAL  53  -0.338  -5.310   3.458
  324   2HG1  VAL  53          2HG1      VAL  53  -0.743  -4.581   1.905
  325   3HG1  VAL  53          3HG1      VAL  53   0.700  -4.062   2.775
  326   1HG2  VAL  53          1HG2      VAL  53   0.500  -5.879  -0.275
  327   2HG2  VAL  53          2HG2      VAL  53   2.210  -5.921   0.153
  328   3HG2  VAL  53          3HG2      VAL  53   1.279  -4.442   0.387
  329    HA   PRO  54           HA       PRO  54   5.775  -4.121   3.042
  330   1HB   PRO  54          1HB       PRO  54   6.990  -5.868   0.955
  331   1HG   PRO  54          1HG       PRO  54   6.950  -7.780   2.282
  332   1HD   PRO  54          1HD       PRO  54   4.727  -7.657   1.677
  333    H    ALA  55           H        ALA  55   5.870  -2.243   1.991
  334    HA   ALA  55           HA       ALA  55   4.492  -1.778  -0.422
  335   1HB   ALA  55          1HB       ALA  55   4.986  -0.098   1.393
  336   2HB   ALA  55          2HB       ALA  55   5.236   0.465  -0.260
  337   3HB   ALA  55          3HB       ALA  55   6.618   0.009   0.734
  338    H    ALA  56           H        ALA  56   7.990  -1.837   0.268
  339    HA   ALA  56           HA       ALA  56   9.802  -2.174  -1.067
  340   1HB   ALA  56          1HB       ALA  56   8.973  -4.342  -1.493
  341   2HB   ALA  56          2HB       ALA  56   9.423  -3.684  -3.067
  342   3HB   ALA  56          3HB       ALA  56   7.727  -3.735  -2.584
  343    H    TYR  57           H        TYR  57   8.720   0.303  -1.348
  344    HA   TYR  57           HA       TYR  57   9.070   2.130  -2.674
  345   1HB   TYR  57          1HB       TYR  57  10.582   1.877  -4.296
  346    HD1  TYR  57           HD1      TYR  57  10.570   2.574  -6.469
  347    HD2  TYR  57           HD2      TYR  57   8.049  -0.677  -5.385
  348    HE1  TYR  57           HE1      TYR  57   9.751   2.438  -8.784
  349    HE2  TYR  57           HE2      TYR  57   7.229  -0.822  -7.692
  350    HH   TYR  57           HH       TYR  57   8.707   0.491 -10.255
  351    H    VAL  58           H        VAL  58   7.739   3.428  -3.953
  352    HA   VAL  58           HA       VAL  58   5.728   2.503  -5.667
  353    HB   VAL  58           HB       VAL  58   4.738   1.509  -3.670
  354   1HG1  VAL  58          1HG1      VAL  58   4.130   2.708  -1.747
  355   2HG1  VAL  58          2HG1      VAL  58   4.383   4.266  -2.536
  356   3HG1  VAL  58          3HG1      VAL  58   5.765   3.254  -2.123
  357   1HG2  VAL  58          1HG2      VAL  58   2.592   2.112  -4.155
  358   2HG2  VAL  58          2HG2      VAL  58   3.416   2.815  -5.548
  359   3HG2  VAL  58          3HG2      VAL  58   2.963   3.837  -4.183
  360    H    LYS  59           H        LYS  59   6.355   4.951  -3.159
  361    HA   LYS  59           HA       LYS  59   6.626   7.089  -4.922
  362   1HB   LYS  59          1HB       LYS  59   4.010   6.375  -4.916
  363   1HG   LYS  59          1HG       LYS  59   4.098   9.246  -4.996
  364   1HD   LYS  59          1HD       LYS  59   4.090   7.344  -7.321
  365   1HE   LYS  59          1HE       LYS  59   4.135   9.813  -7.708
  366   1HZ   LYS  59          1HZ       LYS  59   2.878  10.736  -6.003
  367   2HZ   LYS  59          2HZ       LYS  59   1.601   9.644  -6.201
  368   3HZ   LYS  59          3HZ       LYS  59   1.859  10.862  -7.347
  369    H    LYS  60           H        LYS  60   5.681   9.227  -3.486
  370    HA   LYS  60           HA       LYS  60   6.781   8.845  -0.784
  371   1HB   LYS  60          1HB       LYS  60   7.642  10.740  -2.905
  372   1HG   LYS  60          1HG       LYS  60   8.896   9.017  -0.880
  373   1HD   LYS  60          1HD       LYS  60   9.455  11.666  -0.595
  374   1HE   LYS  60          1HE       LYS  60  11.537  12.168  -1.639
  375   1HZ   LYS  60          1HZ       LYS  60   9.741  11.017  -3.705
  376   2HZ   LYS  60          2HZ       LYS  60  10.953  12.166  -3.973
  377   3HZ   LYS  60          3HZ       LYS  60   9.599  12.566  -3.040
  378    H    LEU  61           H        LEU  61   4.678   8.836   0.065
  379    HA   LEU  61           HA       LEU  61   2.690  10.729  -0.476
  380   1HB   LEU  61          1HB       LEU  61   2.612   8.492   0.856
  381    HG   LEU  61           HG       LEU  61   0.611   9.116   2.108
  382   1HD1  LEU  61          1HD1      LEU  61   1.232  11.966   1.358
  383   2HD1  LEU  61          2HD1      LEU  61   1.509  11.276   2.957
  384   3HD1  LEU  61          3HD1      LEU  61  -0.129  11.381   2.314
  385   1HD2  LEU  61          1HD2      LEU  61  -0.730   9.774   0.277
  386   2HD2  LEU  61          2HD2      LEU  61   0.612   8.854  -0.405
  387   3HD2  LEU  61          3HD2      LEU  61   0.613  10.615  -0.499
  388    H    ASP  62           H        ASP  62   4.683  10.573   2.480
  389    HA   ASP  62           HA       ASP  62   4.744  13.513   2.493
  390   1HB   ASP  62          1HB       ASP  62   3.786  11.659   4.611