*HEADER    APOPTOSIS                               07-JAN-16   2NAQ              
*TITLE     3D NMR SOLUTION STRUCTURE OF NLRP3 PYD                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NACHT, LRR AND PYD DOMAINS-CONTAINING PROTEIN 3;           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: PYRIN DOMAIN RESIDUES 3-93;                                
*COMPND   5 SYNONYM: ANGIOTENSIN/VASOPRESSIN RECEPTOR AII/AVP-LIKE, CATERPILLER  
*COMPND   6 PROTEIN 1.1, CLR1.1, COLD-INDUCED AUTOINFLAMMATORY SYNDROME 1        
*COMPND   7 PROTEIN, CRYOPYRIN, PYRIN-CONTAINING APAF1-LIKE PROTEIN 1;           
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: NLRP3, C1ORF7, CIAS1, NALP3, PYPAF1;                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET-15B                                    
*KEYWDS    DEATH DOMAIN SUPERFAMILY, APOPTOSIS                                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    E.DE ALBA, J.OROZ                                                     
*REVDAT   1   27-JUL-16 2NAQ    0                                                


assign (resid   3 and (name HB1 or name HB2 )) (resid    4 and name HN ) 3.9 1.0 1.6
assign (resid   3 and name HA ) (resid    3 and (name HB1 or name HB2 )) 3.5 0.9 1.4 
assign (resid   3 and name HA ) (resid    3 and (name HB2 or name HB1 )) 3.4 0.8 1.3 
assign (resid   3 and name HA ) (resid    4 and name HA ) 4.0 1.0 1.6 
assign (resid   4 and name HA ) (resid    4 and name HG2# ) 3.2 0.8 1.3 
assign (resid   4 and name HA ) (resid    4 and name HN ) 4.0 1.0 1.6 
assign (resid   4 and name HA ) (resid    7 and name HD# ) 3.1 0.8 1.2 
assign (resid   4 and name HA ) (resid    8 and name HN ) 3.6 0.9 1.4 
assign (resid   4 and name HA ) (resid   90 and (name HG2 or name HG1 )) 3.7 0.9 1.5 
assign (resid   4 and name HB ) (resid    4 and name HG2# ) 2.8 0.7 1.1 
assign (resid   4 and name HB ) (resid    8 and name HN ) 3.6 0.9 1.4 
assign (resid   4 and name HG2# ) (resid    6 and name HN ) 3.9 1.0 1.6 
assign (resid   4 and name HG2# ) (resid    8 and (name HD1# or name HD2# )) 3.7 0.9 1.5 
assign (resid   4 and name HG2# ) (resid   57 and name HD1# ) 2.7 0.7 1.1 
assign (resid   4 and name HG2# ) (resid   62 and (name HG1 or name HG2 )) 3.8 0.9 1.5 
assign (resid   4 and name HG2# ) (resid   62 and (name HG2 or name HG1 )) 3.5 0.9 1.4 
assign (resid   4 and name HG2# ) (resid   62 and name HB# ) 4.4 1.1 1.7 
assign (resid   4 and name HG2# ) (resid   90 and (name HB1 or name HB2 )) 3.3 0.8 1.3 
assign (resid   4 and name HG2# ) (resid   90 and (name HG2 or name HG1 )) 2.7 0.7 1.1 
assign (resid   5 and name HA ) (resid  57 and name HD1# ) 3.2 0.8 1.3
assign (resid   5 and (name HD1 or name HD2 )) (resid   50 and (name HG1# or name HG2# )) 4.0 1.0 1.6
assign (resid   5 and (name HD1 or name HD2 )) (resid   54 and name HG2# ) 3.3 0.8 1.3
assign (resid   5 and (name HD2 or name HD1 )) (resid   50 and (name HG1# or name HG2# )) 3.6 0.9 1.4
assign (resid   5 and (name HD2 or name HD1 )) (resid   54 and name HG2# ) 3.5 0.9 1.4
assign (resid   5 and name HA ) (resid    5 and name HN ) 3.6 0.9 1.4 
assign (resid   5 and name HA ) (resid   57 and name HD1# ) 3.0 0.7 1.2 
assign (resid   5 and name HB# ) (resid    6 and name HB# ) 3.1 0.8 1.2 
assign (resid   5 and name HN ) (resid   57 and name HD1# ) 3.8 1.0 1.5 
assign (resid   6 and name HA ) (resid    6 and name HB# ) 2.9 0.7 1.2 
assign (resid   6 and name HA ) (resid    7 and name HN ) 3.4 0.8 1.4 
assign (resid   6 and name HA ) (resid    9 and name HB# ) 3.8 1.0 1.5 
assign (resid   6 and name HB# ) (resid    7 and name HN ) 3.5 0.9 1.4 
assign (resid   6 and name HB# ) (resid   10 and name HG# ) 4.0 1.0 1.6 
assign (resid   7 and name HA ) (resid    7 and name HB# ) 3.0 0.8 1.2 
assign (resid   7 and name HA ) (resid    7 and name HN ) 3.7 0.9 1.5 
assign (resid   7 and name HA ) (resid    8 and name HN ) 3.6 0.9 1.4 
assign (resid   7 and name HB# ) (resid    7 and (name HG2 or name HG1 )) 2.9 0.7 1.2 
assign (resid   7 and name HB# ) (resid    7 and name HE# ) 3.7 0.9 1.5 
assign (resid   7 and name HD# ) (resid    7 and name HE# ) 3.0 0.8 1.2 
assign (resid   8 and (name HD1# or name HD2# )) (resid    9 and name HB# ) 3.5 0.9 1.4
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assign (resid   8 and (name HD1# or name HD2# )) (resid   11 and name HD# ) 4.2 1.1 1.7
assign (resid   8 and (name HD1# or name HD2# )) (resid   56 and name HE# ) 3.2 0.8 1.3
assign (resid   8 and (name HD1# or name HD2# )) (resid   57 and name HA ) 4.5 1.1 1.8
assign (resid   8 and (name HD1# or name HD2# )) (resid   66 and name HE3 ) 4.3 1.1 1.7
assign (resid   8 and (name HD1# or name HD2# )) (resid   66 and name HZ3 ) 4.5 1.1 1.8
assign (resid   8 and (name HD1# or name HD2# )) (resid   69 and name HB# ) 3.1 0.8 1.2
assign (resid   8 and (name HD2# or name HD1# )) (resid   11 and (name HB2 or name HB1 )) 4.6 1.1 1.8
assign (resid   8 and (name HD2# or name HD1# )) (resid   11 and name HE# ) 4.5 1.1 1.8
assign (resid   8 and (name HD2# or name HD1# )) (resid   56 and (name HB2 or name HB1 )) 3.3 0.8 1.3
assign (resid   8 and (name HD2# or name HD1# )) (resid   65 and name HB# ) 2.9 0.7 1.1
assign (resid   8 and name HA ) (resid    8 and (name HD1# or name HD2# )) 3.4 0.9 1.4 
assign (resid   8 and name HA ) (resid    8 and name HN ) 4.2 1.0 1.7 
assign (resid   8 and name HG ) (resid   11 and name HE# ) 4.5 1.1 1.8 
assign (resid   9 and name HA ) (resid    9 and name HB# ) 2.8 0.7 1.1 
assign (resid   9 and name HA ) (resid    9 and name HN ) 3.8 0.9 1.5 
assign (resid   9 and name HA ) (resid   12 and (name HB1 or name HB2 )) 3.7 0.9 1.5 
assign (resid   9 and name HA ) (resid   12 and (name HB2 or name HB1 )) 4.3 1.1 1.7 
assign (resid   9 and name HA ) (resid   12 and (name HD1# or name HD2# )) 4.0 1.0 1.6 
assign (resid   9 and name HA ) (resid   12 and name HN ) 4.1 1.0 1.6 
assign (resid   9 and name HB# ) (resid   10 and name HN ) 2.9 0.7 1.1 
assign (resid   9 and name HB# ) (resid   12 and (name HB1 or name HB2 )) 4.4 1.1 1.8 
assign (resid   9 and name HB# ) (resid   13 and (name HG1 or name HG2 )) 3.1 0.8 1.2 
assign (resid   9 and name HB# ) (resid   49 and (name HB1 or name HB2 )) 3.8 0.9 1.5 
assign (resid   9 and name HB# ) (resid   50 and (name HG1# or name HG2# )) 2.8 0.7 1.1 
assign (resid   9 and name HB# ) (resid   50 and (name HG2# or name HG1# )) 2.9 0.7 1.2 
assign (resid   9 and name HB# ) (resid   50 and name HA ) 2.7 0.7 1.1 
assign (resid   9 and name HN ) (resid   12 and (name HD1# or name HD2# )) 4.2 1.0 1.7 
assign (resid  10 and name HA ) (resid   10 and name HB# ) 2.8 0.7 1.1 
assign (resid  10 and name HA ) (resid   10 and name HD# ) 3.5 0.9 1.4 
assign (resid  10 and name HA ) (resid   10 and name HG# ) 3.2 0.8 1.3 
assign (resid  10 and name HA ) (resid   10 and name HN ) 3.4 0.9 1.4 
assign (resid  10 and name HA ) (resid   11 and name HD# ) 4.0 1.0 1.6 
assign (resid  10 and name HB# ) (resid   10 and name HD# ) 2.8 0.7 1.1 
assign (resid  10 and name HD# ) (resid   10 and name HG# ) 2.9 0.7 1.1 
assign (resid  10 and name HG# ) (resid   10 and name HN ) 3.5 0.9 1.4 
assign (resid  11 and (name HB1 or name HB2 )) (resid   13 and name HN ) 3.7 0.9 1.5
assign (resid  11 and (name HB1 or name HB2 )) (resid   69 and name HB# ) 4.0 1.0 1.6
assign (resid  11 and (name HB1 or name HB2 )) (resid   73 and name HZ ) 3.9 1.0 1.6
assign (resid  11 and (name HB1 or name HB2 )) (resid   81 and (name HD1# or name HD2# )) 3.2 0.8 1.3
assign (resid  11 and (name HB2 or name HB1 )) (resid   13 and name HN ) 4.3 1.1 1.7
assign (resid  11 and (name HB2 or name HB1 )) (resid   69 and name HB# ) 3.9 1.0 1.5
assign (resid  11 and (name HB2 or name HB1 )) (resid   73 and name HZ ) 4.0 1.0 1.6
assign (resid  11 and (name HB2 or name HB1 )) (resid   81 and (name HD1# or name HD2# )) 3.0 0.8 1.2
assign (resid  11 and name HA ) (resid   11 and name HD# ) 3.6 0.9 1.4 
assign (resid  11 and name HA ) (resid   11 and name HE# ) 4.1 1.0 1.6 
assign (resid  11 and name HA ) (resid   14 and name HN ) 4.0 1.0 1.6 
assign (resid  11 and name HA ) (resid   81 and (name HD1# or name HD2# )) 3.7 0.9 1.5 
assign (resid  11 and name HA ) (resid   81 and (name HD2# or name HD1# )) 4.4 1.1 1.8 
assign (resid  11 and name HD# ) (resid   11 and name HE# ) 3.0 0.7 1.2 
assign (resid  11 and name HD# ) (resid   81 and (name HD1# or name HD2# )) 3.4 0.8 1.4 
assign (resid  11 and name HD# ) (resid   81 and (name HD2# or name HD1# )) 4.1 1.0 1.6 
assign (resid  11 and name HE# ) (resid   81 and name HA ) 4.2 1.1 1.7 
assign (resid  11 and name HE# ) (resid   84 and (name HB1 or name HB2 )) 4.1 1.0 1.6 
assign (resid  11 and name HE# ) (resid   84 and (name HB2 or name HB1 )) 3.4 0.9 1.4 
assign (resid  11 and name HE# ) (resid   85 and name HA ) 4.1 1.0 1.6 
assign (resid  11 and name HE# ) (resid   85 and name HB# ) 4.3 1.1 1.7 
assign (resid  11 and name HE# ) (resid   88 and (name HB1 or name HB2 )) 4.1 1.0 1.6 
assign (resid  11 and name HE# ) (resid   88 and (name HB2 or name HB1 )) 4.4 1.1 1.8 
assign (resid  12 and (name HB1 or name HB2 )) (resid   12 and name HG ) 3.6 0.9 1.4
assign (resid  12 and (name HB2 or name HB1 )) (resid   12 and name HG ) 3.8 1.0 1.5
assign (resid  12 and (name HB2 or name HB1 )) (resid   52 and (name HD1# or name HD2# )) 3.9 1.0 1.5
assign (resid  12 and (name HD1# or name HD2# )) (resid   23 and name HD# ) 4.0 1.0 1.6
assign (resid  12 and (name HD1# or name HD2# )) (resid   49 and (name HB1 or name HB2 )) 3.8 1.0 1.5
assign (resid  12 and (name HD1# or name HD2# )) (resid   49 and (name HB2 or name HB1 )) 3.6 0.9 1.4
assign (resid  12 and (name HD1# or name HD2# )) (resid   52 and name HN ) 3.8 0.9 1.5
assign (resid  12 and (name HD1# or name HD2# )) (resid   53 and name HA ) 3.4 0.8 1.4
assign (resid  12 and (name HD1# or name HD2# )) (resid   53 and name HB# ) 2.5 0.6 1.0
assign (resid  12 and (name HD1# or name HD2# )) (resid   53 and name HN ) 3.5 0.9 1.4
assign (resid  12 and (name HD1# or name HD2# )) (resid   73 and name HD# ) 3.8 1.0 1.5
assign (resid  12 and (name HD2# or name HD1# )) (resid   12 and name HN ) 4.0 1.0 1.6
assign (resid  12 and (name HD2# or name HD1# )) (resid   14 and name HN ) 4.4 1.1 1.8
assign (resid  12 and (name HD2# or name HD1# )) (resid   15 and (name HD2# or name HD1# )) 3.4 0.9 1.4
assign (resid  12 and (name HD2# or name HD1# )) (resid   23 and name HE# ) 3.5 0.9 1.4
assign (resid  12 and (name HD2# or name HD1# )) (resid   23 and name HZ ) 3.6 0.9 1.4
assign (resid  12 and (name HD2# or name HD1# )) (resid   52 and (name HB2 or name HB1 )) 3.6 0.9 1.4
assign (resid  12 and name HA ) (resid   12 and (name HD1# or name HD2# )) 3.6 0.9 1.4 
assign (resid  12 and name HA ) (resid   12 and (name HD2# or name HD1# )) 3.4 0.8 1.4 
assign (resid  12 and name HA ) (resid   12 and name HG ) 4.4 1.1 1.7 
assign (resid  12 and name HA ) (resid   12 and name HN ) 4.0 1.0 1.6 
assign (resid  12 and name HA ) (resid   15 and (name HB1 or name HB2 )) 3.9 1.0 1.6 
assign (resid  12 and name HA ) (resid   15 and (name HD1# or name HD2# )) 3.9 1.0 1.5 
assign (resid  12 and name HA ) (resid   15 and (name HD2# or name HD1# )) 4.0 1.0 1.6 
assign (resid  12 and name HG ) (resid   14 and name HN ) 4.3 1.1 1.7 
assign (resid  13 and (name HG2 or name HG1 )) (resid   13 and name HN ) 3.9 1.0 1.6
assign (resid  13 and name HA ) (resid   13 and name HB# ) 3.3 0.8 1.3 
assign (resid  13 and name HA ) (resid   14 and name HN ) 4.2 1.1 1.7 
assign (resid  13 and name HB# ) (resid   13 and name HN ) 3.4 0.9 1.4 
assign (resid  13 and name HB# ) (resid   14 and name HN ) 3.7 0.9 1.5 
assign (resid  15 and (name HD1# or name HD2# )) (resid   19 and (name HB2 or name HB1 )) 2.9 0.7 1.2
assign (resid  15 and (name HD1# or name HD2# )) (resid   23 and name HE# ) 3.2 0.8 1.3
assign (resid  15 and (name HD1# or name HD2# )) (resid   73 and name HD# ) 3.3 0.8 1.3
assign (resid  15 and (name HD1# or name HD2# )) (resid   81 and (name HD2# or name HD1# )) 3.0 0.8 1.2
assign (resid  15 and (name HD2# or name HD1# )) (resid   19 and (name HB2 or name HB1 )) 4.4 1.1 1.7
assign (resid  15 and (name HD2# or name HD1# )) (resid   20 and name HA ) 3.6 0.9 1.4
assign (resid  15 and (name HD2# or name HD1# )) (resid   23 and (name HB2 or name HB1 )) 4.3 1.1 1.7
assign (resid  15 and (name HD2# or name HD1# )) (resid   23 and name HD# ) 3.7 0.9 1.5
assign (resid  15 and (name HD2# or name HD1# )) (resid   73 and name HD# ) 4.0 1.0 1.6
assign (resid  15 and (name HD2# or name HD1# )) (resid   81 and (name HD2# or name HD1# )) 2.8 0.7 1.1
assign (resid  15 and name HA ) (resid   15 and (name HD1# or name HD2# )) 2.9 0.7 1.1 
assign (resid  16 and (name HB1 or name HB2 )) (resid   16 and name HG# ) 2.8 0.7 1.1
assign (resid  17 and name HA ) (resid   17 and name HB# ) 3.0 0.8 1.2 
assign (resid  17 and name HA ) (resid   18 and name HN ) 3.9 1.0 1.6 
assign (resid  17 and name HA ) (resid   20 and (name HB1 or name HB2 )) 3.4 0.9 1.4 
assign (resid  18 and (name HG1# or name HG2# )) (resid   18 and name HN ) 2.9 0.7 1.1
assign (resid  18 and (name HG2# or name HG1# )) (resid   21 and name HB# ) 3.2 0.8 1.3
assign (resid  18 and (name HG2# or name HG1# )) (resid   21 and name HE# ) 3.3 0.8 1.3
assign (resid  18 and (name HG2# or name HG1# )) (resid   21 and name HG# ) 3.3 0.8 1.3
assign (resid  18 and (name HG2# or name HG1# )) (resid   22 and name HD# ) 3.3 0.8 1.3
assign (resid  18 and name HA ) (resid   18 and (name HG1# or name HG2# )) 2.8 0.7 1.1 
assign (resid  18 and name HA ) (resid   18 and (name HG2# or name HG1# )) 3.1 0.8 1.3 
assign (resid  18 and name HA ) (resid   18 and name HB ) 3.2 0.8 1.3 
assign (resid  18 and name HA ) (resid   21 and name HB# ) 3.4 0.9 1.4 
assign (resid  18 and name HA ) (resid   21 and name HG# ) 3.8 0.9 1.5 
assign (resid  18 and name HB ) (resid   18 and (name HG1# or name HG2# )) 2.6 0.6 1.0 
assign (resid  18 and name HB ) (resid   18 and (name HG2# or name HG1# )) 2.9 0.7 1.1 
assign (resid  18 and name HB ) (resid   19 and name HN ) 4.1 1.0 1.6 
assign (resid  19 and (name HB2 or name HB1 )) (resid   76 and name HD1# ) 3.3 0.8 1.3
assign (resid  19 and name HA ) (resid   22 and name HB1 ) 4.1 1.0 1.7 
assign (resid  19 and name HA ) (resid   76 and name HD1# ) 3.8 1.0 1.5 
assign (resid  20 and (name HD1# or name HD2# )) (resid   23 and (name HB2 or name HB1 )) 4.1 1.0 1.6
assign (resid  20 and name HA ) (resid   20 and (name HD1# or name HD2# )) 2.6 0.6 1.0 
assign (resid  20 and name HA ) (resid   23 and (name HB1 or name HB2 )) 4.1 1.0 1.6 
assign (resid  20 and name HA ) (resid   23 and (name HB2 or name HB1 )) 3.9 1.0 1.6 
assign (resid  20 and name HA ) (resid   23 and name HD# ) 3.9 1.0 1.6 
assign (resid  21 and name HA ) (resid   21 and name HB# ) 2.9 0.7 1.2 
assign (resid  21 and name HA ) (resid   23 and name HN ) 4.1 1.0 1.6 
assign (resid  21 and name HA ) (resid   24 and (name HB2 or name HB1 )) 3.0 0.8 1.2 
assign (resid  21 and name HA ) (resid   24 and name HN ) 4.2 1.0 1.7 
assign (resid  21 and name HB# ) (resid   21 and name HN ) 3.0 0.7 1.2 
assign (resid  21 and name HB# ) (resid   22 and name HN ) 3.4 0.9 1.4 
assign (resid  22 and name HA ) (resid   22 and name HB1 ) 3.1 0.8 1.3 
assign (resid  22 and name HA ) (resid   22 and name HB2 ) 3.2 0.8 1.3 
assign (resid  22 and name HA ) (resid   22 and name HN ) 4.0 1.0 1.6 
assign (resid  22 and name HB1 ) (resid   22 and name HN ) 4.2 1.0 1.7 
assign (resid  22 and name HB1 ) (resid   76 and name HG2# ) 3.4 0.9 1.4 
assign (resid  23 and (name HB1 or name HB2 )) (resid   72 and name HG2# ) 4.3 1.1 1.7
assign (resid  23 and (name HB1 or name HB2 )) (resid   76 and name HG2# ) 4.7 1.2 1.9
assign (resid  23 and (name HB2 or name HB1 )) (resid   52 and (name HD1# or name HD2# )) 4.1 1.0 1.6
assign (resid  23 and (name HB2 or name HB1 )) (resid   76 and name HD1# ) 3.5 0.9 1.4
assign (resid  23 and (name HB2 or name HB1 )) (resid   76 and name HG2# ) 4.1 1.0 1.6
assign (resid  23 and name HA ) (resid   23 and name HD# ) 4.1 1.0 1.6 
assign (resid  23 and name HA ) (resid   25 and name HN ) 4.2 1.1 1.7 
assign (resid  23 and name HA ) (resid   72 and name HG2# ) 3.4 0.9 1.4 
assign (resid  23 and name HA ) (resid   76 and name HD1# ) 3.8 1.0 1.5 
assign (resid  23 and name HA ) (resid   76 and name HG2# ) 3.4 0.9 1.4 
assign (resid  23 and name HD# ) (resid   69 and name HA ) 4.3 1.1 1.7 
assign (resid  23 and name HD# ) (resid   72 and name HG2# ) 3.7 0.9 1.5 
assign (resid  23 and name HD# ) (resid   72 and name HG2# ) 3.8 1.0 1.5 
assign (resid  23 and name HD# ) (resid   76 and name HD1# ) 3.3 0.8 1.3 
assign (resid  23 and name HE# ) (resid   52 and (name HD1# or name HD2# )) 4.2 1.1 1.7 
assign (resid  23 and name HE# ) (resid   69 and name HB# ) 3.5 0.9 1.4 
assign (resid  23 and name HN ) (resid   76 and name HD1# ) 4.1 1.0 1.6 
assign (resid  23 and name HZ ) (resid   56 and name HE# ) 3.0 0.7 1.2 
assign (resid  23 and name HZ ) (resid   69 and name HA ) 3.6 0.9 1.5 
assign (resid  23 and name HZ ) (resid   69 and name HB# ) 3.5 0.9 1.4 
assign (resid  24 and (name HB1 or name HB2 )) (resid   44 and name HG2# ) 3.1 0.8 1.2
assign (resid  24 and (name HB2 or name HB1 )) (resid   44 and name HG2# ) 3.7 0.9 1.5
assign (resid  24 and name HA ) (resid   27 and name HG ) 4.1 1.0 1.6 
assign (resid  25 and name HA ) (resid   25 and (name HB1 or name HB2 )) 2.9 0.7 1.2 
assign (resid  25 and name HA ) (resid   25 and name HN ) 3.5 0.9 1.4 
assign (resid  26 and (name HB1 or name HB2 )) (resid   72 and (name HG12 or name HG11 )) 4.3 1.1 1.7
assign (resid  26 and (name HB1 or name HB2 )) (resid   72 and name HD1# ) 4.4 1.1 1.8
assign (resid  26 and (name HB1 or name HB2 )) (resid   72 and name HG2# ) 4.4 1.1 1.7
assign (resid  26 and (name HB1 or name HB2 )) (resid   76 and name HG2# ) 4.0 1.0 1.6
assign (resid  26 and (name HB2 or name HB1 )) (resid   72 and name HD1# ) 3.9 1.0 1.6
assign (resid  26 and (name HB2 or name HB1 )) (resid   72 and name HG2# ) 4.4 1.1 1.8
assign (resid  26 and name HA ) (resid   26 and (name HB1 or name HB2 )) 3.5 0.9 1.4 
assign (resid  26 and name HA ) (resid   26 and (name HB2 or name HB1 )) 3.5 0.9 1.4 
assign (resid  26 and name HD2 ) (resid   75 and name HB# ) 3.9 1.0 1.6 
assign (resid  26 and name HD2 ) (resid   76 and name HG2# ) 3.4 0.8 1.4 
assign (resid  27 and (name HB1 or name HB2 )) (resid   39 and (name HD2# or name HD1# )) 3.7 0.9 1.5
assign (resid  27 and (name HB2 or name HB1 )) (resid   44 and name HG2# ) 2.8 0.7 1.1
assign (resid  27 and (name HD1# or name HD2# )) (resid   27 and name HN ) 4.0 1.0 1.6
assign (resid  27 and (name HD1# or name HD2# )) (resid   56 and name HE# ) 2.7 0.7 1.1
assign (resid  27 and (name HD1# or name HD2# )) (resid   56 and name HG# ) 3.7 0.9 1.5
assign (resid  27 and (name HD1# or name HD2# )) (resid   68 and (name HB2 or name HB1 )) 2.6 0.6 1.0
assign (resid  27 and (name HD1# or name HD2# )) (resid   68 and name HE# ) 3.3 0.8 1.3
assign (resid  27 and (name HD1# or name HD2# )) (resid   72 and name HD1# ) 2.8 0.7 1.1
assign (resid  27 and name HA ) (resid   27 and (name HB2 or name HB1 )) 3.0 0.7 1.2 
assign (resid  27 and name HA ) (resid   27 and (name HD1# or name HD2# )) 3.1 0.8 1.2 
assign (resid  27 and name HA ) (resid   27 and name HN ) 4.2 1.0 1.7 
assign (resid  27 and name HA ) (resid   30 and name HN ) 4.2 1.1 1.7 
assign (resid  27 and name HA ) (resid   72 and name HD1# ) 3.9 1.0 1.6 
assign (resid  27 and name HG ) (resid   30 and name HD# ) 3.9 1.0 1.6 
assign (resid  27 and name HG ) (resid   72 and name HD1# ) 3.8 1.0 1.5 
assign (resid  27 and name HN ) (resid   44 and name HG2# ) 3.9 1.0 1.6 
assign (resid  27 and name HN ) (resid   72 and name HD1# ) 4.2 1.0 1.7 
assign (resid  28 and (name HG1 or name HG2 )) (resid   44 and name HG2# ) 3.3 0.8 1.3
assign (resid  28 and name HA ) (resid   28 and name HN ) 3.5 0.9 1.4 
assign (resid  28 and name HA ) (resid   29 and name HN ) 3.4 0.9 1.4 
assign (resid  28 and name HB# ) (resid   28 and (name HG1 or name HG2 )) 2.5 0.6 1.0 
assign (resid  30 and (name HB1 or name HB2 )) (resid   38 and name HA ) 3.7 0.9 1.5
assign (resid  30 and (name HB2 or name HB1 )) (resid   39 and name HN ) 4.3 1.1 1.7
assign (resid  30 and name HD# ) (resid   36 and (name HB1 or name HB2 )) 4.6 1.2 1.9 
assign (resid  30 and name HD# ) (resid   68 and name HE# ) 3.4 0.8 1.4 
assign (resid  30 and name HD# ) (resid   72 and name HD1# ) 3.7 0.9 1.5 
assign (resid  30 and name HE# ) (resid   72 and (name HG11 or name HG12 )) 4.3 1.1 1.7 
assign (resid  30 and name HE# ) (resid   72 and (name HG12 or name HG11 )) 4.6 1.2 1.8 
assign (resid  30 and name HE# ) (resid   72 and name HD1# ) 4.2 1.1 1.7 
assign (resid  31 and name HA ) (resid   32 and (name HD1 or name HD2 )) 3.8 2.0 1.5 
assign (resid  31 and name HA ) (resid   32 and (name HD2 or name HD1 )) 4.0 2.0 1.6 
assign (resid  32 and (name HD1 or name HD2 )) (resid   32 and name HG# ) 2.4 0.6 1.0
assign (resid  32 and (name HD2 or name HD1 )) (resid   32 and name HG# ) 2.7 0.7 1.1
assign (resid  32 and name HA ) (resid   32 and name HG# ) 3.2 0.8 1.3 
assign (resid  32 and name HG# ) (resid   33 and name HN ) 4.4 1.1 1.7 
assign (resid  33 and name HB# ) (resid   33 and name HN ) 3.4 0.8 1.4 
assign (resid  34 and name HA ) (resid   34 and name HN ) 3.1 0.8 1.2 
assign (resid  37 and name HA ) (resid   37 and name HD1# ) 4.2 1.0 1.7 
assign (resid  37 and name HA ) (resid   37 and name HG2# ) 3.3 0.8 1.3 
assign (resid  37 and name HA ) (resid   38 and (name HD1 or name HD2 )) 2.9 0.7 1.2 
assign (resid  37 and name HA ) (resid   38 and (name HD2 or name HD1 )) 2.9 0.7 1.2 
assign (resid  37 and name HB ) (resid   38 and (name HD1 or name HD2 )) 4.6 1.1 1.8 
assign (resid  37 and name HB ) (resid   38 and (name HD2 or name HD1 )) 3.9 1.0 1.6 
assign (resid  37 and name HD1# ) (resid   37 and (name HG11 or name HG12 )) 2.7 0.7 1.1 
assign (resid  37 and name HD1# ) (resid   37 and (name HG12 or name HG11 )) 3.1 0.8 1.2 
assign (resid  37 and name HD1# ) (resid   38 and (name HD1 or name HD2 )) 4.3 1.1 1.7 
assign (resid  37 and name HD1# ) (resid   38 and (name HD2 or name HD1 )) 4.4 1.1 1.8 
assign (resid  37 and name HD1# ) (resid   59 and (name HB1 or name HB2 )) 4.4 1.1 1.8 
assign (resid  37 and name HD1# ) (resid   59 and (name HB2 or name HB1 )) 4.2 1.0 1.7 
assign (resid  37 and name HD1# ) (resid   59 and name HD# ) 4.0 1.0 1.6 
assign (resid  37 and name HG2# ) (resid   38 and (name HD1 or name HD2 )) 3.9 1.0 1.6 
assign (resid  37 and name HG2# ) (resid   38 and (name HD2 or name HD1 )) 3.7 0.9 1.5 
assign (resid  37 and name HG2# ) (resid   59 and name HD# ) 3.6 0.9 1.5 
assign (resid  38 and (name HB1 or name HB2 )) (resid   38 and (name HD1 or name HD2 )) 3.8 0.9 1.5
assign (resid  38 and (name HB1 or name HB2 )) (resid   38 and name HG# ) 2.0 0.5 0.8
assign (resid  38 and (name HB2 or name HB1 )) (resid   38 and (name HD2 or name HD1 )) 3.6 0.9 1.5
assign (resid  38 and (name HD1 or name HD2 )) (resid   38 and name HG# ) 2.7 0.7 1.1
assign (resid  38 and name HA ) (resid   38 and (name HB2 or name HB1 )) 3.0 0.8 1.2 
assign (resid  38 and name HA ) (resid   38 and name HG# ) 2.8 0.7 1.1 
assign (resid  38 and name HG# ) (resid   39 and name HN ) 3.5 0.9 1.4 
assign (resid  39 and (name HB1 or name HB2 )) (resid   40 and (name HD2 or name HD1 )) 4.4 1.1 1.8
assign (resid  39 and (name HB1 or name HB2 )) (resid   40 and (name HD1 or name HD2 )) 4.5 1.1 1.8
assign (resid  39 and (name HB2 or name HB1 )) (resid   40 and (name HD1 or name HD2 )) 4.5 1.1 1.8
assign (resid  39 and (name HB2 or name HB1 )) (resid   43 and (name HB1 or name HB2 )) 4.2 1.0 1.7
assign (resid  39 and (name HD1# or name HD2# )) (resid   56 and name HA ) 4.0 1.0 1.6
assign (resid  39 and (name HD1# or name HD2# )) (resid   59 and (name HB1 or name HB2 )) 3.5 0.9 1.4
assign (resid  39 and (name HD1# or name HD2# )) (resid   59 and (name HB2 or name HB1 )) 3.4 0.8 1.3
assign (resid  39 and (name HD2# or name HD1# )) (resid   55 and (name HB1 or name HB2 )) 3.8 1.0 1.5
assign (resid  39 and (name HD2# or name HD1# )) (resid   55 and (name HB2 or name HB1 )) 3.2 0.8 1.3
assign (resid  39 and (name HD2# or name HD1# )) (resid   59 and (name HB1 or name HB2 )) 3.4 0.9 1.4
assign (resid  39 and (name HD2# or name HD1# )) (resid   60 and (name HD22 or name HD21 )) 4.4 1.1 1.7
assign (resid  39 and (name HD2# or name HD1# )) (resid   68 and name HE# ) 2.9 0.7 1.2
assign (resid  39 and name HA ) (resid   40 and (name HD1 or name HD2 )) 3.3 1.6 1.3 
assign (resid  39 and name HA ) (resid   40 and (name HD2 or name HD1 )) 3.6 1.8 1.5 
assign (resid  39 and name HG ) (resid   59 and (name HB2 or name HB1 )) 4.0 1.0 1.6 
assign (resid  40 and (name HB2 or name HB1 )) (resid   40 and (name HD1 or name HD2 )) 3.4 0.9 1.4
assign (resid  40 and (name HB2 or name HB1 )) (resid   40 and (name HD2 or name HD1 )) 3.2 0.8 1.3
assign (resid  40 and (name HD1 or name HD2 )) (resid   40 and name HG# ) 2.9 0.7 1.2
assign (resid  40 and (name HD2 or name HD1 )) (resid   40 and name HG# ) 2.8 0.7 1.1
assign (resid  40 and name HA ) (resid   40 and (name HB1 or name HB2 )) 2.6 0.6 1.0 
assign (resid  40 and name HA ) (resid   40 and (name HB2 or name HB1 )) 3.2 0.8 1.3 
assign (resid  40 and name HA ) (resid   40 and (name HD2 or name HD1 )) 3.4 0.9 1.4 
assign (resid  40 and name HA ) (resid   41 and name HN ) 2.5 0.6 1.0 
assign (resid  41 and name HA ) (resid   41 and name HB# ) 3.4 0.8 1.3 
assign (resid  41 and name HA ) (resid   45 and (name HG1 or name HG2 )) 4.2 1.1 1.7 
assign (resid  41 and name HD# ) (resid   45 and (name HG1 or name HG2 )) 4.5 1.1 1.8 
assign (resid  41 and name HD# ) (resid   45 and (name HG2 or name HG1 )) 4.6 1.1 1.8 
assign (resid  42 and (name HA1 or name HA2 )) (resid   42 and name HN ) 3.4 0.8 1.4
assign (resid  42 and (name HA1 or name HA2 )) (resid   43 and name HN ) 4.0 1.0 1.6
assign (resid  42 and (name HA2 or name HA1 )) (resid   42 and name HN ) 3.5 0.9 1.4
assign (resid  42 and (name HA2 or name HA1 )) (resid   44 and name HN ) 4.5 1.1 1.8
assign (resid  43 and (name HB1 or name HB2 )) (resid   43 and (name HE21 or name HE22 )) 4.4 1.1 1.7
assign (resid  43 and (name HB1 or name HB2 )) (resid   43 and (name HE22 or name HE21 )) 4.5 1.1 1.8
assign (resid  43 and (name HB1 or name HB2 )) (resid   55 and (name HD1# or name HD2# )) 3.3 0.8 1.3
assign (resid  43 and name HA ) (resid   43 and (name HB1 or name HB2 )) 3.3 0.8 1.3 
assign (resid  43 and name HA ) (resid   43 and (name HB2 or name HB1 )) 3.5 0.9 1.4 
assign (resid  43 and name HA ) (resid   43 and name HG# ) 3.2 0.8 1.3 
assign (resid  43 and name HA ) (resid   46 and name HB# ) 3.0 0.7 1.2 
assign (resid  44 and name HA ) (resid   44 and name HG2# ) 3.3 0.8 1.3 
assign (resid  44 and name HA ) (resid   44 and name HN ) 3.9 1.0 1.6 
assign (resid  44 and name HA ) (resid   45 and name HN ) 3.8 1.0 1.5 
assign (resid  44 and name HB ) (resid   52 and (name HD1# or name HD2# )) 3.7 0.9 1.5 
assign (resid  44 and name HB ) (resid   55 and (name HD1# or name HD2# )) 3.6 0.9 1.5 
assign (resid  44 and name HG2# ) (resid   45 and name HN ) 3.6 0.9 1.5 
assign (resid  45 and name HA ) (resid   45 and (name HG1 or name HG2 )) 4.0 1.0 1.6 
assign (resid  45 and name HA ) (resid   45 and (name HG2 or name HG1 )) 4.3 1.1 1.7 
assign (resid  45 and name HA ) (resid   45 and name HB# ) 3.3 0.8 1.3 
assign (resid  45 and name HB# ) (resid   45 and (name HG2 or name HG1 )) 2.0 0.5 0.8 
assign (resid  46 and (name HB1 or name HB2 )) (resid   47 and name HN ) 4.2 1.1 1.7
assign (resid  46 and (name HB2 or name HB1 )) (resid   46 and name HE# ) 3.9 1.0 1.6
assign (resid  46 and (name HB2 or name HB1 )) (resid   47 and name HN ) 4.2 1.1 1.7
assign (resid  46 and name HA ) (resid   47 and name HN ) 3.2 0.8 1.3 
assign (resid  47 and name HA ) (resid   47 and name HB# ) 2.4 0.6 1.0 
assign (resid  47 and name HB# ) (resid   48 and name HN ) 2.9 0.7 1.2 
assign (resid  47 and name HB# ) (resid   51 and name HB# ) 3.7 0.9 1.5 
assign (resid  47 and name HB# ) (resid   52 and (name HD1# or name HD2# )) 2.5 0.6 1.0 
assign (resid  47 and name HB# ) (resid   55 and (name HD1# or name HD2# )) 2.5 0.6 1.0 
assign (resid  49 and (name HB1 or name HB2 )) (resid   50 and (name HG1# or name HG2# )) 3.8 0.9 1.5
assign (resid  49 and (name HB1 or name HB2 )) (resid   50 and name HB ) 4.2 1.1 1.7
assign (resid  49 and (name HB2 or name HB1 )) (resid   50 and (name HG2# or name HG1# )) 4.4 1.1 1.8
assign (resid  49 and name HA ) (resid   52 and (name HB2 or name HB1 )) 3.7 0.9 1.5 
assign (resid  50 and (name HG1# or name HG2# )) (resid   51 and name HN ) 3.4 0.9 1.4
assign (resid  50 and (name HG2# or name HG1# )) (resid   51 and name HN ) 4.0 1.0 1.6
assign (resid  50 and name HA ) (resid   50 and (name HG1# or name HG2# )) 3.1 0.8 1.2 
assign (resid  50 and name HA ) (resid   50 and (name HG1# or name HG2# )) 3.3 0.8 1.3 
assign (resid  50 and name HA ) (resid   50 and name HB ) 4.2 1.1 1.7 
assign (resid  50 and name HA ) (resid   53 and name HB# ) 3.4 0.9 1.4 
assign (resid  50 and name HB ) (resid   50 and (name HG1# or name HG2# )) 2.8 0.7 1.1 
assign (resid  50 and name HB ) (resid   50 and (name HG2# or name HG1# )) 2.6 0.7 1.0 
assign (resid  51 and name HA ) (resid   51 and name HB# ) 3.3 0.8 1.3 
assign (resid  51 and name HB# ) (resid   52 and name HN ) 3.6 0.9 1.4 
assign (resid  52 and (name HD1# or name HD2# )) (resid   52 and name HN ) 4.4 1.1 1.8
assign (resid  52 and (name HD1# or name HD2# )) (resid   56 and name HN ) 4.2 1.1 1.7
assign (resid  52 and name HA ) (resid   52 and (name HD1# or name HD2# )) 3.0 0.7 1.2 
assign (resid  52 and name HA ) (resid   52 and name HN ) 3.8 1.0 1.5 
assign (resid  52 and name HA ) (resid   55 and (name HB1 or name HB2 )) 4.5 1.1 1.8 
assign (resid  52 and name HA ) (resid   55 and (name HB2 or name HB1 )) 4.3 1.1 1.7 
assign (resid  52 and name HA ) (resid   55 and (name HD1# or name HD2# )) 3.2 0.8 1.3 
assign (resid  52 and name HA ) (resid   55 and name HN ) 4.5 1.1 1.8 
assign (resid  53 and name HA ) (resid   53 and name HB# ) 2.8 0.7 1.1 
assign (resid  53 and name HA ) (resid   53 and name HN ) 4.1 1.0 1.6 
assign (resid  53 and name HA ) (resid   54 and name HN ) 4.4 1.1 1.8 
assign (resid  53 and name HA ) (resid   56 and (name HB1 or name HB2 )) 3.8 0.9 1.5 
assign (resid  53 and name HB# ) (resid   53 and name HN ) 2.8 0.7 1.1 
assign (resid  54 and name HA ) (resid   54 and name HG2# ) 3.3 0.8 1.3 
assign (resid  54 and name HA ) (resid   54 and name HN ) 4.0 1.0 1.6 
assign (resid  54 and name HA ) (resid   57 and name HB ) 4.3 1.1 1.7 
assign (resid  54 and name HB ) (resid   54 and name HG2# ) 2.8 0.7 1.1 
assign (resid  54 and name HB ) (resid   55 and name HN ) 3.4 0.9 1.4 
assign (resid  54 and name HG2# ) (resid   54 and name HN ) 3.8 0.9 1.5 
assign (resid  54 and name HG2# ) (resid   55 and name HA ) 2.6 0.6 1.0 
assign (resid  55 and (name HB1 or name HB2 )) (resid   55 and name HN ) 3.3 0.8 1.3
assign (resid  55 and (name HB2 or name HB1 )) (resid   55 and name HN ) 3.6 0.9 1.5
assign (resid  55 and (name HD1# or name HD2# )) (resid   55 and name HG ) 2.3 0.6 0.9
assign (resid  55 and (name HD1# or name HD2# )) (resid   59 and name HD# ) 3.5 0.9 1.4
assign (resid  55 and name HN ) (resid   55 and name HG ) 3.5 0.9 1.4 
assign (resid  55 and name HA ) (resid   55 and (name HD1# or name HD2# )) 2.8 0.7 1.1 
assign (resid  55 and name HA ) (resid   58 and (name HB1 or name HB2 )) 3.8 1.0 1.5 
assign (resid  55 and name HN ) (resid   54 and name HG2# ) 3.3 0.8 1.3 
assign (resid  56 and (name HB1 or name HB2 )) (resid   56 and name HG# ) 3.1 0.8 1.3
assign (resid  56 and (name HB2 or name HB1 )) (resid   65 and name HA ) 3.5 0.9 1.4
assign (resid  56 and name HA ) (resid   56 and (name HB1 or name HB2 )) 3.2 0.8 1.3 
assign (resid  56 and name HA ) (resid   56 and name HE# ) 3.3 0.8 1.3 
assign (resid  56 and name HA ) (resid   56 and name HN ) 4.0 1.0 1.6 
assign (resid  56 and name HA ) (resid   59 and (name HB1 or name HB2 )) 3.8 1.0 1.5 
assign (resid  56 and name HE# ) (resid   65 and name HA ) 2.9 0.7 1.1 
assign (resid  56 and name HE# ) (resid   65 and name HB# ) 2.6 0.7 1.1 
assign (resid  56 and name HE# ) (resid   68 and name HE# ) 3.0 0.7 1.2 
assign (resid  56 and name HE# ) (resid   69 and name HA ) 3.9 1.0 1.6 
assign (resid  56 and name HE# ) (resid   69 and name HB# ) 2.5 0.6 1.0 
assign (resid  56 and name HE# ) (resid   69 and name HN ) 3.0 0.8 1.2 
assign (resid  57 and (name HG11 or name HG12 )) (resid   62 and name HA ) 3.8 1.0 1.5
assign (resid  57 and (name HG12 or name HG11 )) (resid   62 and name HA ) 3.3 0.8 1.3
assign (resid  57 and (name HG12 or name HG11 )) (resid   65 and name HB# ) 4.3 1.1 1.7
assign (resid  57 and name HA ) (resid   57 and name HD1# ) 4.1 1.0 1.7 
assign (resid  57 and name HA ) (resid   57 and name HG2# ) 3.2 0.8 1.3 
assign (resid  57 and name HA ) (resid   65 and name HB# ) 3.5 0.9 1.4 
assign (resid  57 and name HB ) (resid   57 and name HG2# ) 2.8 0.7 1.1 
assign (resid  57 and name HB ) (resid   57 and name HN ) 3.6 0.9 1.4 
assign (resid  57 and name HB ) (resid   58 and name HN ) 4.0 1.0 1.6 
assign (resid  57 and name HD1# ) (resid   57 and (name HG11 or name HG12 )) 2.5 0.6 1.0 
assign (resid  57 and name HD1# ) (resid   57 and name HN ) 3.9 1.0 1.5 
assign (resid  57 and name HD1# ) (resid   62 and (name HG2 or name HG1 )) 3.7 0.9 1.5 
assign (resid  57 and name HG2# ) (resid   57 and name HN ) 3.8 1.0 1.5 
assign (resid  57 and name HG2# ) (resid   61 and name HA# ) 4.4 1.1 1.8 
assign (resid  57 and name HG2# ) (resid   62 and (name HG1 or name HG2 )) 4.2 1.1 1.7 
assign (resid  57 and name HG2# ) (resid   62 and (name HG2 or name HG1 )) 3.4 0.8 1.4 
assign (resid  57 and name HG2# ) (resid   62 and name HA ) 3.3 0.8 1.3 
assign (resid  57 and name HG2# ) (resid   62 and name HB# ) 3.8 1.0 1.5 
assign (resid  57 and name HN ) (resid   65 and name HB# ) 3.1 0.8 1.2 
assign (resid  58 and name HA ) (resid   58 and (name HB1 or name HB2 )) 3.5 0.9 1.4 
assign (resid  58 and name HA ) (resid   58 and (name HB2 or name HB1 )) 3.5 0.9 1.4 
assign (resid  58 and name HA ) (resid   58 and name HN ) 3.3 0.8 1.3 
assign (resid  59 and name HA ) (resid   59 and (name HB2 or name HB1 )) 3.1 0.8 1.2 
assign (resid  59 and name HA ) (resid   59 and name HD# ) 3.7 0.9 1.5 
assign (resid  59 and name HA ) (resid   59 and name HN ) 3.5 0.9 1.4 
assign (resid  60 and name HA ) (resid   60 and (name HB1 or name HB2 )) 3.3 0.8 1.3 
assign (resid  60 and name HA ) (resid   60 and (name HB2 or name HB1 )) 3.5 0.9 1.4 
assign (resid  62 and (name HG2 or name HG1 )) (resid   63 and name HN ) 4.5 1.1 1.8
assign (resid  62 and name HA ) (resid   62 and name HB# ) 3.2 0.8 1.3 
assign (resid  62 and name HA ) (resid   62 and name HN ) 3.9 1.0 1.6 
assign (resid  62 and name HA ) (resid   63 and name HN ) 4.7 1.2 1.9 
assign (resid  62 and name HA ) (resid   65 and name HB# ) 3.6 0.9 1.4 
assign (resid  62 and name HA ) (resid   65 and name HN ) 4.1 1.0 1.7 
assign (resid  62 and name HB# ) (resid   62 and (name HG1 or name HG2 )) 3.0 0.8 1.2 
assign (resid  62 and name HB# ) (resid   62 and (name HG2 or name HG1 )) 2.4 0.6 1.0 
assign (resid  62 and name HB# ) (resid   63 and name HN ) 3.6 0.9 1.4 
assign (resid  63 and name HA ) (resid   63 and name HB# ) 2.7 0.7 1.1 
assign (resid  63 and name HA ) (resid   63 and name HG# ) 3.4 0.8 1.4 
assign (resid  63 and name HA ) (resid   63 and name HN ) 3.4 0.9 1.4 
assign (resid  63 and name HB# ) (resid   64 and name HN ) 4.2 2.0 1.7 
assign (resid  63 and name HG# ) (resid   63 and name HN ) 3.9 1.0 1.6 
assign (resid  64 and name HA ) (resid   64 and (name HB1 or name HB2 )) 2.8 0.7 1.1 
assign (resid  64 and name HA ) (resid   64 and (name HB2 or name HB1 )) 2.7 0.7 1.1 
assign (resid  64 and name HA ) (resid   64 and name HG# ) 2.6 0.7 1.1 
assign (resid  64 and name HA ) (resid   64 and name HN ) 3.6 0.9 1.4 
assign (resid  64 and name HA ) (resid   67 and name HN ) 3.9 1.0 1.6 
assign (resid  65 and name HA ) (resid   65 and name HB# ) 2.6 0.6 1.0 
assign (resid  65 and name HA ) (resid   65 and name HN ) 3.6 0.9 1.4 
assign (resid  65 and name HA ) (resid   68 and (name HB1 or name HB2 )) 3.8 1.0 1.5 
assign (resid  65 and name HA ) (resid   69 and name HN ) 4.3 1.1 1.7 
assign (resid  65 and name HB# ) (resid   65 and name HN ) 2.4 0.6 1.0 
assign (resid  65 and name HB# ) (resid   68 and (name HB1 or name HB2 )) 2.9 0.7 1.2 
assign (resid  66 and name HA ) (resid   66 and name HB# ) 3.4 0.8 1.3 
assign (resid  66 and name HA ) (resid   66 and name HN ) 3.6 0.9 1.4 
assign (resid  66 and name HA ) (resid   69 and name HB# ) 3.2 0.8 1.3 
assign (resid  66 and name HA ) (resid   70 and name HN ) 4.2 1.1 1.7 
assign (resid  66 and name HE3 ) (resid   66 and name HZ3 ) 3.7 0.9 1.5 
assign (resid  66 and name HN ) (resid   67 and name HB# ) 3.5 0.9 1.4 
assign (resid  67 and name HA ) (resid   67 and name HB# ) 2.9 0.7 1.1 
assign (resid  67 and name HA ) (resid   67 and name HN ) 3.7 0.9 1.5 
assign (resid  67 and name HA ) (resid   70 and (name HG2# or name HG1# )) 3.9 2.0 1.6 
assign (resid  67 and name HA ) (resid   70 and name HB ) 3.6 0.9 1.5 
assign (resid  67 and name HA ) (resid   70 and name HN ) 4.0 1.0 1.6 
assign (resid  67 and name HB# ) (resid   68 and name HN ) 3.4 0.9 1.4 
assign (resid  68 and (name HB1 or name HB2 )) (resid   72 and name HD1# ) 3.7 0.9 1.5
assign (resid  68 and (name HB2 or name HB1 )) (resid   68 and name HE# ) 2.8 0.7 1.1
assign (resid  68 and (name HB2 or name HB1 )) (resid   72 and name HD1# ) 3.3 0.8 1.3
assign (resid  68 and name HA ) (resid   68 and name HN ) 3.5 0.9 1.4 
assign (resid  68 and name HE# ) (resid   68 and name HN ) 4.2 1.0 1.7 
assign (resid  68 and name HE# ) (resid   72 and (name HG12 or name HG11 )) 3.2 0.8 1.3 
assign (resid  68 and name HE# ) (resid   72 and name HD1# ) 3.3 0.8 1.3 
assign (resid  68 and name HG# ) (resid   68 and name HN ) 3.7 0.9 1.5 
assign (resid  69 and name HA ) (resid   69 and name HB# ) 3.2 0.8 1.3 
assign (resid  69 and name HA ) (resid   72 and name HB ) 4.2 1.0 1.7 
assign (resid  69 and name HA ) (resid   72 and name HD1# ) 4.4 1.1 1.8 
assign (resid  69 and name HB# ) (resid   70 and name HN ) 3.2 0.8 1.3 
assign (resid  69 and name HB# ) (resid   73 and name HD# ) 3.7 0.9 1.5 
assign (resid  70 and (name HG1# or name HG2# )) (resid   71 and name HA ) 3.3 0.8 1.3
assign (resid  70 and (name HG1# or name HG2# )) (resid   82 and name HA ) 3.7 0.9 1.5
assign (resid  70 and (name HG1# or name HG2# )) (resid   82 and name HD# ) 4.0 1.0 1.6
assign (resid  70 and (name HG1# or name HG2# )) (resid   82 and name HE# ) 3.4 0.9 1.4
assign (resid  70 and (name HG2# or name HG1# )) (resid   85 and name HB# ) 2.6 0.7 1.1
assign (resid  57 and name HD1# ) (resid    5 and name HA ) 3.2 0.8 1.3
assign (resid  70 and name HA ) (resid   73 and name HD# ) 3.3 0.8 1.3 
assign (resid  70 and name HA ) (resid   73 and name HN ) 4.6 1.1 1.8 
assign (resid  70 and name HA ) (resid   82 and name HA ) 4.0 1.0 1.6 
assign (resid  70 and name HB ) (resid   70 and (name HG1# or name HG2# )) 3.0 0.7 1.2 
assign (resid  70 and name HB ) (resid   82 and name HD# ) 4.1 1.0 1.6 
assign (resid  71 and name HA ) (resid   71 and (name HB1 or name HB2 )) 3.3 0.8 1.3 
assign (resid  71 and name HA ) (resid   71 and (name HB2 or name HB1 )) 3.3 0.8 1.3 
assign (resid  71 and name HA ) (resid   74 and name HB# ) 3.5 0.9 1.4 
assign (resid  71 and name HE3 ) (resid   72 and name HB ) 4.1 1.0 1.6 
assign (resid  71 and name HZ3 ) (resid   72 and name HB ) 4.1 1.0 1.6 
assign (resid  71 and name HZ3 ) (resid   75 and name HB# ) 4.4 1.1 1.8 
assign (resid  72 and (name HG11 or name HG12 )) (resid   75 and name HB# ) 3.5 0.9 1.4
assign (resid  72 and name HA ) (resid   72 and name HG2# ) 3.6 0.9 1.4 
assign (resid  72 and name HA ) (resid   75 and name HB# ) 3.3 0.8 1.3 
assign (resid  72 and name HB ) (resid   72 and name HD1# ) 3.6 0.9 1.5 
assign (resid  72 and name HB ) (resid   75 and name HB# ) 3.4 0.9 1.4 
assign (resid  72 and name HG2# ) (resid   76 and name HD1# ) 3.4 0.9 1.4 
assign (resid  72 and name HG2# ) (resid   76 and name HN ) 4.2 1.1 1.7 
assign (resid  73 and (name HB1 or name HB2 )) (resid   74 and name HN ) 4.8 2.4 1.9
assign (resid  73 and (name HB1 or name HB2 )) (resid   82 and name HN ) 4.3 1.1 1.7
assign (resid  73 and (name HB2 or name HB1 )) (resid   74 and name HN ) 4.4 2.2 1.7
assign (resid  73 and name HA ) (resid   76 and name HD1# ) 3.6 0.9 1.4 
assign (resid  73 and name HD# ) (resid   81 and (name HD1# or name HD2# )) 3.7 0.9 1.5 
assign (resid  73 and name HD# ) (resid   82 and name HA ) 3.8 0.9 1.5 
assign (resid  73 and name HD# ) (resid   85 and name HB# ) 3.2 0.8 1.3 
assign (resid  73 and name HZ ) (resid   81 and (name HD2# or name HD1# )) 4.3 1.1 1.7 
assign (resid  73 and name HZ ) (resid   85 and name HB# ) 3.4 0.8 1.3 
assign (resid  74 and name HA ) (resid   74 and name HB# ) 3.1 0.8 1.2 
assign (resid  74 and name HA ) (resid   77 and name HN ) 4.4 1.1 1.8 
assign (resid  74 and name HB# ) (resid   74 and name HN ) 2.8 0.7 1.1 
assign (resid  74 and name HB# ) (resid   82 and (name HB2 or name HB1 )) 4.0 1.0 1.6 
assign (resid  75 and name HA ) (resid   75 and name HB# ) 3.1 0.8 1.3 
assign (resid  75 and name HB# ) (resid   76 and name HA ) 4.7 1.2 1.9 
assign (resid  76 and (name HG12 or name HG11 )) (resid   76 and name HG2# ) 3.4 0.9 1.4
assign (resid  76 and (name HG12 or name HG11 )) (resid   78 and (name HD1 or name HD2 )) 3.5 0.9 1.4
assign (resid  76 and name HA ) (resid   76 and (name HG11 or name HG12 )) 3.9 1.0 1.6 
assign (resid  76 and name HA ) (resid   76 and name HB ) 3.6 0.9 1.5 
assign (resid  76 and name HA ) (resid   76 and name HG2# ) 3.1 0.8 1.2 
assign (resid  76 and name HD1# ) (resid   76 and name HG2# ) 2.9 0.7 1.1 
assign (resid  76 and name HD1# ) (resid   78 and name HN ) 4.1 1.0 1.6 
assign (resid  77 and name HA ) (resid   77 and (name HB1 or name HB2 )) 3.6 0.9 1.4 
assign (resid  77 and name HA ) (resid   77 and (name HB2 or name HB1 )) 3.1 0.8 1.3 
assign (resid  78 and (name HB1 or name HB2 )) (resid   81 and (name HD2# or name HD1# )) 3.7 0.9 1.5
assign (resid  78 and (name HD2 or name HD1 )) (resid   81 and (name HD2# or name HD1# )) 4.4 1.1 1.8
assign (resid  78 and name HA ) (resid   78 and (name HD1 or name HD2 )) 4.3 1.1 1.7 
assign (resid  78 and name HA ) (resid   78 and (name HD2 or name HD1 )) 3.7 0.9 1.5 
assign (resid  79 and name HA ) (resid   82 and (name HB1 or name HB2 )) 3.4 0.9 1.4 
assign (resid  79 and name HA ) (resid   82 and (name HB2 or name HB1 )) 3.7 0.9 1.5 
assign (resid  79 and name HA ) (resid   82 and name HN ) 3.6 0.9 1.4 
assign (resid  80 and name HA ) (resid   80 and (name HB1 or name HB2 )) 3.3 0.8 1.3 
assign (resid  80 and name HA ) (resid   80 and (name HB2 or name HB1 )) 2.8 0.7 1.1 
assign (resid  80 and name HA ) (resid   81 and name HN ) 3.8 0.9 1.5 
assign (resid  81 and (name HD1# or name HD2# )) (resid   84 and (name HB2 or name HB1 )) 3.1 0.8 1.2
assign (resid  81 and name HA ) (resid   84 and (name HB2 or name HB1 )) 3.8 1.0 1.5 
assign (resid  81 and name HG ) (resid   81 and name HN ) 4.0 1.0 1.6 
assign (resid  82 and (name HD1 or name HD2 )) (resid   83 and name HA ) 4.5 1.1 1.8
assign (resid  82 and (name HD1 or name HD2 )) (resid   83 and name HG# ) 3.4 0.9 1.4
assign (resid  82 and (name HD1 or name HD2 )) (resid   85 and name HB# ) 4.0 1.0 1.6
assign (resid  82 and (name HE1 or name HE2 )) (resid   83 and name HG# ) 4.2 1.0 1.7
assign (resid  82 and (name HE1 or name HE2 )) (resid   86 and name HG# ) 4.0 1.0 1.6
assign (resid  82 and name HA ) (resid   82 and name HE# ) 4.0 1.0 1.6 
assign (resid  83 and name HA ) (resid   83 and name HB# ) 3.1 0.8 1.3 
assign (resid  83 and name HB# ) (resid   83 and name HG# ) 2.4 0.6 1.0 
assign (resid  83 and name HB# ) (resid   84 and name HN ) 3.4 0.8 1.4 
assign (resid  83 and name HG# ) (resid   84 and name HN ) 4.1 1.0 1.6 
assign (resid  84 and name HA ) (resid   88 and (name HB1 or name HB2 )) 4.0 1.0 1.6 
assign (resid  84 and name HA ) (resid   88 and (name HB2 or name HB1 )) 4.1 1.0 1.6 
assign (resid  84 and name HN ) (resid   85 and name HB# ) 3.9 1.0 1.5 
assign (resid  85 and name HA ) (resid   85 and name HB# ) 2.9 0.7 1.2 
assign (resid  85 and name HA ) (resid   85 and name HN ) 3.7 0.9 1.5 
assign (resid  85 and name HA ) (resid   88 and (name HB1 or name HB2 )) 3.7 0.9 1.5 
assign (resid  85 and name HA ) (resid   88 and (name HB2 or name HB1 )) 4.0 1.0 1.6 
assign (resid  85 and name HA ) (resid   88 and name HN ) 3.6 0.9 1.4 
assign (resid  85 and name HB# ) (resid   86 and name HN ) 3.5 0.9 1.4 
assign (resid  86 and name HA ) (resid   86 and name HB# ) 3.5 0.9 1.4 
assign (resid  86 and name HA ) (resid   86 and name HN ) 3.3 0.8 1.3 
assign (resid  86 and name HA ) (resid   89 and name HN ) 3.9 1.0 1.6 
assign (resid  86 and name HB# ) (resid   86 and name HG# ) 2.9 0.7 1.2 
assign (resid  86 and name HB# ) (resid   86 and name HN ) 3.3 0.8 1.3 
assign (resid  86 and name HB# ) (resid   87 and name HN ) 4.2 1.0 1.7 
assign (resid  87 and name HA ) (resid   87 and name HB# ) 2.7 0.7 1.1 
assign (resid  87 and name HA ) (resid   87 and name HN ) 3.1 0.8 1.2 
assign (resid  88 and (name HB2 or name HB1 )) (resid   89 and name HN ) 4.4 1.1 1.7
assign (resid  88 and name HA ) (resid   88 and (name HB1 or name HB2 )) 3.5 0.9 1.4 
assign (resid  88 and name HA ) (resid   88 and (name HB2 or name HB1 )) 3.4 0.9 1.4 
assign (resid  89 and (name HB1 or name HB2 )) (resid   90 and (name HD1 or name HD2 )) 3.7 0.9 1.5
assign (resid  89 and (name HB2 or name HB1 )) (resid   90 and (name HD2 or name HD1 )) 4.3 1.1 1.7
assign (resid  89 and (name HG1 or name HG2 )) (resid   90 and (name HD1 or name HD2 )) 4.5 1.1 1.8
assign (resid  89 and (name HG2 or name HG1 )) (resid   90 and (name HD1 or name HD2 )) 4.2 1.0 1.7
assign (resid  89 and name HA ) (resid   90 and (name HD1 or name HD2 )) 3.4 1.6 1.4 
assign (resid  89 and name HA ) (resid   90 and (name HD2 or name HD1 )) 3.2 1.6 1.3 
assign (resid  90 and (name HB1 or name HB2 )) (resid   90 and (name HD1 or name HD2 )) 4.4 1.1 1.8
assign (resid  90 and (name HB1 or name HB2 )) (resid   90 and (name HD2 or name HD1 )) 4.2 1.1 1.7
assign (resid  90 and (name HB2 or name HB1 )) (resid   90 and (name HD2 or name HD1 )) 3.9 1.0 1.6
assign (resid  90 and name HA ) (resid   90 and (name HB1 or name HB2 )) 3.0 0.8 1.2 
assign (resid  90 and name HA ) (resid   90 and (name HB2 or name HB1 )) 3.1 0.8 1.3 
assign (resid  90 and name HA ) (resid   90 and (name HD1 or name HD2 )) 4.1 1.0 1.6 
assign (resid  90 and name HA ) (resid   90 and (name HG2 or name HG1 )) 3.6 0.9 1.4 
assign (resid  90 and name HA ) (resid   91 and name HN ) 2.6 0.6 1.0 
assign (resid  91 and name HA ) (resid   91 and name HG# ) 3.2 0.8 1.3 
assign (resid  91 and name HE# ) (resid   91 and name HG# ) 3.2 0.8 1.3
!!!!
assign (resid   4 and name HN  ) (resid   5 and name HN  )  2.8  0.7  1.1
assign (resid   4 and name HN  ) (resid   7 and name HN  )  3.6  0.9  1.4
assign (resid   6 and name HN  ) (resid   5 and name HN  )  3.1  0.8  1.2
assign (resid   7 and name HN  ) (resid   6 and name HN  )  2.2  0.5  0.9
assign (resid   7 and name HN  ) (resid   9 and name HN  )  2.9  0.7  1.2
assign (resid   8 and name HN  ) (resid   9 and name HN  )  2.8  0.7  1.1
assign (resid   9 and name HN  ) (resid  10 and name HN  )  2.1  0.5  0.9
assign (resid   9 and name HN  ) (resid  11 and name HN  )  2.9  0.7  1.1
assign (resid  13 and name HN  ) (resid  11 and name HN  )  2.5  0.6  1.0
assign (resid  13 and name HN  ) (resid  14 and name HN  )  3.2  0.8  1.3
assign (resid  13 and name HN  ) (resid  15 and name HN  )  2.7  0.7  1.1
assign (resid  17 and name HN  ) (resid  18 and name HN  )  3.6  0.9  1.4
assign (resid  19 and name HN  ) (resid  18 and name HN  )  3.3  0.8  1.3
assign (resid  19 and name HN  ) (resid  20 and name HN  )  2.9  0.7  1.1
assign (resid  21 and name HN  ) (resid  20 and name HN  )  2.9  0.7  1.2
assign (resid  23 and name HN  ) (resid  22 and name HN  )  3.0  0.7  1.2
assign (resid  23 and name HN  ) (resid  24 and name HN  )  3.9  1.0  1.5
assign (resid  24 and name HN  ) (resid  25 and name HN  )  2.7  0.7  1.1
assign (resid  25 and name HN  ) (resid  23 and name HN  )  3.0  0.8  1.2
assign (resid  26 and name HN  ) (resid  23 and name HN  )  3.4  0.8  1.4
assign (resid  28 and name HN  ) (resid  29 and name HN  )  2.8  0.7  1.1
assign (resid  29 and name HN  ) (resid  30 and name HN  )  3.8  1.0  1.5
assign (resid  35 and name HN  ) (resid  34 and name HN  )  2.4  0.6  1.0
assign (resid  35 and name HN  ) (resid  36 and name HN  )  2.8  0.7  1.1
assign (resid  36 and name HN  ) (resid  37 and name HN  )  4.4  1.1  1.8
assign (resid  42 and name HN  ) (resid  43 and name HN  )  3.8  1.0  1.5
assign (resid  44 and name HN  ) (resid  45 and name HN  )  3.0  0.7  1.2
assign (resid  46 and name HN  ) (resid  45 and name HN  )  2.9  0.7  1.2
assign (resid  46 and name HN  ) (resid  47 and name HN  )  2.6  0.6  1.0
assign (resid  48 and name HN  ) (resid  49 and name HN  )  3.7  0.9  1.5
assign (resid  50 and name HN  ) (resid  49 and name HN  )  3.7  0.9  1.5
assign (resid  50 and name HN  ) (resid  51 and name HN  )  2.3  0.6  0.9
assign (resid  52 and name HN  ) (resid  51 and name HN  )  2.7  0.7  1.1
assign (resid  52 and name HN  ) (resid  53 and name HN  )  4.1  1.0  1.6
assign (resid  52 and name HN  ) (resid  56 and name HN  )  4.5  1.1  1.8
assign (resid  53 and name HN  ) (resid  54 and name HN  )  3.4  0.8  1.4
assign (resid  54 and name HN  ) (resid  55 and name HN  )  2.7  0.7  1.1
assign (resid  55 and name HN  ) (resid  57 and name HN  )  2.8  0.7  1.1
assign (resid  55 and name HN  ) (resid  59 and name HN  )  3.8  0.9  1.5
assign (resid  58 and name HN  ) (resid  57 and name HN  )  3.4  0.8  1.3
assign (resid  58 and name HN  ) (resid  59 and name HN  )  3.5  0.9  1.4
assign (resid  59 and name HN  ) (resid  60 and name HN  )  2.9  0.7  1.1
assign (resid  60 and name HN  ) (resid  61 and name HN  )  2.8  0.7  1.1
assign (resid  62 and name HN  ) (resid  63 and name HN  )  2.9  0.7  1.2
assign (resid  62 and name HN  ) (resid  64 and name HN  )  4.6  1.1  1.8
assign (resid  65 and name HN  ) (resid  61 and name HN  )  3.0  0.8  1.2
assign (resid  65 and name HN  ) (resid  64 and name HN  )  2.2  0.6  0.9
assign (resid  65 and name HN  ) (resid  66 and name HN  )  2.4  0.6  1.0
assign (resid  68 and name HN  ) (resid  67 and name HN  )  3.1  0.8  1.3
assign (resid  68 and name HN  ) (resid  69 and name HN  )  2.6  0.7  1.1
assign (resid  69 and name HN  ) (resid  70 and name HN  )  2.3  0.6  0.9
assign (resid  70 and name HN  ) (resid  71 and name HN  )  2.8  0.7  1.1
assign (resid  71 and name HN  ) (resid  72 and name HN  )  2.7  0.7  1.1
assign (resid  72 and name HN  ) (resid  70 and name HN  )  4.3  1.1  1.7
assign (resid  72 and name HN  ) (resid  73 and name HN  )  3.8  0.9  1.5
assign (resid  73 and name HN  ) (resid  74 and name HN  )  4.0  1.0  1.6
assign (resid  74 and name HN  ) (resid  75 and name HN  )  3.1  0.8  1.2
assign (resid  75 and name HN  ) (resid  76 and name HN  )  2.8  0.7  1.1
assign (resid  76 and name HN  ) (resid  75 and name HN  )  2.1  0.5  0.9
assign (resid  77 and name HN  ) (resid  79 and name HN  )  3.6  0.9  1.4
assign (resid  78 and name HN  ) (resid  77 and name HN  )  2.7  0.7  1.1
assign (resid  80 and name HN  ) (resid  79 and name HN  )  2.5  0.6  1.0
assign (resid  80 and name HN  ) (resid  81 and name HN  )  3.6  0.9  1.4
assign (resid  81 and name HN  ) (resid  82 and name HN  )  2.4  0.6  1.0
assign (resid  84 and name HN  ) (resid  83 and name HN  )  2.9  0.7  1.2
assign (resid  85 and name HN  ) (resid  84 and name HN  )  3.3  0.8  1.3
assign (resid  85 and name HN  ) (resid  86 and name HN  )  2.6  0.6  1.0
assign (resid  86 and name HN  ) (resid  88 and name HN  )  3.6  0.9  1.5
assign (resid  87 and name HN  ) (resid  86 and name HN  )  2.6  0.7  1.0
assign (resid  87 and name HN  ) (resid  88 and name HN  )  2.6  0.7  1.1
assign (resid  88 and name HN  ) (resid  89 and name HN  )  2.8  0.7  1.1
!!!!
assign (resid   2 and name HB#  ) (resid   3 and name HN  )  3.4  0.8  1.4
assign (resid   3 and name HA  ) (resid   4 and name HN  )  2.8  0.7  1.1
assign (resid   3 and (name HB2 or name HB1  )) (resid   3 and name HN  )  2.7  0.7  1.1
assign (resid   4 and name HB  ) (resid   4 and name HN  )  3.7  0.9  1.5
assign (resid   4 and name HB  ) (resid   5 and name HN  )  2.7  0.7  1.1
assign (resid   4 and name HG2#  ) (resid   4 and name HN  )  4.6  1.1  1.8
assign (resid   4 and name HG2#  ) (resid   5 and name HN  )  4.6  1.1  1.8
assign (resid   5 and name HB#  ) (resid   5 and name HN  )  2.0  0.5  0.8
assign (resid   5 and name HB#  ) (resid   6 and name HN  )  3.1  0.8  1.3
assign (resid   6 and name HA  ) (resid   6 and name HN  )  3.0  0.7  1.2
assign (resid   6 and name HB#  ) (resid   6 and name HN  )  2.5  0.6  1.0
assign (resid   7 and name HB#  ) (resid   7 and name HN  )  2.6  0.7  1.0
assign (resid   7 and name HB#  ) (resid   8 and name HN  )  3.3  0.8  1.3
assign (resid   8 and (name HB1 or name HB2  )) (resid   9 and name HN  )  2.8  0.7  1.1
assign (resid   9 and name HB#  ) (resid   9 and name HN  )  2.0  0.5  0.8
assign (resid  10 and name HB#  ) (resid  10 and name HN  )  2.5  0.6  1.0
assign (resid  10 and name HB#  ) (resid  11 and name HN  )  3.7  0.9  1.5
assign (resid  10 and name HG#  ) (resid  13 and name HN  )  5.0  1.3  2.0
assign (resid  11 and name HB#  ) (resid  11 and name HN  )  2.9  0.7  1.2
assign (resid  11 and name HB#  ) (resid  12 and name HN  )  3.3  0.8  1.3
assign (resid  12 and (name HB2 or name HB1  )) (resid  13 and name HN  )  4.9  2.4  2.0
assign (resid  12 and (name HD1# or name HD2#  )) (resid  12 and name HN  )  3.7  0.9  1.5
assign (resid  13 and name HA  ) (resid  13 and name HN  )  3.1  0.8  1.3
assign (resid  14 and name HA  ) (resid  14 and name HN  )  4.0  1.0  1.6
assign (resid  14 and name HB#  ) (resid  14 and name HN  )  3.0  0.8  1.2
assign (resid  14 and name HB#  ) (resid  15 and name HN  )  4.8  1.2  1.9
assign (resid  15 and name HA  ) (resid  16 and name HN  )  2.9  0.7  1.2
assign (resid  15 and (name HD1# or name HD2#  )) (resid  15 and name HN  )  4.2  1.1  1.7
assign (resid  15 and (name HD1# or name HD2#  )) (resid  23 and name HN  )  4.2  1.1  1.7
assign (resid  15 and name HG  ) (resid  15 and name HN  )  2.9  0.7  1.2
assign (resid  16 and name HA  ) (resid  17 and name HN  )  3.0  0.8  1.2
assign (resid  16 and (name HB1 or name HB2  )) (resid  17 and name HN  )  3.4  0.9  1.4
assign (resid  16 and (name HB2 or name HB1  )) (resid  17 and name HN  )  3.6  0.9  1.5
assign (resid  16 and name HG#  ) (resid  16 and name HN  )  4.3  1.1  1.7
assign (resid  17 and name HA  ) (resid  17 and name HN  )  3.2  0.8  1.3
assign (resid  17 and name HB#  ) (resid  17 and name HN  )  2.8  0.7  1.1
assign (resid  17 and name HB#  ) (resid  18 and name HN  )  2.9  0.7  1.2
assign (resid  18 and name HA  ) (resid  18 and name HN  )  3.3  0.8  1.3
assign (resid  18 and name HA  ) (resid  19 and name HN  )  4.9  1.2  2.0
assign (resid  18 and name HA  ) (resid  21 and name HN  )  3.2  0.8  1.3
assign (resid  18 and name HB  ) (resid  18 and name HN  )  2.6  0.6  1.0
assign (resid  18 and (name HG2# or name HG1#  )) (resid  18 and name HN  )  2.6  0.7  1.1
assign (resid  18 and (name HG2# or name HG1#  )) (resid  19 and name HN  )  4.3  2.2  1.7
assign (resid  19 and name HA  ) (resid  20 and name HN  )  4.7  1.2  1.9
assign (resid  19 and name HA  ) (resid  22 and name HN  )  4.3  1.1  1.7
assign (resid  19 and (name HB1 or name HB2  )) (resid  20 and name HN  )  3.9  1.0  1.6
assign (resid  20 and name HA  ) (resid  20 and name HN  )  3.6  0.9  1.4
assign (resid  20 and (name HB2 or name HB1  )) (resid  20 and name HN  )  3.0  0.8  1.2
assign (resid  20 and (name HD1# or name HD2#  )) (resid  21 and name HN  )  4.0  1.0  1.6
assign (resid  21 and name HA  ) (resid  21 and name HN  )  2.5  0.6  1.0
assign (resid  21 and name HA  ) (resid  22 and name HN  )  3.0  0.8  1.2
assign (resid  22 and name HA  ) (resid  25 and name HN  )  3.2  0.8  1.3
assign (resid  22 and name HA  ) (resid  25 and name HN  )  3.3  0.8  1.3
assign (resid  22 and name HB2  ) (resid  23 and name HN  )  4.3  1.1  1.7
assign (resid  22 and name HG#  ) (resid  22 and name HN  )  3.4  0.8  1.4
assign (resid  23 and name HA  ) (resid  23 and name HN  )  4.1  1.0  1.6
assign (resid  23 and (name HB1 or name HB2  )) (resid  24 and name HN  )  3.6  0.9  1.4
assign (resid  23 and (name HB2 or name HB1  )) (resid  24 and name HN  )  4.4  2.2  1.8
assign (resid  23 and (name HB2 or name HB1  )) (resid  25 and name HN  )  5.4  1.3  2.2
assign (resid  24 and name HA  ) (resid  24 and name HN  )  3.7  0.9  1.5
assign (resid  24 and name HA  ) (resid  25 and name HN  )  2.8  0.7  1.1
assign (resid  24 and (name HB1 or name HB2  )) (resid  25 and name HN  )  1.8  0.4  0.7
assign (resid  24 and (name HB2 or name HB1  )) (resid  24 and name HN  )  2.9  0.7  1.2
assign (resid  24 and (name HB2 or name HB1  )) (resid  25 and name HN  )  3.0  0.7  1.2
assign (resid  25 and name HB#  ) (resid  26 and name HN  )  3.6  0.9  1.5
assign (resid  25 and (name HG1 or name HG2  )) (resid  25 and name HN  )  3.5  0.9  1.4
assign (resid  25 and (name HG2 or name HG1  )) (resid  25 and name HN  )  4.2  1.1  1.7
assign (resid  26 and name HA  ) (resid  26 and name HN  )  4.3  1.1  1.7
assign (resid  26 and name HB#  ) (resid  26 and name HN  )  3.1  0.8  1.2
assign (resid  26 and name HB#  ) (resid  27 and name HN  )  2.8  0.7  1.1
assign (resid  28 and name HB#  ) (resid  28 and name HN  )  2.7  0.7  1.1
assign (resid  28 and name HB#  ) (resid  29 and name HN  )  3.7  0.9  1.5
assign (resid  29 and name HA  ) (resid  30 and name HN  )  4.3  2.2  1.7
assign (resid  30 and (name HB1 or name HB2  )) (resid  30 and name HN  )  3.1  0.8  1.3
assign (resid  32 and name HA  ) (resid  33 and name HN  )  1.9  0.5  0.8
assign (resid  33 and name HA  ) (resid  33 and name HN  )  2.3  0.6  0.9
assign (resid  33 and name HG#  ) (resid  33 and name HN  )  2.8  0.7  1.1
assign (resid  33 and name HG#  ) (resid  34 and name HN  )  4.2  1.0  1.7
assign (resid  34 and name HA  ) (resid  35 and name HN  )  2.0  0.5  0.8
assign (resid  34 and name HA  ) (resid  36 and name HN  )  3.9  1.0  1.6
assign (resid  34 and name HB#  ) (resid  34 and name HN  )  2.1  0.5  0.8
assign (resid  34 and name HB#  ) (resid  35 and name HN  )  4.4  1.1  1.8
assign (resid  34 and name HG#  ) (resid  34 and name HN  )  3.2  0.8  1.3
assign (resid  35 and name HA#  ) (resid  35 and name HN  )  2.5  0.6  1.0
assign (resid  35 and name HA#  ) (resid  36 and name HN  )  4.3  2.2  1.7
assign (resid  36 and name HA  ) (resid  36 and name HN  )  3.7  0.9  1.5
assign (resid  36 and name HA  ) (resid  37 and name HN  )  2.9  0.7  1.2
assign (resid  36 and (name HB1 or name HB2  )) (resid  36 and name HN  )  3.0  0.7  1.2
assign (resid  36 and (name HB2 or name HB1  )) (resid  37 and name HN  )  4.6  1.2  1.8
assign (resid  37 and name HB  ) (resid  37 and name HN  )  3.4  0.8  1.3
assign (resid  38 and name HA  ) (resid  39 and name HN  )  2.7  0.7  1.1
assign (resid  38 and (name HB2 or name HB1  )) (resid  39 and name HN  )  4.9  2.4  2.0
!assign (resid  39 and (name HD1# or name HD2#  )) (resid  39 and name HN  )  5.2  1.3  2.1
assign (resid  39 and name HG  ) (resid  39 and name HN  )  3.9  1.0  1.6
assign (resid  41 and name HA  ) (resid  41 and name HN  )  4.0  1.0  1.6
assign (resid  41 and name HA  ) (resid  43 and name HN  )  3.6  0.9  1.4
assign (resid  41 and name HB#  ) (resid  41 and name HN  )  2.8  0.7  1.1
assign (resid  41 and name HB#  ) (resid  42 and name HN  )  3.2  0.8  1.3
assign (resid  43 and name HA  ) (resid  43 and name HN  )  3.6  0.9  1.4
assign (resid  43 and (name HB1 or name HB2  )) (resid  44 and name HN  )  4.3  2.2  1.7
assign (resid  43 and (name HB2 or name HB1  )) (resid  43 and name HN  )  3.0  0.8  1.2
assign (resid  43 and name HG#  ) (resid  43 and name HN  )  3.2  0.8  1.3
assign (resid  43 and (name HE22 or name HE21  )) (resid  55 and (name HD2# or name HD1# ))  4.5  1.1  1.8
assign (resid  45 and name HA  ) (resid  46 and name HN  )  5.2  1.3  2.1
assign (resid  45 and (name HB1 or name HB2  )) (resid  45 and name HN  )  2.2  0.5  0.9
assign (resid  45 and (name HB1 or name HB2  )) (resid  46 and name HN  )  3.6  0.9  1.5
assign (resid  45 and name HG#  ) (resid  45 and name HN  )  2.7  0.7  1.1
assign (resid  47 and name HA  ) (resid  48 and name HN  )  2.1  0.5  0.9
assign (resid  47 and name HB#  ) (resid  47 and name HN  )  2.7  0.7  1.1
assign (resid  48 and name HA  ) (resid  48 and name HN  )  4.1  1.0  1.6
assign (resid  48 and name HA  ) (resid  49 and name HN  )  2.7  0.7  1.1
assign (resid  48 and (name HB2 or name HB1  )) (resid  48 and name HN  )  3.0  0.8  1.2
assign (resid  48 and (name HB2 or name HB1  )) (resid  49 and name HN  )  3.3  0.8  1.3
assign (resid  49 and name HA  ) (resid  49 and name HN  )  3.4  0.8  1.4
assign (resid  49 and name HA  ) (resid  50 and name HN  )  4.5  1.1  1.8
assign (resid  49 and (name HB1 or name HB2  )) (resid  50 and name HN  )  4.6  2.2  1.8
assign (resid  49 and (name HB2 or name HB1  )) (resid  49 and name HN  )  3.2  0.8  1.3
assign (resid  50 and name HA  ) (resid  50 and name HN  )  4.3  1.1  1.7
assign (resid  50 and name HA  ) (resid  51 and name HN  )  3.1  0.8  1.2
assign (resid  50 and name HB  ) (resid  50 and name HN  )  3.0  0.7  1.2
assign (resid  50 and name HB  ) (resid  51 and name HN  )  2.5  0.6  1.0
assign (resid  50 and (name HG1# or name HG2#  )) (resid  50 and name HN  )  3.0  0.8  1.2
assign (resid  50 and (name HG1# or name HG2#  )) (resid  54 and name HN  )  4.9  1.2  2.0
assign (resid  50 and (name HG2# or name HG1#  )) (resid  53 and name HN  )  5.2  1.3  2.1
assign (resid  51 and name HB#  ) (resid  51 and name HN  )  2.1  0.5  0.8
assign (resid  52 and (name HB1 or name HB2  )) (resid  53 and name HN  )  4.6  2.4  1.8
assign (resid  53 and name HA  ) (resid  56 and name HN  )  3.7  0.9  1.5
assign (resid  53 and name HA  ) (resid  57 and name HN  )  4.1  1.0  1.6
assign (resid  53 and name HB#  ) (resid  54 and name HN  )  2.6  0.7  1.0
assign (resid  54 and name HA  ) (resid  55 and name HN  )  5.1  1.3  2.0
assign (resid  54 and name HB  ) (resid  54 and name HN  )  2.6  0.7  1.0
assign (resid  54 and name HG2#  ) (resid  55 and name HN  )  4.9  1.2  2.0
assign (resid  55 and name HA  ) (resid  57 and name HN  )  4.4  1.1  1.8
assign (resid  55 and (name HB1 or name HB2  )) (resid  56 and name HN  )  3.8  1.0  1.5
assign (resid  55 and (name HB2 or name HB1  )) (resid  56 and name HN  )  3.7  0.9  1.5
assign (resid  56 and (name HB1 or name HB2  )) (resid  56 and name HN  )  3.0  0.7  1.2
assign (resid  56 and (name HB1 or name HB2  )) (resid  57 and name HN  )  3.4  0.9  1.4
assign (resid  56 and name HG#  ) (resid  56 and name HN  )  3.3  0.8  1.3
assign (resid  57 and name HA  ) (resid  57 and name HN  )  3.7  0.9  1.5
assign (resid  57 and name HA  ) (resid  61 and name HN  )  4.2  1.1  1.7
assign (resid  57 and name HB  ) (resid  62 and name HN  )  4.8  1.2  1.9
assign (resid  57 and name HG2#  ) (resid  58 and name HN  )  4.1  1.0  1.6
assign (resid  57 and name HG2#  ) (resid  62 and name HN  )  4.5  1.1  1.8
assign (resid  58 and name HA  ) (resid  58 and name HN  )  4.0  1.0  1.6
assign (resid  58 and name HA  ) (resid  59 and name HN  )  3.3  0.8  1.3
assign (resid  59 and name HA  ) (resid  60 and name HN  )  5.1  1.3  2.1
assign (resid  59 and (name HB1 or name HB2  )) (resid  59 and name HN  )  2.3  0.6  0.9
assign (resid  61 and name HA#  ) (resid  61 and name HN  )  2.7  0.7  1.1
assign (resid  61 and name HA#  ) (resid  62 and name HN  )  2.5  0.6  1.0
assign (resid  62 and name HB#  ) (resid  62 and name HN  )  2.5  0.6  1.0
assign (resid  62 and (name HG1 or name HG2  )) (resid  62 and name HN  )  4.7  1.2  1.9
assign (resid  63 and name HB#  ) (resid  64 and name HN  )  2.5  0.6  1.0
assign (resid  64 and (name HB1 or name HB2  )) (resid  65 and name HN  )  3.6  0.9  1.4
assign (resid  64 and (name HB1 or name HB2  )) (resid  66 and name HN  )  4.4  1.1  1.8
assign (resid  64 and (name HB2 or name HB1  )) (resid  64 and name HN  )  3.1  0.8  1.3
assign (resid  64 and (name HB2 or name HB1  )) (resid  65 and name HN  )  3.6  0.9  1.5
assign (resid  64 and name HG#  ) (resid  64 and name HN  )  3.6  0.9  1.4
assign (resid  65 and name HB#  ) (resid  57 and name HN  )  4.1  1.0  1.7
assign (resid  65 and name HB#  ) (resid  65 and name HN  )  2.3  0.6  0.9
assign (resid  65 and name HB#  ) (resid  66 and name HN  )  2.7  0.7  1.1
assign (resid  66 and name HB#  ) (resid  66 and name HN  )  2.0  0.5  0.8
assign (resid  66 and name HB#  ) (resid  67 and name HN  )  3.1  0.8  1.2
assign (resid  66 and name HE1  ) (resid  66 and name HD1  )  2.0  0.5  0.8
assign (resid  66 and name HE1  ) (resid  89 and name HA  )  4.7  1.2  1.9
assign (resid  66 and name HE1  ) (resid  4 and name HG2#  )  3.6  0.9  1.4
assign (resid  66 and name HE1  ) (resid  57 and name HD1#  )  4.3  1.1  1.7
assign (resid  67 and name HB#  ) (resid  67 and name HN  )  2.5  0.6  1.0
assign (resid  68 and name HA  ) (resid  68 and name HN  )  3.8  1.0  1.5
assign (resid  68 and name HA  ) (resid  69 and name HN  )  3.9  1.0  1.5
assign (resid  68 and (name HB1 or name HB2  )) (resid  69 and name HN  )  2.7  0.7  1.1
assign (resid  68 and (name HB2 or name HB1  )) (resid  69 and name HN  )  3.3  0.8  1.3
assign (resid  69 and name HA  ) (resid  69 and name HN  )  3.2  0.8  1.3
assign (resid  69 and name HB#  ) (resid  69 and name HN  )  2.1  0.5  0.8
assign (resid  70 and name HA  ) (resid  70 and name HN  )  4.2  1.0  1.7
assign (resid  70 and name HB  ) (resid  70 and name HN  )  2.8  0.7  1.1
assign (resid  70 and name HB  ) (resid  71 and name HN  )  2.8  0.7  1.1
assign (resid  70 and (name HG1# or name HG2#  )) (resid  86 and name HN  )  4.1  1.0  1.6
assign (resid  71 and name HA  ) (resid  71 and name HN  )  3.0  0.8  1.2
assign (resid  71 and (name HB1 or name HB2  )) (resid  71 and name HN  )  2.6  0.6  1.0
assign (resid  71 and (name HB1 or name HB2  )) (resid  72 and name HN  )  3.8  0.9  1.5
assign (resid  71 and (name HB2 or name HB1  )) (resid  72 and name HN  )  4.3  1.1  1.7
assign (resid  71 and name HE3  ) (resid  73 and name HN  )  4.2  1.1  1.7
assign (resid  71 and name HE1  ) (resid  71 and name HD1  )  1.9  0.5  0.8
assign (resid  72 and name HA  ) (resid  72 and name HN  )  4.2  1.0  1.7
assign (resid  72 and name HA  ) (resid  73 and name HN  )  4.8  1.2  1.9
assign (resid  72 and name HA  ) (resid  75 and name HN  )  4.0  1.0  1.6
assign (resid  72 and name HB  ) (resid  72 and name HN  )  3.2  0.8  1.3
assign (resid  72 and name HB  ) (resid  73 and name HN  )  4.2  1.0  1.7
assign (resid  72 and name HB  ) (resid  75 and name HN  )  4.8  1.2  1.9
assign (resid  72 and (name HG11 or name HG12  )) (resid  72 and name HN  )  3.3  0.8  1.3
assign (resid  72 and (name HG12 or name HG11  )) (resid  72 and name HN  )  3.8  1.0  1.5
assign (resid  72 and (name HG12 or name HG11  )) (resid  73 and name HN  )  5.2  1.3  2.1
assign (resid  73 and name HA  ) (resid  78 and name HN  )  3.5  0.9  1.4
assign (resid  73 and (name HB1 or name HB2  )) (resid  82 and name HN  )  3.3  0.8  1.3
assign (resid  74 and name HA  ) (resid  74 and name HN  )  4.0  1.0  1.6
assign (resid  74 and name HB#  ) (resid  75 and name HN  )  3.3  0.8  1.3
assign (resid  74 and name HN  ) (resid  73 and name HN  )  4.1  1.0  1.6
assign (resid  75 and name HA  ) (resid  75 and name HN  )  3.2  0.8  1.3
assign (resid  75 and name HA  ) (resid  76 and name HN  )  4.1  1.0  1.6
assign (resid  75 and name HB#  ) (resid  75 and name HN  )  2.5  0.6  1.0
assign (resid  76 and name HB  ) (resid  76 and name HN  )  3.9  1.0  1.5
assign (resid  76 and name HD1#  ) (resid  76 and name HN  )  4.1  1.0  1.6
assign (resid  76 and name HD1#  ) (resid  24 and name HN  )  4.7  1.2  1.9
assign (resid  76 and (name HG12 or name HG11  )) (resid  78 and name HN  )  3.1  0.8  1.2
assign (resid  76 and name HG2#  ) (resid  76 and name HN  )  2.4  0.6  1.0
assign (resid  77 and name HA  ) (resid  76 and name HN  )  4.9  1.2  2.0
assign (resid  77 and name HA  ) (resid  77 and name HN  )  2.1  0.5  0.8
assign (resid  77 and name HA  ) (resid  78 and name HN  )  2.9  0.7  1.2
assign (resid  77 and name HA  ) (resid  79 and name HN  )  3.1  0.8  1.2
assign (resid  77 and (name HB1 or name HB2  )) (resid  79 and name HN  )  4.2  1.0  1.7
assign (resid  77 and (name HB2 or name HB1  )) (resid  77 and name HN  )  4.0  1.0  1.6
assign (resid  77 and (name HB2 or name HB1  )) (resid  78 and name HN  )  3.1  0.8  1.2
assign (resid  78 and name HA  ) (resid  78 and name HN  )  4.0  1.0  1.6
assign (resid  78 and name HA  ) (resid  79 and name HN  )  2.2  0.5  0.9
assign (resid  78 and name HB#  ) (resid  78 and name HN  )  2.7  0.7  1.1
assign (resid  78 and name HB#  ) (resid  81 and name HN  )  3.9  1.0  1.6
assign (resid  79 and name HA  ) (resid  79 and name HN  )  3.1  0.8  1.2
assign (resid  79 and name HB#  ) (resid  79 and name HN  )  2.0  0.5  0.8
assign (resid  79 and name HB#  ) (resid  80 and name HN  )  3.6  0.9  1.4
assign (resid  80 and name HA  ) (resid  80 and name HN  )  3.4  0.9  1.4
assign (resid  81 and (name HB1 or name HB2  )) (resid  82 and name HN  )  3.4  1.8  1.4
assign (resid  81 and (name HB2 or name HB1  )) (resid  82 and name HN  )  4.5  1.1  1.8
assign (resid  81 and (name HD1# or name HD2#  )) (resid  81 and name HN  )  4.8  1.2  1.9
assign (resid  82 and name HA  ) (resid  82 and name HN  )  2.7  0.7  1.1
assign (resid  82 and name HA  ) (resid  83 and name HN  )  3.9  1.0  1.6
assign (resid  82 and (name HB1 or name HB2  )) (resid  83 and name HN  )  3.0  0.8  1.2
assign (resid  82 and (name HB2 or name HB1  )) (resid  82 and name HN  )  2.4  0.6  0.9
assign (resid  82 and (name HB2 or name HB1  )) (resid  83 and name HN  )  3.8  0.9  1.5
assign (resid  83 and name HA  ) (resid  83 and name HN  )  3.4  0.8  1.4
assign (resid  83 and name HA  ) (resid  86 and name HN  )  4.9  1.2  2.0
assign (resid  83 and name HB#  ) (resid  83 and name HN  )  2.4  0.6  0.9
assign (resid  83 and name HG#  ) (resid  83 and name HN  )  3.0  0.8  1.2
assign (resid  84 and name HA  ) (resid  84 and name HN  )  3.6  0.9  1.4
assign (resid  84 and (name HB2 or name HB1  )) (resid  84 and name HN  )  2.5  0.6  1.0
assign (resid  84 and (name HB2 or name HB1  )) (resid  85 and name HN  )  3.1  0.8  1.2
assign (resid  84 and (name HB2 or name HB1  )) (resid  87 and name HN  )  3.2  0.8  1.3
assign (resid  85 and name HB#  ) (resid  85 and name HN  )  2.6  0.6  1.0
assign (resid  86 and name HA  ) (resid  87 and name HN  )  3.6  0.9  1.4
assign (resid  87 and name HB#  ) (resid  87 and name HN  )  2.6  0.6  1.0
assign (resid  87 and name HB#  ) (resid  88 and name HN  )  3.9  1.0  1.6
assign (resid  88 and name HA  ) (resid  88 and name HN  )  3.8  1.0  1.5
assign (resid  88 and name HA  ) (resid  89 and name HN  )  4.3  1.1  1.7
assign (resid  88 and (name HB2 or name HB1  )) (resid  88 and name HN  )  2.9  0.7  1.2
assign (resid  89 and name HA  ) (resid  89 and name HN  )  4.0  1.0  1.6
assign (resid  89 and (name HB1 or name HB2  )) (resid  89 and name HN  )  2.8  0.7  1.1
assign (resid  89 and (name HG1 or name HG2  )) (resid  89 and name HN  )  3.8  0.9  1.5
assign (resid  90 and (name HB1 or name HB2  )) (resid  91 and name HN  )  3.9  1.0  1.5
assign (resid  91 and name HG#  ) (resid  91 and name HN  )  3.7  0.9  1.5
assign ( resid 4  and name O ) ( resid 8 and name HN ) 1.9 0.0 0.6 
assign ( resid 4  and name O ) ( resid 8 and name  N ) 2.8 0.0 0.6 
assign ( resid 5  and name O ) ( resid 9 and name HN ) 1.9 0.0 0.6 
assign ( resid 5  and name O ) ( resid 9 and name  N ) 2.8 0.0 0.6 

assign ( resid 6  and name O ) ( resid 10 and name HN ) 1.9 0.0 0.6 
assign ( resid 6  and name O ) ( resid 10 and name  N ) 2.8 0.0 0.6 

assign ( resid 7  and name O ) ( resid 11 and name HN ) 1.9 0.0 0.6 
assign ( resid 7  and name O ) ( resid 11 and name  N ) 2.8 0.0 0.6 

assign ( resid 8  and name O ) ( resid 12 and name HN ) 1.9 0.0 0.6 
assign ( resid 8  and name O ) ( resid 12 and name  N ) 2.8 0.0 0.6 

assign ( resid 9  and name O ) ( resid 13 and name HN ) 1.9 0.0 0.6 
assign ( resid 9  and name O ) ( resid 13 and name  N ) 2.8 0.0 0.6 

assign ( resid 17  and name O ) ( resid 21 and name HN ) 1.9 0.0 0.6 
assign ( resid 17  and name O ) ( resid 21 and name  N ) 2.8 0.0 0.6 

assign ( resid 18  and name O ) ( resid 22 and name HN ) 1.9 0.0 0.6 
assign ( resid 18  and name O ) ( resid 22 and name  N ) 2.8 0.0 0.6 

assign ( resid 19  and name O ) ( resid 23 and name HN ) 1.9 0.0 0.6 
assign ( resid 19  and name O ) ( resid 23 and name  N ) 2.8 0.0 0.6 

assign ( resid 20  and name O ) ( resid 24 and name HN ) 1.9 0.0 0.6 
assign ( resid 20  and name O ) ( resid 24 and name  N ) 2.8 0.0 0.6 

assign ( resid 21  and name O ) ( resid 25 and name HN ) 1.9 0.0 0.6 
assign ( resid 21  and name O ) ( resid 25 and name  N ) 2.8 0.0 0.6 

assign ( resid 22  and name O ) ( resid 26 and name HN ) 1.9 0.0 0.6 
assign ( resid 22  and name O ) ( resid 26 and name  N ) 2.8 0.0 0.6 

assign ( resid 23  and name O ) ( resid 27 and name HN ) 1.9 0.0 0.6 
assign ( resid 23  and name O ) ( resid 27 and name  N ) 2.8 0.0 0.6 

assign ( resid 41  and name O ) ( resid 45 and name HN ) 1.9 0.0 0.6 
assign ( resid 41  and name O ) ( resid 45 and name  N ) 2.8 0.0 0.6 

assign ( resid 49  and name O ) ( resid 53 and name HN ) 1.9 0.0 0.6 
assign ( resid 49  and name O ) ( resid 53 and name  N ) 2.8 0.0 0.6 

assign ( resid 50  and name O ) ( resid 54 and name HN ) 1.9 0.0 0.6 
assign ( resid 50  and name O ) ( resid 54 and name  N ) 2.8 0.0 0.6 

assign ( resid 51  and name O ) ( resid 55 and name HN ) 1.9 0.0 0.6 
assign ( resid 51  and name O ) ( resid 55 and name  N ) 2.8 0.0 0.6 

assign ( resid 52  and name O ) ( resid 56 and name HN ) 1.9 0.0 0.6 
assign ( resid 52  and name O ) ( resid 56 and name  N ) 2.8 0.0 0.6 

assign ( resid 53  and name O ) ( resid 57 and name HN ) 1.9 0.0 0.6 
assign ( resid 53  and name O ) ( resid 57 and name  N ) 2.8 0.0 0.6 

assign ( resid 54  and name O ) ( resid 58 and name HN ) 1.9 0.0 0.6 
assign ( resid 54  and name O ) ( resid 58 and name  N ) 2.8 0.0 0.6 

assign ( resid 55  and name O ) ( resid 59 and name HN ) 1.9 0.0 0.6 
assign ( resid 55  and name O ) ( resid 59 and name  N ) 2.8 0.0 0.6 

assign ( resid 62  and name O ) ( resid 66 and name HN ) 1.9 0.0 0.6 
assign ( resid 62  and name O ) ( resid 66 and name  N ) 2.8 0.0 0.6 

assign ( resid 63  and name O ) ( resid 67 and name HN ) 1.9 0.0 0.6 
assign ( resid 63  and name O ) ( resid 67 and name  N ) 2.8 0.0 0.6 

assign ( resid 64  and name O ) ( resid 68 and name HN ) 1.9 0.0 0.6 
assign ( resid 64  and name O ) ( resid 68 and name  N ) 2.8 0.0 0.6 

assign ( resid 65  and name O ) ( resid 69 and name HN ) 1.9 0.0 0.6 
assign ( resid 65  and name O ) ( resid 69 and name  N ) 2.8 0.0 0.6 

assign ( resid 66  and name O ) ( resid 70 and name HN ) 1.9 0.0 0.6 
assign ( resid 66  and name O ) ( resid 70 and name  N ) 2.8 0.0 0.6 

assign ( resid 67  and name O ) ( resid 71 and name HN ) 1.9 0.0 0.6 
assign ( resid 67  and name O ) ( resid 71 and name  N ) 2.8 0.0 0.6 

assign ( resid 68  and name O ) ( resid 72 and name HN ) 1.9 0.0 0.6 
assign ( resid 68  and name O ) ( resid 72 and name  N ) 2.8 0.0 0.6 

assign ( resid 70  and name O ) ( resid 74 and name HN ) 1.9 0.0 0.6 
assign ( resid 70  and name O ) ( resid 74 and name  N ) 2.8 0.0 0.6 

assign ( resid 79  and name O ) ( resid 83 and name HN ) 1.9 0.0 0.6 
assign ( resid 79  and name O ) ( resid 83 and name  N ) 2.8 0.0 0.6 

assign ( resid 80  and name O ) ( resid 84 and name HN ) 1.9 0.0 0.6 
assign ( resid 80  and name O ) ( resid 84 and name  N ) 2.8 0.0 0.6 

assign ( resid 81  and name O ) ( resid 85 and name HN ) 1.9 0.0 0.6 
assign ( resid 81  and name O ) ( resid 85 and name  N ) 2.8 0.0 0.6 

assign ( resid 82  and name O ) ( resid 86 and name HN ) 1.9 0.0 0.6 
assign ( resid 82  and name O ) ( resid 86 and name  N ) 2.8 0.0 0.6 
assign ( resid 1   and name C )
 ( resid 2   and name N ) 
 ( resid 2   and name CA )
 ( resid 2   and name C ) 5.00 -87.63 77.58  2

assign ( resid 2   and name C )
 ( resid 3   and name N ) 
 ( resid 3   and name CA )
 ( resid 3   and name C ) 5.00 -96.82 26.75  2

assign ( resid 3   and name C )
 ( resid 4   and name N ) 
 ( resid 4   and name CA )
 ( resid 4   and name C ) 5.00 -67.68 19.98  2

assign ( resid 4   and name C )
 ( resid 5   and name N ) 
 ( resid 5   and name CA )
 ( resid 5   and name C ) 5.00 -60.78 10.00  2

assign ( resid 5   and name C )
 ( resid 6   and name N ) 
 ( resid 6   and name CA )
 ( resid 6   and name C ) 5.00 -67.85 10.00  2

assign ( resid 6   and name C )
 ( resid 7   and name N ) 
 ( resid 7   and name CA )
 ( resid 7   and name C ) 5.00 -63.63 10.00  2

assign ( resid 7   and name C )
 ( resid 8   and name N ) 
 ( resid 8   and name CA )
 ( resid 8   and name C ) 5.00 -63.37 10.00  2

assign ( resid 8   and name C )
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!!!!
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 ( resid 90  and name CA ) 
 ( resid 90  and name C )
 ( resid 91  and name N ) 5.00 151.13 10.00  2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1  -6.838  18.279   9.460
    2    H2   MET   1           HT2      MET   1  -6.239  18.854  10.943
    3    H3   MET   1           HT3      MET   1  -7.343  19.788  10.049
    4    HA   MET   1           HA       MET   1  -8.288  18.576  12.025
    5    HB2  MET   1           HB2      MET   1  -9.631  19.472  10.104
    6    HB3  MET   1           HB1      MET   1  -9.456  17.910   9.305
    7    HG2  MET   1           HG2      MET   1 -10.614  16.790  11.126
    8    HG3  MET   1           HG1      MET   1 -10.674  18.287  12.056
    9    HE1  MET   1           HE1      MET   1 -13.033  16.415  11.455
   10    HE2  MET   1           HE2      MET   1 -14.354  17.471  10.962
   11    HE3  MET   1           HE3      MET   1 -13.336  17.924  12.326
   12    H    ALA   2           HN       ALA   2  -7.269  16.583   9.256
   13    HA   ALA   2           HA       ALA   2  -6.662  14.339  11.008
   14    HB1  ALA   2           HB1      ALA   2  -9.005  14.089   9.092
   15    HB2  ALA   2           HB2      ALA   2  -9.113  14.083  10.853
   16    HB3  ALA   2           HB3      ALA   2  -8.291  12.767  10.015
   17    H    SER   3           HN       SER   3  -4.640  14.289   9.999
   18    HA   SER   3           HA       SER   3  -4.311  14.399   7.123
   19    HB2  SER   3           HB2      SER   3  -2.486  13.552   9.396
   20    HB3  SER   3           HB1      SER   3  -1.959  13.516   7.714
   21    HG   SER   3           HG       SER   3  -1.420  15.506   8.436
   22    H    THR   4           HN       THR   4  -4.433  12.736   5.670
   23    HA   THR   4           HA       THR   4  -5.411  10.135   6.551
   24    HB   THR   4           HB       THR   4  -4.354  10.790   3.776
   25    HG1  THR   4           HG1      THR   4  -5.950  12.103   3.519
   26   HG21  THR   4          HG21      THR   4  -5.941   9.143   3.044
   27   HG22  THR   4          HG22      THR   4  -6.691   9.066   4.638
   28   HG23  THR   4          HG23      THR   4  -5.062   8.433   4.397
   29    H    ARG   5           HN       ARG   5  -2.287  11.506   5.873
   30    HA   ARG   5           HA       ARG   5  -0.785   9.203   5.216
   31    HB2  ARG   5           HB2      ARG   5   0.064  11.516   6.988
   32    HB3  ARG   5           HB1      ARG   5   1.147  10.399   6.157
   33    HG2  ARG   5           HG2      ARG   5   0.249  11.141   3.981
   34    HG3  ARG   5           HG1      ARG   5  -0.830  12.263   4.810
   35    HD2  ARG   5           HD2      ARG   5   1.102  13.445   5.764
   36    HD3  ARG   5           HD1      ARG   5   2.198  12.309   4.976
   37    HE   ARG   5           HE       ARG   5   0.676  13.329   2.888
   38   HH11  ARG   5          HH21      ARG   5   2.605  14.625   5.443
   39   HH12  ARG   5          HH22      ARG   5   3.080  16.029   4.547
   40   HH21  ARG   5          HH11      ARG   5   1.288  15.155   1.711
   41   HH22  ARG   5          HH12      ARG   5   2.335  16.329   2.436
   42    H    CYS   6           HN       CYS   6  -1.796  10.440   8.386
   43    HA   CYS   6           HA       CYS   6  -0.400   8.427   9.912
   44    HB2  CYS   6           HB2      CYS   6  -2.780  10.177  10.588
   45    HB3  CYS   6           HB1      CYS   6  -1.941   9.155  11.755
   46    HG   CYS   6           HG       CYS   6  -0.977  11.852  10.815
   47    H    LYS   7           HN       LYS   7  -3.502   8.554   8.281
   48    HA   LYS   7           HA       LYS   7  -4.675   6.295   9.652
   49    HB2  LYS   7           HB2      LYS   7  -5.290   7.454   6.915
   50    HB3  LYS   7           HB1      LYS   7  -6.299   6.291   7.768
   51    HG2  LYS   7           HG2      LYS   7  -5.558   8.917   9.103
   52    HG3  LYS   7           HG1      LYS   7  -6.881   8.864   7.943
   53    HD2  LYS   7           HD2      LYS   7  -7.969   7.076   9.287
   54    HD3  LYS   7           HD1      LYS   7  -6.676   7.205  10.477
   55    HE2  LYS   7           HE2      LYS   7  -8.422   9.544   9.653
   56    HE3  LYS   7           HE1      LYS   7  -8.744   8.531  11.061
   57    HZ1  LYS   7           HZ1      LYS   7  -7.273   9.692  12.207
   58    HZ2  LYS   7           HZ2      LYS   7  -6.991  10.691  10.862
   59    HZ3  LYS   7           HZ3      LYS   7  -6.048   9.298  11.102
   60    H    LEU   8           HN       LEU   8  -3.125   6.573   6.408
   61    HA   LEU   8           HA       LEU   8  -3.273   3.772   5.808
   62    HB2  LEU   8           HB2      LEU   8  -1.046   5.657   4.975
   63    HB3  LEU   8           HB1      LEU   8  -1.541   4.179   4.156
   64    HG   LEU   8           HG       LEU   8  -3.338   6.606   4.515
   65   HD11  LEU   8          HD11      LEU   8  -1.785   5.703   2.069
   66   HD12  LEU   8          HD12      LEU   8  -1.366   7.085   3.080
   67   HD13  LEU   8          HD13      LEU   8  -2.869   7.091   2.157
   68   HD21  LEU   8          HD21      LEU   8  -4.567   5.410   2.568
   69   HD22  LEU   8          HD22      LEU   8  -4.724   4.685   4.161
   70   HD23  LEU   8          HD23      LEU   8  -3.607   3.991   2.986
   71    H    ALA   9           HN       ALA   9  -0.963   5.600   7.753
   72    HA   ALA   9           HA       ALA   9   1.029   3.563   7.972
   73    HB1  ALA   9           HB1      ALA   9   1.309   5.945   8.714
   74    HB2  ALA   9           HB2      ALA   9   1.813   4.767   9.925
   75    HB3  ALA   9           HB3      ALA   9   0.262   5.591  10.090
   76    H    ARG  10           HN       ARG  10  -1.961   4.153   9.762
   77    HA   ARG  10           HA       ARG  10  -1.500   2.152  11.779
   78    HB2  ARG  10           HB2      ARG  10  -4.014   3.470  10.713
   79    HB3  ARG  10           HB1      ARG  10  -4.070   2.262  11.997
   80    HG2  ARG  10           HG2      ARG  10  -2.606   3.640  13.399
   81    HG3  ARG  10           HG1      ARG  10  -2.457   4.834  12.110
   82    HD2  ARG  10           HD2      ARG  10  -4.861   5.290  12.211
   83    HD3  ARG  10           HD1      ARG  10  -5.067   4.037  13.436
   84    HE   ARG  10           HE       ARG  10  -3.167   5.744  14.531
   85   HH11  ARG  10          HH21      ARG  10  -6.345   6.048  13.212
   86   HH12  ARG  10          HH22      ARG  10  -6.774   7.393  14.217
   87   HH21  ARG  10          HH11      ARG  10  -3.714   7.496  15.844
   88   HH22  ARG  10          HH12      ARG  10  -5.285   8.211  15.705
   89    H    TYR  11           HN       TYR  11  -2.847   2.024   8.519
   90    HA   TYR  11           HA       TYR  11  -3.886  -0.677   8.795
   91    HB2  TYR  11           HB2      TYR  11  -3.355   1.167   6.451
   92    HB3  TYR  11           HB1      TYR  11  -3.804  -0.515   6.170
   93    HD1  TYR  11           HD2      TYR  11  -5.939  -1.409   7.180
   94    HD2  TYR  11           HD1      TYR  11  -5.033   2.782   7.078
   95    HE1  TYR  11           HE2      TYR  11  -8.332  -0.885   7.567
   96    HE2  TYR  11           HE1      TYR  11  -7.426   3.311   7.467
   97    HH   TYR  11           HH       TYR  11  -9.732   0.839   8.305
   98    H    LEU  12           HN       LEU  12  -0.950   0.608   7.133
   99    HA   LEU  12           HA       LEU  12   0.087  -1.988   6.501
  100    HB2  LEU  12           HB2      LEU  12   1.814   0.427   7.149
  101    HB3  LEU  12           HB1      LEU  12   2.201  -0.918   6.081
  102    HG   LEU  12           HG       LEU  12  -0.105   1.016   5.505
  103   HD11  LEU  12          HD11      LEU  12   2.726   1.066   4.397
  104   HD12  LEU  12          HD12      LEU  12   2.091   2.209   5.578
  105   HD13  LEU  12          HD13      LEU  12   1.409   2.151   3.954
  106   HD21  LEU  12          HD21      LEU  12  -0.367  -1.021   4.243
  107   HD22  LEU  12          HD22      LEU  12   1.356  -1.109   3.882
  108   HD23  LEU  12          HD23      LEU  12   0.358   0.134   3.132
  109    H    GLU  13           HN       GLU  13   0.058  -0.147   9.456
  110    HA   GLU  13           HA       GLU  13   2.067  -1.867  10.774
  111    HB2  GLU  13           HB2      GLU  13   0.323   0.443  11.669
  112    HB3  GLU  13           HB1      GLU  13   1.098  -0.576  12.876
  113    HG2  GLU  13           HG2      GLU  13   2.449   1.446  12.271
  114    HG3  GLU  13           HG1      GLU  13   3.296  -0.073  11.991
  115    H    ASP  14           HN       ASP  14  -1.472  -1.619  10.632
  116    HA   ASP  14           HA       ASP  14  -1.938  -3.532  12.759
  117    HB2  ASP  14           HB2      ASP  14  -3.706  -2.560  10.488
  118    HB3  ASP  14           HB1      ASP  14  -4.263  -3.649  11.759
  119    H    LEU  15           HN       LEU  15  -0.543  -4.026   9.756
  120    HA   LEU  15           HA       LEU  15  -1.825  -6.637   9.226
  121    HB2  LEU  15           HB2      LEU  15  -0.088  -4.761   7.770
  122    HB3  LEU  15           HB1      LEU  15   0.553  -6.393   7.652
  123    HG   LEU  15           HG       LEU  15  -1.760  -7.143   6.921
  124   HD11  LEU  15          HD11      LEU  15  -3.111  -5.306   7.764
  125   HD12  LEU  15          HD12      LEU  15  -3.242  -5.330   6.010
  126   HD13  LEU  15          HD13      LEU  15  -2.202  -4.148   6.798
  127   HD21  LEU  15          HD21      LEU  15   0.108  -6.686   5.319
  128   HD22  LEU  15          HD22      LEU  15  -0.468  -5.028   5.172
  129   HD23  LEU  15          HD23      LEU  15  -1.479  -6.363   4.624
  130    H    GLU  16           HN       GLU  16  -0.465  -8.628   9.156
  131    HA   GLU  16           HA       GLU  16   0.879  -9.022  11.654
  132    HB2  GLU  16           HB2      GLU  16  -0.276 -10.813  10.321
  133    HB3  GLU  16           HB1      GLU  16   1.064 -10.762   9.177
  134    HG2  GLU  16           HG2      GLU  16   2.639 -11.424  10.899
  135    HG3  GLU  16           HG1      GLU  16   1.392 -11.311  12.141
  136    H    ASP  17           HN       ASP  17   3.140  -9.544  12.002
  137    HA   ASP  17           HA       ASP  17   4.952  -7.722  10.757
  138    HB2  ASP  17           HB2      ASP  17   6.715  -9.002  11.960
  139    HB3  ASP  17           HB1      ASP  17   5.351  -8.604  13.006
  140    H    VAL  18           HN       VAL  18   4.555 -11.261  10.329
  141    HA   VAL  18           HA       VAL  18   6.609 -11.456   8.320
  142    HB   VAL  18           HB       VAL  18   4.206 -13.260   8.828
  143   HG11  VAL  18          HG11      VAL  18   6.714 -13.631   7.149
  144   HG12  VAL  18          HG12      VAL  18   5.042 -13.682   6.589
  145   HG13  VAL  18          HG13      VAL  18   5.662 -14.962   7.630
  146   HG21  VAL  18          HG21      VAL  18   7.114 -13.508   9.683
  147   HG22  VAL  18          HG22      VAL  18   5.816 -14.637  10.069
  148   HG23  VAL  18          HG23      VAL  18   5.796 -13.007  10.743
  149    H    ASP  19           HN       ASP  19   3.159 -10.650   8.204
  150    HA   ASP  19           HA       ASP  19   2.962 -10.836   5.309
  151    HB2  ASP  19           HB2      ASP  19   0.962 -10.944   6.760
  152    HB3  ASP  19           HB1      ASP  19   1.263  -9.293   7.299
  153    H    LEU  20           HN       LEU  20   3.969  -8.414   7.624
  154    HA   LEU  20           HA       LEU  20   3.833  -6.114   5.944
  155    HB2  LEU  20           HB2      LEU  20   4.445  -6.486   8.547
  156    HB3  LEU  20           HB1      LEU  20   6.090  -6.395   7.935
  157    HG   LEU  20           HG       LEU  20   3.940  -4.292   7.480
  158   HD11  LEU  20          HD11      LEU  20   4.699  -4.465   9.842
  159   HD12  LEU  20          HD12      LEU  20   5.202  -2.950   9.093
  160   HD13  LEU  20          HD13      LEU  20   6.365  -4.258   9.302
  161   HD21  LEU  20          HD21      LEU  20   5.531  -4.241   5.670
  162   HD22  LEU  20          HD22      LEU  20   6.890  -4.436   6.775
  163   HD23  LEU  20          HD23      LEU  20   5.969  -2.931   6.763
  164    H    LYS  21           HN       LYS  21   6.430  -8.477   6.517
  165    HA   LYS  21           HA       LYS  21   8.342  -7.314   4.733
  166    HB2  LYS  21           HB2      LYS  21   8.963  -8.985   6.423
  167    HB3  LYS  21           HB1      LYS  21   7.983 -10.199   5.601
  168    HG2  LYS  21           HG2      LYS  21   9.424 -10.203   3.682
  169    HG3  LYS  21           HG1      LYS  21  10.267  -8.753   4.224
  170    HD2  LYS  21           HD2      LYS  21  11.661 -10.706   4.667
  171    HD3  LYS  21           HD1      LYS  21  11.120 -10.019   6.196
  172    HE2  LYS  21           HE2      LYS  21   9.519 -11.757   6.530
  173    HE3  LYS  21           HE1      LYS  21   9.622 -12.286   4.850
  174    HZ1  LYS  21           HZ1      LYS  21  12.173 -12.490   5.689
  175    HZ2  LYS  21           HZ2      LYS  21  11.060 -13.773   5.637
  176    HZ3  LYS  21           HZ3      LYS  21  11.317 -12.925   7.087
  177    H    LYS  22           HN       LYS  22   5.647  -9.542   4.203
  178    HA   LYS  22           HA       LYS  22   6.441 -10.241   1.489
  179    HB2  LYS  22           HB2      LYS  22   3.830 -10.504   3.021
  180    HB3  LYS  22           HB1      LYS  22   3.985 -11.003   1.337
  181    HG2  LYS  22           HG2      LYS  22   5.841 -12.519   1.967
  182    HG3  LYS  22           HG1      LYS  22   5.646 -12.044   3.654
  183    HD2  LYS  22           HD2      LYS  22   3.371 -12.924   3.682
  184    HD3  LYS  22           HD1      LYS  22   3.469 -13.305   1.963
  185    HE2  LYS  22           HE2      LYS  22   5.276 -14.485   4.092
  186    HE3  LYS  22           HE1      LYS  22   3.873 -15.301   3.403
  187    HZ1  LYS  22           HZ1      LYS  22   5.383 -14.374   1.274
  188    HZ2  LYS  22           HZ2      LYS  22   5.172 -15.986   1.767
  189    HZ3  LYS  22           HZ3      LYS  22   6.485 -15.080   2.353
  190    H    PHE  23           HN       PHE  23   4.617  -7.599   2.929
  191    HA   PHE  23           HA       PHE  23   3.344  -6.725   0.476
  192    HB2  PHE  23           HB2      PHE  23   2.653  -6.009   2.790
  193    HB3  PHE  23           HB1      PHE  23   4.116  -5.032   2.876
  194    HD1  PHE  23           HD1      PHE  23   4.491  -3.181   1.192
  195    HD2  PHE  23           HD2      PHE  23   0.730  -5.229   1.575
  196    HE1  PHE  23           HE1      PHE  23   3.366  -1.352  -0.044
  197    HE2  PHE  23           HE2      PHE  23  -0.389  -3.397   0.334
  198    HZ   PHE  23           HZ       PHE  23   0.927  -1.458  -0.472
  199    H    LYS  24           HN       LYS  24   6.428  -5.863   2.060
  200    HA   LYS  24           HA       LYS  24   7.121  -3.846   0.104
  201    HB2  LYS  24           HB2      LYS  24   8.837  -5.409   2.055
  202    HB3  LYS  24           HB1      LYS  24   9.396  -4.028   1.111
  203    HG2  LYS  24           HG2      LYS  24   7.605  -2.638   2.150
  204    HG3  LYS  24           HG1      LYS  24   7.157  -4.016   3.156
  205    HD2  LYS  24           HD2      LYS  24   9.376  -4.049   4.171
  206    HD3  LYS  24           HD1      LYS  24   9.912  -2.751   3.104
  207    HE2  LYS  24           HE2      LYS  24   7.634  -2.502   5.087
  208    HE3  LYS  24           HE1      LYS  24   9.277  -1.934   5.380
  209    HZ1  LYS  24           HZ1      LYS  24   9.041  -0.586   3.316
  210    HZ2  LYS  24           HZ2      LYS  24   8.017  -0.109   4.585
  211    HZ3  LYS  24           HZ3      LYS  24   7.398  -1.007   3.281
  212    H    MET  25           HN       MET  25   8.139  -7.244   0.579
  213    HA   MET  25           HA       MET  25   9.916  -7.365  -1.629
  214    HB2  MET  25           HB2      MET  25   9.687  -9.130   0.134
  215    HB3  MET  25           HB1      MET  25   8.161  -9.617  -0.601
  216    HG2  MET  25           HG2      MET  25   9.282 -10.177  -2.683
  217    HG3  MET  25           HG1      MET  25  10.811  -9.548  -2.071
  218    HE1  MET  25           HE1      MET  25  10.371 -12.453  -3.320
  219    HE2  MET  25           HE2      MET  25  11.446 -13.357  -2.255
  220    HE3  MET  25           HE3      MET  25  11.907 -11.746  -2.799
  221    H    HIS  26           HN       HIS  26   6.395  -7.853  -1.476
  222    HA   HIS  26           HA       HIS  26   6.151  -8.663  -4.261
  223    HB2  HIS  26           HB2      HIS  26   4.410  -9.067  -2.437
  224    HB3  HIS  26           HB1      HIS  26   4.020  -7.348  -2.521
  225    HD1  HIS  26           HD1      HIS  26   4.820  -9.564  -5.495
  226    HD2  HIS  26           HD2      HIS  26   1.572  -7.524  -3.863
  227    HE1  HIS  26           HE1      HIS  26   2.952  -9.712  -7.199
  228    H    LEU  27           HN       LEU  27   6.202  -5.555  -2.584
  229    HA   LEU  27           HA       LEU  27   5.225  -4.012  -4.853
  230    HB2  LEU  27           HB2      LEU  27   5.242  -3.266  -2.412
  231    HB3  LEU  27           HB1      LEU  27   6.980  -3.043  -2.571
  232    HG   LEU  27           HG       LEU  27   6.354  -1.537  -4.653
  233   HD11  LEU  27          HD11      LEU  27   3.969  -2.038  -4.784
  234   HD12  LEU  27          HD12      LEU  27   4.163  -0.355  -4.313
  235   HD13  LEU  27          HD13      LEU  27   3.739  -1.563  -3.102
  236   HD21  LEU  27          HD21      LEU  27   7.368  -0.650  -2.607
  237   HD22  LEU  27          HD22      LEU  27   5.799  -0.655  -1.801
  238   HD23  LEU  27          HD23      LEU  27   6.091   0.434  -3.157
  239    H    GLU  28           HN       GLU  28   8.501  -4.619  -3.534
  240    HA   GLU  28           HA       GLU  28   9.860  -3.158  -5.598
  241    HB2  GLU  28           HB2      GLU  28  10.861  -5.467  -3.899
  242    HB3  GLU  28           HB1      GLU  28  11.874  -4.367  -4.834
  243    HG2  GLU  28           HG2      GLU  28  11.080  -2.466  -3.505
  244    HG3  GLU  28           HG1      GLU  28  10.006  -3.530  -2.596
  245    H    ASP  29           HN       ASP  29   8.683  -6.473  -5.378
  246    HA   ASP  29           HA       ASP  29  10.016  -7.249  -7.912
  247    HB2  ASP  29           HB2      ASP  29   8.124  -8.743  -6.069
  248    HB3  ASP  29           HB1      ASP  29   8.893  -9.434  -7.499
  249    H    TYR  30           HN       TYR  30   7.775  -5.147  -7.672
  250    HA   TYR  30           HA       TYR  30   5.400  -6.202  -8.819
  251    HB2  TYR  30           HB2      TYR  30   5.561  -3.954  -7.816
  252    HB3  TYR  30           HB1      TYR  30   6.589  -3.440  -9.154
  253    HD1  TYR  30           HD1      TYR  30   3.180  -4.569  -8.220
  254    HD2  TYR  30           HD2      TYR  30   5.653  -2.949 -11.339
  255    HE1  TYR  30           HE1      TYR  30   1.158  -4.067  -9.564
  256    HE2  TYR  30           HE2      TYR  30   3.629  -2.448 -12.681
  257    HH   TYR  30           HH       TYR  30   0.659  -3.766 -12.092
  258    HA   PRO  31           HA       PRO  31   7.451  -6.951 -12.824
  259    HB2  PRO  31           HB2      PRO  31   5.112  -7.881 -14.173
  260    HB3  PRO  31           HB1      PRO  31   6.318  -8.892 -13.364
  261    HG2  PRO  31           HG2      PRO  31   3.584  -8.226 -12.464
  262    HG3  PRO  31           HG1      PRO  31   4.674  -9.482 -11.855
  263    HD2  PRO  31           HD2      PRO  31   4.053  -6.987 -10.571
  264    HD3  PRO  31           HD1      PRO  31   5.285  -8.167 -10.065
  265    HA   PRO  32           HA       PRO  32   6.291  -3.285 -15.055
  266    HB2  PRO  32           HB2      PRO  32   6.434  -4.177 -17.755
  267    HB3  PRO  32           HB1      PRO  32   7.786  -3.546 -16.803
  268    HG2  PRO  32           HG2      PRO  32   7.194  -6.366 -17.544
  269    HG3  PRO  32           HG1      PRO  32   8.732  -5.649 -17.035
  270    HD2  PRO  32           HD2      PRO  32   7.078  -7.296 -15.418
  271    HD3  PRO  32           HD1      PRO  32   8.394  -6.256 -14.830
  272    H    GLN  33           HN       GLN  33   4.359  -2.340 -15.803
  273    HA   GLN  33           HA       GLN  33   2.075  -4.200 -16.440
  274    HB2  GLN  33           HB2      GLN  33   1.856  -2.824 -14.346
  275    HB3  GLN  33           HB1      GLN  33   1.962  -1.370 -15.340
  276    HG2  GLN  33           HG2      GLN  33  -0.041  -1.995 -16.563
  277    HG3  GLN  33           HG1      GLN  33  -0.114  -3.543 -15.723
  278   HE21  GLN  33          HE21      GLN  33   0.799  -0.571 -14.028
  279   HE22  GLN  33          HE22      GLN  33  -0.615  -0.461 -13.095
  280    H    LYS  34           HN       LYS  34   3.510  -1.028 -17.218
  281    HA   LYS  34           HA       LYS  34   3.037  -1.358 -20.043
  282    HB2  LYS  34           HB2      LYS  34   0.701  -0.851 -19.245
  283    HB3  LYS  34           HB1      LYS  34   1.291   0.699 -18.649
  284    HG2  LYS  34           HG2      LYS  34   1.959   1.360 -20.899
  285    HG3  LYS  34           HG1      LYS  34   1.520  -0.228 -21.528
  286    HD2  LYS  34           HD2      LYS  34  -0.834   0.179 -20.799
  287    HD3  LYS  34           HD1      LYS  34  -0.367   1.807 -20.306
  288    HE2  LYS  34           HE2      LYS  34  -0.223   0.657 -23.107
  289    HE3  LYS  34           HE1      LYS  34  -1.319   1.918 -22.541
  290    HZ1  LYS  34           HZ1      LYS  34   0.301   3.223 -23.389
  291    HZ2  LYS  34           HZ2      LYS  34   1.524   2.065 -23.166
  292    HZ3  LYS  34           HZ3      LYS  34   0.981   2.996 -21.852
  293    H    GLY  35           HN       GLY  35   5.373  -0.824 -19.541
  294    HA2  GLY  35           HA2      GLY  35   7.136   0.720 -19.707
  295    HA3  GLY  35           HA1      GLY  35   5.933   1.919 -20.189
  296    H    CYS  36           HN       CYS  36   5.177   0.390 -17.247
  297    HA   CYS  36           HA       CYS  36   5.258   2.788 -15.728
  298    HB2  CYS  36           HB2      CYS  36   3.923   0.806 -15.080
  299    HB3  CYS  36           HB1      CYS  36   5.411  -0.070 -14.720
  300    HG   CYS  36           HG       CYS  36   5.824   2.067 -12.973
  301    H    ILE  37           HN       ILE  37   6.753   3.501 -14.119
  302    HA   ILE  37           HA       ILE  37   9.543   2.882 -14.738
  303    HB   ILE  37           HB       ILE  37   8.786   5.187 -14.310
  304   HG12  ILE  37          HG12      ILE  37  10.708   4.165 -12.188
  305   HG13  ILE  37          HG11      ILE  37  11.139   4.543 -13.858
  306   HG21  ILE  37          HG21      ILE  37   8.454   4.436 -11.390
  307   HG22  ILE  37          HG22      ILE  37   7.091   4.424 -12.511
  308   HG23  ILE  37          HG23      ILE  37   7.967   5.920 -12.203
  309   HD11  ILE  37          HD11      ILE  37  10.099   6.482 -11.760
  310   HD12  ILE  37          HD12      ILE  37  10.280   6.893 -13.466
  311   HD13  ILE  37          HD13      ILE  37  11.700   6.479 -12.503
  312    HA   PRO  38           HA       PRO  38   9.528  -0.197 -11.395
  313    HB2  PRO  38           HB2      PRO  38  12.352  -0.481 -11.172
  314    HB3  PRO  38           HB1      PRO  38  11.293  -1.453 -12.205
  315    HG2  PRO  38           HG2      PRO  38  13.168   0.706 -12.993
  316    HG3  PRO  38           HG1      PRO  38  12.422  -0.543 -14.005
  317    HD2  PRO  38           HD2      PRO  38  11.674   2.210 -13.921
  318    HD3  PRO  38           HD1      PRO  38  10.758   0.896 -14.696
  319    H    LEU  39           HN       LEU  39   9.557   0.114  -9.159
  320    HA   LEU  39           HA       LEU  39  10.262   2.722  -8.130
  321    HB2  LEU  39           HB2      LEU  39   9.260   0.139  -6.940
  322    HB3  LEU  39           HB1      LEU  39   9.794   1.429  -5.866
  323    HG   LEU  39           HG       LEU  39   8.179   2.974  -6.879
  324   HD11  LEU  39          HD11      LEU  39   7.538   0.596  -8.649
  325   HD12  LEU  39          HD12      LEU  39   8.071   2.201  -9.152
  326   HD13  LEU  39          HD13      LEU  39   6.460   1.982  -8.475
  327   HD21  LEU  39          HD21      LEU  39   6.142   1.921  -6.031
  328   HD22  LEU  39          HD22      LEU  39   7.498   1.498  -4.986
  329   HD23  LEU  39          HD23      LEU  39   6.886   0.326  -6.153
  330    HA   PRO  40           HA       PRO  40  14.608   1.392  -7.637
  331    HB2  PRO  40           HB2      PRO  40  15.124   3.683  -5.861
  332    HB3  PRO  40           HB1      PRO  40  15.755   3.398  -7.490
  333    HG2  PRO  40           HG2      PRO  40  13.748   5.309  -6.752
  334    HG3  PRO  40           HG1      PRO  40  14.247   4.884  -8.396
  335    HD2  PRO  40           HD2      PRO  40  11.741   4.186  -7.045
  336    HD3  PRO  40           HD1      PRO  40  12.200   3.874  -8.736
  337    H    ARG  41           HN       ARG  41  15.377  -0.023  -6.109
  338    HA   ARG  41           HA       ARG  41  13.815  -0.655  -3.780
  339    HB2  ARG  41           HB2      ARG  41  16.656  -1.409  -4.557
  340    HB3  ARG  41           HB1      ARG  41  15.798  -2.108  -3.182
  341    HG2  ARG  41           HG2      ARG  41  14.067  -2.988  -4.653
  342    HG3  ARG  41           HG1      ARG  41  14.800  -2.191  -6.045
  343    HD2  ARG  41           HD2      ARG  41  15.403  -4.604  -5.914
  344    HD3  ARG  41           HD1      ARG  41  16.815  -3.553  -5.810
  345    HE   ARG  41           HE       ARG  41  16.085  -3.961  -3.161
  346   HH11  ARG  41          HH21      ARG  41  16.807  -5.947  -5.893
  347   HH12  ARG  41          HH22      ARG  41  17.447  -7.246  -4.943
  348   HH21  ARG  41          HH11      ARG  41  16.916  -5.648  -1.912
  349   HH22  ARG  41          HH12      ARG  41  17.508  -7.077  -2.691
  350    H    GLY  42           HN       GLY  42  16.940   1.037  -4.153
  351    HA2  GLY  42           HA2      GLY  42  17.506   1.462  -1.408
  352    HA3  GLY  42           HA1      GLY  42  18.005   2.586  -2.675
  353    H    GLN  43           HN       GLN  43  15.185   3.160  -3.476
  354    HA   GLN  43           HA       GLN  43  14.702   5.295  -1.545
  355    HB2  GLN  43           HB2      GLN  43  13.415   4.356  -4.110
  356    HB3  GLN  43           HB1      GLN  43  12.508   5.459  -3.079
  357    HG2  GLN  43           HG2      GLN  43  13.816   6.686  -4.788
  358    HG3  GLN  43           HG1      GLN  43  14.346   7.087  -3.157
  359   HE21  GLN  43          HE21      GLN  43  15.561   6.356  -6.178
  360   HE22  GLN  43          HE22      GLN  43  17.065   5.713  -5.721
  361    H    THR  44           HN       THR  44  12.829   2.390  -2.521
  362    HA   THR  44           HA       THR  44  10.792   2.735  -0.544
  363    HB   THR  44           HB       THR  44  11.783   0.210  -1.901
  364    HG1  THR  44           HG1      THR  44  10.932   2.006  -3.179
  365   HG21  THR  44          HG21      THR  44  10.496  -0.456   0.022
  366   HG22  THR  44          HG22      THR  44   9.436  -0.599  -1.378
  367   HG23  THR  44          HG23      THR  44   9.278   0.780  -0.292
  368    H    GLU  45           HN       GLU  45  13.630   0.529  -0.505
  369    HA   GLU  45           HA       GLU  45  13.234  -0.428   2.141
  370    HB2  GLU  45           HB2      GLU  45  15.897   0.044   0.733
  371    HB3  GLU  45           HB1      GLU  45  15.625  -1.034   2.100
  372    HG2  GLU  45           HG2      GLU  45  14.314  -1.320  -0.629
  373    HG3  GLU  45           HG1      GLU  45  15.690  -2.263  -0.060
  374    H    LYS  46           HN       LYS  46  14.954   2.516   0.999
  375    HA   LYS  46           HA       LYS  46  15.809   3.230   3.701
  376    HB2  LYS  46           HB2      LYS  46  17.011   3.964   1.628
  377    HB3  LYS  46           HB1      LYS  46  15.629   4.984   1.229
  378    HG2  LYS  46           HG2      LYS  46  15.927   6.284   3.254
  379    HG3  LYS  46           HG1      LYS  46  17.188   5.190   3.821
  380    HD2  LYS  46           HD2      LYS  46  18.598   5.808   1.895
  381    HD3  LYS  46           HD1      LYS  46  17.336   6.899   1.320
  382    HE2  LYS  46           HE2      LYS  46  17.504   8.183   3.436
  383    HE3  LYS  46           HE1      LYS  46  18.806   7.116   3.964
  384    HZ1  LYS  46           HZ1      LYS  46  19.923   7.771   1.792
  385    HZ2  LYS  46           HZ2      LYS  46  19.882   8.937   3.027
  386    HZ3  LYS  46           HZ3      LYS  46  18.800   9.040   1.721
  387    H    ALA  47           HN       ALA  47  12.898   3.568   1.877
  388    HA   ALA  47           HA       ALA  47  11.902   5.936   3.265
  389    HB1  ALA  47           HB1      ALA  47  10.450   3.809   1.660
  390    HB2  ALA  47           HB2      ALA  47  11.054   5.344   1.039
  391    HB3  ALA  47           HB3      ALA  47   9.739   5.324   2.213
  392    H    ASP  48           HN       ASP  48  10.875   5.991   5.209
  393    HA   ASP  48           HA       ASP  48  10.656   3.526   6.801
  394    HB2  ASP  48           HB2      ASP  48  11.347   5.750   7.755
  395    HB3  ASP  48           HB1      ASP  48   9.710   6.336   7.464
  396    H    HIS  49           HN       HIS  49   8.413   3.461   8.146
  397    HA   HIS  49           HA       HIS  49   6.408   2.671   6.284
  398    HB2  HIS  49           HB2      HIS  49   4.882   2.915   8.463
  399    HB3  HIS  49           HB1      HIS  49   6.106   1.652   8.372
  400    HD1  HIS  49           HD1      HIS  49   5.156   4.658  10.276
  401    HD2  HIS  49           HD2      HIS  49   8.566   2.309   9.810
  402    HE1  HIS  49           HE1      HIS  49   6.701   5.252  12.192
  403    H    VAL  50           HN       VAL  50   6.696   5.673   8.222
  404    HA   VAL  50           HA       VAL  50   4.283   6.855   7.112
  405    HB   VAL  50           HB       VAL  50   6.734   8.158   8.380
  406   HG11  VAL  50          HG11      VAL  50   3.997   9.291   7.699
  407   HG12  VAL  50          HG12      VAL  50   5.560   9.849   7.102
  408   HG13  VAL  50          HG13      VAL  50   5.132  10.077   8.795
  409   HG21  VAL  50          HG21      VAL  50   5.406   6.540   9.806
  410   HG22  VAL  50          HG22      VAL  50   4.007   7.591   9.597
  411   HG23  VAL  50          HG23      VAL  50   5.443   8.188  10.426
  412    H    ASP  51           HN       ASP  51   7.763   7.358   6.390
  413    HA   ASP  51           HA       ASP  51   7.388   9.151   4.226
  414    HB2  ASP  51           HB2      ASP  51   9.597   8.624   5.286
  415    HB3  ASP  51           HB1      ASP  51   9.565   7.053   4.486
  416    H    LEU  52           HN       LEU  52   7.305   5.602   4.315
  417    HA   LEU  52           HA       LEU  52   7.293   5.071   1.558
  418    HB2  LEU  52           HB2      LEU  52   7.356   3.283   3.226
  419    HB3  LEU  52           HB1      LEU  52   5.737   3.704   3.772
  420    HG   LEU  52           HG       LEU  52   4.794   3.035   1.606
  421   HD11  LEU  52          HD11      LEU  52   6.449   3.531  -0.018
  422   HD12  LEU  52          HD12      LEU  52   6.432   1.774   0.019
  423   HD13  LEU  52          HD13      LEU  52   7.707   2.657   0.859
  424   HD21  LEU  52          HD21      LEU  52   5.361   0.603   1.734
  425   HD22  LEU  52          HD22      LEU  52   5.018   1.313   3.311
  426   HD23  LEU  52          HD23      LEU  52   6.685   1.003   2.828
  427    H    ALA  53           HN       ALA  53   4.554   5.949   3.680
  428    HA   ALA  53           HA       ALA  53   2.535   5.811   1.647
  429    HB1  ALA  53           HB1      ALA  53   2.653   7.571   4.117
  430    HB2  ALA  53           HB2      ALA  53   2.011   5.930   4.059
  431    HB3  ALA  53           HB3      ALA  53   1.205   7.224   3.172
  432    H    THR  54           HN       THR  54   4.913   8.264   2.471
  433    HA   THR  54           HA       THR  54   3.652  10.441   1.048
  434    HB   THR  54           HB       THR  54   6.610  10.054   1.610
  435    HG1  THR  54           HG1      THR  54   6.105  11.238   3.510
  436   HG21  THR  54          HG21      THR  54   6.619  12.535   1.610
  437   HG22  THR  54          HG22      THR  54   4.920  12.529   1.144
  438   HG23  THR  54          HG23      THR  54   6.139  11.879   0.047
  439    H    LEU  55           HN       LEU  55   5.991   7.924   0.055
  440    HA   LEU  55           HA       LEU  55   6.466   9.108  -2.553
  441    HB2  LEU  55           HB2      LEU  55   6.933   6.275  -1.534
  442    HB3  LEU  55           HB1      LEU  55   7.315   6.781  -3.173
  443    HG   LEU  55           HG       LEU  55   8.747   8.642  -2.132
  444   HD11  LEU  55          HD11      LEU  55   7.957   8.668   0.144
  445   HD12  LEU  55          HD12      LEU  55   9.602   8.051   0.189
  446   HD13  LEU  55          HD13      LEU  55   8.242   6.939   0.326
  447   HD21  LEU  55          HD21      LEU  55   9.750   6.666  -3.160
  448   HD22  LEU  55          HD22      LEU  55   9.487   5.730  -1.689
  449   HD23  LEU  55          HD23      LEU  55  10.637   7.067  -1.689
  450    H    MET  56           HN       MET  56   4.153   6.767  -1.261
  451    HA   MET  56           HA       MET  56   3.104   6.003  -3.863
  452    HB2  MET  56           HB2      MET  56   1.935   5.806  -1.072
  453    HB3  MET  56           HB1      MET  56   1.148   5.147  -2.504
  454    HG2  MET  56           HG2      MET  56   3.051   3.682  -2.938
  455    HG3  MET  56           HG1      MET  56   3.955   4.404  -1.609
  456    HE1  MET  56           HE1      MET  56   0.408   2.866  -2.385
  457    HE2  MET  56           HE2      MET  56   0.555   1.369  -1.469
  458    HE3  MET  56           HE3      MET  56   1.688   1.708  -2.774
  459    H    ILE  57           HN       ILE  57   2.091   8.404  -1.408
  460    HA   ILE  57           HA       ILE  57  -0.194   9.254  -3.044
  461    HB   ILE  57           HB       ILE  57   1.085  10.647  -0.662
  462   HG12  ILE  57          HG12      ILE  57  -1.401   8.904  -0.754
  463   HG13  ILE  57          HG11      ILE  57   0.183   8.292  -0.281
  464   HG21  ILE  57          HG21      ILE  57  -0.247  12.217  -1.924
  465   HG22  ILE  57          HG22      ILE  57  -1.195  11.726  -0.525
  466   HG23  ILE  57          HG23      ILE  57  -1.547  11.042  -2.109
  467   HD11  ILE  57          HD11      ILE  57   0.289   9.792   1.602
  468   HD12  ILE  57          HD12      ILE  57  -1.285   9.000   1.651
  469   HD13  ILE  57          HD13      ILE  57  -1.153  10.656   1.068
  470    H    ASP  58           HN       ASP  58   3.115  10.438  -2.505
  471    HA   ASP  58           HA       ASP  58   2.699  12.871  -4.057
  472    HB2  ASP  58           HB2      ASP  58   4.434  12.567  -2.217
  473    HB3  ASP  58           HB1      ASP  58   5.340  11.548  -3.336
  474    H    PHE  59           HN       PHE  59   4.420   9.778  -4.754
  475    HA   PHE  59           HA       PHE  59   5.012  10.695  -7.482
  476    HB2  PHE  59           HB2      PHE  59   6.472   9.180  -5.999
  477    HB3  PHE  59           HB1      PHE  59   5.371   7.874  -6.426
  478    HD1  PHE  59           HD2      PHE  59   5.001   7.324  -8.884
  479    HD2  PHE  59           HD1      PHE  59   8.160   9.912  -7.544
  480    HE1  PHE  59           HE2      PHE  59   6.170   7.024 -11.050
  481    HE2  PHE  59           HE1      PHE  59   9.325   9.612  -9.711
  482    HZ   PHE  59           HZ       PHE  59   8.331   8.170 -11.463
  483    H    ASN  60           HN       ASN  60   2.787   8.174  -6.119
  484    HA   ASN  60           HA       ASN  60   1.798   7.635  -8.888
  485    HB2  ASN  60           HB2      ASN  60   1.152   6.335  -6.219
  486    HB3  ASN  60           HB1      ASN  60   0.480   5.825  -7.765
  487   HD21  ASN  60          HD21      ASN  60   1.903   4.729  -9.272
  488   HD22  ASN  60          HD22      ASN  60   3.446   4.187  -8.816
  489    H    GLY  61           HN       GLY  61   0.778   9.242  -5.934
  490    HA2  GLY  61           HA2      GLY  61  -0.905  10.990  -5.965
  491    HA3  GLY  61           HA1      GLY  61  -1.667  10.227  -7.357
  492    H    GLU  62           HN       GLU  62  -3.209  10.930  -5.170
  493    HA   GLU  62           HA       GLU  62  -3.531   8.774  -3.273
  494    HB2  GLU  62           HB2      GLU  62  -4.292  11.184  -2.970
  495    HB3  GLU  62           HB1      GLU  62  -5.616  10.829  -4.076
  496    HG2  GLU  62           HG2      GLU  62  -6.478  10.510  -1.850
  497    HG3  GLU  62           HG1      GLU  62  -6.248   8.900  -2.530
  498    H    GLU  63           HN       GLU  63  -4.966   9.518  -6.417
  499    HA   GLU  63           HA       GLU  63  -7.065   7.543  -6.233
  500    HB2  GLU  63           HB2      GLU  63  -6.849   9.592  -7.830
  501    HB3  GLU  63           HB1      GLU  63  -5.866   8.538  -8.838
  502    HG2  GLU  63           HG2      GLU  63  -8.719   7.957  -7.952
  503    HG3  GLU  63           HG1      GLU  63  -8.241   8.534  -9.546
  504    H    LYS  64           HN       LYS  64  -3.934   7.502  -8.009
  505    HA   LYS  64           HA       LYS  64  -4.247   4.729  -8.771
  506    HB2  LYS  64           HB2      LYS  64  -2.812   6.379  -9.995
  507    HB3  LYS  64           HB1      LYS  64  -1.685   6.339  -8.643
  508    HG2  LYS  64           HG2      LYS  64  -1.303   3.956  -8.963
  509    HG3  LYS  64           HG1      LYS  64  -2.529   3.902 -10.231
  510    HD2  LYS  64           HD2      LYS  64  -1.192   5.472 -11.591
  511    HD3  LYS  64           HD1      LYS  64   0.040   5.510 -10.329
  512    HE2  LYS  64           HE2      LYS  64  -0.826   3.082 -11.924
  513    HE3  LYS  64           HE1      LYS  64   0.719   3.923 -12.049
  514    HZ1  LYS  64           HZ1      LYS  64  -0.311   2.522  -9.642
  515    HZ2  LYS  64           HZ2      LYS  64   1.164   3.360  -9.736
  516    HZ3  LYS  64           HZ3      LYS  64   0.917   1.962 -10.669
  517    H    ALA  65           HN       ALA  65  -2.504   6.344  -6.093
  518    HA   ALA  65           HA       ALA  65  -1.084   4.101  -5.126
  519    HB1  ALA  65           HB1      ALA  65  -1.224   5.211  -2.894
  520    HB2  ALA  65           HB2      ALA  65  -2.398   6.342  -3.565
  521    HB3  ALA  65           HB3      ALA  65  -0.744   6.320  -4.178
  522    H    TRP  66           HN       TRP  66  -4.425   5.117  -4.358
  523    HA   TRP  66           HA       TRP  66  -4.980   2.988  -2.535
  524    HB2  TRP  66           HB2      TRP  66  -6.743   4.687  -4.328
  525    HB3  TRP  66           HB1      TRP  66  -7.431   3.448  -3.282
  526    HD1  TRP  66           HD1      TRP  66  -4.426   5.229  -1.857
  527    HE1  TRP  66           HE1      TRP  66  -5.190   6.839   0.005
  528    HE3  TRP  66           HE3      TRP  66  -9.475   5.082  -2.578
  529    HZ2  TRP  66           HZ2      TRP  66  -7.611   7.929   1.048
  530    HZ3  TRP  66           HZ3      TRP  66 -10.997   6.429  -1.123
  531    HH2  TRP  66           HH2      TRP  66 -10.063   7.844   0.678
  532    H    ALA  67           HN       ALA  67  -5.302   3.213  -6.073
  533    HA   ALA  67           HA       ALA  67  -6.622   0.742  -6.514
  534    HB1  ALA  67           HB1      ALA  67  -4.508   2.037  -8.264
  535    HB2  ALA  67           HB2      ALA  67  -6.220   2.461  -8.274
  536    HB3  ALA  67           HB3      ALA  67  -5.707   0.853  -8.784
  537    H    MET  68           HN       MET  68  -3.186   1.472  -6.042
  538    HA   MET  68           HA       MET  68  -2.322  -1.277  -6.544
  539    HB2  MET  68           HB2      MET  68  -0.983   1.193  -5.401
  540    HB3  MET  68           HB1      MET  68  -0.160  -0.366  -5.415
  541    HG2  MET  68           HG2      MET  68  -1.348   0.879  -7.913
  542    HG3  MET  68           HG1      MET  68   0.323   1.135  -7.416
  543    HE1  MET  68           HE1      MET  68   2.079  -2.123  -7.664
  544    HE2  MET  68           HE2      MET  68   1.835  -0.656  -6.719
  545    HE3  MET  68           HE3      MET  68   2.244  -0.537  -8.428
  546    H    ALA  69           HN       ALA  69  -3.251   0.632  -3.730
  547    HA   ALA  69           HA       ALA  69  -2.281  -1.219  -1.747
  548    HB1  ALA  69           HB1      ALA  69  -4.589   0.737  -1.503
  549    HB2  ALA  69           HB2      ALA  69  -2.894   1.180  -1.304
  550    HB3  ALA  69           HB3      ALA  69  -3.648   0.049  -0.180
  551    H    VAL  70           HN       VAL  70  -5.468  -0.811  -3.311
  552    HA   VAL  70           HA       VAL  70  -6.677  -2.981  -1.766
  553    HB   VAL  70           HB       VAL  70  -7.994  -1.105  -2.715
  554   HG11  VAL  70          HG11      VAL  70  -7.555  -2.434  -5.412
  555   HG12  VAL  70          HG12      VAL  70  -6.654  -1.015  -4.878
  556   HG13  VAL  70          HG13      VAL  70  -8.402  -0.924  -5.082
  557   HG21  VAL  70          HG21      VAL  70  -9.867  -2.466  -3.464
  558   HG22  VAL  70          HG22      VAL  70  -9.008  -3.358  -2.207
  559   HG23  VAL  70          HG23      VAL  70  -8.787  -3.788  -3.904
  560    H    TRP  71           HN       TRP  71  -5.297  -2.723  -5.047
  561    HA   TRP  71           HA       TRP  71  -6.051  -5.373  -5.843
  562    HB2  TRP  71           HB2      TRP  71  -5.332  -3.613  -7.460
  563    HB3  TRP  71           HB1      TRP  71  -3.689  -3.726  -6.832
  564    HD1  TRP  71           HD1      TRP  71  -6.187  -5.519  -9.033
  565    HE1  TRP  71           HE1      TRP  71  -5.028  -7.516 -10.183
  566    HE3  TRP  71           HE3      TRP  71  -1.749  -5.528  -6.515
  567    HZ2  TRP  71           HZ2      TRP  71  -2.542  -8.930 -10.048
  568    HZ3  TRP  71           HZ3      TRP  71  -0.004  -7.203  -7.041
  569    HH2  TRP  71           HH2      TRP  71  -0.393  -8.905  -8.804
  570    H    ILE  72           HN       ILE  72  -3.310  -4.168  -3.939
  571    HA   ILE  72           HA       ILE  72  -1.812  -6.677  -4.180
  572    HB   ILE  72           HB       ILE  72  -1.561  -4.266  -2.345
  573   HG12  ILE  72          HG12      ILE  72   0.388  -5.484  -4.335
  574   HG13  ILE  72          HG11      ILE  72  -0.762  -4.226  -4.766
  575   HG21  ILE  72          HG21      ILE  72  -0.895  -6.065  -0.899
  576   HG22  ILE  72          HG22      ILE  72   0.600  -5.398  -1.544
  577   HG23  ILE  72          HG23      ILE  72  -0.051  -6.895  -2.205
  578   HD11  ILE  72          HD11      ILE  72   1.212  -3.869  -2.496
  579   HD12  ILE  72          HD12      ILE  72   0.287  -2.628  -3.341
  580   HD13  ILE  72          HD13      ILE  72   1.607  -3.454  -4.162
  581    H    PHE  73           HN       PHE  73  -4.149  -5.402  -1.732
  582    HA   PHE  73           HA       PHE  73  -3.821  -7.506   0.145
  583    HB2  PHE  73           HB2      PHE  73  -6.509  -6.280  -0.527
  584    HB3  PHE  73           HB1      PHE  73  -5.975  -6.924   1.018
  585    HD1  PHE  73           HD2      PHE  73  -3.102  -5.471   0.833
  586    HD2  PHE  73           HD1      PHE  73  -7.181  -4.155   0.398
  587    HE1  PHE  73           HE2      PHE  73  -2.452  -3.201   1.528
  588    HE2  PHE  73           HE1      PHE  73  -6.509  -1.881   1.103
  589    HZ   PHE  73           HZ       PHE  73  -4.146  -1.403   1.666
  590    H    ALA  74           HN       ALA  74  -6.010  -7.381  -2.699
  591    HA   ALA  74           HA       ALA  74  -7.171  -9.949  -2.295
  592    HB1  ALA  74           HB1      ALA  74  -6.560  -8.536  -4.916
  593    HB2  ALA  74           HB2      ALA  74  -8.022  -8.317  -3.953
  594    HB3  ALA  74           HB3      ALA  74  -7.690  -9.875  -4.713
  595    H    ALA  75           HN       ALA  75  -4.036  -9.006  -3.565
  596    HA   ALA  75           HA       ALA  75  -3.425 -11.507  -4.859
  597    HB1  ALA  75           HB1      ALA  75  -1.153 -10.699  -4.959
  598    HB2  ALA  75           HB2      ALA  75  -1.438  -9.563  -3.640
  599    HB3  ALA  75           HB3      ALA  75  -2.209  -9.307  -5.205
  600    H    ILE  76           HN       ILE  76  -2.628 -10.250  -1.598
  601    HA   ILE  76           HA       ILE  76  -1.437 -12.840  -0.834
  602    HB   ILE  76           HB       ILE  76  -1.270 -11.684   1.461
  603   HG12  ILE  76          HG12      ILE  76  -2.087  -9.254  -0.179
  604   HG13  ILE  76          HG11      ILE  76  -3.136 -10.058   0.984
  605   HG21  ILE  76          HG21      ILE  76   0.608 -10.265   0.734
  606   HG22  ILE  76          HG22      ILE  76   0.016 -10.308  -0.926
  607   HG23  ILE  76          HG23      ILE  76   0.601 -11.782  -0.160
  608   HD11  ILE  76          HD11      ILE  76  -1.305  -9.665   2.725
  609   HD12  ILE  76          HD12      ILE  76  -2.125  -8.218   2.148
  610   HD13  ILE  76          HD13      ILE  76  -0.523  -8.621   1.536
  611    H    ASN  77           HN       ASN  77  -4.400 -12.425  -1.524
  612    HA   ASN  77           HA       ASN  77  -6.455 -13.247  -0.805
  613    HB2  ASN  77           HB2      ASN  77  -4.580 -15.014   0.811
  614    HB3  ASN  77           HB1      ASN  77  -6.317 -15.285   0.695
  615   HD21  ASN  77          HD21      ASN  77  -4.194 -14.129  -1.950
  616   HD22  ASN  77          HD22      ASN  77  -4.436 -15.482  -2.946
  617    H    ARG  78           HN       ARG  78  -6.724 -11.089   0.218
  618    HA   ARG  78           HA       ARG  78  -7.285 -11.389   3.137
  619    HB2  ARG  78           HB2      ARG  78  -5.706  -9.167   1.803
  620    HB3  ARG  78           HB1      ARG  78  -6.509  -8.918   3.351
  621    HG2  ARG  78           HG2      ARG  78  -4.704 -11.327   3.068
  622    HG3  ARG  78           HG1      ARG  78  -3.944  -9.748   3.215
  623    HD2  ARG  78           HD2      ARG  78  -4.527 -11.183   5.396
  624    HD3  ARG  78           HD1      ARG  78  -4.691  -9.427   5.405
  625    HE   ARG  78           HE       ARG  78  -7.183 -10.282   4.581
  626   HH11  ARG  78          HH21      ARG  78  -5.060 -11.000   7.208
  627   HH12  ARG  78          HH22      ARG  78  -6.341 -11.349   8.319
  628   HH21  ARG  78          HH11      ARG  78  -8.862 -10.735   6.021
  629   HH22  ARG  78          HH12      ARG  78  -8.492 -11.199   7.648
  630    H    ARG  79           HN       ARG  79  -8.962 -11.618   0.850
  631    HA   ARG  79           HA       ARG  79 -10.330  -9.392  -0.076
  632    HB2  ARG  79           HB2      ARG  79 -10.798 -11.783  -0.677
  633    HB3  ARG  79           HB1      ARG  79 -11.675 -11.947   0.842
  634    HG2  ARG  79           HG2      ARG  79 -13.230 -10.167   0.159
  635    HG3  ARG  79           HG1      ARG  79 -12.334  -9.949  -1.345
  636    HD2  ARG  79           HD2      ARG  79 -12.897 -12.190  -2.074
  637    HD3  ARG  79           HD1      ARG  79 -13.633 -12.560  -0.514
  638    HE   ARG  79           HE       ARG  79 -15.041 -10.340  -1.416
  639   HH11  ARG  79          HH21      ARG  79 -14.249 -13.473  -2.637
  640   HH12  ARG  79          HH22      ARG  79 -15.693 -13.611  -3.583
  641   HH21  ARG  79          HH11      ARG  79 -16.926 -10.510  -2.644
  642   HH22  ARG  79          HH12      ARG  79 -17.207 -11.936  -3.587
  643    H    ASP  80           HN       ASP  80 -10.692 -10.883   3.138
  644    HA   ASP  80           HA       ASP  80 -13.013  -9.459   3.957
  645    HB2  ASP  80           HB2      ASP  80 -10.624 -10.400   5.577
  646    HB3  ASP  80           HB1      ASP  80 -12.125  -9.805   6.288
  647    H    LEU  81           HN       LEU  81  -9.628  -8.503   3.806
  648    HA   LEU  81           HA       LEU  81  -9.932  -6.067   5.308
  649    HB2  LEU  81           HB2      LEU  81  -7.747  -7.349   4.697
  650    HB3  LEU  81           HB1      LEU  81  -7.833  -6.500   3.160
  651    HG   LEU  81           HG       LEU  81  -8.092  -4.332   4.674
  652   HD11  LEU  81          HD11      LEU  81  -6.759  -6.293   6.579
  653   HD12  LEU  81          HD12      LEU  81  -8.281  -5.448   6.846
  654   HD13  LEU  81          HD13      LEU  81  -6.773  -4.546   6.794
  655   HD21  LEU  81          HD21      LEU  81  -5.616  -4.105   4.742
  656   HD22  LEU  81          HD22      LEU  81  -6.174  -4.748   3.199
  657   HD23  LEU  81          HD23      LEU  81  -5.462  -5.827   4.397
  658    H    TYR  82           HN       TYR  82 -10.616  -6.919   1.967
  659    HA   TYR  82           HA       TYR  82 -10.631  -4.184   0.991
  660    HB2  TYR  82           HB2      TYR  82 -10.369  -5.802  -0.717
  661    HB3  TYR  82           HB1      TYR  82 -11.612  -6.844  -0.045
  662    HD1  TYR  82           HD2      TYR  82 -11.854  -3.156  -0.725
  663    HD2  TYR  82           HD1      TYR  82 -13.108  -7.103  -1.894
  664    HE1  TYR  82           HE2      TYR  82 -13.509  -2.175  -2.278
  665    HE2  TYR  82           HE1      TYR  82 -14.762  -6.110  -3.446
  666    HH   TYR  82           HH       TYR  82 -15.460  -4.220  -4.424
  667    H    GLU  83           HN       GLU  83 -13.040  -6.363   2.414
  668    HA   GLU  83           HA       GLU  83 -15.329  -4.735   1.850
  669    HB2  GLU  83           HB2      GLU  83 -14.811  -6.687   4.118
  670    HB3  GLU  83           HB1      GLU  83 -16.385  -5.982   3.754
  671    HG2  GLU  83           HG2      GLU  83 -14.757  -7.574   1.747
  672    HG3  GLU  83           HG1      GLU  83 -16.013  -8.280   2.763
  673    H    LYS  84           HN       LYS  84 -13.134  -4.850   4.668
  674    HA   LYS  84           HA       LYS  84 -14.517  -2.686   6.043
  675    HB2  LYS  84           HB2      LYS  84 -11.721  -3.780   6.457
  676    HB3  LYS  84           HB1      LYS  84 -12.607  -2.749   7.582
  677    HG2  LYS  84           HG2      LYS  84 -14.416  -4.543   7.627
  678    HG3  LYS  84           HG1      LYS  84 -13.298  -5.581   6.743
  679    HD2  LYS  84           HD2      LYS  84 -12.710  -4.290   9.428
  680    HD3  LYS  84           HD1      LYS  84 -13.220  -5.961   9.209
  681    HE2  LYS  84           HE2      LYS  84 -11.168  -6.194   7.640
  682    HE3  LYS  84           HE1      LYS  84 -10.616  -4.678   8.356
  683    HZ1  LYS  84           HZ1      LYS  84 -10.939  -7.312   9.592
  684    HZ2  LYS  84           HZ2      LYS  84 -11.185  -5.936  10.558
  685    HZ3  LYS  84           HZ3      LYS  84  -9.695  -6.175   9.778
  686    H    ALA  85           HN       ALA  85 -11.537  -2.926   4.095
  687    HA   ALA  85           HA       ALA  85 -10.621  -0.278   4.407
  688    HB1  ALA  85           HB1      ALA  85  -9.439  -0.593   2.286
  689    HB2  ALA  85           HB2      ALA  85 -10.480  -1.957   1.882
  690    HB3  ALA  85           HB3      ALA  85  -9.357  -2.076   3.236
  691    H    LYS  86           HN       LYS  86 -13.043  -1.554   2.129
  692    HA   LYS  86           HA       LYS  86 -13.389   0.925   0.713
  693    HB2  LYS  86           HB2      LYS  86 -14.178  -1.328  -0.128
  694    HB3  LYS  86           HB1      LYS  86 -15.477  -1.263   1.065
  695    HG2  LYS  86           HG2      LYS  86 -16.338   0.799   0.071
  696    HG3  LYS  86           HG1      LYS  86 -14.996   0.836  -1.073
  697    HD2  LYS  86           HD2      LYS  86 -15.747  -1.328  -2.013
  698    HD3  LYS  86           HD1      LYS  86 -17.104  -1.338  -0.887
  699    HE2  LYS  86           HE2      LYS  86 -17.923   0.783  -1.862
  700    HE3  LYS  86           HE1      LYS  86 -16.577   0.772  -3.002
  701    HZ1  LYS  86           HZ1      LYS  86 -18.196  -1.643  -2.878
  702    HZ2  LYS  86           HZ2      LYS  86 -17.496  -0.869  -4.219
  703    HZ3  LYS  86           HZ3      LYS  86 -18.942  -0.276  -3.552
  704    H    ARG  87           HN       ARG  87 -14.675  -0.256   3.770
  705    HA   ARG  87           HA       ARG  87 -16.755   1.839   3.871
  706    HB2  ARG  87           HB2      ARG  87 -17.089  -0.427   4.874
  707    HB3  ARG  87           HB1      ARG  87 -15.821  -0.061   6.044
  708    HG2  ARG  87           HG2      ARG  87 -17.096   1.793   6.945
  709    HG3  ARG  87           HG1      ARG  87 -18.311   1.633   5.677
  710    HD2  ARG  87           HD2      ARG  87 -17.671  -0.531   7.701
  711    HD3  ARG  87           HD1      ARG  87 -19.013   0.604   7.852
  712    HE   ARG  87           HE       ARG  87 -19.365  -0.519   5.336
  713   HH11  ARG  87          HH21      ARG  87 -18.974  -1.685   8.565
  714   HH12  ARG  87          HH22      ARG  87 -19.931  -3.106   8.305
  715   HH21  ARG  87          HH11      ARG  87 -20.613  -2.365   4.987
  716   HH22  ARG  87          HH12      ARG  87 -20.858  -3.490   6.281
  717    H    ASP  88           HN       ASP  88 -13.473   1.354   5.076
  718    HA   ASP  88           HA       ASP  88 -13.681   3.742   6.850
  719    HB2  ASP  88           HB2      ASP  88 -12.460   1.625   7.559
  720    HB3  ASP  88           HB1      ASP  88 -11.253   1.987   6.325
  721    H    GLU  89           HN       GLU  89 -12.851   3.068   3.605
  722    HA   GLU  89           HA       GLU  89 -10.724   5.007   3.298
  723    HB2  GLU  89           HB2      GLU  89 -12.534   3.471   1.461
  724    HB3  GLU  89           HB1      GLU  89 -11.666   4.843   0.780
  725    HG2  GLU  89           HG2      GLU  89 -10.175   2.742   2.385
  726    HG3  GLU  89           HG1      GLU  89 -10.540   2.468   0.684
  727    HA   PRO  90           HA       PRO  90 -13.743   8.410   3.745
  728    HB2  PRO  90           HB2      PRO  90 -11.817  10.407   2.861
  729    HB3  PRO  90           HB1      PRO  90 -12.381  10.109   4.512
  730    HG2  PRO  90           HG2      PRO  90  -9.782   9.443   3.386
  731    HG3  PRO  90           HG1      PRO  90 -10.342   9.177   5.044
  732    HD2  PRO  90           HD2      PRO  90  -9.944   7.177   2.977
  733    HD3  PRO  90           HD1      PRO  90 -10.525   6.917   4.637
  734    H    LYS  91           HN       LYS  91 -14.842   9.839   2.201
  735    HA   LYS  91           HA       LYS  91 -14.719   8.818  -0.553
  736    HB2  LYS  91           HB2      LYS  91 -16.457  10.844   0.883
  737    HB3  LYS  91           HB1      LYS  91 -16.593  10.591  -0.856
  738    HG2  LYS  91           HG2      LYS  91 -16.735   8.193   0.996
  739    HG3  LYS  91           HG1      LYS  91 -18.153   9.219   0.806
  740    HD2  LYS  91           HD2      LYS  91 -18.100   8.871  -1.633
  741    HD3  LYS  91           HD1      LYS  91 -16.670   7.857  -1.469
  742    HE2  LYS  91           HE2      LYS  91 -19.397   7.302  -0.267
  743    HE3  LYS  91           HE1      LYS  91 -18.662   6.447  -1.623
  744    HZ1  LYS  91           HZ1      LYS  91 -17.864   5.078  -0.076
  745    HZ2  LYS  91           HZ2      LYS  91 -18.193   6.156   1.196
  746    HZ3  LYS  91           HZ3      LYS  91 -16.760   6.310   0.297
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1  -9.557  18.083  12.316
    2    H2   MET   1           HT2      MET   1 -11.118  17.927  11.662
    3    H3   MET   1           HT3      MET   1 -10.257  19.380  11.478
    4    HA   MET   1           HA       MET   1 -10.294  17.998   9.444
    5    HB2  MET   1           HB2      MET   1  -7.844  18.177   9.049
    6    HB3  MET   1           HB1      MET   1  -8.503  19.632   9.795
    7    HG2  MET   1           HG2      MET   1  -7.800  18.720  12.033
    8    HG3  MET   1           HG1      MET   1  -6.995  17.399  11.187
    9    HE1  MET   1           HE1      MET   1  -4.698  17.740  11.992
   10    HE2  MET   1           HE2      MET   1  -5.310  18.959  13.108
   11    HE3  MET   1           HE3      MET   1  -3.872  19.297  12.149
   12    H    ALA   2           HN       ALA   2  -8.305  16.303   8.665
   13    HA   ALA   2           HA       ALA   2  -7.963  14.056  10.484
   14    HB1  ALA   2           HB1      ALA   2  -9.338  12.454   9.190
   15    HB2  ALA   2           HB2      ALA   2  -9.917  13.777   8.178
   16    HB3  ALA   2           HB3      ALA   2 -10.333  13.731   9.891
   17    H    SER   3           HN       SER   3  -5.789  14.070   9.861
   18    HA   SER   3           HA       SER   3  -4.940  14.232   7.100
   19    HB2  SER   3           HB2      SER   3  -3.548  13.369   9.657
   20    HB3  SER   3           HB1      SER   3  -2.719  13.379   8.100
   21    HG   SER   3           HG       SER   3  -3.484  15.457   9.733
   22    H    THR   4           HN       THR   4  -4.758  12.596   5.622
   23    HA   THR   4           HA       THR   4  -5.726   9.910   6.359
   24    HB   THR   4           HB       THR   4  -4.609  10.749   3.660
   25    HG1  THR   4           HG1      THR   4  -6.575  11.901   4.932
   26   HG21  THR   4          HG21      THR   4  -6.862   8.847   4.352
   27   HG22  THR   4          HG22      THR   4  -5.188   8.327   4.163
   28   HG23  THR   4          HG23      THR   4  -6.049   9.034   2.798
   29    H    ARG   5           HN       ARG   5  -2.665  11.491   5.698
   30    HA   ARG   5           HA       ARG   5  -1.024   9.290   5.077
   31    HB2  ARG   5           HB2      ARG   5  -0.323  11.648   6.852
   32    HB3  ARG   5           HB1      ARG   5   0.827  10.599   6.023
   33    HG2  ARG   5           HG2      ARG   5  -0.095  11.285   3.848
   34    HG3  ARG   5           HG1      ARG   5  -1.268  12.318   4.663
   35    HD2  ARG   5           HD2      ARG   5   0.579  13.627   5.655
   36    HD3  ARG   5           HD1      ARG   5   1.747  12.603   4.820
   37    HE   ARG   5           HE       ARG   5   0.110  13.546   2.786
   38   HH11  ARG   5          HH21      ARG   5   1.978  14.931   5.339
   39   HH12  ARG   5          HH22      ARG   5   2.321  16.391   4.471
   40   HH21  ARG   5          HH11      ARG   5   0.550  15.445   1.645
   41   HH22  ARG   5          HH12      ARG   5   1.513  16.681   2.383
   42    H    CYS   6           HN       CYS   6  -1.865  10.554   8.313
   43    HA   CYS   6           HA       CYS   6  -0.444   8.546   9.772
   44    HB2  CYS   6           HB2      CYS   6  -1.817   9.233  11.682
   45    HB3  CYS   6           HB1      CYS   6  -1.294  10.656  10.780
   46    HG   CYS   6           HG       CYS   6  -4.067   9.554   9.990
   47    H    LYS   7           HN       LYS   7  -3.759   8.672   8.498
   48    HA   LYS   7           HA       LYS   7  -4.717   6.308   9.762
   49    HB2  LYS   7           HB2      LYS   7  -5.464   7.548   7.095
   50    HB3  LYS   7           HB1      LYS   7  -6.353   6.225   7.850
   51    HG2  LYS   7           HG2      LYS   7  -6.669   7.682   9.879
   52    HG3  LYS   7           HG1      LYS   7  -5.934   9.010   8.981
   53    HD2  LYS   7           HD2      LYS   7  -7.690   8.889   7.290
   54    HD3  LYS   7           HD1      LYS   7  -8.394   7.478   8.084
   55    HE2  LYS   7           HE2      LYS   7  -9.565   9.639   8.648
   56    HE3  LYS   7           HE1      LYS   7  -8.935   8.787  10.059
   57    HZ1  LYS   7           HZ1      LYS   7  -6.992  10.209  10.018
   58    HZ2  LYS   7           HZ2      LYS   7  -8.406  11.144  10.129
   59    HZ3  LYS   7           HZ3      LYS   7  -7.578  11.021   8.650
   60    H    LEU   8           HN       LEU   8  -3.215   6.704   6.515
   61    HA   LEU   8           HA       LEU   8  -3.282   3.968   5.747
   62    HB2  LEU   8           HB2      LEU   8  -1.052   5.961   5.236
   63    HB3  LEU   8           HB1      LEU   8  -1.307   4.468   4.341
   64    HG   LEU   8           HG       LEU   8  -3.388   6.676   4.513
   65   HD11  LEU   8          HD11      LEU   8  -2.630   7.255   2.187
   66   HD12  LEU   8          HD12      LEU   8  -1.262   6.165   2.409
   67   HD13  LEU   8          HD13      LEU   8  -1.420   7.597   3.424
   68   HD21  LEU   8          HD21      LEU   8  -4.124   5.483   2.317
   69   HD22  LEU   8          HD22      LEU   8  -4.469   4.660   3.827
   70   HD23  LEU   8          HD23      LEU   8  -3.098   4.151   2.844
   71    H    ALA   9           HN       ALA   9  -1.092   5.597   7.990
   72    HA   ALA   9           HA       ALA   9   0.850   3.512   8.179
   73    HB1  ALA   9           HB1      ALA   9   1.106   5.807   9.164
   74    HB2  ALA   9           HB2      ALA   9   1.497   4.509  10.293
   75    HB3  ALA   9           HB3      ALA   9  -0.048   5.351  10.416
   76    H    ARG  10           HN       ARG  10  -2.111   4.094  10.103
   77    HA   ARG  10           HA       ARG  10  -1.821   1.836  11.803
   78    HB2  ARG  10           HB2      ARG  10  -4.171   3.491  10.882
   79    HB3  ARG  10           HB1      ARG  10  -4.485   2.022  11.800
   80    HG2  ARG  10           HG2      ARG  10  -4.378   3.911  13.330
   81    HG3  ARG  10           HG1      ARG  10  -2.982   2.874  13.610
   82    HD2  ARG  10           HD2      ARG  10  -1.549   4.366  12.336
   83    HD3  ARG  10           HD1      ARG  10  -2.936   5.337  11.843
   84    HE   ARG  10           HE       ARG  10  -3.018   5.417  14.616
   85   HH11  ARG  10          HH21      ARG  10  -0.678   6.089  12.164
   86   HH12  ARG  10          HH22      ARG  10   0.126   7.315  13.086
   87   HH21  ARG  10          HH11      ARG  10  -1.977   7.013  15.826
   88   HH22  ARG  10          HH12      ARG  10  -0.608   7.838  15.157
   89    H    TYR  11           HN       TYR  11  -3.106   2.058   8.506
   90    HA   TYR  11           HA       TYR  11  -4.217  -0.626   8.522
   91    HB2  TYR  11           HB2      TYR  11  -3.530   1.348   6.325
   92    HB3  TYR  11           HB1      TYR  11  -4.091  -0.278   5.940
   93    HD1  TYR  11           HD2      TYR  11  -6.306  -1.077   6.890
   94    HD2  TYR  11           HD1      TYR  11  -5.104   3.041   6.989
   95    HE1  TYR  11           HE2      TYR  11  -8.661  -0.401   7.267
   96    HE2  TYR  11           HE1      TYR  11  -7.459   3.721   7.369
   97    HH   TYR  11           HH       TYR  11  -9.516   2.911   8.037
   98    H    LEU  12           HN       LEU  12  -1.200   0.708   7.097
   99    HA   LEU  12           HA       LEU  12  -0.224  -1.910   6.332
  100    HB2  LEU  12           HB2      LEU  12   1.519   0.518   6.891
  101    HB3  LEU  12           HB1      LEU  12   1.852  -0.820   5.795
  102    HG   LEU  12           HG       LEU  12  -0.529   1.051   5.331
  103   HD11  LEU  12          HD11      LEU  12   1.521   2.416   5.404
  104   HD12  LEU  12          HD12      LEU  12   0.912   2.287   3.755
  105   HD13  LEU  12          HD13      LEU  12   2.300   1.324   4.260
  106   HD21  LEU  12          HD21      LEU  12  -0.637  -0.998   4.023
  107   HD22  LEU  12          HD22      LEU  12   1.060  -0.861   3.566
  108   HD23  LEU  12          HD23      LEU  12  -0.118   0.289   2.942
  109    H    GLU  13           HN       GLU  13  -0.136  -0.064   9.272
  110    HA   GLU  13           HA       GLU  13   1.993  -1.677  10.501
  111    HB2  GLU  13           HB2      GLU  13   1.511   0.760  11.059
  112    HB3  GLU  13           HB1      GLU  13   0.053   0.213  11.885
  113    HG2  GLU  13           HG2      GLU  13   2.817  -0.853  12.555
  114    HG3  GLU  13           HG1      GLU  13   2.119   0.551  13.354
  115    H    ASP  14           HN       ASP  14  -1.543  -1.667  10.451
  116    HA   ASP  14           HA       ASP  14  -1.889  -3.436  12.698
  117    HB2  ASP  14           HB2      ASP  14  -3.637  -2.783  10.303
  118    HB3  ASP  14           HB1      ASP  14  -4.144  -3.945  11.531
  119    H    LEU  15           HN       LEU  15  -0.312  -4.042   9.814
  120    HA   LEU  15           HA       LEU  15  -1.205  -6.896   9.623
  121    HB2  LEU  15           HB2      LEU  15   0.924  -5.476   7.990
  122    HB3  LEU  15           HB1      LEU  15   0.166  -7.026   7.638
  123    HG   LEU  15           HG       LEU  15  -1.135  -4.283   7.564
  124   HD11  LEU  15          HD11      LEU  15  -0.803  -6.413   5.427
  125   HD12  LEU  15          HD12      LEU  15   0.257  -5.017   5.606
  126   HD13  LEU  15          HD13      LEU  15  -1.444  -4.787   5.199
  127   HD21  LEU  15          HD21      LEU  15  -2.859  -5.681   8.450
  128   HD22  LEU  15          HD22      LEU  15  -2.372  -7.054   7.457
  129   HD23  LEU  15          HD23      LEU  15  -3.164  -5.665   6.715
  130    H    GLU  16           HN       GLU  16   0.455  -8.598   9.667
  131    HA   GLU  16           HA       GLU  16   2.107  -8.411  12.006
  132    HB2  GLU  16           HB2      GLU  16   2.063 -10.420   9.732
  133    HB3  GLU  16           HB1      GLU  16   3.035 -10.620  11.189
  134    HG2  GLU  16           HG2      GLU  16   0.969 -11.838  11.510
  135    HG3  GLU  16           HG1      GLU  16   0.918 -10.412  12.545
  136    H    ASP  17           HN       ASP  17   4.465  -8.512  12.090
  137    HA   ASP  17           HA       ASP  17   5.770  -6.583  10.478
  138    HB2  ASP  17           HB2      ASP  17   6.596  -7.357  12.695
  139    HB3  ASP  17           HB1      ASP  17   7.044  -8.899  11.965
  140    H    VAL  18           HN       VAL  18   5.867 -10.159  10.246
  141    HA   VAL  18           HA       VAL  18   7.611 -10.241   7.988
  142    HB   VAL  18           HB       VAL  18   7.027 -12.228   9.388
  143   HG11  VAL  18          HG11      VAL  18   4.429 -12.284   7.811
  144   HG12  VAL  18          HG12      VAL  18   4.541 -11.687   9.468
  145   HG13  VAL  18          HG13      VAL  18   4.921 -13.371   9.110
  146   HG21  VAL  18          HG21      VAL  18   6.993 -13.815   7.524
  147   HG22  VAL  18          HG22      VAL  18   8.005 -12.437   7.087
  148   HG23  VAL  18          HG23      VAL  18   6.369 -12.573   6.440
  149    H    ASP  19           HN       ASP  19   4.072  -9.911   8.225
  150    HA   ASP  19           HA       ASP  19   3.516 -10.166   5.435
  151    HB2  ASP  19           HB2      ASP  19   1.753 -10.161   7.183
  152    HB3  ASP  19           HB1      ASP  19   2.081  -8.459   7.496
  153    H    LEU  20           HN       LEU  20   4.798  -7.554   7.381
  154    HA   LEU  20           HA       LEU  20   4.414  -5.439   5.470
  155    HB2  LEU  20           HB2      LEU  20   5.241  -5.514   8.062
  156    HB3  LEU  20           HB1      LEU  20   6.817  -5.387   7.296
  157    HG   LEU  20           HG       LEU  20   4.489  -3.481   6.846
  158   HD11  LEU  20          HD11      LEU  20   5.834  -1.896   8.165
  159   HD12  LEU  20          HD12      LEU  20   7.063  -3.135   8.416
  160   HD13  LEU  20          HD13      LEU  20   5.458  -3.332   9.118
  161   HD21  LEU  20          HD21      LEU  20   7.349  -3.549   5.827
  162   HD22  LEU  20          HD22      LEU  20   6.372  -2.079   5.808
  163   HD23  LEU  20          HD23      LEU  20   5.864  -3.484   4.882
  164    H    LYS  21           HN       LYS  21   6.829  -7.932   5.944
  165    HA   LYS  21           HA       LYS  21   8.774  -6.911   4.066
  166    HB2  LYS  21           HB2      LYS  21   9.242  -8.579   5.886
  167    HB3  LYS  21           HB1      LYS  21   8.333  -9.775   4.965
  168    HG2  LYS  21           HG2      LYS  21   9.899  -9.495   3.067
  169    HG3  LYS  21           HG1      LYS  21  10.818  -8.319   4.011
  170    HD2  LYS  21           HD2      LYS  21  11.362  -9.994   5.679
  171    HD3  LYS  21           HD1      LYS  21  10.309 -11.175   4.898
  172    HE2  LYS  21           HE2      LYS  21  12.805  -9.948   3.693
  173    HE3  LYS  21           HE1      LYS  21  12.644 -11.599   4.291
  174    HZ1  LYS  21           HZ1      LYS  21  12.191 -11.951   2.114
  175    HZ2  LYS  21           HZ2      LYS  21  11.579 -10.387   1.857
  176    HZ3  LYS  21           HZ3      LYS  21  10.621 -11.563   2.623
  177    H    LYS  22           HN       LYS  22   5.988  -9.095   3.783
  178    HA   LYS  22           HA       LYS  22   6.623  -9.896   1.051
  179    HB2  LYS  22           HB2      LYS  22   4.118 -10.128   2.754
  180    HB3  LYS  22           HB1      LYS  22   4.177 -10.692   1.084
  181    HG2  LYS  22           HG2      LYS  22   6.058 -12.180   1.643
  182    HG3  LYS  22           HG1      LYS  22   6.024 -11.609   3.312
  183    HD2  LYS  22           HD2      LYS  22   3.753 -12.471   3.595
  184    HD3  LYS  22           HD1      LYS  22   3.712 -12.976   1.905
  185    HE2  LYS  22           HE2      LYS  22   5.611 -14.505   2.320
  186    HE3  LYS  22           HE1      LYS  22   5.629 -14.014   4.014
  187    HZ1  LYS  22           HZ1      LYS  22   4.290 -15.810   4.188
  188    HZ2  LYS  22           HZ2      LYS  22   3.733 -15.708   2.586
  189    HZ3  LYS  22           HZ3      LYS  22   3.093 -14.681   3.779
  190    H    PHE  23           HN       PHE  23   4.842  -7.221   2.503
  191    HA   PHE  23           HA       PHE  23   3.433  -6.468   0.079
  192    HB2  PHE  23           HB2      PHE  23   2.896  -5.726   2.472
  193    HB3  PHE  23           HB1      PHE  23   4.246  -4.605   2.337
  194    HD1  PHE  23           HD1      PHE  23   4.250  -2.885   0.465
  195    HD2  PHE  23           HD2      PHE  23   0.775  -5.202   1.481
  196    HE1  PHE  23           HE1      PHE  23   2.809  -1.257  -0.729
  197    HE2  PHE  23           HE2      PHE  23  -0.657  -3.576   0.278
  198    HZ   PHE  23           HZ       PHE  23   0.358  -1.603  -0.824
  199    H    LYS  24           HN       LYS  24   6.546  -5.450   1.515
  200    HA   LYS  24           HA       LYS  24   7.124  -3.470  -0.489
  201    HB2  LYS  24           HB2      LYS  24   8.250  -3.550   1.723
  202    HB3  LYS  24           HB1      LYS  24   9.033  -5.058   1.249
  203    HG2  LYS  24           HG2      LYS  24  10.260  -3.969  -0.513
  204    HG3  LYS  24           HG1      LYS  24   9.323  -2.489  -0.333
  205    HD2  LYS  24           HD2      LYS  24  11.499  -2.200   0.734
  206    HD3  LYS  24           HD1      LYS  24  10.241  -2.213   1.966
  207    HE2  LYS  24           HE2      LYS  24  10.811  -4.409   2.683
  208    HE3  LYS  24           HE1      LYS  24  11.727  -4.746   1.213
  209    HZ1  LYS  24           HZ1      LYS  24  12.999  -4.160   3.332
  210    HZ2  LYS  24           HZ2      LYS  24  12.520  -2.559   3.026
  211    HZ3  LYS  24           HZ3      LYS  24  13.463  -3.399   1.888
  212    H    MET  25           HN       MET  25   7.975  -6.909  -0.154
  213    HA   MET  25           HA       MET  25   9.643  -7.008  -2.496
  214    HB2  MET  25           HB2      MET  25   8.255  -9.025  -0.750
  215    HB3  MET  25           HB1      MET  25   8.777  -9.582  -2.338
  216    HG2  MET  25           HG2      MET  25  11.069  -9.026  -1.870
  217    HG3  MET  25           HG1      MET  25  10.632  -8.169  -0.394
  218    HE1  MET  25           HE1      MET  25  12.638 -10.720  -1.212
  219    HE2  MET  25           HE2      MET  25  12.625 -11.622   0.301
  220    HE3  MET  25           HE3      MET  25  12.780  -9.868   0.331
  221    H    HIS  26           HN       HIS  26   6.166  -7.282  -1.989
  222    HA   HIS  26           HA       HIS  26   5.466  -8.305  -4.577
  223    HB2  HIS  26           HB2      HIS  26   3.924  -7.984  -2.531
  224    HB3  HIS  26           HB1      HIS  26   3.821  -6.285  -2.991
  225    HD1  HIS  26           HD1      HIS  26   3.931  -7.117  -6.166
  226    HD2  HIS  26           HD2      HIS  26   1.179  -8.379  -3.301
  227    HE1  HIS  26           HE1      HIS  26   1.860  -7.837  -7.430
  228    H    LEU  27           HN       LEU  27   6.098  -4.976  -3.453
  229    HA   LEU  27           HA       LEU  27   5.324  -3.708  -5.945
  230    HB2  LEU  27           HB2      LEU  27   7.394  -2.735  -3.947
  231    HB3  LEU  27           HB1      LEU  27   6.522  -1.754  -5.119
  232    HG   LEU  27           HG       LEU  27   5.166  -3.308  -2.891
  233   HD11  LEU  27          HD11      LEU  27   4.972  -1.141  -1.733
  234   HD12  LEU  27          HD12      LEU  27   5.901  -0.367  -3.015
  235   HD13  LEU  27          HD13      LEU  27   6.665  -1.570  -1.976
  236   HD21  LEU  27          HD21      LEU  27   3.574  -2.848  -4.624
  237   HD22  LEU  27          HD22      LEU  27   4.219  -1.230  -4.896
  238   HD23  LEU  27          HD23      LEU  27   3.318  -1.586  -3.424
  239    H    GLU  28           HN       GLU  28   8.385  -5.060  -4.758
  240    HA   GLU  28           HA       GLU  28   9.943  -4.136  -7.018
  241    HB2  GLU  28           HB2      GLU  28  10.479  -6.456  -5.136
  242    HB3  GLU  28           HB1      GLU  28  11.659  -5.689  -6.197
  243    HG2  GLU  28           HG2      GLU  28  10.141  -4.231  -4.012
  244    HG3  GLU  28           HG1      GLU  28  11.769  -4.879  -3.820
  245    H    ASP  29           HN       ASP  29   7.990  -6.994  -6.373
  246    HA   ASP  29           HA       ASP  29   8.981  -8.462  -8.711
  247    HB2  ASP  29           HB2      ASP  29   8.092  -9.591  -6.663
  248    HB3  ASP  29           HB1      ASP  29   6.494  -8.949  -7.046
  249    H    TYR  30           HN       TYR  30   7.883  -5.752  -9.203
  250    HA   TYR  30           HA       TYR  30   5.267  -6.108 -10.420
  251    HB2  TYR  30           HB2      TYR  30   6.902  -3.889  -9.710
  252    HB3  TYR  30           HB1      TYR  30   6.741  -3.766 -11.454
  253    HD1  TYR  30           HD1      TYR  30   4.825  -4.085  -8.271
  254    HD2  TYR  30           HD2      TYR  30   4.675  -3.006 -12.429
  255    HE1  TYR  30           HE1      TYR  30   2.551  -3.154  -7.949
  256    HE2  TYR  30           HE2      TYR  30   2.400  -2.074 -12.103
  257    HH   TYR  30           HH       TYR  30   0.752  -2.311  -8.957
  258    HA   PRO  31           HA       PRO  31   6.831  -7.914 -14.205
  259    HB2  PRO  31           HB2      PRO  31   4.873  -6.820 -16.004
  260    HB3  PRO  31           HB1      PRO  31   4.802  -8.396 -15.202
  261    HG2  PRO  31           HG2      PRO  31   3.296  -5.928 -14.556
  262    HG3  PRO  31           HG1      PRO  31   2.975  -7.592 -14.037
  263    HD2  PRO  31           HD2      PRO  31   4.049  -5.531 -12.400
  264    HD3  PRO  31           HD1      PRO  31   4.056  -7.268 -12.024
  265    HA   PRO  32           HA       PRO  32   9.248  -4.757 -16.170
  266    HB2  PRO  32           HB2      PRO  32   8.965  -5.477 -18.938
  267    HB3  PRO  32           HB1      PRO  32  10.241  -6.012 -17.835
  268    HG2  PRO  32           HG2      PRO  32   7.910  -7.540 -18.832
  269    HG3  PRO  32           HG1      PRO  32   9.374  -8.145 -18.038
  270    HD2  PRO  32           HD2      PRO  32   6.795  -7.964 -16.842
  271    HD3  PRO  32           HD1      PRO  32   8.325  -8.234 -15.982
  272    H    GLN  33           HN       GLN  33   8.735  -2.651 -16.673
  273    HA   GLN  33           HA       GLN  33   6.031  -2.066 -17.854
  274    HB2  GLN  33           HB2      GLN  33   7.869  -0.252 -16.258
  275    HB3  GLN  33           HB1      GLN  33   6.223   0.112 -16.776
  276    HG2  GLN  33           HG2      GLN  33   6.963  -2.192 -14.945
  277    HG3  GLN  33           HG1      GLN  33   6.359  -0.633 -14.388
  278   HE21  GLN  33          HE21      GLN  33   4.415  -0.190 -16.487
  279   HE22  GLN  33          HE22      GLN  33   3.178  -1.337 -16.298
  280    H    LYS  34           HN       LYS  34   9.491  -1.337 -18.118
  281    HA   LYS  34           HA       LYS  34  10.702  -0.280 -19.819
  282    HB2  LYS  34           HB2      LYS  34   9.535  -2.203 -21.062
  283    HB3  LYS  34           HB1      LYS  34   8.370  -1.008 -21.624
  284    HG2  LYS  34           HG2      LYS  34  10.221   0.315 -22.614
  285    HG3  LYS  34           HG1      LYS  34  11.371  -0.905 -22.068
  286    HD2  LYS  34           HD2      LYS  34  10.136  -2.609 -23.416
  287    HD3  LYS  34           HD1      LYS  34   9.102  -1.321 -24.034
  288    HE2  LYS  34           HE2      LYS  34  12.108  -1.522 -24.370
  289    HE3  LYS  34           HE1      LYS  34  10.897  -1.747 -25.633
  290    HZ1  LYS  34           HZ1      LYS  34  11.645   0.448 -25.852
  291    HZ2  LYS  34           HZ2      LYS  34  11.583   0.738 -24.179
  292    HZ3  LYS  34           HZ3      LYS  34  10.145   0.579 -25.070
  293    H    GLY  35           HN       GLY  35   9.554   1.573 -18.324
  294    HA2  GLY  35           HA2      GLY  35   9.323   3.883 -19.867
  295    HA3  GLY  35           HA1      GLY  35   7.667   3.291 -19.700
  296    H    CYS  36           HN       CYS  36   7.087   2.676 -17.343
  297    HA   CYS  36           HA       CYS  36   7.322   4.986 -15.693
  298    HB2  CYS  36           HB2      CYS  36   5.502   3.334 -15.440
  299    HB3  CYS  36           HB1      CYS  36   6.668   2.134 -14.885
  300    HG   CYS  36           HG       CYS  36   7.103   3.607 -12.763
  301    H    ILE  37           HN       ILE  37   8.585   5.311 -13.763
  302    HA   ILE  37           HA       ILE  37  11.249   4.123 -13.914
  303    HB   ILE  37           HB       ILE  37  10.965   6.503 -13.439
  304   HG12  ILE  37          HG12      ILE  37  12.075   5.040 -11.020
  305   HG13  ILE  37          HG11      ILE  37  12.935   5.231 -12.550
  306   HG21  ILE  37          HG21      ILE  37   9.864   7.362 -11.527
  307   HG22  ILE  37          HG22      ILE  37   9.872   5.812 -10.696
  308   HG23  ILE  37          HG23      ILE  37   8.787   6.074 -12.061
  309   HD11  ILE  37          HD11      ILE  37  11.981   7.471 -10.728
  310   HD12  ILE  37          HD12      ILE  37  12.709   7.720 -12.316
  311   HD13  ILE  37          HD13      ILE  37  13.657   6.996 -11.014
  312    HA   PRO  38           HA       PRO  38   9.846   0.975 -10.930
  313    HB2  PRO  38           HB2      PRO  38  12.426  -0.142 -10.440
  314    HB3  PRO  38           HB1      PRO  38  11.250  -0.719 -11.630
  315    HG2  PRO  38           HG2      PRO  38  13.754   0.779 -12.102
  316    HG3  PRO  38           HG1      PRO  38  12.753  -0.103 -13.269
  317    HD2  PRO  38           HD2      PRO  38  12.910   2.743 -12.980
  318    HD3  PRO  38           HD1      PRO  38  11.744   1.843 -13.979
  319    H    LEU  39           HN       LEU  39   9.872   0.882  -8.634
  320    HA   LEU  39           HA       LEU  39  10.893   3.204  -7.272
  321    HB2  LEU  39           HB2      LEU  39   9.574   0.637  -6.391
  322    HB3  LEU  39           HB1      LEU  39  10.145   1.792  -5.196
  323    HG   LEU  39           HG       LEU  39   7.698   2.011  -5.823
  324   HD11  LEU  39          HD11      LEU  39   9.133   4.562  -6.586
  325   HD12  LEU  39          HD12      LEU  39   9.219   3.937  -4.940
  326   HD13  LEU  39          HD13      LEU  39   7.661   4.346  -5.645
  327   HD21  LEU  39          HD21      LEU  39   8.740   3.188  -8.414
  328   HD22  LEU  39          HD22      LEU  39   7.063   2.905  -7.954
  329   HD23  LEU  39          HD23      LEU  39   8.125   1.538  -8.287
  330    HA   PRO  40           HA       PRO  40  14.994   1.237  -6.846
  331    HB2  PRO  40           HB2      PRO  40  15.767   3.201  -4.801
  332    HB3  PRO  40           HB1      PRO  40  16.391   3.039  -6.449
  333    HG2  PRO  40           HG2      PRO  40  14.628   5.093  -5.476
  334    HG3  PRO  40           HG1      PRO  40  15.136   4.837  -7.154
  335    HD2  PRO  40           HD2      PRO  40  12.506   4.316  -5.984
  336    HD3  PRO  40           HD1      PRO  40  12.998   4.148  -7.686
  337    H    ARG  41           HN       ARG  41  15.504  -0.439  -5.480
  338    HA   ARG  41           HA       ARG  41  13.784  -1.102  -3.273
  339    HB2  ARG  41           HB2      ARG  41  15.136  -2.748  -4.651
  340    HB3  ARG  41           HB1      ARG  41  16.578  -2.182  -3.806
  341    HG2  ARG  41           HG2      ARG  41  15.603  -2.842  -1.651
  342    HG3  ARG  41           HG1      ARG  41  14.126  -3.364  -2.465
  343    HD2  ARG  41           HD2      ARG  41  15.457  -5.011  -3.768
  344    HD3  ARG  41           HD1      ARG  41  16.898  -4.525  -2.877
  345    HE   ARG  41           HE       ARG  41  15.079  -5.206  -0.891
  346   HH11  ARG  41          HH21      ARG  41  16.389  -6.714  -3.710
  347   HH12  ARG  41          HH22      ARG  41  16.275  -8.316  -3.064
  348   HH21  ARG  41          HH11      ARG  41  14.926  -7.290  -0.040
  349   HH22  ARG  41          HH12      ARG  41  15.448  -8.642  -0.988
  350    H    GLY  42           HN       GLY  42  17.070   0.270  -3.423
  351    HA2  GLY  42           HA2      GLY  42  17.540   0.309  -0.591
  352    HA3  GLY  42           HA1      GLY  42  18.326   1.400  -1.735
  353    H    GLN  43           HN       GLN  43  15.829   2.607  -2.705
  354    HA   GLN  43           HA       GLN  43  15.507   4.607  -0.610
  355    HB2  GLN  43           HB2      GLN  43  15.437   5.035  -3.136
  356    HB3  GLN  43           HB1      GLN  43  13.840   4.291  -3.135
  357    HG2  GLN  43           HG2      GLN  43  13.491   6.661  -2.944
  358    HG3  GLN  43           HG1      GLN  43  13.167   5.980  -1.352
  359   HE21  GLN  43          HE21      GLN  43  13.911   7.558   0.099
  360   HE22  GLN  43          HE22      GLN  43  15.455   8.263   0.043
  361    H    THR  44           HN       THR  44  13.495   1.980  -1.919
  362    HA   THR  44           HA       THR  44  11.155   2.666  -0.374
  363    HB   THR  44           HB       THR  44  11.942  -0.014  -1.555
  364    HG1  THR  44           HG1      THR  44  11.887   1.697  -3.070
  365   HG21  THR  44          HG21      THR  44  10.104  -0.247   0.019
  366   HG22  THR  44          HG22      THR  44   9.461  -0.354  -1.618
  367   HG23  THR  44          HG23      THR  44   9.270   1.135  -0.694
  368    H    GLU  45           HN       GLU  45  13.744   0.236   0.140
  369    HA   GLU  45           HA       GLU  45  12.627  -0.754   2.598
  370    HB2  GLU  45           HB2      GLU  45  14.782  -1.848   2.927
  371    HB3  GLU  45           HB1      GLU  45  14.373  -1.933   1.217
  372    HG2  GLU  45           HG2      GLU  45  16.622  -1.245   1.133
  373    HG3  GLU  45           HG1      GLU  45  15.768   0.288   1.011
  374    H    LYS  46           HN       LYS  46  14.998   1.847   1.905
  375    HA   LYS  46           HA       LYS  46  15.511   2.402   4.703
  376    HB2  LYS  46           HB2      LYS  46  17.034   3.040   2.802
  377    HB3  LYS  46           HB1      LYS  46  15.854   4.262   2.329
  378    HG2  LYS  46           HG2      LYS  46  16.097   5.407   4.454
  379    HG3  LYS  46           HG1      LYS  46  17.133   4.122   5.076
  380    HD2  LYS  46           HD2      LYS  46  18.784   4.626   3.281
  381    HD3  LYS  46           HD1      LYS  46  17.767   5.970   2.758
  382    HE2  LYS  46           HE2      LYS  46  19.511   6.831   4.224
  383    HE3  LYS  46           HE1      LYS  46  17.959   6.946   5.054
  384    HZ1  LYS  46           HZ1      LYS  46  18.777   5.698   6.668
  385    HZ2  LYS  46           HZ2      LYS  46  20.262   5.562   5.853
  386    HZ3  LYS  46           HZ3      LYS  46  19.031   4.424   5.578
  387    H    ALA  47           HN       ALA  47  12.905   3.124   2.581
  388    HA   ALA  47           HA       ALA  47  12.037   5.604   3.756
  389    HB1  ALA  47           HB1      ALA  47  11.239   4.729   1.555
  390    HB2  ALA  47           HB2      ALA  47   9.915   5.161   2.635
  391    HB3  ALA  47           HB3      ALA  47  10.354   3.470   2.413
  392    H    ASP  48           HN       ASP  48  10.790   5.976   5.562
  393    HA   ASP  48           HA       ASP  48  10.469   3.777   7.491
  394    HB2  ASP  48           HB2      ASP  48  11.121   6.111   8.147
  395    HB3  ASP  48           HB1      ASP  48   9.510   6.652   7.678
  396    H    HIS  49           HN       HIS  49   8.192   3.904   8.726
  397    HA   HIS  49           HA       HIS  49   6.240   2.856   6.920
  398    HB2  HIS  49           HB2      HIS  49   5.939   3.878   9.757
  399    HB3  HIS  49           HB1      HIS  49   4.700   2.977   8.886
  400    HD1  HIS  49           HD1      HIS  49   8.395   2.211   8.681
  401    HD2  HIS  49           HD2      HIS  49   4.940   0.582  10.350
  402    HE1  HIS  49           HE1      HIS  49   9.026  -0.090   9.530
  403    H    VAL  50           HN       VAL  50   6.367   6.024   8.610
  404    HA   VAL  50           HA       VAL  50   3.965   7.019   7.320
  405    HB   VAL  50           HB       VAL  50   6.325   8.536   8.523
  406   HG11  VAL  50          HG11      VAL  50   5.102  10.046   7.075
  407   HG12  VAL  50          HG12      VAL  50   4.631  10.407   8.733
  408   HG13  VAL  50          HG13      VAL  50   3.555   9.473   7.697
  409   HG21  VAL  50          HG21      VAL  50   5.217   7.125  10.184
  410   HG22  VAL  50          HG22      VAL  50   3.634   7.722   9.687
  411   HG23  VAL  50          HG23      VAL  50   4.779   8.805  10.475
  412    H    ASP  51           HN       ASP  51   7.402   7.062   6.479
  413    HA   ASP  51           HA       ASP  51   7.108   8.878   4.245
  414    HB2  ASP  51           HB2      ASP  51   9.290   8.473   5.332
  415    HB3  ASP  51           HB1      ASP  51   9.247   6.795   4.799
  416    H    LEU  52           HN       LEU  52   7.032   5.316   4.542
  417    HA   LEU  52           HA       LEU  52   6.999   4.703   1.787
  418    HB2  LEU  52           HB2      LEU  52   5.787   3.355   4.197
  419    HB3  LEU  52           HB1      LEU  52   5.483   2.695   2.596
  420    HG   LEU  52           HG       LEU  52   8.297   3.244   3.603
  421   HD11  LEU  52          HD11      LEU  52   7.369   1.683   5.188
  422   HD12  LEU  52          HD12      LEU  52   8.374   0.754   4.080
  423   HD13  LEU  52          HD13      LEU  52   6.619   0.736   3.905
  424   HD21  LEU  52          HD21      LEU  52   8.752   1.334   1.894
  425   HD22  LEU  52          HD22      LEU  52   8.333   2.903   1.231
  426   HD23  LEU  52          HD23      LEU  52   7.117   1.631   1.310
  427    H    ALA  53           HN       ALA  53   4.232   5.465   3.927
  428    HA   ALA  53           HA       ALA  53   2.242   5.267   1.862
  429    HB1  ALA  53           HB1      ALA  53   2.290   6.888   4.428
  430    HB2  ALA  53           HB2      ALA  53   1.594   5.283   4.209
  431    HB3  ALA  53           HB3      ALA  53   0.863   6.676   3.413
  432    H    THR  54           HN       THR  54   4.479   7.812   2.785
  433    HA   THR  54           HA       THR  54   3.136   9.942   1.339
  434    HB   THR  54           HB       THR  54   6.053   9.687   2.155
  435    HG1  THR  54           HG1      THR  54   3.782  10.056   3.544
  436   HG21  THR  54          HG21      THR  54   5.815  11.434   0.504
  437   HG22  THR  54          HG22      THR  54   5.933  12.207   2.084
  438   HG23  THR  54          HG23      THR  54   4.364  12.054   1.295
  439    H    LEU  55           HN       LEU  55   5.551   7.495   0.459
  440    HA   LEU  55           HA       LEU  55   6.237   8.715  -2.077
  441    HB2  LEU  55           HB2      LEU  55   6.513   5.805  -1.249
  442    HB3  LEU  55           HB1      LEU  55   7.244   6.539  -2.664
  443    HG   LEU  55           HG       LEU  55   7.826   7.418   0.189
  444   HD11  LEU  55          HD11      LEU  55   9.996   6.247  -0.152
  445   HD12  LEU  55          HD12      LEU  55   9.390   5.619  -1.684
  446   HD13  LEU  55          HD13      LEU  55   8.623   5.139  -0.171
  447   HD21  LEU  55          HD21      LEU  55   9.886   8.414  -1.055
  448   HD22  LEU  55          HD22      LEU  55   8.352   9.248  -1.239
  449   HD23  LEU  55          HD23      LEU  55   8.938   8.197  -2.526
  450    H    MET  56           HN       MET  56   3.814   6.416  -0.972
  451    HA   MET  56           HA       MET  56   2.937   5.623  -3.611
  452    HB2  MET  56           HB2      MET  56   1.551   5.602  -0.911
  453    HB3  MET  56           HB1      MET  56   0.814   4.948  -2.373
  454    HG2  MET  56           HG2      MET  56   2.694   3.378  -2.641
  455    HG3  MET  56           HG1      MET  56   3.475   4.047  -1.210
  456    HE1  MET  56           HE1      MET  56   1.225   1.476  -2.644
  457    HE2  MET  56           HE2      MET  56  -0.025   2.697  -2.425
  458    HE3  MET  56           HE3      MET  56  -0.085   1.209  -1.485
  459    H    ILE  57           HN       ILE  57   1.918   8.216  -1.379
  460    HA   ILE  57           HA       ILE  57  -0.214   9.097  -3.192
  461    HB   ILE  57           HB       ILE  57   1.027  10.615  -0.867
  462   HG12  ILE  57          HG12      ILE  57  -1.476   8.892  -0.892
  463   HG13  ILE  57          HG11      ILE  57   0.079   8.328  -0.289
  464   HG21  ILE  57          HG21      ILE  57  -0.268  12.052  -2.359
  465   HG22  ILE  57          HG22      ILE  57  -1.187  11.779  -0.884
  466   HG23  ILE  57          HG23      ILE  57  -1.602  10.902  -2.354
  467   HD11  ILE  57          HD11      ILE  57   0.114  10.184   1.348
  468   HD12  ILE  57          HD12      ILE  57  -1.305   9.158   1.564
  469   HD13  ILE  57          HD13      ILE  57  -1.461  10.720   0.761
  470    H    ASP  58           HN       ASP  58   3.161  10.047  -2.590
  471    HA   ASP  58           HA       ASP  58   2.983  12.424  -4.275
  472    HB2  ASP  58           HB2      ASP  58   4.644  12.061  -2.367
  473    HB3  ASP  58           HB1      ASP  58   5.505  10.955  -3.436
  474    H    PHE  59           HN       PHE  59   4.603   9.224  -4.766
  475    HA   PHE  59           HA       PHE  59   5.221   9.951  -7.548
  476    HB2  PHE  59           HB2      PHE  59   5.630   7.462  -5.878
  477    HB3  PHE  59           HB1      PHE  59   6.003   7.471  -7.601
  478    HD1  PHE  59           HD1      PHE  59   6.764   9.124  -4.354
  479    HD2  PHE  59           HD2      PHE  59   8.001   8.534  -8.421
  480    HE1  PHE  59           HE1      PHE  59   8.929  10.222  -3.852
  481    HE2  PHE  59           HE2      PHE  59  10.167   9.632  -7.921
  482    HZ   PHE  59           HZ       PHE  59  10.631  10.476  -5.638
  483    H    ASN  60           HN       ASN  60   2.855   7.617  -6.078
  484    HA   ASN  60           HA       ASN  60   1.897   6.971  -8.832
  485    HB2  ASN  60           HB2      ASN  60   1.074   5.913  -6.107
  486    HB3  ASN  60           HB1      ASN  60   0.415   5.345  -7.637
  487   HD21  ASN  60          HD21      ASN  60   2.454   4.255  -5.417
  488   HD22  ASN  60          HD22      ASN  60   3.659   3.544  -6.378
  489    H    GLY  61           HN       GLY  61   0.895   8.831  -6.021
  490    HA2  GLY  61           HA2      GLY  61  -0.673  10.667  -6.189
  491    HA3  GLY  61           HA1      GLY  61  -1.397   9.916  -7.607
  492    H    GLU  62           HN       GLU  62  -3.062  10.762  -5.610
  493    HA   GLU  62           HA       GLU  62  -3.635   8.745  -3.625
  494    HB2  GLU  62           HB2      GLU  62  -4.322  11.131  -3.434
  495    HB3  GLU  62           HB1      GLU  62  -5.460  10.885  -4.760
  496    HG2  GLU  62           HG2      GLU  62  -6.713   9.259  -3.475
  497    HG3  GLU  62           HG1      GLU  62  -5.501   9.265  -2.193
  498    H    GLU  63           HN       GLU  63  -4.702   9.275  -6.943
  499    HA   GLU  63           HA       GLU  63  -6.945   7.446  -6.818
  500    HB2  GLU  63           HB2      GLU  63  -5.380   8.751  -9.049
  501    HB3  GLU  63           HB1      GLU  63  -6.555   7.495  -9.436
  502    HG2  GLU  63           HG2      GLU  63  -7.241   9.937  -7.763
  503    HG3  GLU  63           HG1      GLU  63  -7.453   9.876  -9.511
  504    H    LYS  64           HN       LYS  64  -3.652   7.044  -8.224
  505    HA   LYS  64           HA       LYS  64  -4.105   4.215  -8.731
  506    HB2  LYS  64           HB2      LYS  64  -1.625   5.947  -8.750
  507    HB3  LYS  64           HB1      LYS  64  -1.551   4.220  -9.073
  508    HG2  LYS  64           HG2      LYS  64  -3.124   4.486 -10.946
  509    HG3  LYS  64           HG1      LYS  64  -3.237   6.215 -10.622
  510    HD2  LYS  64           HD2      LYS  64  -0.802   6.438 -11.028
  511    HD3  LYS  64           HD1      LYS  64  -0.719   4.716 -11.397
  512    HE2  LYS  64           HE2      LYS  64  -0.880   6.051 -13.466
  513    HE3  LYS  64           HE1      LYS  64  -2.306   5.034 -13.259
  514    HZ1  LYS  64           HZ1      LYS  64  -2.194   7.812 -13.511
  515    HZ2  LYS  64           HZ2      LYS  64  -2.738   7.469 -11.938
  516    HZ3  LYS  64           HZ3      LYS  64  -3.564   6.837 -13.282
  517    H    ALA  65           HN       ALA  65  -2.500   6.033  -6.106
  518    HA   ALA  65           HA       ALA  65  -1.266   3.881  -4.779
  519    HB1  ALA  65           HB1      ALA  65  -2.676   6.264  -3.556
  520    HB2  ALA  65           HB2      ALA  65  -0.980   6.185  -4.031
  521    HB3  ALA  65           HB3      ALA  65  -1.570   5.198  -2.694
  522    H    TRP  66           HN       TRP  66  -4.624   5.065  -4.259
  523    HA   TRP  66           HA       TRP  66  -5.320   2.998  -2.406
  524    HB2  TRP  66           HB2      TRP  66  -6.858   4.909  -4.159
  525    HB3  TRP  66           HB1      TRP  66  -7.752   3.566  -3.452
  526    HD1  TRP  66           HD1      TRP  66  -6.781   6.995  -2.690
  527    HE1  TRP  66           HE1      TRP  66  -7.003   7.495  -0.172
  528    HE3  TRP  66           HE3      TRP  66  -7.231   2.241  -0.895
  529    HZ2  TRP  66           HZ2      TRP  66  -7.329   6.067   2.284
  530    HZ3  TRP  66           HZ3      TRP  66  -7.499   1.837   1.557
  531    HH2  TRP  66           HH2      TRP  66  -7.546   3.746   3.133
  532    H    ALA  67           HN       ALA  67  -5.650   3.174  -5.957
  533    HA   ALA  67           HA       ALA  67  -6.983   0.698  -6.330
  534    HB1  ALA  67           HB1      ALA  67  -6.049   0.748  -8.615
  535    HB2  ALA  67           HB2      ALA  67  -4.909   2.000  -8.124
  536    HB3  ALA  67           HB3      ALA  67  -6.639   2.342  -8.146
  537    H    MET  68           HN       MET  68  -3.537   1.423  -5.922
  538    HA   MET  68           HA       MET  68  -2.689  -1.338  -6.384
  539    HB2  MET  68           HB2      MET  68  -1.324   1.145  -5.302
  540    HB3  MET  68           HB1      MET  68  -0.506  -0.417  -5.311
  541    HG2  MET  68           HG2      MET  68  -0.596  -0.562  -7.697
  542    HG3  MET  68           HG1      MET  68  -1.748   0.767  -7.813
  543    HE1  MET  68           HE1      MET  68   2.692   0.908  -6.769
  544    HE2  MET  68           HE2      MET  68   1.570  -0.446  -6.668
  545    HE3  MET  68           HE3      MET  68   1.570   0.785  -5.407
  546    H    ALA  69           HN       ALA  69  -3.576   0.624  -3.590
  547    HA   ALA  69           HA       ALA  69  -2.587  -1.193  -1.587
  548    HB1  ALA  69           HB1      ALA  69  -4.901   0.757  -1.359
  549    HB2  ALA  69           HB2      ALA  69  -3.206   1.205  -1.165
  550    HB3  ALA  69           HB3      ALA  69  -3.960   0.085  -0.028
  551    H    VAL  70           HN       VAL  70  -5.800  -0.795  -3.100
  552    HA   VAL  70           HA       VAL  70  -6.972  -2.980  -1.548
  553    HB   VAL  70           HB       VAL  70  -8.923  -2.671  -2.977
  554   HG11  VAL  70          HG11      VAL  70  -8.459  -1.020  -1.166
  555   HG12  VAL  70          HG12      VAL  70  -9.328  -0.286  -2.515
  556   HG13  VAL  70          HG13      VAL  70  -7.596  -0.013  -2.329
  557   HG21  VAL  70          HG21      VAL  70  -7.005  -1.022  -4.662
  558   HG22  VAL  70          HG22      VAL  70  -8.756  -0.887  -4.819
  559   HG23  VAL  70          HG23      VAL  70  -7.957  -2.416  -5.171
  560    H    TRP  71           HN       TRP  71  -5.711  -2.673  -4.871
  561    HA   TRP  71           HA       TRP  71  -6.438  -5.329  -5.665
  562    HB2  TRP  71           HB2      TRP  71  -5.836  -3.539  -7.290
  563    HB3  TRP  71           HB1      TRP  71  -4.166  -3.606  -6.728
  564    HD1  TRP  71           HD1      TRP  71  -6.713  -5.502  -8.799
  565    HE1  TRP  71           HE1      TRP  71  -5.525  -7.430 -10.034
  566    HE3  TRP  71           HE3      TRP  71  -2.130  -5.280  -6.573
  567    HZ2  TRP  71           HZ2      TRP  71  -2.962  -8.708 -10.069
  568    HZ3  TRP  71           HZ3      TRP  71  -0.335  -6.857  -7.217
  569    HH2  TRP  71           HH2      TRP  71  -0.744  -8.572  -8.964
  570    H    ILE  72           HN       ILE  72  -3.653  -4.089  -3.853
  571    HA   ILE  72           HA       ILE  72  -2.100  -6.546  -4.211
  572    HB   ILE  72           HB       ILE  72  -1.840  -4.167  -2.339
  573   HG12  ILE  72          HG12      ILE  72   0.060  -5.327  -4.409
  574   HG13  ILE  72          HG11      ILE  72  -1.114  -4.069  -4.773
  575   HG21  ILE  72          HG21      ILE  72   0.368  -5.270  -1.616
  576   HG22  ILE  72          HG22      ILE  72  -0.281  -6.770  -2.268
  577   HG23  ILE  72          HG23      ILE  72  -1.097  -5.965  -0.930
  578   HD11  ILE  72          HD11      ILE  72   0.993  -3.783  -2.610
  579   HD12  ILE  72          HD12      ILE  72  -0.041  -2.518  -3.272
  580   HD13  ILE  72          HD13      ILE  72   1.223  -3.232  -4.267
  581    H    PHE  73           HN       PHE  73  -4.335  -5.398  -1.594
  582    HA   PHE  73           HA       PHE  73  -3.869  -7.573   0.171
  583    HB2  PHE  73           HB2      PHE  73  -6.633  -6.418  -0.289
  584    HB3  PHE  73           HB1      PHE  73  -5.961  -7.059   1.205
  585    HD1  PHE  73           HD2      PHE  73  -3.204  -5.572   1.023
  586    HD2  PHE  73           HD1      PHE  73  -7.275  -4.259   0.521
  587    HE1  PHE  73           HE2      PHE  73  -2.559  -3.288   1.691
  588    HE2  PHE  73           HE1      PHE  73  -6.610  -1.974   1.195
  589    HZ   PHE  73           HZ       PHE  73  -4.253  -1.487   1.778
  590    H    ALA  74           HN       ALA  74  -6.204  -7.377  -2.549
  591    HA   ALA  74           HA       ALA  74  -7.273 -10.000  -2.195
  592    HB1  ALA  74           HB1      ALA  74  -8.284  -8.318  -3.705
  593    HB2  ALA  74           HB2      ALA  74  -7.953  -9.821  -4.568
  594    HB3  ALA  74           HB3      ALA  74  -6.884  -8.433  -4.770
  595    H    ALA  75           HN       ALA  75  -4.258  -8.888  -3.610
  596    HA   ALA  75           HA       ALA  75  -3.667 -11.323  -5.057
  597    HB1  ALA  75           HB1      ALA  75  -1.692  -9.288  -3.975
  598    HB2  ALA  75           HB2      ALA  75  -2.595  -9.075  -5.475
  599    HB3  ALA  75           HB3      ALA  75  -1.443 -10.403  -5.319
  600    H    ILE  76           HN       ILE  76  -2.598 -10.103  -1.851
  601    HA   ILE  76           HA       ILE  76  -1.216 -12.651  -1.295
  602    HB   ILE  76           HB       ILE  76  -0.805 -11.592   0.973
  603   HG12  ILE  76          HG12      ILE  76  -2.176  -9.208  -0.323
  604   HG13  ILE  76          HG11      ILE  76  -2.844 -10.169   0.987
  605   HG21  ILE  76          HG21      ILE  76   0.755 -11.357  -0.984
  606   HG22  ILE  76          HG22      ILE  76   0.829 -10.000   0.133
  607   HG23  ILE  76          HG23      ILE  76  -0.045  -9.841  -1.391
  608   HD11  ILE  76          HD11      ILE  76  -0.713  -9.589   2.304
  609   HD12  ILE  76          HD12      ILE  76  -1.854  -8.273   2.038
  610   HD13  ILE  76          HD13      ILE  76  -0.399  -8.386   1.051
  611    H    ASN  77           HN       ASN  77  -4.250 -12.353  -1.668
  612    HA   ASN  77           HA       ASN  77  -6.146 -13.416  -0.834
  613    HB2  ASN  77           HB2      ASN  77  -4.372 -15.297  -0.583
  614    HB3  ASN  77           HB1      ASN  77  -4.342 -14.881   1.129
  615   HD21  ASN  77          HD21      ASN  77  -6.849 -14.566   1.960
  616   HD22  ASN  77          HD22      ASN  77  -7.851 -15.876   1.559
  617    H    ARG  78           HN       ARG  78  -6.510 -11.166   0.061
  618    HA   ARG  78           HA       ARG  78  -7.208 -11.387   2.920
  619    HB2  ARG  78           HB2      ARG  78  -5.261  -9.301   1.871
  620    HB3  ARG  78           HB1      ARG  78  -6.139  -9.113   3.389
  621    HG2  ARG  78           HG2      ARG  78  -5.163 -11.355   4.101
  622    HG3  ARG  78           HG1      ARG  78  -4.125 -11.268   2.685
  623    HD2  ARG  78           HD2      ARG  78  -3.539  -8.853   3.655
  624    HD3  ARG  78           HD1      ARG  78  -4.063  -9.576   5.176
  625    HE   ARG  78           HE       ARG  78  -1.547  -9.982   3.910
  626   HH11  ARG  78          HH21      ARG  78  -4.073 -11.824   5.381
  627   HH12  ARG  78          HH22      ARG  78  -3.094 -13.235   5.577
  628   HH21  ARG  78          HH11      ARG  78  -0.267 -11.800   4.189
  629   HH22  ARG  78          HH12      ARG  78  -0.943 -13.220   4.915
  630    H    ARG  79           HN       ARG  79  -8.703 -11.285   0.492
  631    HA   ARG  79           HA       ARG  79  -9.653  -8.756  -0.291
  632    HB2  ARG  79           HB2      ARG  79 -11.249 -11.318   0.005
  633    HB3  ARG  79           HB1      ARG  79 -11.716  -9.922  -0.966
  634    HG2  ARG  79           HG2      ARG  79  -9.674 -10.187  -2.331
  635    HG3  ARG  79           HG1      ARG  79  -9.215 -11.591  -1.366
  636    HD2  ARG  79           HD2      ARG  79 -11.286 -12.743  -2.052
  637    HD3  ARG  79           HD1      ARG  79 -11.747 -11.341  -3.017
  638    HE   ARG  79           HE       ARG  79  -9.227 -12.015  -3.973
  639   HH11  ARG  79          HH21      ARG  79 -12.236 -13.640  -3.486
  640   HH12  ARG  79          HH22      ARG  79 -12.007 -14.736  -4.807
  641   HH21  ARG  79          HH11      ARG  79  -8.918 -13.438  -5.697
  642   HH22  ARG  79          HH12      ARG  79 -10.130 -14.622  -6.058
  643    H    ASP  80           HN       ASP  80 -10.346 -10.573   2.644
  644    HA   ASP  80           HA       ASP  80 -12.715  -9.257   3.472
  645    HB2  ASP  80           HB2      ASP  80 -11.967  -9.808   5.798
  646    HB3  ASP  80           HB1      ASP  80 -11.795 -11.183   4.702
  647    H    LEU  81           HN       LEU  81  -9.376  -8.173   3.471
  648    HA   LEU  81           HA       LEU  81  -9.792  -5.898   5.201
  649    HB2  LEU  81           HB2      LEU  81  -7.552  -7.076   4.481
  650    HB3  LEU  81           HB1      LEU  81  -7.627  -6.016   3.080
  651    HG   LEU  81           HG       LEU  81  -7.975  -4.095   4.876
  652   HD11  LEU  81          HD11      LEU  81  -8.203  -5.509   6.865
  653   HD12  LEU  81          HD12      LEU  81  -6.716  -4.579   6.988
  654   HD13  LEU  81          HD13      LEU  81  -6.652  -6.278   6.530
  655   HD21  LEU  81          HD21      LEU  81  -5.494  -3.854   5.072
  656   HD22  LEU  81          HD22      LEU  81  -6.010  -4.231   3.431
  657   HD23  LEU  81          HD23      LEU  81  -5.313  -5.492   4.446
  658    H    TYR  82           HN       TYR  82 -10.373  -6.480   1.786
  659    HA   TYR  82           HA       TYR  82 -10.499  -3.667   1.045
  660    HB2  TYR  82           HB2      TYR  82 -10.144  -5.056  -0.822
  661    HB3  TYR  82           HB1      TYR  82 -11.253  -6.286  -0.244
  662    HD1  TYR  82           HD1      TYR  82 -11.382  -2.638  -1.149
  663    HD2  TYR  82           HD2      TYR  82 -13.268  -6.488  -1.486
  664    HE1  TYR  82           HE1      TYR  82 -13.156  -1.650  -2.570
  665    HE2  TYR  82           HE2      TYR  82 -15.036  -5.495  -2.906
  666    HH   TYR  82           HH       TYR  82 -16.010  -3.441  -3.458
  667    H    GLU  83           HN       GLU  83 -12.841  -6.098   2.154
  668    HA   GLU  83           HA       GLU  83 -15.175  -4.527   1.696
  669    HB2  GLU  83           HB2      GLU  83 -14.961  -7.041   2.353
  670    HB3  GLU  83           HB1      GLU  83 -14.901  -6.468   4.015
  671    HG2  GLU  83           HG2      GLU  83 -17.129  -5.836   2.048
  672    HG3  GLU  83           HG1      GLU  83 -17.208  -7.084   3.290
  673    H    LYS  84           HN       LYS  84 -13.050  -4.789   4.560
  674    HA   LYS  84           HA       LYS  84 -14.578  -2.836   6.086
  675    HB2  LYS  84           HB2      LYS  84 -13.141  -4.574   7.147
  676    HB3  LYS  84           HB1      LYS  84 -11.725  -3.769   6.472
  677    HG2  LYS  84           HG2      LYS  84 -12.122  -1.784   7.772
  678    HG3  LYS  84           HG1      LYS  84 -13.716  -2.349   8.265
  679    HD2  LYS  84           HD2      LYS  84 -12.039  -2.625  10.071
  680    HD3  LYS  84           HD1      LYS  84 -12.718  -4.168   9.558
  681    HE2  LYS  84           HE2      LYS  84 -10.145  -4.040   9.863
  682    HE3  LYS  84           HE1      LYS  84 -10.745  -4.777   8.380
  683    HZ1  LYS  84           HZ1      LYS  84  -8.918  -3.015   8.213
  684    HZ2  LYS  84           HZ2      LYS  84 -10.154  -1.888   8.507
  685    HZ3  LYS  84           HZ3      LYS  84 -10.231  -2.901   7.145
  686    H    ALA  85           HN       ALA  85 -11.507  -2.740   4.261
  687    HA   ALA  85           HA       ALA  85 -10.782  -0.070   4.783
  688    HB1  ALA  85           HB1      ALA  85  -9.529  -0.149   2.683
  689    HB2  ALA  85           HB2      ALA  85 -10.483  -1.528   2.139
  690    HB3  ALA  85           HB3      ALA  85  -9.385  -1.701   3.509
  691    H    LYS  86           HN       LYS  86 -13.260  -1.347   2.656
  692    HA   LYS  86           HA       LYS  86 -13.725   1.126   1.218
  693    HB2  LYS  86           HB2      LYS  86 -14.485  -1.150   0.405
  694    HB3  LYS  86           HB1      LYS  86 -15.711  -1.139   1.675
  695    HG2  LYS  86           HG2      LYS  86 -16.697   0.904   0.753
  696    HG3  LYS  86           HG1      LYS  86 -15.434   0.982  -0.476
  697    HD2  LYS  86           HD2      LYS  86 -16.176  -1.204  -1.371
  698    HD3  LYS  86           HD1      LYS  86 -17.460  -1.252  -0.161
  699    HE2  LYS  86           HE2      LYS  86 -17.128   0.850  -2.321
  700    HE3  LYS  86           HE1      LYS  86 -18.350  -0.420  -2.289
  701    HZ1  LYS  86           HZ1      LYS  86 -18.043   1.788  -0.329
  702    HZ2  LYS  86           HZ2      LYS  86 -19.155   0.513  -0.178
  703    HZ3  LYS  86           HZ3      LYS  86 -19.288   1.612  -1.468
  704    H    ARG  87           HN       ARG  87 -14.763  -0.152   4.328
  705    HA   ARG  87           HA       ARG  87 -16.968   1.739   4.645
  706    HB2  ARG  87           HB2      ARG  87 -16.757  -0.474   5.859
  707    HB3  ARG  87           HB1      ARG  87 -15.466   0.243   6.819
  708    HG2  ARG  87           HG2      ARG  87 -17.019   2.023   7.563
  709    HG3  ARG  87           HG1      ARG  87 -18.312   1.282   6.627
  710    HD2  ARG  87           HD2      ARG  87 -17.573  -0.884   8.085
  711    HD3  ARG  87           HD1      ARG  87 -17.105   0.379   9.222
  712    HE   ARG  87           HE       ARG  87 -19.751  -0.530   8.764
  713   HH11  ARG  87          HH21      ARG  87 -18.016   2.453   8.922
  714   HH12  ARG  87          HH22      ARG  87 -19.436   3.408   9.165
  715   HH21  ARG  87          HH11      ARG  87 -21.593   0.702   9.105
  716   HH22  ARG  87          HH12      ARG  87 -21.456   2.419   9.280
  717    H    ASP  88           HN       ASP  88 -13.519   1.762   5.276
  718    HA   ASP  88           HA       ASP  88 -13.687   4.254   6.891
  719    HB2  ASP  88           HB2      ASP  88 -12.059   2.383   7.441
  720    HB3  ASP  88           HB1      ASP  88 -11.217   2.756   5.936
  721    H    GLU  89           HN       GLU  89 -13.724   3.490   3.649
  722    HA   GLU  89           HA       GLU  89 -11.862   5.197   2.424
  723    HB2  GLU  89           HB2      GLU  89 -13.237   3.655   1.146
  724    HB3  GLU  89           HB1      GLU  89 -14.697   4.524   1.600
  725    HG2  GLU  89           HG2      GLU  89 -13.927   5.061  -0.714
  726    HG3  GLU  89           HG1      GLU  89 -13.981   6.484   0.319
  727    HA   PRO  90           HA       PRO  90 -13.656   9.015   4.224
  728    HB2  PRO  90           HB2      PRO  90 -11.827  10.706   2.716
  729    HB3  PRO  90           HB1      PRO  90 -11.767  10.324   4.443
  730    HG2  PRO  90           HG2      PRO  90 -10.000   9.337   2.361
  731    HG3  PRO  90           HG1      PRO  90  -9.948   8.956   4.090
  732    HD2  PRO  90           HD2      PRO  90 -10.829   7.229   1.915
  733    HD3  PRO  90           HD1      PRO  90 -10.735   6.838   3.648
  734    H    LYS  91           HN       LYS  91 -14.994  10.729   3.316
  735    HA   LYS  91           HA       LYS  91 -16.593  11.481   1.767
  736    HB2  LYS  91           HB2      LYS  91 -14.029  11.283   0.173
  737    HB3  LYS  91           HB1      LYS  91 -15.519  11.752  -0.641
  738    HG2  LYS  91           HG2      LYS  91 -14.273  13.737   0.097
  739    HG3  LYS  91           HG1      LYS  91 -15.810  13.616   0.951
  740    HD2  LYS  91           HD2      LYS  91 -14.742  12.769   2.935
  741    HD3  LYS  91           HD1      LYS  91 -13.208  12.555   2.092
  742    HE2  LYS  91           HE2      LYS  91 -12.964  14.969   1.837
  743    HE3  LYS  91           HE1      LYS  91 -14.559  15.237   2.541
  744    HZ1  LYS  91           HZ1      LYS  91 -12.845  15.571   4.184
  745    HZ2  LYS  91           HZ2      LYS  91 -12.225  14.012   3.908
  746    HZ3  LYS  91           HZ3      LYS  91 -13.769  14.207   4.590
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1 -11.254  18.305  10.852
    2    H2   MET   1           HT2      MET   1 -10.201  17.524  11.933
    3    H3   MET   1           HT3      MET   1 -11.501  16.673  11.243
    4    HA   MET   1           HA       MET   1 -10.530  16.682   9.112
    5    HB2  MET   1           HB2      MET   1  -8.347  17.868   8.747
    6    HB3  MET   1           HB1      MET   1  -9.687  18.962   9.088
    7    HG2  MET   1           HG2      MET   1  -8.984  19.038  11.476
    8    HG3  MET   1           HG1      MET   1  -7.613  18.003  11.085
    9    HE1  MET   1           HE1      MET   1  -8.934  21.441  11.474
   10    HE2  MET   1           HE2      MET   1  -9.464  21.241   9.806
   11    HE3  MET   1           HE3      MET   1  -8.226  22.432  10.193
   12    H    ALA   2           HN       ALA   2  -8.234  15.669   8.550
   13    HA   ALA   2           HA       ALA   2  -6.816  14.403  10.756
   14    HB1  ALA   2           HB1      ALA   2  -7.480  12.085  10.216
   15    HB2  ALA   2           HB2      ALA   2  -8.640  12.692   9.034
   16    HB3  ALA   2           HB3      ALA   2  -8.869  13.030  10.750
   17    H    SER   3           HN       SER   3  -4.814  13.739  10.035
   18    HA   SER   3           HA       SER   3  -4.034  14.406   7.330
   19    HB2  SER   3           HB2      SER   3  -2.628  12.969   9.605
   20    HB3  SER   3           HB1      SER   3  -1.846  13.242   8.049
   21    HG   SER   3           HG       SER   3  -1.968  14.899  10.044
   22    H    THR   4           HN       THR   4  -3.996  13.097   5.548
   23    HA   THR   4           HA       THR   4  -5.198  10.441   5.706
   24    HB   THR   4           HB       THR   4  -3.846  11.015   3.145
   25    HG1  THR   4           HG1      THR   4  -3.968  13.098   3.324
   26   HG21  THR   4          HG21      THR   4  -6.072  10.847   2.230
   27   HG22  THR   4          HG22      THR   4  -6.805  11.108   3.813
   28   HG23  THR   4          HG23      THR   4  -5.923   9.617   3.482
   29    H    ARG   5           HN       ARG   5  -1.923  11.714   5.111
   30    HA   ARG   5           HA       ARG   5  -0.600   9.283   4.557
   31    HB2  ARG   5           HB2      ARG   5   1.429  10.437   5.606
   32    HB3  ARG   5           HB1      ARG   5   0.630  11.329   4.313
   33    HG2  ARG   5           HG2      ARG   5  -0.591  12.675   5.968
   34    HG3  ARG   5           HG1      ARG   5   0.159  11.762   7.277
   35    HD2  ARG   5           HD2      ARG   5   1.350  13.881   6.921
   36    HD3  ARG   5           HD1      ARG   5   2.389  12.515   6.517
   37    HE   ARG   5           HE       ARG   5   1.186  13.182   4.104
   38   HH11  ARG   5          HH21      ARG   5   3.003  14.830   6.535
   39   HH12  ARG   5          HH22      ARG   5   3.706  15.960   5.426
   40   HH21  ARG   5          HH11      ARG   5   2.096  14.649   2.651
   41   HH22  ARG   5          HH12      ARG   5   3.193  15.859   3.231
   42    H    CYS   6           HN       CYS   6  -1.617  10.653   7.642
   43    HA   CYS   6           HA       CYS   6  -0.239   8.651   9.250
   44    HB2  CYS   6           HB2      CYS   6  -0.830  10.920  10.085
   45    HB3  CYS   6           HB1      CYS   6  -2.537  10.481   9.989
   46    HG   CYS   6           HG       CYS   6  -2.276   9.409  12.199
   47    H    LYS   7           HN       LYS   7  -3.312   8.896   7.626
   48    HA   LYS   7           HA       LYS   7  -4.662   6.839   9.164
   49    HB2  LYS   7           HB2      LYS   7  -5.735   8.679   7.716
   50    HB3  LYS   7           HB1      LYS   7  -5.322   7.683   6.326
   51    HG2  LYS   7           HG2      LYS   7  -7.494   6.904   6.763
   52    HG3  LYS   7           HG1      LYS   7  -6.557   5.758   7.718
   53    HD2  LYS   7           HD2      LYS   7  -6.935   7.146   9.739
   54    HD3  LYS   7           HD1      LYS   7  -7.859   8.295   8.773
   55    HE2  LYS   7           HE2      LYS   7  -9.434   6.814   9.869
   56    HE3  LYS   7           HE1      LYS   7  -9.414   6.402   8.154
   57    HZ1  LYS   7           HZ1      LYS   7  -8.969   4.694  10.248
   58    HZ2  LYS   7           HZ2      LYS   7  -7.421   4.974   9.605
   59    HZ3  LYS   7           HZ3      LYS   7  -8.662   4.380   8.608
   60    H    LEU   8           HN       LEU   8  -3.092   6.839   5.930
   61    HA   LEU   8           HA       LEU   8  -3.513   3.976   5.568
   62    HB2  LEU   8           HB2      LEU   8  -1.861   6.091   4.167
   63    HB3  LEU   8           HB1      LEU   8  -1.602   4.392   3.774
   64    HG   LEU   8           HG       LEU   8  -4.020   4.163   3.241
   65   HD11  LEU   8          HD11      LEU   8  -5.316   6.330   2.960
   66   HD12  LEU   8          HD12      LEU   8  -4.037   7.127   3.877
   67   HD13  LEU   8          HD13      LEU   8  -5.006   5.861   4.631
   68   HD21  LEU   8          HD21      LEU   8  -3.936   5.346   1.126
   69   HD22  LEU   8          HD22      LEU   8  -2.306   4.789   1.506
   70   HD23  LEU   8          HD23      LEU   8  -2.742   6.479   1.757
   71    H    ALA   9           HN       ALA   9  -0.903   5.929   6.955
   72    HA   ALA   9           HA       ALA   9   1.083   3.881   7.057
   73    HB1  ALA   9           HB1      ALA   9   0.666   6.037   9.144
   74    HB2  ALA   9           HB2      ALA   9   1.437   6.331   7.586
   75    HB3  ALA   9           HB3      ALA   9   2.173   5.217   8.738
   76    H    ARG  10           HN       ARG  10  -1.627   4.643   9.191
   77    HA   ARG  10           HA       ARG  10  -0.913   2.754  11.256
   78    HB2  ARG  10           HB2      ARG  10  -3.515   4.110  10.488
   79    HB3  ARG  10           HB1      ARG  10  -3.423   2.973  11.832
   80    HG2  ARG  10           HG2      ARG  10  -1.759   4.360  12.951
   81    HG3  ARG  10           HG1      ARG  10  -1.706   5.465  11.577
   82    HD2  ARG  10           HD2      ARG  10  -3.147   6.357  13.383
   83    HD3  ARG  10           HD1      ARG  10  -4.084   6.024  11.925
   84    HE   ARG  10           HE       ARG  10  -4.287   3.678  13.392
   85   HH11  ARG  10          HH21      ARG  10  -4.860   7.036  13.967
   86   HH12  ARG  10          HH22      ARG  10  -6.139   6.756  15.099
   87   HH21  ARG  10          HH11      ARG  10  -5.954   3.302  14.867
   88   HH22  ARG  10          HH12      ARG  10  -6.759   4.645  15.609
   89    H    TYR  11           HN       TYR  11  -2.736   2.534   8.247
   90    HA   TYR  11           HA       TYR  11  -3.891  -0.050   8.755
   91    HB2  TYR  11           HB2      TYR  11  -3.512   1.728   6.382
   92    HB3  TYR  11           HB1      TYR  11  -3.734   0.024   6.008
   93    HD1  TYR  11           HD1      TYR  11  -5.178   2.481   8.473
   94    HD2  TYR  11           HD2      TYR  11  -5.978  -0.537   5.518
   95    HE1  TYR  11           HE1      TYR  11  -7.617   2.740   8.859
   96    HE2  TYR  11           HE2      TYR  11  -8.410  -0.282   5.909
   97    HH   TYR  11           HH       TYR  11  -9.987   0.852   6.980
   98    H    LEU  12           HN       LEU  12  -1.021   0.839   6.784
   99    HA   LEU  12           HA       LEU  12  -0.215  -1.861   6.315
  100    HB2  LEU  12           HB2      LEU  12   1.732   0.451   6.619
  101    HB3  LEU  12           HB1      LEU  12   1.914  -0.990   5.624
  102    HG   LEU  12           HG       LEU  12  -0.274   1.095   5.111
  103   HD11  LEU  12          HD11      LEU  12   2.020   2.078   4.889
  104   HD12  LEU  12          HD12      LEU  12   1.173   1.977   3.347
  105   HD13  LEU  12          HD13      LEU  12   2.427   0.803   3.742
  106   HD21  LEU  12          HD21      LEU  12  -0.140   0.010   2.790
  107   HD22  LEU  12          HD22      LEU  12  -0.818  -1.008   4.050
  108   HD23  LEU  12          HD23      LEU  12   0.848  -1.253   3.523
  109    H    GLU  13           HN       GLU  13   0.074   0.158   9.116
  110    HA   GLU  13           HA       GLU  13   2.154  -1.509  10.376
  111    HB2  GLU  13           HB2      GLU  13   0.469   0.811  11.359
  112    HB3  GLU  13           HB1      GLU  13   1.546  -0.072  12.434
  113    HG2  GLU  13           HG2      GLU  13   2.492   1.172   9.829
  114    HG3  GLU  13           HG1      GLU  13   2.546   2.018  11.373
  115    H    ASP  14           HN       ASP  14  -1.393  -1.298  10.508
  116    HA   ASP  14           HA       ASP  14  -1.662  -2.898  12.887
  117    HB2  ASP  14           HB2      ASP  14  -4.000  -3.170  12.264
  118    HB3  ASP  14           HB1      ASP  14  -3.504  -1.504  11.990
  119    H    LEU  15           HN       LEU  15  -0.851  -3.773   9.636
  120    HA   LEU  15           HA       LEU  15  -1.812  -6.531   9.829
  121    HB2  LEU  15           HB2      LEU  15   0.336  -5.398   8.007
  122    HB3  LEU  15           HB1      LEU  15  -0.496  -6.935   7.803
  123    HG   LEU  15           HG       LEU  15  -1.771  -4.179   7.678
  124   HD11  LEU  15          HD11      LEU  15  -1.425  -6.278   5.515
  125   HD12  LEU  15          HD12      LEU  15  -0.361  -4.885   5.714
  126   HD13  LEU  15          HD13      LEU  15  -2.062  -4.648   5.314
  127   HD21  LEU  15          HD21      LEU  15  -2.953  -6.974   7.609
  128   HD22  LEU  15          HD22      LEU  15  -3.762  -5.639   6.786
  129   HD23  LEU  15          HD23      LEU  15  -3.503  -5.569   8.523
  130    H    GLU  16           HN       GLU  16  -0.284  -8.407   9.801
  131    HA   GLU  16           HA       GLU  16   1.385  -8.360  12.129
  132    HB2  GLU  16           HB2      GLU  16   1.171 -10.363   9.859
  133    HB3  GLU  16           HB1      GLU  16   2.113 -10.643  11.322
  134    HG2  GLU  16           HG2      GLU  16  -0.052 -11.671  11.640
  135    HG3  GLU  16           HG1      GLU  16   0.010 -10.236  12.664
  136    H    ASP  17           HN       ASP  17   3.701  -8.638  12.250
  137    HA   ASP  17           HA       ASP  17   5.230  -6.863  10.681
  138    HB2  ASP  17           HB2      ASP  17   5.932  -7.773  12.890
  139    HB3  ASP  17           HB1      ASP  17   6.231  -9.334  12.125
  140    H    VAL  18           HN       VAL  18   4.893 -10.409  10.338
  141    HA   VAL  18           HA       VAL  18   6.707 -10.767   8.204
  142    HB   VAL  18           HB       VAL  18   5.567 -12.624   9.410
  143   HG11  VAL  18          HG11      VAL  18   3.277 -11.513   9.355
  144   HG12  VAL  18          HG12      VAL  18   3.280 -13.220   8.915
  145   HG13  VAL  18          HG13      VAL  18   3.163 -11.990   7.659
  146   HG21  VAL  18          HG21      VAL  18   6.645 -12.930   7.150
  147   HG22  VAL  18          HG22      VAL  18   5.058 -12.697   6.414
  148   HG23  VAL  18          HG23      VAL  18   5.345 -14.080   7.469
  149    H    ASP  19           HN       ASP  19   3.405  -9.486   8.173
  150    HA   ASP  19           HA       ASP  19   3.095  -9.581   5.303
  151    HB2  ASP  19           HB2      ASP  19   1.175  -9.355   6.848
  152    HB3  ASP  19           HB1      ASP  19   1.748  -7.754   7.314
  153    H    LEU  20           HN       LEU  20   4.549  -7.233   7.524
  154    HA   LEU  20           HA       LEU  20   4.707  -5.066   5.643
  155    HB2  LEU  20           HB2      LEU  20   6.177  -5.787   8.176
  156    HB3  LEU  20           HB1      LEU  20   6.829  -4.499   7.169
  157    HG   LEU  20           HG       LEU  20   4.655  -3.318   7.285
  158   HD11  LEU  20          HD11      LEU  20   3.143  -5.196   7.577
  159   HD12  LEU  20          HD12      LEU  20   2.986  -4.137   8.977
  160   HD13  LEU  20          HD13      LEU  20   3.916  -5.628   9.101
  161   HD21  LEU  20          HD21      LEU  20   6.463  -2.913   8.968
  162   HD22  LEU  20          HD22      LEU  20   5.701  -4.103  10.023
  163   HD23  LEU  20          HD23      LEU  20   4.850  -2.614   9.613
  164    H    LYS  21           HN       LYS  21   6.586  -7.961   6.176
  165    HA   LYS  21           HA       LYS  21   8.841  -7.194   4.522
  166    HB2  LYS  21           HB2      LYS  21   9.010  -8.921   6.269
  167    HB3  LYS  21           HB1      LYS  21   7.871  -9.936   5.388
  168    HG2  LYS  21           HG2      LYS  21   9.407 -10.174   3.532
  169    HG3  LYS  21           HG1      LYS  21  10.503  -8.977   4.225
  170    HD2  LYS  21           HD2      LYS  21  11.021 -10.432   6.089
  171    HD3  LYS  21           HD1      LYS  21   9.776 -11.583   5.599
  172    HE2  LYS  21           HE2      LYS  21  12.077 -12.297   4.932
  173    HE3  LYS  21           HE1      LYS  21  10.990 -12.100   3.556
  174    HZ1  LYS  21           HZ1      LYS  21  13.358 -11.042   3.542
  175    HZ2  LYS  21           HZ2      LYS  21  12.598  -9.807   4.426
  176    HZ3  LYS  21           HZ3      LYS  21  12.041 -10.208   2.873
  177    H    LYS  22           HN       LYS  22   6.005  -9.336   3.917
  178    HA   LYS  22           HA       LYS  22   6.787  -9.755   1.136
  179    HB2  LYS  22           HB2      LYS  22   4.274 -10.412   2.710
  180    HB3  LYS  22           HB1      LYS  22   4.416 -10.747   0.985
  181    HG2  LYS  22           HG2      LYS  22   6.264 -12.241   1.334
  182    HG3  LYS  22           HG1      LYS  22   6.450 -11.728   3.009
  183    HD2  LYS  22           HD2      LYS  22   5.319 -13.938   2.813
  184    HD3  LYS  22           HD1      LYS  22   4.308 -12.732   3.607
  185    HE2  LYS  22           HE2      LYS  22   3.205 -14.201   1.765
  186    HE3  LYS  22           HE1      LYS  22   2.923 -12.462   1.694
  187    HZ1  LYS  22           HZ1      LYS  22   3.758 -13.839  -0.381
  188    HZ2  LYS  22           HZ2      LYS  22   5.274 -13.495   0.305
  189    HZ3  LYS  22           HZ3      LYS  22   4.225 -12.229  -0.124
  190    H    PHE  23           HN       PHE  23   4.567  -7.502   2.772
  191    HA   PHE  23           HA       PHE  23   3.296  -6.593   0.332
  192    HB2  PHE  23           HB2      PHE  23   2.414  -6.236   2.679
  193    HB3  PHE  23           HB1      PHE  23   3.667  -5.023   2.900
  194    HD1  PHE  23           HD1      PHE  23   3.741  -3.004   1.395
  195    HD2  PHE  23           HD2      PHE  23   0.409  -5.717   1.447
  196    HE1  PHE  23           HE1      PHE  23   2.328  -1.293   0.292
  197    HE2  PHE  23           HE2      PHE  23  -0.999  -4.007   0.335
  198    HZ   PHE  23           HZ       PHE  23  -0.041  -1.794  -0.241
  199    H    LYS  24           HN       LYS  24   6.133  -5.429   2.170
  200    HA   LYS  24           HA       LYS  24   6.605  -3.161   0.431
  201    HB2  LYS  24           HB2      LYS  24   7.464  -3.311   2.766
  202    HB3  LYS  24           HB1      LYS  24   8.527  -4.625   2.261
  203    HG2  LYS  24           HG2      LYS  24   9.751  -3.183   0.774
  204    HG3  LYS  24           HG1      LYS  24   8.572  -1.885   0.963
  205    HD2  LYS  24           HD2      LYS  24  10.614  -1.469   2.309
  206    HD3  LYS  24           HD1      LYS  24   9.184  -1.633   3.324
  207    HE2  LYS  24           HE2      LYS  24  10.900  -4.057   2.753
  208    HE3  LYS  24           HE1      LYS  24  11.366  -2.917   4.014
  209    HZ1  LYS  24           HZ1      LYS  24   9.461  -4.938   4.162
  210    HZ2  LYS  24           HZ2      LYS  24   8.623  -3.463   4.253
  211    HZ3  LYS  24           HZ3      LYS  24   9.873  -3.803   5.352
  212    H    MET  25           HN       MET  25   7.896  -6.468   0.627
  213    HA   MET  25           HA       MET  25   9.814  -6.142  -1.489
  214    HB2  MET  25           HB2      MET  25   9.800  -7.986   0.244
  215    HB3  MET  25           HB1      MET  25   8.448  -8.711  -0.622
  216    HG2  MET  25           HG2      MET  25  11.045  -8.076  -2.052
  217    HG3  MET  25           HG1      MET  25  10.828  -9.587  -1.174
  218    HE1  MET  25           HE1      MET  25  11.099 -11.178  -3.115
  219    HE2  MET  25           HE2      MET  25  11.603  -9.752  -4.019
  220    HE3  MET  25           HE3      MET  25  10.455 -10.881  -4.735
  221    H    HIS  26           HN       HIS  26   6.396  -7.049  -1.426
  222    HA   HIS  26           HA       HIS  26   6.260  -7.969  -4.168
  223    HB2  HIS  26           HB2      HIS  26   4.476  -8.352  -2.392
  224    HB3  HIS  26           HB1      HIS  26   4.034  -6.652  -2.554
  225    HD1  HIS  26           HD1      HIS  26   5.026  -7.612  -5.815
  226    HD2  HIS  26           HD2      HIS  26   1.593  -8.298  -3.552
  227    HE1  HIS  26           HE1      HIS  26   3.202  -8.243  -7.455
  228    H    LEU  27           HN       LEU  27   6.087  -4.759  -2.682
  229    HA   LEU  27           HA       LEU  27   5.127  -3.410  -5.066
  230    HB2  LEU  27           HB2      LEU  27   6.297  -2.627  -2.429
  231    HB3  LEU  27           HB1      LEU  27   6.526  -1.441  -3.706
  232    HG   LEU  27           HG       LEU  27   3.779  -2.629  -3.175
  233   HD11  LEU  27          HD11      LEU  27   3.338  -0.595  -1.760
  234   HD12  LEU  27          HD12      LEU  27   5.070  -0.266  -1.780
  235   HD13  LEU  27          HD13      LEU  27   4.462  -1.739  -1.026
  236   HD21  LEU  27          HD21      LEU  27   3.054  -0.431  -4.118
  237   HD22  LEU  27          HD22      LEU  27   4.049  -1.334  -5.255
  238   HD23  LEU  27          HD23      LEU  27   4.745   0.008  -4.349
  239    H    GLU  28           HN       GLU  28   8.391  -4.004  -3.747
  240    HA   GLU  28           HA       GLU  28   9.774  -2.618  -5.846
  241    HB2  GLU  28           HB2      GLU  28  10.758  -4.943  -4.161
  242    HB3  GLU  28           HB1      GLU  28  11.763  -3.806  -5.060
  243    HG2  GLU  28           HG2      GLU  28  10.968  -1.953  -3.680
  244    HG3  GLU  28           HG1      GLU  28   9.871  -3.034  -2.820
  245    H    ASP  29           HN       ASP  29   8.534  -5.910  -5.543
  246    HA   ASP  29           HA       ASP  29   9.786  -6.731  -8.111
  247    HB2  ASP  29           HB2      ASP  29   8.000  -8.204  -6.151
  248    HB3  ASP  29           HB1      ASP  29   8.692  -8.916  -7.609
  249    H    TYR  30           HN       TYR  30   7.478  -4.668  -7.746
  250    HA   TYR  30           HA       TYR  30   5.155  -5.879  -8.943
  251    HB2  TYR  30           HB2      TYR  30   5.085  -3.779  -7.633
  252    HB3  TYR  30           HB1      TYR  30   5.995  -2.973  -8.912
  253    HD1  TYR  30           HD2      TYR  30   2.782  -4.615  -8.058
  254    HD2  TYR  30           HD1      TYR  30   4.933  -2.350 -11.009
  255    HE1  TYR  30           HE2      TYR  30   0.668  -4.209  -9.290
  256    HE2  TYR  30           HE1      TYR  30   2.819  -1.945 -12.237
  257    HH   TYR  30           HH       TYR  30   0.070  -1.987 -11.228
  258    HA   PRO  31           HA       PRO  31   7.240  -5.825 -12.994
  259    HB2  PRO  31           HB2      PRO  31   5.012  -6.808 -14.485
  260    HB3  PRO  31           HB1      PRO  31   6.328  -7.782 -13.814
  261    HG2  PRO  31           HG2      PRO  31   3.541  -7.554 -12.854
  262    HG3  PRO  31           HG1      PRO  31   4.766  -8.757 -12.420
  263    HD2  PRO  31           HD2      PRO  31   3.886  -6.556 -10.799
  264    HD3  PRO  31           HD1      PRO  31   5.247  -7.650 -10.457
  265    HA   PRO  32           HA       PRO  32   5.650  -2.029 -14.686
  266    HB2  PRO  32           HB2      PRO  32   5.972  -2.446 -17.473
  267    HB3  PRO  32           HB1      PRO  32   7.228  -1.856 -16.373
  268    HG2  PRO  32           HG2      PRO  32   6.931  -4.566 -17.579
  269    HG3  PRO  32           HG1      PRO  32   8.386  -3.787 -16.933
  270    HD2  PRO  32           HD2      PRO  32   6.905  -5.824 -15.625
  271    HD3  PRO  32           HD1      PRO  32   8.097  -4.753 -14.854
  272    H    GLN  33           HN       GLN  33   3.607  -1.262 -15.262
  273    HA   GLN  33           HA       GLN  33   1.619  -3.235 -16.363
  274    HB2  GLN  33           HB2      GLN  33   1.247  -2.307 -14.019
  275    HB3  GLN  33           HB1      GLN  33   1.059  -0.717 -14.754
  276    HG2  GLN  33           HG2      GLN  33  -1.148  -1.624 -14.498
  277    HG3  GLN  33           HG1      GLN  33  -0.763  -1.721 -16.213
  278   HE21  GLN  33          HE21      GLN  33  -0.817  -3.697 -13.217
  279   HE22  GLN  33          HE22      GLN  33  -1.013  -5.182 -14.015
  280    H    LYS  34           HN       LYS  34   2.628   0.186 -16.420
  281    HA   LYS  34           HA       LYS  34   1.905   0.351 -19.295
  282    HB2  LYS  34           HB2      LYS  34   0.657   2.057 -17.114
  283    HB3  LYS  34           HB1      LYS  34   0.739   2.599 -18.788
  284    HG2  LYS  34           HG2      LYS  34  -0.488   0.554 -19.493
  285    HG3  LYS  34           HG1      LYS  34  -0.595   0.057 -17.812
  286    HD2  LYS  34           HD2      LYS  34  -2.685   1.097 -18.178
  287    HD3  LYS  34           HD1      LYS  34  -1.743   2.360 -17.396
  288    HE2  LYS  34           HE2      LYS  34  -3.041   3.158 -19.389
  289    HE3  LYS  34           HE1      LYS  34  -1.311   3.432 -19.544
  290    HZ1  LYS  34           HZ1      LYS  34  -2.562   0.977 -20.599
  291    HZ2  LYS  34           HZ2      LYS  34  -1.090   1.697 -21.047
  292    HZ3  LYS  34           HZ3      LYS  34  -2.563   2.410 -21.507
  293    H    GLY  35           HN       GLY  35   4.442   0.258 -18.566
  294    HA2  GLY  35           HA2      GLY  35   6.461   1.451 -18.732
  295    HA3  GLY  35           HA1      GLY  35   5.509   2.828 -19.292
  296    H    CYS  36           HN       CYS  36   4.521   1.482 -16.297
  297    HA   CYS  36           HA       CYS  36   4.865   3.888 -14.842
  298    HB2  CYS  36           HB2      CYS  36   3.347   2.064 -14.135
  299    HB3  CYS  36           HB1      CYS  36   4.746   1.058 -13.757
  300    HG   CYS  36           HG       CYS  36   4.069   3.703 -12.226
  301    H    ILE  37           HN       ILE  37   6.422   4.488 -13.263
  302    HA   ILE  37           HA       ILE  37   9.157   3.596 -13.841
  303    HB   ILE  37           HB       ILE  37   8.132   5.615 -11.822
  304   HG12  ILE  37          HG12      ILE  37   9.293   6.124 -14.585
  305   HG13  ILE  37          HG11      ILE  37   7.560   6.074 -14.264
  306   HG21  ILE  37          HG21      ILE  37  10.903   5.207 -12.995
  307   HG22  ILE  37          HG22      ILE  37  10.426   4.840 -11.337
  308   HG23  ILE  37          HG23      ILE  37  10.432   6.505 -11.903
  309   HD11  ILE  37          HD11      ILE  37   8.452   8.406 -14.209
  310   HD12  ILE  37          HD12      ILE  37   9.510   7.948 -12.875
  311   HD13  ILE  37          HD13      ILE  37   7.759   7.919 -12.661
  312    HA   PRO  38           HA       PRO  38   8.529   0.634 -10.387
  313    HB2  PRO  38           HB2      PRO  38  11.312  -0.210 -10.463
  314    HB3  PRO  38           HB1      PRO  38   9.894  -1.105 -11.026
  315    HG2  PRO  38           HG2      PRO  38  11.926   0.171 -12.655
  316    HG3  PRO  38           HG1      PRO  38  10.500  -0.721 -13.211
  317    HD2  PRO  38           HD2      PRO  38  10.933   2.154 -13.282
  318    HD3  PRO  38           HD1      PRO  38   9.522   1.253 -13.870
  319    H    LEU  39           HN       LEU  39   8.987   0.833  -8.170
  320    HA   LEU  39           HA       LEU  39  10.154   3.314  -7.290
  321    HB2  LEU  39           HB2      LEU  39   9.041   0.861  -5.937
  322    HB3  LEU  39           HB1      LEU  39   9.880   2.066  -4.964
  323    HG   LEU  39           HG       LEU  39   8.332   3.806  -5.753
  324   HD11  LEU  39          HD11      LEU  39   7.780   3.047  -7.966
  325   HD12  LEU  39          HD12      LEU  39   6.279   3.031  -7.045
  326   HD13  LEU  39          HD13      LEU  39   7.141   1.521  -7.354
  327   HD21  LEU  39          HD21      LEU  39   6.849   1.339  -4.789
  328   HD22  LEU  39          HD22      LEU  39   6.344   3.016  -4.575
  329   HD23  LEU  39          HD23      LEU  39   7.783   2.415  -3.750
  330    HA   PRO  40           HA       PRO  40  14.376   1.568  -7.462
  331    HB2  PRO  40           HB2      PRO  40  15.247   3.697  -5.589
  332    HB3  PRO  40           HB1      PRO  40  15.768   3.412  -7.258
  333    HG2  PRO  40           HG2      PRO  40  14.046   5.502  -6.401
  334    HG3  PRO  40           HG1      PRO  40  14.303   4.995  -8.079
  335    HD2  PRO  40           HD2      PRO  40  11.916   4.584  -6.409
  336    HD3  PRO  40           HD1      PRO  40  12.112   4.265  -8.148
  337    H    ARG  41           HN       ARG  41  15.208  -0.022  -6.169
  338    HA   ARG  41           HA       ARG  41  13.905  -0.755  -3.719
  339    HB2  ARG  41           HB2      ARG  41  15.138  -2.321  -5.284
  340    HB3  ARG  41           HB1      ARG  41  16.649  -1.651  -4.672
  341    HG2  ARG  41           HG2      ARG  41  16.063  -2.352  -2.391
  342    HG3  ARG  41           HG1      ARG  41  14.523  -2.985  -2.971
  343    HD2  ARG  41           HD2      ARG  41  17.270  -3.949  -3.819
  344    HD3  ARG  41           HD1      ARG  41  16.155  -4.808  -2.756
  345    HE   ARG  41           HE       ARG  41  14.678  -4.377  -5.068
  346   HH11  ARG  41          HH21      ARG  41  17.734  -5.775  -4.272
  347   HH12  ARG  41          HH22      ARG  41  17.699  -6.916  -5.575
  348   HH21  ARG  41          HH11      ARG  41  14.620  -5.859  -6.770
  349   HH22  ARG  41          HH12      ARG  41  15.937  -6.964  -6.988
  350    H    GLY  42           HN       GLY  42  17.149   0.655  -4.304
  351    HA2  GLY  42           HA2      GLY  42  17.996   0.794  -1.603
  352    HA3  GLY  42           HA1      GLY  42  18.512   1.955  -2.829
  353    H    GLN  43           HN       GLN  43  15.848   3.036  -3.361
  354    HA   GLN  43           HA       GLN  43  15.731   4.939  -1.159
  355    HB2  GLN  43           HB2      GLN  43  14.004   4.524  -3.625
  356    HB3  GLN  43           HB1      GLN  43  13.742   5.841  -2.481
  357    HG2  GLN  43           HG2      GLN  43  16.391   5.349  -3.884
  358    HG3  GLN  43           HG1      GLN  43  15.158   6.450  -4.495
  359   HE21  GLN  43          HE21      GLN  43  17.819   6.196  -2.331
  360   HE22  GLN  43          HE22      GLN  43  17.601   7.678  -1.533
  361    H    THR  44           HN       THR  44  13.759   2.176  -2.202
  362    HA   THR  44           HA       THR  44  11.601   2.677  -0.352
  363    HB   THR  44           HB       THR  44  12.480   0.082  -1.651
  364    HG1  THR  44           HG1      THR  44  11.111   2.309  -2.498
  365   HG21  THR  44          HG21      THR  44   9.919   0.891  -0.253
  366   HG22  THR  44          HG22      THR  44  11.008  -0.426   0.184
  367   HG23  THR  44          HG23      THR  44  10.054  -0.525  -1.294
  368    H    GLU  45           HN       GLU  45  14.449   0.496  -0.183
  369    HA   GLU  45           HA       GLU  45  13.837  -0.583   2.394
  370    HB2  GLU  45           HB2      GLU  45  16.585  -0.063   1.174
  371    HB3  GLU  45           HB1      GLU  45  16.248  -1.149   2.519
  372    HG2  GLU  45           HG2      GLU  45  15.092  -1.449  -0.276
  373    HG3  GLU  45           HG1      GLU  45  16.464  -2.359   0.355
  374    H    LYS  46           HN       LYS  46  15.625   2.391   1.459
  375    HA   LYS  46           HA       LYS  46  16.295   3.047   4.218
  376    HB2  LYS  46           HB2      LYS  46  16.264   4.722   1.687
  377    HB3  LYS  46           HB1      LYS  46  16.890   5.276   3.240
  378    HG2  LYS  46           HG2      LYS  46  18.534   3.453   3.254
  379    HG3  LYS  46           HG1      LYS  46  17.889   2.843   1.729
  380    HD2  LYS  46           HD2      LYS  46  18.499   4.952   0.614
  381    HD3  LYS  46           HD1      LYS  46  19.125   5.583   2.138
  382    HE2  LYS  46           HE2      LYS  46  20.960   4.701   0.755
  383    HE3  LYS  46           HE1      LYS  46  20.770   3.736   2.220
  384    HZ1  LYS  46           HZ1      LYS  46  19.097   2.730   0.183
  385    HZ2  LYS  46           HZ2      LYS  46  20.370   1.953   0.998
  386    HZ3  LYS  46           HZ3      LYS  46  20.682   2.855  -0.407
  387    H    ALA  47           HN       ALA  47  13.459   3.289   2.317
  388    HA   ALA  47           HA       ALA  47  12.326   5.650   3.569
  389    HB1  ALA  47           HB1      ALA  47  11.605   4.669   1.348
  390    HB2  ALA  47           HB2      ALA  47  10.282   5.029   2.454
  391    HB3  ALA  47           HB3      ALA  47  10.828   3.367   2.247
  392    H    ASP  48           HN       ASP  48  11.244   5.791   5.488
  393    HA   ASP  48           HA       ASP  48  11.171   3.445   7.266
  394    HB2  ASP  48           HB2      ASP  48  10.035   6.230   7.700
  395    HB3  ASP  48           HB1      ASP  48  10.364   5.021   8.941
  396    H    HIS  49           HN       HIS  49   9.022   3.000   8.460
  397    HA   HIS  49           HA       HIS  49   7.057   2.104   6.658
  398    HB2  HIS  49           HB2      HIS  49   6.746   2.851   9.579
  399    HB3  HIS  49           HB1      HIS  49   5.569   1.922   8.652
  400    HD1  HIS  49           HD1      HIS  49   8.896   1.669  10.316
  401    HD2  HIS  49           HD2      HIS  49   6.459  -0.720   7.921
  402    HE1  HIS  49           HE1      HIS  49   9.848  -0.674  10.438
  403    H    VAL  50           HN       VAL  50   6.996   5.104   8.634
  404    HA   VAL  50           HA       VAL  50   4.491   6.043   7.522
  405    HB   VAL  50           HB       VAL  50   6.811   7.609   8.746
  406   HG11  VAL  50          HG11      VAL  50   5.019   9.348   9.177
  407   HG12  VAL  50          HG12      VAL  50   3.957   8.436   8.107
  408   HG13  VAL  50          HG13      VAL  50   5.440   9.152   7.478
  409   HG21  VAL  50          HG21      VAL  50   5.857   6.001  10.326
  410   HG22  VAL  50          HG22      VAL  50   4.225   6.548   9.948
  411   HG23  VAL  50          HG23      VAL  50   5.346   7.627  10.774
  412    H    ASP  51           HN       ASP  51   7.901   6.730   6.693
  413    HA   ASP  51           HA       ASP  51   7.341   8.549   4.574
  414    HB2  ASP  51           HB2      ASP  51   9.672   6.653   4.983
  415    HB3  ASP  51           HB1      ASP  51   9.634   7.910   3.747
  416    H    LEU  52           HN       LEU  52   7.495   5.001   4.626
  417    HA   LEU  52           HA       LEU  52   7.491   4.511   1.856
  418    HB2  LEU  52           HB2      LEU  52   7.443   2.899   3.999
  419    HB3  LEU  52           HB1      LEU  52   5.730   2.805   3.617
  420    HG   LEU  52           HG       LEU  52   8.033   2.146   1.747
  421   HD11  LEU  52          HD11      LEU  52   7.578   0.483   3.545
  422   HD12  LEU  52          HD12      LEU  52   7.221  -0.151   1.938
  423   HD13  LEU  52          HD13      LEU  52   5.907   0.375   2.991
  424   HD21  LEU  52          HD21      LEU  52   5.026   2.186   1.332
  425   HD22  LEU  52          HD22      LEU  52   6.121   1.289   0.279
  426   HD23  LEU  52          HD23      LEU  52   6.259   3.039   0.403
  427    H    ALA  53           HN       ALA  53   4.684   5.033   4.022
  428    HA   ALA  53           HA       ALA  53   2.681   4.887   1.988
  429    HB1  ALA  53           HB1      ALA  53   1.268   6.141   3.577
  430    HB2  ALA  53           HB2      ALA  53   2.693   6.538   4.536
  431    HB3  ALA  53           HB3      ALA  53   2.158   4.863   4.402
  432    H    THR  54           HN       THR  54   4.892   7.469   2.912
  433    HA   THR  54           HA       THR  54   3.461   9.599   1.573
  434    HB   THR  54           HB       THR  54   6.439   9.428   2.143
  435    HG1  THR  54           HG1      THR  54   4.812   9.126   3.918
  436   HG21  THR  54          HG21      THR  54   4.560  11.771   1.727
  437   HG22  THR  54          HG22      THR  54   5.847  11.257   0.635
  438   HG23  THR  54          HG23      THR  54   6.245  11.903   2.225
  439    H    LEU  55           HN       LEU  55   5.937   7.271   0.482
  440    HA   LEU  55           HA       LEU  55   6.367   8.603  -2.064
  441    HB2  LEU  55           HB2      LEU  55   6.971   5.757  -1.157
  442    HB3  LEU  55           HB1      LEU  55   7.278   6.306  -2.797
  443    HG   LEU  55           HG       LEU  55   8.675   8.199  -1.778
  444   HD11  LEU  55          HD11      LEU  55   8.342   6.442   0.669
  445   HD12  LEU  55          HD12      LEU  55   7.910   8.144   0.521
  446   HD13  LEU  55          HD13      LEU  55   9.601   7.663   0.506
  447   HD21  LEU  55          HD21      LEU  55  10.635   6.710  -1.432
  448   HD22  LEU  55          HD22      LEU  55   9.694   6.232  -2.845
  449   HD23  LEU  55          HD23      LEU  55   9.550   5.322  -1.341
  450    H    MET  56           HN       MET  56   4.149   6.125  -0.880
  451    HA   MET  56           HA       MET  56   3.122   5.412  -3.495
  452    HB2  MET  56           HB2      MET  56   1.943   5.147  -0.712
  453    HB3  MET  56           HB1      MET  56   1.152   4.520  -2.156
  454    HG2  MET  56           HG2      MET  56   3.127   3.119  -2.643
  455    HG3  MET  56           HG1      MET  56   3.935   3.747  -1.209
  456    HE1  MET  56           HE1      MET  56   0.465   2.228  -2.331
  457    HE2  MET  56           HE2      MET  56   0.582   0.673  -1.512
  458    HE3  MET  56           HE3      MET  56   1.793   1.124  -2.710
  459    H    ILE  57           HN       ILE  57   2.034   7.750  -1.010
  460    HA   ILE  57           HA       ILE  57  -0.240   8.592  -2.663
  461    HB   ILE  57           HB       ILE  57   0.952  10.011  -0.253
  462   HG12  ILE  57          HG12      ILE  57  -1.383   8.071  -0.344
  463   HG13  ILE  57          HG11      ILE  57   0.241   7.602   0.148
  464   HG21  ILE  57          HG21      ILE  57  -1.356  10.955  -0.090
  465   HG22  ILE  57          HG22      ILE  57  -1.751  10.174  -1.618
  466   HG23  ILE  57          HG23      ILE  57  -0.528  11.442  -1.565
  467   HD11  ILE  57          HD11      ILE  57   0.158   9.390   1.913
  468   HD12  ILE  57          HD12      ILE  57  -1.036   8.114   2.143
  469   HD13  ILE  57          HD13      ILE  57  -1.529   9.672   1.479
  470    H    ASP  58           HN       ASP  58   3.017   9.887  -1.997
  471    HA   ASP  58           HA       ASP  58   2.549  12.321  -3.536
  472    HB2  ASP  58           HB2      ASP  58   4.229  12.074  -1.641
  473    HB3  ASP  58           HB1      ASP  58   5.215  11.100  -2.733
  474    H    PHE  59           HN       PHE  59   4.267   9.246  -4.213
  475    HA   PHE  59           HA       PHE  59   5.108  10.186  -6.852
  476    HB2  PHE  59           HB2      PHE  59   6.262   8.465  -5.275
  477    HB3  PHE  59           HB1      PHE  59   5.137   7.293  -5.950
  478    HD1  PHE  59           HD1      PHE  59   5.051   6.990  -8.483
  479    HD2  PHE  59           HD2      PHE  59   8.212   9.131  -6.507
  480    HE1  PHE  59           HE1      PHE  59   6.483   6.737 -10.490
  481    HE2  PHE  59           HE2      PHE  59   9.640   8.874  -8.515
  482    HZ   PHE  59           HZ       PHE  59   8.778   7.678 -10.506
  483    H    ASN  60           HN       ASN  60   2.576   7.847  -5.746
  484    HA   ASN  60           HA       ASN  60   1.706   7.526  -8.597
  485    HB2  ASN  60           HB2      ASN  60   0.903   6.077  -6.050
  486    HB3  ASN  60           HB1      ASN  60   0.245   5.720  -7.646
  487   HD21  ASN  60          HD21      ASN  60   1.728   4.785  -9.261
  488   HD22  ASN  60          HD22      ASN  60   3.189   4.064  -8.783
  489    H    GLY  61           HN       GLY  61   0.641   8.960  -5.564
  490    HA2  GLY  61           HA2      GLY  61  -0.982  10.773  -5.524
  491    HA3  GLY  61           HA1      GLY  61  -1.715  10.140  -6.995
  492    H    GLU  62           HN       GLU  62  -3.317  10.713  -4.805
  493    HA   GLU  62           HA       GLU  62  -3.756   8.423  -3.098
  494    HB2  GLU  62           HB2      GLU  62  -4.488  10.761  -2.567
  495    HB3  GLU  62           HB1      GLU  62  -5.712  10.621  -3.830
  496    HG2  GLU  62           HG2      GLU  62  -6.769   8.758  -2.669
  497    HG3  GLU  62           HG1      GLU  62  -5.485   8.740  -1.458
  498    H    GLU  63           HN       GLU  63  -4.976   9.396  -6.254
  499    HA   GLU  63           HA       GLU  63  -7.176   7.534  -6.332
  500    HB2  GLU  63           HB2      GLU  63  -5.617   8.874  -8.564
  501    HB3  GLU  63           HB1      GLU  63  -7.096   7.947  -8.807
  502    HG2  GLU  63           HG2      GLU  63  -7.698  10.286  -8.692
  503    HG3  GLU  63           HG1      GLU  63  -8.257   9.520  -7.208
  504    H    LYS  64           HN       LYS  64  -3.914   7.372  -7.837
  505    HA   LYS  64           HA       LYS  64  -4.334   4.629  -8.708
  506    HB2  LYS  64           HB2      LYS  64  -1.882   6.394  -8.541
  507    HB3  LYS  64           HB1      LYS  64  -1.786   4.728  -9.101
  508    HG2  LYS  64           HG2      LYS  64  -3.595   5.337 -10.811
  509    HG3  LYS  64           HG1      LYS  64  -3.334   7.017 -10.362
  510    HD2  LYS  64           HD2      LYS  64  -1.172   5.142 -11.380
  511    HD3  LYS  64           HD1      LYS  64  -2.024   6.316 -12.376
  512    HE2  LYS  64           HE2      LYS  64  -0.145   6.868 -10.064
  513    HE3  LYS  64           HE1      LYS  64   0.035   7.358 -11.743
  514    HZ1  LYS  64           HZ1      LYS  64  -0.717   9.220 -10.486
  515    HZ2  LYS  64           HZ2      LYS  64  -2.001   8.332  -9.817
  516    HZ3  LYS  64           HZ3      LYS  64  -1.998   8.710 -11.474
  517    H    ALA  65           HN       ALA  65  -2.613   6.096  -5.922
  518    HA   ALA  65           HA       ALA  65  -1.419   3.739  -4.922
  519    HB1  ALA  65           HB1      ALA  65  -2.683   5.942  -3.271
  520    HB2  ALA  65           HB2      ALA  65  -1.067   6.016  -3.972
  521    HB3  ALA  65           HB3      ALA  65  -1.439   4.816  -2.735
  522    H    TRP  66           HN       TRP  66  -4.680   5.026  -4.181
  523    HA   TRP  66           HA       TRP  66  -5.510   2.871  -2.505
  524    HB2  TRP  66           HB2      TRP  66  -7.076   4.716  -4.340
  525    HB3  TRP  66           HB1      TRP  66  -7.855   3.571  -3.256
  526    HD1  TRP  66           HD1      TRP  66  -4.956   4.736  -1.355
  527    HE1  TRP  66           HE1      TRP  66  -5.601   6.646   0.230
  528    HE3  TRP  66           HE3      TRP  66  -9.488   6.047  -3.327
  529    HZ2  TRP  66           HZ2      TRP  66  -7.720   8.507   0.616
  530    HZ3  TRP  66           HZ3      TRP  66 -10.796   7.920  -2.316
  531    HH2  TRP  66           HH2      TRP  66  -9.912   9.140  -0.356
  532    H    ALA  67           HN       ALA  67  -5.744   3.282  -6.039
  533    HA   ALA  67           HA       ALA  67  -7.204   0.913  -6.586
  534    HB1  ALA  67           HB1      ALA  67  -5.034   2.212  -8.263
  535    HB2  ALA  67           HB2      ALA  67  -6.743   2.642  -8.290
  536    HB3  ALA  67           HB3      ALA  67  -6.225   1.051  -8.849
  537    H    MET  68           HN       MET  68  -3.708   1.412  -6.177
  538    HA   MET  68           HA       MET  68  -3.049  -1.376  -6.757
  539    HB2  MET  68           HB2      MET  68  -1.511   0.974  -5.614
  540    HB3  MET  68           HB1      MET  68  -0.795  -0.636  -5.680
  541    HG2  MET  68           HG2      MET  68  -1.098  -0.712  -8.105
  542    HG3  MET  68           HG1      MET  68  -1.921   0.845  -8.080
  543    HE1  MET  68           HE1      MET  68   1.255  -1.019  -8.496
  544    HE2  MET  68           HE2      MET  68   1.345  -0.900  -6.740
  545    HE3  MET  68           HE3      MET  68   2.535  -0.064  -7.735
  546    H    ALA  69           HN       ALA  69  -3.753   0.515  -3.870
  547    HA   ALA  69           HA       ALA  69  -2.824  -1.356  -1.924
  548    HB1  ALA  69           HB1      ALA  69  -3.522   1.038  -1.494
  549    HB2  ALA  69           HB2      ALA  69  -4.195  -0.123  -0.350
  550    HB3  ALA  69           HB3      ALA  69  -5.198   0.515  -1.651
  551    H    VAL  70           HN       VAL  70  -5.916  -1.081  -3.646
  552    HA   VAL  70           HA       VAL  70  -7.198  -3.221  -2.112
  553    HB   VAL  70           HB       VAL  70  -7.928  -2.009  -4.802
  554   HG11  VAL  70          HG11      VAL  70  -9.062  -4.134  -4.537
  555   HG12  VAL  70          HG12      VAL  70 -10.232  -2.874  -4.152
  556   HG13  VAL  70          HG13      VAL  70  -9.449  -3.777  -2.854
  557   HG21  VAL  70          HG21      VAL  70  -9.454  -0.599  -3.508
  558   HG22  VAL  70          HG22      VAL  70  -7.819  -0.398  -2.875
  559   HG23  VAL  70          HG23      VAL  70  -8.979  -1.407  -2.014
  560    H    TRP  71           HN       TRP  71  -5.998  -3.042  -5.493
  561    HA   TRP  71           HA       TRP  71  -6.458  -5.740  -6.142
  562    HB2  TRP  71           HB2      TRP  71  -5.783  -4.000  -7.797
  563    HB3  TRP  71           HB1      TRP  71  -4.151  -4.020  -7.132
  564    HD1  TRP  71           HD1      TRP  71  -6.535  -6.022  -9.291
  565    HE1  TRP  71           HE1      TRP  71  -5.254  -7.984 -10.370
  566    HE3  TRP  71           HE3      TRP  71  -2.114  -5.676  -6.770
  567    HZ2  TRP  71           HZ2      TRP  71  -2.687  -9.239 -10.183
  568    HZ3  TRP  71           HZ3      TRP  71  -0.269  -7.259  -7.234
  569    HH2  TRP  71           HH2      TRP  71  -0.548  -9.041  -8.939
  570    H    ILE  72           HN       ILE  72  -3.810  -4.368  -4.213
  571    HA   ILE  72           HA       ILE  72  -2.199  -6.810  -4.372
  572    HB   ILE  72           HB       ILE  72  -2.086  -4.347  -2.597
  573   HG12  ILE  72          HG12      ILE  72  -0.048  -5.550  -4.505
  574   HG13  ILE  72          HG11      ILE  72  -1.230  -4.345  -4.994
  575   HG21  ILE  72          HG21      ILE  72  -1.388  -6.074  -1.077
  576   HG22  ILE  72          HG22      ILE  72   0.094  -5.359  -1.702
  577   HG23  ILE  72          HG23      ILE  72  -0.472  -6.903  -2.336
  578   HD11  ILE  72          HD11      ILE  72  -0.267  -2.675  -3.588
  579   HD12  ILE  72          HD12      ILE  72   1.094  -3.472  -4.369
  580   HD13  ILE  72          HD13      ILE  72   0.690  -3.862  -2.701
  581    H    PHE  73           HN       PHE  73  -4.624  -5.606  -1.968
  582    HA   PHE  73           HA       PHE  73  -4.218  -7.677  -0.066
  583    HB2  PHE  73           HB2      PHE  73  -6.947  -6.567  -0.771
  584    HB3  PHE  73           HB1      PHE  73  -6.405  -7.183   0.785
  585    HD1  PHE  73           HD1      PHE  73  -3.617  -5.674   0.751
  586    HD2  PHE  73           HD2      PHE  73  -7.671  -4.414   0.009
  587    HE1  PHE  73           HE1      PHE  73  -3.039  -3.385   1.447
  588    HE2  PHE  73           HE2      PHE  73  -7.069  -2.119   0.708
  589    HZ   PHE  73           HZ       PHE  73  -4.758  -1.606   1.430
  590    H    ALA  74           HN       ALA  74  -6.389  -7.679  -2.922
  591    HA   ALA  74           HA       ALA  74  -7.417 -10.306  -2.483
  592    HB1  ALA  74           HB1      ALA  74  -8.387  -8.723  -4.125
  593    HB2  ALA  74           HB2      ALA  74  -7.989 -10.263  -4.888
  594    HB3  ALA  74           HB3      ALA  74  -6.935  -8.867  -5.116
  595    H    ALA  75           HN       ALA  75  -4.364  -9.189  -3.811
  596    HA   ALA  75           HA       ALA  75  -3.631 -11.620  -5.147
  597    HB1  ALA  75           HB1      ALA  75  -1.733  -9.639  -3.847
  598    HB2  ALA  75           HB2      ALA  75  -2.503  -9.363  -5.409
  599    HB3  ALA  75           HB3      ALA  75  -1.393 -10.718  -5.201
  600    H    ILE  76           HN       ILE  76  -2.902 -10.444  -1.836
  601    HA   ILE  76           HA       ILE  76  -1.607 -13.004  -1.159
  602    HB   ILE  76           HB       ILE  76  -1.967 -11.664   1.282
  603   HG12  ILE  76          HG12      ILE  76  -1.558  -9.546  -0.864
  604   HG13  ILE  76          HG11      ILE  76  -3.044  -9.768   0.052
  605   HG21  ILE  76          HG21      ILE  76   0.366 -10.986   1.077
  606   HG22  ILE  76          HG22      ILE  76   0.304 -11.171  -0.674
  607   HG23  ILE  76          HG23      ILE  76   0.165 -12.584   0.368
  608   HD11  ILE  76          HD11      ILE  76  -0.329  -8.941   1.109
  609   HD12  ILE  76          HD12      ILE  76  -1.642  -9.460   2.166
  610   HD13  ILE  76          HD13      ILE  76  -1.833  -8.025   1.162
  611    H    ASN  77           HN       ASN  77  -4.581 -12.675  -1.900
  612    HA   ASN  77           HA       ASN  77  -6.598 -13.669  -1.267
  613    HB2  ASN  77           HB2      ASN  77  -4.967 -15.656  -1.174
  614    HB3  ASN  77           HB1      ASN  77  -4.894 -15.399   0.569
  615   HD21  ASN  77          HD21      ASN  77  -6.180 -17.610  -1.210
  616   HD22  ASN  77          HD22      ASN  77  -7.754 -17.745  -0.588
  617    H    ARG  78           HN       ARG  78  -6.882 -11.501  -0.131
  618    HA   ARG  78           HA       ARG  78  -7.673 -12.013   2.682
  619    HB2  ARG  78           HB2      ARG  78  -5.777  -9.782   1.863
  620    HB3  ARG  78           HB1      ARG  78  -6.595  -9.871   3.424
  621    HG2  ARG  78           HG2      ARG  78  -5.529 -12.172   3.721
  622    HG3  ARG  78           HG1      ARG  78  -4.554 -11.810   2.297
  623    HD2  ARG  78           HD2      ARG  78  -3.682  -9.784   3.418
  624    HD3  ARG  78           HD1      ARG  78  -4.638 -10.175   4.848
  625    HE   ARG  78           HE       ARG  78  -3.126 -12.466   4.381
  626   HH11  ARG  78          HH21      ARG  78  -2.525  -9.098   4.845
  627   HH12  ARG  78          HH22      ARG  78  -0.967  -9.342   5.562
  628   HH21  ARG  78          HH11      ARG  78  -1.098 -12.798   5.312
  629   HH22  ARG  78          HH12      ARG  78  -0.160 -11.435   5.826
  630    H    ARG  79           HN       ARG  79  -9.176 -11.710   0.308
  631    HA   ARG  79           HA       ARG  79 -10.128  -9.191  -0.391
  632    HB2  ARG  79           HB2      ARG  79 -11.824 -11.659   0.086
  633    HB3  ARG  79           HB1      ARG  79 -12.269 -10.273  -0.910
  634    HG2  ARG  79           HG2      ARG  79 -10.397 -10.709  -2.418
  635    HG3  ARG  79           HG1      ARG  79  -9.849 -12.036  -1.393
  636    HD2  ARG  79           HD2      ARG  79 -11.159 -12.829  -3.362
  637    HD3  ARG  79           HD1      ARG  79 -11.904 -13.276  -1.827
  638    HE   ARG  79           HE       ARG  79 -13.092 -10.848  -2.472
  639   HH11  ARG  79          HH21      ARG  79 -12.641 -13.904  -4.017
  640   HH12  ARG  79          HH22      ARG  79 -14.105 -13.800  -4.938
  641   HH21  ARG  79          HH11      ARG  79 -15.000 -10.701  -3.666
  642   HH22  ARG  79          HH12      ARG  79 -15.439 -11.989  -4.740
  643    H    ASP  80           HN       ASP  80 -10.685 -10.907   2.629
  644    HA   ASP  80           HA       ASP  80 -12.944  -9.532   3.608
  645    HB2  ASP  80           HB2      ASP  80 -10.472 -10.484   5.092
  646    HB3  ASP  80           HB1      ASP  80 -11.954  -9.953   5.887
  647    H    LEU  81           HN       LEU  81  -9.658  -8.415   3.179
  648    HA   LEU  81           HA       LEU  81  -9.914  -6.076   4.879
  649    HB2  LEU  81           HB2      LEU  81  -7.780  -7.359   3.705
  650    HB3  LEU  81           HB1      LEU  81  -7.936  -5.989   2.616
  651    HG   LEU  81           HG       LEU  81  -7.656  -5.816   5.637
  652   HD11  LEU  81          HD11      LEU  81  -5.705  -5.187   3.400
  653   HD12  LEU  81          HD12      LEU  81  -5.597  -6.559   4.503
  654   HD13  LEU  81          HD13      LEU  81  -5.415  -4.916   5.118
  655   HD21  LEU  81          HD21      LEU  81  -8.913  -3.913   4.880
  656   HD22  LEU  81          HD22      LEU  81  -7.890  -3.714   3.458
  657   HD23  LEU  81          HD23      LEU  81  -7.255  -3.356   5.063
  658    H    TYR  82           HN       TYR  82 -10.810  -6.830   1.557
  659    HA   TYR  82           HA       TYR  82 -11.064  -4.061   0.713
  660    HB2  TYR  82           HB2      TYR  82 -10.850  -5.605  -1.077
  661    HB3  TYR  82           HB1      TYR  82 -12.008  -6.720  -0.372
  662    HD1  TYR  82           HD2      TYR  82 -12.255  -3.015  -1.018
  663    HD2  TYR  82           HD1      TYR  82 -13.784  -6.930  -1.945
  664    HE1  TYR  82           HE2      TYR  82 -14.048  -1.996  -2.384
  665    HE2  TYR  82           HE1      TYR  82 -15.573  -5.900  -3.310
  666    HH   TYR  82           HH       TYR  82 -15.576  -2.505  -4.085
  667    H    GLU  83           HN       GLU  83 -13.181  -6.433   2.260
  668    HA   GLU  83           HA       GLU  83 -15.618  -4.943   1.968
  669    HB2  GLU  83           HB2      GLU  83 -14.763  -6.961   4.069
  670    HB3  GLU  83           HB1      GLU  83 -16.403  -6.336   3.903
  671    HG2  GLU  83           HG2      GLU  83 -16.495  -7.192   1.588
  672    HG3  GLU  83           HG1      GLU  83 -14.858  -7.826   1.760
  673    H    LYS  84           HN       LYS  84 -13.157  -5.024   4.558
  674    HA   LYS  84           HA       LYS  84 -14.531  -3.022   6.169
  675    HB2  LYS  84           HB2      LYS  84 -12.929  -4.718   7.090
  676    HB3  LYS  84           HB1      LYS  84 -11.623  -3.867   6.269
  677    HG2  LYS  84           HG2      LYS  84 -12.077  -1.842   7.546
  678    HG3  LYS  84           HG1      LYS  84 -13.487  -2.595   8.294
  679    HD2  LYS  84           HD2      LYS  84 -12.032  -4.296   9.334
  680    HD3  LYS  84           HD1      LYS  84 -10.621  -3.548   8.585
  681    HE2  LYS  84           HE2      LYS  84 -11.152  -1.429   9.791
  682    HE3  LYS  84           HE1      LYS  84 -12.480  -2.258  10.604
  683    HZ1  LYS  84           HZ1      LYS  84 -10.701  -2.425  12.074
  684    HZ2  LYS  84           HZ2      LYS  84  -9.577  -2.756  10.843
  685    HZ3  LYS  84           HZ3      LYS  84 -10.715  -3.932  11.297
  686    H    ALA  85           HN       ALA  85 -11.772  -2.983   3.908
  687    HA   ALA  85           HA       ALA  85 -10.969  -0.303   4.223
  688    HB1  ALA  85           HB1      ALA  85 -10.081  -0.447   1.950
  689    HB2  ALA  85           HB2      ALA  85 -11.114  -1.835   1.610
  690    HB3  ALA  85           HB3      ALA  85  -9.803  -1.977   2.781
  691    H    LYS  86           HN       LYS  86 -13.718  -1.647   2.501
  692    HA   LYS  86           HA       LYS  86 -14.435   0.805   1.136
  693    HB2  LYS  86           HB2      LYS  86 -15.248  -1.546   0.519
  694    HB3  LYS  86           HB1      LYS  86 -16.342  -1.446   1.899
  695    HG2  LYS  86           HG2      LYS  86 -17.223   0.727   0.907
  696    HG3  LYS  86           HG1      LYS  86 -16.287   0.356  -0.540
  697    HD2  LYS  86           HD2      LYS  86 -18.410  -1.451   0.665
  698    HD3  LYS  86           HD1      LYS  86 -18.658  -0.394  -0.722
  699    HE2  LYS  86           HE2      LYS  86 -16.638  -1.653  -1.787
  700    HE3  LYS  86           HE1      LYS  86 -16.926  -2.866  -0.539
  701    HZ1  LYS  86           HZ1      LYS  86 -18.151  -3.450  -2.483
  702    HZ2  LYS  86           HZ2      LYS  86 -18.859  -1.908  -2.574
  703    HZ3  LYS  86           HZ3      LYS  86 -19.257  -2.954  -1.296
  704    H    ARG  87           HN       ARG  87 -14.982  -0.465   4.371
  705    HA   ARG  87           HA       ARG  87 -17.122   1.451   4.989
  706    HB2  ARG  87           HB2      ARG  87 -16.901  -0.800   6.089
  707    HB3  ARG  87           HB1      ARG  87 -15.446  -0.214   6.894
  708    HG2  ARG  87           HG2      ARG  87 -16.732   1.576   7.971
  709    HG3  ARG  87           HG1      ARG  87 -18.191   1.058   7.126
  710    HD2  ARG  87           HD2      ARG  87 -18.226   0.139   9.378
  711    HD3  ARG  87           HD1      ARG  87 -17.976  -1.178   8.231
  712    HE   ARG  87           HE       ARG  87 -15.404  -0.405   8.930
  713   HH11  ARG  87          HH21      ARG  87 -18.268  -1.353  10.613
  714   HH12  ARG  87          HH22      ARG  87 -17.408  -2.064  11.938
  715   HH21  ARG  87          HH11      ARG  87 -14.275  -1.329  10.651
  716   HH22  ARG  87          HH12      ARG  87 -15.151  -2.050  11.960
  717    H    ASP  88           HN       ASP  88 -13.613   1.314   5.302
  718    HA   ASP  88           HA       ASP  88 -13.580   3.841   6.907
  719    HB2  ASP  88           HB2      ASP  88 -12.109   1.867   7.537
  720    HB3  ASP  88           HB1      ASP  88 -11.240   2.110   6.022
  721    H    GLU  89           HN       GLU  89 -13.607   2.894   3.690
  722    HA   GLU  89           HA       GLU  89 -11.651   4.480   2.420
  723    HB2  GLU  89           HB2      GLU  89 -13.068   2.885   1.223
  724    HB3  GLU  89           HB1      GLU  89 -14.494   3.855   1.563
  725    HG2  GLU  89           HG2      GLU  89 -13.667   4.203  -0.747
  726    HG3  GLU  89           HG1      GLU  89 -13.599   5.692   0.189
  727    HA   PRO  90           HA       PRO  90 -13.441   8.407   3.982
  728    HB2  PRO  90           HB2      PRO  90 -11.515  10.022   2.534
  729    HB3  PRO  90           HB1      PRO  90 -11.519   9.654   4.267
  730    HG2  PRO  90           HG2      PRO  90  -9.722   8.594   2.232
  731    HG3  PRO  90           HG1      PRO  90  -9.695   8.277   3.973
  732    HD2  PRO  90           HD2      PRO  90 -10.556   6.474   1.862
  733    HD3  PRO  90           HD1      PRO  90 -10.524   6.159   3.610
  734    H    LYS  91           HN       LYS  91 -14.839   9.933   2.980
  735    HA   LYS  91           HA       LYS  91 -14.826  10.432   0.132
  736    HB2  LYS  91           HB2      LYS  91 -15.805   7.996   0.525
  737    HB3  LYS  91           HB1      LYS  91 -17.260   8.854   1.016
  738    HG2  LYS  91           HG2      LYS  91 -15.847   9.029  -1.666
  739    HG3  LYS  91           HG1      LYS  91 -17.434   8.333  -1.343
  740    HD2  LYS  91           HD2      LYS  91 -18.126  10.668  -0.513
  741    HD3  LYS  91           HD1      LYS  91 -16.624  11.254  -1.230
  742    HE2  LYS  91           HE2      LYS  91 -18.887   9.849  -2.676
  743    HE3  LYS  91           HE1      LYS  91 -18.411  11.538  -2.847
  744    HZ1  LYS  91           HZ1      LYS  91 -17.401  10.471  -4.631
  745    HZ2  LYS  91           HZ2      LYS  91 -16.956   9.117  -3.707
  746    HZ3  LYS  91           HZ3      LYS  91 -16.150  10.597  -3.493
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1  -8.006  18.449  10.670
    2    H2   MET   1           HT2      MET   1  -9.426  18.486  11.604
    3    H3   MET   1           HT3      MET   1  -9.004  17.079  10.748
    4    HA   MET   1           HA       MET   1  -6.968  17.985  12.575
    5    HB2  MET   1           HB2      MET   1  -8.200  17.121  14.569
    6    HB3  MET   1           HB1      MET   1  -8.914  18.594  13.916
    7    HG2  MET   1           HG2      MET   1 -10.552  17.187  12.652
    8    HG3  MET   1           HG1      MET   1  -9.888  15.759  13.441
    9    HE1  MET   1           HE1      MET   1 -11.054  15.781  16.962
   10    HE2  MET   1           HE2      MET   1  -9.463  15.919  16.220
   11    HE3  MET   1           HE3      MET   1 -10.662  14.835  15.521
   12    H    ALA   2           HN       ALA   2  -7.632  16.088  10.287
   13    HA   ALA   2           HA       ALA   2  -6.237  13.776  11.377
   14    HB1  ALA   2           HB1      ALA   2  -9.158  13.516  10.600
   15    HB2  ALA   2           HB2      ALA   2  -8.457  13.200  12.186
   16    HB3  ALA   2           HB3      ALA   2  -8.069  12.149  10.825
   17    H    SER   3           HN       SER   3  -4.789  14.021   9.664
   18    HA   SER   3           HA       SER   3  -5.702  14.324   6.902
   19    HB2  SER   3           HB2      SER   3  -2.995  13.804   8.175
   20    HB3  SER   3           HB1      SER   3  -3.205  13.896   6.426
   21    HG   SER   3           HG       SER   3  -4.416  15.971   7.164
   22    H    THR   4           HN       THR   4  -5.855  12.708   5.353
   23    HA   THR   4           HA       THR   4  -6.361  10.019   6.193
   24    HB   THR   4           HB       THR   4  -5.588  10.920   3.393
   25    HG1  THR   4           HG1      THR   4  -7.981  11.097   4.866
   26   HG21  THR   4          HG21      THR   4  -7.087   9.029   2.748
   27   HG22  THR   4          HG22      THR   4  -7.225   8.599   4.451
   28   HG23  THR   4          HG23      THR   4  -5.661   8.503   3.641
   29    H    ARG   5           HN       ARG   5  -3.427  11.684   5.482
   30    HA   ARG   5           HA       ARG   5  -1.797   9.478   4.667
   31    HB2  ARG   5           HB2      ARG   5  -1.145  11.906   4.541
   32    HB3  ARG   5           HB1      ARG   5  -0.940  11.894   6.293
   33    HG2  ARG   5           HG2      ARG   5   0.775  10.158   6.112
   34    HG3  ARG   5           HG1      ARG   5   0.531  10.068   4.368
   35    HD2  ARG   5           HD2      ARG   5   2.502  11.460   4.956
   36    HD3  ARG   5           HD1      ARG   5   1.261  12.393   4.119
   37    HE   ARG   5           HE       ARG   5   0.662  12.741   6.809
   38   HH11  ARG   5          HH21      ARG   5   3.433  13.157   4.789
   39   HH12  ARG   5          HH22      ARG   5   4.079  14.463   5.725
   40   HH21  ARG   5          HH11      ARG   5   1.495  14.442   8.036
   41   HH22  ARG   5          HH12      ARG   5   2.983  15.189   7.561
   42    H    CYS   6           HN       CYS   6  -2.691  10.740   7.858
   43    HA   CYS   6           HA       CYS   6  -0.968   8.913   9.319
   44    HB2  CYS   6           HB2      CYS   6  -3.336  10.608  10.162
   45    HB3  CYS   6           HB1      CYS   6  -2.358   9.664  11.286
   46    HG   CYS   6           HG       CYS   6  -0.527  11.340  11.116
   47    H    LYS   7           HN       LYS   7  -4.451   8.941   8.489
   48    HA   LYS   7           HA       LYS   7  -5.047   6.514   9.930
   49    HB2  LYS   7           HB2      LYS   7  -6.434   8.032   7.705
   50    HB3  LYS   7           HB1      LYS   7  -7.071   6.487   8.271
   51    HG2  LYS   7           HG2      LYS   7  -7.189   7.384  10.576
   52    HG3  LYS   7           HG1      LYS   7  -6.577   8.935  10.001
   53    HD2  LYS   7           HD2      LYS   7  -8.526   9.312   8.650
   54    HD3  LYS   7           HD1      LYS   7  -9.090   7.655   8.878
   55    HE2  LYS   7           HE2      LYS   7 -10.240   9.458  10.317
   56    HE3  LYS   7           HE1      LYS   7  -9.629   8.042  11.175
   57    HZ1  LYS   7           HZ1      LYS   7  -7.758  10.238  10.842
   58    HZ2  LYS   7           HZ2      LYS   7  -8.023   9.224  12.179
   59    HZ3  LYS   7           HZ3      LYS   7  -9.064  10.534  11.883
   60    H    LEU   8           HN       LEU   8  -4.468   7.089   6.430
   61    HA   LEU   8           HA       LEU   8  -4.628   4.367   5.627
   62    HB2  LEU   8           HB2      LEU   8  -4.345   6.551   4.198
   63    HB3  LEU   8           HB1      LEU   8  -2.619   6.283   4.406
   64    HG   LEU   8           HG       LEU   8  -3.247   3.790   3.593
   65   HD11  LEU   8          HD11      LEU   8  -5.417   5.498   2.326
   66   HD12  LEU   8          HD12      LEU   8  -5.681   4.190   3.477
   67   HD13  LEU   8          HD13      LEU   8  -5.029   3.839   1.878
   68   HD21  LEU   8          HD21      LEU   8  -3.027   6.185   1.736
   69   HD22  LEU   8          HD22      LEU   8  -2.798   4.507   1.241
   70   HD23  LEU   8          HD23      LEU   8  -1.688   5.246   2.396
   71    H    ALA   9           HN       ALA   9  -1.982   6.126   7.151
   72    HA   ALA   9           HA       ALA   9   0.046   4.138   6.711
   73    HB1  ALA   9           HB1      ALA   9   1.296   5.294   8.444
   74    HB2  ALA   9           HB2      ALA   9  -0.169   6.089   9.021
   75    HB3  ALA   9           HB3      ALA   9   0.490   6.496   7.436
   76    H    ARG  10           HN       ARG  10  -2.513   4.497   9.083
   77    HA   ARG  10           HA       ARG  10  -1.489   2.501  10.929
   78    HB2  ARG  10           HB2      ARG  10  -4.238   3.725  10.542
   79    HB3  ARG  10           HB1      ARG  10  -3.891   2.537  11.798
   80    HG2  ARG  10           HG2      ARG  10  -2.109   4.023  12.685
   81    HG3  ARG  10           HG1      ARG  10  -2.515   5.227  11.469
   82    HD2  ARG  10           HD2      ARG  10  -4.976   4.939  12.499
   83    HD3  ARG  10           HD1      ARG  10  -4.072   4.420  13.919
   84    HE   ARG  10           HE       ARG  10  -4.445   7.109  13.076
   85   HH11  ARG  10          HH21      ARG  10  -1.894   5.015  14.099
   86   HH12  ARG  10          HH22      ARG  10  -0.807   6.311  14.452
   87   HH21  ARG  10          HH11      ARG  10  -3.046   8.794  13.558
   88   HH22  ARG  10          HH12      ARG  10  -1.460   8.445  14.157
   89    H    TYR  11           HN       TYR  11  -3.575   2.423   8.084
   90    HA   TYR  11           HA       TYR  11  -4.521  -0.281   8.487
   91    HB2  TYR  11           HB2      TYR  11  -4.413   1.602   6.118
   92    HB3  TYR  11           HB1      TYR  11  -4.885  -0.078   5.874
   93    HD1  TYR  11           HD1      TYR  11  -6.900  -0.999   6.986
   94    HD2  TYR  11           HD2      TYR  11  -5.898   3.163   7.251
   95    HE1  TYR  11           HE1      TYR  11  -9.203  -0.499   7.755
   96    HE2  TYR  11           HE2      TYR  11  -8.197   3.671   8.020
   97    HH   TYR  11           HH       TYR  11 -10.700   1.179   8.094
   98    H    LEU  12           HN       LEU  12  -1.963   1.042   6.339
   99    HA   LEU  12           HA       LEU  12  -1.039  -1.501   5.452
  100    HB2  LEU  12           HB2      LEU  12  -0.398   0.610   4.346
  101    HB3  LEU  12           HB1      LEU  12   0.439   1.137   5.797
  102    HG   LEU  12           HG       LEU  12   1.954  -1.018   5.451
  103   HD11  LEU  12          HD11      LEU  12   0.658  -2.159   3.735
  104   HD12  LEU  12          HD12      LEU  12   2.161  -1.611   3.009
  105   HD13  LEU  12          HD13      LEU  12   0.666  -0.727   2.708
  106   HD21  LEU  12          HD21      LEU  12   2.061   1.313   3.505
  107   HD22  LEU  12          HD22      LEU  12   3.401   0.231   3.883
  108   HD23  LEU  12          HD23      LEU  12   2.746   1.292   5.130
  109    H    GLU  13           HN       GLU  13  -0.455   0.334   8.372
  110    HA   GLU  13           HA       GLU  13   1.750  -1.411   9.279
  111    HB2  GLU  13           HB2      GLU  13   0.217   0.865  10.580
  112    HB3  GLU  13           HB1      GLU  13   1.373  -0.107  11.484
  113    HG2  GLU  13           HG2      GLU  13   3.146   0.482   9.877
  114    HG3  GLU  13           HG1      GLU  13   2.000   1.454   8.955
  115    H    ASP  14           HN       ASP  14  -1.722  -1.279   9.515
  116    HA   ASP  14           HA       ASP  14  -2.061  -2.854  11.880
  117    HB2  ASP  14           HB2      ASP  14  -3.921  -1.627  10.796
  118    HB3  ASP  14           HB1      ASP  14  -3.846  -2.731   9.422
  119    H    LEU  15           HN       LEU  15  -0.437  -3.693   9.113
  120    HA   LEU  15           HA       LEU  15  -1.359  -6.523   9.014
  121    HB2  LEU  15           HB2      LEU  15   0.987  -5.239   7.576
  122    HB3  LEU  15           HB1      LEU  15   0.231  -6.785   7.203
  123    HG   LEU  15           HG       LEU  15  -1.051  -4.045   6.944
  124   HD11  LEU  15          HD11      LEU  15   0.560  -4.522   5.177
  125   HD12  LEU  15          HD12      LEU  15  -1.069  -4.670   4.517
  126   HD13  LEU  15          HD13      LEU  15  -0.146  -6.117   4.918
  127   HD21  LEU  15          HD21      LEU  15  -2.875  -5.491   5.760
  128   HD22  LEU  15          HD22      LEU  15  -2.855  -5.487   7.518
  129   HD23  LEU  15          HD23      LEU  15  -2.169  -6.852   6.634
  130    H    GLU  16           HN       GLU  16   0.201  -8.281   9.346
  131    HA   GLU  16           HA       GLU  16   1.628  -8.011  11.821
  132    HB2  GLU  16           HB2      GLU  16   0.647 -10.151  10.852
  133    HB3  GLU  16           HB1      GLU  16   2.009 -10.184   9.733
  134    HG2  GLU  16           HG2      GLU  16   2.602 -11.584  11.601
  135    HG3  GLU  16           HG1      GLU  16   3.546 -10.106  11.754
  136    H    ASP  17           HN       ASP  17   3.931  -8.011  12.164
  137    HA   ASP  17           HA       ASP  17   5.458  -6.300  10.544
  138    HB2  ASP  17           HB2      ASP  17   6.053  -6.955  12.872
  139    HB3  ASP  17           HB1      ASP  17   6.520  -8.549  12.278
  140    H    VAL  18           HN       VAL  18   5.464  -9.881  10.538
  141    HA   VAL  18           HA       VAL  18   7.370 -10.084   8.389
  142    HB   VAL  18           HB       VAL  18   6.832 -11.954   9.962
  143   HG11  VAL  18          HG11      VAL  18   4.803 -13.235   9.719
  144   HG12  VAL  18          HG12      VAL  18   4.311 -12.311   8.301
  145   HG13  VAL  18          HG13      VAL  18   4.318 -11.550   9.891
  146   HG21  VAL  18          HG21      VAL  18   6.955 -13.714   8.262
  147   HG22  VAL  18          HG22      VAL  18   7.921 -12.334   7.737
  148   HG23  VAL  18          HG23      VAL  18   6.326 -12.613   7.038
  149    H    ASP  19           HN       ASP  19   3.813  -9.913   8.479
  150    HA   ASP  19           HA       ASP  19   3.407 -10.467   5.695
  151    HB2  ASP  19           HB2      ASP  19   1.568 -10.479   7.368
  152    HB3  ASP  19           HB1      ASP  19   1.727  -8.731   7.537
  153    H    LEU  20           HN       LEU  20   4.364  -7.585   7.452
  154    HA   LEU  20           HA       LEU  20   3.863  -5.700   5.345
  155    HB2  LEU  20           HB2      LEU  20   4.335  -5.139   7.779
  156    HB3  LEU  20           HB1      LEU  20   6.018  -5.555   7.477
  157    HG   LEU  20           HG       LEU  20   5.874  -3.802   5.521
  158   HD11  LEU  20          HD11      LEU  20   3.474  -3.404   5.499
  159   HD12  LEU  20          HD12      LEU  20   4.264  -1.935   6.056
  160   HD13  LEU  20          HD13      LEU  20   3.479  -3.003   7.215
  161   HD21  LEU  20          HD21      LEU  20   6.399  -1.955   7.105
  162   HD22  LEU  20          HD22      LEU  20   7.223  -3.453   7.538
  163   HD23  LEU  20          HD23      LEU  20   5.792  -2.944   8.432
  164    H    LYS  21           HN       LYS  21   6.565  -7.799   6.172
  165    HA   LYS  21           HA       LYS  21   8.477  -6.764   4.321
  166    HB2  LYS  21           HB2      LYS  21   8.990  -8.366   6.168
  167    HB3  LYS  21           HB1      LYS  21   8.147  -9.627   5.268
  168    HG2  LYS  21           HG2      LYS  21   9.732  -9.444   3.431
  169    HG3  LYS  21           HG1      LYS  21  10.525  -8.073   4.208
  170    HD2  LYS  21           HD2      LYS  21  11.250  -9.467   6.058
  171    HD3  LYS  21           HD1      LYS  21  10.322 -10.835   5.447
  172    HE2  LYS  21           HE2      LYS  21  12.677 -11.102   4.844
  173    HE3  LYS  21           HE1      LYS  21  11.715 -10.833   3.391
  174    HZ1  LYS  21           HZ1      LYS  21  12.542  -8.363   4.489
  175    HZ2  LYS  21           HZ2      LYS  21  12.866  -9.009   2.952
  176    HZ3  LYS  21           HZ3      LYS  21  13.892  -9.363   4.259
  177    H    LYS  22           HN       LYS  22   5.997  -9.298   3.986
  178    HA   LYS  22           HA       LYS  22   6.695 -10.138   1.354
  179    HB2  LYS  22           HB2      LYS  22   4.882 -11.061   3.061
  180    HB3  LYS  22           HB1      LYS  22   3.780  -9.987   2.199
  181    HG2  LYS  22           HG2      LYS  22   4.382 -11.084   0.069
  182    HG3  LYS  22           HG1      LYS  22   5.484 -12.160   0.929
  183    HD2  LYS  22           HD2      LYS  22   3.530 -12.941   2.312
  184    HD3  LYS  22           HD1      LYS  22   2.476 -11.986   1.269
  185    HE2  LYS  22           HE2      LYS  22   3.191 -13.273  -0.686
  186    HE3  LYS  22           HE1      LYS  22   4.330 -14.185   0.306
  187    HZ1  LYS  22           HZ1      LYS  22   1.953 -14.427   1.618
  188    HZ2  LYS  22           HZ2      LYS  22   2.671 -15.605   0.626
  189    HZ3  LYS  22           HZ3      LYS  22   1.512 -14.541  -0.016
  190    H    PHE  23           HN       PHE  23   4.592  -7.485   2.439
  191    HA   PHE  23           HA       PHE  23   3.610  -6.655  -0.102
  192    HB2  PHE  23           HB2      PHE  23   2.926  -5.787   2.199
  193    HB3  PHE  23           HB1      PHE  23   4.380  -4.796   2.177
  194    HD1  PHE  23           HD1      PHE  23   4.720  -3.142   0.259
  195    HD2  PHE  23           HD2      PHE  23   0.959  -5.078   1.029
  196    HE1  PHE  23           HE1      PHE  23   3.555  -1.424  -1.093
  197    HE2  PHE  23           HE2      PHE  23  -0.202  -3.358  -0.328
  198    HZ   PHE  23           HZ       PHE  23   1.096  -1.531  -1.388
  199    H    LYS  24           HN       LYS  24   6.695  -6.006   1.505
  200    HA   LYS  24           HA       LYS  24   7.621  -4.015  -0.353
  201    HB2  LYS  24           HB2      LYS  24   8.596  -4.369   1.904
  202    HB3  LYS  24           HB1      LYS  24   9.219  -5.931   1.371
  203    HG2  LYS  24           HG2      LYS  24  10.636  -4.868  -0.290
  204    HG3  LYS  24           HG1      LYS  24   9.918  -3.292   0.049
  205    HD2  LYS  24           HD2      LYS  24  10.843  -3.280   2.287
  206    HD3  LYS  24           HD1      LYS  24  11.405  -4.943   2.113
  207    HE2  LYS  24           HE2      LYS  24  13.220  -3.248   1.784
  208    HE3  LYS  24           HE1      LYS  24  12.976  -4.291   0.381
  209    HZ1  LYS  24           HZ1      LYS  24  11.529  -2.538  -0.550
  210    HZ2  LYS  24           HZ2      LYS  24  13.140  -2.039  -0.354
  211    HZ3  LYS  24           HZ3      LYS  24  11.950  -1.529   0.745
  212    H    MET  25           HN       MET  25   7.964  -7.551  -0.215
  213    HA   MET  25           HA       MET  25   9.743  -7.682  -2.513
  214    HB2  MET  25           HB2      MET  25   8.197  -9.667  -0.859
  215    HB3  MET  25           HB1      MET  25   8.782 -10.204  -2.431
  216    HG2  MET  25           HG2      MET  25  11.086  -9.517  -1.786
  217    HG3  MET  25           HG1      MET  25  10.494  -9.060  -0.192
  218    HE1  MET  25           HE1      MET  25   8.305 -11.678   0.445
  219    HE2  MET  25           HE2      MET  25   9.228 -10.433   1.284
  220    HE3  MET  25           HE3      MET  25   9.557 -12.132   1.607
  221    H    HIS  26           HN       HIS  26   6.224  -7.982  -2.082
  222    HA   HIS  26           HA       HIS  26   5.715  -8.729  -4.844
  223    HB2  HIS  26           HB2      HIS  26   3.980  -7.563  -2.636
  224    HB3  HIS  26           HB1      HIS  26   3.329  -7.897  -4.242
  225    HD1  HIS  26           HD1      HIS  26   5.936 -10.151  -2.759
  226    HD2  HIS  26           HD2      HIS  26   1.801 -10.111  -3.285
  227    HE1  HIS  26           HE1      HIS  26   5.125 -12.495  -2.243
  228    H    LEU  27           HN       LEU  27   6.096  -5.618  -3.193
  229    HA   LEU  27           HA       LEU  27   4.996  -4.028  -5.357
  230    HB2  LEU  27           HB2      LEU  27   5.391  -3.259  -2.952
  231    HB3  LEU  27           HB1      LEU  27   7.103  -3.163  -3.349
  232    HG   LEU  27           HG       LEU  27   6.301  -1.649  -5.366
  233   HD11  LEU  27          HD11      LEU  27   4.269  -0.303  -4.757
  234   HD12  LEU  27          HD12      LEU  27   3.934  -1.455  -3.468
  235   HD13  LEU  27          HD13      LEU  27   3.890  -1.976  -5.149
  236   HD21  LEU  27          HD21      LEU  27   6.399   0.359  -3.905
  237   HD22  LEU  27          HD22      LEU  27   7.652  -0.814  -3.497
  238   HD23  LEU  27          HD23      LEU  27   6.209  -0.678  -2.490
  239    H    GLU  28           HN       GLU  28   8.365  -4.852  -4.456
  240    HA   GLU  28           HA       GLU  28   9.487  -3.569  -6.802
  241    HB2  GLU  28           HB2      GLU  28  10.696  -5.706  -5.018
  242    HB3  GLU  28           HB1      GLU  28  11.575  -4.663  -6.136
  243    HG2  GLU  28           HG2      GLU  28  10.890  -2.680  -4.871
  244    HG3  GLU  28           HG1      GLU  28   9.938  -3.686  -3.778
  245    H    ASP  29           HN       ASP  29   8.302  -6.806  -6.086
  246    HA   ASP  29           HA       ASP  29   9.475  -8.043  -8.447
  247    HB2  ASP  29           HB2      ASP  29   8.800  -9.313  -6.398
  248    HB3  ASP  29           HB1      ASP  29   7.114  -8.972  -6.786
  249    H    TYR  30           HN       TYR  30   7.850  -5.565  -8.884
  250    HA   TYR  30           HA       TYR  30   5.348  -6.340 -10.072
  251    HB2  TYR  30           HB2      TYR  30   6.038  -4.006  -9.290
  252    HB3  TYR  30           HB1      TYR  30   6.968  -3.870 -10.781
  253    HD1  TYR  30           HD2      TYR  30   3.547  -4.495  -9.427
  254    HD2  TYR  30           HD1      TYR  30   5.868  -3.309 -12.844
  255    HE1  TYR  30           HE2      TYR  30   1.469  -3.859 -10.620
  256    HE2  TYR  30           HE1      TYR  30   3.787  -2.676 -14.035
  257    HH   TYR  30           HH       TYR  30   1.584  -2.357 -13.839
  258    HA   PRO  31           HA       PRO  31   7.213  -8.074 -13.782
  259    HB2  PRO  31           HB2      PRO  31   4.974  -7.714 -15.535
  260    HB3  PRO  31           HB1      PRO  31   5.337  -9.159 -14.580
  261    HG2  PRO  31           HG2      PRO  31   3.276  -7.087 -14.082
  262    HG3  PRO  31           HG1      PRO  31   3.402  -8.714 -13.394
  263    HD2  PRO  31           HD2      PRO  31   3.986  -6.287 -12.027
  264    HD3  PRO  31           HD1      PRO  31   4.420  -7.923 -11.482
  265    HA   PRO  32           HA       PRO  32   8.586  -4.565 -16.132
  266    HB2  PRO  32           HB2      PRO  32   8.579  -5.607 -18.788
  267    HB3  PRO  32           HB1      PRO  32   9.918  -5.713 -17.634
  268    HG2  PRO  32           HG2      PRO  32   8.021  -7.841 -18.472
  269    HG3  PRO  32           HG1      PRO  32   9.607  -8.006 -17.701
  270    HD2  PRO  32           HD2      PRO  32   7.106  -8.380 -16.406
  271    HD3  PRO  32           HD1      PRO  32   8.671  -8.159 -15.593
  272    H    GLN  33           HN       GLN  33   7.545  -2.772 -16.981
  273    HA   GLN  33           HA       GLN  33   4.791  -3.132 -18.137
  274    HB2  GLN  33           HB2      GLN  33   5.022  -1.887 -15.936
  275    HB3  GLN  33           HB1      GLN  33   5.960  -0.667 -16.795
  276    HG2  GLN  33           HG2      GLN  33   3.686   0.111 -16.715
  277    HG3  GLN  33           HG1      GLN  33   3.998  -0.396 -18.369
  278   HE21  GLN  33          HE21      GLN  33   2.189  -1.473 -19.166
  279   HE22  GLN  33          HE22      GLN  33   1.239  -2.570 -18.286
  280    H    LYS  34           HN       LYS  34   7.984  -1.807 -18.626
  281    HA   LYS  34           HA       LYS  34   8.940  -0.718 -20.460
  282    HB2  LYS  34           HB2      LYS  34   7.820  -2.813 -21.524
  283    HB3  LYS  34           HB1      LYS  34   6.580  -1.704 -22.098
  284    HG2  LYS  34           HG2      LYS  34   8.346  -0.347 -23.217
  285    HG3  LYS  34           HG1      LYS  34   9.555  -1.511 -22.678
  286    HD2  LYS  34           HD2      LYS  34   8.395  -3.298 -23.921
  287    HD3  LYS  34           HD1      LYS  34   7.186  -2.135 -24.465
  288    HE2  LYS  34           HE2      LYS  34   8.916  -2.488 -26.193
  289    HE3  LYS  34           HE1      LYS  34   8.939  -0.828 -25.600
  290    HZ1  LYS  34           HZ1      LYS  34  11.083  -2.453 -25.722
  291    HZ2  LYS  34           HZ2      LYS  34  10.606  -2.636 -24.102
  292    HZ3  LYS  34           HZ3      LYS  34  10.957  -1.092 -24.718
  293    H    GLY  35           HN       GLY  35   7.214   0.793 -18.784
  294    HA2  GLY  35           HA2      GLY  35   6.891   3.178 -20.247
  295    HA3  GLY  35           HA1      GLY  35   5.325   2.368 -20.266
  296    H    CYS  36           HN       CYS  36   7.749   2.388 -17.664
  297    HA   CYS  36           HA       CYS  36   6.317   4.302 -16.027
  298    HB2  CYS  36           HB2      CYS  36   4.743   2.410 -15.844
  299    HB3  CYS  36           HB1      CYS  36   6.060   1.361 -15.317
  300    HG   CYS  36           HG       CYS  36   5.936   2.344 -13.036
  301    H    ILE  37           HN       ILE  37   7.512   4.777 -14.111
  302    HA   ILE  37           HA       ILE  37  10.313   3.941 -14.208
  303    HB   ILE  37           HB       ILE  37   9.695   6.268 -13.775
  304   HG12  ILE  37          HG12      ILE  37  11.034   4.928 -11.394
  305   HG13  ILE  37          HG11      ILE  37  11.831   5.387 -12.901
  306   HG21  ILE  37          HG21      ILE  37   7.598   5.491 -12.352
  307   HG22  ILE  37          HG22      ILE  37   8.417   6.995 -11.945
  308   HG23  ILE  37          HG23      ILE  37   8.731   5.546 -11.000
  309   HD11  ILE  37          HD11      ILE  37  10.555   7.238 -10.856
  310   HD12  ILE  37          HD12      ILE  37  11.070   7.776 -12.456
  311   HD13  ILE  37          HD13      ILE  37  12.259   7.158 -11.309
  312    HA   PRO  38           HA       PRO  38   9.151   0.714 -11.173
  313    HB2  PRO  38           HB2      PRO  38  11.790  -0.334 -10.882
  314    HB3  PRO  38           HB1      PRO  38  10.541  -0.950 -11.972
  315    HG2  PRO  38           HG2      PRO  38  12.967   0.584 -12.654
  316    HG3  PRO  38           HG1      PRO  38  11.878  -0.299 -13.735
  317    HD2  PRO  38           HD2      PRO  38  12.033   2.556 -13.407
  318    HD3  PRO  38           HD1      PRO  38  10.833   1.656 -14.366
  319    H    LEU  39           HN       LEU  39   9.306   0.729  -8.881
  320    HA   LEU  39           HA       LEU  39  10.449   3.078  -7.673
  321    HB2  LEU  39           HB2      LEU  39   9.159   0.567  -6.610
  322    HB3  LEU  39           HB1      LEU  39   9.830   1.754  -5.500
  323    HG   LEU  39           HG       LEU  39   7.360   2.018  -5.944
  324   HD11  LEU  39          HD11      LEU  39   8.721   4.494  -7.008
  325   HD12  LEU  39          HD12      LEU  39   9.028   3.966  -5.354
  326   HD13  LEU  39          HD13      LEU  39   7.390   4.345  -5.868
  327   HD21  LEU  39          HD21      LEU  39   7.593   1.372  -8.405
  328   HD22  LEU  39          HD22      LEU  39   8.182   3.012  -8.684
  329   HD23  LEU  39          HD23      LEU  39   6.553   2.755  -8.067
  330    HA   PRO  40           HA       PRO  40  14.536   1.060  -7.461
  331    HB2  PRO  40           HB2      PRO  40  15.548   3.092  -5.619
  332    HB3  PRO  40           HB1      PRO  40  15.961   2.874  -7.324
  333    HG2  PRO  40           HG2      PRO  40  14.315   4.959  -6.182
  334    HG3  PRO  40           HG1      PRO  40  14.686   4.702  -7.894
  335    HD2  PRO  40           HD2      PRO  40  12.153   4.213  -6.539
  336    HD3  PRO  40           HD1      PRO  40  12.524   3.985  -8.264
  337    H    ARG  41           HN       ARG  41  15.179  -0.518  -6.043
  338    HA   ARG  41           HA       ARG  41  13.640  -1.060  -3.677
  339    HB2  ARG  41           HB2      ARG  41  15.392  -2.820  -3.250
  340    HB3  ARG  41           HB1      ARG  41  14.747  -2.882  -4.893
  341    HG2  ARG  41           HG2      ARG  41  16.698  -1.536  -5.672
  342    HG3  ARG  41           HG1      ARG  41  17.358  -1.595  -4.038
  343    HD2  ARG  41           HD2      ARG  41  17.412  -4.056  -4.140
  344    HD3  ARG  41           HD1      ARG  41  16.745  -4.006  -5.773
  345    HE   ARG  41           HE       ARG  41  19.018  -2.416  -5.926
  346   HH11  ARG  41          HH21      ARG  41  18.272  -5.625  -4.891
  347   HH12  ARG  41          HH22      ARG  41  19.824  -6.264  -5.320
  348   HH21  ARG  41          HH11      ARG  41  21.044  -3.238  -6.490
  349   HH22  ARG  41          HH12      ARG  41  21.391  -4.914  -6.225
  350    H    GLY  42           HN       GLY  42  16.683   0.633  -4.218
  351    HA2  GLY  42           HA2      GLY  42  17.550   0.668  -1.462
  352    HA3  GLY  42           HA1      GLY  42  18.073   1.832  -2.682
  353    H    GLN  43           HN       GLN  43  15.502   2.952  -3.325
  354    HA   GLN  43           HA       GLN  43  15.197   4.754  -1.045
  355    HB2  GLN  43           HB2      GLN  43  13.844   4.493  -3.750
  356    HB3  GLN  43           HB1      GLN  43  13.261   5.652  -2.555
  357    HG2  GLN  43           HG2      GLN  43  14.867   6.697  -4.123
  358    HG3  GLN  43           HG1      GLN  43  15.481   6.708  -2.471
  359   HE21  GLN  43          HE21      GLN  43  17.169   5.059  -1.923
  360   HE22  GLN  43          HE22      GLN  43  18.126   4.398  -3.160
  361    H    THR  44           HN       THR  44  13.437   1.980  -2.336
  362    HA   THR  44           HA       THR  44  11.066   2.401  -0.706
  363    HB   THR  44           HB       THR  44  12.080  -0.090  -2.110
  364    HG1  THR  44           HG1      THR  44  10.263   0.677  -3.528
  365   HG21  THR  44          HG21      THR  44  10.453  -0.749  -0.455
  366   HG22  THR  44          HG22      THR  44   9.634  -0.732  -2.015
  367   HG23  THR  44          HG23      THR  44   9.395   0.596  -0.882
  368    H    GLU  45           HN       GLU  45  13.983   0.360  -0.363
  369    HA   GLU  45           HA       GLU  45  13.033  -0.875   2.097
  370    HB2  GLU  45           HB2      GLU  45  15.236  -1.881   2.230
  371    HB3  GLU  45           HB1      GLU  45  14.752  -1.885   0.540
  372    HG2  GLU  45           HG2      GLU  45  16.968  -1.101   0.406
  373    HG3  GLU  45           HG1      GLU  45  16.046   0.395   0.396
  374    H    LYS  46           HN       LYS  46  15.241   1.868   1.368
  375    HA   LYS  46           HA       LYS  46  15.888   2.338   4.150
  376    HB2  LYS  46           HB2      LYS  46  17.254   3.144   2.196
  377    HB3  LYS  46           HB1      LYS  46  15.982   4.316   1.850
  378    HG2  LYS  46           HG2      LYS  46  16.294   5.385   4.003
  379    HG3  LYS  46           HG1      LYS  46  17.426   4.133   4.512
  380    HD2  LYS  46           HD2      LYS  46  18.958   4.797   2.676
  381    HD3  LYS  46           HD1      LYS  46  17.838   6.085   2.227
  382    HE2  LYS  46           HE2      LYS  46  19.667   6.934   3.668
  383    HE3  LYS  46           HE1      LYS  46  18.095   7.105   4.449
  384    HZ1  LYS  46           HZ1      LYS  46  20.176   6.004   5.644
  385    HZ2  LYS  46           HZ2      LYS  46  19.526   4.613   4.916
  386    HZ3  LYS  46           HZ3      LYS  46  18.579   5.540   5.980
  387    H    ALA  47           HN       ALA  47  13.118   2.997   2.232
  388    HA   ALA  47           HA       ALA  47  12.188   5.378   3.542
  389    HB1  ALA  47           HB1      ALA  47  10.690   3.149   2.134
  390    HB2  ALA  47           HB2      ALA  47  11.188   4.692   1.443
  391    HB3  ALA  47           HB3      ALA  47   9.935   4.644   2.680
  392    H    ASP  48           HN       ASP  48  11.271   5.626   5.531
  393    HA   ASP  48           HA       ASP  48  11.068   3.301   7.329
  394    HB2  ASP  48           HB2      ASP  48  10.271   6.198   7.786
  395    HB3  ASP  48           HB1      ASP  48  10.485   4.965   9.029
  396    H    HIS  49           HN       HIS  49   8.964   3.039   8.627
  397    HA   HIS  49           HA       HIS  49   6.819   2.325   6.984
  398    HB2  HIS  49           HB2      HIS  49   5.414   2.430   9.063
  399    HB3  HIS  49           HB1      HIS  49   6.925   1.548   9.270
  400    HD1  HIS  49           HD1      HIS  49   8.844   3.978   9.597
  401    HD2  HIS  49           HD2      HIS  49   5.208   3.581  11.597
  402    HE1  HIS  49           HE1      HIS  49   9.003   5.429  11.665
  403    H    VAL  50           HN       VAL  50   7.276   5.426   8.700
  404    HA   VAL  50           HA       VAL  50   4.776   6.567   7.749
  405    HB   VAL  50           HB       VAL  50   7.330   7.931   8.711
  406   HG11  VAL  50          HG11      VAL  50   5.756   9.846   9.214
  407   HG12  VAL  50          HG12      VAL  50   4.515   8.999   8.295
  408   HG13  VAL  50          HG13      VAL  50   5.987   9.544   7.494
  409   HG21  VAL  50          HG21      VAL  50   4.759   7.372  10.235
  410   HG22  VAL  50          HG22      VAL  50   6.259   8.034  10.881
  411   HG23  VAL  50          HG23      VAL  50   6.199   6.358  10.340
  412    H    ASP  51           HN       ASP  51   8.177   6.976   6.690
  413    HA   ASP  51           HA       ASP  51   7.602   8.688   4.491
  414    HB2  ASP  51           HB2      ASP  51   9.836   6.674   4.902
  415    HB3  ASP  51           HB1      ASP  51   9.803   7.844   3.581
  416    H    LEU  52           HN       LEU  52   7.525   5.159   4.779
  417    HA   LEU  52           HA       LEU  52   7.338   4.470   2.058
  418    HB2  LEU  52           HB2      LEU  52   7.366   2.994   4.246
  419    HB3  LEU  52           HB1      LEU  52   5.621   3.080   4.125
  420    HG   LEU  52           HG       LEU  52   6.263   1.060   3.026
  421   HD11  LEU  52          HD11      LEU  52   4.610   2.547   1.813
  422   HD12  LEU  52          HD12      LEU  52   5.416   1.338   0.819
  423   HD13  LEU  52          HD13      LEU  52   5.936   3.018   0.747
  424   HD21  LEU  52          HD21      LEU  52   8.724   1.881   2.699
  425   HD22  LEU  52          HD22      LEU  52   8.162   2.479   1.139
  426   HD23  LEU  52          HD23      LEU  52   8.043   0.767   1.521
  427    H    ALA  53           HN       ALA  53   4.644   5.228   4.305
  428    HA   ALA  53           HA       ALA  53   2.597   5.120   2.290
  429    HB1  ALA  53           HB1      ALA  53   1.223   6.359   3.927
  430    HB2  ALA  53           HB2      ALA  53   2.668   6.703   4.880
  431    HB3  ALA  53           HB3      ALA  53   2.100   5.042   4.707
  432    H    THR  54           HN       THR  54   4.853   7.638   3.246
  433    HA   THR  54           HA       THR  54   3.434   9.812   1.935
  434    HB   THR  54           HB       THR  54   6.387   9.597   2.616
  435    HG1  THR  54           HG1      THR  54   5.147  11.054   4.361
  436   HG21  THR  54          HG21      THR  54   6.224  12.079   2.736
  437   HG22  THR  54          HG22      THR  54   4.563  11.979   2.158
  438   HG23  THR  54          HG23      THR  54   5.892  11.468   1.116
  439    H    LEU  55           HN       LEU  55   6.025   7.570   0.919
  440    HA   LEU  55           HA       LEU  55   6.479   8.924  -1.610
  441    HB2  LEU  55           HB2      LEU  55   8.151   7.349  -0.496
  442    HB3  LEU  55           HB1      LEU  55   7.109   6.018  -0.989
  443    HG   LEU  55           HG       LEU  55   7.334   7.030  -3.407
  444   HD11  LEU  55          HD11      LEU  55   9.716   8.295  -2.003
  445   HD12  LEU  55          HD12      LEU  55   8.430   9.138  -2.865
  446   HD13  LEU  55          HD13      LEU  55   9.570   8.135  -3.751
  447   HD21  LEU  55          HD21      LEU  55   9.442   5.754  -3.760
  448   HD22  LEU  55          HD22      LEU  55   8.299   4.870  -2.749
  449   HD23  LEU  55          HD23      LEU  55   9.677   5.688  -2.013
  450    H    MET  56           HN       MET  56   4.388   6.272  -0.557
  451    HA   MET  56           HA       MET  56   3.550   5.545  -3.237
  452    HB2  MET  56           HB2      MET  56   3.358   4.080  -1.173
  453    HB3  MET  56           HB1      MET  56   2.020   5.102  -0.652
  454    HG2  MET  56           HG2      MET  56   0.830   4.594  -2.781
  455    HG3  MET  56           HG1      MET  56   2.152   3.520  -3.242
  456    HE1  MET  56           HE1      MET  56   1.241   1.294  -3.424
  457    HE2  MET  56           HE2      MET  56  -0.319   2.110  -3.487
  458    HE3  MET  56           HE3      MET  56  -0.125   0.672  -2.489
  459    H    ILE  57           HN       ILE  57   2.145   7.637  -0.692
  460    HA   ILE  57           HA       ILE  57  -0.151   8.328  -2.383
  461    HB   ILE  57           HB       ILE  57   0.852   9.716   0.133
  462   HG12  ILE  57          HG12      ILE  57  -1.381   7.673  -0.141
  463   HG13  ILE  57          HG11      ILE  57   0.255   7.240   0.351
  464   HG21  ILE  57          HG21      ILE  57  -0.643  11.160  -1.104
  465   HG22  ILE  57          HG22      ILE  57  -1.554  10.476   0.237
  466   HG23  ILE  57          HG23      ILE  57  -1.769   9.833  -1.390
  467   HD11  ILE  57          HD11      ILE  57   0.085   8.846   2.243
  468   HD12  ILE  57          HD12      ILE  57  -1.141   7.583   2.332
  469   HD13  ILE  57          HD13      ILE  57  -1.578   9.195   1.771
  470    H    ASP  58           HN       ASP  58   2.971   9.851  -1.606
  471    HA   ASP  58           HA       ASP  58   2.328  12.318  -3.022
  472    HB2  ASP  58           HB2      ASP  58   4.020  12.103  -1.135
  473    HB3  ASP  58           HB1      ASP  58   5.076  11.259  -2.268
  474    H    PHE  59           HN       PHE  59   4.381   9.471  -3.825
  475    HA   PHE  59           HA       PHE  59   5.036  10.596  -6.439
  476    HB2  PHE  59           HB2      PHE  59   6.445   8.960  -4.993
  477    HB3  PHE  59           HB1      PHE  59   5.432   7.687  -5.668
  478    HD1  PHE  59           HD2      PHE  59   5.448   7.217  -8.106
  479    HD2  PHE  59           HD1      PHE  59   8.044  10.173  -6.375
  480    HE1  PHE  59           HE2      PHE  59   6.797   7.254 -10.186
  481    HE2  PHE  59           HE1      PHE  59   9.389  10.210  -8.457
  482    HZ   PHE  59           HZ       PHE  59   8.765   8.755 -10.361
  483    H    ASN  60           HN       ASN  60   2.786   7.967  -5.379
  484    HA   ASN  60           HA       ASN  60   1.962   7.575  -8.218
  485    HB2  ASN  60           HB2      ASN  60   0.837   6.193  -5.753
  486    HB3  ASN  60           HB1      ASN  60   0.773   5.633  -7.423
  487   HD21  ASN  60          HD21      ASN  60   2.078   4.420  -4.918
  488   HD22  ASN  60          HD22      ASN  60   3.680   4.118  -5.391
  489    H    GLY  61           HN       GLY  61   0.777   9.080  -5.270
  490    HA2  GLY  61           HA2      GLY  61  -0.890  10.822  -5.275
  491    HA3  GLY  61           HA1      GLY  61  -1.511  10.220  -6.810
  492    H    GLU  62           HN       GLU  62  -3.292  10.739  -4.791
  493    HA   GLU  62           HA       GLU  62  -3.851   8.451  -3.120
  494    HB2  GLU  62           HB2      GLU  62  -4.640  10.766  -2.641
  495    HB3  GLU  62           HB1      GLU  62  -5.716  10.668  -4.031
  496    HG2  GLU  62           HG2      GLU  62  -5.849   8.594  -1.814
  497    HG3  GLU  62           HG1      GLU  62  -6.712  10.123  -1.675
  498    H    GLU  63           HN       GLU  63  -4.819   9.394  -6.381
  499    HA   GLU  63           HA       GLU  63  -6.963   7.470  -6.602
  500    HB2  GLU  63           HB2      GLU  63  -6.479   9.589  -8.041
  501    HB3  GLU  63           HB1      GLU  63  -5.382   8.559  -8.952
  502    HG2  GLU  63           HG2      GLU  63  -8.345   8.013  -8.516
  503    HG3  GLU  63           HG1      GLU  63  -7.630   8.655  -9.992
  504    H    LYS  64           HN       LYS  64  -3.615   7.431  -7.932
  505    HA   LYS  64           HA       LYS  64  -3.884   4.688  -8.840
  506    HB2  LYS  64           HB2      LYS  64  -2.297   6.353  -9.837
  507    HB3  LYS  64           HB1      LYS  64  -1.332   6.250  -8.369
  508    HG2  LYS  64           HG2      LYS  64  -0.954   3.870  -8.724
  509    HG3  LYS  64           HG1      LYS  64  -2.022   3.883 -10.129
  510    HD2  LYS  64           HD2      LYS  64  -0.513   5.444 -11.282
  511    HD3  LYS  64           HD1      LYS  64   0.547   5.474  -9.873
  512    HE2  LYS  64           HE2      LYS  64   0.902   3.027 -10.112
  513    HE3  LYS  64           HE1      LYS  64  -0.108   3.039 -11.558
  514    HZ1  LYS  64           HZ1      LYS  64   1.429   4.346 -12.704
  515    HZ2  LYS  64           HZ2      LYS  64   2.384   3.202 -11.888
  516    HZ3  LYS  64           HZ3      LYS  64   2.260   4.789 -11.294
  517    H    ALA  65           HN       ALA  65  -2.435   6.195  -5.935
  518    HA   ALA  65           HA       ALA  65  -1.180   3.893  -4.873
  519    HB1  ALA  65           HB1      ALA  65  -2.622   6.119  -3.412
  520    HB2  ALA  65           HB2      ALA  65  -0.913   6.089  -3.845
  521    HB3  ALA  65           HB3      ALA  65  -1.542   4.953  -2.651
  522    H    TRP  66           HN       TRP  66  -4.584   4.895  -4.739
  523    HA   TRP  66           HA       TRP  66  -5.435   2.822  -2.932
  524    HB2  TRP  66           HB2      TRP  66  -6.837   4.599  -4.944
  525    HB3  TRP  66           HB1      TRP  66  -7.735   3.300  -4.164
  526    HD1  TRP  66           HD1      TRP  66  -5.035   5.296  -2.316
  527    HE1  TRP  66           HE1      TRP  66  -6.161   6.620  -0.410
  528    HE3  TRP  66           HE3      TRP  66  -9.935   4.356  -3.376
  529    HZ2  TRP  66           HZ2      TRP  66  -8.796   7.206   0.539
  530    HZ3  TRP  66           HZ3      TRP  66 -11.746   5.317  -1.945
  531    HH2  TRP  66           HH2      TRP  66 -11.171   6.733   0.000
  532    H    ALA  67           HN       ALA  67  -5.543   3.041  -6.510
  533    HA   ALA  67           HA       ALA  67  -6.647   0.493  -7.006
  534    HB1  ALA  67           HB1      ALA  67  -5.570   0.640  -9.220
  535    HB2  ALA  67           HB2      ALA  67  -4.537   1.944  -8.634
  536    HB3  ALA  67           HB3      ALA  67  -6.278   2.190  -8.766
  537    H    MET  68           HN       MET  68  -3.263   1.399  -6.409
  538    HA   MET  68           HA       MET  68  -2.261  -1.312  -6.840
  539    HB2  MET  68           HB2      MET  68  -1.072   1.227  -5.690
  540    HB3  MET  68           HB1      MET  68  -0.178  -0.290  -5.661
  541    HG2  MET  68           HG2      MET  68  -1.348   0.868  -8.209
  542    HG3  MET  68           HG1      MET  68   0.292   1.209  -7.666
  543    HE1  MET  68           HE1      MET  68   2.281  -0.247  -8.536
  544    HE2  MET  68           HE2      MET  68   2.259  -1.925  -7.998
  545    HE3  MET  68           HE3      MET  68   1.871  -0.637  -6.861
  546    H    ALA  69           HN       ALA  69  -3.330   0.583  -4.055
  547    HA   ALA  69           HA       ALA  69  -2.352  -1.262  -2.056
  548    HB1  ALA  69           HB1      ALA  69  -3.809  -0.017  -0.512
  549    HB2  ALA  69           HB2      ALA  69  -4.637   0.731  -1.878
  550    HB3  ALA  69           HB3      ALA  69  -2.943   1.107  -1.562
  551    H    VAL  70           HN       VAL  70  -5.466  -0.906  -3.740
  552    HA   VAL  70           HA       VAL  70  -6.767  -3.019  -2.191
  553    HB   VAL  70           HB       VAL  70  -7.521  -1.719  -4.833
  554   HG11  VAL  70          HG11      VAL  70  -8.694  -3.826  -4.672
  555   HG12  VAL  70          HG12      VAL  70  -9.836  -2.580  -4.174
  556   HG13  VAL  70          HG13      VAL  70  -9.034  -3.575  -2.960
  557   HG21  VAL  70          HG21      VAL  70  -8.380  -1.211  -1.958
  558   HG22  VAL  70          HG22      VAL  70  -9.106  -0.444  -3.372
  559   HG23  VAL  70          HG23      VAL  70  -7.419  -0.128  -2.964
  560    H    TRP  71           HN       TRP  71  -5.591  -2.859  -5.592
  561    HA   TRP  71           HA       TRP  71  -6.162  -5.556  -6.217
  562    HB2  TRP  71           HB2      TRP  71  -5.508  -3.836  -7.907
  563    HB3  TRP  71           HB1      TRP  71  -3.852  -3.901  -7.309
  564    HD1  TRP  71           HD1      TRP  71  -6.366  -5.811  -9.392
  565    HE1  TRP  71           HE1      TRP  71  -5.193  -7.815 -10.510
  566    HE3  TRP  71           HE3      TRP  71  -1.872  -5.658  -6.982
  567    HZ2  TRP  71           HZ2      TRP  71  -2.675  -9.174 -10.396
  568    HZ3  TRP  71           HZ3      TRP  71  -0.104  -7.310  -7.499
  569    HH2  TRP  71           HH2      TRP  71  -0.499  -9.071  -9.203
  570    H    ILE  72           HN       ILE  72  -3.383  -4.199  -4.454
  571    HA   ILE  72           HA       ILE  72  -1.872  -6.710  -4.563
  572    HB   ILE  72           HB       ILE  72  -1.615  -4.177  -2.900
  573   HG12  ILE  72          HG12      ILE  72   0.307  -5.505  -4.844
  574   HG13  ILE  72          HG11      ILE  72  -0.857  -4.278  -5.324
  575   HG21  ILE  72          HG21      ILE  72   0.575  -5.223  -2.060
  576   HG22  ILE  72          HG22      ILE  72  -0.070  -6.769  -2.601
  577   HG23  ILE  72          HG23      ILE  72  -0.902  -5.858  -1.343
  578   HD11  ILE  72          HD11      ILE  72   0.193  -2.619  -3.915
  579   HD12  ILE  72          HD12      ILE  72   1.461  -3.392  -4.862
  580   HD13  ILE  72          HD13      ILE  72   1.234  -3.834  -3.173
  581    H    PHE  73           HN       PHE  73  -4.270  -5.327  -2.306
  582    HA   PHE  73           HA       PHE  73  -3.893  -7.122  -0.154
  583    HB2  PHE  73           HB2      PHE  73  -6.253  -5.568  -1.209
  584    HB3  PHE  73           HB1      PHE  73  -6.527  -6.740   0.075
  585    HD1  PHE  73           HD1      PHE  73  -3.399  -4.689  -0.311
  586    HD2  PHE  73           HD2      PHE  73  -7.097  -5.206   1.835
  587    HE1  PHE  73           HE1      PHE  73  -2.659  -3.042   1.368
  588    HE2  PHE  73           HE2      PHE  73  -6.341  -3.549   3.513
  589    HZ   PHE  73           HZ       PHE  73  -4.123  -2.468   3.281
  590    H    ALA  74           HN       ALA  74  -5.995  -7.519  -3.053
  591    HA   ALA  74           HA       ALA  74  -6.969 -10.108  -2.303
  592    HB1  ALA  74           HB1      ALA  74  -6.571  -8.944  -5.082
  593    HB2  ALA  74           HB2      ALA  74  -8.013  -8.740  -4.086
  594    HB3  ALA  74           HB3      ALA  74  -7.576 -10.339  -4.689
  595    H    ALA  75           HN       ALA  75  -3.974  -9.057  -3.798
  596    HA   ALA  75           HA       ALA  75  -3.191 -11.601  -4.877
  597    HB1  ALA  75           HB1      ALA  75  -1.375  -9.393  -3.859
  598    HB2  ALA  75           HB2      ALA  75  -2.134  -9.390  -5.450
  599    HB3  ALA  75           HB3      ALA  75  -0.963 -10.644  -5.034
  600    H    ILE  76           HN       ILE  76  -2.435 -10.031  -1.742
  601    HA   ILE  76           HA       ILE  76  -1.053 -12.466  -0.801
  602    HB   ILE  76           HB       ILE  76  -0.846 -11.158   1.355
  603   HG12  ILE  76          HG12      ILE  76  -2.155  -8.954  -0.284
  604   HG13  ILE  76          HG11      ILE  76  -2.921  -9.806   1.052
  605   HG21  ILE  76          HG21      ILE  76   0.860 -11.080  -0.479
  606   HG22  ILE  76          HG22      ILE  76   0.802  -9.597   0.466
  607   HG23  ILE  76          HG23      ILE  76   0.052  -9.655  -1.130
  608   HD11  ILE  76          HD11      ILE  76  -0.964  -9.050   2.505
  609   HD12  ILE  76          HD12      ILE  76  -2.053  -7.771   1.968
  610   HD13  ILE  76          HD13      ILE  76  -0.498  -7.993   1.170
  611    H    ASN  77           HN       ASN  77  -4.063 -12.277  -1.448
  612    HA   ASN  77           HA       ASN  77  -6.055 -13.133  -0.590
  613    HB2  ASN  77           HB2      ASN  77  -4.043 -14.678   1.090
  614    HB3  ASN  77           HB1      ASN  77  -5.765 -15.043   1.043
  615   HD21  ASN  77          HD21      ASN  77  -2.785 -15.052  -0.895
  616   HD22  ASN  77          HD22      ASN  77  -3.394 -16.036  -2.138
  617    H    ARG  78           HN       ARG  78  -6.726 -11.124   0.302
  618    HA   ARG  78           HA       ARG  78  -7.060 -11.184   3.218
  619    HB2  ARG  78           HB2      ARG  78  -4.806  -9.956   2.546
  620    HB3  ARG  78           HB1      ARG  78  -5.870  -8.646   2.065
  621    HG2  ARG  78           HG2      ARG  78  -5.460  -8.044   4.292
  622    HG3  ARG  78           HG1      ARG  78  -6.926  -8.991   4.483
  623    HD2  ARG  78           HD2      ARG  78  -4.184 -10.254   4.744
  624    HD3  ARG  78           HD1      ARG  78  -4.956  -9.477   6.110
  625    HE   ARG  78           HE       ARG  78  -5.515 -12.106   5.019
  626   HH11  ARG  78          HH21      ARG  78  -7.066  -9.359   6.422
  627   HH12  ARG  78          HH22      ARG  78  -8.505 -10.231   6.831
  628   HH21  ARG  78          HH11      ARG  78  -7.367 -13.241   5.552
  629   HH22  ARG  78          HH12      ARG  78  -8.674 -12.423   6.341
  630    H    ARG  79           HN       ARG  79  -8.660 -11.327   0.767
  631    HA   ARG  79           HA       ARG  79 -10.020  -9.039  -0.010
  632    HB2  ARG  79           HB2      ARG  79 -10.409 -11.394  -0.828
  633    HB3  ARG  79           HB1      ARG  79 -11.386 -11.672   0.612
  634    HG2  ARG  79           HG2      ARG  79 -12.858  -9.773  -0.051
  635    HG3  ARG  79           HG1      ARG  79 -11.900  -9.572  -1.519
  636    HD2  ARG  79           HD2      ARG  79 -13.526 -12.002  -0.727
  637    HD3  ARG  79           HD1      ARG  79 -13.848 -10.902  -2.068
  638    HE   ARG  79           HE       ARG  79 -11.291 -11.852  -2.584
  639   HH11  ARG  79          HH21      ARG  79 -14.389 -13.238  -1.942
  640   HH12  ARG  79          HH22      ARG  79 -14.098 -14.653  -2.898
  641   HH21  ARG  79          HH11      ARG  79 -10.900 -13.693  -3.831
  642   HH22  ARG  79          HH12      ARG  79 -12.125 -14.910  -3.965
  643    H    ASP  80           HN       ASP  80 -10.284 -10.684   3.091
  644    HA   ASP  80           HA       ASP  80 -12.744  -9.472   3.939
  645    HB2  ASP  80           HB2      ASP  80 -11.648 -11.445   5.045
  646    HB3  ASP  80           HB1      ASP  80 -10.422 -10.350   5.683
  647    H    LEU  81           HN       LEU  81  -9.349  -8.556   4.635
  648    HA   LEU  81           HA       LEU  81  -9.966  -6.244   6.134
  649    HB2  LEU  81           HB2      LEU  81  -7.695  -7.279   5.978
  650    HB3  LEU  81           HB1      LEU  81  -7.543  -6.651   4.344
  651    HG   LEU  81           HG       LEU  81  -7.828  -4.332   5.246
  652   HD11  LEU  81          HD11      LEU  81  -7.327  -4.241   7.852
  653   HD12  LEU  81          HD12      LEU  81  -8.050  -5.848   7.853
  654   HD13  LEU  81          HD13      LEU  81  -8.977  -4.460   7.284
  655   HD21  LEU  81          HD21      LEU  81  -5.587  -5.380   4.874
  656   HD22  LEU  81          HD22      LEU  81  -5.588  -5.909   6.555
  657   HD23  LEU  81          HD23      LEU  81  -5.569  -4.190   6.174
  658    H    TYR  82           HN       TYR  82 -10.100  -6.766   2.669
  659    HA   TYR  82           HA       TYR  82 -10.050  -3.962   1.933
  660    HB2  TYR  82           HB2      TYR  82  -9.592  -5.409   0.122
  661    HB3  TYR  82           HB1      TYR  82 -10.866  -6.530   0.575
  662    HD1  TYR  82           HD1      TYR  82 -10.652  -2.861  -0.197
  663    HD2  TYR  82           HD2      TYR  82 -12.664  -6.578  -0.982
  664    HE1  TYR  82           HE1      TYR  82 -12.172  -1.708  -1.779
  665    HE2  TYR  82           HE2      TYR  82 -14.177  -5.421  -2.564
  666    HH   TYR  82           HH       TYR  82 -13.813  -3.029  -4.046
  667    H    GLU  83           HN       GLU  83 -12.626  -6.286   2.741
  668    HA   GLU  83           HA       GLU  83 -14.829  -4.638   2.075
  669    HB2  GLU  83           HB2      GLU  83 -14.780  -7.125   2.837
  670    HB3  GLU  83           HB1      GLU  83 -14.831  -6.491   4.480
  671    HG2  GLU  83           HG2      GLU  83 -16.895  -5.204   3.854
  672    HG3  GLU  83           HG1      GLU  83 -16.862  -6.002   2.281
  673    H    LYS  84           HN       LYS  84 -12.873  -4.794   5.036
  674    HA   LYS  84           HA       LYS  84 -14.474  -2.803   6.444
  675    HB2  LYS  84           HB2      LYS  84 -11.585  -3.513   7.044
  676    HB3  LYS  84           HB1      LYS  84 -12.824  -2.943   8.163
  677    HG2  LYS  84           HG2      LYS  84 -12.766  -5.633   6.758
  678    HG3  LYS  84           HG1      LYS  84 -12.475  -5.340   8.471
  679    HD2  LYS  84           HD2      LYS  84 -14.842  -4.329   8.547
  680    HD3  LYS  84           HD1      LYS  84 -15.080  -5.034   6.947
  681    HE2  LYS  84           HE2      LYS  84 -14.308  -6.573   9.442
  682    HE3  LYS  84           HE1      LYS  84 -15.911  -6.546   8.708
  683    HZ1  LYS  84           HZ1      LYS  84 -14.939  -8.446   7.842
  684    HZ2  LYS  84           HZ2      LYS  84 -13.415  -7.718   7.656
  685    HZ3  LYS  84           HZ3      LYS  84 -14.689  -7.306   6.611
  686    H    ALA  85           HN       ALA  85 -11.405  -2.740   4.626
  687    HA   ALA  85           HA       ALA  85 -10.732  -0.027   5.083
  688    HB1  ALA  85           HB1      ALA  85  -9.428  -0.179   2.995
  689    HB2  ALA  85           HB2      ALA  85 -10.290  -1.653   2.558
  690    HB3  ALA  85           HB3      ALA  85  -9.222  -1.641   3.962
  691    H    LYS  86           HN       LYS  86 -13.012  -1.472   2.808
  692    HA   LYS  86           HA       LYS  86 -13.474   0.951   1.301
  693    HB2  LYS  86           HB2      LYS  86 -14.071  -1.368   0.484
  694    HB3  LYS  86           HB1      LYS  86 -15.398  -1.384   1.648
  695    HG2  LYS  86           HG2      LYS  86 -16.390   0.590   0.599
  696    HG3  LYS  86           HG1      LYS  86 -15.030   0.708  -0.518
  697    HD2  LYS  86           HD2      LYS  86 -15.594  -1.509  -1.446
  698    HD3  LYS  86           HD1      LYS  86 -16.957  -1.628  -0.331
  699    HE2  LYS  86           HE2      LYS  86 -17.934   0.421  -1.334
  700    HE3  LYS  86           HE1      LYS  86 -16.594   0.483  -2.479
  701    HZ1  LYS  86           HZ1      LYS  86 -18.926  -0.832  -2.868
  702    HZ2  LYS  86           HZ2      LYS  86 -17.889  -2.079  -2.365
  703    HZ3  LYS  86           HZ3      LYS  86 -17.485  -1.126  -3.712
  704    H    ARG  87           HN       ARG  87 -14.741  -0.287   4.344
  705    HA   ARG  87           HA       ARG  87 -17.020   1.553   4.397
  706    HB2  ARG  87           HB2      ARG  87 -15.720  -0.126   6.564
  707    HB3  ARG  87           HB1      ARG  87 -17.207   0.799   6.772
  708    HG2  ARG  87           HG2      ARG  87 -18.293  -0.488   4.996
  709    HG3  ARG  87           HG1      ARG  87 -16.799  -1.377   4.701
  710    HD2  ARG  87           HD2      ARG  87 -18.344  -2.687   6.113
  711    HD3  ARG  87           HD1      ARG  87 -16.871  -2.277   6.993
  712    HE   ARG  87           HE       ARG  87 -18.618  -0.208   7.611
  713   HH11  ARG  87          HH21      ARG  87 -18.674  -3.660   7.762
  714   HH12  ARG  87          HH22      ARG  87 -19.730  -3.711   9.134
  715   HH21  ARG  87          HH11      ARG  87 -19.993  -0.264   9.399
  716   HH22  ARG  87          HH12      ARG  87 -20.476  -1.791  10.060
  717    H    ASP  88           HN       ASP  88 -13.667   1.620   5.456
  718    HA   ASP  88           HA       ASP  88 -14.087   4.091   7.053
  719    HB2  ASP  88           HB2      ASP  88 -12.483   2.260   7.772
  720    HB3  ASP  88           HB1      ASP  88 -11.485   2.667   6.375
  721    H    GLU  89           HN       GLU  89 -13.631   3.337   3.810
  722    HA   GLU  89           HA       GLU  89 -11.719   5.204   2.938
  723    HB2  GLU  89           HB2      GLU  89 -12.597   4.925   0.756
  724    HB3  GLU  89           HB1      GLU  89 -13.005   3.428   1.585
  725    HG2  GLU  89           HG2      GLU  89 -15.296   4.516   2.084
  726    HG3  GLU  89           HG1      GLU  89 -14.837   5.753   0.916
  727    HA   PRO  90           HA       PRO  90 -14.000   8.894   4.328
  728    HB2  PRO  90           HB2      PRO  90 -12.252  10.745   2.954
  729    HB3  PRO  90           HB1      PRO  90 -12.229  10.336   4.675
  730    HG2  PRO  90           HG2      PRO  90 -10.322   9.515   2.610
  731    HG3  PRO  90           HG1      PRO  90 -10.230   9.233   4.355
  732    HD2  PRO  90           HD2      PRO  90 -10.842   7.285   2.310
  733    HD3  PRO  90           HD1      PRO  90 -10.844   7.032   4.071
  734    H    LYS  91           HN       LYS  91 -15.306  10.573   3.216
  735    HA   LYS  91           HA       LYS  91 -16.193   9.676   0.553
  736    HB2  LYS  91           HB2      LYS  91 -17.114  11.842   2.470
  737    HB3  LYS  91           HB1      LYS  91 -17.800  11.683   0.854
  738    HG2  LYS  91           HG2      LYS  91 -18.525   9.402   1.341
  739    HG3  LYS  91           HG1      LYS  91 -17.754   9.463   2.926
  740    HD2  LYS  91           HD2      LYS  91 -19.254  11.248   3.636
  741    HD3  LYS  91           HD1      LYS  91 -19.969  11.328   2.025
  742    HE2  LYS  91           HE2      LYS  91 -20.074   8.947   3.902
  743    HE3  LYS  91           HE1      LYS  91 -21.414  10.028   3.522
  744    HZ1  LYS  91           HZ1      LYS  91 -21.858   8.602   1.891
  745    HZ2  LYS  91           HZ2      LYS  91 -20.345   7.838   2.008
  746    HZ3  LYS  91           HZ3      LYS  91 -20.515   9.253   1.084
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1  -8.235  18.955  10.423
    2    H2   MET   1           HT2      MET   1  -7.533  17.542   9.795
    3    H3   MET   1           HT3      MET   1  -6.801  18.350  11.098
    4    HA   MET   1           HA       MET   1  -8.364  17.654  12.616
    5    HB2  MET   1           HB2      MET   1 -10.266  18.386  11.099
    6    HB3  MET   1           HB1      MET   1 -10.152  16.819  10.305
    7    HG2  MET   1           HG2      MET   1 -10.534  17.037  13.307
    8    HG3  MET   1           HG1      MET   1 -11.900  17.054  12.196
    9    HE1  MET   1           HE1      MET   1 -11.471  14.965  14.522
   10    HE2  MET   1           HE2      MET   1 -12.033  13.501  13.718
   11    HE3  MET   1           HE3      MET   1 -12.873  15.026  13.444
   12    H    ALA   2           HN       ALA   2  -7.971  15.842   9.570
   13    HA   ALA   2           HA       ALA   2  -6.536  13.710  10.937
   14    HB1  ALA   2           HB1      ALA   2  -8.851  13.096  11.544
   15    HB2  ALA   2           HB2      ALA   2  -8.160  11.915  10.431
   16    HB3  ALA   2           HB3      ALA   2  -9.305  13.120   9.839
   17    H    SER   3           HN       SER   3  -4.952  13.964   9.350
   18    HA   SER   3           HA       SER   3  -5.601  14.062   6.507
   19    HB2  SER   3           HB2      SER   3  -3.515  15.061   7.620
   20    HB3  SER   3           HB1      SER   3  -2.900  13.416   7.750
   21    HG   SER   3           HG       SER   3  -3.864  14.450   5.304
   22    H    THR   4           HN       THR   4  -5.356  12.385   4.990
   23    HA   THR   4           HA       THR   4  -5.929   9.721   5.913
   24    HB   THR   4           HB       THR   4  -4.826  10.482   3.183
   25    HG1  THR   4           HG1      THR   4  -6.595  11.786   3.690
   26   HG21  THR   4          HG21      THR   4  -4.951   8.080   3.566
   27   HG22  THR   4          HG22      THR   4  -6.241   8.557   2.463
   28   HG23  THR   4          HG23      THR   4  -6.608   8.228   4.155
   29    H    ARG   5           HN       ARG   5  -3.009  11.475   5.622
   30    HA   ARG   5           HA       ARG   5  -1.138   9.429   5.013
   31    HB2  ARG   5           HB2      ARG   5  -0.624  11.882   5.212
   32    HB3  ARG   5           HB1      ARG   5  -0.740  11.719   6.964
   33    HG2  ARG   5           HG2      ARG   5   1.083  10.090   6.970
   34    HG3  ARG   5           HG1      ARG   5   1.164  10.141   5.208
   35    HD2  ARG   5           HD2      ARG   5   1.728  12.551   5.315
   36    HD3  ARG   5           HD1      ARG   5   1.687  12.472   7.077
   37    HE   ARG   5           HE       ARG   5   3.494  10.488   6.356
   38   HH11  ARG   5          HH21      ARG   5   3.098  13.863   5.736
   39   HH12  ARG   5          HH22      ARG   5   4.797  14.166   5.581
   40   HH21  ARG   5          HH11      ARG   5   5.710  10.871   6.154
   41   HH22  ARG   5          HH12      ARG   5   6.273  12.474   5.818
   42    H    CYS   6           HN       CYS   6  -2.415  10.481   8.183
   43    HA   CYS   6           HA       CYS   6  -0.965   8.485   9.676
   44    HB2  CYS   6           HB2      CYS   6  -3.474  10.040  10.363
   45    HB3  CYS   6           HB1      CYS   6  -2.562   9.054  11.506
   46    HG   CYS   6           HG       CYS   6  -0.668  10.736  11.490
   47    H    LYS   7           HN       LYS   7  -4.063   8.511   8.010
   48    HA   LYS   7           HA       LYS   7  -5.096   6.118   9.272
   49    HB2  LYS   7           HB2      LYS   7  -5.789   7.434   6.629
   50    HB3  LYS   7           HB1      LYS   7  -6.697   6.109   7.356
   51    HG2  LYS   7           HG2      LYS   7  -7.048   7.524   9.389
   52    HG3  LYS   7           HG1      LYS   7  -6.251   8.860   8.557
   53    HD2  LYS   7           HD2      LYS   7  -7.954   8.731   6.755
   54    HD3  LYS   7           HD1      LYS   7  -8.769   7.439   7.637
   55    HE2  LYS   7           HE2      LYS   7  -9.101   8.965   9.559
   56    HE3  LYS   7           HE1      LYS   7  -8.306  10.258   8.661
   57    HZ1  LYS   7           HZ1      LYS   7 -10.368   9.044   7.125
   58    HZ2  LYS   7           HZ2      LYS   7 -10.162  10.675   7.550
   59    HZ3  LYS   7           HZ3      LYS   7 -10.975   9.616   8.601
   60    H    LEU   8           HN       LEU   8  -3.492   6.688   6.109
   61    HA   LEU   8           HA       LEU   8  -3.527   3.926   5.323
   62    HB2  LEU   8           HB2      LEU   8  -2.972   6.084   3.927
   63    HB3  LEU   8           HB1      LEU   8  -1.326   5.840   4.498
   64    HG   LEU   8           HG       LEU   8  -1.729   3.332   3.634
   65   HD11  LEU   8          HD11      LEU   8  -3.672   4.948   1.944
   66   HD12  LEU   8          HD12      LEU   8  -4.096   3.623   3.027
   67   HD13  LEU   8          HD13      LEU   8  -3.136   3.308   1.586
   68   HD21  LEU   8          HD21      LEU   8  -1.205   5.697   1.801
   69   HD22  LEU   8          HD22      LEU   8  -0.861   4.017   1.385
   70   HD23  LEU   8          HD23      LEU   8  -0.002   4.789   2.716
   71    H    ALA   9           HN       ALA   9  -1.282   5.790   7.306
   72    HA   ALA   9           HA       ALA   9   0.757   3.736   7.414
   73    HB1  ALA   9           HB1      ALA   9   1.146   6.162   7.962
   74    HB2  ALA   9           HB2      ALA   9   1.727   5.051   9.201
   75    HB3  ALA   9           HB3      ALA   9   0.214   5.923   9.440
   76    H    ARG  10           HN       ARG  10  -2.205   4.391   9.122
   77    HA   ARG  10           HA       ARG  10  -1.711   2.728  11.407
   78    HB2  ARG  10           HB2      ARG  10  -3.561   4.476  11.124
   79    HB3  ARG  10           HB1      ARG  10  -4.426   3.280  10.161
   80    HG2  ARG  10           HG2      ARG  10  -4.264   1.692  12.104
   81    HG3  ARG  10           HG1      ARG  10  -3.559   3.001  13.055
   82    HD2  ARG  10           HD2      ARG  10  -5.585   4.371  12.659
   83    HD3  ARG  10           HD1      ARG  10  -6.297   3.039  11.745
   84    HE   ARG  10           HE       ARG  10  -5.656   1.896  14.192
   85   HH11  ARG  10          HH21      ARG  10  -7.442   4.651  13.116
   86   HH12  ARG  10          HH22      ARG  10  -8.553   4.611  14.445
   87   HH21  ARG  10          HH11      ARG  10  -7.098   1.836  15.928
   88   HH22  ARG  10          HH12      ARG  10  -8.357   3.019  16.036
   89    H    TYR  11           HN       TYR  11  -2.894   2.072   8.149
   90    HA   TYR  11           HA       TYR  11  -3.738  -0.657   8.755
   91    HB2  TYR  11           HB2      TYR  11  -3.279   0.884   6.181
   92    HB3  TYR  11           HB1      TYR  11  -3.664  -0.835   6.158
   93    HD1  TYR  11           HD2      TYR  11  -5.773  -1.639   7.323
   94    HD2  TYR  11           HD1      TYR  11  -5.024   2.503   6.500
   95    HE1  TYR  11           HE2      TYR  11  -8.190  -1.149   7.601
   96    HE2  TYR  11           HE1      TYR  11  -7.436   3.000   6.778
   97    HH   TYR  11           HH       TYR  11  -9.460   2.146   7.109
   98    H    LEU  12           HN       LEU  12  -0.919   0.684   6.954
   99    HA   LEU  12           HA       LEU  12   0.372  -1.851   6.637
  100    HB2  LEU  12           HB2      LEU  12   1.867   0.771   6.974
  101    HB3  LEU  12           HB1      LEU  12   2.359  -0.643   6.049
  102    HG   LEU  12           HG       LEU  12  -0.103   1.036   5.327
  103   HD11  LEU  12          HD11      LEU  12   2.039   2.340   5.176
  104   HD12  LEU  12          HD12      LEU  12   1.279   2.075   3.609
  105   HD13  LEU  12          HD13      LEU  12   2.672   1.107   4.087
  106   HD21  LEU  12          HD21      LEU  12  -0.278  -1.151   4.332
  107   HD22  LEU  12          HD22      LEU  12   1.438  -1.191   3.930
  108   HD23  LEU  12          HD23      LEU  12   0.352  -0.110   3.062
  109    H    GLU  13           HN       GLU  13   0.109   0.287   9.361
  110    HA   GLU  13           HA       GLU  13   2.292  -1.027  10.858
  111    HB2  GLU  13           HB2      GLU  13   0.223   1.076  11.579
  112    HB3  GLU  13           HB1      GLU  13   1.266   0.355  12.803
  113    HG2  GLU  13           HG2      GLU  13   3.258   1.125  11.659
  114    HG3  GLU  13           HG1      GLU  13   2.310   1.702  10.291
  115    H    ASP  14           HN       ASP  14  -1.228  -1.293  10.613
  116    HA   ASP  14           HA       ASP  14  -1.442  -3.043  12.958
  117    HB2  ASP  14           HB2      ASP  14  -3.413  -2.376  10.747
  118    HB3  ASP  14           HB1      ASP  14  -3.794  -3.361  12.159
  119    H    LEU  15           HN       LEU  15  -0.164  -3.611   9.920
  120    HA   LEU  15           HA       LEU  15  -1.291  -6.339   9.608
  121    HB2  LEU  15           HB2      LEU  15   0.199  -4.422   7.929
  122    HB3  LEU  15           HB1      LEU  15   0.888  -6.034   7.810
  123    HG   LEU  15           HG       LEU  15  -1.440  -6.898   7.323
  124   HD11  LEU  15          HD11      LEU  15  -3.103  -5.210   6.540
  125   HD12  LEU  15          HD12      LEU  15  -2.045  -3.934   7.130
  126   HD13  LEU  15          HD13      LEU  15  -2.767  -5.074   8.262
  127   HD21  LEU  15          HD21      LEU  15  -1.414  -6.209   4.993
  128   HD22  LEU  15          HD22      LEU  15   0.254  -6.375   5.537
  129   HD23  LEU  15          HD23      LEU  15  -0.468  -4.775   5.387
  130    H    GLU  16           HN       GLU  16   0.107  -8.236   9.646
  131    HA   GLU  16           HA       GLU  16   1.795  -8.311  11.959
  132    HB2  GLU  16           HB2      GLU  16   0.506 -10.256  10.923
  133    HB3  GLU  16           HB1      GLU  16   1.770 -10.340   9.701
  134    HG2  GLU  16           HG2      GLU  16   2.348 -11.932  11.411
  135    HG3  GLU  16           HG1      GLU  16   3.449 -10.569  11.596
  136    H    ASP  17           HN       ASP  17   4.086  -8.569  12.087
  137    HA   ASP  17           HA       ASP  17   5.626  -6.904  10.398
  138    HB2  ASP  17           HB2      ASP  17   6.301  -7.604  12.686
  139    HB3  ASP  17           HB1      ASP  17   6.610  -9.230  12.075
  140    H    VAL  18           HN       VAL  18   5.382 -10.486  10.382
  141    HA   VAL  18           HA       VAL  18   7.172 -10.801   8.156
  142    HB   VAL  18           HB       VAL  18   6.555 -12.652   9.717
  143   HG11  VAL  18          HG11      VAL  18   3.952 -12.795   8.154
  144   HG12  VAL  18          HG12      VAL  18   4.078 -12.060   9.751
  145   HG13  VAL  18          HG13      VAL  18   4.429 -13.773   9.540
  146   HG21  VAL  18          HG21      VAL  18   5.879 -13.230   6.810
  147   HG22  VAL  18          HG22      VAL  18   6.489 -14.386   7.993
  148   HG23  VAL  18          HG23      VAL  18   7.519 -13.065   7.437
  149    H    ASP  19           HN       ASP  19   3.616 -10.478   8.340
  150    HA   ASP  19           HA       ASP  19   3.232 -10.820   5.488
  151    HB2  ASP  19           HB2      ASP  19   1.454  -9.417   7.511
  152    HB3  ASP  19           HB1      ASP  19   0.973  -9.957   5.904
  153    H    LEU  20           HN       LEU  20   4.031  -8.135   7.591
  154    HA   LEU  20           HA       LEU  20   3.430  -6.010   5.764
  155    HB2  LEU  20           HB2      LEU  20   3.893  -5.708   8.210
  156    HB3  LEU  20           HB1      LEU  20   5.574  -6.127   7.909
  157    HG   LEU  20           HG       LEU  20   5.727  -4.170   6.332
  158   HD11  LEU  20          HD11      LEU  20   2.868  -3.787   7.251
  159   HD12  LEU  20          HD12      LEU  20   3.534  -3.677   5.623
  160   HD13  LEU  20          HD13      LEU  20   3.846  -2.395   6.781
  161   HD21  LEU  20          HD21      LEU  20   4.865  -3.573   9.181
  162   HD22  LEU  20          HD22      LEU  20   5.768  -2.469   8.143
  163   HD23  LEU  20          HD23      LEU  20   6.497  -3.991   8.655
  164    H    LYS  21           HN       LYS  21   6.333  -7.955   6.365
  165    HA   LYS  21           HA       LYS  21   8.062  -6.613   4.529
  166    HB2  LYS  21           HB2      LYS  21   8.936  -8.156   6.207
  167    HB3  LYS  21           HB1      LYS  21   8.039  -9.492   5.489
  168    HG2  LYS  21           HG2      LYS  21   9.396  -9.490   3.522
  169    HG3  LYS  21           HG1      LYS  21  10.089  -7.914   3.905
  170    HD2  LYS  21           HD2      LYS  21  11.714  -9.678   4.399
  171    HD3  LYS  21           HD1      LYS  21  11.201  -8.904   5.896
  172    HE2  LYS  21           HE2      LYS  21   9.796 -10.747   6.484
  173    HE3  LYS  21           HE1      LYS  21   9.884 -11.432   4.861
  174    HZ1  LYS  21           HZ1      LYS  21  11.398 -12.700   5.993
  175    HZ2  LYS  21           HZ2      LYS  21  11.909 -11.423   6.990
  176    HZ3  LYS  21           HZ3      LYS  21  12.409 -11.491   5.368
  177    H    LYS  22           HN       LYS  22   5.946  -9.460   4.108
  178    HA   LYS  22           HA       LYS  22   6.627 -10.024   1.407
  179    HB2  LYS  22           HB2      LYS  22   5.050 -11.346   3.007
  180    HB3  LYS  22           HB1      LYS  22   3.769 -10.282   2.422
  181    HG2  LYS  22           HG2      LYS  22   4.313 -10.957   0.089
  182    HG3  LYS  22           HG1      LYS  22   5.522 -12.079   0.715
  183    HD2  LYS  22           HD2      LYS  22   3.741 -13.231   2.015
  184    HD3  LYS  22           HD1      LYS  22   2.547 -12.146   1.304
  185    HE2  LYS  22           HE2      LYS  22   2.647 -14.297   0.084
  186    HE3  LYS  22           HE1      LYS  22   3.134 -12.950  -0.946
  187    HZ1  LYS  22           HZ1      LYS  22   5.152 -14.443   0.595
  188    HZ2  LYS  22           HZ2      LYS  22   5.342 -13.546  -0.837
  189    HZ3  LYS  22           HZ3      LYS  22   4.579 -15.065  -0.876
  190    H    PHE  23           HN       PHE  23   4.495  -7.555   2.743
  191    HA   PHE  23           HA       PHE  23   3.231  -6.802   0.268
  192    HB2  PHE  23           HB2      PHE  23   2.453  -6.094   2.543
  193    HB3  PHE  23           HB1      PHE  23   3.847  -5.024   2.650
  194    HD1  PHE  23           HD2      PHE  23   4.133  -3.162   0.974
  195    HD2  PHE  23           HD1      PHE  23   0.509  -5.457   1.267
  196    HE1  PHE  23           HE2      PHE  23   2.917  -1.410  -0.289
  197    HE2  PHE  23           HE1      PHE  23  -0.702  -3.702   0.005
  198    HZ   PHE  23           HZ       PHE  23   0.501  -1.678  -0.773
  199    H    LYS  24           HN       LYS  24   6.232  -5.646   1.859
  200    HA   LYS  24           HA       LYS  24   6.785  -3.613  -0.098
  201    HB2  LYS  24           HB2      LYS  24   8.643  -5.151   1.744
  202    HB3  LYS  24           HB1      LYS  24   9.114  -3.732   0.807
  203    HG2  LYS  24           HG2      LYS  24   7.328  -2.424   1.952
  204    HG3  LYS  24           HG1      LYS  24   6.965  -3.838   2.943
  205    HD2  LYS  24           HD2      LYS  24   9.228  -3.824   3.860
  206    HD3  LYS  24           HD1      LYS  24   9.673  -2.481   2.809
  207    HE2  LYS  24           HE2      LYS  24   9.158  -1.603   5.019
  208    HE3  LYS  24           HE1      LYS  24   7.890  -1.104   3.900
  209    HZ1  LYS  24           HZ1      LYS  24   7.008  -3.496   4.797
  210    HZ2  LYS  24           HZ2      LYS  24   6.507  -1.984   5.388
  211    HZ3  LYS  24           HZ3      LYS  24   7.739  -2.844   6.181
  212    H    MET  25           HN       MET  25   7.981  -6.958   0.281
  213    HA   MET  25           HA       MET  25   9.611  -6.983  -2.053
  214    HB2  MET  25           HB2      MET  25   9.556  -8.736  -0.216
  215    HB3  MET  25           HB1      MET  25   8.069  -9.349  -0.936
  216    HG2  MET  25           HG2      MET  25   9.865 -10.674  -1.827
  217    HG3  MET  25           HG1      MET  25   9.361  -9.590  -3.121
  218    HE1  MET  25           HE1      MET  25  12.093 -11.265  -2.620
  219    HE2  MET  25           HE2      MET  25  13.298 -10.164  -3.284
  220    HE3  MET  25           HE3      MET  25  11.775 -10.408  -4.134
  221    H    HIS  26           HN       HIS  26   6.157  -7.484  -1.591
  222    HA   HIS  26           HA       HIS  26   5.633  -8.478  -4.268
  223    HB2  HIS  26           HB2      HIS  26   4.087  -8.658  -2.214
  224    HB3  HIS  26           HB1      HIS  26   3.675  -6.964  -2.486
  225    HD1  HIS  26           HD1      HIS  26   3.417  -6.842  -5.506
  226    HD2  HIS  26           HD2      HIS  26   1.915 -10.017  -3.261
  227    HE1  HIS  26           HE1      HIS  26   1.617  -7.928  -6.918
  228    H    LEU  27           HN       LEU  27   5.928  -5.238  -2.871
  229    HA   LEU  27           HA       LEU  27   4.689  -3.815  -5.042
  230    HB2  LEU  27           HB2      LEU  27   5.332  -2.877  -2.755
  231    HB3  LEU  27           HB1      LEU  27   6.994  -2.834  -3.328
  232    HG   LEU  27           HG       LEU  27   6.012  -1.454  -5.353
  233   HD11  LEU  27          HD11      LEU  27   3.824  -1.122  -3.270
  234   HD12  LEU  27          HD12      LEU  27   3.632  -1.735  -4.909
  235   HD13  LEU  27          HD13      LEU  27   4.046  -0.047  -4.647
  236   HD21  LEU  27          HD21      LEU  27   6.207  -0.303  -2.550
  237   HD22  LEU  27          HD22      LEU  27   6.228   0.654  -4.031
  238   HD23  LEU  27          HD23      LEU  27   7.531  -0.487  -3.700
  239    H    GLU  28           HN       GLU  28   8.069  -4.824  -4.489
  240    HA   GLU  28           HA       GLU  28   9.018  -3.652  -6.981
  241    HB2  GLU  28           HB2      GLU  28  10.185  -5.662  -5.032
  242    HB3  GLU  28           HB1      GLU  28  11.030  -5.201  -6.510
  243    HG2  GLU  28           HG2      GLU  28  11.783  -3.841  -4.591
  244    HG3  GLU  28           HG1      GLU  28  10.992  -2.841  -5.809
  245    H    ASP  29           HN       ASP  29   7.653  -6.742  -6.016
  246    HA   ASP  29           HA       ASP  29   8.462  -8.240  -8.329
  247    HB2  ASP  29           HB2      ASP  29   7.561  -9.251  -6.224
  248    HB3  ASP  29           HB1      ASP  29   5.969  -8.618  -6.645
  249    H    TYR  30           HN       TYR  30   6.678  -5.497  -8.288
  250    HA   TYR  30           HA       TYR  30   4.412  -6.112  -9.884
  251    HB2  TYR  30           HB2      TYR  30   4.957  -3.928  -8.662
  252    HB3  TYR  30           HB1      TYR  30   5.977  -3.517 -10.038
  253    HD1  TYR  30           HD2      TYR  30   2.506  -4.364  -8.999
  254    HD2  TYR  30           HD1      TYR  30   4.993  -2.738 -12.103
  255    HE1  TYR  30           HE2      TYR  30   0.488  -3.582 -10.207
  256    HE2  TYR  30           HE1      TYR  30   2.972  -1.954 -13.307
  257    HH   TYR  30           HH       TYR  30   0.630  -2.393 -13.448
  258    HA   PRO  31           HA       PRO  31   6.969  -7.186 -13.473
  259    HB2  PRO  31           HB2      PRO  31   4.764  -7.331 -15.326
  260    HB3  PRO  31           HB1      PRO  31   5.561  -8.683 -14.511
  261    HG2  PRO  31           HG2      PRO  31   2.922  -7.524 -13.941
  262    HG3  PRO  31           HG1      PRO  31   3.636  -9.004 -13.283
  263    HD2  PRO  31           HD2      PRO  31   3.288  -6.501 -11.904
  264    HD3  PRO  31           HD1      PRO  31   4.139  -7.943 -11.303
  265    HA   PRO  32           HA       PRO  32   7.262  -3.106 -15.312
  266    HB2  PRO  32           HB2      PRO  32   8.442  -3.765 -17.801
  267    HB3  PRO  32           HB1      PRO  32   9.327  -3.499 -16.291
  268    HG2  PRO  32           HG2      PRO  32   8.702  -6.078 -17.655
  269    HG3  PRO  32           HG1      PRO  32  10.004  -5.708 -16.510
  270    HD2  PRO  32           HD2      PRO  32   7.653  -7.156 -15.881
  271    HD3  PRO  32           HD1      PRO  32   8.745  -6.398 -14.700
  272    H    GLN  33           HN       GLN  33   5.991  -1.818 -16.694
  273    HA   GLN  33           HA       GLN  33   3.967  -3.240 -18.420
  274    HB2  GLN  33           HB2      GLN  33   3.795  -0.515 -17.088
  275    HB3  GLN  33           HB1      GLN  33   2.527  -1.289 -18.038
  276    HG2  GLN  33           HG2      GLN  33   3.718  -2.487 -15.519
  277    HG3  GLN  33           HG1      GLN  33   2.228  -1.544 -15.553
  278   HE21  GLN  33          HE21      GLN  33   3.345  -4.700 -15.645
  279   HE22  GLN  33          HE22      GLN  33   2.029  -5.429 -16.430
  280    H    LYS  34           HN       LYS  34   6.808  -2.067 -18.943
  281    HA   LYS  34           HA       LYS  34   7.864  -0.909 -20.678
  282    HB2  LYS  34           HB2      LYS  34   6.306  -2.543 -21.930
  283    HB3  LYS  34           HB1      LYS  34   5.238  -1.166 -22.181
  284    HG2  LYS  34           HG2      LYS  34   7.053   0.051 -23.320
  285    HG3  LYS  34           HG1      LYS  34   8.152  -1.296 -23.028
  286    HD2  LYS  34           HD2      LYS  34   6.596  -2.774 -24.326
  287    HD3  LYS  34           HD1      LYS  34   5.636  -1.347 -24.718
  288    HE2  LYS  34           HE2      LYS  34   8.531  -1.850 -25.461
  289    HE3  LYS  34           HE1      LYS  34   7.155  -1.754 -26.560
  290    HZ1  LYS  34           HZ1      LYS  34   7.589   0.402 -26.712
  291    HZ2  LYS  34           HZ2      LYS  34   8.725   0.344 -25.451
  292    HZ3  LYS  34           HZ3      LYS  34   7.077   0.570 -25.104
  293    H    GLY  35           HN       GLY  35   6.977   0.765 -18.743
  294    HA2  GLY  35           HA2      GLY  35   6.917   3.311 -19.852
  295    HA3  GLY  35           HA1      GLY  35   5.215   2.857 -19.729
  296    H    CYS  36           HN       CYS  36   5.246   1.366 -17.382
  297    HA   CYS  36           HA       CYS  36   5.107   3.378 -15.369
  298    HB2  CYS  36           HB2      CYS  36   4.769   1.524 -13.813
  299    HB3  CYS  36           HB1      CYS  36   3.925   1.157 -15.314
  300    HG   CYS  36           HG       CYS  36   5.249  -0.952 -15.171
  301    H    ILE  37           HN       ILE  37   6.660   4.141 -13.920
  302    HA   ILE  37           HA       ILE  37   9.446   3.469 -14.465
  303    HB   ILE  37           HB       ILE  37   8.787   5.773 -14.026
  304   HG12  ILE  37          HG12      ILE  37  10.498   4.685 -11.763
  305   HG13  ILE  37          HG11      ILE  37  11.071   4.984 -13.407
  306   HG21  ILE  37          HG21      ILE  37   6.952   5.006 -12.300
  307   HG22  ILE  37          HG22      ILE  37   7.779   6.538 -12.039
  308   HG23  ILE  37          HG23      ILE  37   8.257   5.118 -11.117
  309   HD11  ILE  37          HD11      ILE  37   9.973   7.046 -11.460
  310   HD12  ILE  37          HD12      ILE  37  10.339   7.387 -13.152
  311   HD13  ILE  37          HD13      ILE  37  11.634   6.925 -12.046
  312    HA   PRO  38           HA       PRO  38   9.061   0.284 -11.207
  313    HB2  PRO  38           HB2      PRO  38  11.818  -0.482 -11.275
  314    HB3  PRO  38           HB1      PRO  38  10.487  -1.278 -12.125
  315    HG2  PRO  38           HG2      PRO  38  12.605   0.431 -13.252
  316    HG3  PRO  38           HG1      PRO  38  11.441  -0.591 -14.109
  317    HD2  PRO  38           HD2      PRO  38  11.386   2.278 -13.905
  318    HD3  PRO  38           HD1      PRO  38  10.134   1.235 -14.623
  319    H    LEU  39           HN       LEU  39   9.344   0.519  -8.999
  320    HA   LEU  39           HA       LEU  39  10.763   2.895  -8.029
  321    HB2  LEU  39           HB2      LEU  39   8.985   0.785  -6.807
  322    HB3  LEU  39           HB1      LEU  39   9.891   1.870  -5.756
  323    HG   LEU  39           HG       LEU  39   8.839   3.816  -6.796
  324   HD11  LEU  39          HD11      LEU  39   8.547   3.113  -9.073
  325   HD12  LEU  39          HD12      LEU  39   6.929   3.391  -8.434
  326   HD13  LEU  39          HD13      LEU  39   7.543   1.744  -8.592
  327   HD21  LEU  39          HD21      LEU  39   6.752   1.718  -6.126
  328   HD22  LEU  39          HD22      LEU  39   6.569   3.466  -5.984
  329   HD23  LEU  39          HD23      LEU  39   7.688   2.609  -4.925
  330    HA   PRO  40           HA       PRO  40  14.445   0.235  -7.502
  331    HB2  PRO  40           HB2      PRO  40  15.657   2.238  -5.716
  332    HB3  PRO  40           HB1      PRO  40  16.176   1.763  -7.341
  333    HG2  PRO  40           HG2      PRO  40  14.881   4.219  -6.612
  334    HG3  PRO  40           HG1      PRO  40  15.241   3.660  -8.253
  335    HD2  PRO  40           HD2      PRO  40  12.626   3.808  -6.946
  336    HD3  PRO  40           HD1      PRO  40  12.983   3.349  -8.626
  337    H    ARG  41           HN       ARG  41  14.907  -1.276  -5.898
  338    HA   ARG  41           HA       ARG  41  13.122  -1.502  -3.656
  339    HB2  ARG  41           HB2      ARG  41  14.711  -3.337  -2.919
  340    HB3  ARG  41           HB1      ARG  41  14.161  -3.510  -4.587
  341    HG2  ARG  41           HG2      ARG  41  16.249  -2.436  -5.379
  342    HG3  ARG  41           HG1      ARG  41  16.803  -2.301  -3.712
  343    HD2  ARG  41           HD2      ARG  41  16.075  -4.930  -5.029
  344    HD3  ARG  41           HD1      ARG  41  17.720  -4.301  -4.934
  345    HE   ARG  41           HE       ARG  41  16.822  -4.237  -2.306
  346   HH11  ARG  41          HH21      ARG  41  17.052  -6.597  -4.817
  347   HH12  ARG  41          HH22      ARG  41  17.279  -7.923  -3.727
  348   HH21  ARG  41          HH11      ARG  41  17.117  -5.957  -0.876
  349   HH22  ARG  41          HH12      ARG  41  17.316  -7.561  -1.498
  350    H    GLY  42           HN       GLY  42  16.349  -0.143  -4.034
  351    HA2  GLY  42           HA2      GLY  42  16.981   0.110  -1.235
  352    HA3  GLY  42           HA1      GLY  42  17.677   1.118  -2.505
  353    H    GLN  43           HN       GLN  43  14.843   1.934  -3.318
  354    HA   GLN  43           HA       GLN  43  14.730   4.306  -1.649
  355    HB2  GLN  43           HB2      GLN  43  14.112   4.142  -4.129
  356    HB3  GLN  43           HB1      GLN  43  12.625   3.343  -3.621
  357    HG2  GLN  43           HG2      GLN  43  12.032   5.309  -2.243
  358    HG3  GLN  43           HG1      GLN  43  13.519   6.113  -2.750
  359   HE21  GLN  43          HE21      GLN  43  12.928   7.700  -4.248
  360   HE22  GLN  43          HE22      GLN  43  11.855   7.457  -5.542
  361    H    THR  44           HN       THR  44  12.820   1.301  -1.825
  362    HA   THR  44           HA       THR  44  10.755   2.243  -0.021
  363    HB   THR  44           HB       THR  44   9.953  -0.009  -0.005
  364    HG1  THR  44           HG1      THR  44  11.415  -1.473   0.257
  365   HG21  THR  44          HG21      THR  44   9.857   1.203  -2.210
  366   HG22  THR  44          HG22      THR  44   9.841  -0.555  -2.355
  367   HG23  THR  44          HG23      THR  44  11.324   0.344  -2.682
  368    H    GLU  45           HN       GLU  45  13.446  -0.087   0.515
  369    HA   GLU  45           HA       GLU  45  13.019  -0.348   3.312
  370    HB2  GLU  45           HB2      GLU  45  15.377  -1.142   3.406
  371    HB3  GLU  45           HB1      GLU  45  14.501  -1.866   2.054
  372    HG2  GLU  45           HG2      GLU  45  15.450  -0.043   0.581
  373    HG3  GLU  45           HG1      GLU  45  16.461   0.440   1.942
  374    H    LYS  46           HN       LYS  46  14.934   2.090   1.498
  375    HA   LYS  46           HA       LYS  46  16.043   3.295   3.894
  376    HB2  LYS  46           HB2      LYS  46  15.699   4.269   1.039
  377    HB3  LYS  46           HB1      LYS  46  16.414   5.286   2.291
  378    HG2  LYS  46           HG2      LYS  46  18.131   3.554   2.708
  379    HG3  LYS  46           HG1      LYS  46  17.431   2.560   1.433
  380    HD2  LYS  46           HD2      LYS  46  17.863   4.359  -0.205
  381    HD3  LYS  46           HD1      LYS  46  18.585   5.339   1.071
  382    HE2  LYS  46           HE2      LYS  46  19.575   2.602   0.221
  383    HE3  LYS  46           HE1      LYS  46  20.304   4.134  -0.263
  384    HZ1  LYS  46           HZ1      LYS  46  20.625   4.636   2.111
  385    HZ2  LYS  46           HZ2      LYS  46  21.478   3.253   1.613
  386    HZ3  LYS  46           HZ3      LYS  46  20.041   3.093   2.506
  387    H    ALA  47           HN       ALA  47  12.948   3.354   2.408
  388    HA   ALA  47           HA       ALA  47  12.142   5.954   3.561
  389    HB1  ALA  47           HB1      ALA  47  10.429   3.812   2.263
  390    HB2  ALA  47           HB2      ALA  47  11.242   5.100   1.374
  391    HB3  ALA  47           HB3      ALA  47   9.987   5.496   2.548
  392    H    ASP  48           HN       ASP  48  10.958   6.194   5.439
  393    HA   ASP  48           HA       ASP  48  10.851   3.906   7.291
  394    HB2  ASP  48           HB2      ASP  48   9.738   6.713   7.631
  395    HB3  ASP  48           HB1      ASP  48  10.056   5.542   8.911
  396    H    HIS  49           HN       HIS  49   8.674   3.558   8.504
  397    HA   HIS  49           HA       HIS  49   6.710   2.651   6.677
  398    HB2  HIS  49           HB2      HIS  49   6.446   3.364   9.613
  399    HB3  HIS  49           HB1      HIS  49   5.216   2.504   8.688
  400    HD1  HIS  49           HD1      HIS  49   6.763   0.491   7.117
  401    HD2  HIS  49           HD2      HIS  49   7.760   1.416  11.058
  402    HE1  HIS  49           HE1      HIS  49   8.080  -1.482   8.006
  403    H    VAL  50           HN       VAL  50   6.761   5.657   8.635
  404    HA   VAL  50           HA       VAL  50   4.255   6.647   7.548
  405    HB   VAL  50           HB       VAL  50   6.600   8.163   8.785
  406   HG11  VAL  50          HG11      VAL  50   4.836   9.918   9.244
  407   HG12  VAL  50          HG12      VAL  50   3.748   9.025   8.183
  408   HG13  VAL  50          HG13      VAL  50   5.232   9.728   7.538
  409   HG21  VAL  50          HG21      VAL  50   5.146   8.172  10.822
  410   HG22  VAL  50          HG22      VAL  50   5.643   6.549  10.354
  411   HG23  VAL  50          HG23      VAL  50   4.012   7.110   9.990
  412    H    ASP  51           HN       ASP  51   7.680   7.361   6.783
  413    HA   ASP  51           HA       ASP  51   7.163   9.165   4.646
  414    HB2  ASP  51           HB2      ASP  51   9.473   7.243   5.081
  415    HB3  ASP  51           HB1      ASP  51   9.462   8.508   3.852
  416    H    LEU  52           HN       LEU  52   7.259   5.629   4.738
  417    HA   LEU  52           HA       LEU  52   7.315   5.089   1.979
  418    HB2  LEU  52           HB2      LEU  52   7.442   3.337   3.719
  419    HB3  LEU  52           HB1      LEU  52   5.753   3.620   4.122
  420    HG   LEU  52           HG       LEU  52   5.102   2.930   1.817
  421   HD11  LEU  52          HD11      LEU  52   6.953   3.370   0.417
  422   HD12  LEU  52          HD12      LEU  52   6.995   1.621   0.563
  423   HD13  LEU  52          HD13      LEU  52   8.099   2.608   1.521
  424   HD21  LEU  52          HD21      LEU  52   5.087   1.280   3.607
  425   HD22  LEU  52          HD22      LEU  52   6.810   0.979   3.387
  426   HD23  LEU  52          HD23      LEU  52   5.666   0.514   2.128
  427    H    ALA  53           HN       ALA  53   4.430   5.596   4.054
  428    HA   ALA  53           HA       ALA  53   2.513   5.441   1.934
  429    HB1  ALA  53           HB1      ALA  53   2.460   6.940   4.572
  430    HB2  ALA  53           HB2      ALA  53   1.776   5.349   4.238
  431    HB3  ALA  53           HB3      ALA  53   1.061   6.786   3.509
  432    H    THR  54           HN       THR  54   4.625   8.048   2.991
  433    HA   THR  54           HA       THR  54   3.215  10.153   1.564
  434    HB   THR  54           HB       THR  54   6.118  10.042   2.454
  435    HG1  THR  54           HG1      THR  54   4.608   9.726   4.142
  436   HG21  THR  54          HG21      THR  54   5.854  12.536   2.495
  437   HG22  THR  54          HG22      THR  54   4.284  12.343   1.718
  438   HG23  THR  54          HG23      THR  54   5.753  11.849   0.874
  439    H    LEU  55           HN       LEU  55   5.865   7.925   0.726
  440    HA   LEU  55           HA       LEU  55   6.491   9.263  -1.782
  441    HB2  LEU  55           HB2      LEU  55   7.054   6.377  -1.015
  442    HB3  LEU  55           HB1      LEU  55   7.779   7.249  -2.353
  443    HG   LEU  55           HG       LEU  55   8.080   8.153   0.534
  444   HD11  LEU  55          HD11      LEU  55  10.346   7.113   0.414
  445   HD12  LEU  55          HD12      LEU  55   9.896   6.381  -1.125
  446   HD13  LEU  55          HD13      LEU  55   9.047   5.923   0.350
  447   HD21  LEU  55          HD21      LEU  55   9.470   8.865  -2.070
  448   HD22  LEU  55          HD22      LEU  55  10.138   9.277  -0.493
  449   HD23  LEU  55          HD23      LEU  55   8.588   9.942  -0.990
  450    H    MET  56           HN       MET  56   4.315   6.661  -0.804
  451    HA   MET  56           HA       MET  56   3.644   5.873  -3.509
  452    HB2  MET  56           HB2      MET  56   3.300   4.502  -1.373
  453    HB3  MET  56           HB1      MET  56   1.892   5.514  -1.055
  454    HG2  MET  56           HG2      MET  56   1.022   4.884  -3.345
  455    HG3  MET  56           HG1      MET  56   2.355   3.736  -3.472
  456    HE1  MET  56           HE1      MET  56  -0.349   1.214  -2.941
  457    HE2  MET  56           HE2      MET  56   1.382   1.224  -3.266
  458    HE3  MET  56           HE3      MET  56   0.329   2.365  -4.102
  459    H    ILE  57           HN       ILE  57   2.178   8.150  -1.177
  460    HA   ILE  57           HA       ILE  57  -0.055   8.741  -2.986
  461    HB   ILE  57           HB       ILE  57   0.896  10.290  -0.544
  462   HG12  ILE  57          HG12      ILE  57  -1.395   8.308  -0.762
  463   HG13  ILE  57          HG11      ILE  57   0.207   7.849  -0.191
  464   HG21  ILE  57          HG21      ILE  57  -1.657  10.381  -2.177
  465   HG22  ILE  57          HG22      ILE  57  -0.503  11.691  -1.931
  466   HG23  ILE  57          HG23      ILE  57  -1.488  11.122  -0.588
  467   HD11  ILE  57          HD11      ILE  57  -1.283   8.384   1.700
  468   HD12  ILE  57          HD12      ILE  57  -1.549   9.996   1.037
  469   HD13  ILE  57          HD13      ILE  57   0.054   9.531   1.607
  470    H    ASP  58           HN       ASP  58   3.018  10.372  -2.153
  471    HA   ASP  58           HA       ASP  58   2.459  12.647  -3.895
  472    HB2  ASP  58           HB2      ASP  58   4.994  11.675  -2.526
  473    HB3  ASP  58           HB1      ASP  58   4.898  13.181  -3.440
  474    H    PHE  59           HN       PHE  59   4.660   9.818  -4.147
  475    HA   PHE  59           HA       PHE  59   5.561  10.616  -6.794
  476    HB2  PHE  59           HB2      PHE  59   6.713   9.128  -4.932
  477    HB3  PHE  59           HB1      PHE  59   5.887   7.800  -5.735
  478    HD1  PHE  59           HD2      PHE  59   8.457  10.428  -6.081
  479    HD2  PHE  59           HD1      PHE  59   6.499   7.133  -8.024
  480    HE1  PHE  59           HE2      PHE  59  10.223  10.405  -7.820
  481    HE2  PHE  59           HE1      PHE  59   8.268   7.113  -9.762
  482    HZ   PHE  59           HZ       PHE  59  10.128   8.746  -9.661
  483    H    ASN  60           HN       ASN  60   3.215   8.095  -5.680
  484    HA   ASN  60           HA       ASN  60   2.689   7.383  -8.528
  485    HB2  ASN  60           HB2      ASN  60   2.869   5.719  -6.501
  486    HB3  ASN  60           HB1      ASN  60   1.218   6.212  -6.147
  487   HD21  ASN  60          HD21      ASN  60   1.210   6.576  -9.372
  488   HD22  ASN  60          HD22      ASN  60   0.786   5.010  -9.871
  489    H    GLY  61           HN       GLY  61   1.213   9.174  -5.897
  490    HA2  GLY  61           HA2      GLY  61  -0.412  10.925  -6.322
  491    HA3  GLY  61           HA1      GLY  61  -0.963  10.060  -7.754
  492    H    GLU  62           HN       GLU  62  -2.724  10.988  -5.751
  493    HA   GLU  62           HA       GLU  62  -3.409   8.912  -3.863
  494    HB2  GLU  62           HB2      GLU  62  -4.064  11.322  -3.639
  495    HB3  GLU  62           HB1      GLU  62  -5.191  11.097  -4.977
  496    HG2  GLU  62           HG2      GLU  62  -6.422   9.409  -3.721
  497    HG3  GLU  62           HG1      GLU  62  -5.241   9.476  -2.412
  498    H    GLU  63           HN       GLU  63  -4.337   9.598  -7.194
  499    HA   GLU  63           HA       GLU  63  -6.604   7.811  -7.244
  500    HB2  GLU  63           HB2      GLU  63  -6.267   9.637  -8.893
  501    HB3  GLU  63           HB1      GLU  63  -4.865   8.784  -9.535
  502    HG2  GLU  63           HG2      GLU  63  -6.263   6.907 -10.228
  503    HG3  GLU  63           HG1      GLU  63  -7.678   7.636  -9.468
  504    H    LYS  64           HN       LYS  64  -3.267   7.430  -8.521
  505    HA   LYS  64           HA       LYS  64  -3.706   4.625  -9.163
  506    HB2  LYS  64           HB2      LYS  64  -1.231   6.369  -9.035
  507    HB3  LYS  64           HB1      LYS  64  -1.136   4.649  -9.408
  508    HG2  LYS  64           HG2      LYS  64  -2.686   4.984 -11.310
  509    HG3  LYS  64           HG1      LYS  64  -2.737   6.711 -10.959
  510    HD2  LYS  64           HD2      LYS  64  -0.336   6.903 -11.359
  511    HD3  LYS  64           HD1      LYS  64  -0.214   5.161 -11.609
  512    HE2  LYS  64           HE2      LYS  64  -1.901   7.031 -13.298
  513    HE3  LYS  64           HE1      LYS  64  -0.311   6.422 -13.757
  514    HZ1  LYS  64           HZ1      LYS  64  -1.256   4.575 -14.484
  515    HZ2  LYS  64           HZ2      LYS  64  -2.790   5.178 -14.073
  516    HZ3  LYS  64           HZ3      LYS  64  -1.904   4.262 -12.950
  517    H    ALA  65           HN       ALA  65  -2.117   6.324  -6.438
  518    HA   ALA  65           HA       ALA  65  -0.988   4.092  -5.152
  519    HB1  ALA  65           HB1      ALA  65  -2.319   6.512  -3.918
  520    HB2  ALA  65           HB2      ALA  65  -0.614   6.350  -4.335
  521    HB3  ALA  65           HB3      ALA  65  -1.301   5.375  -3.037
  522    H    TRP  66           HN       TRP  66  -4.262   5.438  -4.520
  523    HA   TRP  66           HA       TRP  66  -5.096   3.374  -2.761
  524    HB2  TRP  66           HB2      TRP  66  -6.489   5.392  -4.501
  525    HB3  TRP  66           HB1      TRP  66  -7.478   4.064  -3.905
  526    HD1  TRP  66           HD1      TRP  66  -5.493   7.102  -2.718
  527    HE1  TRP  66           HE1      TRP  66  -6.165   7.627  -0.284
  528    HE3  TRP  66           HE3      TRP  66  -8.383   3.022  -1.706
  529    HZ2  TRP  66           HZ2      TRP  66  -7.720   6.471   1.815
  530    HZ3  TRP  66           HZ3      TRP  66  -9.455   2.756   0.537
  531    HH2  TRP  66           HH2      TRP  66  -9.120   4.478   2.284
  532    H    ALA  67           HN       ALA  67  -5.433   3.585  -6.317
  533    HA   ALA  67           HA       ALA  67  -6.835   1.162  -6.713
  534    HB1  ALA  67           HB1      ALA  67  -5.884   1.185  -8.989
  535    HB2  ALA  67           HB2      ALA  67  -4.690   2.378  -8.482
  536    HB3  ALA  67           HB3      ALA  67  -6.401   2.803  -8.514
  537    H    MET  68           HN       MET  68  -3.357   1.731  -6.287
  538    HA   MET  68           HA       MET  68  -2.643  -1.067  -6.749
  539    HB2  MET  68           HB2      MET  68  -1.172   1.363  -5.692
  540    HB3  MET  68           HB1      MET  68  -0.426  -0.231  -5.627
  541    HG2  MET  68           HG2      MET  68  -0.746  -0.465  -8.076
  542    HG3  MET  68           HG1      MET  68  -1.428   1.159  -8.132
  543    HE1  MET  68           HE1      MET  68   1.112   0.082  -9.801
  544    HE2  MET  68           HE2      MET  68   1.646  -0.934  -8.465
  545    HE3  MET  68           HE3      MET  68   2.699   0.344  -9.065
  546    H    ALA  69           HN       ALA  69  -3.442   0.925  -3.945
  547    HA   ALA  69           HA       ALA  69  -2.542  -0.940  -1.951
  548    HB1  ALA  69           HB1      ALA  69  -4.799   1.081  -1.732
  549    HB2  ALA  69           HB2      ALA  69  -3.095   1.468  -1.503
  550    HB3  ALA  69           HB3      ALA  69  -3.904   0.361  -0.393
  551    H    VAL  70           HN       VAL  70  -5.731  -0.430  -3.490
  552    HA   VAL  70           HA       VAL  70  -6.976  -2.606  -1.977
  553    HB   VAL  70           HB       VAL  70  -8.888  -2.259  -3.472
  554   HG11  VAL  70          HG11      VAL  70  -8.548  -0.698  -1.588
  555   HG12  VAL  70          HG12      VAL  70  -9.274   0.140  -2.962
  556   HG13  VAL  70          HG13      VAL  70  -7.555   0.334  -2.617
  557   HG21  VAL  70          HG21      VAL  70  -7.829  -1.925  -5.614
  558   HG22  VAL  70          HG22      VAL  70  -6.920  -0.538  -5.017
  559   HG23  VAL  70          HG23      VAL  70  -8.665  -0.420  -5.236
  560    H    TRP  71           HN       TRP  71  -5.582  -2.291  -5.254
  561    HA   TRP  71           HA       TRP  71  -6.394  -4.919  -6.099
  562    HB2  TRP  71           HB2      TRP  71  -5.692  -3.118  -7.691
  563    HB3  TRP  71           HB1      TRP  71  -4.035  -3.285  -7.123
  564    HD1  TRP  71           HD1      TRP  71  -6.629  -4.938  -9.308
  565    HE1  TRP  71           HE1      TRP  71  -5.562  -6.936 -10.539
  566    HE3  TRP  71           HE3      TRP  71  -2.151  -5.176  -6.877
  567    HZ2  TRP  71           HZ2      TRP  71  -3.125  -8.437 -10.494
  568    HZ3  TRP  71           HZ3      TRP  71  -0.476  -6.893  -7.486
  569    HH2  TRP  71           HH2      TRP  71  -0.955  -8.526  -9.291
  570    H    ILE  72           HN       ILE  72  -3.531  -3.743  -4.323
  571    HA   ILE  72           HA       ILE  72  -2.142  -6.320  -4.543
  572    HB   ILE  72           HB       ILE  72  -1.741  -3.878  -2.765
  573   HG12  ILE  72          HG12      ILE  72   0.076  -5.174  -4.830
  574   HG13  ILE  72          HG11      ILE  72  -1.041  -3.871  -5.211
  575   HG21  ILE  72          HG21      ILE  72  -0.291  -6.544  -2.663
  576   HG22  ILE  72          HG22      ILE  72  -1.070  -5.691  -1.332
  577   HG23  ILE  72          HG23      ILE  72   0.413  -5.058  -2.031
  578   HD11  ILE  72          HD11      ILE  72   0.106  -2.361  -3.687
  579   HD12  ILE  72          HD12      ILE  72   1.299  -3.082  -4.764
  580   HD13  ILE  72          HD13      ILE  72   1.141  -3.669  -3.111
  581    H    PHE  73           HN       PHE  73  -4.451  -4.882  -2.242
  582    HA   PHE  73           HA       PHE  73  -4.174  -6.733  -0.126
  583    HB2  PHE  73           HB2      PHE  73  -6.452  -5.055  -1.173
  584    HB3  PHE  73           HB1      PHE  73  -6.780  -6.221   0.103
  585    HD1  PHE  73           HD1      PHE  73  -3.553  -4.324  -0.252
  586    HD2  PHE  73           HD2      PHE  73  -7.290  -4.660   1.859
  587    HE1  PHE  73           HE1      PHE  73  -2.750  -2.712   1.431
  588    HE2  PHE  73           HE2      PHE  73  -6.470  -3.041   3.544
  589    HZ   PHE  73           HZ       PHE  73  -4.202  -2.066   3.329
  590    H    ALA  74           HN       ALA  74  -6.286  -6.962  -3.036
  591    HA   ALA  74           HA       ALA  74  -7.391  -9.515  -2.340
  592    HB1  ALA  74           HB1      ALA  74  -6.953  -8.295  -5.089
  593    HB2  ALA  74           HB2      ALA  74  -8.377  -8.050  -4.076
  594    HB3  ALA  74           HB3      ALA  74  -8.022  -9.651  -4.728
  595    H    ALA  75           HN       ALA  75  -4.356  -8.580  -3.844
  596    HA   ALA  75           HA       ALA  75  -3.690 -11.092  -5.024
  597    HB1  ALA  75           HB1      ALA  75  -1.738  -9.131  -3.777
  598    HB2  ALA  75           HB2      ALA  75  -2.455  -8.908  -5.371
  599    HB3  ALA  75           HB3      ALA  75  -1.406 -10.293  -5.061
  600    H    ILE  76           HN       ILE  76  -3.100  -9.819  -1.743
  601    HA   ILE  76           HA       ILE  76  -1.720 -12.219  -0.873
  602    HB   ILE  76           HB       ILE  76  -3.010 -10.558   1.264
  603   HG12  ILE  76          HG12      ILE  76  -1.103  -9.284  -0.738
  604   HG13  ILE  76          HG11      ILE  76  -2.743  -8.770  -0.356
  605   HG21  ILE  76          HG21      ILE  76  -0.063 -11.060   0.745
  606   HG22  ILE  76          HG22      ILE  76  -1.107 -12.259   1.509
  607   HG23  ILE  76          HG23      ILE  76  -0.851 -10.698   2.282
  608   HD11  ILE  76          HD11      ILE  76  -1.326  -7.291   0.853
  609   HD12  ILE  76          HD12      ILE  76  -0.300  -8.608   1.417
  610   HD13  ILE  76          HD13      ILE  76  -1.938  -8.432   2.050
  611    H    ASN  77           HN       ASN  77  -4.643 -12.158  -1.989
  612    HA   ASN  77           HA       ASN  77  -6.610 -13.360  -1.662
  613    HB2  ASN  77           HB2      ASN  77  -4.701 -15.030   0.018
  614    HB3  ASN  77           HB1      ASN  77  -6.346 -15.523  -0.369
  615   HD21  ASN  77          HD21      ASN  77  -4.544 -13.669  -2.749
  616   HD22  ASN  77          HD22      ASN  77  -4.266 -14.957  -3.820
  617    H    ARG  78           HN       ARG  78  -5.382 -11.422   0.635
  618    HA   ARG  78           HA       ARG  78  -7.077 -12.216   2.915
  619    HB2  ARG  78           HB2      ARG  78  -5.357  -9.780   2.335
  620    HB3  ARG  78           HB1      ARG  78  -6.324  -9.935   3.802
  621    HG2  ARG  78           HG2      ARG  78  -5.150 -12.028   4.365
  622    HG3  ARG  78           HG1      ARG  78  -4.184 -11.889   2.905
  623    HD2  ARG  78           HD2      ARG  78  -3.598  -9.482   3.937
  624    HD3  ARG  78           HD1      ARG  78  -3.990 -10.297   5.449
  625    HE   ARG  78           HE       ARG  78  -1.561 -10.561   3.998
  626   HH11  ARG  78          HH21      ARG  78  -3.944 -12.561   5.501
  627   HH12  ARG  78          HH22      ARG  78  -2.921 -13.952   5.551
  628   HH21  ARG  78          HH11      ARG  78  -0.222 -12.358   4.085
  629   HH22  ARG  78          HH12      ARG  78  -0.815 -13.837   4.763
  630    H    ARG  79           HN       ARG  79  -8.776 -12.127   0.876
  631    HA   ARG  79           HA       ARG  79  -9.902  -9.678   0.061
  632    HB2  ARG  79           HB2      ARG  79 -10.482 -12.032  -0.749
  633    HB3  ARG  79           HB1      ARG  79 -11.503 -12.180   0.679
  634    HG2  ARG  79           HG2      ARG  79 -13.056 -11.410  -0.900
  635    HG3  ARG  79           HG1      ARG  79 -12.552  -9.891  -0.171
  636    HD2  ARG  79           HD2      ARG  79 -10.692 -10.038  -2.148
  637    HD3  ARG  79           HD1      ARG  79 -11.981 -10.952  -2.920
  638    HE   ARG  79           HE       ARG  79 -11.869  -8.126  -2.682
  639   HH11  ARG  79          HH21      ARG  79 -14.090 -10.709  -2.107
  640   HH12  ARG  79          HH22      ARG  79 -15.476  -9.676  -2.094
  641   HH21  ARG  79          HH11      ARG  79 -13.668  -6.788  -2.694
  642   HH22  ARG  79          HH12      ARG  79 -15.242  -7.464  -2.434
  643    H    ASP  80           HN       ASP  80 -10.234 -11.368   3.126
  644    HA   ASP  80           HA       ASP  80 -12.562 -10.065   4.105
  645    HB2  ASP  80           HB2      ASP  80 -11.640 -10.580   6.370
  646    HB3  ASP  80           HB1      ASP  80 -11.528 -11.968   5.283
  647    H    LEU  81           HN       LEU  81  -9.139  -9.075   4.240
  648    HA   LEU  81           HA       LEU  81  -9.574  -6.734   5.798
  649    HB2  LEU  81           HB2      LEU  81  -7.329  -7.791   5.319
  650    HB3  LEU  81           HB1      LEU  81  -7.412  -7.112   3.700
  651    HG   LEU  81           HG       LEU  81  -7.651  -4.826   4.727
  652   HD11  LEU  81          HD11      LEU  81  -8.415  -5.046   6.925
  653   HD12  LEU  81          HD12      LEU  81  -6.697  -4.825   7.216
  654   HD13  LEU  81          HD13      LEU  81  -7.394  -6.442   7.267
  655   HD21  LEU  81          HD21      LEU  81  -5.172  -6.387   5.519
  656   HD22  LEU  81          HD22      LEU  81  -5.266  -4.640   5.310
  657   HD23  LEU  81          HD23      LEU  81  -5.480  -5.705   3.923
  658    H    TYR  82           HN       TYR  82 -10.147  -7.371   2.390
  659    HA   TYR  82           HA       TYR  82 -10.232  -4.580   1.592
  660    HB2  TYR  82           HB2      TYR  82  -9.902  -6.293  -0.103
  661    HB3  TYR  82           HB1      TYR  82 -11.417  -7.078   0.328
  662    HD1  TYR  82           HD1      TYR  82  -9.931  -3.973  -1.092
  663    HD2  TYR  82           HD2      TYR  82 -13.517  -6.277  -0.544
  664    HE1  TYR  82           HE1      TYR  82 -11.135  -2.483  -2.669
  665    HE2  TYR  82           HE2      TYR  82 -14.715  -4.789  -2.124
  666    HH   TYR  82           HH       TYR  82 -13.898  -1.905  -2.904
  667    H    GLU  83           HN       GLU  83 -12.576  -6.886   2.901
  668    HA   GLU  83           HA       GLU  83 -14.916  -5.320   2.397
  669    HB2  GLU  83           HB2      GLU  83 -14.777  -7.771   3.183
  670    HB3  GLU  83           HB1      GLU  83 -14.520  -7.134   4.804
  671    HG2  GLU  83           HG2      GLU  83 -16.908  -6.400   3.074
  672    HG3  GLU  83           HG1      GLU  83 -16.926  -7.694   4.268
  673    H    LYS  84           HN       LYS  84 -12.630  -5.396   5.128
  674    HA   LYS  84           HA       LYS  84 -14.064  -3.363   6.642
  675    HB2  LYS  84           HB2      LYS  84 -11.196  -4.329   6.858
  676    HB3  LYS  84           HB1      LYS  84 -12.025  -3.318   8.041
  677    HG2  LYS  84           HG2      LYS  84 -13.717  -5.103   8.362
  678    HG3  LYS  84           HG1      LYS  84 -12.842  -6.120   7.218
  679    HD2  LYS  84           HD2      LYS  84 -10.853  -6.064   8.664
  680    HD3  LYS  84           HD1      LYS  84 -11.703  -5.021   9.804
  681    HE2  LYS  84           HE2      LYS  84 -12.575  -7.819   9.021
  682    HE3  LYS  84           HE1      LYS  84 -11.754  -7.395  10.523
  683    HZ1  LYS  84           HZ1      LYS  84 -13.696  -5.694  10.706
  684    HZ2  LYS  84           HZ2      LYS  84 -13.931  -7.312  11.166
  685    HZ3  LYS  84           HZ3      LYS  84 -14.487  -6.766   9.656
  686    H    ALA  85           HN       ALA  85 -11.056  -3.345   4.698
  687    HA   ALA  85           HA       ALA  85 -10.452  -0.600   4.955
  688    HB1  ALA  85           HB1      ALA  85 -10.042  -2.364   2.521
  689    HB2  ALA  85           HB2      ALA  85  -8.937  -2.243   3.889
  690    HB3  ALA  85           HB3      ALA  85  -9.203  -0.847   2.845
  691    H    LYS  86           HN       LYS  86 -12.816  -2.216   2.917
  692    HA   LYS  86           HA       LYS  86 -13.356   0.024   1.192
  693    HB2  LYS  86           HB2      LYS  86 -14.074  -2.275   0.612
  694    HB3  LYS  86           HB1      LYS  86 -15.182  -2.288   1.981
  695    HG2  LYS  86           HG2      LYS  86 -15.520   0.034   0.107
  696    HG3  LYS  86           HG1      LYS  86 -15.920  -1.534  -0.583
  697    HD2  LYS  86           HD2      LYS  86 -17.043  -0.759   2.125
  698    HD3  LYS  86           HD1      LYS  86 -17.803  -0.164   0.654
  699    HE2  LYS  86           HE2      LYS  86 -17.312  -3.091   1.300
  700    HE3  LYS  86           HE1      LYS  86 -18.859  -2.259   1.439
  701    HZ1  LYS  86           HZ1      LYS  86 -17.506  -3.240  -0.902
  702    HZ2  LYS  86           HZ2      LYS  86 -18.068  -1.645  -1.068
  703    HZ3  LYS  86           HZ3      LYS  86 -19.149  -2.894  -0.663
  704    H    ARG  87           HN       ARG  87 -14.400  -0.783   4.454
  705    HA   ARG  87           HA       ARG  87 -16.616   1.122   4.461
  706    HB2  ARG  87           HB2      ARG  87 -16.399  -0.932   5.966
  707    HB3  ARG  87           HB1      ARG  87 -15.171  -0.044   6.862
  708    HG2  ARG  87           HG2      ARG  87 -17.086   0.497   8.111
  709    HG3  ARG  87           HG1      ARG  87 -17.046   1.852   6.988
  710    HD2  ARG  87           HD2      ARG  87 -19.314   0.903   7.151
  711    HD3  ARG  87           HD1      ARG  87 -18.673   0.676   5.527
  712    HE   ARG  87           HE       ARG  87 -17.972  -1.659   6.862
  713   HH11  ARG  87          HH21      ARG  87 -20.869   0.127   6.272
  714   HH12  ARG  87          HH22      ARG  87 -21.890  -1.272   6.293
  715   HH21  ARG  87          HH11      ARG  87 -19.293  -3.489   6.893
  716   HH22  ARG  87          HH12      ARG  87 -20.999  -3.317   6.645
  717    H    ASP  88           HN       ASP  88 -13.179   1.239   5.193
  718    HA   ASP  88           HA       ASP  88 -13.397   3.900   6.481
  719    HB2  ASP  88           HB2      ASP  88 -11.723   2.135   7.215
  720    HB3  ASP  88           HB1      ASP  88 -10.893   2.372   5.676
  721    H    GLU  89           HN       GLU  89 -13.366   2.765   3.327
  722    HA   GLU  89           HA       GLU  89 -11.561   4.463   1.995
  723    HB2  GLU  89           HB2      GLU  89 -12.723   3.946  -0.002
  724    HB3  GLU  89           HB1      GLU  89 -13.056   2.576   1.052
  725    HG2  GLU  89           HG2      GLU  89 -15.233   3.795   1.699
  726    HG3  GLU  89           HG1      GLU  89 -14.901   4.882   0.352
  727    HA   PRO  90           HA       PRO  90 -13.554   8.368   3.206
  728    HB2  PRO  90           HB2      PRO  90 -12.062   9.970   1.313
  729    HB3  PRO  90           HB1      PRO  90 -11.747   9.796   3.046
  730    HG2  PRO  90           HG2      PRO  90 -10.227   8.650   0.820
  731    HG3  PRO  90           HG1      PRO  90  -9.836   8.607   2.545
  732    HD2  PRO  90           HD2      PRO  90 -10.792   6.413   0.930
  733    HD3  PRO  90           HD1      PRO  90 -10.503   6.407   2.685
  734    H    LYS  91           HN       LYS  91 -15.110   9.813   2.190
  735    HA   LYS  91           HA       LYS  91 -15.620   9.769  -0.656
  736    HB2  LYS  91           HB2      LYS  91 -16.416   7.480  -0.017
  737    HB3  LYS  91           HB1      LYS  91 -17.567   8.227   1.089
  738    HG2  LYS  91           HG2      LYS  91 -18.677   9.368  -0.751
  739    HG3  LYS  91           HG1      LYS  91 -17.457   8.793  -1.889
  740    HD2  LYS  91           HD2      LYS  91 -18.126   6.456  -1.408
  741    HD3  LYS  91           HD1      LYS  91 -19.371   7.050  -0.307
  742    HE2  LYS  91           HE2      LYS  91 -19.195   7.559  -3.291
  743    HE3  LYS  91           HE1      LYS  91 -20.408   6.591  -2.453
  744    HZ1  LYS  91           HZ1      LYS  91 -20.451   9.019  -1.189
  745    HZ2  LYS  91           HZ2      LYS  91 -21.591   8.447  -2.313
  746    HZ3  LYS  91           HZ3      LYS  91 -20.294   9.415  -2.831
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1  -7.108  19.428   8.806
    2    H2   MET   1           HT2      MET   1  -5.936  18.310   8.292
    3    H3   MET   1           HT3      MET   1  -5.471  19.872   8.768
    4    HA   MET   1           HA       MET   1  -5.147  19.135  10.815
    5    HB2  MET   1           HB2      MET   1  -7.510  19.937  11.054
    6    HB3  MET   1           HB1      MET   1  -8.060  18.293  10.732
    7    HG2  MET   1           HG2      MET   1  -6.906  17.464  12.703
    8    HG3  MET   1           HG1      MET   1  -6.177  19.044  12.987
    9    HE1  MET   1           HE1      MET   1  -8.555  18.904  15.956
   10    HE2  MET   1           HE2      MET   1  -7.024  19.555  15.375
   11    HE3  MET   1           HE3      MET   1  -7.333  17.824  15.273
   12    H    ALA   2           HN       ALA   2  -7.584  16.679   9.942
   13    HA   ALA   2           HA       ALA   2  -5.997  14.532  11.010
   14    HB1  ALA   2           HB1      ALA   2  -8.450  14.383  10.815
   15    HB2  ALA   2           HB2      ALA   2  -7.675  13.060   9.944
   16    HB3  ALA   2           HB3      ALA   2  -8.319  14.442   9.058
   17    H    SER   3           HN       SER   3  -3.985  14.291  10.052
   18    HA   SER   3           HA       SER   3  -3.540  14.559   7.203
   19    HB2  SER   3           HB2      SER   3  -1.292  13.598   7.718
   20    HB3  SER   3           HB1      SER   3  -1.710  14.844   8.899
   21    HG   SER   3           HG       SER   3  -1.739  12.032   9.157
   22    H    THR   4           HN       THR   4  -3.781  13.025   5.629
   23    HA   THR   4           HA       THR   4  -5.095  10.517   6.275
   24    HB   THR   4           HB       THR   4  -3.812  10.842   3.574
   25    HG1  THR   4           HG1      THR   4  -5.802  12.601   4.559
   26   HG21  THR   4          HG21      THR   4  -6.741  10.500   4.263
   27   HG22  THR   4          HG22      THR   4  -5.624   9.137   4.243
   28   HG23  THR   4          HG23      THR   4  -5.916  10.060   2.769
   29    H    ARG   5           HN       ARG   5  -1.780  11.480   5.502
   30    HA   ARG   5           HA       ARG   5  -0.598   8.977   5.015
   31    HB2  ARG   5           HB2      ARG   5   0.578  11.269   6.619
   32    HB3  ARG   5           HB1      ARG   5   1.492   9.967   5.858
   33    HG2  ARG   5           HG2      ARG   5   0.686  10.667   3.645
   34    HG3  ARG   5           HG1      ARG   5  -0.271  11.949   4.388
   35    HD2  ARG   5           HD2      ARG   5   2.747  11.696   4.554
   36    HD3  ARG   5           HD1      ARG   5   1.873  12.823   3.515
   37    HE   ARG   5           HE       ARG   5   0.901  13.365   6.060
   38   HH11  ARG   5          HH21      ARG   5   4.007  13.168   4.560
   39   HH12  ARG   5          HH22      ARG   5   4.726  14.356   5.595
   40   HH21  ARG   5          HH11      ARG   5   1.829  14.915   7.415
   41   HH22  ARG   5          HH12      ARG   5   3.494  15.344   7.210
   42    H    CYS   6           HN       CYS   6  -1.148  10.557   8.175
   43    HA   CYS   6           HA       CYS   6  -0.035   8.492   9.779
   44    HB2  CYS   6           HB2      CYS   6  -0.642  10.696  10.692
   45    HB3  CYS   6           HB1      CYS   6  -2.348  10.353  10.405
   46    HG   CYS   6           HG       CYS   6  -1.416   8.128  12.081
   47    H    LYS   7           HN       LYS   7  -3.177   8.819   8.234
   48    HA   LYS   7           HA       LYS   7  -4.492   6.703   9.645
   49    HB2  LYS   7           HB2      LYS   7  -5.511   8.525   8.102
   50    HB3  LYS   7           HB1      LYS   7  -5.072   7.468   6.768
   51    HG2  LYS   7           HG2      LYS   7  -7.267   6.735   7.192
   52    HG3  LYS   7           HG1      LYS   7  -6.354   5.612   8.194
   53    HD2  LYS   7           HD2      LYS   7  -6.767   7.021  10.177
   54    HD3  LYS   7           HD1      LYS   7  -7.620   8.195   9.176
   55    HE2  LYS   7           HE2      LYS   7  -8.454   5.290   9.437
   56    HE3  LYS   7           HE1      LYS   7  -9.143   6.600  10.400
   57    HZ1  LYS   7           HZ1      LYS   7 -10.118   5.824   8.050
   58    HZ2  LYS   7           HZ2      LYS   7  -9.061   7.050   7.535
   59    HZ3  LYS   7           HZ3      LYS   7 -10.288   7.399   8.658
   60    H    LEU   8           HN       LEU   8  -2.719   6.719   6.523
   61    HA   LEU   8           HA       LEU   8  -3.097   3.909   5.991
   62    HB2  LEU   8           HB2      LEU   8  -1.075   5.979   5.102
   63    HB3  LEU   8           HB1      LEU   8  -0.807   4.289   4.687
   64    HG   LEU   8           HG       LEU   8  -3.050   4.214   3.617
   65   HD11  LEU   8          HD11      LEU   8  -4.221   5.927   4.854
   66   HD12  LEU   8          HD12      LEU   8  -4.156   6.440   3.171
   67   HD13  LEU   8          HD13      LEU   8  -3.059   7.155   4.352
   68   HD21  LEU   8          HD21      LEU   8  -1.296   6.483   2.620
   69   HD22  LEU   8          HD22      LEU   8  -2.434   5.545   1.653
   70   HD23  LEU   8          HD23      LEU   8  -0.996   4.771   2.320
   71    H    ALA   9           HN       ALA   9  -0.759   5.645   7.998
   72    HA   ALA   9           HA       ALA   9   1.102   3.539   8.415
   73    HB1  ALA   9           HB1      ALA   9   1.407   5.892   9.207
   74    HB2  ALA   9           HB2      ALA   9   1.725   4.696  10.463
   75    HB3  ALA   9           HB3      ALA   9   0.204   5.588  10.461
   76    H    ARG  10           HN       ARG  10  -1.992   4.235   9.989
   77    HA   ARG  10           HA       ARG  10  -1.762   2.148  11.969
   78    HB2  ARG  10           HB2      ARG  10  -4.099   3.702  10.837
   79    HB3  ARG  10           HB1      ARG  10  -4.338   2.447  12.048
   80    HG2  ARG  10           HG2      ARG  10  -2.450   4.800  12.422
   81    HG3  ARG  10           HG1      ARG  10  -4.123   4.806  12.970
   82    HD2  ARG  10           HD2      ARG  10  -3.122   4.048  14.932
   83    HD3  ARG  10           HD1      ARG  10  -3.292   2.482  14.144
   84    HE   ARG  10           HE       ARG  10  -0.834   3.446  13.251
   85   HH11  ARG  10          HH21      ARG  10  -2.376   2.878  16.289
   86   HH12  ARG  10          HH22      ARG  10  -0.899   2.525  17.122
   87   HH21  ARG  10          HH11      ARG  10   1.099   2.989  14.327
   88   HH22  ARG  10          HH12      ARG  10   1.066   2.589  16.012
   89    H    TYR  11           HN       TYR  11  -2.980   2.225   8.650
   90    HA   TYR  11           HA       TYR  11  -4.149  -0.455   8.828
   91    HB2  TYR  11           HB2      TYR  11  -3.662   1.518   6.580
   92    HB3  TYR  11           HB1      TYR  11  -4.151  -0.136   6.210
   93    HD1  TYR  11           HD2      TYR  11  -6.242  -1.066   7.303
   94    HD2  TYR  11           HD1      TYR  11  -5.303   3.120   7.315
   95    HE1  TYR  11           HE2      TYR  11  -8.608  -0.548   7.823
   96    HE2  TYR  11           HE1      TYR  11  -7.674   3.645   7.841
   97    HH   TYR  11           HH       TYR  11 -10.103   1.051   8.149
   98    H    LEU  12           HN       LEU  12  -1.272   0.832   7.078
   99    HA   LEU  12           HA       LEU  12  -0.317  -1.729   6.266
  100    HB2  LEU  12           HB2      LEU  12   1.470   0.616   7.014
  101    HB3  LEU  12           HB1      LEU  12   1.826  -0.676   5.872
  102    HG   LEU  12           HG       LEU  12  -0.515   1.243   5.407
  103   HD11  LEU  12          HD11      LEU  12   2.358   1.532   4.460
  104   HD12  LEU  12          HD12      LEU  12   1.541   2.586   5.613
  105   HD13  LEU  12          HD13      LEU  12   1.002   2.529   3.936
  106   HD21  LEU  12          HD21      LEU  12  -0.607  -0.728   3.992
  107   HD22  LEU  12          HD22      LEU  12   1.112  -0.620   3.623
  108   HD23  LEU  12          HD23      LEU  12  -0.004   0.589   2.995
  109    H    GLU  13           HN       GLU  13  -0.196  -0.126   9.355
  110    HA   GLU  13           HA       GLU  13   1.838  -1.967  10.452
  111    HB2  GLU  13           HB2      GLU  13   0.070   0.162  11.708
  112    HB3  GLU  13           HB1      GLU  13   1.090  -0.892  12.681
  113    HG2  GLU  13           HG2      GLU  13   2.177   0.787  10.394
  114    HG3  GLU  13           HG1      GLU  13   2.133   1.345  12.065
  115    H    ASP  14           HN       ASP  14  -1.636  -1.810  10.152
  116    HA   ASP  14           HA       ASP  14  -2.297  -3.653  12.251
  117    HB2  ASP  14           HB2      ASP  14  -3.984  -2.227  11.134
  118    HB3  ASP  14           HB1      ASP  14  -3.767  -3.140   9.640
  119    H    LEU  15           HN       LEU  15  -0.385  -4.182   9.580
  120    HA   LEU  15           HA       LEU  15  -1.299  -7.005   9.142
  121    HB2  LEU  15           HB2      LEU  15   0.984  -5.535   7.787
  122    HB3  LEU  15           HB1      LEU  15   0.233  -7.046   7.280
  123    HG   LEU  15           HG       LEU  15  -1.039  -4.289   7.288
  124   HD11  LEU  15          HD11      LEU  15  -1.120  -4.622   4.861
  125   HD12  LEU  15          HD12      LEU  15  -0.431  -6.234   5.038
  126   HD13  LEU  15          HD13      LEU  15   0.539  -4.816   5.430
  127   HD21  LEU  15          HD21      LEU  15  -2.959  -5.595   6.119
  128   HD22  LEU  15          HD22      LEU  15  -2.837  -5.747   7.867
  129   HD23  LEU  15          HD23      LEU  15  -2.238  -7.042   6.828
  130    H    GLU  16           HN       GLU  16   0.224  -8.754   9.378
  131    HA   GLU  16           HA       GLU  16   1.762  -8.618  11.797
  132    HB2  GLU  16           HB2      GLU  16   0.709 -10.696  10.774
  133    HB3  GLU  16           HB1      GLU  16   2.019 -10.694   9.597
  134    HG2  GLU  16           HG2      GLU  16   2.669 -12.190  11.370
  135    HG3  GLU  16           HG1      GLU  16   3.644 -10.734  11.548
  136    H    ASP  17           HN       ASP  17   4.071  -8.668  12.044
  137    HA   ASP  17           HA       ASP  17   5.564  -6.902  10.453
  138    HB2  ASP  17           HB2      ASP  17   6.599  -9.242  12.082
  139    HB3  ASP  17           HB1      ASP  17   7.566  -7.876  11.526
  140    H    VAL  18           HN       VAL  18   5.505 -10.480  10.263
  141    HA   VAL  18           HA       VAL  18   7.363 -10.654   8.096
  142    HB   VAL  18           HB       VAL  18   6.680 -12.599   9.501
  143   HG11  VAL  18          HG11      VAL  18   4.208 -11.993   9.492
  144   HG12  VAL  18          HG12      VAL  18   4.551 -13.691   9.171
  145   HG13  VAL  18          HG13      VAL  18   4.132 -12.612   7.842
  146   HG21  VAL  18          HG21      VAL  18   6.682 -14.220   7.678
  147   HG22  VAL  18          HG22      VAL  18   7.714 -12.864   7.220
  148   HG23  VAL  18          HG23      VAL  18   6.089 -13.004   6.547
  149    H    ASP  19           HN       ASP  19   3.813 -10.278   8.144
  150    HA   ASP  19           HA       ASP  19   3.482 -10.538   5.298
  151    HB2  ASP  19           HB2      ASP  19   1.585 -10.700   6.888
  152    HB3  ASP  19           HB1      ASP  19   1.778  -8.992   7.281
  153    H    LEU  20           HN       LEU  20   4.441  -7.895   7.396
  154    HA   LEU  20           HA       LEU  20   4.009  -5.746   5.575
  155    HB2  LEU  20           HB2      LEU  20   4.607  -5.565   8.045
  156    HB3  LEU  20           HB1      LEU  20   6.261  -5.961   7.592
  157    HG   LEU  20           HG       LEU  20   6.034  -3.945   5.905
  158   HD11  LEU  20          HD11      LEU  20   4.529  -2.143   6.808
  159   HD12  LEU  20          HD12      LEU  20   3.808  -3.337   7.885
  160   HD13  LEU  20          HD13      LEU  20   3.645  -3.509   6.140
  161   HD21  LEU  20          HD21      LEU  20   6.730  -2.355   7.691
  162   HD22  LEU  20          HD22      LEU  20   7.540  -3.915   7.836
  163   HD23  LEU  20          HD23      LEU  20   6.198  -3.517   8.907
  164    H    LYS  21           HN       LYS  21   6.699  -7.994   6.014
  165    HA   LYS  21           HA       LYS  21   8.469  -6.738   4.122
  166    HB2  LYS  21           HB2      LYS  21   9.277  -8.314   5.832
  167    HB3  LYS  21           HB1      LYS  21   8.348  -9.613   5.083
  168    HG2  LYS  21           HG2      LYS  21   9.693  -9.569   3.102
  169    HG3  LYS  21           HG1      LYS  21  10.452  -8.047   3.563
  170    HD2  LYS  21           HD2      LYS  21  11.954  -9.985   3.949
  171    HD3  LYS  21           HD1      LYS  21  11.576  -9.133   5.444
  172    HE2  LYS  21           HE2      LYS  21   9.919 -11.518   4.587
  173    HE3  LYS  21           HE1      LYS  21  11.439 -11.740   5.451
  174    HZ1  LYS  21           HZ1      LYS  21  10.313 -11.371   7.302
  175    HZ2  LYS  21           HZ2      LYS  21   8.916 -10.913   6.452
  176    HZ3  LYS  21           HZ3      LYS  21  10.111  -9.760   6.815
  177    H    LYS  22           HN       LYS  22   6.025  -9.312   3.833
  178    HA   LYS  22           HA       LYS  22   6.671  -9.962   1.090
  179    HB2  LYS  22           HB2      LYS  22   4.201 -10.407   2.799
  180    HB3  LYS  22           HB1      LYS  22   4.258 -10.905   1.109
  181    HG2  LYS  22           HG2      LYS  22   6.262 -12.278   1.588
  182    HG3  LYS  22           HG1      LYS  22   6.180 -11.799   3.283
  183    HD2  LYS  22           HD2      LYS  22   4.004 -12.854   3.532
  184    HD3  LYS  22           HD1      LYS  22   3.945 -13.218   1.807
  185    HE2  LYS  22           HE2      LYS  22   4.651 -15.160   3.276
  186    HE3  LYS  22           HE1      LYS  22   5.784 -14.758   1.986
  187    HZ1  LYS  22           HZ1      LYS  22   7.098 -13.501   3.555
  188    HZ2  LYS  22           HZ2      LYS  22   6.899 -15.093   4.114
  189    HZ3  LYS  22           HZ3      LYS  22   5.993 -13.829   4.799
  190    H    PHE  23           HN       PHE  23   4.739  -7.441   2.588
  191    HA   PHE  23           HA       PHE  23   3.243  -6.709   0.225
  192    HB2  PHE  23           HB2      PHE  23   2.731  -5.980   2.594
  193    HB3  PHE  23           HB1      PHE  23   4.107  -4.886   2.497
  194    HD1  PHE  23           HD1      PHE  23   4.117  -3.013   0.844
  195    HD2  PHE  23           HD2      PHE  23   0.646  -5.468   1.473
  196    HE1  PHE  23           HE1      PHE  23   2.706  -1.313  -0.279
  197    HE2  PHE  23           HE2      PHE  23  -0.757  -3.770   0.337
  198    HZ   PHE  23           HZ       PHE  23   0.271  -1.691  -0.535
  199    H    LYS  24           HN       LYS  24   6.394  -5.601   1.541
  200    HA   LYS  24           HA       LYS  24   6.826  -3.638  -0.529
  201    HB2  LYS  24           HB2      LYS  24   8.794  -5.099   1.259
  202    HB3  LYS  24           HB1      LYS  24   9.192  -3.709   0.247
  203    HG2  LYS  24           HG2      LYS  24   7.554  -2.336   1.460
  204    HG3  LYS  24           HG1      LYS  24   7.112  -3.723   2.456
  205    HD2  LYS  24           HD2      LYS  24   9.371  -3.838   3.371
  206    HD3  LYS  24           HD1      LYS  24   9.898  -2.534   2.306
  207    HE2  LYS  24           HE2      LYS  24   9.362  -1.789   4.656
  208    HE3  LYS  24           HE1      LYS  24   8.440  -0.953   3.406
  209    HZ1  LYS  24           HZ1      LYS  24   7.180  -3.366   4.303
  210    HZ2  LYS  24           HZ2      LYS  24   6.541  -1.799   4.156
  211    HZ3  LYS  24           HZ3      LYS  24   7.395  -2.242   5.556
  212    H    MET  25           HN       MET  25   7.859  -7.021  -0.102
  213    HA   MET  25           HA       MET  25   9.485  -7.230  -2.413
  214    HB2  MET  25           HB2      MET  25   9.274  -8.974  -0.624
  215    HB3  MET  25           HB1      MET  25   7.684  -9.388  -1.269
  216    HG2  MET  25           HG2      MET  25   8.657 -10.011  -3.409
  217    HG3  MET  25           HG1      MET  25  10.249  -9.459  -2.887
  218    HE1  MET  25           HE1      MET  25  11.211 -11.688  -3.643
  219    HE2  MET  25           HE2      MET  25   9.639 -12.342  -4.091
  220    HE3  MET  25           HE3      MET  25  10.717 -13.284  -3.064
  221    H    HIS  26           HN       HIS  26   5.974  -7.382  -2.041
  222    HA   HIS  26           HA       HIS  26   5.411  -8.357  -4.708
  223    HB2  HIS  26           HB2      HIS  26   3.774  -6.692  -2.751
  224    HB3  HIS  26           HB1      HIS  26   3.122  -7.298  -4.275
  225    HD1  HIS  26           HD1      HIS  26   5.551  -9.472  -2.487
  226    HD2  HIS  26           HD2      HIS  26   1.409  -9.071  -2.745
  227    HE1  HIS  26           HE1      HIS  26   4.564 -11.571  -1.471
  228    H    LEU  27           HN       LEU  27   5.888  -5.102  -3.348
  229    HA   LEU  27           HA       LEU  27   5.137  -3.675  -5.749
  230    HB2  LEU  27           HB2      LEU  27   6.815  -3.025  -3.320
  231    HB3  LEU  27           HB1      LEU  27   6.786  -1.891  -4.663
  232    HG   LEU  27           HG       LEU  27   4.188  -2.907  -3.458
  233   HD11  LEU  27          HD11      LEU  27   4.215  -0.794  -2.055
  234   HD12  LEU  27          HD12      LEU  27   5.923  -0.627  -2.460
  235   HD13  LEU  27          HD13      LEU  27   5.367  -2.028  -1.546
  236   HD21  LEU  27          HD21      LEU  27   4.990  -0.364  -4.934
  237   HD22  LEU  27          HD22      LEU  27   3.393  -0.653  -4.251
  238   HD23  LEU  27          HD23      LEU  27   3.981  -1.662  -5.564
  239    H    GLU  28           HN       GLU  28   8.110  -5.239  -4.695
  240    HA   GLU  28           HA       GLU  28   9.841  -4.083  -6.665
  241    HB2  GLU  28           HB2      GLU  28   9.984  -6.771  -5.270
  242    HB3  GLU  28           HB1      GLU  28  11.293  -6.056  -6.211
  243    HG2  GLU  28           HG2      GLU  28  11.246  -4.073  -4.693
  244    HG3  GLU  28           HG1      GLU  28  10.031  -4.892  -3.711
  245    H    ASP  29           HN       ASP  29   7.262  -6.299  -6.947
  246    HA   ASP  29           HA       ASP  29   8.044  -6.924  -9.780
  247    HB2  ASP  29           HB2      ASP  29   8.513  -8.905  -8.343
  248    HB3  ASP  29           HB1      ASP  29   6.833  -8.888  -7.807
  249    H    TYR  30           HN       TYR  30   6.383  -4.842  -9.278
  250    HA   TYR  30           HA       TYR  30   3.614  -5.573  -9.031
  251    HB2  TYR  30           HB2      TYR  30   4.449  -3.302  -8.548
  252    HB3  TYR  30           HB1      TYR  30   4.865  -3.096 -10.249
  253    HD1  TYR  30           HD2      TYR  30   2.079  -3.454  -7.835
  254    HD2  TYR  30           HD1      TYR  30   3.147  -2.695 -11.928
  255    HE1  TYR  30           HE2      TYR  30  -0.240  -2.709  -8.304
  256    HE2  TYR  30           HE1      TYR  30   0.828  -1.951 -12.393
  257    HH   TYR  30           HH       TYR  30  -1.604  -2.583 -11.083
  258    HA   PRO  31           HA       PRO  31   3.273  -7.102 -13.254
  259    HB2  PRO  31           HB2      PRO  31   0.454  -6.755 -13.554
  260    HB3  PRO  31           HB1      PRO  31   1.278  -8.221 -13.004
  261    HG2  PRO  31           HG2      PRO  31  -0.235  -6.239 -11.400
  262    HG3  PRO  31           HG1      PRO  31   0.239  -7.890 -10.967
  263    HD2  PRO  31           HD2      PRO  31   1.440  -5.507  -9.978
  264    HD3  PRO  31           HD1      PRO  31   2.103  -7.151  -9.827
  265    HA   PRO  32           HA       PRO  32   3.217  -2.877 -15.009
  266    HB2  PRO  32           HB2      PRO  32   3.915  -3.670 -17.663
  267    HB3  PRO  32           HB1      PRO  32   5.036  -3.129 -16.406
  268    HG2  PRO  32           HG2      PRO  32   4.613  -5.868 -17.426
  269    HG3  PRO  32           HG1      PRO  32   5.935  -5.255 -16.418
  270    HD2  PRO  32           HD2      PRO  32   3.742  -6.893 -15.548
  271    HD3  PRO  32           HD1      PRO  32   4.959  -6.110 -14.513
  272    H    GLN  33           HN       GLN  33   1.435  -1.823 -15.819
  273    HA   GLN  33           HA       GLN  33  -0.676  -3.434 -17.240
  274    HB2  GLN  33           HB2      GLN  33  -0.926  -0.802 -15.745
  275    HB3  GLN  33           HB1      GLN  33  -2.247  -1.739 -16.440
  276    HG2  GLN  33           HG2      GLN  33  -0.375  -2.788 -14.297
  277    HG3  GLN  33           HG1      GLN  33  -1.962  -2.093 -13.968
  278   HE21  GLN  33          HE21      GLN  33  -0.308  -4.866 -15.449
  279   HE22  GLN  33          HE22      GLN  33  -1.688  -5.847 -15.562
  280    H    LYS  34           HN       LYS  34   0.963  -0.261 -17.244
  281    HA   LYS  34           HA       LYS  34   0.961  -0.180 -20.147
  282    HB2  LYS  34           HB2      LYS  34  -0.462   1.823 -20.356
  283    HB3  LYS  34           HB1      LYS  34  -1.370   0.470 -19.683
  284    HG2  LYS  34           HG2      LYS  34  -0.880   1.389 -17.380
  285    HG3  LYS  34           HG1      LYS  34  -0.205   2.819 -18.161
  286    HD2  LYS  34           HD2      LYS  34  -2.366   3.213 -19.298
  287    HD3  LYS  34           HD1      LYS  34  -3.042   1.800 -18.487
  288    HE2  LYS  34           HE2      LYS  34  -1.917   4.247 -17.090
  289    HE3  LYS  34           HE1      LYS  34  -3.632   3.889 -17.298
  290    HZ1  LYS  34           HZ1      LYS  34  -1.653   2.577 -15.581
  291    HZ2  LYS  34           HZ2      LYS  34  -2.929   1.642 -16.203
  292    HZ3  LYS  34           HZ3      LYS  34  -3.259   3.006 -15.244
  293    H    GLY  35           HN       GLY  35   2.880   0.013 -17.982
  294    HA2  GLY  35           HA2      GLY  35   4.626   1.977 -18.887
  295    HA3  GLY  35           HA1      GLY  35   3.675   2.787 -17.640
  296    H    CYS  36           HN       CYS  36   6.136   0.408 -18.247
  297    HA   CYS  36           HA       CYS  36   6.203  -0.770 -15.624
  298    HB2  CYS  36           HB2      CYS  36   8.516  -0.434 -17.559
  299    HB3  CYS  36           HB1      CYS  36   8.381  -1.627 -16.266
  300    HG   CYS  36           HG       CYS  36   6.421  -2.762 -17.597
  301    H    ILE  37           HN       ILE  37   6.637   0.335 -13.783
  302    HA   ILE  37           HA       ILE  37   8.724   2.509 -13.815
  303    HB   ILE  37           HB       ILE  37   7.219   3.445 -11.861
  304   HG12  ILE  37          HG12      ILE  37   5.112   1.941 -13.462
  305   HG13  ILE  37          HG11      ILE  37   5.735   1.355 -11.923
  306   HG21  ILE  37          HG21      ILE  37   7.543   4.656 -13.962
  307   HG22  ILE  37          HG22      ILE  37   5.841   4.719 -13.512
  308   HG23  ILE  37          HG23      ILE  37   6.376   3.613 -14.775
  309   HD11  ILE  37          HD11      ILE  37   4.390   4.046 -12.358
  310   HD12  ILE  37          HD12      ILE  37   5.013   3.451 -10.820
  311   HD13  ILE  37          HD13      ILE  37   3.647   2.643 -11.588
  312    HA   PRO  38           HA       PRO  38   9.852  -0.655 -10.648
  313    HB2  PRO  38           HB2      PRO  38  12.656  -0.140 -10.919
  314    HB3  PRO  38           HB1      PRO  38  11.764  -1.490 -11.634
  315    HG2  PRO  38           HG2      PRO  38  12.894   0.831 -13.008
  316    HG3  PRO  38           HG1      PRO  38  12.108  -0.585 -13.725
  317    HD2  PRO  38           HD2      PRO  38  11.004   2.099 -13.390
  318    HD3  PRO  38           HD1      PRO  38  10.252   0.704 -14.196
  319    H    LEU  39           HN       LEU  39  10.120  -0.160  -8.482
  320    HA   LEU  39           HA       LEU  39  10.615   2.676  -7.753
  321    HB2  LEU  39           HB2      LEU  39   9.363   0.280  -6.424
  322    HB3  LEU  39           HB1      LEU  39   9.966   1.576  -5.393
  323    HG   LEU  39           HG       LEU  39   8.564   3.202  -6.645
  324   HD11  LEU  39          HD11      LEU  39   7.653   0.705  -8.106
  325   HD12  LEU  39          HD12      LEU  39   8.433   2.123  -8.808
  326   HD13  LEU  39          HD13      LEU  39   6.796   2.245  -8.169
  327   HD21  LEU  39          HD21      LEU  39   6.955   0.820  -5.675
  328   HD22  LEU  39          HD22      LEU  39   6.441   2.507  -5.698
  329   HD23  LEU  39          HD23      LEU  39   7.724   1.991  -4.604
  330    HA   PRO  40           HA       PRO  40  14.903   1.362  -6.924
  331    HB2  PRO  40           HB2      PRO  40  15.142   3.638  -5.027
  332    HB3  PRO  40           HB1      PRO  40  16.056   3.333  -6.513
  333    HG2  PRO  40           HG2      PRO  40  14.017   5.279  -6.210
  334    HG3  PRO  40           HG1      PRO  40  14.677   4.711  -7.752
  335    HD2  PRO  40           HD2      PRO  40  12.024   4.160  -6.606
  336    HD3  PRO  40           HD1      PRO  40  12.624   3.767  -8.234
  337    H    ARG  41           HN       ARG  41  15.586  -0.099  -5.427
  338    HA   ARG  41           HA       ARG  41  13.900  -0.885  -3.237
  339    HB2  ARG  41           HB2      ARG  41  15.536  -2.367  -4.486
  340    HB3  ARG  41           HB1      ARG  41  16.840  -1.554  -3.621
  341    HG2  ARG  41           HG2      ARG  41  15.899  -2.267  -1.474
  342    HG3  ARG  41           HG1      ARG  41  14.540  -3.027  -2.302
  343    HD2  ARG  41           HD2      ARG  41  17.459  -3.791  -2.617
  344    HD3  ARG  41           HD1      ARG  41  16.242  -4.710  -1.730
  345    HE   ARG  41           HE       ARG  41  15.160  -4.460  -4.273
  346   HH11  ARG  41          HH21      ARG  41  18.144  -5.567  -2.929
  347   HH12  ARG  41          HH22      ARG  41  18.419  -6.742  -4.172
  348   HH21  ARG  41          HH11      ARG  41  15.508  -5.990  -5.899
  349   HH22  ARG  41          HH12      ARG  41  16.928  -6.981  -5.852
  350    H    GLY  42           HN       GLY  42  16.986   0.912  -3.323
  351    HA2  GLY  42           HA2      GLY  42  17.343   1.137  -0.501
  352    HA3  GLY  42           HA1      GLY  42  17.977   2.308  -1.658
  353    H    GLN  43           HN       GLN  43  15.306   3.078  -2.683
  354    HA   GLN  43           HA       GLN  43  14.697   5.074  -0.650
  355    HB2  GLN  43           HB2      GLN  43  13.401   4.353  -3.303
  356    HB3  GLN  43           HB1      GLN  43  12.823   5.678  -2.292
  357    HG2  GLN  43           HG2      GLN  43  15.693   5.448  -3.258
  358    HG3  GLN  43           HG1      GLN  43  14.453   6.360  -4.113
  359   HE21  GLN  43          HE21      GLN  43  16.956   7.279  -2.579
  360   HE22  GLN  43          HE22      GLN  43  16.370   8.445  -1.494
  361    H    THR  44           HN       THR  44  13.037   2.150  -1.852
  362    HA   THR  44           HA       THR  44  10.673   2.528  -0.262
  363    HB   THR  44           HB       THR  44  11.883  -0.039  -1.335
  364    HG1  THR  44           HG1      THR  44   9.788   0.717  -2.694
  365   HG21  THR  44          HG21      THR  44   9.483  -0.819  -1.227
  366   HG22  THR  44          HG22      THR  44   9.121   0.620  -0.277
  367   HG23  THR  44          HG23      THR  44  10.245  -0.589   0.346
  368    H    GLU  45           HN       GLU  45  13.655   0.630   0.325
  369    HA   GLU  45           HA       GLU  45  12.765  -0.277   2.946
  370    HB2  GLU  45           HB2      GLU  45  15.605  -0.087   1.855
  371    HB3  GLU  45           HB1      GLU  45  15.073  -1.067   3.219
  372    HG2  GLU  45           HG2      GLU  45  14.102  -1.394   0.358
  373    HG3  GLU  45           HG1      GLU  45  15.310  -2.409   1.143
  374    H    LYS  46           HN       LYS  46  14.792   2.458   1.795
  375    HA   LYS  46           HA       LYS  46  15.514   3.312   4.467
  376    HB2  LYS  46           HB2      LYS  46  16.787   3.971   2.432
  377    HB3  LYS  46           HB1      LYS  46  15.407   4.930   1.897
  378    HG2  LYS  46           HG2      LYS  46  15.582   6.382   3.826
  379    HG3  LYS  46           HG1      LYS  46  16.814   5.350   4.551
  380    HD2  LYS  46           HD2      LYS  46  18.347   5.852   2.697
  381    HD3  LYS  46           HD1      LYS  46  17.111   6.852   1.932
  382    HE2  LYS  46           HE2      LYS  46  18.377   7.345   4.644
  383    HE3  LYS  46           HE1      LYS  46  18.679   8.269   3.173
  384    HZ1  LYS  46           HZ1      LYS  46  17.072   9.393   4.553
  385    HZ2  LYS  46           HZ2      LYS  46  16.076   8.017   4.581
  386    HZ3  LYS  46           HZ3      LYS  46  16.323   8.862   3.128
  387    H    ALA  47           HN       ALA  47  12.653   3.551   2.580
  388    HA   ALA  47           HA       ALA  47  11.602   5.979   3.798
  389    HB1  ALA  47           HB1      ALA  47   9.438   5.190   2.793
  390    HB2  ALA  47           HB2      ALA  47  10.259   3.714   2.290
  391    HB3  ALA  47           HB3      ALA  47  10.760   5.269   1.628
  392    H    ASP  48           HN       ASP  48  10.669   6.139   5.785
  393    HA   ASP  48           HA       ASP  48  10.383   3.741   7.474
  394    HB2  ASP  48           HB2      ASP  48   9.599   6.629   8.011
  395    HB3  ASP  48           HB1      ASP  48   9.722   5.345   9.214
  396    H    HIS  49           HN       HIS  49   8.212   3.452   8.675
  397    HA   HIS  49           HA       HIS  49   6.148   2.787   6.924
  398    HB2  HIS  49           HB2      HIS  49   4.629   2.905   8.924
  399    HB3  HIS  49           HB1      HIS  49   6.117   2.003   9.209
  400    HD1  HIS  49           HD1      HIS  49   8.062   4.367   9.671
  401    HD2  HIS  49           HD2      HIS  49   4.287   4.095  11.419
  402    HE1  HIS  49           HE1      HIS  49   8.125   5.821  11.743
  403    H    VAL  50           HN       VAL  50   6.615   5.907   8.582
  404    HA   VAL  50           HA       VAL  50   4.144   7.063   7.531
  405    HB   VAL  50           HB       VAL  50   6.652   8.414   8.623
  406   HG11  VAL  50          HG11      VAL  50   3.845   9.471   8.119
  407   HG12  VAL  50          HG12      VAL  50   5.338  10.022   7.359
  408   HG13  VAL  50          HG13      VAL  50   5.062  10.319   9.073
  409   HG21  VAL  50          HG21      VAL  50   5.493   8.491  10.749
  410   HG22  VAL  50          HG22      VAL  50   5.467   6.821  10.191
  411   HG23  VAL  50          HG23      VAL  50   4.025   7.823  10.036
  412    H    ASP  51           HN       ASP  51   7.600   7.378   6.640
  413    HA   ASP  51           HA       ASP  51   7.133   9.118   4.412
  414    HB2  ASP  51           HB2      ASP  51   9.367   8.804   5.438
  415    HB3  ASP  51           HB1      ASP  51   9.394   7.140   4.857
  416    H    LEU  52           HN       LEU  52   7.135   5.591   4.717
  417    HA   LEU  52           HA       LEU  52   7.159   4.912   1.980
  418    HB2  LEU  52           HB2      LEU  52   7.103   3.431   4.197
  419    HB3  LEU  52           HB1      LEU  52   5.376   3.371   3.874
  420    HG   LEU  52           HG       LEU  52   7.608   2.495   2.008
  421   HD11  LEU  52          HD11      LEU  52   7.068   0.967   3.898
  422   HD12  LEU  52          HD12      LEU  52   6.664   0.265   2.331
  423   HD13  LEU  52          HD13      LEU  52   5.390   0.926   3.356
  424   HD21  LEU  52          HD21      LEU  52   5.897   3.400   0.604
  425   HD22  LEU  52          HD22      LEU  52   4.609   2.714   1.594
  426   HD23  LEU  52          HD23      LEU  52   5.622   1.661   0.606
  427    H    ALA  53           HN       ALA  53   4.321   5.534   4.091
  428    HA   ALA  53           HA       ALA  53   2.345   5.307   2.044
  429    HB1  ALA  53           HB1      ALA  53   0.920   6.652   3.558
  430    HB2  ALA  53           HB2      ALA  53   2.338   7.056   4.526
  431    HB3  ALA  53           HB3      ALA  53   1.777   5.386   4.437
  432    H    THR  54           HN       THR  54   4.534   7.935   2.873
  433    HA   THR  54           HA       THR  54   3.108   9.986   1.387
  434    HB   THR  54           HB       THR  54   6.047   9.868   2.147
  435    HG1  THR  54           HG1      THR  54   4.574  11.459   3.678
  436   HG21  THR  54          HG21      THR  54   5.826  12.362   2.079
  437   HG22  THR  54          HG22      THR  54   4.210  12.164   1.405
  438   HG23  THR  54          HG23      THR  54   5.618  11.605   0.501
  439    H    LEU  55           HN       LEU  55   5.705   7.687   0.562
  440    HA   LEU  55           HA       LEU  55   6.243   8.875  -2.026
  441    HB2  LEU  55           HB2      LEU  55   7.859   7.331  -0.819
  442    HB3  LEU  55           HB1      LEU  55   6.773   5.998  -1.204
  443    HG   LEU  55           HG       LEU  55   7.025   6.673  -3.667
  444   HD11  LEU  55          HD11      LEU  55   9.165   8.429  -2.427
  445   HD12  LEU  55          HD12      LEU  55   7.938   8.869  -3.613
  446   HD13  LEU  55          HD13      LEU  55   9.293   7.859  -4.090
  447   HD21  LEU  55          HD21      LEU  55   9.225   5.519  -3.860
  448   HD22  LEU  55          HD22      LEU  55   8.149   4.708  -2.723
  449   HD23  LEU  55          HD23      LEU  55   9.461   5.721  -2.123
  450    H    MET  56           HN       MET  56   4.040   6.389  -0.841
  451    HA   MET  56           HA       MET  56   3.230   5.440  -3.445
  452    HB2  MET  56           HB2      MET  56   1.853   5.411  -0.741
  453    HB3  MET  56           HB1      MET  56   1.154   4.660  -2.174
  454    HG2  MET  56           HG2      MET  56   3.949   3.980  -1.204
  455    HG3  MET  56           HG1      MET  56   2.520   3.105  -0.654
  456    HE1  MET  56           HE1      MET  56   1.610   1.162  -1.734
  457    HE2  MET  56           HE2      MET  56   1.338   1.008  -3.467
  458    HE3  MET  56           HE3      MET  56   0.626   2.356  -2.587
  459    H    ILE  57           HN       ILE  57   2.016   8.030  -1.312
  460    HA   ILE  57           HA       ILE  57  -0.180   8.680  -3.147
  461    HB   ILE  57           HB       ILE  57   0.925  10.334  -0.845
  462   HG12  ILE  57          HG12      ILE  57  -1.487   8.487  -0.864
  463   HG13  ILE  57          HG11      ILE  57   0.092   7.990  -0.263
  464   HG21  ILE  57          HG21      ILE  57  -0.411  11.696  -2.337
  465   HG22  ILE  57          HG22      ILE  57  -1.392  11.325  -0.923
  466   HG23  ILE  57          HG23      ILE  57  -1.657  10.452  -2.431
  467   HD11  ILE  57          HD11      ILE  57  -1.536  10.327   0.778
  468   HD12  ILE  57          HD12      ILE  57   0.054   9.844   1.370
  469   HD13  ILE  57          HD13      ILE  57  -1.329   8.773   1.586
  470    H    ASP  58           HN       ASP  58   3.047  10.077  -2.475
  471    HA   ASP  58           HA       ASP  58   2.636  12.292  -4.329
  472    HB2  ASP  58           HB2      ASP  58   5.120  11.171  -2.985
  473    HB3  ASP  58           HB1      ASP  58   5.130  12.625  -3.983
  474    H    PHE  59           HN       PHE  59   4.531   9.242  -4.512
  475    HA   PHE  59           HA       PHE  59   5.502   9.819  -7.172
  476    HB2  PHE  59           HB2      PHE  59   6.571   8.257  -5.498
  477    HB3  PHE  59           HB1      PHE  59   5.299   7.092  -5.862
  478    HD1  PHE  59           HD1      PHE  59   8.281   8.824  -7.170
  479    HD2  PHE  59           HD2      PHE  59   5.172   5.991  -8.055
  480    HE1  PHE  59           HE1      PHE  59   9.531   8.075  -9.177
  481    HE2  PHE  59           HE2      PHE  59   6.425   5.245 -10.061
  482    HZ   PHE  59           HZ       PHE  59   8.603   6.286 -10.622
  483    H    ASN  60           HN       ASN  60   2.774   7.726  -6.049
  484    HA   ASN  60           HA       ASN  60   2.096   7.174  -8.918
  485    HB2  ASN  60           HB2      ASN  60   1.058   6.016  -6.308
  486    HB3  ASN  60           HB1      ASN  60   0.464   5.545  -7.902
  487   HD21  ASN  60          HD21      ASN  60   2.077   4.516  -9.394
  488   HD22  ASN  60          HD22      ASN  60   3.421   3.711  -8.742
  489    H    GLY  61           HN       GLY  61   0.891   8.917  -6.105
  490    HA2  GLY  61           HA2      GLY  61  -0.607  10.836  -6.412
  491    HA3  GLY  61           HA1      GLY  61  -1.338  10.024  -7.793
  492    H    GLU  62           HN       GLU  62  -2.973  10.965  -5.778
  493    HA   GLU  62           HA       GLU  62  -3.533   8.986  -3.750
  494    HB2  GLU  62           HB2      GLU  62  -4.182  11.438  -3.684
  495    HB3  GLU  62           HB1      GLU  62  -5.432  11.071  -4.870
  496    HG2  GLU  62           HG2      GLU  62  -6.478  10.982  -2.699
  497    HG3  GLU  62           HG1      GLU  62  -6.313   9.319  -3.252
  498    H    GLU  63           HN       GLU  63  -4.721   9.540  -7.033
  499    HA   GLU  63           HA       GLU  63  -6.921   7.683  -6.869
  500    HB2  GLU  63           HB2      GLU  63  -6.765   9.484  -8.571
  501    HB3  GLU  63           HB1      GLU  63  -5.399   8.652  -9.308
  502    HG2  GLU  63           HG2      GLU  63  -6.799   6.729  -9.852
  503    HG3  GLU  63           HG1      GLU  63  -8.166   7.438  -8.991
  504    H    LYS  64           HN       LYS  64  -3.677   7.353  -8.390
  505    HA   LYS  64           HA       LYS  64  -4.092   4.554  -9.010
  506    HB2  LYS  64           HB2      LYS  64  -1.629   6.309  -8.909
  507    HB3  LYS  64           HB1      LYS  64  -1.522   4.596  -9.300
  508    HG2  LYS  64           HG2      LYS  64  -3.071   4.918 -11.187
  509    HG3  LYS  64           HG1      LYS  64  -3.201   6.633 -10.803
  510    HD2  LYS  64           HD2      LYS  64  -0.786   6.915 -11.181
  511    HD3  LYS  64           HD1      LYS  64  -0.638   5.196 -11.546
  512    HE2  LYS  64           HE2      LYS  64  -0.786   6.520 -13.621
  513    HE3  LYS  64           HE1      LYS  64  -2.188   5.465 -13.449
  514    HZ1  LYS  64           HZ1      LYS  64  -3.485   7.237 -13.530
  515    HZ2  LYS  64           HZ2      LYS  64  -2.133   8.254 -13.683
  516    HZ3  LYS  64           HZ3      LYS  64  -2.743   7.872 -12.144
  517    H    ALA  65           HN       ALA  65  -2.544   6.247  -6.280
  518    HA   ALA  65           HA       ALA  65  -1.309   4.048  -5.035
  519    HB1  ALA  65           HB1      ALA  65  -1.043   6.305  -4.174
  520    HB2  ALA  65           HB2      ALA  65  -1.677   5.270  -2.895
  521    HB3  ALA  65           HB3      ALA  65  -2.753   6.375  -3.749
  522    H    TRP  66           HN       TRP  66  -4.680   5.185  -4.495
  523    HA   TRP  66           HA       TRP  66  -5.398   3.052  -2.742
  524    HB2  TRP  66           HB2      TRP  66  -6.939   4.945  -4.523
  525    HB3  TRP  66           HB1      TRP  66  -7.808   3.586  -3.813
  526    HD1  TRP  66           HD1      TRP  66  -7.011   7.041  -3.079
  527    HE1  TRP  66           HE1      TRP  66  -7.232   7.554  -0.561
  528    HE3  TRP  66           HE3      TRP  66  -7.162   2.288  -1.231
  529    HZ2  TRP  66           HZ2      TRP  66  -7.448   6.134   1.912
  530    HZ3  TRP  66           HZ3      TRP  66  -7.378   1.894   1.227
  531    HH2  TRP  66           HH2      TRP  66  -7.520   3.813   2.785
  532    H    ALA  67           HN       ALA  67  -5.740   3.322  -6.295
  533    HA   ALA  67           HA       ALA  67  -6.968   0.828  -6.770
  534    HB1  ALA  67           HB1      ALA  67  -5.996   0.963  -9.028
  535    HB2  ALA  67           HB2      ALA  67  -4.871   2.204  -8.477
  536    HB3  ALA  67           HB3      ALA  67  -6.602   2.540  -8.521
  537    H    MET  68           HN       MET  68  -3.545   1.591  -6.259
  538    HA   MET  68           HA       MET  68  -2.657  -1.150  -6.779
  539    HB2  MET  68           HB2      MET  68  -1.319   1.310  -5.617
  540    HB3  MET  68           HB1      MET  68  -0.493  -0.247  -5.690
  541    HG2  MET  68           HG2      MET  68  -0.803  -0.319  -8.128
  542    HG3  MET  68           HG1      MET  68  -1.674   1.211  -8.080
  543    HE1  MET  68           HE1      MET  68   1.478  -0.624  -7.017
  544    HE2  MET  68           HE2      MET  68   2.791   0.418  -7.560
  545    HE3  MET  68           HE3      MET  68   1.735  -0.345  -8.745
  546    H    ALA  69           HN       ALA  69  -3.591   0.738  -3.951
  547    HA   ALA  69           HA       ALA  69  -2.600  -1.145  -1.994
  548    HB1  ALA  69           HB1      ALA  69  -3.134   1.273  -1.530
  549    HB2  ALA  69           HB2      ALA  69  -3.878   0.156  -0.385
  550    HB3  ALA  69           HB3      ALA  69  -4.846   0.872  -1.674
  551    H    VAL  70           HN       VAL  70  -5.768  -0.709  -3.584
  552    HA   VAL  70           HA       VAL  70  -7.056  -2.771  -1.955
  553    HB   VAL  70           HB       VAL  70  -8.929  -2.539  -3.526
  554   HG11  VAL  70          HG11      VAL  70  -7.629   0.104  -2.781
  555   HG12  VAL  70          HG12      VAL  70  -8.653  -0.871  -1.728
  556   HG13  VAL  70          HG13      VAL  70  -9.336  -0.115  -3.169
  557   HG21  VAL  70          HG21      VAL  70  -8.661  -0.796  -5.382
  558   HG22  VAL  70          HG22      VAL  70  -7.823  -2.321  -5.653
  559   HG23  VAL  70          HG23      VAL  70  -6.923  -0.908  -5.111
  560    H    TRP  71           HN       TRP  71  -5.647  -2.717  -5.239
  561    HA   TRP  71           HA       TRP  71  -6.453  -5.401  -5.874
  562    HB2  TRP  71           HB2      TRP  71  -5.740  -3.743  -7.598
  563    HB3  TRP  71           HB1      TRP  71  -4.088  -3.840  -6.991
  564    HD1  TRP  71           HD1      TRP  71  -6.654  -5.743  -9.024
  565    HE1  TRP  71           HE1      TRP  71  -5.529  -7.807 -10.086
  566    HE3  TRP  71           HE3      TRP  71  -2.150  -5.618  -6.633
  567    HZ2  TRP  71           HZ2      TRP  71  -3.042  -9.217  -9.938
  568    HZ3  TRP  71           HZ3      TRP  71  -0.422  -7.325  -7.105
  569    HH2  TRP  71           HH2      TRP  71  -0.861  -9.126  -8.755
  570    H    ILE  72           HN       ILE  72  -3.673  -4.120  -4.080
  571    HA   ILE  72           HA       ILE  72  -2.204  -6.653  -4.199
  572    HB   ILE  72           HB       ILE  72  -1.901  -4.140  -2.520
  573   HG12  ILE  72          HG12      ILE  72   0.018  -5.511  -4.437
  574   HG13  ILE  72          HG11      ILE  72  -1.123  -4.273  -4.945
  575   HG21  ILE  72          HG21      ILE  72  -0.429  -6.775  -2.214
  576   HG22  ILE  72          HG22      ILE  72  -1.246  -5.844  -0.961
  577   HG23  ILE  72          HG23      ILE  72   0.252  -5.245  -1.663
  578   HD11  ILE  72          HD11      ILE  72   1.256  -3.485  -4.409
  579   HD12  ILE  72          HD12      ILE  72   0.871  -3.786  -2.717
  580   HD13  ILE  72          HD13      ILE  72  -0.050  -2.594  -3.636
  581    H    PHE  73           HN       PHE  73  -4.459  -5.210  -1.753
  582    HA   PHE  73           HA       PHE  73  -4.123  -7.244   0.198
  583    HB2  PHE  73           HB2      PHE  73  -6.790  -5.961  -0.444
  584    HB3  PHE  73           HB1      PHE  73  -6.248  -6.593   1.105
  585    HD1  PHE  73           HD2      PHE  73  -3.385  -5.318   1.056
  586    HD2  PHE  73           HD1      PHE  73  -7.302  -3.727   0.235
  587    HE1  PHE  73           HE2      PHE  73  -2.610  -3.068   1.687
  588    HE2  PHE  73           HE1      PHE  73  -6.507  -1.474   0.875
  589    HZ   PHE  73           HZ       PHE  73  -4.163  -1.145   1.603
  590    H    ALA  74           HN       ALA  74  -6.396  -7.177  -2.578
  591    HA   ALA  74           HA       ALA  74  -7.586  -9.713  -2.022
  592    HB1  ALA  74           HB1      ALA  74  -8.244  -9.695  -4.406
  593    HB2  ALA  74           HB2      ALA  74  -7.109  -8.381  -4.712
  594    HB3  ALA  74           HB3      ALA  74  -8.509  -8.111  -3.673
  595    H    ALA  75           HN       ALA  75  -4.514  -8.854  -3.497
  596    HA   ALA  75           HA       ALA  75  -4.006 -11.363  -4.791
  597    HB1  ALA  75           HB1      ALA  75  -2.718  -9.211  -5.149
  598    HB2  ALA  75           HB2      ALA  75  -1.703 -10.638  -4.925
  599    HB3  ALA  75           HB3      ALA  75  -1.928  -9.498  -3.598
  600    H    ILE  76           HN       ILE  76  -3.089 -10.173  -1.537
  601    HA   ILE  76           HA       ILE  76  -1.903 -12.750  -0.819
  602    HB   ILE  76           HB       ILE  76  -2.466 -11.209   1.577
  603   HG12  ILE  76          HG12      ILE  76  -1.404  -9.511  -0.713
  604   HG13  ILE  76          HG11      ILE  76  -2.951  -9.303   0.097
  605   HG21  ILE  76          HG21      ILE  76  -0.429 -12.627   1.041
  606   HG22  ILE  76          HG22      ILE  76  -0.075 -11.071   1.780
  607   HG23  ILE  76          HG23      ILE  76   0.152 -11.292   0.045
  608   HD11  ILE  76          HD11      ILE  76  -0.182  -8.842   1.212
  609   HD12  ILE  76          HD12      ILE  76  -1.570  -9.061   2.279
  610   HD13  ILE  76          HD13      ILE  76  -1.536  -7.717   1.139
  611    H    ASN  77           HN       ASN  77  -4.826 -12.427  -1.638
  612    HA   ASN  77           HA       ASN  77  -6.866 -13.412  -1.103
  613    HB2  ASN  77           HB2      ASN  77  -5.270 -15.039   0.912
  614    HB3  ASN  77           HB1      ASN  77  -6.803 -15.484   0.168
  615   HD21  ASN  77          HD21      ASN  77  -3.425 -15.813  -0.137
  616   HD22  ASN  77          HD22      ASN  77  -3.382 -16.367  -1.740
  617    H    ARG  78           HN       ARG  78  -5.603 -11.164   0.639
  618    HA   ARG  78           HA       ARG  78  -6.919 -11.525   3.242
  619    HB2  ARG  78           HB2      ARG  78  -5.515  -9.214   1.871
  620    HB3  ARG  78           HB1      ARG  78  -6.297  -9.016   3.434
  621    HG2  ARG  78           HG2      ARG  78  -4.412 -11.351   3.191
  622    HG3  ARG  78           HG1      ARG  78  -3.673  -9.756   3.173
  623    HD2  ARG  78           HD2      ARG  78  -3.960 -10.903   5.476
  624    HD3  ARG  78           HD1      ARG  78  -4.474  -9.221   5.341
  625    HE   ARG  78           HE       ARG  78  -6.785 -10.611   4.782
  626   HH11  ARG  78          HH21      ARG  78  -4.421 -10.674   7.296
  627   HH12  ARG  78          HH22      ARG  78  -5.546 -11.158   8.520
  628   HH21  ARG  78          HH11      ARG  78  -8.262 -11.244   6.367
  629   HH22  ARG  78          HH12      ARG  78  -7.719 -11.480   7.995
  630    H    ARG  79           HN       ARG  79  -8.841 -12.002   1.422
  631    HA   ARG  79           HA       ARG  79 -10.296  -9.891   0.295
  632    HB2  ARG  79           HB2      ARG  79 -11.391 -12.402   1.590
  633    HB3  ARG  79           HB1      ARG  79 -12.270 -11.366   0.465
  634    HG2  ARG  79           HG2      ARG  79 -10.548 -11.789  -1.261
  635    HG3  ARG  79           HG1      ARG  79  -9.695 -12.851  -0.139
  636    HD2  ARG  79           HD2      ARG  79 -12.506 -13.249  -1.202
  637    HD3  ARG  79           HD1      ARG  79 -11.083 -14.200  -1.626
  638    HE   ARG  79           HE       ARG  79 -11.242 -14.424   1.138
  639   HH11  ARG  79          HH21      ARG  79 -13.354 -14.960  -1.542
  640   HH12  ARG  79          HH22      ARG  79 -14.231 -16.234  -0.762
  641   HH21  ARG  79          HH11      ARG  79 -12.379 -16.082   2.165
  642   HH22  ARG  79          HH12      ARG  79 -13.681 -16.868   1.335
  643    H    ASP  80           HN       ASP  80 -10.337 -11.011   3.673
  644    HA   ASP  80           HA       ASP  80 -12.586  -9.424   4.492
  645    HB2  ASP  80           HB2      ASP  80 -11.599 -11.322   5.812
  646    HB3  ASP  80           HB1      ASP  80 -10.220 -10.286   6.187
  647    H    LEU  81           HN       LEU  81  -9.077  -8.800   4.706
  648    HA   LEU  81           HA       LEU  81  -9.267  -6.239   5.906
  649    HB2  LEU  81           HB2      LEU  81  -7.200  -7.835   5.286
  650    HB3  LEU  81           HB1      LEU  81  -7.089  -6.790   3.883
  651    HG   LEU  81           HG       LEU  81  -5.616  -5.893   5.540
  652   HD11  LEU  81          HD11      LEU  81  -6.378  -3.674   5.740
  653   HD12  LEU  81          HD12      LEU  81  -8.069  -4.158   5.812
  654   HD13  LEU  81          HD13      LEU  81  -7.172  -4.292   4.296
  655   HD21  LEU  81          HD21      LEU  81  -6.909  -7.085   7.494
  656   HD22  LEU  81          HD22      LEU  81  -7.814  -5.576   7.598
  657   HD23  LEU  81          HD23      LEU  81  -6.070  -5.574   7.816
  658    H    TYR  82           HN       TYR  82  -9.873  -7.255   2.601
  659    HA   TYR  82           HA       TYR  82  -9.734  -4.571   1.468
  660    HB2  TYR  82           HB2      TYR  82  -9.413  -6.371  -0.070
  661    HB3  TYR  82           HB1      TYR  82 -10.852  -7.211   0.494
  662    HD1  TYR  82           HD2      TYR  82  -9.834  -3.914  -0.979
  663    HD2  TYR  82           HD1      TYR  82 -12.845  -6.978  -0.792
  664    HE1  TYR  82           HE2      TYR  82 -11.165  -2.721  -2.701
  665    HE2  TYR  82           HE1      TYR  82 -14.166  -5.783  -2.512
  666    HH   TYR  82           HH       TYR  82 -14.298  -3.202  -3.264
  667    H    GLU  83           HN       GLU  83 -12.287  -6.605   2.866
  668    HA   GLU  83           HA       GLU  83 -14.498  -5.038   2.013
  669    HB2  GLU  83           HB2      GLU  83 -14.553  -7.332   3.136
  670    HB3  GLU  83           HB1      GLU  83 -14.336  -6.496   4.671
  671    HG2  GLU  83           HG2      GLU  83 -16.373  -5.140   4.179
  672    HG3  GLU  83           HG1      GLU  83 -16.606  -6.081   2.704
  673    H    LYS  84           HN       LYS  84 -12.502  -4.770   4.969
  674    HA   LYS  84           HA       LYS  84 -13.994  -2.474   5.962
  675    HB2  LYS  84           HB2      LYS  84 -12.690  -4.046   7.412
  676    HB3  LYS  84           HB1      LYS  84 -11.209  -3.392   6.718
  677    HG2  LYS  84           HG2      LYS  84 -11.736  -1.170   7.557
  678    HG3  LYS  84           HG1      LYS  84 -13.305  -1.726   8.137
  679    HD2  LYS  84           HD2      LYS  84 -12.182  -3.287   9.685
  680    HD3  LYS  84           HD1      LYS  84 -10.612  -2.726   9.109
  681    HE2  LYS  84           HE2      LYS  84 -11.180  -1.569  11.187
  682    HE3  LYS  84           HE1      LYS  84 -11.199  -0.422   9.848
  683    HZ1  LYS  84           HZ1      LYS  84 -13.202  -0.737  11.597
  684    HZ2  LYS  84           HZ2      LYS  84 -13.714  -1.757  10.339
  685    HZ3  LYS  84           HZ3      LYS  84 -13.395  -0.117  10.031
  686    H    ALA  85           HN       ALA  85 -11.062  -2.925   4.029
  687    HA   ALA  85           HA       ALA  85  -9.974  -0.338   4.180
  688    HB1  ALA  85           HB1      ALA  85  -9.072  -0.781   1.881
  689    HB2  ALA  85           HB2      ALA  85 -10.087  -2.221   1.806
  690    HB3  ALA  85           HB3      ALA  85  -8.802  -2.112   3.007
  691    H    LYS  86           HN       LYS  86 -12.532  -1.505   1.958
  692    HA   LYS  86           HA       LYS  86 -12.850   1.079   0.690
  693    HB2  LYS  86           HB2      LYS  86 -15.032   0.086  -0.141
  694    HB3  LYS  86           HB1      LYS  86 -13.615  -0.893  -0.511
  695    HG2  LYS  86           HG2      LYS  86 -14.060  -2.352   1.382
  696    HG3  LYS  86           HG1      LYS  86 -15.411  -1.352   1.896
  697    HD2  LYS  86           HD2      LYS  86 -15.478  -2.455  -0.919
  698    HD3  LYS  86           HD1      LYS  86 -15.789  -3.574   0.402
  699    HE2  LYS  86           HE2      LYS  86 -17.900  -2.654  -0.395
  700    HE3  LYS  86           HE1      LYS  86 -17.588  -2.060   1.233
  701    HZ1  LYS  86           HZ1      LYS  86 -18.344  -0.350  -0.395
  702    HZ2  LYS  86           HZ2      LYS  86 -16.872  -0.555  -1.218
  703    HZ3  LYS  86           HZ3      LYS  86 -16.881   0.015   0.382
  704    H    ARG  87           HN       ARG  87 -14.168  -0.424   3.580
  705    HA   ARG  87           HA       ARG  87 -16.378   1.424   3.898
  706    HB2  ARG  87           HB2      ARG  87 -16.215  -0.810   5.027
  707    HB3  ARG  87           HB1      ARG  87 -14.927  -0.157   6.040
  708    HG2  ARG  87           HG2      ARG  87 -16.427   1.519   6.962
  709    HG3  ARG  87           HG1      ARG  87 -17.711   1.032   5.856
  710    HD2  ARG  87           HD2      ARG  87 -17.690  -1.239   6.885
  711    HD3  ARG  87           HD1      ARG  87 -16.485  -0.674   8.043
  712    HE   ARG  87           HE       ARG  87 -18.567   1.146   8.302
  713   HH11  ARG  87          HH21      ARG  87 -18.217  -2.289   8.428
  714   HH12  ARG  87          HH22      ARG  87 -19.506  -2.509   9.564
  715   HH21  ARG  87          HH11      ARG  87 -20.249   0.870   9.782
  716   HH22  ARG  87          HH12      ARG  87 -20.655  -0.723  10.329
  717    H    ASP  88           HN       ASP  88 -12.967   1.566   4.621
  718    HA   ASP  88           HA       ASP  88 -13.302   3.968   6.365
  719    HB2  ASP  88           HB2      ASP  88 -11.684   2.122   6.969
  720    HB3  ASP  88           HB1      ASP  88 -10.754   2.536   5.529
  721    H    GLU  89           HN       GLU  89 -13.066   3.347   3.081
  722    HA   GLU  89           HA       GLU  89 -11.161   5.301   2.227
  723    HB2  GLU  89           HB2      GLU  89 -13.522   3.936   0.961
  724    HB3  GLU  89           HB1      GLU  89 -12.820   5.313   0.116
  725    HG2  GLU  89           HG2      GLU  89 -10.629   4.222   0.088
  726    HG3  GLU  89           HG1      GLU  89 -11.261   2.865   1.016
  727    HA   PRO  90           HA       PRO  90 -13.789   8.745   3.691
  728    HB2  PRO  90           HB2      PRO  90 -12.066  10.787   2.595
  729    HB3  PRO  90           HB1      PRO  90 -12.135  10.248   4.281
  730    HG2  PRO  90           HG2      PRO  90 -10.042   9.706   2.304
  731    HG3  PRO  90           HG1      PRO  90 -10.046   9.304   4.027
  732    HD2  PRO  90           HD2      PRO  90 -10.402   7.478   1.808
  733    HD3  PRO  90           HD1      PRO  90 -10.477   7.094   3.542
  734    H    LYS  91           HN       LYS  91 -15.131  10.374   2.572
  735    HA   LYS  91           HA       LYS  91 -15.940   9.558  -0.056
  736    HB2  LYS  91           HB2      LYS  91 -17.440  10.711   1.564
  737    HB3  LYS  91           HB1      LYS  91 -16.501  12.186   1.358
  738    HG2  LYS  91           HG2      LYS  91 -17.082  12.321  -0.987
  739    HG3  LYS  91           HG1      LYS  91 -17.861  10.742  -0.941
  740    HD2  LYS  91           HD2      LYS  91 -18.846  12.943   0.898
  741    HD3  LYS  91           HD1      LYS  91 -19.340  12.942  -0.792
  742    HE2  LYS  91           HE2      LYS  91 -19.764  10.656   1.165
  743    HE3  LYS  91           HE1      LYS  91 -20.999  11.772   0.592
  744    HZ1  LYS  91           HZ1      LYS  91 -21.313  10.216  -0.965
  745    HZ2  LYS  91           HZ2      LYS  91 -19.779   9.519  -0.748
  746    HZ3  LYS  91           HZ3      LYS  91 -19.956  10.907  -1.710
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1  -7.381  17.591   8.798
    2    H2   MET   1           HT2      MET   1  -7.153  19.198   9.300
    3    H3   MET   1           HT3      MET   1  -8.605  18.390   9.659
    4    HA   MET   1           HA       MET   1  -6.174  18.444  11.121
    5    HB2  MET   1           HB2      MET   1  -8.495  18.803  11.988
    6    HB3  MET   1           HB1      MET   1  -8.838  17.102  11.677
    7    HG2  MET   1           HG2      MET   1  -7.118  16.409  13.244
    8    HG3  MET   1           HG1      MET   1  -6.588  18.076  13.460
    9    HE1  MET   1           HE1      MET   1  -8.718  15.267  14.624
   10    HE2  MET   1           HE2      MET   1  -9.891  15.923  13.484
   11    HE3  MET   1           HE3      MET   1 -10.234  15.964  15.211
   12    H    ALA   2           HN       ALA   2  -8.305  15.614  10.687
   13    HA   ALA   2           HA       ALA   2  -6.153  13.762  11.166
   14    HB1  ALA   2           HB1      ALA   2  -8.855  13.303   9.863
   15    HB2  ALA   2           HB2      ALA   2  -8.511  13.177  11.588
   16    HB3  ALA   2           HB3      ALA   2  -7.779  12.039  10.456
   17    H    SER   3           HN       SER   3  -4.459  14.048   9.697
   18    HA   SER   3           HA       SER   3  -4.891  14.341   6.840
   19    HB2  SER   3           HB2      SER   3  -2.449  13.712   8.530
   20    HB3  SER   3           HB1      SER   3  -2.365  13.828   6.772
   21    HG   SER   3           HG       SER   3  -2.762  15.935   6.884
   22    H    THR   4           HN       THR   4  -4.922  12.737   5.276
   23    HA   THR   4           HA       THR   4  -5.537  10.039   6.082
   24    HB   THR   4           HB       THR   4  -4.603  10.906   3.320
   25    HG1  THR   4           HG1      THR   4  -6.623  11.848   4.710
   26   HG21  THR   4          HG21      THR   4  -4.878   8.474   3.696
   27   HG22  THR   4          HG22      THR   4  -6.087   9.097   2.574
   28   HG23  THR   4          HG23      THR   4  -6.532   8.753   4.246
   29    H    ARG   5           HN       ARG   5  -2.563  11.702   5.535
   30    HA   ARG   5           HA       ARG   5  -0.857   9.585   4.731
   31    HB2  ARG   5           HB2      ARG   5  -0.200  12.002   4.917
   32    HB3  ARG   5           HB1      ARG   5  -0.167  11.815   6.670
   33    HG2  ARG   5           HG2      ARG   5   1.572  10.115   6.502
   34    HG3  ARG   5           HG1      ARG   5   1.482  10.154   4.740
   35    HD2  ARG   5           HD2      ARG   5   3.391  11.492   5.628
   36    HD3  ARG   5           HD1      ARG   5   2.244  12.472   4.714
   37    HE   ARG   5           HE       ARG   5   1.356  12.674   7.337
   38   HH11  ARG   5          HH21      ARG   5   4.330  13.192   5.657
   39   HH12  ARG   5          HH22      ARG   5   4.867  14.443   6.729
   40   HH21  ARG   5          HH11      ARG   5   2.047  14.301   8.740
   41   HH22  ARG   5          HH12      ARG   5   3.576  15.069   8.472
   42    H    CYS   6           HN       CYS   6  -1.713  10.649   8.042
   43    HA   CYS   6           HA       CYS   6  -0.261   8.515   9.328
   44    HB2  CYS   6           HB2      CYS   6  -2.568  10.221  10.309
   45    HB3  CYS   6           HB1      CYS   6  -1.622   9.137  11.329
   46    HG   CYS   6           HG       CYS   6  -0.757  11.803  11.077
   47    H    LYS   7           HN       LYS   7  -3.472   8.797   7.959
   48    HA   LYS   7           HA       LYS   7  -4.604   6.488   9.258
   49    HB2  LYS   7           HB2      LYS   7  -5.872   8.357   8.054
   50    HB3  LYS   7           HB1      LYS   7  -5.389   7.593   6.544
   51    HG2  LYS   7           HG2      LYS   7  -7.482   6.575   6.889
   52    HG3  LYS   7           HG1      LYS   7  -6.421   5.397   7.656
   53    HD2  LYS   7           HD2      LYS   7  -6.882   6.411   9.863
   54    HD3  LYS   7           HD1      LYS   7  -7.901   7.629   9.099
   55    HE2  LYS   7           HE2      LYS   7  -9.359   5.900   9.947
   56    HE3  LYS   7           HE1      LYS   7  -9.322   5.734   8.191
   57    HZ1  LYS   7           HZ1      LYS   7  -7.236   4.214   8.986
   58    HZ2  LYS   7           HZ2      LYS   7  -8.785   3.627   8.611
   59    HZ3  LYS   7           HZ3      LYS   7  -8.360   3.942  10.226
   60    H    LEU   8           HN       LEU   8  -3.032   6.960   6.087
   61    HA   LEU   8           HA       LEU   8  -3.319   4.251   5.194
   62    HB2  LEU   8           HB2      LEU   8  -2.443   6.474   4.001
   63    HB3  LEU   8           HB1      LEU   8  -0.863   5.894   4.503
   64    HG   LEU   8           HG       LEU   8  -2.822   4.182   2.915
   65   HD11  LEU   8          HD11      LEU   8  -1.483   4.753   0.930
   66   HD12  LEU   8          HD12      LEU   8  -0.525   5.876   1.893
   67   HD13  LEU   8          HD13      LEU   8  -2.238   6.191   1.617
   68   HD21  LEU   8          HD21      LEU   8  -0.677   2.967   2.337
   69   HD22  LEU   8          HD22      LEU   8  -1.118   2.870   4.035
   70   HD23  LEU   8          HD23      LEU   8   0.150   3.978   3.522
   71    H    ALA   9           HN       ALA   9  -0.698   5.843   7.035
   72    HA   ALA   9           HA       ALA   9   0.938   3.503   7.289
   73    HB1  ALA   9           HB1      ALA   9   0.694   5.839   9.204
   74    HB2  ALA   9           HB2      ALA   9   1.757   5.792   7.798
   75    HB3  ALA   9           HB3      ALA   9   2.025   4.683   9.145
   76    H    ARG  10           HN       ARG  10  -1.767   4.764   9.162
   77    HA   ARG  10           HA       ARG  10  -1.586   3.081  11.415
   78    HB2  ARG  10           HB2      ARG  10  -3.226   5.020  10.983
   79    HB3  ARG  10           HB1      ARG  10  -4.202   3.858  10.095
   80    HG2  ARG  10           HG2      ARG  10  -5.169   3.666  12.221
   81    HG3  ARG  10           HG1      ARG  10  -3.950   2.399  12.323
   82    HD2  ARG  10           HD2      ARG  10  -2.419   3.972  13.478
   83    HD3  ARG  10           HD1      ARG  10  -3.626   5.248  13.342
   84    HE   ARG  10           HE       ARG  10  -4.957   3.173  14.636
   85   HH11  ARG  10          HH21      ARG  10  -2.060   4.995  15.107
   86   HH12  ARG  10          HH22      ARG  10  -2.096   4.851  16.833
   87   HH21  ARG  10          HH11      ARG  10  -5.012   2.979  16.886
   88   HH22  ARG  10          HH12      ARG  10  -3.763   3.712  17.838
   89    H    TYR  11           HN       TYR  11  -2.776   2.393   8.166
   90    HA   TYR  11           HA       TYR  11  -3.913  -0.201   8.917
   91    HB2  TYR  11           HB2      TYR  11  -3.457   1.295   6.338
   92    HB3  TYR  11           HB1      TYR  11  -3.773  -0.435   6.251
   93    HD1  TYR  11           HD2      TYR  11  -5.854  -1.371   7.308
   94    HD2  TYR  11           HD1      TYR  11  -5.250   2.846   6.778
   95    HE1  TYR  11           HE2      TYR  11  -8.291  -0.992   7.585
   96    HE2  TYR  11           HE1      TYR  11  -7.686   3.231   7.058
   97    HH   TYR  11           HH       TYR  11  -9.616   2.039   8.163
   98    H    LEU  12           HN       LEU  12  -1.034   0.705   6.928
   99    HA   LEU  12           HA       LEU  12  -0.037  -1.972   6.772
  100    HB2  LEU  12           HB2      LEU  12   1.782   0.462   6.875
  101    HB3  LEU  12           HB1      LEU  12   2.045  -1.055   6.022
  102    HG   LEU  12           HG       LEU  12  -0.226   0.863   5.279
  103   HD11  LEU  12          HD11      LEU  12   2.523   0.602   4.004
  104   HD12  LEU  12          HD12      LEU  12   2.015   1.950   5.017
  105   HD13  LEU  12          HD13      LEU  12   1.219   1.662   3.471
  106   HD21  LEU  12          HD21      LEU  12   1.061  -1.546   3.925
  107   HD22  LEU  12          HD22      LEU  12   0.021  -0.410   3.069
  108   HD23  LEU  12          HD23      LEU  12  -0.626  -1.355   4.400
  109    H    GLU  13           HN       GLU  13   0.056   0.368   9.319
  110    HA   GLU  13           HA       GLU  13   2.160  -1.008  10.839
  111    HB2  GLU  13           HB2      GLU  13   1.632   1.492  10.958
  112    HB3  GLU  13           HB1      GLU  13   0.180   1.066  11.859
  113    HG2  GLU  13           HG2      GLU  13   2.955   0.176  12.716
  114    HG3  GLU  13           HG1      GLU  13   2.233   1.688  13.255
  115    H    ASP  14           HN       ASP  14  -1.323  -1.146  10.555
  116    HA   ASP  14           HA       ASP  14  -1.705  -2.601  13.077
  117    HB2  ASP  14           HB2      ASP  14  -3.486  -1.163  12.131
  118    HB3  ASP  14           HB1      ASP  14  -3.608  -2.239  10.738
  119    H    LEU  15           HN       LEU  15  -0.422  -3.548  10.087
  120    HA   LEU  15           HA       LEU  15  -1.589  -6.305  10.208
  121    HB2  LEU  15           HB2      LEU  15   0.481  -5.224   8.270
  122    HB3  LEU  15           HB1      LEU  15  -0.425  -6.727   8.127
  123    HG   LEU  15           HG       LEU  15  -1.489  -3.896   7.899
  124   HD11  LEU  15          HD11      LEU  15  -2.095  -4.565   5.652
  125   HD12  LEU  15          HD12      LEU  15  -1.640  -6.236   5.979
  126   HD13  LEU  15          HD13      LEU  15  -0.401  -4.985   5.903
  127   HD21  LEU  15          HD21      LEU  15  -2.986  -6.511   8.236
  128   HD22  LEU  15          HD22      LEU  15  -3.724  -5.130   7.423
  129   HD23  LEU  15          HD23      LEU  15  -3.228  -4.997   9.106
  130    H    GLU  16           HN       GLU  16   0.031  -8.126   9.964
  131    HA   GLU  16           HA       GLU  16   1.799  -8.112  12.228
  132    HB2  GLU  16           HB2      GLU  16   0.630 -10.132  11.217
  133    HB3  GLU  16           HB1      GLU  16   1.814 -10.077   9.914
  134    HG2  GLU  16           HG2      GLU  16   2.632 -11.660  11.534
  135    HG3  GLU  16           HG1      GLU  16   3.628 -10.217  11.688
  136    H    ASP  17           HN       ASP  17   4.107  -8.164  12.247
  137    HA   ASP  17           HA       ASP  17   5.432  -6.356  10.527
  138    HB2  ASP  17           HB2      ASP  17   6.670  -8.650  12.078
  139    HB3  ASP  17           HB1      ASP  17   7.512  -7.215  11.491
  140    H    VAL  18           HN       VAL  18   5.195  -9.913  10.332
  141    HA   VAL  18           HA       VAL  18   6.997 -10.173   8.109
  142    HB   VAL  18           HB       VAL  18   4.676 -11.967   8.934
  143   HG11  VAL  18          HG11      VAL  18   6.998 -12.388   7.015
  144   HG12  VAL  18          HG12      VAL  18   5.276 -12.467   6.637
  145   HG13  VAL  18          HG13      VAL  18   6.013 -13.706   7.651
  146   HG21  VAL  18          HG21      VAL  18   6.439 -13.299  10.027
  147   HG22  VAL  18          HG22      VAL  18   6.438 -11.657  10.670
  148   HG23  VAL  18          HG23      VAL  18   7.661 -12.145   9.496
  149    H    ASP  19           HN       ASP  19   3.542  -9.386   8.326
  150    HA   ASP  19           HA       ASP  19   3.021  -9.706   5.494
  151    HB2  ASP  19           HB2      ASP  19   1.190  -9.660   7.146
  152    HB3  ASP  19           HB1      ASP  19   1.607  -8.003   7.578
  153    H    LEU  20           HN       LEU  20   4.349  -7.193   7.524
  154    HA   LEU  20           HA       LEU  20   4.125  -4.997   5.711
  155    HB2  LEU  20           HB2      LEU  20   4.883  -5.156   8.257
  156    HB3  LEU  20           HB1      LEU  20   6.488  -5.333   7.576
  157    HG   LEU  20           HG       LEU  20   6.202  -3.004   8.036
  158   HD11  LEU  20          HD11      LEU  20   7.159  -3.661   5.770
  159   HD12  LEU  20          HD12      LEU  20   6.577  -2.004   5.918
  160   HD13  LEU  20          HD13      LEU  20   5.598  -3.207   5.085
  161   HD21  LEU  20          HD21      LEU  20   3.704  -2.795   6.335
  162   HD22  LEU  20          HD22      LEU  20   4.314  -1.692   7.559
  163   HD23  LEU  20          HD23      LEU  20   3.589  -3.218   8.043
  164    H    LYS  21           HN       LYS  21   6.658  -7.412   6.250
  165    HA   LYS  21           HA       LYS  21   8.516  -6.489   4.298
  166    HB2  LYS  21           HB2      LYS  21   9.042  -8.126   6.084
  167    HB3  LYS  21           HB1      LYS  21   8.027  -9.319   5.275
  168    HG2  LYS  21           HG2      LYS  21   9.481  -9.313   3.324
  169    HG3  LYS  21           HG1      LYS  21  10.438  -7.992   3.998
  170    HD2  LYS  21           HD2      LYS  21  11.212  -9.391   5.816
  171    HD3  LYS  21           HD1      LYS  21  10.114 -10.689   5.348
  172    HE2  LYS  21           HE2      LYS  21  12.412 -11.143   4.569
  173    HE3  LYS  21           HE1      LYS  21  11.304 -10.946   3.212
  174    HZ1  LYS  21           HZ1      LYS  21  12.055  -8.718   2.896
  175    HZ2  LYS  21           HZ2      LYS  21  13.423  -9.722   2.963
  176    HZ3  LYS  21           HZ3      LYS  21  13.000  -8.769   4.305
  177    H    LYS  22           HN       LYS  22   5.763  -8.742   4.001
  178    HA   LYS  22           HA       LYS  22   6.416  -9.525   1.287
  179    HB2  LYS  22           HB2      LYS  22   3.879  -9.713   2.942
  180    HB3  LYS  22           HB1      LYS  22   3.942 -10.269   1.271
  181    HG2  LYS  22           HG2      LYS  22   5.815 -11.781   1.853
  182    HG3  LYS  22           HG1      LYS  22   5.720 -11.245   3.530
  183    HD2  LYS  22           HD2      LYS  22   3.437 -12.096   3.711
  184    HD3  LYS  22           HD1      LYS  22   3.449 -12.554   2.008
  185    HE2  LYS  22           HE2      LYS  22   5.300 -14.123   2.433
  186    HE3  LYS  22           HE1      LYS  22   5.305 -13.662   4.135
  187    HZ1  LYS  22           HZ1      LYS  22   3.077 -14.486   4.366
  188    HZ2  LYS  22           HZ2      LYS  22   4.049 -15.710   3.699
  189    HZ3  LYS  22           HZ3      LYS  22   2.981 -14.835   2.710
  190    H    PHE  23           HN       PHE  23   4.664  -6.801   2.654
  191    HA   PHE  23           HA       PHE  23   3.300  -6.057   0.212
  192    HB2  PHE  23           HB2      PHE  23   2.914  -5.264   2.686
  193    HB3  PHE  23           HB1      PHE  23   4.151  -4.066   2.335
  194    HD1  PHE  23           HD1      PHE  23   3.793  -2.376   0.525
  195    HD2  PHE  23           HD2      PHE  23   0.689  -5.093   1.738
  196    HE1  PHE  23           HE1      PHE  23   2.097  -0.945  -0.584
  197    HE2  PHE  23           HE2      PHE  23  -0.997  -3.663   0.622
  198    HZ   PHE  23           HZ       PHE  23  -0.294  -1.588  -0.538
  199    H    LYS  24           HN       LYS  24   6.473  -5.147   1.601
  200    HA   LYS  24           HA       LYS  24   7.081  -3.232  -0.480
  201    HB2  LYS  24           HB2      LYS  24   9.373  -4.674   0.832
  202    HB3  LYS  24           HB1      LYS  24   9.125  -2.943   0.598
  203    HG2  LYS  24           HG2      LYS  24   7.289  -3.119   2.389
  204    HG3  LYS  24           HG1      LYS  24   7.918  -4.732   2.720
  205    HD2  LYS  24           HD2      LYS  24   9.448  -2.118   2.925
  206    HD3  LYS  24           HD1      LYS  24   8.950  -3.153   4.261
  207    HE2  LYS  24           HE2      LYS  24  11.217  -3.749   3.949
  208    HE3  LYS  24           HE1      LYS  24  10.366  -5.001   3.044
  209    HZ1  LYS  24           HZ1      LYS  24  11.158  -4.237   1.114
  210    HZ2  LYS  24           HZ2      LYS  24  12.310  -3.420   2.056
  211    HZ3  LYS  24           HZ3      LYS  24  10.913  -2.611   1.527
  212    H    MET  25           HN       MET  25   7.988  -6.639   0.029
  213    HA   MET  25           HA       MET  25   9.578  -7.044  -2.237
  214    HB2  MET  25           HB2      MET  25   9.103  -8.717  -0.410
  215    HB3  MET  25           HB1      MET  25   7.538  -9.016  -1.159
  216    HG2  MET  25           HG2      MET  25  10.089  -9.290  -2.770
  217    HG3  MET  25           HG1      MET  25   9.505 -10.614  -1.770
  218    HE1  MET  25           HE1      MET  25   7.963 -12.311  -2.504
  219    HE2  MET  25           HE2      MET  25   6.464 -11.987  -3.369
  220    HE3  MET  25           HE3      MET  25   6.774 -11.190  -1.830
  221    H    HIS  26           HN       HIS  26   6.063  -6.846  -2.007
  222    HA   HIS  26           HA       HIS  26   5.530  -7.792  -4.695
  223    HB2  HIS  26           HB2      HIS  26   3.942  -5.980  -2.827
  224    HB3  HIS  26           HB1      HIS  26   3.310  -6.604  -4.353
  225    HD1  HIS  26           HD1      HIS  26   5.483  -9.101  -2.944
  226    HD2  HIS  26           HD2      HIS  26   1.526  -7.971  -2.288
  227    HE1  HIS  26           HE1      HIS  26   4.373 -11.039  -1.751
  228    H    LEU  27           HN       LEU  27   6.022  -4.524  -3.313
  229    HA   LEU  27           HA       LEU  27   5.703  -3.204  -5.914
  230    HB2  LEU  27           HB2      LEU  27   7.098  -2.132  -3.436
  231    HB3  LEU  27           HB1      LEU  27   6.436  -1.194  -4.772
  232    HG   LEU  27           HG       LEU  27   4.782  -2.946  -2.920
  233   HD11  LEU  27          HD11      LEU  27   5.684  -1.089  -1.655
  234   HD12  LEU  27          HD12      LEU  27   3.996  -0.733  -2.013
  235   HD13  LEU  27          HD13      LEU  27   5.274   0.047  -2.941
  236   HD21  LEU  27          HD21      LEU  27   4.088  -1.029  -5.173
  237   HD22  LEU  27          HD22      LEU  27   2.912  -1.472  -3.937
  238   HD23  LEU  27          HD23      LEU  27   3.593  -2.710  -4.983
  239    H    GLU  28           HN       GLU  28   8.373  -4.555  -4.065
  240    HA   GLU  28           HA       GLU  28  10.509  -3.347  -5.539
  241    HB2  GLU  28           HB2      GLU  28  10.725  -4.570  -3.343
  242    HB3  GLU  28           HB1      GLU  28  10.508  -6.081  -4.224
  243    HG2  GLU  28           HG2      GLU  28  12.501  -5.642  -5.556
  244    HG3  GLU  28           HG1      GLU  28  12.689  -4.056  -4.806
  245    H    ASP  29           HN       ASP  29   8.253  -5.811  -6.380
  246    HA   ASP  29           HA       ASP  29   9.671  -6.243  -8.975
  247    HB2  ASP  29           HB2      ASP  29   9.217  -8.695  -8.802
  248    HB3  ASP  29           HB1      ASP  29  10.375  -8.132  -7.598
  249    H    TYR  30           HN       TYR  30   7.518  -4.602  -8.768
  250    HA   TYR  30           HA       TYR  30   4.989  -5.943  -9.011
  251    HB2  TYR  30           HB2      TYR  30   5.220  -3.542  -8.423
  252    HB3  TYR  30           HB1      TYR  30   5.815  -3.219 -10.051
  253    HD1  TYR  30           HD2      TYR  30   4.321  -3.385 -12.005
  254    HD2  TYR  30           HD1      TYR  30   2.862  -4.072  -8.020
  255    HE1  TYR  30           HE2      TYR  30   1.989  -3.195 -12.825
  256    HE2  TYR  30           HE1      TYR  30   0.530  -3.882  -8.844
  257    HH   TYR  30           HH       TYR  30  -0.296  -4.035 -12.075
  258    HA   PRO  31           HA       PRO  31   5.753  -7.388 -13.199
  259    HB2  PRO  31           HB2      PRO  31   3.027  -7.626 -14.024
  260    HB3  PRO  31           HB1      PRO  31   4.027  -8.904 -13.320
  261    HG2  PRO  31           HG2      PRO  31   1.861  -7.339 -12.038
  262    HG3  PRO  31           HG1      PRO  31   2.594  -8.863 -11.507
  263    HD2  PRO  31           HD2      PRO  31   3.053  -6.304 -10.343
  264    HD3  PRO  31           HD1      PRO  31   4.012  -7.773 -10.051
  265    HA   PRO  32           HA       PRO  32   5.156  -3.216 -14.976
  266    HB2  PRO  32           HB2      PRO  32   6.427  -3.826 -17.475
  267    HB3  PRO  32           HB1      PRO  32   7.179  -3.045 -16.077
  268    HG2  PRO  32           HG2      PRO  32   7.570  -5.794 -17.054
  269    HG3  PRO  32           HG1      PRO  32   8.498  -4.919 -15.825
  270    HD2  PRO  32           HD2      PRO  32   6.585  -7.019 -15.363
  271    HD3  PRO  32           HD1      PRO  32   7.398  -6.027 -14.130
  272    H    GLN  33           HN       GLN  33   3.342  -2.527 -16.080
  273    HA   GLN  33           HA       GLN  33   1.715  -4.545 -17.511
  274    HB2  GLN  33           HB2      GLN  33   0.832  -2.760 -15.826
  275    HB3  GLN  33           HB1      GLN  33   1.007  -1.608 -17.148
  276    HG2  GLN  33           HG2      GLN  33  -0.619  -4.167 -17.298
  277    HG3  GLN  33           HG1      GLN  33  -1.290  -2.572 -16.979
  278   HE21  GLN  33          HE21      GLN  33  -0.333  -4.734 -19.484
  279   HE22  GLN  33          HE22      GLN  33  -0.481  -3.649 -20.781
  280    H    LYS  34           HN       LYS  34   3.291  -1.415 -18.195
  281    HA   LYS  34           HA       LYS  34   3.878  -2.183 -20.921
  282    HB2  LYS  34           HB2      LYS  34   1.422  -1.686 -21.095
  283    HB3  LYS  34           HB1      LYS  34   1.758  -0.042 -20.553
  284    HG2  LYS  34           HG2      LYS  34   3.180   0.358 -22.486
  285    HG3  LYS  34           HG1      LYS  34   3.017  -1.322 -22.996
  286    HD2  LYS  34           HD2      LYS  34   0.579  -0.992 -23.277
  287    HD3  LYS  34           HD1      LYS  34   0.760   0.697 -22.799
  288    HE2  LYS  34           HE2      LYS  34   2.266   1.083 -24.712
  289    HE3  LYS  34           HE1      LYS  34   2.099  -0.605 -25.189
  290    HZ1  LYS  34           HZ1      LYS  34   0.445   0.219 -26.445
  291    HZ2  LYS  34           HZ2      LYS  34   0.231   1.597 -25.474
  292    HZ3  LYS  34           HZ3      LYS  34  -0.453   0.113 -25.010
  293    H    GLY  35           HN       GLY  35   5.967  -1.457 -20.254
  294    HA2  GLY  35           HA2      GLY  35   7.677   0.149 -20.138
  295    HA3  GLY  35           HA1      GLY  35   6.509   1.327 -20.742
  296    H    CYS  36           HN       CYS  36   5.741  -0.492 -17.882
  297    HA   CYS  36           HA       CYS  36   5.253   1.821 -16.305
  298    HB2  CYS  36           HB2      CYS  36   4.326  -0.439 -15.812
  299    HB3  CYS  36           HB1      CYS  36   5.936  -0.967 -15.324
  300    HG   CYS  36           HG       CYS  36   5.572   0.105 -13.128
  301    H    ILE  37           HN       ILE  37   6.484   2.760 -14.594
  302    HA   ILE  37           HA       ILE  37   9.370   2.726 -15.055
  303    HB   ILE  37           HB       ILE  37   8.220   4.832 -14.643
  304   HG12  ILE  37          HG12      ILE  37  10.015   4.146 -12.289
  305   HG13  ILE  37          HG11      ILE  37  10.608   4.489 -13.917
  306   HG21  ILE  37          HG21      ILE  37   7.736   4.046 -11.756
  307   HG22  ILE  37          HG22      ILE  37   6.527   3.684 -12.987
  308   HG23  ILE  37          HG23      ILE  37   7.007   5.351 -12.688
  309   HD11  ILE  37          HD11      ILE  37  10.692   6.531 -12.528
  310   HD12  ILE  37          HD12      ILE  37   8.966   6.384 -12.191
  311   HD13  ILE  37          HD13      ILE  37   9.518   6.724 -13.831
  312    HA   PRO  38           HA       PRO  38   9.593  -0.459 -11.784
  313    HB2  PRO  38           HB2      PRO  38  12.448  -0.609 -11.756
  314    HB3  PRO  38           HB1      PRO  38  11.354  -1.667 -12.659
  315    HG2  PRO  38           HG2      PRO  38  13.087   0.481 -13.697
  316    HG3  PRO  38           HG1      PRO  38  12.222  -0.773 -14.599
  317    HD2  PRO  38           HD2      PRO  38  11.512   2.007 -14.411
  318    HD3  PRO  38           HD1      PRO  38  10.557   0.711 -15.172
  319    H    LEU  39           HN       LEU  39   9.750  -0.156  -9.567
  320    HA   LEU  39           HA       LEU  39  10.563   2.475  -8.581
  321    HB2  LEU  39           HB2      LEU  39   9.362   0.000  -7.340
  322    HB3  LEU  39           HB1      LEU  39   9.887   1.336  -6.327
  323    HG   LEU  39           HG       LEU  39   7.430   1.363  -6.946
  324   HD11  LEU  39          HD11      LEU  39   8.878   3.459  -6.377
  325   HD12  LEU  39          HD12      LEU  39   7.294   3.694  -7.102
  326   HD13  LEU  39          HD13      LEU  39   8.738   3.835  -8.096
  327   HD21  LEU  39          HD21      LEU  39   7.859   0.552  -9.321
  328   HD22  LEU  39          HD22      LEU  39   8.394   2.193  -9.696
  329   HD23  LEU  39          HD23      LEU  39   6.736   1.904  -9.173
  330    HA   PRO  40           HA       PRO  40  14.722   0.705  -7.915
  331    HB2  PRO  40           HB2      PRO  40  15.540   2.986  -6.281
  332    HB3  PRO  40           HB1      PRO  40  16.050   2.597  -7.930
  333    HG2  PRO  40           HG2      PRO  40  14.250   4.710  -7.109
  334    HG3  PRO  40           HG1      PRO  40  14.729   4.288  -8.761
  335    HD2  PRO  40           HD2      PRO  40  12.148   3.817  -7.489
  336    HD3  PRO  40           HD1      PRO  40  12.625   3.426  -9.157
  337    H    ARG  41           HN       ARG  41  15.292  -0.687  -6.286
  338    HA   ARG  41           HA       ARG  41  13.646  -0.974  -3.942
  339    HB2  ARG  41           HB2      ARG  41  14.990  -2.803  -5.095
  340    HB3  ARG  41           HB1      ARG  41  16.436  -2.105  -4.367
  341    HG2  ARG  41           HG2      ARG  41  15.375  -2.393  -2.110
  342    HG3  ARG  41           HG1      ARG  41  14.031  -3.223  -2.894
  343    HD2  ARG  41           HD2      ARG  41  15.609  -4.888  -2.083
  344    HD3  ARG  41           HD1      ARG  41  15.666  -4.864  -3.845
  345    HE   ARG  41           HE       ARG  41  17.651  -3.075  -3.085
  346   HH11  ARG  41          HH21      ARG  41  16.839  -6.357  -2.383
  347   HH12  ARG  41          HH22      ARG  41  18.482  -6.847  -2.133
  348   HH21  ARG  41          HH11      ARG  41  19.796  -3.700  -2.761
  349   HH22  ARG  41          HH12      ARG  41  20.155  -5.343  -2.346
  350    H    GLY  42           HN       GLY  42  16.692   0.668  -4.547
  351    HA2  GLY  42           HA2      GLY  42  17.750   0.980  -1.977
  352    HA3  GLY  42           HA1      GLY  42  17.864   2.250  -3.193
  353    H    GLN  43           HN       GLN  43  15.019   2.893  -3.333
  354    HA   GLN  43           HA       GLN  43  14.898   4.600  -0.975
  355    HB2  GLN  43           HB2      GLN  43  12.995   5.625  -2.015
  356    HB3  GLN  43           HB1      GLN  43  14.013   5.120  -3.367
  357    HG2  GLN  43           HG2      GLN  43  12.607   2.962  -3.406
  358    HG3  GLN  43           HG1      GLN  43  11.489   3.793  -2.331
  359   HE21  GLN  43          HE21      GLN  43  10.986   2.950  -5.149
  360   HE22  GLN  43          HE22      GLN  43  10.607   4.370  -5.998
  361    H    THR  44           HN       THR  44  13.142   1.671  -2.004
  362    HA   THR  44           HA       THR  44  11.166   1.647   0.016
  363    HB   THR  44           HB       THR  44  10.971  -0.721  -0.372
  364    HG1  THR  44           HG1      THR  44  13.654  -0.448  -0.856
  365   HG21  THR  44          HG21      THR  44  10.865  -0.809  -2.800
  366   HG22  THR  44          HG22      THR  44  11.976   0.555  -2.929
  367   HG23  THR  44          HG23      THR  44  10.360   0.794  -2.263
  368    H    GLU  45           HN       GLU  45  14.364   0.001   0.146
  369    HA   GLU  45           HA       GLU  45  14.094  -0.786   2.881
  370    HB2  GLU  45           HB2      GLU  45  16.601  -1.009   2.836
  371    HB3  GLU  45           HB1      GLU  45  15.814  -1.805   1.474
  372    HG2  GLU  45           HG2      GLU  45  16.270   0.234   0.088
  373    HG3  GLU  45           HG1      GLU  45  17.174   0.904   1.444
  374    H    LYS  46           HN       LYS  46  15.424   2.204   1.414
  375    HA   LYS  46           HA       LYS  46  16.251   3.285   4.002
  376    HB2  LYS  46           HB2      LYS  46  17.295   3.922   1.800
  377    HB3  LYS  46           HB1      LYS  46  15.798   4.754   1.383
  378    HG2  LYS  46           HG2      LYS  46  16.040   6.262   3.268
  379    HG3  LYS  46           HG1      LYS  46  17.436   5.362   3.861
  380    HD2  LYS  46           HD2      LYS  46  18.707   5.952   1.853
  381    HD3  LYS  46           HD1      LYS  46  17.306   6.796   1.193
  382    HE2  LYS  46           HE2      LYS  46  17.337   8.332   3.147
  383    HE3  LYS  46           HE1      LYS  46  18.786   7.518   3.738
  384    HZ1  LYS  46           HZ1      LYS  46  18.464   9.339   1.486
  385    HZ2  LYS  46           HZ2      LYS  46  19.554   8.054   1.276
  386    HZ3  LYS  46           HZ3      LYS  46  19.768   9.154   2.554
  387    H    ALA  47           HN       ALA  47  13.290   3.051   2.275
  388    HA   ALA  47           HA       ALA  47  12.030   5.423   3.445
  389    HB1  ALA  47           HB1      ALA  47   9.938   4.399   2.498
  390    HB2  ALA  47           HB2      ALA  47  10.904   3.017   1.982
  391    HB3  ALA  47           HB3      ALA  47  11.219   4.615   1.307
  392    H    ASP  48           HN       ASP  48  11.237   5.518   5.479
  393    HA   ASP  48           HA       ASP  48  11.110   3.103   7.163
  394    HB2  ASP  48           HB2      ASP  48  10.183   5.927   7.802
  395    HB3  ASP  48           HB1      ASP  48  10.567   4.648   8.954
  396    H    HIS  49           HN       HIS  49   8.950   2.910   8.539
  397    HA   HIS  49           HA       HIS  49   6.859   2.112   6.841
  398    HB2  HIS  49           HB2      HIS  49   6.689   3.034   9.723
  399    HB3  HIS  49           HB1      HIS  49   5.420   2.155   8.872
  400    HD1  HIS  49           HD1      HIS  49   6.321   0.601  11.156
  401    HD2  HIS  49           HD2      HIS  49   8.502   0.531   7.604
  402    HE1  HIS  49           HE1      HIS  49   7.720  -1.510  11.217
  403    H    VAL  50           HN       VAL  50   7.227   5.231   8.565
  404    HA   VAL  50           HA       VAL  50   4.748   6.340   7.532
  405    HB   VAL  50           HB       VAL  50   7.269   7.744   8.533
  406   HG11  VAL  50          HG11      VAL  50   4.463   8.792   8.014
  407   HG12  VAL  50          HG12      VAL  50   5.957   9.325   7.243
  408   HG13  VAL  50          HG13      VAL  50   5.676   9.665   8.947
  409   HG21  VAL  50          HG21      VAL  50   4.680   6.991   9.942
  410   HG22  VAL  50          HG22      VAL  50   5.934   8.016  10.634
  411   HG23  VAL  50          HG23      VAL  50   6.282   6.329  10.266
  412    H    ASP  51           HN       ASP  51   8.170   6.834   6.576
  413    HA   ASP  51           HA       ASP  51   7.655   8.474   4.325
  414    HB2  ASP  51           HB2      ASP  51   9.923   8.014   5.304
  415    HB3  ASP  51           HB1      ASP  51   9.863   6.408   4.578
  416    H    LEU  52           HN       LEU  52   7.532   4.952   4.669
  417    HA   LEU  52           HA       LEU  52   7.429   4.231   1.948
  418    HB2  LEU  52           HB2      LEU  52   7.543   2.588   3.793
  419    HB3  LEU  52           HB1      LEU  52   5.901   3.006   4.267
  420    HG   LEU  52           HG       LEU  52   5.070   2.206   2.062
  421   HD11  LEU  52          HD11      LEU  52   8.021   1.701   1.601
  422   HD12  LEU  52          HD12      LEU  52   6.844   2.453   0.522
  423   HD13  LEU  52          HD13      LEU  52   6.807   0.716   0.780
  424   HD21  LEU  52          HD21      LEU  52   5.135   0.689   3.994
  425   HD22  LEU  52          HD22      LEU  52   6.789   0.227   3.590
  426   HD23  LEU  52          HD23      LEU  52   5.465  -0.199   2.506
  427    H    ALA  53           HN       ALA  53   4.710   5.085   4.126
  428    HA   ALA  53           HA       ALA  53   2.685   4.929   2.095
  429    HB1  ALA  53           HB1      ALA  53   1.343   6.322   3.662
  430    HB2  ALA  53           HB2      ALA  53   2.789   6.589   4.634
  431    HB3  ALA  53           HB3      ALA  53   2.118   4.965   4.479
  432    H    THR  54           HN       THR  54   4.984   7.437   2.978
  433    HA   THR  54           HA       THR  54   3.649   9.598   1.585
  434    HB   THR  54           HB       THR  54   6.600   9.280   2.239
  435    HG1  THR  54           HG1      THR  54   5.142   9.111   4.032
  436   HG21  THR  54          HG21      THR  54   6.236  11.081   0.650
  437   HG22  THR  54          HG22      THR  54   6.529  11.786   2.238
  438   HG23  THR  54          HG23      THR  54   4.887  11.701   1.603
  439    H    LEU  55           HN       LEU  55   6.061   7.166   0.604
  440    HA   LEU  55           HA       LEU  55   6.562   8.390  -1.985
  441    HB2  LEU  55           HB2      LEU  55   7.018   5.514  -1.109
  442    HB3  LEU  55           HB1      LEU  55   7.612   6.230  -2.597
  443    HG   LEU  55           HG       LEU  55   8.355   7.182   0.193
  444   HD11  LEU  55          HD11      LEU  55  10.582   6.184  -0.395
  445   HD12  LEU  55          HD12      LEU  55   9.836   5.471  -1.823
  446   HD13  LEU  55          HD13      LEU  55   9.299   4.988  -0.214
  447   HD21  LEU  55          HD21      LEU  55   9.120   8.084  -2.599
  448   HD22  LEU  55          HD22      LEU  55  10.242   8.304  -1.257
  449   HD23  LEU  55          HD23      LEU  55   8.659   9.063  -1.206
  450    H    MET  56           HN       MET  56   4.293   5.980  -0.752
  451    HA   MET  56           HA       MET  56   3.337   5.182  -3.367
  452    HB2  MET  56           HB2      MET  56   3.041   3.892  -1.187
  453    HB3  MET  56           HB1      MET  56   1.785   5.054  -0.761
  454    HG2  MET  56           HG2      MET  56   0.618   4.484  -2.920
  455    HG3  MET  56           HG1      MET  56   1.815   3.215  -3.176
  456    HE1  MET  56           HE1      MET  56   0.669   1.100  -3.131
  457    HE2  MET  56           HE2      MET  56  -0.787   2.060  -3.381
  458    HE3  MET  56           HE3      MET  56  -0.795   0.750  -2.204
  459    H    ILE  57           HN       ILE  57   2.227   7.601  -0.976
  460    HA   ILE  57           HA       ILE  57  -0.050   8.379  -2.658
  461    HB   ILE  57           HB       ILE  57   1.175   9.878  -0.309
  462   HG12  ILE  57          HG12      ILE  57  -1.252   8.049  -0.307
  463   HG13  ILE  57          HG11      ILE  57   0.355   7.496   0.158
  464   HG21  ILE  57          HG21      ILE  57  -1.146  10.866  -0.203
  465   HG22  ILE  57          HG22      ILE  57  -1.479  10.104  -1.756
  466   HG23  ILE  57          HG23      ILE  57  -0.226  11.337  -1.629
  467   HD11  ILE  57          HD11      ILE  57   0.456   9.132   1.955
  468   HD12  ILE  57          HD12      ILE  57  -1.040   8.214   2.112
  469   HD13  ILE  57          HD13      ILE  57  -1.074   9.843   1.441
  470    H    ASP  58           HN       ASP  58   3.227   9.663  -2.072
  471    HA   ASP  58           HA       ASP  58   2.774  12.033  -3.712
  472    HB2  ASP  58           HB2      ASP  58   4.474  11.852  -1.826
  473    HB3  ASP  58           HB1      ASP  58   5.436  10.818  -2.884
  474    H    PHE  59           HN       PHE  59   4.551   8.955  -4.256
  475    HA   PHE  59           HA       PHE  59   5.321   9.760  -6.945
  476    HB2  PHE  59           HB2      PHE  59   6.390   8.017  -5.233
  477    HB3  PHE  59           HB1      PHE  59   5.358   6.866  -6.070
  478    HD1  PHE  59           HD2      PHE  59   8.212   9.186  -6.401
  479    HD2  PHE  59           HD1      PHE  59   5.757   6.301  -8.430
  480    HE1  PHE  59           HE2      PHE  59   9.862   9.081  -8.246
  481    HE2  PHE  59           HE1      PHE  59   7.410   6.198 -10.276
  482    HZ   PHE  59           HZ       PHE  59   9.462   7.588 -10.182
  483    H    ASN  60           HN       ASN  60   2.772   7.504  -5.718
  484    HA   ASN  60           HA       ASN  60   1.884   7.037  -8.532
  485    HB2  ASN  60           HB2      ASN  60   0.772   5.904  -5.940
  486    HB3  ASN  60           HB1      ASN  60   0.417   5.332  -7.567
  487   HD21  ASN  60          HD21      ASN  60   3.043   5.600  -5.152
  488   HD22  ASN  60          HD22      ASN  60   4.005   4.373  -5.825
  489    H    GLY  61           HN       GLY  61   0.905   8.790  -5.651
  490    HA2  GLY  61           HA2      GLY  61  -0.567  10.719  -5.784
  491    HA3  GLY  61           HA1      GLY  61  -1.346  10.019  -7.200
  492    H    GLU  62           HN       GLU  62  -2.875  10.913  -5.047
  493    HA   GLU  62           HA       GLU  62  -3.502   8.804  -3.176
  494    HB2  GLU  62           HB2      GLU  62  -4.028  11.229  -2.820
  495    HB3  GLU  62           HB1      GLU  62  -5.266  11.103  -4.069
  496    HG2  GLU  62           HG2      GLU  62  -6.470   9.424  -2.773
  497    HG3  GLU  62           HG1      GLU  62  -5.186   9.391  -1.564
  498    H    GLU  63           HN       GLU  63  -4.722   9.691  -6.373
  499    HA   GLU  63           HA       GLU  63  -7.031   7.966  -6.294
  500    HB2  GLU  63           HB2      GLU  63  -6.774   9.855  -7.892
  501    HB3  GLU  63           HB1      GLU  63  -5.475   8.978  -8.698
  502    HG2  GLU  63           HG2      GLU  63  -7.007   7.186  -9.325
  503    HG3  GLU  63           HG1      GLU  63  -8.314   7.935  -8.405
  504    H    LYS  64           HN       LYS  64  -3.832   7.535  -7.884
  505    HA   LYS  64           HA       LYS  64  -4.421   4.800  -8.634
  506    HB2  LYS  64           HB2      LYS  64  -2.753   6.268  -9.802
  507    HB3  LYS  64           HB1      LYS  64  -1.702   6.114  -8.398
  508    HG2  LYS  64           HG2      LYS  64  -1.584   3.699  -8.688
  509    HG3  LYS  64           HG1      LYS  64  -2.747   3.771 -10.013
  510    HD2  LYS  64           HD2      LYS  64  -1.167   5.187 -11.300
  511    HD3  LYS  64           HD1      LYS  64   0.005   5.047  -9.989
  512    HE2  LYS  64           HE2      LYS  64   0.002   2.583 -10.268
  513    HE3  LYS  64           HE1      LYS  64  -1.129   2.748 -11.611
  514    HZ1  LYS  64           HZ1      LYS  64   1.713   3.317 -11.500
  515    HZ2  LYS  64           HZ2      LYS  64   0.775   4.452 -12.348
  516    HZ3  LYS  64           HZ3      LYS  64   0.755   2.816 -12.807
  517    H    ALA  65           HN       ALA  65  -2.661   6.260  -5.888
  518    HA   ALA  65           HA       ALA  65  -1.496   3.925  -4.830
  519    HB1  ALA  65           HB1      ALA  65  -1.688   5.056  -2.611
  520    HB2  ALA  65           HB2      ALA  65  -2.723   6.269  -3.361
  521    HB3  ALA  65           HB3      ALA  65  -1.042   6.110  -3.869
  522    H    TRP  66           HN       TRP  66  -4.719   5.260  -3.942
  523    HA   TRP  66           HA       TRP  66  -5.486   3.061  -2.314
  524    HB2  TRP  66           HB2      TRP  66  -6.954   5.228  -3.801
  525    HB3  TRP  66           HB1      TRP  66  -7.917   3.870  -3.224
  526    HD1  TRP  66           HD1      TRP  66  -6.156   6.980  -2.056
  527    HE1  TRP  66           HE1      TRP  66  -6.497   7.265   0.482
  528    HE3  TRP  66           HE3      TRP  66  -8.186   2.435  -0.932
  529    HZ2  TRP  66           HZ2      TRP  66  -7.498   5.765   2.700
  530    HZ3  TRP  66           HZ3      TRP  66  -8.828   1.886   1.421
  531    HH2  TRP  66           HH2      TRP  66  -8.483   3.548   3.222
  532    H    ALA  67           HN       ALA  67  -5.761   3.532  -5.827
  533    HA   ALA  67           HA       ALA  67  -7.330   1.216  -6.379
  534    HB1  ALA  67           HB1      ALA  67  -6.485   1.395  -8.661
  535    HB2  ALA  67           HB2      ALA  67  -5.149   2.411  -8.119
  536    HB3  ALA  67           HB3      ALA  67  -6.804   3.015  -8.041
  537    H    MET  68           HN       MET  68  -3.827   1.640  -5.991
  538    HA   MET  68           HA       MET  68  -3.218  -1.146  -6.639
  539    HB2  MET  68           HB2      MET  68  -1.638   1.148  -5.441
  540    HB3  MET  68           HB1      MET  68  -0.950  -0.472  -5.550
  541    HG2  MET  68           HG2      MET  68  -1.200  -0.483  -7.961
  542    HG3  MET  68           HG1      MET  68  -2.083   1.040  -7.925
  543    HE1  MET  68           HE1      MET  68   1.168  -0.704  -8.313
  544    HE2  MET  68           HE2      MET  68   1.231  -0.584  -6.556
  545    HE3  MET  68           HE3      MET  68   2.401   0.298  -7.535
  546    H    ALA  69           HN       ALA  69  -3.890   0.703  -3.716
  547    HA   ALA  69           HA       ALA  69  -2.988  -1.162  -1.778
  548    HB1  ALA  69           HB1      ALA  69  -4.475  -0.027  -0.231
  549    HB2  ALA  69           HB2      ALA  69  -5.454   0.594  -1.558
  550    HB3  ALA  69           HB3      ALA  69  -3.808   1.184  -1.326
  551    H    VAL  70           HN       VAL  70  -6.034  -1.012  -3.593
  552    HA   VAL  70           HA       VAL  70  -7.259  -3.232  -2.129
  553    HB   VAL  70           HB       VAL  70  -7.964  -2.066  -4.845
  554   HG11  VAL  70          HG11      VAL  70  -9.474  -3.824  -2.877
  555   HG12  VAL  70          HG12      VAL  70  -9.022  -4.229  -4.532
  556   HG13  VAL  70          HG13      VAL  70 -10.244  -2.995  -4.229
  557   HG21  VAL  70          HG21      VAL  70  -9.606  -0.721  -3.576
  558   HG22  VAL  70          HG22      VAL  70  -7.967  -0.377  -3.024
  559   HG23  VAL  70          HG23      VAL  70  -9.017  -1.417  -2.067
  560    H    TRP  71           HN       TRP  71  -5.990  -2.945  -5.475
  561    HA   TRP  71           HA       TRP  71  -6.281  -5.649  -6.172
  562    HB2  TRP  71           HB2      TRP  71  -5.651  -3.857  -7.786
  563    HB3  TRP  71           HB1      TRP  71  -4.041  -3.796  -7.071
  564    HD1  TRP  71           HD1      TRP  71  -6.258  -5.924  -9.300
  565    HE1  TRP  71           HE1      TRP  71  -4.838  -7.802 -10.353
  566    HE3  TRP  71           HE3      TRP  71  -1.918  -5.310  -6.693
  567    HZ2  TRP  71           HZ2      TRP  71  -2.201  -8.896 -10.118
  568    HZ3  TRP  71           HZ3      TRP  71   0.030  -6.775  -7.120
  569    HH2  TRP  71           HH2      TRP  71  -0.103  -8.568  -8.830
  570    H    ILE  72           HN       ILE  72  -3.767  -4.181  -4.139
  571    HA   ILE  72           HA       ILE  72  -2.019  -6.525  -4.297
  572    HB   ILE  72           HB       ILE  72  -2.101  -4.092  -2.484
  573   HG12  ILE  72          HG12      ILE  72   0.081  -5.190  -4.290
  574   HG13  ILE  72          HG11      ILE  72  -1.126  -4.032  -4.832
  575   HG21  ILE  72          HG21      ILE  72   0.092  -5.034  -1.500
  576   HG22  ILE  72          HG22      ILE  72  -0.420  -6.593  -2.139
  577   HG23  ILE  72          HG23      ILE  72  -1.400  -5.772  -0.926
  578   HD11  ILE  72          HD11      ILE  72   0.664  -3.496  -2.446
  579   HD12  ILE  72          HD12      ILE  72  -0.313  -2.339  -3.351
  580   HD13  ILE  72          HD13      ILE  72   1.114  -3.055  -4.092
  581    H    PHE  73           HN       PHE  73  -4.551  -5.510  -1.915
  582    HA   PHE  73           HA       PHE  73  -4.088  -7.608  -0.062
  583    HB2  PHE  73           HB2      PHE  73  -6.856  -6.630  -0.812
  584    HB3  PHE  73           HB1      PHE  73  -6.315  -7.238   0.745
  585    HD1  PHE  73           HD2      PHE  73  -3.629  -5.604   0.845
  586    HD2  PHE  73           HD1      PHE  73  -7.694  -4.510  -0.074
  587    HE1  PHE  73           HE2      PHE  73  -3.179  -3.295   1.575
  588    HE2  PHE  73           HE1      PHE  73  -7.226  -2.198   0.671
  589    HZ   PHE  73           HZ       PHE  73  -4.973  -1.592   1.497
  590    H    ALA  74           HN       ALA  74  -6.183  -7.647  -2.973
  591    HA   ALA  74           HA       ALA  74  -7.087 -10.334  -2.632
  592    HB1  ALA  74           HB1      ALA  74  -7.605 -10.242  -5.049
  593    HB2  ALA  74           HB2      ALA  74  -6.620  -8.788  -5.206
  594    HB3  ALA  74           HB3      ALA  74  -8.099  -8.750  -4.247
  595    H    ALA  75           HN       ALA  75  -4.067  -9.019  -3.850
  596    HA   ALA  75           HA       ALA  75  -3.181 -11.378  -5.234
  597    HB1  ALA  75           HB1      ALA  75  -2.188  -9.051  -5.441
  598    HB2  ALA  75           HB2      ALA  75  -1.003 -10.344  -5.252
  599    HB3  ALA  75           HB3      ALA  75  -1.415  -9.315  -3.879
  600    H    ILE  76           HN       ILE  76  -2.552 -10.221  -1.898
  601    HA   ILE  76           HA       ILE  76  -1.185 -12.777  -1.249
  602    HB   ILE  76           HB       ILE  76  -1.024 -11.645   1.084
  603   HG12  ILE  76          HG12      ILE  76  -1.874  -9.228  -0.557
  604   HG13  ILE  76          HG11      ILE  76  -2.897 -10.028   0.629
  605   HG21  ILE  76          HG21      ILE  76   0.840 -11.728  -0.566
  606   HG22  ILE  76          HG22      ILE  76   0.852 -10.235   0.365
  607   HG23  ILE  76          HG23      ILE  76   0.247 -10.234  -1.291
  608   HD11  ILE  76          HD11      ILE  76  -0.299  -8.545   1.113
  609   HD12  ILE  76          HD12      ILE  76  -1.023  -9.604   2.326
  610   HD13  ILE  76          HD13      ILE  76  -1.895  -8.180   1.765
  611    H    ASN  77           HN       ASN  77  -4.187 -12.409  -1.838
  612    HA   ASN  77           HA       ASN  77  -6.174 -13.376  -1.105
  613    HB2  ASN  77           HB2      ASN  77  -4.549 -15.365  -0.923
  614    HB3  ASN  77           HB1      ASN  77  -4.455 -15.010   0.802
  615   HD21  ASN  77          HD21      ASN  77  -6.601 -16.178  -1.761
  616   HD22  ASN  77          HD22      ASN  77  -7.824 -16.737  -0.725
  617    H    ARG  78           HN       ARG  78  -6.788 -11.348  -0.118
  618    HA   ARG  78           HA       ARG  78  -7.313 -11.629   2.767
  619    HB2  ARG  78           HB2      ARG  78  -5.644  -9.341   1.661
  620    HB3  ARG  78           HB1      ARG  78  -6.420  -9.309   3.244
  621    HG2  ARG  78           HG2      ARG  78  -5.149 -11.495   3.742
  622    HG3  ARG  78           HG1      ARG  78  -4.208 -11.154   2.291
  623    HD2  ARG  78           HD2      ARG  78  -3.001 -10.261   4.184
  624    HD3  ARG  78           HD1      ARG  78  -3.654  -8.900   3.270
  625    HE   ARG  78           HE       ARG  78  -5.618  -9.436   5.154
  626   HH11  ARG  78          HH21      ARG  78  -2.223  -8.804   5.199
  627   HH12  ARG  78          HH22      ARG  78  -2.253  -8.053   6.759
  628   HH21  ARG  78          HH11      ARG  78  -5.670  -8.459   7.186
  629   HH22  ARG  78          HH12      ARG  78  -4.203  -7.860   7.885
  630    H    ARG  79           HN       ARG  79  -8.845 -11.575   0.298
  631    HA   ARG  79           HA       ARG  79 -10.064  -9.176  -0.409
  632    HB2  ARG  79           HB2      ARG  79 -12.090 -10.498  -0.922
  633    HB3  ARG  79           HB1      ARG  79 -10.629 -11.321  -1.462
  634    HG2  ARG  79           HG2      ARG  79 -10.656 -12.611   0.711
  635    HG3  ARG  79           HG1      ARG  79 -12.234 -11.907   1.044
  636    HD2  ARG  79           HD2      ARG  79 -12.800 -12.839  -1.398
  637    HD3  ARG  79           HD1      ARG  79 -11.481 -13.950  -1.039
  638    HE   ARG  79           HE       ARG  79 -14.141 -14.137  -0.045
  639   HH11  ARG  79          HH21      ARG  79 -10.888 -14.296   1.107
  640   HH12  ARG  79          HH22      ARG  79 -11.323 -15.067   2.592
  641   HH21  ARG  79          HH11      ARG  79 -14.705 -15.161   1.869
  642   HH22  ARG  79          HH12      ARG  79 -13.476 -15.565   3.019
  643    H    ASP  80           HN       ASP  80 -10.473 -10.946   2.604
  644    HA   ASP  80           HA       ASP  80 -12.877  -9.751   3.527
  645    HB2  ASP  80           HB2      ASP  80 -11.630 -11.618   4.673
  646    HB3  ASP  80           HB1      ASP  80 -10.447 -10.429   5.218
  647    H    LEU  81           HN       LEU  81  -9.589  -8.509   3.383
  648    HA   LEU  81           HA       LEU  81 -10.051  -6.208   5.059
  649    HB2  LEU  81           HB2      LEU  81  -7.783  -6.973   4.689
  650    HB3  LEU  81           HB1      LEU  81  -7.938  -6.789   2.949
  651    HG   LEU  81           HG       LEU  81  -8.121  -4.350   3.192
  652   HD11  LEU  81          HD11      LEU  81  -7.607  -3.419   5.556
  653   HD12  LEU  81          HD12      LEU  81  -8.082  -5.008   6.151
  654   HD13  LEU  81          HD13      LEU  81  -9.237  -4.010   5.268
  655   HD21  LEU  81          HD21      LEU  81  -5.839  -3.923   3.956
  656   HD22  LEU  81          HD22      LEU  81  -5.884  -5.436   3.053
  657   HD23  LEU  81          HD23      LEU  81  -5.812  -5.464   4.814
  658    H    TYR  82           HN       TYR  82 -10.716  -6.914   1.671
  659    HA   TYR  82           HA       TYR  82 -10.997  -4.140   0.869
  660    HB2  TYR  82           HB2      TYR  82 -10.632  -5.633  -0.938
  661    HB3  TYR  82           HB1      TYR  82 -11.793  -6.799  -0.326
  662    HD1  TYR  82           HD1      TYR  82 -12.155  -3.090  -0.878
  663    HD2  TYR  82           HD2      TYR  82 -13.434  -7.032  -2.040
  664    HE1  TYR  82           HE1      TYR  82 -13.895  -2.102  -2.326
  665    HE2  TYR  82           HE2      TYR  82 -15.174  -6.031  -3.488
  666    HH   TYR  82           HH       TYR  82 -15.307  -2.587  -4.098
  667    H    GLU  83           HN       GLU  83 -13.148  -6.588   2.241
  668    HA   GLU  83           HA       GLU  83 -15.598  -5.153   1.812
  669    HB2  GLU  83           HB2      GLU  83 -14.851  -7.175   3.950
  670    HB3  GLU  83           HB1      GLU  83 -16.490  -6.607   3.643
  671    HG2  GLU  83           HG2      GLU  83 -14.748  -7.919   1.531
  672    HG3  GLU  83           HG1      GLU  83 -15.914  -8.799   2.518
  673    H    LYS  84           HN       LYS  84 -13.316  -5.221   4.562
  674    HA   LYS  84           HA       LYS  84 -14.874  -3.284   6.095
  675    HB2  LYS  84           HB2      LYS  84 -11.998  -4.187   6.416
  676    HB3  LYS  84           HB1      LYS  84 -12.923  -3.251   7.590
  677    HG2  LYS  84           HG2      LYS  84 -14.462  -5.065   7.957
  678    HG3  LYS  84           HG1      LYS  84 -13.823  -5.968   6.587
  679    HD2  LYS  84           HD2      LYS  84 -12.992  -6.861   8.744
  680    HD3  LYS  84           HD1      LYS  84 -11.680  -6.264   7.730
  681    HE2  LYS  84           HE2      LYS  84 -11.652  -5.589  10.236
  682    HE3  LYS  84           HE1      LYS  84 -11.391  -4.309   9.054
  683    HZ1  LYS  84           HZ1      LYS  84 -13.021  -3.748  10.810
  684    HZ2  LYS  84           HZ2      LYS  84 -14.037  -4.978  10.224
  685    HZ3  LYS  84           HZ3      LYS  84 -13.660  -3.644   9.242
  686    H    ALA  85           HN       ALA  85 -12.065  -3.144   3.937
  687    HA   ALA  85           HA       ALA  85 -11.219  -0.510   4.482
  688    HB1  ALA  85           HB1      ALA  85 -11.195  -1.945   1.812
  689    HB2  ALA  85           HB2      ALA  85  -9.951  -2.061   3.054
  690    HB3  ALA  85           HB3      ALA  85 -10.230  -0.530   2.226
  691    H    LYS  86           HN       LYS  86 -13.662  -1.557   2.051
  692    HA   LYS  86           HA       LYS  86 -14.185   1.100   1.125
  693    HB2  LYS  86           HB2      LYS  86 -16.360   0.147   0.288
  694    HB3  LYS  86           HB1      LYS  86 -14.957  -0.812  -0.195
  695    HG2  LYS  86           HG2      LYS  86 -15.371  -2.293   1.780
  696    HG3  LYS  86           HG1      LYS  86 -16.852  -1.398   2.100
  697    HD2  LYS  86           HD2      LYS  86 -16.214  -2.891  -0.466
  698    HD3  LYS  86           HD1      LYS  86 -17.286  -3.471   0.807
  699    HE2  LYS  86           HE2      LYS  86 -18.822  -2.511  -0.689
  700    HE3  LYS  86           HE1      LYS  86 -18.529  -1.152   0.395
  701    HZ1  LYS  86           HZ1      LYS  86 -17.863  -1.466  -2.375
  702    HZ2  LYS  86           HZ2      LYS  86 -16.532  -0.966  -1.444
  703    HZ3  LYS  86           HZ3      LYS  86 -17.967  -0.054  -1.442
  704    H    ARG  87           HN       ARG  87 -15.306  -0.687   3.929
  705    HA   ARG  87           HA       ARG  87 -17.513   1.113   4.523
  706    HB2  ARG  87           HB2      ARG  87 -17.254  -1.282   5.369
  707    HB3  ARG  87           HB1      ARG  87 -16.026  -0.675   6.473
  708    HG2  ARG  87           HG2      ARG  87 -17.932  -0.553   7.839
  709    HG3  ARG  87           HG1      ARG  87 -17.915   1.072   7.166
  710    HD2  ARG  87           HD2      ARG  87 -20.173   0.089   7.062
  711    HD3  ARG  87           HD1      ARG  87 -19.551   0.369   5.439
  712    HE   ARG  87           HE       ARG  87 -18.812  -2.250   6.003
  713   HH11  ARG  87          HH21      ARG  87 -21.734  -0.408   6.011
  714   HH12  ARG  87          HH22      ARG  87 -22.741  -1.761   5.618
  715   HH21  ARG  87          HH11      ARG  87 -20.114  -4.021   5.492
  716   HH22  ARG  87          HH12      ARG  87 -21.824  -3.804   5.324
  717    H    ASP  88           HN       ASP  88 -14.076   1.036   5.277
  718    HA   ASP  88           HA       ASP  88 -14.347   3.377   7.125
  719    HB2  ASP  88           HB2      ASP  88 -12.914   1.380   7.758
  720    HB3  ASP  88           HB1      ASP  88 -11.858   1.783   6.403
  721    H    GLU  89           HN       GLU  89 -13.892   2.784   3.846
  722    HA   GLU  89           HA       GLU  89 -11.820   4.530   3.087
  723    HB2  GLU  89           HB2      GLU  89 -12.890   3.087   1.474
  724    HB3  GLU  89           HB1      GLU  89 -14.438   3.890   1.711
  725    HG2  GLU  89           HG2      GLU  89 -13.266   4.596  -0.388
  726    HG3  GLU  89           HG1      GLU  89 -13.579   5.942   0.699
  727    HA   PRO  90           HA       PRO  90 -13.925   8.262   4.712
  728    HB2  PRO  90           HB2      PRO  90 -11.882  10.031   3.643
  729    HB3  PRO  90           HB1      PRO  90 -12.102   9.541   5.330
  730    HG2  PRO  90           HG2      PRO  90 -10.016   8.674   3.495
  731    HG3  PRO  90           HG1      PRO  90 -10.222   8.217   5.192
  732    HD2  PRO  90           HD2      PRO  90 -10.727   6.577   2.845
  733    HD3  PRO  90           HD1      PRO  90 -10.928   6.120   4.553
  734    H    LYS  91           HN       LYS  91 -14.952  10.159   3.643
  735    HA   LYS  91           HA       LYS  91 -14.825  10.268   0.677
  736    HB2  LYS  91           HB2      LYS  91 -17.389   9.699   2.204
  737    HB3  LYS  91           HB1      LYS  91 -17.281  10.032   0.475
  738    HG2  LYS  91           HG2      LYS  91 -15.686   8.024   0.329
  739    HG3  LYS  91           HG1      LYS  91 -16.184   7.636   1.976
  740    HD2  LYS  91           HD2      LYS  91 -17.998   7.848  -0.450
  741    HD3  LYS  91           HD1      LYS  91 -17.543   6.367   0.389
  742    HE2  LYS  91           HE2      LYS  91 -18.591   7.448   2.497
  743    HE3  LYS  91           HE1      LYS  91 -19.327   8.600   1.380
  744    HZ1  LYS  91           HZ1      LYS  91 -19.849   5.755   1.732
  745    HZ2  LYS  91           HZ2      LYS  91 -19.925   6.357   0.145
  746    HZ3  LYS  91           HZ3      LYS  91 -20.918   7.017   1.356
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1  -9.839  17.728   7.778
    2    H2   MET   1           HT2      MET   1 -11.130  18.094   8.821
    3    H3   MET   1           HT3      MET   1 -10.664  16.479   8.574
    4    HA   MET   1           HA       MET   1  -8.624  18.303   9.580
    5    HB2  MET   1           HB2      MET   1  -9.452  17.981  11.905
    6    HB3  MET   1           HB1      MET   1 -10.562  18.943  10.932
    7    HG2  MET   1           HG2      MET   1 -11.870  16.843  10.468
    8    HG3  MET   1           HG1      MET   1 -10.825  15.999  11.611
    9    HE1  MET   1           HE1      MET   1 -13.315  15.405  12.521
   10    HE2  MET   1           HE2      MET   1 -14.116  16.609  11.513
   11    HE3  MET   1           HE3      MET   1 -14.402  16.594  13.251
   12    H    ALA   2           HN       ALA   2 -10.313  15.210   9.453
   13    HA   ALA   2           HA       ALA   2  -8.373  13.712  10.959
   14    HB1  ALA   2           HB1      ALA   2 -10.593  12.796  10.556
   15    HB2  ALA   2           HB2      ALA   2  -9.399  11.732   9.812
   16    HB3  ALA   2           HB3      ALA   2 -10.333  12.845   8.813
   17    H    SER   3           HN       SER   3  -6.273  13.493  10.351
   18    HA   SER   3           HA       SER   3  -5.366  13.990   7.647
   19    HB2  SER   3           HB2      SER   3  -4.002  14.279   9.805
   20    HB3  SER   3           HB1      SER   3  -3.829  12.526   9.827
   21    HG   SER   3           HG       SER   3  -3.016  12.787   7.614
   22    H    THR   4           HN       THR   4  -5.151  12.563   5.986
   23    HA   THR   4           HA       THR   4  -6.108   9.794   6.354
   24    HB   THR   4           HB       THR   4  -5.004  11.069   3.825
   25    HG1  THR   4           HG1      THR   4  -6.718  12.298   4.680
   26   HG21  THR   4          HG21      THR   4  -5.252   8.620   3.780
   27   HG22  THR   4          HG22      THR   4  -6.431   9.393   2.722
   28   HG23  THR   4          HG23      THR   4  -6.931   8.775   4.296
   29    H    ARG   5           HN       ARG   5  -3.072  11.468   6.128
   30    HA   ARG   5           HA       ARG   5  -1.466   9.234   5.248
   31    HB2  ARG   5           HB2      ARG   5  -0.682  11.666   6.886
   32    HB3  ARG   5           HB1      ARG   5   0.437  10.572   6.071
   33    HG2  ARG   5           HG2      ARG   5  -0.585  11.142   3.897
   34    HG3  ARG   5           HG1      ARG   5  -1.698  12.242   4.711
   35    HD2  ARG   5           HD2      ARG   5   1.325  12.475   4.768
   36    HD3  ARG   5           HD1      ARG   5   0.256  13.441   3.751
   37    HE   ARG   5           HE       ARG   5  -0.727  13.835   6.318
   38   HH11  ARG   5          HH21      ARG   5   2.329  14.135   4.736
   39   HH12  ARG   5          HH22      ARG   5   2.874  15.428   5.751
   40   HH21  ARG   5          HH11      ARG   5  -0.027  15.518   7.648
   41   HH22  ARG   5          HH12      ARG   5   1.540  16.210   7.399
   42    H    CYS   6           HN       CYS   6  -2.321  10.517   8.459
   43    HA   CYS   6           HA       CYS   6  -0.731   8.579   9.906
   44    HB2  CYS   6           HB2      CYS   6  -3.074  10.300  10.769
   45    HB3  CYS   6           HB1      CYS   6  -2.085   9.339  11.869
   46    HG   CYS   6           HG       CYS   6  -1.335  12.045  10.938
   47    H    LYS   7           HN       LYS   7  -4.160   8.736   8.947
   48    HA   LYS   7           HA       LYS   7  -4.871   6.286  10.334
   49    HB2  LYS   7           HB2      LYS   7  -6.250   7.847   8.127
   50    HB3  LYS   7           HB1      LYS   7  -6.958   6.440   8.923
   51    HG2  LYS   7           HG2      LYS   7  -6.725   7.599  11.117
   52    HG3  LYS   7           HG1      LYS   7  -6.112   9.023  10.275
   53    HD2  LYS   7           HD2      LYS   7  -8.199   9.284   9.069
   54    HD3  LYS   7           HD1      LYS   7  -8.813   7.762   9.718
   55    HE2  LYS   7           HE2      LYS   7  -9.756   9.655  10.977
   56    HE3  LYS   7           HE1      LYS   7  -8.685   8.710  12.013
   57    HZ1  LYS   7           HZ1      LYS   7  -8.475  11.288  11.898
   58    HZ2  LYS   7           HZ2      LYS   7  -7.573  10.963  10.496
   59    HZ3  LYS   7           HZ3      LYS   7  -7.085  10.320  11.991
   60    H    LEU   8           HN       LEU   8  -4.267   7.043   6.870
   61    HA   LEU   8           HA       LEU   8  -4.622   4.353   5.946
   62    HB2  LEU   8           HB2      LEU   8  -4.395   6.512   4.549
   63    HB3  LEU   8           HB1      LEU   8  -2.657   6.338   4.756
   64    HG   LEU   8           HG       LEU   8  -3.123   3.841   3.881
   65   HD11  LEU   8          HD11      LEU   8  -4.908   3.824   2.155
   66   HD12  LEU   8          HD12      LEU   8  -5.421   5.426   2.679
   67   HD13  LEU   8          HD13      LEU   8  -5.574   4.052   3.770
   68   HD21  LEU   8          HD21      LEU   8  -3.117   6.256   2.038
   69   HD22  LEU   8          HD22      LEU   8  -2.690   4.611   1.569
   70   HD23  LEU   8          HD23      LEU   8  -1.689   5.484   2.728
   71    H    ALA   9           HN       ALA   9  -1.851   5.979   7.398
   72    HA   ALA   9           HA       ALA   9   0.087   3.948   6.786
   73    HB1  ALA   9           HB1      ALA   9   0.728   6.220   7.515
   74    HB2  ALA   9           HB2      ALA   9   1.431   4.993   8.568
   75    HB3  ALA   9           HB3      ALA   9   0.020   5.906   9.100
   76    H    ARG  10           HN       ARG  10  -2.286   4.349   9.350
   77    HA   ARG  10           HA       ARG  10  -1.248   2.319  11.095
   78    HB2  ARG  10           HB2      ARG  10  -4.015   3.500  10.758
   79    HB3  ARG  10           HB1      ARG  10  -3.654   2.299  11.992
   80    HG2  ARG  10           HG2      ARG  10  -1.755   4.619  11.931
   81    HG3  ARG  10           HG1      ARG  10  -3.405   5.038  12.374
   82    HD2  ARG  10           HD2      ARG  10  -2.014   4.491  14.360
   83    HD3  ARG  10           HD1      ARG  10  -3.378   3.386  14.186
   84    HE   ARG  10           HE       ARG  10  -1.331   2.077  12.871
   85   HH11  ARG  10          HH21      ARG  10  -1.745   3.523  15.976
   86   HH12  ARG  10          HH22      ARG  10  -0.672   2.423  16.775
   87   HH21  ARG  10          HH11      ARG  10   0.070   0.637  13.897
   88   HH22  ARG  10          HH12      ARG  10   0.355   0.791  15.599
   89    H    TYR  11           HN       TYR  11  -3.371   2.232   8.289
   90    HA   TYR  11           HA       TYR  11  -4.290  -0.477   8.664
   91    HB2  TYR  11           HB2      TYR  11  -4.185   1.441   6.330
   92    HB3  TYR  11           HB1      TYR  11  -4.568  -0.249   6.012
   93    HD1  TYR  11           HD1      TYR  11  -6.567  -1.300   7.021
   94    HD2  TYR  11           HD2      TYR  11  -5.774   2.894   7.467
   95    HE1  TYR  11           HE1      TYR  11  -8.919  -0.938   7.724
   96    HE2  TYR  11           HE2      TYR  11  -8.125   3.264   8.170
   97    HH   TYR  11           HH       TYR  11 -10.052   1.167   9.314
   98    H    LEU  12           HN       LEU  12  -1.704   0.874   6.584
   99    HA   LEU  12           HA       LEU  12  -0.756  -1.651   5.684
  100    HB2  LEU  12           HB2      LEU  12  -0.126   0.496   4.626
  101    HB3  LEU  12           HB1      LEU  12   0.729   0.973   6.084
  102    HG   LEU  12           HG       LEU  12   2.223  -1.172   5.680
  103   HD11  LEU  12          HD11      LEU  12   2.388  -1.718   3.208
  104   HD12  LEU  12          HD12      LEU  12   0.866  -0.864   2.972
  105   HD13  LEU  12          HD13      LEU  12   0.922  -2.310   3.978
  106   HD21  LEU  12          HD21      LEU  12   2.304   1.190   3.769
  107   HD22  LEU  12          HD22      LEU  12   3.644   0.090   4.087
  108   HD23  LEU  12          HD23      LEU  12   3.032   1.129   5.374
  109    H    GLU  13           HN       GLU  13  -0.202   0.159   8.628
  110    HA   GLU  13           HA       GLU  13   2.002  -1.592   9.532
  111    HB2  GLU  13           HB2      GLU  13   0.468   0.677  10.843
  112    HB3  GLU  13           HB1      GLU  13   1.630  -0.296  11.739
  113    HG2  GLU  13           HG2      GLU  13   3.390   0.296  10.109
  114    HG3  GLU  13           HG1      GLU  13   2.237   1.293   9.223
  115    H    ASP  14           HN       ASP  14  -1.478  -1.378   9.887
  116    HA   ASP  14           HA       ASP  14  -1.761  -3.021  12.209
  117    HB2  ASP  14           HB2      ASP  14  -3.622  -1.699  11.247
  118    HB3  ASP  14           HB1      ASP  14  -3.650  -2.765   9.843
  119    H    LEU  15           HN       LEU  15  -0.259  -3.869   9.384
  120    HA   LEU  15           HA       LEU  15  -1.349  -6.636   9.224
  121    HB2  LEU  15           HB2      LEU  15   1.067  -5.498   7.785
  122    HB3  LEU  15           HB1      LEU  15   0.162  -6.952   7.375
  123    HG   LEU  15           HG       LEU  15  -0.800  -4.078   7.185
  124   HD11  LEU  15          HD11      LEU  15  -1.031  -4.693   4.770
  125   HD12  LEU  15          HD12      LEU  15  -0.314  -6.260   5.130
  126   HD13  LEU  15          HD13      LEU  15   0.635  -4.790   5.341
  127   HD21  LEU  15          HD21      LEU  15  -2.313  -6.699   6.915
  128   HD22  LEU  15          HD22      LEU  15  -2.873  -5.219   6.139
  129   HD23  LEU  15          HD23      LEU  15  -2.741  -5.292   7.889
  130    H    GLU  16           HN       GLU  16   0.147  -8.489   9.395
  131    HA   GLU  16           HA       GLU  16   1.607  -8.412  11.886
  132    HB2  GLU  16           HB2      GLU  16   1.462 -10.503   9.691
  133    HB3  GLU  16           HB1      GLU  16   2.277 -10.755  11.233
  134    HG2  GLU  16           HG2      GLU  16   0.053 -11.677  11.432
  135    HG3  GLU  16           HG1      GLU  16   0.097 -10.196  12.387
  136    H    ASP  17           HN       ASP  17   3.920  -8.816  12.135
  137    HA   ASP  17           HA       ASP  17   5.575  -7.149  10.555
  138    HB2  ASP  17           HB2      ASP  17   6.146  -7.939  12.843
  139    HB3  ASP  17           HB1      ASP  17   6.421  -9.556  12.195
  140    H    VAL  18           HN       VAL  18   5.035 -10.669  10.353
  141    HA   VAL  18           HA       VAL  18   6.966 -11.118   8.277
  142    HB   VAL  18           HB       VAL  18   5.813 -13.243   7.877
  143   HG11  VAL  18          HG11      VAL  18   5.798 -12.639  10.852
  144   HG12  VAL  18          HG12      VAL  18   7.270 -12.907   9.921
  145   HG13  VAL  18          HG13      VAL  18   6.079 -14.198  10.080
  146   HG21  VAL  18          HG21      VAL  18   3.489 -12.597   7.945
  147   HG22  VAL  18          HG22      VAL  18   3.635 -12.012   9.601
  148   HG23  VAL  18          HG23      VAL  18   3.733 -13.738   9.265
  149    H    ASP  19           HN       ASP  19   3.500 -10.277   8.175
  150    HA   ASP  19           HA       ASP  19   3.314 -10.471   5.289
  151    HB2  ASP  19           HB2      ASP  19   1.333 -10.580   6.797
  152    HB3  ASP  19           HB1      ASP  19   1.585  -8.885   7.216
  153    H    LEU  20           HN       LEU  20   4.289  -7.966   7.544
  154    HA   LEU  20           HA       LEU  20   4.071  -5.722   5.799
  155    HB2  LEU  20           HB2      LEU  20   4.440  -5.446   8.197
  156    HB3  LEU  20           HB1      LEU  20   5.981  -6.286   8.090
  157    HG   LEU  20           HG       LEU  20   6.917  -4.473   6.728
  158   HD11  LEU  20          HD11      LEU  20   5.114  -3.640   5.432
  159   HD12  LEU  20          HD12      LEU  20   5.452  -2.330   6.554
  160   HD13  LEU  20          HD13      LEU  20   4.084  -3.405   6.845
  161   HD21  LEU  20          HD21      LEU  20   5.468  -3.495   9.206
  162   HD22  LEU  20          HD22      LEU  20   6.831  -2.677   8.442
  163   HD23  LEU  20          HD23      LEU  20   7.051  -4.270   9.165
  164    H    LYS  21           HN       LYS  21   6.624  -8.131   6.274
  165    HA   LYS  21           HA       LYS  21   8.551  -6.851   4.544
  166    HB2  LYS  21           HB2      LYS  21   8.298  -9.752   5.397
  167    HB3  LYS  21           HB1      LYS  21   9.715  -9.033   4.630
  168    HG2  LYS  21           HG2      LYS  21   9.973  -7.477   6.509
  169    HG3  LYS  21           HG1      LYS  21   8.522  -8.134   7.269
  170    HD2  LYS  21           HD2      LYS  21   9.619 -10.367   7.365
  171    HD3  LYS  21           HD1      LYS  21  11.085  -9.651   6.694
  172    HE2  LYS  21           HE2      LYS  21  11.220  -8.113   8.618
  173    HE3  LYS  21           HE1      LYS  21   9.754  -8.824   9.291
  174    HZ1  LYS  21           HZ1      LYS  21  12.210 -10.374   8.686
  175    HZ2  LYS  21           HZ2      LYS  21  10.837 -10.909   9.534
  176    HZ3  LYS  21           HZ3      LYS  21  11.856  -9.732  10.216
  177    H    LYS  22           HN       LYS  22   6.101  -9.389   4.029
  178    HA   LYS  22           HA       LYS  22   6.886  -9.981   1.329
  179    HB2  LYS  22           HB2      LYS  22   4.495 -10.509   3.059
  180    HB3  LYS  22           HB1      LYS  22   4.207 -10.603   1.326
  181    HG2  LYS  22           HG2      LYS  22   4.804 -12.810   2.174
  182    HG3  LYS  22           HG1      LYS  22   6.101 -12.223   1.135
  183    HD2  LYS  22           HD2      LYS  22   7.383 -11.512   3.114
  184    HD3  LYS  22           HD1      LYS  22   6.072 -12.052   4.164
  185    HE2  LYS  22           HE2      LYS  22   7.845 -13.757   4.042
  186    HE3  LYS  22           HE1      LYS  22   6.351 -14.358   3.322
  187    HZ1  LYS  22           HZ1      LYS  22   7.389 -14.634   1.403
  188    HZ2  LYS  22           HZ2      LYS  22   8.851 -14.166   2.131
  189    HZ3  LYS  22           HZ3      LYS  22   7.869 -13.008   1.369
  190    H    PHE  23           HN       PHE  23   4.785  -7.475   2.701
  191    HA   PHE  23           HA       PHE  23   3.648  -6.635   0.186
  192    HB2  PHE  23           HB2      PHE  23   2.756  -5.963   2.424
  193    HB3  PHE  23           HB1      PHE  23   4.174  -4.943   2.648
  194    HD1  PHE  23           HD1      PHE  23   4.615  -3.034   1.075
  195    HD2  PHE  23           HD2      PHE  23   0.925  -5.241   1.018
  196    HE1  PHE  23           HE1      PHE  23   3.540  -1.212  -0.216
  197    HE2  PHE  23           HE2      PHE  23  -0.144  -3.416  -0.273
  198    HZ   PHE  23           HZ       PHE  23   1.163  -1.402  -0.890
  199    H    LYS  24           HN       LYS  24   6.620  -5.666   1.919
  200    HA   LYS  24           HA       LYS  24   7.301  -3.547   0.095
  201    HB2  LYS  24           HB2      LYS  24   9.068  -5.245   1.885
  202    HB3  LYS  24           HB1      LYS  24   9.577  -3.763   1.076
  203    HG2  LYS  24           HG2      LYS  24   7.846  -2.494   2.280
  204    HG3  LYS  24           HG1      LYS  24   7.310  -3.973   3.079
  205    HD2  LYS  24           HD2      LYS  24   9.491  -4.224   4.154
  206    HD3  LYS  24           HD1      LYS  24  10.102  -2.808   3.297
  207    HE2  LYS  24           HE2      LYS  24   8.465  -1.382   4.429
  208    HE3  LYS  24           HE1      LYS  24   7.772  -2.786   5.240
  209    HZ1  LYS  24           HZ1      LYS  24   9.259  -2.486   6.834
  210    HZ2  LYS  24           HZ2      LYS  24  10.031  -1.246   5.967
  211    HZ3  LYS  24           HZ3      LYS  24  10.490  -2.864   5.731
  212    H    MET  25           HN       MET  25   8.173  -6.997   0.239
  213    HA   MET  25           HA       MET  25   9.971  -6.919  -2.000
  214    HB2  MET  25           HB2      MET  25   9.857  -8.772  -0.314
  215    HB3  MET  25           HB1      MET  25   8.324  -9.273  -1.027
  216    HG2  MET  25           HG2      MET  25   9.396  -9.688  -3.168
  217    HG3  MET  25           HG1      MET  25  10.926  -9.047  -2.570
  218    HE1  MET  25           HE1      MET  25  12.704 -10.381  -1.656
  219    HE2  MET  25           HE2      MET  25  12.491 -11.664  -0.467
  220    HE3  MET  25           HE3      MET  25  11.881 -10.048  -0.125
  221    H    HIS  26           HN       HIS  26   6.470  -7.423  -1.734
  222    HA   HIS  26           HA       HIS  26   6.111  -8.207  -4.512
  223    HB2  HIS  26           HB2      HIS  26   4.244  -7.128  -2.366
  224    HB3  HIS  26           HB1      HIS  26   3.665  -7.445  -4.001
  225    HD1  HIS  26           HD1      HIS  26   3.952  -9.064  -0.832
  226    HD2  HIS  26           HD2      HIS  26   4.472 -10.312  -4.775
  227    HE1  HIS  26           HE1      HIS  26   3.783 -11.593  -0.814
  228    H    LEU  27           HN       LEU  27   6.037  -5.080  -2.801
  229    HA   LEU  27           HA       LEU  27   5.212  -3.588  -5.174
  230    HB2  LEU  27           HB2      LEU  27   4.921  -2.845  -2.745
  231    HB3  LEU  27           HB1      LEU  27   6.651  -2.522  -2.721
  232    HG   LEU  27           HG       LEU  27   6.157  -1.068  -4.878
  233   HD11  LEU  27          HD11      LEU  27   3.823  -1.701  -5.230
  234   HD12  LEU  27          HD12      LEU  27   3.884  -0.005  -4.769
  235   HD13  LEU  27          HD13      LEU  27   3.408  -1.220  -3.586
  236   HD21  LEU  27          HD21      LEU  27   5.648   0.897  -3.439
  237   HD22  LEU  27          HD22      LEU  27   6.916  -0.116  -2.749
  238   HD23  LEU  27          HD23      LEU  27   5.276  -0.196  -2.105
  239    H    GLU  28           HN       GLU  28   8.280  -4.541  -3.734
  240    HA   GLU  28           HA       GLU  28   9.932  -2.793  -5.326
  241    HB2  GLU  28           HB2      GLU  28  10.669  -3.932  -3.214
  242    HB3  GLU  28           HB1      GLU  28  10.685  -5.461  -4.091
  243    HG2  GLU  28           HG2      GLU  28  12.361  -4.605  -5.641
  244    HG3  GLU  28           HG1      GLU  28  12.290  -3.014  -4.882
  245    H    ASP  29           HN       ASP  29   8.645  -6.062  -5.824
  246    HA   ASP  29           HA       ASP  29  10.056  -6.258  -8.460
  247    HB2  ASP  29           HB2      ASP  29   9.204  -8.615  -8.409
  248    HB3  ASP  29           HB1      ASP  29  10.256  -8.223  -7.050
  249    H    TYR  30           HN       TYR  30   8.131  -4.315  -8.552
  250    HA   TYR  30           HA       TYR  30   5.515  -5.281  -9.223
  251    HB2  TYR  30           HB2      TYR  30   5.991  -2.943  -8.562
  252    HB3  TYR  30           HB1      TYR  30   6.861  -2.712 -10.078
  253    HD1  TYR  30           HD2      TYR  30   3.539  -3.372  -8.565
  254    HD2  TYR  30           HD1      TYR  30   5.673  -2.460 -12.181
  255    HE1  TYR  30           HE2      TYR  30   1.394  -2.881  -9.709
  256    HE2  TYR  30           HE1      TYR  30   3.528  -1.969 -13.323
  257    HH   TYR  30           HH       TYR  30   0.471  -2.740 -11.900
  258    HA   PRO  31           HA       PRO  31   6.989  -6.845 -13.232
  259    HB2  PRO  31           HB2      PRO  31   4.335  -7.333 -14.258
  260    HB3  PRO  31           HB1      PRO  31   5.466  -8.522 -13.601
  261    HG2  PRO  31           HG2      PRO  31   3.044  -7.463 -12.346
  262    HG3  PRO  31           HG1      PRO  31   4.103  -8.758 -11.763
  263    HD2  PRO  31           HD2      PRO  31   3.902  -6.072 -10.719
  264    HD3  PRO  31           HD1      PRO  31   5.029  -7.347 -10.199
  265    HA   PRO  32           HA       PRO  32   6.186  -2.773 -15.143
  266    HB2  PRO  32           HB2      PRO  32   7.679  -3.317 -17.535
  267    HB3  PRO  32           HB1      PRO  32   8.258  -2.453 -16.103
  268    HG2  PRO  32           HG2      PRO  32   8.940  -5.178 -16.984
  269    HG3  PRO  32           HG1      PRO  32   9.704  -4.207 -15.716
  270    HD2  PRO  32           HD2      PRO  32   7.948  -6.450 -15.332
  271    HD3  PRO  32           HD1      PRO  32   8.573  -5.359 -14.072
  272    H    GLN  33           HN       GLN  33   4.596  -2.113 -16.616
  273    HA   GLN  33           HA       GLN  33   3.131  -4.278 -18.066
  274    HB2  GLN  33           HB2      GLN  33   2.314  -1.397 -17.574
  275    HB3  GLN  33           HB1      GLN  33   1.290  -2.703 -18.168
  276    HG2  GLN  33           HG2      GLN  33   1.604  -3.924 -16.050
  277    HG3  GLN  33           HG1      GLN  33   2.632  -2.622 -15.451
  278   HE21  GLN  33          HE21      GLN  33   1.226  -0.342 -16.257
  279   HE22  GLN  33          HE22      GLN  33  -0.300  -0.311 -15.512
  280    H    LYS  34           HN       LYS  34   4.514  -1.026 -18.657
  281    HA   LYS  34           HA       LYS  34   5.266  -1.754 -21.360
  282    HB2  LYS  34           HB2      LYS  34   3.771  -0.028 -22.438
  283    HB3  LYS  34           HB1      LYS  34   2.924  -1.435 -21.805
  284    HG2  LYS  34           HG2      LYS  34   2.307  -0.206 -19.784
  285    HG3  LYS  34           HG1      LYS  34   3.213   1.201 -20.337
  286    HD2  LYS  34           HD2      LYS  34   1.742   1.296 -22.359
  287    HD3  LYS  34           HD1      LYS  34   0.785  -0.019 -21.677
  288    HE2  LYS  34           HE2      LYS  34  -0.296   2.080 -21.116
  289    HE3  LYS  34           HE1      LYS  34   0.394   1.401 -19.642
  290    HZ1  LYS  34           HZ1      LYS  34   1.774   3.113 -19.435
  291    HZ2  LYS  34           HZ2      LYS  34   0.843   3.903 -20.616
  292    HZ3  LYS  34           HZ3      LYS  34   2.246   3.054 -21.063
  293    H    GLY  35           HN       GLY  35   6.890  -0.826 -19.406
  294    HA2  GLY  35           HA2      GLY  35   8.718   0.775 -19.662
  295    HA3  GLY  35           HA1      GLY  35   7.584   1.950 -20.322
  296    H    CYS  36           HN       CYS  36   6.942  -0.021 -17.466
  297    HA   CYS  36           HA       CYS  36   6.241   2.293 -15.892
  298    HB2  CYS  36           HB2      CYS  36   5.323  -0.014 -15.520
  299    HB3  CYS  36           HB1      CYS  36   6.907  -0.499 -14.911
  300    HG   CYS  36           HG       CYS  36   5.406   0.287 -12.881
  301    H    ILE  37           HN       ILE  37   7.397   3.169 -14.087
  302    HA   ILE  37           HA       ILE  37  10.311   3.188 -14.417
  303    HB   ILE  37           HB       ILE  37   8.571   4.563 -12.347
  304   HG12  ILE  37          HG12      ILE  37   9.679   5.690 -14.943
  305   HG13  ILE  37          HG11      ILE  37   8.024   5.110 -14.764
  306   HG21  ILE  37          HG21      ILE  37  10.482   6.102 -12.115
  307   HG22  ILE  37          HG22      ILE  37  11.396   5.164 -13.290
  308   HG23  ILE  37          HG23      ILE  37  10.971   4.456 -11.733
  309   HD11  ILE  37          HD11      ILE  37   7.635   6.744 -12.946
  310   HD12  ILE  37          HD12      ILE  37   8.129   7.561 -14.430
  311   HD13  ILE  37          HD13      ILE  37   9.288   7.334 -13.120
  312    HA   PRO  38           HA       PRO  38  10.307  -0.098 -11.208
  313    HB2  PRO  38           HB2      PRO  38  13.113  -0.537 -11.239
  314    HB3  PRO  38           HB1      PRO  38  11.919  -1.429 -12.193
  315    HG2  PRO  38           HG2      PRO  38  13.853   0.612 -13.113
  316    HG3  PRO  38           HG1      PRO  38  12.918  -0.542 -14.077
  317    HD2  PRO  38           HD2      PRO  38  12.400   2.270 -13.797
  318    HD3  PRO  38           HD1      PRO  38  11.368   1.076 -14.606
  319    H    LEU  39           HN       LEU  39  10.540   0.175  -8.997
  320    HA   LEU  39           HA       LEU  39  11.718   2.692  -8.025
  321    HB2  LEU  39           HB2      LEU  39  10.041   0.487  -6.840
  322    HB3  LEU  39           HB1      LEU  39  10.812   1.652  -5.770
  323    HG   LEU  39           HG       LEU  39   9.148   2.634  -8.115
  324   HD11  LEU  39          HD11      LEU  39   7.183   2.722  -6.599
  325   HD12  LEU  39          HD12      LEU  39   8.094   1.815  -5.391
  326   HD13  LEU  39          HD13      LEU  39   7.688   1.066  -6.935
  327   HD21  LEU  39          HD21      LEU  39  10.465   4.308  -6.877
  328   HD22  LEU  39          HD22      LEU  39   9.771   3.755  -5.355
  329   HD23  LEU  39          HD23      LEU  39   8.749   4.542  -6.555
  330    HA   PRO  40           HA       PRO  40  15.524   0.270  -7.282
  331    HB2  PRO  40           HB2      PRO  40  16.533   2.391  -5.503
  332    HB3  PRO  40           HB1      PRO  40  17.158   1.898  -7.084
  333    HG2  PRO  40           HG2      PRO  40  15.702   4.297  -6.508
  334    HG3  PRO  40           HG1      PRO  40  16.149   3.696  -8.112
  335    HD2  PRO  40           HD2      PRO  40  13.483   3.741  -6.890
  336    HD3  PRO  40           HD1      PRO  40  13.923   3.266  -8.547
  337    H    ARG  41           HN       ARG  41  16.113  -1.102  -5.566
  338    HA   ARG  41           HA       ARG  41  14.206  -1.469  -3.448
  339    HB2  ARG  41           HB2      ARG  41  15.892  -3.102  -2.547
  340    HB3  ARG  41           HB1      ARG  41  15.572  -3.346  -4.266
  341    HG2  ARG  41           HG2      ARG  41  17.592  -1.973  -4.795
  342    HG3  ARG  41           HG1      ARG  41  17.944  -1.881  -3.075
  343    HD2  ARG  41           HD2      ARG  41  17.847  -4.360  -4.796
  344    HD3  ARG  41           HD1      ARG  41  19.259  -3.693  -3.989
  345    HE   ARG  41           HE       ARG  41  17.313  -5.516  -2.878
  346   HH11  ARG  41          HH21      ARG  41  19.177  -2.729  -2.040
  347   HH12  ARG  41          HH22      ARG  41  18.968  -2.955  -0.336
  348   HH21  ARG  41          HH11      ARG  41  17.055  -5.817  -0.675
  349   HH22  ARG  41          HH12      ARG  41  17.775  -4.698   0.434
  350    H    GLY  42           HN       GLY  42  17.303   0.220  -3.618
  351    HA2  GLY  42           HA2      GLY  42  17.727   0.610  -0.819
  352    HA3  GLY  42           HA1      GLY  42  18.300   1.730  -2.058
  353    H    GLN  43           HN       GLN  43  15.404   2.087  -2.983
  354    HA   GLN  43           HA       GLN  43  14.836   4.375  -1.280
  355    HB2  GLN  43           HB2      GLN  43  13.292   3.055  -3.541
  356    HB3  GLN  43           HB1      GLN  43  12.747   4.526  -2.735
  357    HG2  GLN  43           HG2      GLN  43  15.473   4.255  -4.045
  358    HG3  GLN  43           HG1      GLN  43  14.059   4.907  -4.869
  359   HE21  GLN  43          HE21      GLN  43  16.755   6.061  -3.558
  360   HE22  GLN  43          HE22      GLN  43  16.188   7.471  -2.805
  361    H    THR  44           HN       THR  44  13.075   1.299  -1.902
  362    HA   THR  44           HA       THR  44  11.053   1.775   0.064
  363    HB   THR  44           HB       THR  44  10.520  -0.576  -0.135
  364    HG1  THR  44           HG1      THR  44  12.120  -1.900  -0.259
  365   HG21  THR  44          HG21      THR  44  10.050   0.878  -2.107
  366   HG22  THR  44          HG22      THR  44  10.332  -0.806  -2.553
  367   HG23  THR  44          HG23      THR  44  11.602   0.395  -2.794
  368    H    GLU  45           HN       GLU  45  14.079  -0.131   0.293
  369    HA   GLU  45           HA       GLU  45  13.729  -0.836   3.049
  370    HB2  GLU  45           HB2      GLU  45  16.359  -0.441   1.562
  371    HB3  GLU  45           HB1      GLU  45  16.117  -1.396   3.022
  372    HG2  GLU  45           HG2      GLU  45  14.821  -1.959   0.330
  373    HG3  GLU  45           HG1      GLU  45  16.204  -2.824   0.997
  374    H    LYS  46           HN       LYS  46  15.335   1.997   1.516
  375    HA   LYS  46           HA       LYS  46  16.185   3.064   4.106
  376    HB2  LYS  46           HB2      LYS  46  17.366   3.530   1.928
  377    HB3  LYS  46           HB1      LYS  46  15.980   4.504   1.441
  378    HG2  LYS  46           HG2      LYS  46  16.311   6.018   3.310
  379    HG3  LYS  46           HG1      LYS  46  17.591   4.995   3.963
  380    HD2  LYS  46           HD2      LYS  46  18.908   5.378   1.879
  381    HD3  LYS  46           HD1      LYS  46  17.654   6.489   1.326
  382    HE2  LYS  46           HE2      LYS  46  19.497   7.727   2.392
  383    HE3  LYS  46           HE1      LYS  46  18.014   7.889   3.332
  384    HZ1  LYS  46           HZ1      LYS  46  18.976   6.922   5.060
  385    HZ2  LYS  46           HZ2      LYS  46  20.454   6.972   4.225
  386    HZ3  LYS  46           HZ3      LYS  46  19.469   5.591   4.132
  387    H    ALA  47           HN       ALA  47  13.276   3.102   2.260
  388    HA   ALA  47           HA       ALA  47  12.232   5.626   3.262
  389    HB1  ALA  47           HB1      ALA  47  11.305   4.745   1.218
  390    HB2  ALA  47           HB2      ALA  47  10.030   4.675   2.434
  391    HB3  ALA  47           HB3      ALA  47  10.909   3.211   1.992
  392    H    ASP  48           HN       ASP  48  11.281   5.994   5.215
  393    HA   ASP  48           HA       ASP  48  11.116   3.809   7.186
  394    HB2  ASP  48           HB2      ASP  48  10.214   6.705   7.396
  395    HB3  ASP  48           HB1      ASP  48  10.432   5.580   8.737
  396    H    HIS  49           HN       HIS  49   8.984   3.574   8.451
  397    HA   HIS  49           HA       HIS  49   6.910   2.689   6.782
  398    HB2  HIS  49           HB2      HIS  49   6.721   3.713   9.630
  399    HB3  HIS  49           HB1      HIS  49   5.459   2.796   8.809
  400    HD1  HIS  49           HD1      HIS  49   8.236   1.280   7.424
  401    HD2  HIS  49           HD2      HIS  49   6.696   1.197  11.297
  402    HE1  HIS  49           HE1      HIS  49   9.165  -0.806   8.519
  403    H    VAL  50           HN       VAL  50   7.298   5.905   8.288
  404    HA   VAL  50           HA       VAL  50   4.765   6.921   7.251
  405    HB   VAL  50           HB       VAL  50   7.270   8.417   8.150
  406   HG11  VAL  50          HG11      VAL  50   5.639  10.314   8.507
  407   HG12  VAL  50          HG12      VAL  50   4.428   9.368   7.645
  408   HG13  VAL  50          HG13      VAL  50   5.890   9.899   6.814
  409   HG21  VAL  50          HG21      VAL  50   4.729   7.662   9.643
  410   HG22  VAL  50          HG22      VAL  50   5.970   8.747  10.263
  411   HG23  VAL  50          HG23      VAL  50   6.354   7.055   9.962
  412    H    ASP  51           HN       ASP  51   8.175   7.305   6.221
  413    HA   ASP  51           HA       ASP  51   7.628   8.878   3.914
  414    HB2  ASP  51           HB2      ASP  51   9.906   8.534   4.865
  415    HB3  ASP  51           HB1      ASP  51   9.865   6.863   4.304
  416    H    LEU  52           HN       LEU  52   7.598   5.364   4.395
  417    HA   LEU  52           HA       LEU  52   7.453   4.573   1.687
  418    HB2  LEU  52           HB2      LEU  52   7.527   3.195   3.975
  419    HB3  LEU  52           HB1      LEU  52   5.785   3.124   3.749
  420    HG   LEU  52           HG       LEU  52   7.886   2.198   1.759
  421   HD11  LEU  52          HD11      LEU  52   5.879   0.621   3.397
  422   HD12  LEU  52          HD12      LEU  52   7.595   0.763   3.778
  423   HD13  LEU  52          HD13      LEU  52   7.085  -0.044   2.295
  424   HD21  LEU  52          HD21      LEU  52   5.814   1.220   0.606
  425   HD22  LEU  52          HD22      LEU  52   5.997   2.966   0.500
  426   HD23  LEU  52          HD23      LEU  52   4.852   2.270   1.648
  427    H    ALA  53           HN       ALA  53   4.749   5.297   3.941
  428    HA   ALA  53           HA       ALA  53   2.671   5.030   1.986
  429    HB1  ALA  53           HB1      ALA  53   2.760   6.793   4.457
  430    HB2  ALA  53           HB2      ALA  53   2.231   5.111   4.417
  431    HB3  ALA  53           HB3      ALA  53   1.304   6.348   3.565
  432    H    THR  54           HN       THR  54   4.891   7.648   2.728
  433    HA   THR  54           HA       THR  54   3.417   9.710   1.311
  434    HB   THR  54           HB       THR  54   6.380   9.547   1.967
  435    HG1  THR  54           HG1      THR  54   5.706  10.839   3.753
  436   HG21  THR  54          HG21      THR  54   4.578  11.852   1.173
  437   HG22  THR  54          HG22      THR  54   5.994  11.258   0.305
  438   HG23  THR  54          HG23      THR  54   6.186  12.059   1.864
  439    H    LEU  55           HN       LEU  55   5.874   7.324   0.355
  440    HA   LEU  55           HA       LEU  55   6.352   8.515  -2.254
  441    HB2  LEU  55           HB2      LEU  55   6.831   5.656  -1.342
  442    HB3  LEU  55           HB1      LEU  55   7.416   6.350  -2.843
  443    HG   LEU  55           HG       LEU  55   8.135   7.547  -0.143
  444   HD11  LEU  55          HD11      LEU  55   8.887   5.201  -0.178
  445   HD12  LEU  55          HD12      LEU  55  10.261   6.301  -0.291
  446   HD13  LEU  55          HD13      LEU  55   9.675   5.473  -1.734
  447   HD21  LEU  55          HD21      LEU  55   9.275   7.786  -2.951
  448   HD22  LEU  55          HD22      LEU  55  10.136   8.349  -1.520
  449   HD23  LEU  55          HD23      LEU  55   8.594   9.071  -1.955
  450    H    MET  56           HN       MET  56   4.107   6.126  -0.963
  451    HA   MET  56           HA       MET  56   3.127   5.235  -3.534
  452    HB2  MET  56           HB2      MET  56   1.896   5.206  -0.761
  453    HB3  MET  56           HB1      MET  56   1.113   4.485  -2.166
  454    HG2  MET  56           HG2      MET  56   3.940   3.730  -1.363
  455    HG3  MET  56           HG1      MET  56   2.531   2.898  -0.709
  456    HE1  MET  56           HE1      MET  56   0.928   1.035  -3.498
  457    HE2  MET  56           HE2      MET  56   0.594   2.144  -2.171
  458    HE3  MET  56           HE3      MET  56   1.615   0.736  -1.895
  459    H    ILE  57           HN       ILE  57   2.075   7.788  -1.271
  460    HA   ILE  57           HA       ILE  57  -0.185   8.536  -2.983
  461    HB   ILE  57           HB       ILE  57   1.046  10.114  -0.692
  462   HG12  ILE  57          HG12      ILE  57  -1.346   8.241  -0.638
  463   HG13  ILE  57          HG11      ILE  57   0.265   7.762  -0.110
  464   HG21  ILE  57          HG21      ILE  57  -1.642  10.248  -2.089
  465   HG22  ILE  57          HG22      ILE  57  -0.387  11.485  -2.106
  466   HG23  ILE  57          HG23      ILE  57  -1.243  11.124  -0.613
  467   HD11  ILE  57          HD11      ILE  57   0.262   9.590   1.555
  468   HD12  ILE  57          HD12      ILE  57  -1.093   8.489   1.809
  469   HD13  ILE  57          HD13      ILE  57  -1.359  10.052   1.038
  470    H    ASP  58           HN       ASP  58   3.098   9.842  -2.426
  471    HA   ASP  58           HA       ASP  58   2.651  12.121  -4.193
  472    HB2  ASP  58           HB2      ASP  58   5.165  10.908  -2.991
  473    HB3  ASP  58           HB1      ASP  58   5.169  12.385  -3.955
  474    H    PHE  59           HN       PHE  59   4.406   9.009  -4.551
  475    HA   PHE  59           HA       PHE  59   5.297   9.632  -7.232
  476    HB2  PHE  59           HB2      PHE  59   6.302   7.940  -5.576
  477    HB3  PHE  59           HB1      PHE  59   5.025   6.837  -6.079
  478    HD1  PHE  59           HD1      PHE  59   8.075   8.625  -7.134
  479    HD2  PHE  59           HD2      PHE  59   4.977   5.908  -8.355
  480    HE1  PHE  59           HE1      PHE  59   9.400   8.015  -9.137
  481    HE2  PHE  59           HE2      PHE  59   6.305   5.300 -10.359
  482    HZ   PHE  59           HZ       PHE  59   8.516   6.352 -10.748
  483    H    ASN  60           HN       ASN  60   2.522   7.650  -6.036
  484    HA   ASN  60           HA       ASN  60   1.673   7.216  -8.881
  485    HB2  ASN  60           HB2      ASN  60   0.713   6.011  -6.263
  486    HB3  ASN  60           HB1      ASN  60   0.055   5.604  -7.847
  487   HD21  ASN  60          HD21      ASN  60   2.597   4.909  -5.617
  488   HD22  ASN  60          HD22      ASN  60   3.514   3.906  -6.635
  489    H    GLY  61           HN       GLY  61   0.689   8.911  -5.952
  490    HA2  GLY  61           HA2      GLY  61  -0.759  10.885  -6.113
  491    HA3  GLY  61           HA1      GLY  61  -1.591  10.146  -7.478
  492    H    GLU  62           HN       GLU  62  -3.082  11.068  -5.328
  493    HA   GLU  62           HA       GLU  62  -3.584   9.021  -3.351
  494    HB2  GLU  62           HB2      GLU  62  -4.161  11.451  -3.079
  495    HB3  GLU  62           HB1      GLU  62  -5.452  11.231  -4.260
  496    HG2  GLU  62           HG2      GLU  62  -6.540   9.577  -2.838
  497    HG3  GLU  62           HG1      GLU  62  -5.203   9.640  -1.688
  498    H    GLU  63           HN       GLU  63  -5.055   9.790  -6.496
  499    HA   GLU  63           HA       GLU  63  -7.241   7.922  -6.202
  500    HB2  GLU  63           HB2      GLU  63  -7.265   9.833  -7.794
  501    HB3  GLU  63           HB1      GLU  63  -6.003   9.045  -8.736
  502    HG2  GLU  63           HG2      GLU  63  -7.474   7.161  -9.225
  503    HG3  GLU  63           HG1      GLU  63  -8.725   7.821  -8.170
  504    H    LYS  64           HN       LYS  64  -4.204   7.717  -8.117
  505    HA   LYS  64           HA       LYS  64  -4.672   4.981  -8.881
  506    HB2  LYS  64           HB2      LYS  64  -3.142   6.567 -10.084
  507    HB3  LYS  64           HB1      LYS  64  -2.011   6.420  -8.743
  508    HG2  LYS  64           HG2      LYS  64  -1.797   4.023  -9.121
  509    HG3  LYS  64           HG1      LYS  64  -3.026   4.085 -10.386
  510    HD2  LYS  64           HD2      LYS  64  -1.575   5.627 -11.688
  511    HD3  LYS  64           HD1      LYS  64  -0.333   5.479 -10.444
  512    HE2  LYS  64           HE2      LYS  64  -0.236   3.040 -10.834
  513    HE3  LYS  64           HE1      LYS  64  -1.464   3.196 -12.091
  514    HZ1  LYS  64           HZ1      LYS  64   1.155   4.594 -12.125
  515    HZ2  LYS  64           HZ2      LYS  64  -0.004   4.570 -13.368
  516    HZ3  LYS  64           HZ3      LYS  64   0.832   3.151 -12.954
  517    H    ALA  65           HN       ALA  65  -2.850   6.447  -6.180
  518    HA   ALA  65           HA       ALA  65  -1.553   4.107  -5.260
  519    HB1  ALA  65           HB1      ALA  65  -1.037   6.250  -4.266
  520    HB2  ALA  65           HB2      ALA  65  -1.653   5.197  -2.994
  521    HB3  ALA  65           HB3      ALA  65  -2.695   6.436  -3.696
  522    H    TRP  66           HN       TRP  66  -4.862   5.262  -4.647
  523    HA   TRP  66           HA       TRP  66  -5.555   3.202  -2.771
  524    HB2  TRP  66           HB2      TRP  66  -7.192   4.949  -4.639
  525    HB3  TRP  66           HB1      TRP  66  -7.959   3.764  -3.585
  526    HD1  TRP  66           HD1      TRP  66  -4.913   5.421  -2.105
  527    HE1  TRP  66           HE1      TRP  66  -5.646   7.108  -0.302
  528    HE3  TRP  66           HE3      TRP  66  -9.943   5.529  -2.986
  529    HZ2  TRP  66           HZ2      TRP  66  -8.036   8.346   0.643
  530    HZ3  TRP  66           HZ3      TRP  66 -11.432   6.986  -1.605
  531    HH2  TRP  66           HH2      TRP  66 -10.477   8.386   0.199
  532    H    ALA  67           HN       ALA  67  -5.679   3.385  -6.313
  533    HA   ALA  67           HA       ALA  67  -7.096   0.917  -6.703
  534    HB1  ALA  67           HB1      ALA  67  -6.231   1.035  -9.013
  535    HB2  ALA  67           HB2      ALA  67  -5.098   2.296  -8.526
  536    HB3  ALA  67           HB3      ALA  67  -6.834   2.608  -8.488
  537    H    MET  68           HN       MET  68  -3.640   1.680  -6.388
  538    HA   MET  68           HA       MET  68  -2.789  -1.060  -6.951
  539    HB2  MET  68           HB2      MET  68  -1.396   1.388  -5.832
  540    HB3  MET  68           HB1      MET  68  -0.575  -0.169  -5.930
  541    HG2  MET  68           HG2      MET  68  -0.726  -0.214  -8.312
  542    HG3  MET  68           HG1      MET  68  -1.919   1.083  -8.347
  543    HE1  MET  68           HE1      MET  68   1.457   1.109  -6.043
  544    HE2  MET  68           HE2      MET  68   2.543   1.336  -7.411
  545    HE3  MET  68           HE3      MET  68   1.476  -0.065  -7.367
  546    H    ALA  69           HN       ALA  69  -3.446   0.849  -4.031
  547    HA   ALA  69           HA       ALA  69  -2.447  -1.060  -2.145
  548    HB1  ALA  69           HB1      ALA  69  -3.035   1.286  -1.545
  549    HB2  ALA  69           HB2      ALA  69  -3.858   0.124  -0.501
  550    HB3  ALA  69           HB3      ALA  69  -4.738   0.911  -1.812
  551    H    VAL  70           HN       VAL  70  -5.641  -0.640  -3.651
  552    HA   VAL  70           HA       VAL  70  -6.847  -2.861  -2.171
  553    HB   VAL  70           HB       VAL  70  -7.735  -1.373  -4.670
  554   HG11  VAL  70          HG11      VAL  70  -9.142  -3.422  -2.921
  555   HG12  VAL  70          HG12      VAL  70  -8.868  -3.508  -4.660
  556   HG13  VAL  70          HG13      VAL  70 -10.010  -2.337  -4.007
  557   HG21  VAL  70          HG21      VAL  70  -8.640  -1.162  -1.773
  558   HG22  VAL  70          HG22      VAL  70  -9.202  -0.169  -3.118
  559   HG23  VAL  70          HG23      VAL  70  -7.536  -0.033  -2.557
  560    H    TRP  71           HN       TRP  71  -5.493  -2.460  -5.468
  561    HA   TRP  71           HA       TRP  71  -6.187  -5.101  -6.337
  562    HB2  TRP  71           HB2      TRP  71  -5.508  -3.256  -7.894
  563    HB3  TRP  71           HB1      TRP  71  -3.852  -3.401  -7.311
  564    HD1  TRP  71           HD1      TRP  71  -6.377  -5.038  -9.578
  565    HE1  TRP  71           HE1      TRP  71  -5.265  -7.003 -10.822
  566    HE3  TRP  71           HE3      TRP  71  -1.959  -5.302  -7.040
  567    HZ2  TRP  71           HZ2      TRP  71  -2.819  -8.491 -10.749
  568    HZ3  TRP  71           HZ3      TRP  71  -0.257  -6.995  -7.642
  569    HH2  TRP  71           HH2      TRP  71  -0.680  -8.591  -9.493
  570    H    ILE  72           HN       ILE  72  -3.380  -3.874  -4.515
  571    HA   ILE  72           HA       ILE  72  -1.914  -6.405  -4.742
  572    HB   ILE  72           HB       ILE  72  -1.611  -3.965  -2.949
  573   HG12  ILE  72          HG12      ILE  72   0.293  -5.182  -4.982
  574   HG13  ILE  72          HG11      ILE  72  -0.885  -3.945  -5.397
  575   HG21  ILE  72          HG21      ILE  72  -0.078  -6.580  -2.833
  576   HG22  ILE  72          HG22      ILE  72  -0.894  -5.749  -1.509
  577   HG23  ILE  72          HG23      ILE  72   0.576  -5.070  -2.198
  578   HD11  ILE  72          HD11      ILE  72   1.159  -3.554  -3.196
  579   HD12  ILE  72          HD12      ILE  72   0.164  -2.326  -3.980
  580   HD13  ILE  72          HD13      ILE  72   1.465  -3.107  -4.873
  581    H    PHE  73           HN       PHE  73  -4.297  -5.067  -2.465
  582    HA   PHE  73           HA       PHE  73  -3.985  -6.904  -0.350
  583    HB2  PHE  73           HB2      PHE  73  -6.316  -5.328  -1.436
  584    HB3  PHE  73           HB1      PHE  73  -6.601  -6.482  -0.141
  585    HD1  PHE  73           HD2      PHE  73  -3.372  -4.586  -0.373
  586    HD2  PHE  73           HD1      PHE  73  -7.277  -4.772   1.441
  587    HE1  PHE  73           HE2      PHE  73  -2.683  -2.910   1.296
  588    HE2  PHE  73           HE1      PHE  73  -6.570  -3.083   3.105
  589    HZ   PHE  73           HZ       PHE  73  -4.275  -2.153   3.035
  590    H    ALA  74           HN       ALA  74  -6.041  -7.228  -3.287
  591    HA   ALA  74           HA       ALA  74  -7.080  -9.805  -2.595
  592    HB1  ALA  74           HB1      ALA  74  -8.043  -8.392  -4.388
  593    HB2  ALA  74           HB2      ALA  74  -7.629  -9.996  -4.997
  594    HB3  ALA  74           HB3      ALA  74  -6.582  -8.622  -5.349
  595    H    ALA  75           HN       ALA  75  -4.019  -8.811  -3.998
  596    HA   ALA  75           HA       ALA  75  -3.270 -11.345  -5.107
  597    HB1  ALA  75           HB1      ALA  75  -2.133  -9.142  -5.568
  598    HB2  ALA  75           HB2      ALA  75  -1.017 -10.450  -5.173
  599    HB3  ALA  75           HB3      ALA  75  -1.416  -9.234  -3.960
  600    H    ILE  76           HN       ILE  76  -2.573  -9.901  -1.899
  601    HA   ILE  76           HA       ILE  76  -1.358 -12.459  -0.996
  602    HB   ILE  76           HB       ILE  76  -1.084 -11.091   1.194
  603   HG12  ILE  76          HG12      ILE  76  -1.764  -8.797  -0.684
  604   HG13  ILE  76          HG11      ILE  76  -2.880  -9.428   0.522
  605   HG21  ILE  76          HG21      ILE  76   0.747 -11.473  -0.429
  606   HG22  ILE  76          HG22      ILE  76   0.851  -9.863   0.274
  607   HG23  ILE  76          HG23      ILE  76   0.221 -10.073  -1.359
  608   HD11  ILE  76          HD11      ILE  76  -1.226  -8.933   2.300
  609   HD12  ILE  76          HD12      ILE  76  -1.676  -7.479   1.411
  610   HD13  ILE  76          HD13      ILE  76  -0.135  -8.264   1.087
  611    H    ASN  77           HN       ASN  77  -4.343 -11.967  -1.584
  612    HA   ASN  77           HA       ASN  77  -6.371 -12.711  -0.735
  613    HB2  ASN  77           HB2      ASN  77  -4.675 -14.253   1.262
  614    HB3  ASN  77           HB1      ASN  77  -6.311 -14.641   0.740
  615   HD21  ASN  77          HD21      ASN  77  -6.115 -16.499  -0.530
  616   HD22  ASN  77          HD22      ASN  77  -4.999 -16.692  -1.794
  617    H    ARG  78           HN       ARG  78  -7.107 -10.751   0.069
  618    HA   ARG  78           HA       ARG  78  -7.243 -10.564   3.036
  619    HB2  ARG  78           HB2      ARG  78  -6.164  -8.424   1.177
  620    HB3  ARG  78           HB1      ARG  78  -6.924  -7.984   2.705
  621    HG2  ARG  78           HG2      ARG  78  -5.309  -9.395   3.921
  622    HG3  ARG  78           HG1      ARG  78  -4.549  -9.846   2.393
  623    HD2  ARG  78           HD2      ARG  78  -3.322  -7.996   3.499
  624    HD3  ARG  78           HD1      ARG  78  -3.997  -7.496   1.954
  625    HE   ARG  78           HE       ARG  78  -5.947  -6.851   3.861
  626   HH11  ARG  78          HH21      ARG  78  -2.635  -6.126   3.209
  627   HH12  ARG  78          HH22      ARG  78  -2.693  -4.567   3.962
  628   HH21  ARG  78          HH11      ARG  78  -6.033  -4.821   4.850
  629   HH22  ARG  78          HH12      ARG  78  -4.613  -3.831   4.892
  630    H    ARG  79           HN       ARG  79  -8.987 -11.347   0.782
  631    HA   ARG  79           HA       ARG  79 -10.842  -9.468  -0.079
  632    HB2  ARG  79           HB2      ARG  79 -12.495 -11.291  -0.142
  633    HB3  ARG  79           HB1      ARG  79 -10.923 -11.825  -0.724
  634    HG2  ARG  79           HG2      ARG  79 -11.203 -13.587   0.746
  635    HG3  ARG  79           HG1      ARG  79 -10.703 -12.436   1.978
  636    HD2  ARG  79           HD2      ARG  79 -13.089 -11.870   2.390
  637    HD3  ARG  79           HD1      ARG  79 -13.567 -13.039   1.162
  638    HE   ARG  79           HE       ARG  79 -11.992 -14.507   2.919
  639   HH11  ARG  79          HH21      ARG  79 -14.774 -12.472   3.145
  640   HH12  ARG  79          HH22      ARG  79 -15.440 -13.313   4.505
  641   HH21  ARG  79          HH11      ARG  79 -12.851 -15.611   4.692
  642   HH22  ARG  79          HH12      ARG  79 -14.352 -15.088   5.380
  643    H    ASP  80           HN       ASP  80 -10.675 -10.951   3.146
  644    HA   ASP  80           HA       ASP  80 -13.159  -9.752   4.072
  645    HB2  ASP  80           HB2      ASP  80 -12.123 -11.808   5.077
  646    HB3  ASP  80           HB1      ASP  80 -10.830 -10.793   5.715
  647    H    LEU  81           HN       LEU  81  -9.718  -9.042   4.808
  648    HA   LEU  81           HA       LEU  81 -10.245  -6.713   6.333
  649    HB2  LEU  81           HB2      LEU  81  -7.956  -8.127   5.587
  650    HB3  LEU  81           HB1      LEU  81  -7.715  -6.603   4.745
  651    HG   LEU  81           HG       LEU  81  -8.332  -6.842   7.714
  652   HD11  LEU  81          HD11      LEU  81  -6.143  -7.783   7.281
  653   HD12  LEU  81          HD12      LEU  81  -5.925  -6.173   7.969
  654   HD13  LEU  81          HD13      LEU  81  -5.720  -6.427   6.235
  655   HD21  LEU  81          HD21      LEU  81  -7.557  -4.452   7.696
  656   HD22  LEU  81          HD22      LEU  81  -9.040  -4.704   6.779
  657   HD23  LEU  81          HD23      LEU  81  -7.502  -4.525   5.936
  658    H    TYR  82           HN       TYR  82 -10.279  -7.205   2.869
  659    HA   TYR  82           HA       TYR  82 -10.081  -4.401   2.150
  660    HB2  TYR  82           HB2      TYR  82  -9.605  -5.872   0.362
  661    HB3  TYR  82           HB1      TYR  82 -10.953  -6.929   0.753
  662    HD1  TYR  82           HD1      TYR  82 -10.512  -3.277  -0.001
  663    HD2  TYR  82           HD2      TYR  82 -12.685  -6.881  -0.876
  664    HE1  TYR  82           HE1      TYR  82 -11.898  -2.046  -1.649
  665    HE2  TYR  82           HE2      TYR  82 -14.064  -5.649  -2.523
  666    HH   TYR  82           HH       TYR  82 -14.413  -3.717  -3.548
  667    H    GLU  83           HN       GLU  83 -12.767  -6.619   2.879
  668    HA   GLU  83           HA       GLU  83 -14.886  -4.906   2.113
  669    HB2  GLU  83           HB2      GLU  83 -14.943  -7.388   2.906
  670    HB3  GLU  83           HB1      GLU  83 -15.050  -6.727   4.536
  671    HG2  GLU  83           HG2      GLU  83 -17.042  -5.392   3.804
  672    HG3  GLU  83           HG1      GLU  83 -16.961  -6.204   2.239
  673    H    LYS  84           HN       LYS  84 -13.059  -5.103   5.154
  674    HA   LYS  84           HA       LYS  84 -14.633  -3.041   6.478
  675    HB2  LYS  84           HB2      LYS  84 -11.849  -4.070   7.106
  676    HB3  LYS  84           HB1      LYS  84 -12.862  -3.106   8.180
  677    HG2  LYS  84           HG2      LYS  84 -14.577  -4.893   8.155
  678    HG3  LYS  84           HG1      LYS  84 -13.537  -5.864   7.112
  679    HD2  LYS  84           HD2      LYS  84 -11.797  -5.896   8.849
  680    HD3  LYS  84           HD1      LYS  84 -12.809  -4.896   9.892
  681    HE2  LYS  84           HE2      LYS  84 -14.541  -6.658   9.903
  682    HE3  LYS  84           HE1      LYS  84 -13.524  -7.660   8.868
  683    HZ1  LYS  84           HZ1      LYS  84 -13.487  -7.874  11.480
  684    HZ2  LYS  84           HZ2      LYS  84 -12.342  -6.628  11.331
  685    HZ3  LYS  84           HZ3      LYS  84 -12.091  -8.113  10.546
  686    H    ALA  85           HN       ALA  85 -11.479  -3.118   4.805
  687    HA   ALA  85           HA       ALA  85 -10.742  -0.416   5.260
  688    HB1  ALA  85           HB1      ALA  85  -9.307  -0.652   3.282
  689    HB2  ALA  85           HB2      ALA  85 -10.207  -2.082   2.779
  690    HB3  ALA  85           HB3      ALA  85  -9.236  -2.124   4.250
  691    H    LYS  86           HN       LYS  86 -12.887  -1.853   2.848
  692    HA   LYS  86           HA       LYS  86 -13.207   0.515   1.257
  693    HB2  LYS  86           HB2      LYS  86 -13.908  -1.804   0.530
  694    HB3  LYS  86           HB1      LYS  86 -15.265  -1.695   1.651
  695    HG2  LYS  86           HG2      LYS  86 -16.119   0.278   0.482
  696    HG3  LYS  86           HG1      LYS  86 -14.726   0.265  -0.601
  697    HD2  LYS  86           HD2      LYS  86 -15.386  -1.951  -1.445
  698    HD3  LYS  86           HD1      LYS  86 -16.769  -1.964  -0.350
  699    HE2  LYS  86           HE2      LYS  86 -17.624   0.098  -1.455
  700    HE3  LYS  86           HE1      LYS  86 -16.281   0.016  -2.595
  701    HZ1  LYS  86           HZ1      LYS  86 -18.654  -1.666  -2.393
  702    HZ2  LYS  86           HZ2      LYS  86 -17.207  -2.434  -2.842
  703    HZ3  LYS  86           HZ3      LYS  86 -17.810  -1.143  -3.767
  704    H    ARG  87           HN       ARG  87 -14.619  -0.507   4.309
  705    HA   ARG  87           HA       ARG  87 -16.811   1.408   4.227
  706    HB2  ARG  87           HB2      ARG  87 -16.818  -0.684   5.621
  707    HB3  ARG  87           HB1      ARG  87 -15.568   0.032   6.629
  708    HG2  ARG  87           HG2      ARG  87 -17.721   0.380   7.693
  709    HG3  ARG  87           HG1      ARG  87 -17.104   1.929   7.154
  710    HD2  ARG  87           HD2      ARG  87 -18.706   2.129   5.457
  711    HD3  ARG  87           HD1      ARG  87 -18.914   0.392   5.276
  712    HE   ARG  87           HE       ARG  87 -20.438   2.198   6.957
  713   HH11  ARG  87          HH21      ARG  87 -19.077  -0.975   6.929
  714   HH12  ARG  87          HH22      ARG  87 -20.114  -1.561   8.187
  715   HH21  ARG  87          HH11      ARG  87 -21.786   1.448   8.579
  716   HH22  ARG  87          HH12      ARG  87 -21.643  -0.191   9.119
  717    H    ASP  88           HN       ASP  88 -13.458   1.462   5.297
  718    HA   ASP  88           HA       ASP  88 -13.807   4.092   6.641
  719    HB2  ASP  88           HB2      ASP  88 -12.287   2.286   7.577
  720    HB3  ASP  88           HB1      ASP  88 -11.245   2.517   6.173
  721    H    GLU  89           HN       GLU  89 -13.114   2.891   3.524
  722    HA   GLU  89           HA       GLU  89 -11.223   4.684   2.435
  723    HB2  GLU  89           HB2      GLU  89 -12.255   2.719   1.297
  724    HB3  GLU  89           HB1      GLU  89 -13.756   3.623   1.144
  725    HG2  GLU  89           HG2      GLU  89 -12.546   5.337  -0.211
  726    HG3  GLU  89           HG1      GLU  89 -11.089   4.344  -0.109
  727    HA   PRO  90           HA       PRO  90 -13.921   8.334   3.183
  728    HB2  PRO  90           HB2      PRO  90 -11.914  10.175   2.183
  729    HB3  PRO  90           HB1      PRO  90 -12.363   9.895   3.873
  730    HG2  PRO  90           HG2      PRO  90  -9.915   9.070   2.542
  731    HG3  PRO  90           HG1      PRO  90 -10.367   8.804   4.232
  732    HD2  PRO  90           HD2      PRO  90 -10.302   6.847   2.075
  733    HD3  PRO  90           HD1      PRO  90 -10.677   6.569   3.779
  734    H    LYS  91           HN       LYS  91 -15.061   9.735   1.679
  735    HA   LYS  91           HA       LYS  91 -14.312   9.902  -1.114
  736    HB2  LYS  91           HB2      LYS  91 -15.269   7.466  -0.654
  737    HB3  LYS  91           HB1      LYS  91 -16.831   8.271  -0.684
  738    HG2  LYS  91           HG2      LYS  91 -14.757   8.223  -2.902
  739    HG3  LYS  91           HG1      LYS  91 -16.341   7.450  -2.912
  740    HD2  LYS  91           HD2      LYS  91 -17.333   9.803  -2.622
  741    HD3  LYS  91           HD1      LYS  91 -15.720  10.417  -2.990
  742    HE2  LYS  91           HE2      LYS  91 -17.465   8.703  -4.776
  743    HE3  LYS  91           HE1      LYS  91 -16.969  10.371  -5.054
  744    HZ1  LYS  91           HZ1      LYS  91 -14.740   9.715  -5.347
  745    HZ2  LYS  91           HZ2      LYS  91 -15.665   8.631  -6.272
  746    HZ3  LYS  91           HZ3      LYS  91 -15.034   8.148  -4.771
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1  -9.805  17.563  10.083
    2    H2   MET   1           HT2      MET   1  -8.600  17.685  11.275
    3    H3   MET   1           HT3      MET   1  -9.849  18.835  11.205
    4    HA   MET   1           HA       MET   1 -10.417  17.425  12.976
    5    HB2  MET   1           HB2      MET   1 -12.242  17.945  11.337
    6    HB3  MET   1           HB1      MET   1 -11.897  16.416  10.529
    7    HG2  MET   1           HG2      MET   1 -12.446  15.166  12.536
    8    HG3  MET   1           HG1      MET   1 -12.640  16.655  13.459
    9    HE1  MET   1           HE1      MET   1 -14.735  17.769  13.836
   10    HE2  MET   1           HE2      MET   1 -15.945  18.087  12.595
   11    HE3  MET   1           HE3      MET   1 -14.291  18.649  12.367
   12    H    ALA   2           HN       ALA   2  -9.068  15.752  10.221
   13    HA   ALA   2           HA       ALA   2  -8.091  13.599  11.919
   14    HB1  ALA   2           HB1      ALA   2 -10.200  12.953   9.832
   15    HB2  ALA   2           HB2      ALA   2 -10.414  12.829  11.578
   16    HB3  ALA   2           HB3      ALA   2  -9.273  11.768  10.753
   17    H    SER   3           HN       SER   3  -6.039  13.762  11.090
   18    HA   SER   3           HA       SER   3  -5.489  14.321   8.304
   19    HB2  SER   3           HB2      SER   3  -3.930  14.767  10.297
   20    HB3  SER   3           HB1      SER   3  -3.583  13.039  10.300
   21    HG   SER   3           HG       SER   3  -2.712  15.006   8.622
   22    H    THR   4           HN       THR   4  -5.317  12.906   6.626
   23    HA   THR   4           HA       THR   4  -6.017  10.089   7.057
   24    HB   THR   4           HB       THR   4  -5.075  11.390   4.473
   25    HG1  THR   4           HG1      THR   4  -7.161  11.978   4.148
   26   HG21  THR   4          HG21      THR   4  -6.453   9.626   3.443
   27   HG22  THR   4          HG22      THR   4  -6.866   9.007   5.042
   28   HG23  THR   4          HG23      THR   4  -5.201   8.926   4.467
   29    H    ARG   5           HN       ARG   5  -3.099  11.931   6.781
   30    HA   ARG   5           HA       ARG   5  -1.308  10.005   5.737
   31    HB2  ARG   5           HB2      ARG   5  -0.792  12.425   6.274
   32    HB3  ARG   5           HB1      ARG   5  -0.681  11.962   7.971
   33    HG2  ARG   5           HG2      ARG   5   1.081  10.300   7.366
   34    HG3  ARG   5           HG1      ARG   5   1.019  10.874   5.705
   35    HD2  ARG   5           HD2      ARG   5   1.836  12.432   8.162
   36    HD3  ARG   5           HD1      ARG   5   2.853  12.014   6.792
   37    HE   ARG   5           HE       ARG   5   1.139  14.324   7.051
   38   HH11  ARG   5          HH21      ARG   5   2.126  11.949   4.743
   39   HH12  ARG   5          HH22      ARG   5   1.597  12.881   3.383
   40   HH21  ARG   5          HH11      ARG   5   0.468  15.536   5.294
   41   HH22  ARG   5          HH12      ARG   5   0.666  14.906   3.692
   42    H    CYS   6           HN       CYS   6  -2.172  10.603   9.164
   43    HA   CYS   6           HA       CYS   6  -0.661   8.331  10.127
   44    HB2  CYS   6           HB2      CYS   6  -2.936   9.860  11.424
   45    HB3  CYS   6           HB1      CYS   6  -1.873   8.720  12.248
   46    HG   CYS   6           HG       CYS   6   0.147  10.377  11.584
   47    H    LYS   7           HN       LYS   7  -3.860   8.734   8.809
   48    HA   LYS   7           HA       LYS   7  -4.981   6.311   9.941
   49    HB2  LYS   7           HB2      LYS   7  -6.280   8.311   9.018
   50    HB3  LYS   7           HB1      LYS   7  -5.881   7.721   7.411
   51    HG2  LYS   7           HG2      LYS   7  -7.966   6.684   7.742
   52    HG3  LYS   7           HG1      LYS   7  -6.882   5.420   8.313
   53    HD2  LYS   7           HD2      LYS   7  -7.230   6.149  10.640
   54    HD3  LYS   7           HD1      LYS   7  -8.247   7.479  10.085
   55    HE2  LYS   7           HE2      LYS   7  -9.796   5.814   9.056
   56    HE3  LYS   7           HE1      LYS   7  -8.812   4.518   9.737
   57    HZ1  LYS   7           HZ1      LYS   7 -10.424   6.543  11.162
   58    HZ2  LYS   7           HZ2      LYS   7  -9.183   5.686  11.945
   59    HZ3  LYS   7           HZ3      LYS   7 -10.507   4.853  11.280
   60    H    LEU   8           HN       LEU   8  -3.751   7.089   6.649
   61    HA   LEU   8           HA       LEU   8  -4.059   4.420   5.652
   62    HB2  LEU   8           HB2      LEU   8  -3.492   6.718   4.432
   63    HB3  LEU   8           HB1      LEU   8  -1.826   6.218   4.681
   64    HG   LEU   8           HG       LEU   8  -2.661   3.915   3.617
   65   HD11  LEU   8          HD11      LEU   8  -4.401   4.294   1.873
   66   HD12  LEU   8          HD12      LEU   8  -4.680   5.908   2.521
   67   HD13  LEU   8          HD13      LEU   8  -5.054   4.491   3.495
   68   HD21  LEU   8          HD21      LEU   8  -0.979   5.409   2.589
   69   HD22  LEU   8          HD22      LEU   8  -2.274   6.411   1.932
   70   HD23  LEU   8          HD23      LEU   8  -2.073   4.752   1.370
   71    H    ALA   9           HN       ALA   9  -1.448   5.953   7.471
   72    HA   ALA   9           HA       ALA   9   0.445   3.802   7.133
   73    HB1  ALA   9           HB1      ALA   9   0.247   5.735   9.459
   74    HB2  ALA   9           HB2      ALA   9   1.028   6.121   7.927
   75    HB3  ALA   9           HB3      ALA   9   1.674   4.835   8.946
   76    H    ARG  10           HN       ARG  10  -2.103   4.504   9.470
   77    HA   ARG  10           HA       ARG  10  -1.531   2.488  11.369
   78    HB2  ARG  10           HB2      ARG  10  -3.294   4.326  11.533
   79    HB3  ARG  10           HB1      ARG  10  -4.323   3.321  10.514
   80    HG2  ARG  10           HG2      ARG  10  -4.006   1.455  12.209
   81    HG3  ARG  10           HG1      ARG  10  -3.217   2.638  13.255
   82    HD2  ARG  10           HD2      ARG  10  -5.546   2.524  13.907
   83    HD3  ARG  10           HD1      ARG  10  -5.300   4.063  13.079
   84    HE   ARG  10           HE       ARG  10  -6.089   2.334  11.054
   85   HH11  ARG  10          HH21      ARG  10  -7.310   3.291  14.141
   86   HH12  ARG  10          HH22      ARG  10  -8.970   3.077  13.694
   87   HH21  ARG  10          HH11      ARG  10  -8.248   2.052  10.462
   88   HH22  ARG  10          HH12      ARG  10  -9.500   2.375  11.614
   89    H    TYR  11           HN       TYR  11  -3.099   2.294   8.220
   90    HA   TYR  11           HA       TYR  11  -4.088  -0.409   8.572
   91    HB2  TYR  11           HB2      TYR  11  -3.705   1.438   6.209
   92    HB3  TYR  11           HB1      TYR  11  -4.079  -0.260   5.920
   93    HD1  TYR  11           HD2      TYR  11  -6.138  -1.270   6.945
   94    HD2  TYR  11           HD1      TYR  11  -5.431   2.958   6.946
   95    HE1  TYR  11           HE2      TYR  11  -8.541  -0.873   7.419
   96    HE2  TYR  11           HE1      TYR  11  -7.832   3.364   7.425
   97    HH   TYR  11           HH       TYR  11 -10.140   0.661   7.617
   98    H    LEU  12           HN       LEU  12  -1.229   0.873   6.772
   99    HA   LEU  12           HA       LEU  12  -0.216  -1.740   6.154
  100    HB2  LEU  12           HB2      LEU  12   1.558   0.676   6.662
  101    HB3  LEU  12           HB1      LEU  12   1.868  -0.687   5.593
  102    HG   LEU  12           HG       LEU  12  -0.422   1.297   5.131
  103   HD11  LEU  12          HD11      LEU  12   2.300   1.198   3.773
  104   HD12  LEU  12          HD12      LEU  12   1.862   2.368   5.015
  105   HD13  LEU  12          HD13      LEU  12   1.010   2.360   3.472
  106   HD21  LEU  12          HD21      LEU  12   0.826  -0.939   3.477
  107   HD22  LEU  12          HD22      LEU  12  -0.155   0.332   2.750
  108   HD23  LEU  12          HD23      LEU  12  -0.866  -0.746   3.940
  109    H    GLU  13           HN       GLU  13  -0.096   0.206   9.040
  110    HA   GLU  13           HA       GLU  13   1.928  -1.500  10.351
  111    HB2  GLU  13           HB2      GLU  13   0.224   0.847  11.247
  112    HB3  GLU  13           HB1      GLU  13   1.094  -0.124  12.430
  113    HG2  GLU  13           HG2      GLU  13   2.390   1.874  11.692
  114    HG3  GLU  13           HG1      GLU  13   3.218   0.359  11.342
  115    H    ASP  14           HN       ASP  14  -1.540  -1.387  10.004
  116    HA   ASP  14           HA       ASP  14  -2.179  -2.984  12.329
  117    HB2  ASP  14           HB2      ASP  14  -3.874  -1.611  11.163
  118    HB3  ASP  14           HB1      ASP  14  -3.737  -2.644   9.741
  119    H    LEU  15           HN       LEU  15  -0.400  -3.808   9.629
  120    HA   LEU  15           HA       LEU  15  -1.432  -6.620   9.475
  121    HB2  LEU  15           HB2      LEU  15   0.861  -5.378   7.923
  122    HB3  LEU  15           HB1      LEU  15   0.016  -6.883   7.568
  123    HG   LEU  15           HG       LEU  15  -1.101  -4.065   7.380
  124   HD11  LEU  15          HD11      LEU  15  -0.793  -6.237   5.285
  125   HD12  LEU  15          HD12      LEU  15   0.349  -4.914   5.509
  126   HD13  LEU  15          HD13      LEU  15  -1.309  -4.575   5.011
  127   HD21  LEU  15          HD21      LEU  15  -2.494  -6.760   7.240
  128   HD22  LEU  15          HD22      LEU  15  -3.162  -5.335   6.442
  129   HD23  LEU  15          HD23      LEU  15  -2.949  -5.344   8.188
  130    H    GLU  16           HN       GLU  16   0.098  -8.401   9.719
  131    HA   GLU  16           HA       GLU  16   1.630  -8.188  12.131
  132    HB2  GLU  16           HB2      GLU  16   0.569 -10.290  11.220
  133    HB3  GLU  16           HB1      GLU  16   1.848 -10.346  10.009
  134    HG2  GLU  16           HG2      GLU  16   3.550 -10.575  11.709
  135    HG3  GLU  16           HG1      GLU  16   2.382 -10.278  12.996
  136    H    ASP  17           HN       ASP  17   3.981  -8.557  12.327
  137    HA   ASP  17           HA       ASP  17   5.510  -6.766  10.731
  138    HB2  ASP  17           HB2      ASP  17   6.480  -9.080  12.435
  139    HB3  ASP  17           HB1      ASP  17   7.472  -7.738  11.863
  140    H    VAL  18           HN       VAL  18   5.349 -10.353  10.640
  141    HA   VAL  18           HA       VAL  18   7.190 -10.558   8.420
  142    HB   VAL  18           HB       VAL  18   5.066 -12.524   9.374
  143   HG11  VAL  18          HG11      VAL  18   7.397 -12.812   7.441
  144   HG12  VAL  18          HG12      VAL  18   5.688 -13.085   7.097
  145   HG13  VAL  18          HG13      VAL  18   6.559 -14.187   8.161
  146   HG21  VAL  18          HG21      VAL  18   6.901 -13.593  10.566
  147   HG22  VAL  18          HG22      VAL  18   6.860 -11.893  11.034
  148   HG23  VAL  18          HG23      VAL  18   8.064 -12.460   9.877
  149    H    ASP  19           HN       ASP  19   3.675 -10.111   8.660
  150    HA   ASP  19           HA       ASP  19   3.163 -10.634   5.855
  151    HB2  ASP  19           HB2      ASP  19   1.604  -9.087   7.952
  152    HB3  ASP  19           HB1      ASP  19   1.011  -9.401   6.321
  153    H    LEU  20           HN       LEU  20   4.223  -7.878   7.732
  154    HA   LEU  20           HA       LEU  20   3.750  -5.874   5.714
  155    HB2  LEU  20           HB2      LEU  20   4.173  -5.401   8.156
  156    HB3  LEU  20           HB1      LEU  20   5.841  -5.906   7.915
  157    HG   LEU  20           HG       LEU  20   5.991  -4.089   6.099
  158   HD11  LEU  20          HD11      LEU  20   4.325  -2.167   6.538
  159   HD12  LEU  20          HD12      LEU  20   3.319  -3.370   7.340
  160   HD13  LEU  20          HD13      LEU  20   3.715  -3.545   5.633
  161   HD21  LEU  20          HD21      LEU  20   7.017  -3.822   8.310
  162   HD22  LEU  20          HD22      LEU  20   5.480  -3.275   8.978
  163   HD23  LEU  20          HD23      LEU  20   6.322  -2.289   7.784
  164    H    LYS  21           HN       LYS  21   6.296  -8.165   6.403
  165    HA   LYS  21           HA       LYS  21   8.295  -7.048   4.651
  166    HB2  LYS  21           HB2      LYS  21   8.758  -8.674   6.497
  167    HB3  LYS  21           HB1      LYS  21   7.946  -9.923   5.555
  168    HG2  LYS  21           HG2      LYS  21   9.586  -9.672   3.752
  169    HG3  LYS  21           HG1      LYS  21  10.370  -8.354   4.625
  170    HD2  LYS  21           HD2      LYS  21  10.986  -9.850   6.437
  171    HD3  LYS  21           HD1      LYS  21  10.072 -11.171   5.709
  172    HE2  LYS  21           HE2      LYS  21  12.497  -9.811   4.499
  173    HE3  LYS  21           HE1      LYS  21  12.461 -11.422   5.216
  174    HZ1  LYS  21           HZ1      LYS  21  12.179 -11.890   3.004
  175    HZ2  LYS  21           HZ2      LYS  21  11.278 -10.484   2.696
  176    HZ3  LYS  21           HZ3      LYS  21  10.563 -11.792   3.511
  177    H    LYS  22           HN       LYS  22   5.614  -9.303   4.187
  178    HA   LYS  22           HA       LYS  22   6.472 -10.131   1.524
  179    HB2  LYS  22           HB2      LYS  22   3.825 -10.372   2.992
  180    HB3  LYS  22           HB1      LYS  22   4.086 -11.023   1.379
  181    HG2  LYS  22           HG2      LYS  22   5.984 -11.764   3.629
  182    HG3  LYS  22           HG1      LYS  22   4.438 -12.590   3.479
  183    HD2  LYS  22           HD2      LYS  22   5.031 -13.189   1.119
  184    HD3  LYS  22           HD1      LYS  22   6.620 -12.469   1.370
  185    HE2  LYS  22           HE2      LYS  22   7.045 -14.031   3.226
  186    HE3  LYS  22           HE1      LYS  22   5.454 -14.753   2.983
  187    HZ1  LYS  22           HZ1      LYS  22   6.116 -15.817   1.128
  188    HZ2  LYS  22           HZ2      LYS  22   7.653 -15.679   1.838
  189    HZ3  LYS  22           HZ3      LYS  22   7.165 -14.577   0.639
  190    H    PHE  23           HN       PHE  23   4.539  -7.488   2.809
  191    HA   PHE  23           HA       PHE  23   3.286  -6.795   0.277
  192    HB2  PHE  23           HB2      PHE  23   2.466  -6.073   2.556
  193    HB3  PHE  23           HB1      PHE  23   3.835  -4.968   2.639
  194    HD1  PHE  23           HD2      PHE  23   4.094  -3.164   0.882
  195    HD2  PHE  23           HD1      PHE  23   0.511  -5.509   1.272
  196    HE1  PHE  23           HE2      PHE  23   2.848  -1.485  -0.447
  197    HE2  PHE  23           HE1      PHE  23  -0.732  -3.826  -0.059
  198    HZ   PHE  23           HZ       PHE  23   0.436  -1.815  -0.917
  199    H    LYS  24           HN       LYS  24   6.254  -5.696   1.940
  200    HA   LYS  24           HA       LYS  24   6.873  -3.652   0.006
  201    HB2  LYS  24           HB2      LYS  24   7.833  -3.701   2.295
  202    HB3  LYS  24           HB1      LYS  24   8.724  -5.163   1.873
  203    HG2  LYS  24           HG2      LYS  24  10.034  -3.999   0.226
  204    HG3  LYS  24           HG1      LYS  24   9.002  -2.575   0.318
  205    HD2  LYS  24           HD2      LYS  24  11.134  -2.255   1.548
  206    HD3  LYS  24           HD1      LYS  24   9.733  -2.140   2.611
  207    HE2  LYS  24           HE2      LYS  24  11.738  -3.565   3.436
  208    HE3  LYS  24           HE1      LYS  24  10.134  -4.284   3.562
  209    HZ1  LYS  24           HZ1      LYS  24  12.041  -4.728   1.328
  210    HZ2  LYS  24           HZ2      LYS  24  10.515  -5.454   1.499
  211    HZ3  LYS  24           HZ3      LYS  24  11.757  -5.811   2.601
  212    H    MET  25           HN       MET  25   8.017  -7.016   0.425
  213    HA   MET  25           HA       MET  25   9.830  -7.029  -1.757
  214    HB2  MET  25           HB2      MET  25   9.643  -8.835  -0.038
  215    HB3  MET  25           HB1      MET  25   8.137  -9.355  -0.792
  216    HG2  MET  25           HG2      MET  25   9.284  -9.842  -2.877
  217    HG3  MET  25           HG1      MET  25  10.792  -9.179  -2.247
  218    HE1  MET  25           HE1      MET  25  11.662 -10.098   0.264
  219    HE2  MET  25           HE2      MET  25  12.535 -10.476  -1.220
  220    HE3  MET  25           HE3      MET  25  12.283 -11.732  -0.010
  221    H    HIS  26           HN       HIS  26   6.332  -7.678  -1.660
  222    HA   HIS  26           HA       HIS  26   6.147  -8.406  -4.471
  223    HB2  HIS  26           HB2      HIS  26   4.077  -7.427  -2.462
  224    HB3  HIS  26           HB1      HIS  26   3.666  -7.958  -4.095
  225    HD1  HIS  26           HD1      HIS  26   6.402  -9.697  -2.226
  226    HD2  HIS  26           HD2      HIS  26   2.366 -10.303  -3.072
  227    HE1  HIS  26           HE1      HIS  26   5.886 -12.091  -1.579
  228    H    LEU  27           HN       LEU  27   6.029  -5.358  -2.697
  229    HA   LEU  27           HA       LEU  27   4.919  -3.782  -4.855
  230    HB2  LEU  27           HB2      LEU  27   5.067  -3.129  -2.388
  231    HB3  LEU  27           HB1      LEU  27   6.776  -2.812  -2.659
  232    HG   LEU  27           HG       LEU  27   5.913  -1.281  -4.646
  233   HD11  LEU  27          HD11      LEU  27   3.714  -0.214  -4.095
  234   HD12  LEU  27          HD12      LEU  27   3.452  -1.452  -2.869
  235   HD13  LEU  27          HD13      LEU  27   3.548  -1.900  -4.571
  236   HD21  LEU  27          HD21      LEU  27   5.704   0.635  -3.076
  237   HD22  LEU  27          HD22      LEU  27   7.064  -0.409  -2.663
  238   HD23  LEU  27          HD23      LEU  27   5.570  -0.500  -1.732
  239    H    GLU  28           HN       GLU  28   8.310  -4.169  -3.732
  240    HA   GLU  28           HA       GLU  28   9.417  -2.627  -5.883
  241    HB2  GLU  28           HB2      GLU  28  11.571  -3.674  -5.238
  242    HB3  GLU  28           HB1      GLU  28  10.687  -3.077  -3.834
  243    HG2  GLU  28           HG2      GLU  28   9.768  -5.411  -3.524
  244    HG3  GLU  28           HG1      GLU  28  10.864  -5.948  -4.796
  245    H    ASP  29           HN       ASP  29   8.689  -6.077  -5.546
  246    HA   ASP  29           HA       ASP  29   9.963  -6.789  -8.083
  247    HB2  ASP  29           HB2      ASP  29   8.029  -8.293  -6.293
  248    HB3  ASP  29           HB1      ASP  29   8.828  -8.984  -7.705
  249    H    TYR  30           HN       TYR  30   8.016  -4.635  -8.293
  250    HA   TYR  30           HA       TYR  30   5.532  -5.661  -9.336
  251    HB2  TYR  30           HB2      TYR  30   5.816  -3.357  -8.458
  252    HB3  TYR  30           HB1      TYR  30   6.844  -2.983  -9.843
  253    HD1  TYR  30           HD2      TYR  30   3.404  -3.811  -8.760
  254    HD2  TYR  30           HD1      TYR  30   5.903  -2.710 -12.080
  255    HE1  TYR  30           HE2      TYR  30   1.387  -3.331 -10.120
  256    HE2  TYR  30           HE1      TYR  30   3.883  -2.232 -13.438
  257    HH   TYR  30           HH       TYR  30   0.842  -3.276 -12.639
  258    HA   PRO  31           HA       PRO  31   7.624  -6.771 -13.229
  259    HB2  PRO  31           HB2      PRO  31   5.257  -7.588 -14.601
  260    HB3  PRO  31           HB1      PRO  31   6.375  -8.640 -13.722
  261    HG2  PRO  31           HG2      PRO  31   3.677  -7.757 -12.915
  262    HG3  PRO  31           HG1      PRO  31   4.673  -9.045 -12.220
  263    HD2  PRO  31           HD2      PRO  31   4.183  -6.454 -11.078
  264    HD3  PRO  31           HD1      PRO  31   5.328  -7.681 -10.482
  265    HA   PRO  32           HA       PRO  32   6.455  -2.743 -15.037
  266    HB2  PRO  32           HB2      PRO  32   8.149  -3.023 -17.351
  267    HB3  PRO  32           HB1      PRO  32   8.513  -2.121 -15.873
  268    HG2  PRO  32           HG2      PRO  32   9.629  -4.694 -16.744
  269    HG3  PRO  32           HG1      PRO  32  10.139  -3.681 -15.385
  270    HD2  PRO  32           HD2      PRO  32   8.678  -6.157 -15.233
  271    HD3  PRO  32           HD1      PRO  32   9.058  -5.057 -13.887
  272    H    GLN  33           HN       GLN  33   4.901  -2.201 -16.602
  273    HA   GLN  33           HA       GLN  33   3.920  -4.429 -18.377
  274    HB2  GLN  33           HB2      GLN  33   2.414  -2.008 -17.339
  275    HB3  GLN  33           HB1      GLN  33   1.739  -3.360 -18.249
  276    HG2  GLN  33           HG2      GLN  33   2.451  -4.897 -16.408
  277    HG3  GLN  33           HG1      GLN  33   2.974  -3.488 -15.483
  278   HE21  GLN  33          HE21      GLN  33   0.089  -5.050 -16.901
  279   HE22  GLN  33          HE22      GLN  33  -1.031  -4.241 -15.916
  280    H    LYS  34           HN       LYS  34   4.414  -0.882 -18.258
  281    HA   LYS  34           HA       LYS  34   5.344  -0.821 -20.993
  282    HB2  LYS  34           HB2      LYS  34   2.877  -1.128 -21.352
  283    HB3  LYS  34           HB1      LYS  34   2.604   0.382 -20.484
  284    HG2  LYS  34           HG2      LYS  34   3.883   1.625 -22.136
  285    HG3  LYS  34           HG1      LYS  34   4.340   0.133 -22.958
  286    HD2  LYS  34           HD2      LYS  34   1.967  -0.313 -23.471
  287    HD3  LYS  34           HD1      LYS  34   1.511   1.184 -22.658
  288    HE2  LYS  34           HE2      LYS  34   1.638   1.567 -25.071
  289    HE3  LYS  34           HE1      LYS  34   2.927   2.455 -24.261
  290    HZ1  LYS  34           HZ1      LYS  34   3.868  -0.111 -24.830
  291    HZ2  LYS  34           HZ2      LYS  34   4.391   1.367 -25.484
  292    HZ3  LYS  34           HZ3      LYS  34   3.151   0.488 -26.245
  293    H    GLY  35           HN       GLY  35   7.020   0.453 -20.147
  294    HA2  GLY  35           HA2      GLY  35   8.040   2.526 -19.683
  295    HA3  GLY  35           HA1      GLY  35   6.462   3.291 -19.868
  296    H    CYS  36           HN       CYS  36   5.942   0.846 -17.749
  297    HA   CYS  36           HA       CYS  36   5.523   2.517 -15.496
  298    HB2  CYS  36           HB2      CYS  36   6.013  -0.471 -15.666
  299    HB3  CYS  36           HB1      CYS  36   5.478   0.351 -14.202
  300    HG   CYS  36           HG       CYS  36   3.780   0.112 -16.811
  301    H    ILE  37           HN       ILE  37   6.974   3.430 -14.106
  302    HA   ILE  37           HA       ILE  37   9.814   2.794 -14.351
  303    HB   ILE  37           HB       ILE  37   9.060   5.102 -14.097
  304   HG12  ILE  37          HG12      ILE  37  10.629   4.150 -11.674
  305   HG13  ILE  37          HG11      ILE  37  11.308   4.412 -13.282
  306   HG21  ILE  37          HG21      ILE  37   7.123   4.357 -12.463
  307   HG22  ILE  37          HG22      ILE  37   7.877   5.933 -12.239
  308   HG23  ILE  37          HG23      ILE  37   8.334   4.588 -11.201
  309   HD11  ILE  37          HD11      ILE  37  10.482   6.801 -13.155
  310   HD12  ILE  37          HD12      ILE  37  11.726   6.413 -11.965
  311   HD13  ILE  37          HD13      ILE  37  10.033   6.497 -11.477
  312    HA   PRO  38           HA       PRO  38   9.180  -0.188 -10.937
  313    HB2  PRO  38           HB2      PRO  38  11.922  -0.961 -10.753
  314    HB3  PRO  38           HB1      PRO  38  10.664  -1.797 -11.674
  315    HG2  PRO  38           HG2      PRO  38  12.877  -0.137 -12.696
  316    HG3  PRO  38           HG1      PRO  38  11.800  -1.219 -13.595
  317    HD2  PRO  38           HD2      PRO  38  11.709   1.656 -13.560
  318    HD3  PRO  38           HD1      PRO  38  10.532   0.560 -14.324
  319    H    LEU  39           HN       LEU  39   9.440   0.105  -8.692
  320    HA   LEU  39           HA       LEU  39  10.474   2.641  -7.798
  321    HB2  LEU  39           HB2      LEU  39   9.335   0.191  -6.464
  322    HB3  LEU  39           HB1      LEU  39  10.082   1.434  -5.464
  323    HG   LEU  39           HG       LEU  39   8.555   3.125  -6.409
  324   HD11  LEU  39          HD11      LEU  39   8.146   2.268  -8.619
  325   HD12  LEU  39          HD12      LEU  39   6.596   2.261  -7.784
  326   HD13  LEU  39          HD13      LEU  39   7.496   0.757  -7.983
  327   HD21  LEU  39          HD21      LEU  39   6.525   2.341  -5.308
  328   HD22  LEU  39          HD22      LEU  39   7.925   1.789  -4.388
  329   HD23  LEU  39          HD23      LEU  39   7.064   0.667  -5.441
  330    HA   PRO  40           HA       PRO  40  14.731   0.990  -7.651
  331    HB2  PRO  40           HB2      PRO  40  15.493   3.214  -5.856
  332    HB3  PRO  40           HB1      PRO  40  16.055   2.885  -7.502
  333    HG2  PRO  40           HG2      PRO  40  14.246   4.951  -6.732
  334    HG3  PRO  40           HG1      PRO  40  14.603   4.440  -8.390
  335    HD2  PRO  40           HD2      PRO  40  12.142   3.984  -6.850
  336    HD3  PRO  40           HD1      PRO  40  12.450   3.621  -8.566
  337    H    ARG  41           HN       ARG  41  15.524  -0.510  -6.228
  338    HA   ARG  41           HA       ARG  41  14.108  -1.129  -3.806
  339    HB2  ARG  41           HB2      ARG  41  15.459  -2.756  -5.206
  340    HB3  ARG  41           HB1      ARG  41  16.920  -2.007  -4.562
  341    HG2  ARG  41           HG2      ARG  41  16.257  -2.594  -2.281
  342    HG3  ARG  41           HG1      ARG  41  14.739  -3.270  -2.874
  343    HD2  ARG  41           HD2      ARG  41  17.507  -4.265  -3.616
  344    HD3  ARG  41           HD1      ARG  41  16.415  -5.047  -2.473
  345    HE   ARG  41           HE       ARG  41  14.912  -4.830  -4.800
  346   HH11  ARG  41          HH21      ARG  41  17.991  -6.122  -3.916
  347   HH12  ARG  41          HH22      ARG  41  17.959  -7.367  -5.119
  348   HH21  ARG  41          HH11      ARG  41  14.859  -6.450  -6.371
  349   HH22  ARG  41          HH12      ARG  41  16.187  -7.553  -6.508
  350    H    GLY  42           HN       GLY  42  17.000   0.780  -4.466
  351    HA2  GLY  42           HA2      GLY  42  17.897   0.949  -1.718
  352    HA3  GLY  42           HA1      GLY  42  18.350   2.090  -2.987
  353    H    GLN  43           HN       GLN  43  15.681   3.011  -3.640
  354    HA   GLN  43           HA       GLN  43  15.341   4.936  -1.481
  355    HB2  GLN  43           HB2      GLN  43  13.764   4.382  -4.021
  356    HB3  GLN  43           HB1      GLN  43  13.379   5.704  -2.918
  357    HG2  GLN  43           HG2      GLN  43  16.114   5.329  -4.186
  358    HG3  GLN  43           HG1      GLN  43  14.854   6.351  -4.875
  359   HE21  GLN  43          HE21      GLN  43  17.407   7.371  -3.914
  360   HE22  GLN  43          HE22      GLN  43  17.081   8.394  -2.600
  361    H    THR  44           HN       THR  44  13.516   2.103  -2.632
  362    HA   THR  44           HA       THR  44  11.252   2.471  -0.922
  363    HB   THR  44           HB       THR  44  12.439  -0.082  -2.053
  364    HG1  THR  44           HG1      THR  44  10.395   0.421  -3.391
  365   HG21  THR  44          HG21      THR  44  10.061  -0.917  -1.779
  366   HG22  THR  44          HG22      THR  44   9.751   0.501  -0.780
  367   HG23  THR  44          HG23      THR  44  10.943  -0.695  -0.270
  368    H    GLU  45           HN       GLU  45  14.149   0.388  -0.463
  369    HA   GLU  45           HA       GLU  45  13.421  -0.406   2.208
  370    HB2  GLU  45           HB2      GLU  45  16.191  -0.207   0.949
  371    HB3  GLU  45           HB1      GLU  45  15.797  -1.100   2.414
  372    HG2  GLU  45           HG2      GLU  45  14.593  -1.659  -0.322
  373    HG3  GLU  45           HG1      GLU  45  15.921  -2.566   0.400
  374    H    LYS  46           HN       LYS  46  15.303   2.368   0.946
  375    HA   LYS  46           HA       LYS  46  16.160   3.259   3.563
  376    HB2  LYS  46           HB2      LYS  46  15.902   4.671   0.892
  377    HB3  LYS  46           HB1      LYS  46  16.560   5.459   2.322
  378    HG2  LYS  46           HG2      LYS  46  17.718   2.801   1.430
  379    HG3  LYS  46           HG1      LYS  46  18.203   4.277   0.601
  380    HD2  LYS  46           HD2      LYS  46  18.899   5.256   2.778
  381    HD3  LYS  46           HD1      LYS  46  18.471   3.746   3.580
  382    HE2  LYS  46           HE2      LYS  46  20.896   3.865   3.069
  383    HE3  LYS  46           HE1      LYS  46  20.110   2.530   2.228
  384    HZ1  LYS  46           HZ1      LYS  46  20.087   5.014   0.771
  385    HZ2  LYS  46           HZ2      LYS  46  20.494   3.450   0.248
  386    HZ3  LYS  46           HZ3      LYS  46  21.645   4.406   1.052
  387    H    ALA  47           HN       ALA  47  13.165   3.340   1.914
  388    HA   ALA  47           HA       ALA  47  12.116   5.749   3.211
  389    HB1  ALA  47           HB1      ALA  47  10.575   3.488   1.895
  390    HB2  ALA  47           HB2      ALA  47  11.277   4.842   1.009
  391    HB3  ALA  47           HB3      ALA  47  10.007   5.130   2.197
  392    H    ASP  48           HN       ASP  48  11.176   5.837   5.207
  393    HA   ASP  48           HA       ASP  48  11.168   3.429   6.899
  394    HB2  ASP  48           HB2      ASP  48  11.784   5.712   7.747
  395    HB3  ASP  48           HB1      ASP  48  10.109   6.210   7.508
  396    H    HIS  49           HN       HIS  49   9.011   3.316   8.367
  397    HA   HIS  49           HA       HIS  49   6.954   2.316   6.678
  398    HB2  HIS  49           HB2      HIS  49   6.837   3.196   9.576
  399    HB3  HIS  49           HB1      HIS  49   5.565   2.289   8.759
  400    HD1  HIS  49           HD1      HIS  49   7.440   0.385   7.115
  401    HD2  HIS  49           HD2      HIS  49   7.811   1.127  11.200
  402    HE1  HIS  49           HE1      HIS  49   8.689  -1.590   8.091
  403    H    VAL  50           HN       VAL  50   7.145   5.411   8.481
  404    HA   VAL  50           HA       VAL  50   4.610   6.401   7.468
  405    HB   VAL  50           HB       VAL  50   7.050   7.920   8.502
  406   HG11  VAL  50          HG11      VAL  50   5.663   9.458   7.243
  407   HG12  VAL  50          HG12      VAL  50   5.352   9.743   8.952
  408   HG13  VAL  50          HG13      VAL  50   4.195   8.827   7.989
  409   HG21  VAL  50          HG21      VAL  50   6.136   6.418  10.201
  410   HG22  VAL  50          HG22      VAL  50   4.502   7.001   9.887
  411   HG23  VAL  50          HG23      VAL  50   5.700   8.077  10.603
  412    H    ASP  51           HN       ASP  51   8.000   6.973   6.478
  413    HA   ASP  51           HA       ASP  51   7.389   8.679   4.276
  414    HB2  ASP  51           HB2      ASP  51   9.676   8.365   5.235
  415    HB3  ASP  51           HB1      ASP  51   9.713   6.747   4.535
  416    H    LEU  52           HN       LEU  52   7.482   5.150   4.559
  417    HA   LEU  52           HA       LEU  52   7.437   4.449   1.838
  418    HB2  LEU  52           HB2      LEU  52   7.613   2.780   3.627
  419    HB3  LEU  52           HB1      LEU  52   5.974   3.147   4.152
  420    HG   LEU  52           HG       LEU  52   5.076   2.310   2.016
  421   HD11  LEU  52          HD11      LEU  52   6.725   2.742   0.374
  422   HD12  LEU  52          HD12      LEU  52   6.793   0.994   0.551
  423   HD13  LEU  52          HD13      LEU  52   8.011   2.003   1.331
  424   HD21  LEU  52          HD21      LEU  52   5.681  -0.076   2.339
  425   HD22  LEU  52          HD22      LEU  52   5.372   0.738   3.873
  426   HD23  LEU  52          HD23      LEU  52   7.029   0.420   3.363
  427    H    ALA  53           HN       ALA  53   4.637   5.113   3.978
  428    HA   ALA  53           HA       ALA  53   2.674   4.898   1.885
  429    HB1  ALA  53           HB1      ALA  53   2.064   4.794   4.265
  430    HB2  ALA  53           HB2      ALA  53   1.191   6.101   3.468
  431    HB3  ALA  53           HB3      ALA  53   2.585   6.464   4.484
  432    H    THR  54           HN       THR  54   4.779   7.507   2.934
  433    HA   THR  54           HA       THR  54   3.344   9.640   1.603
  434    HB   THR  54           HB       THR  54   6.296   9.473   2.293
  435    HG1  THR  54           HG1      THR  54   4.057  10.390   3.767
  436   HG21  THR  54          HG21      THR  54   4.444  11.815   1.760
  437   HG22  THR  54          HG22      THR  54   5.830  11.323   0.786
  438   HG23  THR  54          HG23      THR  54   6.076  11.965   2.409
  439    H    LEU  55           HN       LEU  55   5.908   7.399   0.577
  440    HA   LEU  55           HA       LEU  55   6.435   8.759  -1.924
  441    HB2  LEU  55           HB2      LEU  55   8.053   7.138  -0.852
  442    HB3  LEU  55           HB1      LEU  55   6.948   5.834  -1.276
  443    HG   LEU  55           HG       LEU  55   7.164   6.568  -3.704
  444   HD11  LEU  55          HD11      LEU  55   9.404   7.837  -4.123
  445   HD12  LEU  55          HD12      LEU  55   9.243   8.388  -2.458
  446   HD13  LEU  55          HD13      LEU  55   8.002   8.784  -3.645
  447   HD21  LEU  55          HD21      LEU  55   9.668   5.670  -2.236
  448   HD22  LEU  55          HD22      LEU  55   9.392   5.487  -3.969
  449   HD23  LEU  55          HD23      LEU  55   8.373   4.623  -2.817
  450    H    MET  56           HN       MET  56   4.222   6.207  -0.902
  451    HA   MET  56           HA       MET  56   3.374   5.518  -3.597
  452    HB2  MET  56           HB2      MET  56   2.090   5.088  -0.881
  453    HB3  MET  56           HB1      MET  56   1.403   4.473  -2.383
  454    HG2  MET  56           HG2      MET  56   3.358   3.108  -2.804
  455    HG3  MET  56           HG1      MET  56   4.230   3.850  -1.465
  456    HE1  MET  56           HE1      MET  56   1.232   2.021  -2.660
  457    HE2  MET  56           HE2      MET  56   0.280   2.642  -1.313
  458    HE3  MET  56           HE3      MET  56   0.720   0.938  -1.360
  459    H    ILE  57           HN       ILE  57   2.099   7.726  -1.088
  460    HA   ILE  57           HA       ILE  57  -0.168   8.511  -2.778
  461    HB   ILE  57           HB       ILE  57   0.923   9.893  -0.300
  462   HG12  ILE  57          HG12      ILE  57  -1.375   7.920  -0.539
  463   HG13  ILE  57          HG11      ILE  57   0.234   7.465   0.000
  464   HG21  ILE  57          HG21      ILE  57  -1.440  10.763  -0.183
  465   HG22  ILE  57          HG22      ILE  57  -1.710  10.088  -1.788
  466   HG23  ILE  57          HG23      ILE  57  -0.524  11.372  -1.559
  467   HD11  ILE  57          HD11      ILE  57  -0.459   7.972   2.092
  468   HD12  ILE  57          HD12      ILE  57  -1.917   8.754   1.493
  469   HD13  ILE  57          HD13      ILE  57  -0.421   9.673   1.631
  470    H    ASP  58           HN       ASP  58   3.044   9.883  -2.053
  471    HA   ASP  58           HA       ASP  58   2.501  12.359  -3.496
  472    HB2  ASP  58           HB2      ASP  58   5.103  11.101  -2.557
  473    HB3  ASP  58           HB1      ASP  58   4.973  12.724  -3.234
  474    H    PHE  59           HN       PHE  59   4.399   9.403  -4.291
  475    HA   PHE  59           HA       PHE  59   5.112  10.475  -6.910
  476    HB2  PHE  59           HB2      PHE  59   6.387   8.744  -5.428
  477    HB3  PHE  59           HB1      PHE  59   5.324   7.548  -6.160
  478    HD1  PHE  59           HD2      PHE  59   5.211   7.417  -8.720
  479    HD2  PHE  59           HD1      PHE  59   8.286   9.576  -6.632
  480    HE1  PHE  59           HE2      PHE  59   6.621   7.386 -10.759
  481    HE2  PHE  59           HE1      PHE  59   9.691   9.547  -8.673
  482    HZ   PHE  59           HZ       PHE  59   8.859   8.453 -10.735
  483    H    ASN  60           HN       ASN  60   2.714   7.964  -5.872
  484    HA   ASN  60           HA       ASN  60   1.843   7.695  -8.724
  485    HB2  ASN  60           HB2      ASN  60   1.087   6.184  -6.200
  486    HB3  ASN  60           HB1      ASN  60   0.383   5.859  -7.783
  487   HD21  ASN  60          HD21      ASN  60   3.786   6.800  -7.385
  488   HD22  ASN  60          HD22      ASN  60   4.431   5.298  -7.840
  489    H    GLY  61           HN       GLY  61   0.739   9.058  -5.674
  490    HA2  GLY  61           HA2      GLY  61  -0.915  10.840  -5.605
  491    HA3  GLY  61           HA1      GLY  61  -1.625  10.228  -7.096
  492    H    GLU  62           HN       GLU  62  -3.272  10.716  -4.932
  493    HA   GLU  62           HA       GLU  62  -3.672   8.392  -3.261
  494    HB2  GLU  62           HB2      GLU  62  -4.475  10.703  -2.710
  495    HB3  GLU  62           HB1      GLU  62  -5.679  10.546  -3.990
  496    HG2  GLU  62           HG2      GLU  62  -6.698   8.639  -2.867
  497    HG3  GLU  62           HG1      GLU  62  -5.429   8.641  -1.641
  498    H    GLU  63           HN       GLU  63  -4.879   9.368  -6.423
  499    HA   GLU  63           HA       GLU  63  -7.028   7.449  -6.538
  500    HB2  GLU  63           HB2      GLU  63  -6.891   9.459  -7.996
  501    HB3  GLU  63           HB1      GLU  63  -5.502   8.752  -8.815
  502    HG2  GLU  63           HG2      GLU  63  -6.855   6.885  -9.609
  503    HG3  GLU  63           HG1      GLU  63  -8.244   7.454  -8.682
  504    H    LYS  64           HN       LYS  64  -3.758   7.399  -8.045
  505    HA   LYS  64           HA       LYS  64  -4.103   4.665  -8.967
  506    HB2  LYS  64           HB2      LYS  64  -1.713   6.510  -8.770
  507    HB3  LYS  64           HB1      LYS  64  -1.544   4.852  -9.330
  508    HG2  LYS  64           HG2      LYS  64  -3.636   6.637 -10.604
  509    HG3  LYS  64           HG1      LYS  64  -1.954   6.815 -11.087
  510    HD2  LYS  64           HD2      LYS  64  -3.181   4.044 -11.064
  511    HD3  LYS  64           HD1      LYS  64  -3.538   5.131 -12.402
  512    HE2  LYS  64           HE2      LYS  64  -1.147   5.381 -12.880
  513    HE3  LYS  64           HE1      LYS  64  -0.741   4.360 -11.503
  514    HZ1  LYS  64           HZ1      LYS  64  -2.378   2.733 -12.726
  515    HZ2  LYS  64           HZ2      LYS  64  -0.735   2.816 -13.147
  516    HZ3  LYS  64           HZ3      LYS  64  -1.897   3.625 -14.086
  517    H    ALA  65           HN       ALA  65  -2.415   6.125  -6.162
  518    HA   ALA  65           HA       ALA  65  -1.156   3.791  -5.197
  519    HB1  ALA  65           HB1      ALA  65  -0.843   6.053  -4.221
  520    HB2  ALA  65           HB2      ALA  65  -1.215   4.845  -2.990
  521    HB3  ALA  65           HB3      ALA  65  -2.466   5.961  -3.537
  522    H    TRP  66           HN       TRP  66  -4.449   4.978  -4.446
  523    HA   TRP  66           HA       TRP  66  -5.217   2.824  -2.755
  524    HB2  TRP  66           HB2      TRP  66  -6.746   4.714  -4.564
  525    HB3  TRP  66           HB1      TRP  66  -7.603   3.435  -3.712
  526    HD1  TRP  66           HD1      TRP  66  -4.684   4.926  -1.824
  527    HE1  TRP  66           HE1      TRP  66  -5.584   6.398   0.091
  528    HE3  TRP  66           HE3      TRP  66  -9.626   5.106  -3.089
  529    HZ2  TRP  66           HZ2      TRP  66  -8.054   7.519   0.966
  530    HZ3  TRP  66           HZ3      TRP  66 -11.238   6.400  -1.686
  531    HH2  TRP  66           HH2      TRP  66 -10.450   7.599   0.330
  532    H    ALA  67           HN       ALA  67  -5.547   3.175  -6.300
  533    HA   ALA  67           HA       ALA  67  -6.859   0.729  -6.815
  534    HB1  ALA  67           HB1      ALA  67  -5.900   0.886  -9.082
  535    HB2  ALA  67           HB2      ALA  67  -4.746   2.093  -8.513
  536    HB3  ALA  67           HB3      ALA  67  -6.471   2.462  -8.536
  537    H    MET  68           HN       MET  68  -3.391   1.384  -6.387
  538    HA   MET  68           HA       MET  68  -2.610  -1.375  -6.953
  539    HB2  MET  68           HB2      MET  68  -1.180   1.035  -5.798
  540    HB3  MET  68           HB1      MET  68  -0.401  -0.545  -5.854
  541    HG2  MET  68           HG2      MET  68  -0.576  -0.634  -8.257
  542    HG3  MET  68           HG1      MET  68  -1.597   0.801  -8.295
  543    HE1  MET  68           HE1      MET  68   1.813  -0.657  -8.522
  544    HE2  MET  68           HE2      MET  68   1.817  -0.445  -6.773
  545    HE3  MET  68           HE3      MET  68   2.926   0.493  -7.769
  546    H    ALA  69           HN       ALA  69  -3.425   0.492  -4.071
  547    HA   ALA  69           HA       ALA  69  -2.454  -1.410  -2.150
  548    HB1  ALA  69           HB1      ALA  69  -3.840  -0.204  -0.540
  549    HB2  ALA  69           HB2      ALA  69  -4.773   0.526  -1.847
  550    HB3  ALA  69           HB3      ALA  69  -3.079   0.965  -1.622
  551    H    VAL  70           HN       VAL  70  -5.560  -1.044  -3.827
  552    HA   VAL  70           HA       VAL  70  -6.867  -3.182  -2.313
  553    HB   VAL  70           HB       VAL  70  -7.605  -1.892  -4.964
  554   HG11  VAL  70          HG11      VAL  70  -9.918  -2.734  -4.309
  555   HG12  VAL  70          HG12      VAL  70  -9.138  -3.690  -3.049
  556   HG13  VAL  70          HG13      VAL  70  -8.776  -4.005  -4.746
  557   HG21  VAL  70          HG21      VAL  70  -9.095  -0.499  -3.605
  558   HG22  VAL  70          HG22      VAL  70  -7.446  -0.339  -2.999
  559   HG23  VAL  70          HG23      VAL  70  -8.603  -1.354  -2.142
  560    H    TRP  71           HN       TRP  71  -5.510  -2.975  -5.639
  561    HA   TRP  71           HA       TRP  71  -6.112  -5.671  -6.324
  562    HB2  TRP  71           HB2      TRP  71  -5.421  -3.935  -7.986
  563    HB3  TRP  71           HB1      TRP  71  -3.778  -4.008  -7.355
  564    HD1  TRP  71           HD1      TRP  71  -6.250  -5.894  -9.505
  565    HE1  TRP  71           HE1      TRP  71  -5.062  -7.901 -10.606
  566    HE3  TRP  71           HE3      TRP  71  -1.814  -5.776  -6.992
  567    HZ2  TRP  71           HZ2      TRP  71  -2.555  -9.274 -10.438
  568    HZ3  TRP  71           HZ3      TRP  71  -0.044  -7.437  -7.475
  569    HH2  TRP  71           HH2      TRP  71  -0.408  -9.187  -9.196
  570    H    ILE  72           HN       ILE  72  -3.361  -4.325  -4.500
  571    HA   ILE  72           HA       ILE  72  -1.862  -6.846  -4.587
  572    HB   ILE  72           HB       ILE  72  -1.623  -4.335  -2.883
  573   HG12  ILE  72          HG12      ILE  72   0.325  -5.605  -4.840
  574   HG13  ILE  72          HG11      ILE  72  -0.853  -4.389  -5.313
  575   HG21  ILE  72          HG21      ILE  72  -0.913  -6.061  -1.369
  576   HG22  ILE  72          HG22      ILE  72   0.562  -5.391  -2.055
  577   HG23  ILE  72          HG23      ILE  72  -0.063  -6.927  -2.647
  578   HD11  ILE  72          HD11      ILE  72   1.163  -3.920  -3.101
  579   HD12  ILE  72          HD12      ILE  72   0.161  -2.722  -3.922
  580   HD13  ILE  72          HD13      ILE  72   1.477  -3.512  -4.786
  581    H    PHE  73           HN       PHE  73  -4.299  -5.448  -2.391
  582    HA   PHE  73           HA       PHE  73  -3.992  -7.224  -0.214
  583    HB2  PHE  73           HB2      PHE  73  -6.323  -5.689  -1.361
  584    HB3  PHE  73           HB1      PHE  73  -6.611  -6.814  -0.040
  585    HD1  PHE  73           HD2      PHE  73  -3.416  -4.867  -0.342
  586    HD2  PHE  73           HD1      PHE  73  -7.279  -5.114   1.546
  587    HE1  PHE  73           HE2      PHE  73  -2.733  -3.152   1.290
  588    HE2  PHE  73           HE1      PHE  73  -6.579  -3.386   3.175
  589    HZ   PHE  73           HZ       PHE  73  -4.309  -2.406   3.048
  590    H    ALA  74           HN       ALA  74  -6.026  -7.633  -3.159
  591    HA   ALA  74           HA       ALA  74  -7.029 -10.212  -2.396
  592    HB1  ALA  74           HB1      ALA  74  -7.631 -10.441  -4.784
  593    HB2  ALA  74           HB2      ALA  74  -6.620  -9.050  -5.174
  594    HB3  ALA  74           HB3      ALA  74  -8.063  -8.840  -4.181
  595    H    ALA  75           HN       ALA  75  -4.027  -9.181  -3.892
  596    HA   ALA  75           HA       ALA  75  -3.249 -11.714  -4.981
  597    HB1  ALA  75           HB1      ALA  75  -1.426  -9.548  -3.886
  598    HB2  ALA  75           HB2      ALA  75  -2.148  -9.510  -5.494
  599    HB3  ALA  75           HB3      ALA  75  -1.004 -10.784  -5.072
  600    H    ILE  76           HN       ILE  76  -2.544 -10.210  -1.809
  601    HA   ILE  76           HA       ILE  76  -1.195 -12.661  -0.874
  602    HB   ILE  76           HB       ILE  76  -1.053 -11.387   1.310
  603   HG12  ILE  76          HG12      ILE  76  -2.333  -9.165  -0.334
  604   HG13  ILE  76          HG11      ILE  76  -3.129 -10.042   0.970
  605   HG21  ILE  76          HG21      ILE  76  -0.095  -9.834  -1.122
  606   HG22  ILE  76          HG22      ILE  76   0.702 -11.269  -0.479
  607   HG23  ILE  76          HG23      ILE  76   0.610  -9.806   0.494
  608   HD11  ILE  76          HD11      ILE  76  -2.306  -8.021   1.943
  609   HD12  ILE  76          HD12      ILE  76  -0.732  -8.203   1.173
  610   HD13  ILE  76          HD13      ILE  76  -1.207  -9.291   2.479
  611    H    ASN  77           HN       ASN  77  -4.208 -12.440  -1.580
  612    HA   ASN  77           HA       ASN  77  -6.207 -13.346  -0.772
  613    HB2  ASN  77           HB2      ASN  77  -4.587 -15.319  -0.488
  614    HB3  ASN  77           HB1      ASN  77  -4.442 -14.846   1.204
  615   HD21  ASN  77          HD21      ASN  77  -5.743 -16.213   2.425
  616   HD22  ASN  77          HD22      ASN  77  -7.319 -16.689   2.009
  617    H    ARG  78           HN       ARG  78  -6.843 -11.275   0.098
  618    HA   ARG  78           HA       ARG  78  -7.339 -11.369   2.986
  619    HB2  ARG  78           HB2      ARG  78  -4.977 -10.308   2.531
  620    HB3  ARG  78           HB1      ARG  78  -5.875  -8.921   1.938
  621    HG2  ARG  78           HG2      ARG  78  -6.041  -8.178   4.105
  622    HG3  ARG  78           HG1      ARG  78  -7.088  -9.543   4.458
  623    HD2  ARG  78           HD2      ARG  78  -4.972 -10.903   4.894
  624    HD3  ARG  78           HD1      ARG  78  -4.076  -9.390   4.778
  625    HE   ARG  78           HE       ARG  78  -6.078  -8.851   6.630
  626   HH11  ARG  78          HH21      ARG  78  -3.600 -11.224   6.232
  627   HH12  ARG  78          HH22      ARG  78  -3.375 -11.464   7.933
  628   HH21  ARG  78          HH11      ARG  78  -5.793  -9.155   8.850
  629   HH22  ARG  78          HH12      ARG  78  -4.615 -10.293   9.413
  630    H    ARG  79           HN       ARG  79  -8.796 -11.336   0.438
  631    HA   ARG  79           HA       ARG  79  -9.928  -8.904  -0.313
  632    HB2  ARG  79           HB2      ARG  79 -11.987 -10.254  -0.885
  633    HB3  ARG  79           HB1      ARG  79 -10.479 -10.915  -1.514
  634    HG2  ARG  79           HG2      ARG  79 -10.360 -12.499   0.352
  635    HG3  ARG  79           HG1      ARG  79 -11.828 -11.815   1.050
  636    HD2  ARG  79           HD2      ARG  79 -11.691 -13.060  -1.709
  637    HD3  ARG  79           HD1      ARG  79 -12.234 -13.914  -0.265
  638    HE   ARG  79           HE       ARG  79 -13.800 -11.618  -0.322
  639   HH11  ARG  79          HH21      ARG  79 -13.063 -14.207  -2.486
  640   HH12  ARG  79          HH22      ARG  79 -14.600 -14.151  -3.283
  641   HH21  ARG  79          HH11      ARG  79 -15.806 -11.537  -1.352
  642   HH22  ARG  79          HH12      ARG  79 -16.151 -12.641  -2.641
  643    H    ASP  80           HN       ASP  80 -10.654 -10.784   2.601
  644    HA   ASP  80           HA       ASP  80 -13.078  -9.494   3.332
  645    HB2  ASP  80           HB2      ASP  80 -12.473 -10.137   5.673
  646    HB3  ASP  80           HB1      ASP  80 -12.234 -11.470   4.539
  647    H    LEU  81           HN       LEU  81  -9.705  -8.551   3.902
  648    HA   LEU  81           HA       LEU  81 -10.305  -6.290   5.539
  649    HB2  LEU  81           HB2      LEU  81  -8.056  -7.379   5.366
  650    HB3  LEU  81           HB1      LEU  81  -7.883  -6.699   3.754
  651    HG   LEU  81           HG       LEU  81  -8.107  -4.411   4.721
  652   HD11  LEU  81          HD11      LEU  81  -7.645  -4.409   7.339
  653   HD12  LEU  81          HD12      LEU  81  -8.421  -5.988   7.280
  654   HD13  LEU  81          HD13      LEU  81  -9.291  -4.554   6.737
  655   HD21  LEU  81          HD21      LEU  81  -5.938  -6.082   6.037
  656   HD22  LEU  81          HD22      LEU  81  -5.859  -4.358   5.677
  657   HD23  LEU  81          HD23      LEU  81  -5.890  -5.531   4.363
  658    H    TYR  82           HN       TYR  82 -10.410  -6.731   2.049
  659    HA   TYR  82           HA       TYR  82 -10.294  -3.910   1.399
  660    HB2  TYR  82           HB2      TYR  82  -9.823  -5.311  -0.445
  661    HB3  TYR  82           HB1      TYR  82 -11.129  -6.415  -0.056
  662    HD1  TYR  82           HD1      TYR  82 -11.253  -2.679  -0.375
  663    HD2  TYR  82           HD2      TYR  82 -12.447  -6.456  -2.049
  664    HE1  TYR  82           HE1      TYR  82 -12.709  -1.504  -1.992
  665    HE2  TYR  82           HE2      TYR  82 -13.904  -5.273  -3.664
  666    HH   TYR  82           HH       TYR  82 -14.394  -3.255  -4.560
  667    H    GLU  83           HN       GLU  83 -12.890  -6.179   2.224
  668    HA   GLU  83           HA       GLU  83 -15.080  -4.456   1.569
  669    HB2  GLU  83           HB2      GLU  83 -14.763  -6.729   3.553
  670    HB3  GLU  83           HB1      GLU  83 -16.288  -5.859   3.390
  671    HG2  GLU  83           HG2      GLU  83 -16.367  -7.834   1.980
  672    HG3  GLU  83           HG1      GLU  83 -16.281  -6.413   0.942
  673    H    LYS  84           HN       LYS  84 -13.177  -4.847   4.564
  674    HA   LYS  84           HA       LYS  84 -14.705  -2.862   6.032
  675    HB2  LYS  84           HB2      LYS  84 -13.307  -4.647   7.102
  676    HB3  LYS  84           HB1      LYS  84 -11.868  -3.798   6.539
  677    HG2  LYS  84           HG2      LYS  84 -12.464  -1.824   7.834
  678    HG3  LYS  84           HG1      LYS  84 -13.997  -2.558   8.308
  679    HD2  LYS  84           HD2      LYS  84 -12.793  -4.342   9.497
  680    HD3  LYS  84           HD1      LYS  84 -11.251  -3.646   8.999
  681    HE2  LYS  84           HE2      LYS  84 -11.870  -1.535  10.186
  682    HE3  LYS  84           HE1      LYS  84 -13.332  -2.331  10.768
  683    HZ1  LYS  84           HZ1      LYS  84 -12.105  -3.822  12.041
  684    HZ2  LYS  84           HZ2      LYS  84 -11.297  -2.346  12.273
  685    HZ3  LYS  84           HZ3      LYS  84 -10.660  -3.509  11.212
  686    H    ALA  85           HN       ALA  85 -11.588  -2.778   4.280
  687    HA   ALA  85           HA       ALA  85 -10.850  -0.124   4.867
  688    HB1  ALA  85           HB1      ALA  85  -9.671  -0.168   2.649
  689    HB2  ALA  85           HB2      ALA  85 -10.484  -1.692   2.300
  690    HB3  ALA  85           HB3      ALA  85  -9.347  -1.590   3.643
  691    H    LYS  86           HN       LYS  86 -13.260  -1.348   2.620
  692    HA   LYS  86           HA       LYS  86 -13.697   1.176   1.261
  693    HB2  LYS  86           HB2      LYS  86 -14.384  -1.078   0.335
  694    HB3  LYS  86           HB1      LYS  86 -15.672  -1.126   1.538
  695    HG2  LYS  86           HG2      LYS  86 -16.602   0.981   0.653
  696    HG3  LYS  86           HG1      LYS  86 -15.316   1.055  -0.549
  697    HD2  LYS  86           HD2      LYS  86 -17.093  -1.400  -0.399
  698    HD3  LYS  86           HD1      LYS  86 -17.668   0.044  -1.226
  699    HE2  LYS  86           HE2      LYS  86 -15.110  -1.458  -1.881
  700    HE3  LYS  86           HE1      LYS  86 -16.599  -1.490  -2.818
  701    HZ1  LYS  86           HZ1      LYS  86 -15.655   0.196  -3.914
  702    HZ2  LYS  86           HZ2      LYS  86 -14.563   0.552  -2.664
  703    HZ3  LYS  86           HZ3      LYS  86 -16.155   1.140  -2.597
  704    H    ARG  87           HN       ARG  87 -14.875  -0.225   4.278
  705    HA   ARG  87           HA       ARG  87 -17.089   1.686   4.530
  706    HB2  ARG  87           HB2      ARG  87 -15.780  -0.084   6.620
  707    HB3  ARG  87           HB1      ARG  87 -17.306   0.776   6.809
  708    HG2  ARG  87           HG2      ARG  87 -16.742  -1.337   4.709
  709    HG3  ARG  87           HG1      ARG  87 -17.635  -1.620   6.197
  710    HD2  ARG  87           HD2      ARG  87 -19.087   0.464   5.260
  711    HD3  ARG  87           HD1      ARG  87 -18.508  -0.161   3.720
  712    HE   ARG  87           HE       ARG  87 -20.618  -1.263   5.263
  713   HH11  ARG  87          HH21      ARG  87 -17.740  -2.305   3.662
  714   HH12  ARG  87          HH22      ARG  87 -18.212  -3.967   3.632
  715   HH21  ARG  87          HH11      ARG  87 -21.247  -3.415   5.202
  716   HH22  ARG  87          HH12      ARG  87 -20.196  -4.594   4.492
  717    H    ASP  88           HN       ASP  88 -13.703   1.568   5.461
  718    HA   ASP  88           HA       ASP  88 -13.979   3.999   7.167
  719    HB2  ASP  88           HB2      ASP  88 -11.652   2.155   6.526
  720    HB3  ASP  88           HB1      ASP  88 -11.490   3.602   7.521
  721    H    GLU  89           HN       GLU  89 -13.615   3.308   3.933
  722    HA   GLU  89           HA       GLU  89 -11.576   4.978   2.918
  723    HB2  GLU  89           HB2      GLU  89 -12.941   3.445   1.566
  724    HB3  GLU  89           HB1      GLU  89 -14.368   4.430   1.853
  725    HG2  GLU  89           HG2      GLU  89 -13.351   6.302   0.623
  726    HG3  GLU  89           HG1      GLU  89 -11.883   5.353   0.382
  727    HA   PRO  90           HA       PRO  90 -13.547   8.779   4.612
  728    HB2  PRO  90           HB2      PRO  90 -11.381  10.453   3.630
  729    HB3  PRO  90           HB1      PRO  90 -11.698   9.975   5.304
  730    HG2  PRO  90           HG2      PRO  90  -9.559   9.031   3.594
  731    HG3  PRO  90           HG1      PRO  90  -9.905   8.533   5.256
  732    HD2  PRO  90           HD2      PRO  90 -10.363   7.020   2.803
  733    HD3  PRO  90           HD1      PRO  90 -10.605   6.484   4.470
  734    H    LYS  91           HN       LYS  91 -14.642  10.529   3.549
  735    HA   LYS  91           HA       LYS  91 -15.792  11.502   1.767
  736    HB2  LYS  91           HB2      LYS  91 -13.417  12.311   1.344
  737    HB3  LYS  91           HB1      LYS  91 -13.248  10.990   0.191
  738    HG2  LYS  91           HG2      LYS  91 -14.966  11.880  -1.231
  739    HG3  LYS  91           HG1      LYS  91 -15.486  13.032  -0.007
  740    HD2  LYS  91           HD2      LYS  91 -14.129  14.104  -1.788
  741    HD3  LYS  91           HD1      LYS  91 -13.383  14.253  -0.198
  742    HE2  LYS  91           HE2      LYS  91 -11.851  13.547  -2.170
  743    HE3  LYS  91           HE1      LYS  91 -11.739  12.605  -0.686
  744    HZ1  LYS  91           HZ1      LYS  91 -12.049  11.463  -3.011
  745    HZ2  LYS  91           HZ2      LYS  91 -13.691  11.773  -2.703
  746    HZ3  LYS  91           HZ3      LYS  91 -12.784  10.832  -1.618
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1 -10.515  15.810  15.510
    2    H2   MET   1           HT2      MET   1  -9.012  15.238  16.057
    3    H3   MET   1           HT3      MET   1 -10.171  14.150  15.458
    4    HA   MET   1           HA       MET   1 -10.007  15.208  13.260
    5    HB2  MET   1           HB2      MET   1  -7.705  16.669  14.592
    6    HB3  MET   1           HB1      MET   1  -8.109  16.737  12.876
    7    HG2  MET   1           HG2      MET   1 -10.322  17.682  13.435
    8    HG3  MET   1           HG1      MET   1  -9.912  17.623  15.149
    9    HE1  MET   1           HE1      MET   1 -10.942  20.159  14.024
   10    HE2  MET   1           HE2      MET   1  -9.799  21.399  14.535
   11    HE3  MET   1           HE3      MET   1 -10.252  20.115  15.653
   12    H    ALA   2           HN       ALA   2  -8.366  14.366  11.746
   13    HA   ALA   2           HA       ALA   2  -6.073  12.884  12.754
   14    HB1  ALA   2           HB1      ALA   2  -7.881  11.335  13.413
   15    HB2  ALA   2           HB2      ALA   2  -6.896  10.640  12.126
   16    HB3  ALA   2           HB3      ALA   2  -8.479  11.324  11.754
   17    H    SER   3           HN       SER   3  -4.667  13.333  11.133
   18    HA   SER   3           HA       SER   3  -5.521  13.976   8.444
   19    HB2  SER   3           HB2      SER   3  -3.375  14.777   9.608
   20    HB3  SER   3           HB1      SER   3  -2.715  13.171   9.307
   21    HG   SER   3           HG       SER   3  -3.347  15.232   7.531
   22    H    THR   4           HN       THR   4  -5.179  12.707   6.528
   23    HA   THR   4           HA       THR   4  -5.738   9.896   6.856
   24    HB   THR   4           HB       THR   4  -4.688  11.206   4.324
   25    HG1  THR   4           HG1      THR   4  -7.391  11.012   4.622
   26   HG21  THR   4          HG21      THR   4  -6.656   8.940   4.764
   27   HG22  THR   4          HG22      THR   4  -4.955   8.725   4.351
   28   HG23  THR   4          HG23      THR   4  -6.045   9.514   3.212
   29    H    ARG   5           HN       ARG   5  -2.814  11.727   6.740
   30    HA   ARG   5           HA       ARG   5  -1.007   9.779   5.725
   31    HB2  ARG   5           HB2      ARG   5  -0.473  12.197   6.192
   32    HB3  ARG   5           HB1      ARG   5  -0.433  11.803   7.910
   33    HG2  ARG   5           HG2      ARG   5   1.369  10.190   7.530
   34    HG3  ARG   5           HG1      ARG   5   1.299  10.492   5.794
   35    HD2  ARG   5           HD2      ARG   5   3.127  11.792   6.722
   36    HD3  ARG   5           HD1      ARG   5   1.840  12.900   6.248
   37    HE   ARG   5           HE       ARG   5   1.296  12.343   8.915
   38   HH11  ARG   5          HH21      ARG   5   4.004  13.485   7.099
   39   HH12  ARG   5          HH22      ARG   5   4.634  14.443   8.396
   40   HH21  ARG   5          HH11      ARG   5   2.110  13.588  10.612
   41   HH22  ARG   5          HH12      ARG   5   3.563  14.502  10.383
   42    H    CYS   6           HN       CYS   6  -1.931  10.460   9.124
   43    HA   CYS   6           HA       CYS   6  -0.435   8.218  10.168
   44    HB2  CYS   6           HB2      CYS   6  -1.766   8.628  12.244
   45    HB3  CYS   6           HB1      CYS   6  -1.001  10.090  11.619
   46    HG   CYS   6           HG       CYS   6  -4.040   9.445  11.230
   47    H    LYS   7           HN       LYS   7  -3.665   8.609   8.871
   48    HA   LYS   7           HA       LYS   7  -4.753   6.162   9.967
   49    HB2  LYS   7           HB2      LYS   7  -6.093   8.110   9.044
   50    HB3  LYS   7           HB1      LYS   7  -5.625   7.580   7.429
   51    HG2  LYS   7           HG2      LYS   7  -6.682   5.403   7.798
   52    HG3  LYS   7           HG1      LYS   7  -7.081   5.852   9.457
   53    HD2  LYS   7           HD2      LYS   7  -8.428   7.767   8.555
   54    HD3  LYS   7           HD1      LYS   7  -8.127   7.157   6.927
   55    HE2  LYS   7           HE2      LYS   7  -9.244   5.055   7.463
   56    HE3  LYS   7           HE1      LYS   7  -9.448   5.556   9.141
   57    HZ1  LYS   7           HZ1      LYS   7 -10.743   7.481   8.279
   58    HZ2  LYS   7           HZ2      LYS   7 -11.475   5.972   8.010
   59    HZ3  LYS   7           HZ3      LYS   7 -10.688   6.775   6.737
   60    H    LEU   8           HN       LEU   8  -3.225   7.001   6.849
   61    HA   LEU   8           HA       LEU   8  -3.553   4.357   5.718
   62    HB2  LEU   8           HB2      LEU   8  -2.967   6.650   4.581
   63    HB3  LEU   8           HB1      LEU   8  -1.300   6.254   4.967
   64    HG   LEU   8           HG       LEU   8  -3.050   4.253   3.476
   65   HD11  LEU   8          HD11      LEU   8  -1.416   6.484   2.236
   66   HD12  LEU   8          HD12      LEU   8  -3.175   6.358   2.208
   67   HD13  LEU   8          HD13      LEU   8  -2.192   5.168   1.355
   68   HD21  LEU   8          HD21      LEU   8  -0.055   4.776   3.588
   69   HD22  LEU   8          HD22      LEU   8  -0.816   3.589   2.532
   70   HD23  LEU   8          HD23      LEU   8  -0.905   3.397   4.275
   71    H    ALA   9           HN       ALA   9  -0.865   5.917   7.490
   72    HA   ALA   9           HA       ALA   9   0.932   3.694   7.322
   73    HB1  ALA   9           HB1      ALA   9   2.086   4.691   9.231
   74    HB2  ALA   9           HB2      ALA   9   0.680   5.695   9.586
   75    HB3  ALA   9           HB3      ALA   9   1.606   5.967   8.110
   76    H    ARG  10           HN       ARG  10  -1.630   4.526   9.618
   77    HA   ARG  10           HA       ARG  10  -1.171   2.486  11.519
   78    HB2  ARG  10           HB2      ARG  10  -2.831   4.405  11.693
   79    HB3  ARG  10           HB1      ARG  10  -3.906   3.476  10.652
   80    HG2  ARG  10           HG2      ARG  10  -3.796   1.591  12.295
   81    HG3  ARG  10           HG1      ARG  10  -2.834   2.620  13.357
   82    HD2  ARG  10           HD2      ARG  10  -4.690   4.285  13.375
   83    HD3  ARG  10           HD1      ARG  10  -5.662   3.175  12.407
   84    HE   ARG  10           HE       ARG  10  -4.893   1.649  14.593
   85   HH11  ARG  10          HH21      ARG  10  -6.435   4.702  14.101
   86   HH12  ARG  10          HH22      ARG  10  -7.382   4.601  15.548
   87   HH21  ARG  10          HH11      ARG  10  -6.124   1.507  16.479
   88   HH22  ARG  10          HH12      ARG  10  -7.207   2.795  16.892
   89    H    TYR  11           HN       TYR  11  -2.742   2.356   8.361
   90    HA   TYR  11           HA       TYR  11  -3.892  -0.276   8.716
   91    HB2  TYR  11           HB2      TYR  11  -3.397   1.577   6.401
   92    HB3  TYR  11           HB1      TYR  11  -3.674  -0.116   6.012
   93    HD1  TYR  11           HD1      TYR  11  -5.115   2.110   8.680
   94    HD2  TYR  11           HD2      TYR  11  -5.897  -0.302   5.208
   95    HE1  TYR  11           HE1      TYR  11  -7.552   2.461   8.977
   96    HE2  TYR  11           HE2      TYR  11  -8.332   0.042   5.513
   97    HH   TYR  11           HH       TYR  11  -9.815   0.690   7.859
   98    H    LEU  12           HN       LEU  12  -0.959   0.786   6.917
   99    HA   LEU  12           HA       LEU  12  -0.058  -1.906   6.448
  100    HB2  LEU  12           HB2      LEU  12   1.798   0.487   6.705
  101    HB3  LEU  12           HB1      LEU  12   2.019  -0.955   5.718
  102    HG   LEU  12           HG       LEU  12  -0.252   1.038   5.209
  103   HD11  LEU  12          HD11      LEU  12   2.466   0.874   3.856
  104   HD12  LEU  12          HD12      LEU  12   1.977   2.139   4.981
  105   HD13  LEU  12          HD13      LEU  12   1.154   1.973   3.431
  106   HD21  LEU  12          HD21      LEU  12  -0.081  -0.035   2.893
  107   HD22  LEU  12          HD22      LEU  12  -0.691  -1.095   4.153
  108   HD23  LEU  12          HD23      LEU  12   0.980  -1.246   3.609
  109    H    GLU  13           HN       GLU  13   0.164   0.226   9.169
  110    HA   GLU  13           HA       GLU  13   2.266  -1.322  10.518
  111    HB2  GLU  13           HB2      GLU  13   1.766   1.206  10.802
  112    HB3  GLU  13           HB1      GLU  13   0.414   0.712  11.815
  113    HG2  GLU  13           HG2      GLU  13   3.287  -0.148  12.297
  114    HG3  GLU  13           HG1      GLU  13   2.529   1.236  13.080
  115    H    ASP  14           HN       ASP  14  -1.250  -1.212  10.462
  116    HA   ASP  14           HA       ASP  14  -1.661  -2.745  12.872
  117    HB2  ASP  14           HB2      ASP  14  -3.455  -1.394  11.857
  118    HB3  ASP  14           HB1      ASP  14  -3.465  -2.450  10.446
  119    H    LEU  15           HN       LEU  15  -0.167  -3.694  10.032
  120    HA   LEU  15           HA       LEU  15  -1.251  -6.487  10.089
  121    HB2  LEU  15           HB2      LEU  15   0.934  -5.359   8.309
  122    HB3  LEU  15           HB1      LEU  15   0.057  -6.870   8.094
  123    HG   LEU  15           HG       LEU  15  -1.036  -4.049   7.819
  124   HD11  LEU  15          HD11      LEU  15  -0.973  -6.361   5.853
  125   HD12  LEU  15          HD12      LEU  15   0.237  -5.079   5.897
  126   HD13  LEU  15          HD13      LEU  15  -1.442  -4.696   5.515
  127   HD21  LEU  15          HD21      LEU  15  -2.490  -6.711   7.978
  128   HD22  LEU  15          HD22      LEU  15  -3.195  -5.323   7.145
  129   HD23  LEU  15          HD23      LEU  15  -2.836  -5.225   8.864
  130    H    GLU  16           HN       GLU  16   0.456  -8.261  10.053
  131    HA   GLU  16           HA       GLU  16   2.091  -8.002  12.443
  132    HB2  GLU  16           HB2      GLU  16   1.417 -10.155  10.476
  133    HB3  GLU  16           HB1      GLU  16   2.956 -10.362  11.302
  134    HG2  GLU  16           HG2      GLU  16   1.814 -10.166  13.485
  135    HG3  GLU  16           HG1      GLU  16   0.267  -9.968  12.662
  136    H    ASP  17           HN       ASP  17   4.476  -8.501  12.416
  137    HA   ASP  17           HA       ASP  17   5.856  -6.645  10.724
  138    HB2  ASP  17           HB2      ASP  17   7.009  -8.936  12.343
  139    HB3  ASP  17           HB1      ASP  17   7.894  -7.531  11.745
  140    H    VAL  18           HN       VAL  18   5.744 -10.238  10.680
  141    HA   VAL  18           HA       VAL  18   7.431 -10.440   8.340
  142    HB   VAL  18           HB       VAL  18   5.397 -12.421   9.451
  143   HG11  VAL  18          HG11      VAL  18   6.819 -14.079   8.155
  144   HG12  VAL  18          HG12      VAL  18   7.598 -12.704   7.372
  145   HG13  VAL  18          HG13      VAL  18   5.873 -12.990   7.141
  146   HG21  VAL  18          HG21      VAL  18   8.419 -12.297   9.758
  147   HG22  VAL  18          HG22      VAL  18   7.335 -13.469  10.506
  148   HG23  VAL  18          HG23      VAL  18   7.274 -11.776  10.993
  149    H    ASP  19           HN       ASP  19   3.940 -10.042   8.832
  150    HA   ASP  19           HA       ASP  19   3.218 -10.572   6.081
  151    HB2  ASP  19           HB2      ASP  19   1.820  -8.988   8.262
  152    HB3  ASP  19           HB1      ASP  19   1.105  -9.362   6.694
  153    H    LEU  20           HN       LEU  20   4.423  -7.811   7.858
  154    HA   LEU  20           HA       LEU  20   3.796  -5.802   5.904
  155    HB2  LEU  20           HB2      LEU  20   4.516  -5.380   8.304
  156    HB3  LEU  20           HB1      LEU  20   6.142  -5.854   7.830
  157    HG   LEU  20           HG       LEU  20   5.883  -3.995   5.967
  158   HD11  LEU  20          HD11      LEU  20   3.504  -3.509   6.284
  159   HD12  LEU  20          HD12      LEU  20   4.450  -2.096   6.734
  160   HD13  LEU  20          HD13      LEU  20   3.781  -3.140   7.984
  161   HD21  LEU  20          HD21      LEU  20   6.693  -2.270   7.560
  162   HD22  LEU  20          HD22      LEU  20   7.469  -3.830   7.831
  163   HD23  LEU  20          HD23      LEU  20   6.179  -3.290   8.904
  164    H    LYS  21           HN       LYS  21   6.357  -8.146   6.296
  165    HA   LYS  21           HA       LYS  21   8.207  -7.068   4.389
  166    HB2  LYS  21           HB2      LYS  21   8.728  -8.834   6.100
  167    HB3  LYS  21           HB1      LYS  21   7.793  -9.978   5.137
  168    HG2  LYS  21           HG2      LYS  21   9.295  -9.642   3.230
  169    HG3  LYS  21           HG1      LYS  21  10.205  -8.435   4.139
  170    HD2  LYS  21           HD2      LYS  21  10.834 -10.122   5.802
  171    HD3  LYS  21           HD1      LYS  21   9.871 -11.336   4.959
  172    HE2  LYS  21           HE2      LYS  21  12.301  -9.893   3.863
  173    HE3  LYS  21           HE1      LYS  21  12.215 -11.590   4.334
  174    HZ1  LYS  21           HZ1      LYS  21  10.866 -10.248   2.069
  175    HZ2  LYS  21           HZ2      LYS  21  10.356 -11.762   2.648
  176    HZ3  LYS  21           HZ3      LYS  21  11.927 -11.572   2.028
  177    H    LYS  22           HN       LYS  22   5.565  -9.457   4.072
  178    HA   LYS  22           HA       LYS  22   6.066 -10.035   1.301
  179    HB2  LYS  22           HB2      LYS  22   3.693 -10.355   3.143
  180    HB3  LYS  22           HB1      LYS  22   3.452 -10.596   1.415
  181    HG2  LYS  22           HG2      LYS  22   3.957 -12.730   2.513
  182    HG3  LYS  22           HG1      LYS  22   5.260 -12.292   1.409
  183    HD2  LYS  22           HD2      LYS  22   6.631 -11.497   3.245
  184    HD3  LYS  22           HD1      LYS  22   5.303 -11.712   4.385
  185    HE2  LYS  22           HE2      LYS  22   6.668 -13.923   2.821
  186    HE3  LYS  22           HE1      LYS  22   6.895 -13.587   4.537
  187    HZ1  LYS  22           HZ1      LYS  22   5.292 -15.204   4.588
  188    HZ2  LYS  22           HZ2      LYS  22   4.551 -14.688   3.150
  189    HZ3  LYS  22           HZ3      LYS  22   4.324 -13.811   4.588
  190    H    PHE  23           HN       PHE  23   4.371  -7.380   2.889
  191    HA   PHE  23           HA       PHE  23   3.010  -6.445   0.502
  192    HB2  PHE  23           HB2      PHE  23   2.393  -5.780   2.846
  193    HB3  PHE  23           HB1      PHE  23   3.865  -4.815   2.916
  194    HD1  PHE  23           HD1      PHE  23   4.204  -2.919   1.291
  195    HD2  PHE  23           HD2      PHE  23   0.445  -4.969   1.683
  196    HE1  PHE  23           HE1      PHE  23   3.061  -1.049   0.136
  197    HE2  PHE  23           HE2      PHE  23  -0.691  -3.097   0.523
  198    HZ   PHE  23           HZ       PHE  23   0.613  -1.137  -0.248
  199    H    LYS  24           HN       LYS  24   6.141  -5.570   2.014
  200    HA   LYS  24           HA       LYS  24   6.752  -3.548   0.035
  201    HB2  LYS  24           HB2      LYS  24   8.600  -5.085   1.883
  202    HB3  LYS  24           HB1      LYS  24   9.014  -3.611   1.008
  203    HG2  LYS  24           HG2      LYS  24   7.086  -2.473   2.198
  204    HG3  LYS  24           HG1      LYS  24   6.932  -3.920   3.191
  205    HD2  LYS  24           HD2      LYS  24   9.469  -2.267   2.946
  206    HD3  LYS  24           HD1      LYS  24   8.311  -2.121   4.265
  207    HE2  LYS  24           HE2      LYS  24   8.679  -4.668   4.625
  208    HE3  LYS  24           HE1      LYS  24  10.107  -4.464   3.609
  209    HZ1  LYS  24           HZ1      LYS  24  11.179  -3.675   5.351
  210    HZ2  LYS  24           HZ2      LYS  24   9.794  -3.844   6.320
  211    HZ3  LYS  24           HZ3      LYS  24  10.074  -2.395   5.479
  212    H    MET  25           HN       MET  25   7.821  -6.934   0.495
  213    HA   MET  25           HA       MET  25   9.547  -7.048  -1.753
  214    HB2  MET  25           HB2      MET  25   9.362  -8.815   0.016
  215    HB3  MET  25           HB1      MET  25   7.823  -9.308  -0.691
  216    HG2  MET  25           HG2      MET  25   8.906  -9.860  -2.795
  217    HG3  MET  25           HG1      MET  25  10.445  -9.226  -2.212
  218    HE1  MET  25           HE1      MET  25  10.931 -13.093  -2.470
  219    HE2  MET  25           HE2      MET  25  11.331 -11.508  -3.126
  220    HE3  MET  25           HE3      MET  25   9.739 -12.201  -3.425
  221    H    HIS  26           HN       HIS  26   6.033  -7.525  -1.518
  222    HA   HIS  26           HA       HIS  26   5.716  -8.347  -4.293
  223    HB2  HIS  26           HB2      HIS  26   3.786  -7.216  -2.225
  224    HB3  HIS  26           HB1      HIS  26   3.267  -7.684  -3.845
  225    HD1  HIS  26           HD1      HIS  26   5.770  -9.511  -1.635
  226    HD2  HIS  26           HD2      HIS  26   1.990 -10.095  -3.293
  227    HE1  HIS  26           HE1      HIS  26   5.132 -11.910  -1.133
  228    H    LEU  27           HN       LEU  27   5.840  -5.233  -2.629
  229    HA   LEU  27           HA       LEU  27   4.774  -3.666  -4.812
  230    HB2  LEU  27           HB2      LEU  27   5.086  -2.904  -2.392
  231    HB3  LEU  27           HB1      LEU  27   6.805  -2.761  -2.741
  232    HG   LEU  27           HG       LEU  27   6.014  -1.248  -4.767
  233   HD11  LEU  27          HD11      LEU  27   3.933   0.037  -4.200
  234   HD12  LEU  27          HD12      LEU  27   3.598  -1.130  -2.923
  235   HD13  LEU  27          HD13      LEU  27   3.608  -1.644  -4.608
  236   HD21  LEU  27          HD21      LEU  27   5.829  -0.309  -1.885
  237   HD22  LEU  27          HD22      LEU  27   6.019   0.749  -3.284
  238   HD23  LEU  27          HD23      LEU  27   7.296  -0.391  -2.861
  239    H    GLU  28           HN       GLU  28   8.084  -4.642  -3.923
  240    HA   GLU  28           HA       GLU  28   9.359  -3.167  -6.045
  241    HB2  GLU  28           HB2      GLU  28  10.316  -5.675  -4.626
  242    HB3  GLU  28           HB1      GLU  28  11.318  -4.574  -5.570
  243    HG2  GLU  28           HG2      GLU  28   9.741  -3.744  -3.116
  244    HG3  GLU  28           HG1      GLU  28  11.450  -4.177  -3.091
  245    H    ASP  29           HN       ASP  29   7.881  -6.361  -5.843
  246    HA   ASP  29           HA       ASP  29   8.829  -7.111  -8.553
  247    HB2  ASP  29           HB2      ASP  29   6.986  -8.524  -6.599
  248    HB3  ASP  29           HB1      ASP  29   7.574  -9.203  -8.117
  249    H    TYR  30           HN       TYR  30   7.002  -4.772  -8.141
  250    HA   TYR  30           HA       TYR  30   4.343  -5.436  -8.882
  251    HB2  TYR  30           HB2      TYR  30   5.022  -3.221  -8.027
  252    HB3  TYR  30           HB1      TYR  30   5.897  -2.923  -9.529
  253    HD1  TYR  30           HD1      TYR  30   2.545  -3.416  -8.026
  254    HD2  TYR  30           HD2      TYR  30   4.718  -2.375 -11.585
  255    HE1  TYR  30           HE1      TYR  30   0.443  -2.630  -9.081
  256    HE2  TYR  30           HE2      TYR  30   2.614  -1.589 -12.637
  257    HH   TYR  30           HH       TYR  30  -0.330  -1.244 -10.824
  258    HA   PRO  31           HA       PRO  31   5.575  -6.700 -13.072
  259    HB2  PRO  31           HB2      PRO  31   2.878  -6.945 -14.049
  260    HB3  PRO  31           HB1      PRO  31   3.934  -8.252 -13.497
  261    HG2  PRO  31           HG2      PRO  31   1.619  -7.094 -12.115
  262    HG3  PRO  31           HG1      PRO  31   2.557  -8.528 -11.671
  263    HD2  PRO  31           HD2      PRO  31   2.626  -5.948 -10.385
  264    HD3  PRO  31           HD1      PRO  31   3.657  -7.353 -10.024
  265    HA   PRO  32           HA       PRO  32   4.997  -2.457 -14.613
  266    HB2  PRO  32           HB2      PRO  32   6.170  -2.911 -17.188
  267    HB3  PRO  32           HB1      PRO  32   6.995  -2.279 -15.756
  268    HG2  PRO  32           HG2      PRO  32   7.209  -4.969 -16.956
  269    HG3  PRO  32           HG1      PRO  32   8.253  -4.215 -15.741
  270    HD2  PRO  32           HD2      PRO  32   6.315  -6.269 -15.265
  271    HD3  PRO  32           HD1      PRO  32   7.191  -5.336 -14.030
  272    H    GLN  33           HN       GLN  33   3.226  -1.587 -15.673
  273    HA   GLN  33           HA       GLN  33   1.512  -3.435 -17.277
  274    HB2  GLN  33           HB2      GLN  33   0.580  -2.130 -15.308
  275    HB3  GLN  33           HB1      GLN  33   0.855  -0.657 -16.235
  276    HG2  GLN  33           HG2      GLN  33  -1.433  -1.292 -16.593
  277    HG3  GLN  33           HG1      GLN  33  -0.567  -1.667 -18.077
  278   HE21  GLN  33          HE21      GLN  33  -2.045  -3.125 -15.187
  279   HE22  GLN  33          HE22      GLN  33  -2.094  -4.706 -15.802
  280    H    LYS  34           HN       LYS  34   2.952  -0.157 -17.454
  281    HA   LYS  34           HA       LYS  34   3.445  -0.408 -20.283
  282    HB2  LYS  34           HB2      LYS  34   0.913  -0.028 -20.189
  283    HB3  LYS  34           HB1      LYS  34   1.263   1.564 -19.529
  284    HG2  LYS  34           HG2      LYS  34   1.090   2.054 -21.824
  285    HG3  LYS  34           HG1      LYS  34   2.826   1.812 -21.664
  286    HD2  LYS  34           HD2      LYS  34   2.593  -0.504 -22.475
  287    HD3  LYS  34           HD1      LYS  34   0.843  -0.310 -22.563
  288    HE2  LYS  34           HE2      LYS  34   2.857   1.335 -24.120
  289    HE3  LYS  34           HE1      LYS  34   1.915  -0.003 -24.776
  290    HZ1  LYS  34           HZ1      LYS  34   0.198   1.340 -25.072
  291    HZ2  LYS  34           HZ2      LYS  34   1.160   2.653 -24.583
  292    HZ3  LYS  34           HZ3      LYS  34   0.216   1.818 -23.445
  293    H    GLY  35           HN       GLY  35   5.511   0.372 -19.715
  294    HA2  GLY  35           HA2      GLY  35   7.116   2.069 -19.446
  295    HA3  GLY  35           HA1      GLY  35   5.812   3.240 -19.642
  296    H    CYS  36           HN       CYS  36   5.259   0.911 -17.200
  297    HA   CYS  36           HA       CYS  36   5.032   2.809 -15.106
  298    HB2  CYS  36           HB2      CYS  36   5.567  -0.174 -15.010
  299    HB3  CYS  36           HB1      CYS  36   5.140   0.790 -13.597
  300    HG   CYS  36           HG       CYS  36   2.775   0.660 -14.297
  301    H    ILE  37           HN       ILE  37   6.555   3.767 -13.802
  302    HA   ILE  37           HA       ILE  37   9.398   3.276 -14.318
  303    HB   ILE  37           HB       ILE  37   8.074   5.101 -12.285
  304   HG12  ILE  37          HG12      ILE  37   9.114   5.808 -15.055
  305   HG13  ILE  37          HG11      ILE  37   7.412   5.502 -14.710
  306   HG21  ILE  37          HG21      ILE  37  10.213   6.329 -12.364
  307   HG22  ILE  37          HG22      ILE  37  10.863   5.144 -13.492
  308   HG23  ILE  37          HG23      ILE  37  10.471   4.667 -11.838
  309   HD11  ILE  37          HD11      ILE  37   9.106   7.637 -13.360
  310   HD12  ILE  37          HD12      ILE  37   7.397   7.329 -13.050
  311   HD13  ILE  37          HD13      ILE  37   7.912   7.931 -14.627
  312    HA   PRO  38           HA       PRO  38   9.145   0.301 -10.832
  313    HB2  PRO  38           HB2      PRO  38  11.919  -0.407 -10.920
  314    HB3  PRO  38           HB1      PRO  38  10.581  -1.304 -11.653
  315    HG2  PRO  38           HG2      PRO  38  12.626   0.331 -12.996
  316    HG3  PRO  38           HG1      PRO  38  11.440  -0.764 -13.723
  317    HD2  PRO  38           HD2      PRO  38  11.366   2.116 -13.731
  318    HD3  PRO  38           HD1      PRO  38  10.119   1.015 -14.346
  319    H    LEU  39           HN       LEU  39   9.480   0.708  -8.663
  320    HA   LEU  39           HA       LEU  39  10.756   3.195  -7.882
  321    HB2  LEU  39           HB2      LEU  39   9.274   0.970  -6.503
  322    HB3  LEU  39           HB1      LEU  39  10.215   2.066  -5.498
  323    HG   LEU  39           HG       LEU  39   8.987   3.992  -6.474
  324   HD11  LEU  39          HD11      LEU  39   8.413   3.097  -8.654
  325   HD12  LEU  39          HD12      LEU  39   6.914   3.467  -7.805
  326   HD13  LEU  39          HD13      LEU  39   7.473   1.798  -7.923
  327   HD21  LEU  39          HD21      LEU  39   8.191   2.810  -4.405
  328   HD22  LEU  39          HD22      LEU  39   7.121   1.843  -5.420
  329   HD23  LEU  39          HD23      LEU  39   6.890   3.587  -5.308
  330    HA   PRO  40           HA       PRO  40  14.816   1.143  -7.622
  331    HB2  PRO  40           HB2      PRO  40  15.716   3.200  -5.695
  332    HB3  PRO  40           HB1      PRO  40  16.317   2.882  -7.329
  333    HG2  PRO  40           HG2      PRO  40  14.681   5.085  -6.542
  334    HG3  PRO  40           HG1      PRO  40  15.072   4.614  -8.204
  335    HD2  PRO  40           HD2      PRO  40  12.500   4.353  -6.824
  336    HD3  PRO  40           HD1      PRO  40  12.869   3.995  -8.527
  337    H    ARG  41           HN       ARG  41  15.461  -0.468  -6.229
  338    HA   ARG  41           HA       ARG  41  13.873  -1.100  -3.924
  339    HB2  ARG  41           HB2      ARG  41  15.225  -2.731  -5.346
  340    HB3  ARG  41           HB1      ARG  41  16.668  -2.141  -4.524
  341    HG2  ARG  41           HG2      ARG  41  15.650  -2.761  -2.341
  342    HG3  ARG  41           HG1      ARG  41  14.256  -3.415  -3.192
  343    HD2  ARG  41           HD2      ARG  41  16.262  -4.755  -4.491
  344    HD3  ARG  41           HD1      ARG  41  16.995  -4.578  -2.900
  345    HE   ARG  41           HE       ARG  41  15.001  -6.464  -3.585
  346   HH11  ARG  41          HH21      ARG  41  15.566  -4.058  -1.171
  347   HH12  ARG  41          HH22      ARG  41  14.435  -4.737  -0.055
  348   HH21  ARG  41          HH11      ARG  41  13.547  -7.360  -2.129
  349   HH22  ARG  41          HH12      ARG  41  13.301  -6.605  -0.589
  350    H    GLY  42           HN       GLY  42  17.211   0.177  -4.190
  351    HA2  GLY  42           HA2      GLY  42  17.758   0.357  -1.404
  352    HA3  GLY  42           HA1      GLY  42  18.465   1.449  -2.599
  353    H    GLN  43           HN       GLN  43  15.736   2.417  -3.430
  354    HA   GLN  43           HA       GLN  43  15.528   4.563  -1.467
  355    HB2  GLN  43           HB2      GLN  43  15.094   4.772  -3.985
  356    HB3  GLN  43           HB1      GLN  43  13.576   3.920  -3.712
  357    HG2  GLN  43           HG2      GLN  43  13.065   6.267  -3.649
  358    HG3  GLN  43           HG1      GLN  43  13.007   5.699  -1.982
  359   HE21  GLN  43          HE21      GLN  43  14.198   6.941  -0.527
  360   HE22  GLN  43          HE22      GLN  43  15.493   7.956  -0.944
  361    H    THR  44           HN       THR  44  13.565   1.716  -2.320
  362    HA   THR  44           HA       THR  44  11.420   2.334  -0.491
  363    HB   THR  44           HB       THR  44  12.286  -0.312  -1.693
  364    HG1  THR  44           HG1      THR  44  11.360   0.429  -3.398
  365   HG21  THR  44          HG21      THR  44   9.762   0.510  -0.234
  366   HG22  THR  44          HG22      THR  44  10.874  -0.790   0.195
  367   HG23  THR  44          HG23      THR  44   9.869  -0.930  -1.246
  368    H    GLU  45           HN       GLU  45  14.258   0.151  -0.237
  369    HA   GLU  45           HA       GLU  45  13.676  -0.792   2.397
  370    HB2  GLU  45           HB2      GLU  45  16.420  -0.325   1.148
  371    HB3  GLU  45           HB1      GLU  45  16.074  -1.372   2.523
  372    HG2  GLU  45           HG2      GLU  45  14.935  -1.739  -0.272
  373    HG3  GLU  45           HG1      GLU  45  16.284  -2.652   0.401
  374    H    LYS  46           HN       LYS  46  15.432   2.136   1.284
  375    HA   LYS  46           HA       LYS  46  16.125   2.950   3.997
  376    HB2  LYS  46           HB2      LYS  46  16.021   4.524   1.402
  377    HB3  LYS  46           HB1      LYS  46  16.725   5.113   2.904
  378    HG2  LYS  46           HG2      LYS  46  17.685   2.501   1.690
  379    HG3  LYS  46           HG1      LYS  46  18.309   4.035   1.095
  380    HD2  LYS  46           HD2      LYS  46  18.987   4.618   3.441
  381    HD3  LYS  46           HD1      LYS  46  18.483   3.007   3.948
  382    HE2  LYS  46           HE2      LYS  46  20.106   1.976   2.460
  383    HE3  LYS  46           HE1      LYS  46  20.550   3.552   1.801
  384    HZ1  LYS  46           HZ1      LYS  46  21.307   2.316   4.303
  385    HZ2  LYS  46           HZ2      LYS  46  20.878   3.955   4.424
  386    HZ3  LYS  46           HZ3      LYS  46  22.123   3.475   3.373
  387    H    ALA  47           HN       ALA  47  13.276   3.055   2.107
  388    HA   ALA  47           HA       ALA  47  12.129   5.463   3.289
  389    HB1  ALA  47           HB1      ALA  47  10.658   3.167   1.957
  390    HB2  ALA  47           HB2      ALA  47  11.448   4.464   1.062
  391    HB3  ALA  47           HB3      ALA  47  10.105   4.831   2.143
  392    H    ASP  48           HN       ASP  48  11.226   5.604   5.281
  393    HA   ASP  48           HA       ASP  48  10.974   3.207   6.973
  394    HB2  ASP  48           HB2      ASP  48  10.124   6.066   7.551
  395    HB3  ASP  48           HB1      ASP  48  10.384   4.782   8.732
  396    H    HIS  49           HN       HIS  49   8.828   2.946   8.234
  397    HA   HIS  49           HA       HIS  49   6.728   2.272   6.501
  398    HB2  HIS  49           HB2      HIS  49   5.277   2.300   8.551
  399    HB3  HIS  49           HB1      HIS  49   6.782   1.408   8.759
  400    HD1  HIS  49           HD1      HIS  49   8.688   3.838   9.215
  401    HD2  HIS  49           HD2      HIS  49   5.018   3.338  11.129
  402    HE1  HIS  49           HE1      HIS  49   8.799   5.203  11.343
  403    H    VAL  50           HN       VAL  50   7.146   5.295   8.360
  404    HA   VAL  50           HA       VAL  50   4.679   6.490   7.393
  405    HB   VAL  50           HB       VAL  50   7.219   7.793   8.473
  406   HG11  VAL  50          HG11      VAL  50   4.427   8.905   8.019
  407   HG12  VAL  50          HG12      VAL  50   5.927   9.465   7.281
  408   HG13  VAL  50          HG13      VAL  50   5.651   9.704   9.004
  409   HG21  VAL  50          HG21      VAL  50   6.087   7.826  10.615
  410   HG22  VAL  50          HG22      VAL  50   6.028   6.173  10.009
  411   HG23  VAL  50          HG23      VAL  50   4.601   7.202   9.900
  412    H    ASP  51           HN       ASP  51   8.107   6.896   6.428
  413    HA   ASP  51           HA       ASP  51   7.623   8.696   4.284
  414    HB2  ASP  51           HB2      ASP  51   9.782   6.593   4.631
  415    HB3  ASP  51           HB1      ASP  51   9.806   7.828   3.372
  416    H    LEU  52           HN       LEU  52   7.387   5.171   4.456
  417    HA   LEU  52           HA       LEU  52   7.226   4.583   1.707
  418    HB2  LEU  52           HB2      LEU  52   7.167   3.035   3.839
  419    HB3  LEU  52           HB1      LEU  52   5.428   3.205   3.713
  420    HG   LEU  52           HG       LEU  52   6.001   1.194   2.552
  421   HD11  LEU  52          HD11      LEU  52   4.393   2.789   1.406
  422   HD12  LEU  52          HD12      LEU  52   5.136   1.573   0.371
  423   HD13  LEU  52          HD13      LEU  52   5.727   3.231   0.338
  424   HD21  LEU  52          HD21      LEU  52   7.767   0.882   1.049
  425   HD22  LEU  52          HD22      LEU  52   8.490   1.969   2.226
  426   HD23  LEU  52          HD23      LEU  52   7.922   2.595   0.679
  427    H    ALA  53           HN       ALA  53   4.547   5.391   3.954
  428    HA   ALA  53           HA       ALA  53   2.467   5.409   2.008
  429    HB1  ALA  53           HB1      ALA  53   1.241   6.822   3.607
  430    HB2  ALA  53           HB2      ALA  53   2.737   7.144   4.483
  431    HB3  ALA  53           HB3      ALA  53   2.069   5.513   4.450
  432    H    THR  54           HN       THR  54   4.943   7.795   2.754
  433    HA   THR  54           HA       THR  54   3.653   9.989   1.342
  434    HB   THR  54           HB       THR  54   6.590   9.603   2.014
  435    HG1  THR  54           HG1      THR  54   5.383  11.317   3.598
  436   HG21  THR  54          HG21      THR  54   6.287  11.368   0.378
  437   HG22  THR  54          HG22      THR  54   6.589  12.110   1.948
  438   HG23  THR  54          HG23      THR  54   4.949  12.051   1.304
  439    H    LEU  55           HN       LEU  55   5.918   7.415   0.400
  440    HA   LEU  55           HA       LEU  55   6.528   8.582  -2.195
  441    HB2  LEU  55           HB2      LEU  55   6.743   5.662  -1.366
  442    HB3  LEU  55           HB1      LEU  55   7.462   6.391  -2.790
  443    HG   LEU  55           HG       LEU  55   8.151   7.133   0.076
  444   HD11  LEU  55          HD11      LEU  55   8.924   4.882  -0.530
  445   HD12  LEU  55          HD12      LEU  55  10.290   5.992  -0.423
  446   HD13  LEU  55          HD13      LEU  55   9.661   5.519  -2.001
  447   HD21  LEU  55          HD21      LEU  55   9.109   8.132  -2.624
  448   HD22  LEU  55          HD22      LEU  55  10.145   8.234  -1.201
  449   HD23  LEU  55          HD23      LEU  55   8.601   9.072  -1.220
  450    H    MET  56           HN       MET  56   4.088   6.363  -0.946
  451    HA   MET  56           HA       MET  56   3.065   5.610  -3.556
  452    HB2  MET  56           HB2      MET  56   1.850   5.519  -0.777
  453    HB3  MET  56           HB1      MET  56   1.030   4.896  -2.206
  454    HG2  MET  56           HG2      MET  56   3.814   3.985  -1.413
  455    HG3  MET  56           HG1      MET  56   2.355   3.169  -0.856
  456    HE1  MET  56           HE1      MET  56   1.284   1.352  -2.009
  457    HE2  MET  56           HE2      MET  56   0.930   1.328  -3.734
  458    HE3  MET  56           HE3      MET  56   0.343   2.659  -2.741
  459    H    ILE  57           HN       ILE  57   2.114   8.093  -1.160
  460    HA   ILE  57           HA       ILE  57  -0.087   9.031  -2.855
  461    HB   ILE  57           HB       ILE  57   1.198  10.420  -0.478
  462   HG12  ILE  57          HG12      ILE  57  -1.318   8.719  -0.557
  463   HG13  ILE  57          HG11      ILE  57   0.248   8.094  -0.042
  464   HG21  ILE  57          HG21      ILE  57  -1.408  10.829  -1.959
  465   HG22  ILE  57          HG22      ILE  57  -0.087  11.983  -1.790
  466   HG23  ILE  57          HG23      ILE  57  -1.058  11.547  -0.389
  467   HD11  ILE  57          HD11      ILE  57  -1.151   8.840   1.881
  468   HD12  ILE  57          HD12      ILE  57  -1.152  10.473   1.217
  469   HD13  ILE  57          HD13      ILE  57   0.359   9.742   1.759
  470    H    ASP  58           HN       ASP  58   3.257  10.096  -2.235
  471    HA   ASP  58           HA       ASP  58   2.970  12.517  -3.835
  472    HB2  ASP  58           HB2      ASP  58   4.647  12.187  -1.949
  473    HB3  ASP  58           HB1      ASP  58   5.541  11.108  -3.023
  474    H    PHE  59           HN       PHE  59   4.417   9.289  -4.450
  475    HA   PHE  59           HA       PHE  59   5.270  10.110  -7.138
  476    HB2  PHE  59           HB2      PHE  59   6.423   8.411  -5.589
  477    HB3  PHE  59           HB1      PHE  59   5.176   7.269  -6.077
  478    HD1  PHE  59           HD2      PHE  59   8.090   9.235  -7.197
  479    HD2  PHE  59           HD1      PHE  59   5.068   6.419  -8.383
  480    HE1  PHE  59           HE2      PHE  59   9.348   8.762  -9.279
  481    HE2  PHE  59           HE1      PHE  59   6.329   5.947 -10.465
  482    HZ   PHE  59           HZ       PHE  59   8.468   7.118 -10.912
  483    H    ASN  60           HN       ASN  60   2.646   7.947  -5.893
  484    HA   ASN  60           HA       ASN  60   1.710   7.554  -8.712
  485    HB2  ASN  60           HB2      ASN  60   0.822   6.286  -6.097
  486    HB3  ASN  60           HB1      ASN  60   0.210   5.850  -7.689
  487   HD21  ASN  60          HD21      ASN  60   1.424   4.343  -8.888
  488   HD22  ASN  60          HD22      ASN  60   2.966   3.789  -8.440
  489    H    GLY  61           HN       GLY  61   0.741   9.175  -5.732
  490    HA2  GLY  61           HA2      GLY  61  -0.795  11.033  -5.692
  491    HA3  GLY  61           HA1      GLY  61  -1.475  10.502  -7.227
  492    H    GLU  62           HN       GLU  62  -3.350  11.070  -5.470
  493    HA   GLU  62           HA       GLU  62  -4.025   8.972  -3.601
  494    HB2  GLU  62           HB2      GLU  62  -5.592  11.271  -4.807
  495    HB3  GLU  62           HB1      GLU  62  -6.357  10.117  -3.718
  496    HG2  GLU  62           HG2      GLU  62  -5.643  11.989  -2.384
  497    HG3  GLU  62           HG1      GLU  62  -4.552  10.655  -2.019
  498    H    GLU  63           HN       GLU  63  -5.192   9.699  -6.918
  499    HA   GLU  63           HA       GLU  63  -7.141   7.623  -6.933
  500    HB2  GLU  63           HB2      GLU  63  -7.353   8.002  -9.284
  501    HB3  GLU  63           HB1      GLU  63  -7.029   9.559  -8.536
  502    HG2  GLU  63           HG2      GLU  63  -5.079   7.821 -10.063
  503    HG3  GLU  63           HG1      GLU  63  -5.681   9.405 -10.523
  504    H    LYS  64           HN       LYS  64  -3.777   7.508  -8.254
  505    HA   LYS  64           HA       LYS  64  -4.090   4.703  -8.984
  506    HB2  LYS  64           HB2      LYS  64  -1.739   6.594  -8.839
  507    HB3  LYS  64           HB1      LYS  64  -1.466   4.877  -9.106
  508    HG2  LYS  64           HG2      LYS  64  -2.991   4.984 -11.081
  509    HG3  LYS  64           HG1      LYS  64  -3.137   6.723 -10.837
  510    HD2  LYS  64           HD2      LYS  64  -0.695   6.968 -11.100
  511    HD3  LYS  64           HD1      LYS  64  -0.555   5.230 -11.367
  512    HE2  LYS  64           HE2      LYS  64  -1.912   5.374 -13.375
  513    HE3  LYS  64           HE1      LYS  64  -2.242   7.080 -13.076
  514    HZ1  LYS  64           HZ1      LYS  64   0.121   7.537 -13.298
  515    HZ2  LYS  64           HZ2      LYS  64  -0.487   6.802 -14.704
  516    HZ3  LYS  64           HZ3      LYS  64   0.432   5.897 -13.597
  517    H    ALA  65           HN       ALA  65  -2.579   6.395  -6.205
  518    HA   ALA  65           HA       ALA  65  -1.423   4.157  -4.949
  519    HB1  ALA  65           HB1      ALA  65  -2.793   6.536  -3.669
  520    HB2  ALA  65           HB2      ALA  65  -1.083   6.404  -4.080
  521    HB3  ALA  65           HB3      ALA  65  -1.765   5.391  -2.808
  522    H    TRP  66           HN       TRP  66  -4.767   5.389  -4.500
  523    HA   TRP  66           HA       TRP  66  -5.573   3.311  -2.714
  524    HB2  TRP  66           HB2      TRP  66  -7.019   5.236  -4.536
  525    HB3  TRP  66           HB1      TRP  66  -7.949   3.911  -3.844
  526    HD1  TRP  66           HD1      TRP  66  -7.114   7.345  -3.102
  527    HE1  TRP  66           HE1      TRP  66  -7.353   7.868  -0.591
  528    HE3  TRP  66           HE3      TRP  66  -7.331   2.598  -1.236
  529    HZ2  TRP  66           HZ2      TRP  66  -7.608   6.462   1.886
  530    HZ3  TRP  66           HZ3      TRP  66  -7.577   2.219   1.222
  531    HH2  TRP  66           HH2      TRP  66  -7.714   4.146   2.769
  532    H    ALA  67           HN       ALA  67  -5.449   3.450  -6.250
  533    HA   ALA  67           HA       ALA  67  -6.904   1.015  -6.712
  534    HB1  ALA  67           HB1      ALA  67  -4.718   2.265  -8.404
  535    HB2  ALA  67           HB2      ALA  67  -6.427   2.690  -8.488
  536    HB3  ALA  67           HB3      ALA  67  -5.896   1.071  -8.949
  537    H    MET  68           HN       MET  68  -3.465   1.701  -6.168
  538    HA   MET  68           HA       MET  68  -2.648  -1.079  -6.570
  539    HB2  MET  68           HB2      MET  68  -1.273   1.395  -5.478
  540    HB3  MET  68           HB1      MET  68  -0.484  -0.182  -5.440
  541    HG2  MET  68           HG2      MET  68  -0.598  -0.376  -7.847
  542    HG3  MET  68           HG1      MET  68  -1.602   1.065  -7.970
  543    HE1  MET  68           HE1      MET  68   2.900   0.745  -7.276
  544    HE2  MET  68           HE2      MET  68   1.857  -0.352  -8.179
  545    HE3  MET  68           HE3      MET  68   1.709  -0.251  -6.426
  546    H    ALA  69           HN       ALA  69  -3.598   0.925  -3.834
  547    HA   ALA  69           HA       ALA  69  -2.691  -0.842  -1.761
  548    HB1  ALA  69           HB1      ALA  69  -3.349   1.544  -1.396
  549    HB2  ALA  69           HB2      ALA  69  -4.176   0.439  -0.295
  550    HB3  ALA  69           HB3      ALA  69  -5.028   1.094  -1.693
  551    H    VAL  70           HN       VAL  70  -5.852  -0.527  -3.401
  552    HA   VAL  70           HA       VAL  70  -7.043  -2.703  -1.852
  553    HB   VAL  70           HB       VAL  70  -8.371  -0.853  -2.855
  554   HG11  VAL  70          HG11      VAL  70  -8.752  -0.725  -5.229
  555   HG12  VAL  70          HG12      VAL  70  -7.888  -2.234  -5.518
  556   HG13  VAL  70          HG13      VAL  70  -7.004  -0.796  -5.007
  557   HG21  VAL  70          HG21      VAL  70 -10.214  -2.258  -3.611
  558   HG22  VAL  70          HG22      VAL  70  -9.370  -3.094  -2.307
  559   HG23  VAL  70          HG23      VAL  70  -9.102  -3.577  -3.982
  560    H    TRP  71           HN       TRP  71  -5.622  -2.433  -5.105
  561    HA   TRP  71           HA       TRP  71  -6.278  -5.106  -5.905
  562    HB2  TRP  71           HB2      TRP  71  -5.609  -3.330  -7.517
  563    HB3  TRP  71           HB1      TRP  71  -3.973  -3.364  -6.863
  564    HD1  TRP  71           HD1      TRP  71  -6.373  -5.326  -9.048
  565    HE1  TRP  71           HE1      TRP  71  -5.090  -7.246 -10.195
  566    HE3  TRP  71           HE3      TRP  71  -1.921  -5.002  -6.581
  567    HZ2  TRP  71           HZ2      TRP  71  -2.508  -8.481 -10.077
  568    HZ3  TRP  71           HZ3      TRP  71  -0.068  -6.555  -7.110
  569    HH2  TRP  71           HH2      TRP  71  -0.355  -8.295  -8.856
  570    H    ILE  72           HN       ILE  72  -3.606  -3.815  -3.958
  571    HA   ILE  72           HA       ILE  72  -2.005  -6.252  -4.211
  572    HB   ILE  72           HB       ILE  72  -1.877  -3.856  -2.347
  573   HG12  ILE  72          HG12      ILE  72   0.153  -5.006  -4.295
  574   HG13  ILE  72          HG11      ILE  72  -1.019  -3.774  -4.740
  575   HG21  ILE  72          HG21      ILE  72  -1.190  -5.639  -0.887
  576   HG22  ILE  72          HG22      ILE  72   0.296  -4.916  -1.486
  577   HG23  ILE  72          HG23      ILE  72  -0.281  -6.431  -2.173
  578   HD11  ILE  72          HD11      ILE  72   1.309  -2.940  -4.087
  579   HD12  ILE  72          HD12      ILE  72   0.908  -3.393  -2.433
  580   HD13  ILE  72          HD13      ILE  72  -0.045  -2.166  -3.269
  581    H    PHE  73           HN       PHE  73  -4.398  -5.125  -1.728
  582    HA   PHE  73           HA       PHE  73  -3.995  -7.290   0.067
  583    HB2  PHE  73           HB2      PHE  73  -6.752  -6.180  -0.521
  584    HB3  PHE  73           HB1      PHE  73  -6.124  -6.783   1.008
  585    HD1  PHE  73           HD1      PHE  73  -3.400  -5.261   0.931
  586    HD2  PHE  73           HD2      PHE  73  -7.455  -4.013   0.193
  587    HE1  PHE  73           HE1      PHE  73  -2.820  -2.956   1.594
  588    HE2  PHE  73           HE2      PHE  73  -6.855  -1.706   0.854
  589    HZ   PHE  73           HZ       PHE  73  -4.541  -1.177   1.554
  590    H    ALA  74           HN       ALA  74  -6.213  -7.120  -2.753
  591    HA   ALA  74           HA       ALA  74  -7.267  -9.755  -2.435
  592    HB1  ALA  74           HB1      ALA  74  -7.876  -9.578  -4.827
  593    HB2  ALA  74           HB2      ALA  74  -6.815  -8.180  -4.995
  594    HB3  ALA  74           HB3      ALA  74  -8.249  -8.080  -3.973
  595    H    ALA  75           HN       ALA  75  -4.225  -8.610  -3.749
  596    HA   ALA  75           HA       ALA  75  -3.557 -11.006  -5.207
  597    HB1  ALA  75           HB1      ALA  75  -2.469  -8.753  -5.516
  598    HB2  ALA  75           HB2      ALA  75  -1.321 -10.080  -5.333
  599    HB3  ALA  75           HB3      ALA  75  -1.642  -8.998  -3.977
  600    H    ILE  76           HN       ILE  76  -2.650  -9.892  -1.913
  601    HA   ILE  76           HA       ILE  76  -1.236 -12.420  -1.388
  602    HB   ILE  76           HB       ILE  76  -1.020 -11.437   0.955
  603   HG12  ILE  76          HG12      ILE  76  -2.262  -8.994  -0.363
  604   HG13  ILE  76          HG11      ILE  76  -3.119 -10.045   0.755
  605   HG21  ILE  76          HG21      ILE  76  -0.126  -9.681  -1.360
  606   HG22  ILE  76          HG22      ILE  76   0.702 -11.132  -0.802
  607   HG23  ILE  76          HG23      ILE  76   0.597  -9.723   0.249
  608   HD11  ILE  76          HD11      ILE  76  -2.273  -8.199   2.042
  609   HD12  ILE  76          HD12      ILE  76  -0.667  -8.363   1.336
  610   HD13  ILE  76          HD13      ILE  76  -1.275  -9.594   2.443
  611    H    ASN  77           HN       ASN  77  -4.309 -12.213  -1.861
  612    HA   ASN  77           HA       ASN  77  -6.201 -13.312  -1.063
  613    HB2  ASN  77           HB2      ASN  77  -4.475 -15.223  -1.110
  614    HB3  ASN  77           HB1      ASN  77  -4.281 -14.966   0.623
  615   HD21  ASN  77          HD21      ASN  77  -5.836 -16.996  -1.402
  616   HD22  ASN  77          HD22      ASN  77  -7.253 -17.295  -0.518
  617    H    ARG  78           HN       ARG  78  -6.626 -11.247   0.068
  618    HA   ARG  78           HA       ARG  78  -6.953 -11.710   2.987
  619    HB2  ARG  78           HB2      ARG  78  -4.830 -10.277   2.401
  620    HB3  ARG  78           HB1      ARG  78  -5.976  -9.020   1.978
  621    HG2  ARG  78           HG2      ARG  78  -5.607  -8.494   4.229
  622    HG3  ARG  78           HG1      ARG  78  -7.003  -9.550   4.382
  623    HD2  ARG  78           HD2      ARG  78  -4.165 -10.601   4.589
  624    HD3  ARG  78           HD1      ARG  78  -5.015  -9.970   5.987
  625    HE   ARG  78           HE       ARG  78  -5.333 -12.574   4.741
  626   HH11  ARG  78          HH21      ARG  78  -7.118 -10.058   6.291
  627   HH12  ARG  78          HH22      ARG  78  -8.476 -11.075   6.641
  628   HH21  ARG  78          HH11      ARG  78  -7.080 -13.895   5.197
  629   HH22  ARG  78          HH12      ARG  78  -8.454 -13.241   6.024
  630    H    ARG  79           HN       ARG  79  -8.813 -12.021   1.016
  631    HA   ARG  79           HA       ARG  79 -10.353  -9.922   0.099
  632    HB2  ARG  79           HB2      ARG  79 -12.320 -11.432   0.291
  633    HB3  ARG  79           HB1      ARG  79 -10.908 -12.243  -0.386
  634    HG2  ARG  79           HG2      ARG  79 -10.373 -13.108   1.910
  635    HG3  ARG  79           HG1      ARG  79 -11.889 -12.409   2.480
  636    HD2  ARG  79           HD2      ARG  79 -12.263 -14.752   1.966
  637    HD3  ARG  79           HD1      ARG  79 -13.102 -13.770   0.765
  638    HE   ARG  79           HE       ARG  79 -10.621 -14.245  -0.382
  639   HH11  ARG  79          HH21      ARG  79 -13.144 -16.166   0.986
  640   HH12  ARG  79          HH22      ARG  79 -12.836 -17.530  -0.036
  641   HH21  ARG  79          HH11      ARG  79 -10.211 -16.016  -1.720
  642   HH22  ARG  79          HH12      ARG  79 -11.177 -17.445  -1.566
  643    H    ASP  80           HN       ASP  80 -10.221 -11.078   3.443
  644    HA   ASP  80           HA       ASP  80 -12.514  -9.799   4.484
  645    HB2  ASP  80           HB2      ASP  80 -10.973 -11.326   5.764
  646    HB3  ASP  80           HB1      ASP  80  -9.817  -9.996   5.865
  647    H    LEU  81           HN       LEU  81  -9.281  -8.466   3.857
  648    HA   LEU  81           HA       LEU  81  -9.846  -5.875   4.970
  649    HB2  LEU  81           HB2      LEU  81  -7.570  -7.155   3.997
  650    HB3  LEU  81           HB1      LEU  81  -7.836  -5.942   2.755
  651    HG   LEU  81           HG       LEU  81  -7.666  -5.348   5.733
  652   HD11  LEU  81          HD11      LEU  81  -5.520  -6.147   4.745
  653   HD12  LEU  81          HD12      LEU  81  -5.450  -4.458   5.244
  654   HD13  LEU  81          HD13      LEU  81  -5.631  -4.866   3.539
  655   HD21  LEU  81          HD21      LEU  81  -7.427  -2.996   4.885
  656   HD22  LEU  81          HD22      LEU  81  -9.002  -3.695   4.534
  657   HD23  LEU  81          HD23      LEU  81  -7.785  -3.586   3.265
  658    H    TYR  82           HN       TYR  82 -10.624  -7.372   1.901
  659    HA   TYR  82           HA       TYR  82 -11.062  -4.941   0.421
  660    HB2  TYR  82           HB2      TYR  82 -10.874  -7.354  -0.479
  661    HB3  TYR  82           HB1      TYR  82 -12.560  -7.548  -0.018
  662    HD1  TYR  82           HD2      TYR  82 -14.262  -5.823  -0.928
  663    HD2  TYR  82           HD1      TYR  82 -10.320  -6.333  -2.566
  664    HE1  TYR  82           HE2      TYR  82 -14.987  -4.714  -3.021
  665    HE2  TYR  82           HE1      TYR  82 -11.052  -5.227  -4.659
  666    HH   TYR  82           HH       TYR  82 -13.583  -3.347  -4.959
  667    H    GLU  83           HN       GLU  83 -13.052  -6.834   2.649
  668    HA   GLU  83           HA       GLU  83 -15.522  -5.427   2.070
  669    HB2  GLU  83           HB2      GLU  83 -14.668  -7.083   4.463
  670    HB3  GLU  83           HB1      GLU  83 -16.305  -6.480   4.200
  671    HG2  GLU  83           HG2      GLU  83 -16.436  -7.711   2.078
  672    HG3  GLU  83           HG1      GLU  83 -14.785  -8.292   2.301
  673    H    LYS  84           HN       LYS  84 -13.107  -5.126   4.710
  674    HA   LYS  84           HA       LYS  84 -14.496  -2.872   5.917
  675    HB2  LYS  84           HB2      LYS  84 -11.625  -3.776   6.260
  676    HB3  LYS  84           HB1      LYS  84 -12.505  -2.685   7.330
  677    HG2  LYS  84           HG2      LYS  84 -14.195  -4.561   7.670
  678    HG3  LYS  84           HG1      LYS  84 -13.068  -5.622   6.826
  679    HD2  LYS  84           HD2      LYS  84 -12.406  -4.026   9.324
  680    HD3  LYS  84           HD1      LYS  84 -12.824  -5.737   9.308
  681    HE2  LYS  84           HE2      LYS  84 -10.856  -6.020   7.644
  682    HE3  LYS  84           HE1      LYS  84 -10.359  -4.409   8.163
  683    HZ1  LYS  84           HZ1      LYS  84 -10.936  -5.774  10.473
  684    HZ2  LYS  84           HZ2      LYS  84  -9.392  -5.390   9.876
  685    HZ3  LYS  84           HZ3      LYS  84 -10.096  -6.893   9.513
  686    H    ALA  85           HN       ALA  85 -11.800  -3.234   3.655
  687    HA   ALA  85           HA       ALA  85 -10.849  -0.577   3.649
  688    HB1  ALA  85           HB1      ALA  85 -10.118  -1.071   1.293
  689    HB2  ALA  85           HB2      ALA  85 -11.027  -2.580   1.379
  690    HB3  ALA  85           HB3      ALA  85  -9.655  -2.314   2.454
  691    H    LYS  86           HN       LYS  86 -13.548  -2.013   1.822
  692    HA   LYS  86           HA       LYS  86 -14.131   0.415   0.355
  693    HB2  LYS  86           HB2      LYS  86 -14.872  -1.895  -0.364
  694    HB3  LYS  86           HB1      LYS  86 -16.048  -1.876   0.951
  695    HG2  LYS  86           HG2      LYS  86 -17.118   0.113   0.015
  696    HG3  LYS  86           HG1      LYS  86 -15.901   0.196  -1.260
  697    HD2  LYS  86           HD2      LYS  86 -16.614  -2.059  -2.045
  698    HD3  LYS  86           HD1      LYS  86 -17.888  -2.053  -0.825
  699    HE2  LYS  86           HE2      LYS  86 -17.576  -0.075  -3.103
  700    HE3  LYS  86           HE1      LYS  86 -18.817  -1.320  -2.961
  701    HZ1  LYS  86           HZ1      LYS  86 -19.594  -0.244  -0.930
  702    HZ2  LYS  86           HZ2      LYS  86 -19.668   0.813  -2.258
  703    HZ3  LYS  86           HZ3      LYS  86 -18.424   0.970  -1.112
  704    H    ARG  87           HN       ARG  87 -15.045  -0.776   3.541
  705    HA   ARG  87           HA       ARG  87 -17.228   1.178   3.839
  706    HB2  ARG  87           HB2      ARG  87 -17.234  -1.073   4.953
  707    HB3  ARG  87           HB1      ARG  87 -15.887  -0.533   5.955
  708    HG2  ARG  87           HG2      ARG  87 -17.241   1.268   6.885
  709    HG3  ARG  87           HG1      ARG  87 -18.575   0.864   5.803
  710    HD2  ARG  87           HD2      ARG  87 -17.428  -0.943   7.952
  711    HD3  ARG  87           HD1      ARG  87 -18.966  -0.083   8.040
  712    HE   ARG  87           HE       ARG  87 -19.167  -1.574   5.706
  713   HH11  ARG  87          HH21      ARG  87 -18.436  -2.208   9.022
  714   HH12  ARG  87          HH22      ARG  87 -19.092  -3.810   8.995
  715   HH21  ARG  87          HH11      ARG  87 -20.025  -3.661   5.660
  716   HH22  ARG  87          HH12      ARG  87 -19.991  -4.633   7.094
  717    H    ASP  88           HN       ASP  88 -13.802   0.989   4.598
  718    HA   ASP  88           HA       ASP  88 -13.907   3.324   6.408
  719    HB2  ASP  88           HB2      ASP  88 -11.594   1.718   5.269
  720    HB3  ASP  88           HB1      ASP  88 -11.402   3.044   6.413
  721    H    GLU  89           HN       GLU  89 -14.028   2.954   3.096
  722    HA   GLU  89           HA       GLU  89 -12.178   4.828   2.070
  723    HB2  GLU  89           HB2      GLU  89 -14.876   3.839   1.208
  724    HB3  GLU  89           HB1      GLU  89 -14.237   5.251   0.373
  725    HG2  GLU  89           HG2      GLU  89 -12.235   4.023  -0.274
  726    HG3  GLU  89           HG1      GLU  89 -12.744   2.621   0.663
  727    HA   PRO  90           HA       PRO  90 -14.028   8.337   4.356
  728    HB2  PRO  90           HB2      PRO  90 -12.243  10.274   3.156
  729    HB3  PRO  90           HB1      PRO  90 -12.127   9.578   4.780
  730    HG2  PRO  90           HG2      PRO  90 -10.438   9.004   2.465
  731    HG3  PRO  90           HG1      PRO  90 -10.264   8.392   4.117
  732    HD2  PRO  90           HD2      PRO  90 -11.197   6.931   1.790
  733    HD3  PRO  90           HD1      PRO  90 -11.050   6.330   3.457
  734    H    LYS  91           HN       LYS  91 -15.312  10.214   3.675
  735    HA   LYS  91           HA       LYS  91 -16.299   9.967   0.875
  736    HB2  LYS  91           HB2      LYS  91 -17.327  11.438   3.323
  737    HB3  LYS  91           HB1      LYS  91 -18.085  11.568   1.735
  738    HG2  LYS  91           HG2      LYS  91 -18.291   9.023   1.754
  739    HG3  LYS  91           HG1      LYS  91 -17.799   9.075   3.444
  740    HD2  LYS  91           HD2      LYS  91 -20.229  10.431   2.237
  741    HD3  LYS  91           HD1      LYS  91 -20.238   9.022   3.294
  742    HE2  LYS  91           HE2      LYS  91 -20.713  10.786   4.787
  743    HE3  LYS  91           HE1      LYS  91 -18.971  10.597   4.983
  744    HZ1  LYS  91           HZ1      LYS  91 -19.563  12.330   2.816
  745    HZ2  LYS  91           HZ2      LYS  91 -18.649  12.635   4.215
  746    HZ3  LYS  91           HZ3      LYS  91 -20.331  12.873   4.227
  Start of MODEL   11
    1    H1   MET   1           HT1      MET   1  -2.764  17.507  13.119
    2    H2   MET   1           HT2      MET   1  -3.517  19.030  13.082
    3    H3   MET   1           HT3      MET   1  -3.023  18.286  11.636
    4    HA   MET   1           HA       MET   1  -5.214  17.431  13.443
    5    HB2  MET   1           HB2      MET   1  -5.188  18.223  10.514
    6    HB3  MET   1           HB1      MET   1  -6.611  17.820  11.475
    7    HG2  MET   1           HG2      MET   1  -6.126  19.735  12.974
    8    HG3  MET   1           HG1      MET   1  -4.733  20.147  11.976
    9    HE1  MET   1           HE1      MET   1  -9.166  20.800  11.141
   10    HE2  MET   1           HE2      MET   1  -8.336  20.630  12.686
   11    HE3  MET   1           HE3      MET   1  -8.553  19.221  11.651
   12    H    ALA   2           HN       ALA   2  -6.322  15.464  12.669
   13    HA   ALA   2           HA       ALA   2  -4.448  13.369  12.002
   14    HB1  ALA   2           HB1      ALA   2  -7.483  13.351  12.007
   15    HB2  ALA   2           HB2      ALA   2  -6.446  12.935  13.373
   16    HB3  ALA   2           HB3      ALA   2  -6.455  11.920  11.931
   17    H    SER   3           HN       SER   3  -3.526  13.713   9.967
   18    HA   SER   3           HA       SER   3  -5.231  14.262   7.616
   19    HB2  SER   3           HB2      SER   3  -2.858  15.186   7.951
   20    HB3  SER   3           HB1      SER   3  -2.271  13.551   7.653
   21    HG   SER   3           HG       SER   3  -3.957  13.982   5.745
   22    H    THR   4           HN       THR   4  -4.746  12.759   5.630
   23    HA   THR   4           HA       THR   4  -5.646  10.103   6.328
   24    HB   THR   4           HB       THR   4  -4.385  10.857   3.669
   25    HG1  THR   4           HG1      THR   4  -5.805  12.487   4.071
   26   HG21  THR   4          HG21      THR   4  -5.899   9.235   2.758
   27   HG22  THR   4          HG22      THR   4  -6.798   9.128   4.271
   28   HG23  THR   4          HG23      THR   4  -5.161   8.482   4.172
   29    H    ARG   5           HN       ARG   5  -2.525  11.573   5.964
   30    HA   ARG   5           HA       ARG   5  -0.941   9.285   5.371
   31    HB2  ARG   5           HB2      ARG   5  -0.260  11.713   7.058
   32    HB3  ARG   5           HB1      ARG   5   0.914  10.554   6.435
   33    HG2  ARG   5           HG2      ARG   5   0.115  11.066   4.119
   34    HG3  ARG   5           HG1      ARG   5  -0.923  12.319   4.789
   35    HD2  ARG   5           HD2      ARG   5   1.345  13.170   5.899
   36    HD3  ARG   5           HD1      ARG   5   2.086  12.277   4.572
   37    HE   ARG   5           HE       ARG   5   0.876  14.850   4.391
   38   HH11  ARG   5          HH21      ARG   5   0.872  11.818   2.734
   39   HH12  ARG   5          HH22      ARG   5   0.177  12.470   1.292
   40   HH21  ARG   5          HH11      ARG   5  -0.002  15.703   2.513
   41   HH22  ARG   5          HH12      ARG   5  -0.307  14.663   1.161
   42    H    CYS   6           HN       CYS   6  -1.798  10.697   8.553
   43    HA   CYS   6           HA       CYS   6  -0.524   8.692  10.111
   44    HB2  CYS   6           HB2      CYS   6  -1.856   9.480  11.961
   45    HB3  CYS   6           HB1      CYS   6  -1.450  10.880  10.971
   46    HG   CYS   6           HG       CYS   6  -3.999  10.162   9.872
   47    H    LYS   7           HN       LYS   7  -3.695   8.774   8.555
   48    HA   LYS   7           HA       LYS   7  -4.752   6.443   9.859
   49    HB2  LYS   7           HB2      LYS   7  -5.380   7.667   7.152
   50    HB3  LYS   7           HB1      LYS   7  -6.303   6.351   7.877
   51    HG2  LYS   7           HG2      LYS   7  -6.731   7.806   9.868
   52    HG3  LYS   7           HG1      LYS   7  -5.915   9.130   9.033
   53    HD2  LYS   7           HD2      LYS   7  -7.555   8.897   7.158
   54    HD3  LYS   7           HD1      LYS   7  -8.414   7.683   8.108
   55    HE2  LYS   7           HE2      LYS   7  -8.794   9.328   9.898
   56    HE3  LYS   7           HE1      LYS   7  -7.904  10.545   8.982
   57    HZ1  LYS   7           HZ1      LYS   7  -9.551  10.679   7.393
   58    HZ2  LYS   7           HZ2      LYS   7 -10.458  10.468   8.814
   59    HZ3  LYS   7           HZ3      LYS   7 -10.199   9.157   7.765
   60    H    LEU   8           HN       LEU   8  -3.163   6.824   6.653
   61    HA   LEU   8           HA       LEU   8  -3.152   4.082   5.918
   62    HB2  LEU   8           HB2      LEU   8  -1.132   6.284   5.406
   63    HB3  LEU   8           HB1      LEU   8  -0.996   4.695   4.658
   64    HG   LEU   8           HG       LEU   8  -3.602   6.237   4.407
   65   HD11  LEU   8          HD11      LEU   8  -1.882   7.836   3.710
   66   HD12  LEU   8          HD12      LEU   8  -2.750   7.236   2.297
   67   HD13  LEU   8          HD13      LEU   8  -1.141   6.619   2.671
   68   HD21  LEU   8          HD21      LEU   8  -3.564   3.916   3.581
   69   HD22  LEU   8          HD22      LEU   8  -2.135   4.260   2.613
   70   HD23  LEU   8          HD23      LEU   8  -3.672   5.025   2.219
   71    H    ALA   9           HN       ALA   9  -1.073   5.796   8.196
   72    HA   ALA   9           HA       ALA   9   0.943   3.796   8.468
   73    HB1  ALA   9           HB1      ALA   9   1.082   6.118   9.389
   74    HB2  ALA   9           HB2      ALA   9   1.493   4.875  10.570
   75    HB3  ALA   9           HB3      ALA   9  -0.087   5.655  10.626
   76    H    ARG  10           HN       ARG  10  -2.063   4.301  10.353
   77    HA   ARG  10           HA       ARG  10  -1.662   1.951  11.985
   78    HB2  ARG  10           HB2      ARG  10  -3.961   3.830  11.459
   79    HB3  ARG  10           HB1      ARG  10  -4.286   2.323  12.313
   80    HG2  ARG  10           HG2      ARG  10  -3.847   4.096  13.931
   81    HG3  ARG  10           HG1      ARG  10  -2.533   2.924  13.985
   82    HD2  ARG  10           HD2      ARG  10  -1.112   4.373  12.647
   83    HD3  ARG  10           HD1      ARG  10  -2.445   5.496  12.379
   84    HE   ARG  10           HE       ARG  10  -2.217   5.382  15.142
   85   HH11  ARG  10          HH21      ARG  10  -0.096   6.010  12.489
   86   HH12  ARG  10          HH22      ARG  10   0.917   7.092  13.386
   87   HH21  ARG  10          HH11      ARG  10  -0.903   6.788  16.321
   88   HH22  ARG  10          HH12      ARG  10   0.461   7.531  15.553
   89    H    TYR  11           HN       TYR  11  -3.291   2.489   8.892
   90    HA   TYR  11           HA       TYR  11  -4.590  -0.111   8.862
   91    HB2  TYR  11           HB2      TYR  11  -4.113   2.091   6.863
   92    HB3  TYR  11           HB1      TYR  11  -4.556   0.508   6.232
   93    HD1  TYR  11           HD2      TYR  11  -6.679  -0.580   6.971
   94    HD2  TYR  11           HD1      TYR  11  -5.762   3.491   7.959
   95    HE1  TYR  11           HE2      TYR  11  -9.069  -0.178   7.499
   96    HE2  TYR  11           HE1      TYR  11  -8.149   3.904   8.486
   97    HH   TYR  11           HH       TYR  11 -10.138   2.532   9.188
   98    H    LEU  12           HN       LEU  12  -1.570   1.157   7.461
   99    HA   LEU  12           HA       LEU  12  -0.869  -1.374   6.238
  100    HB2  LEU  12           HB2      LEU  12  -0.007   0.816   5.427
  101    HB3  LEU  12           HB1      LEU  12   0.837   1.042   6.951
  102    HG   LEU  12           HG       LEU  12   2.069  -1.252   6.322
  103   HD11  LEU  12          HD11      LEU  12   2.348  -1.462   3.836
  104   HD12  LEU  12          HD12      LEU  12   1.037  -0.306   3.618
  105   HD13  LEU  12          HD13      LEU  12   0.724  -1.866   4.374
  106   HD21  LEU  12          HD21      LEU  12   3.182   0.946   6.447
  107   HD22  LEU  12          HD22      LEU  12   2.621   1.331   4.820
  108   HD23  LEU  12          HD23      LEU  12   3.771   0.018   5.068
  109    H    GLU  13           HN       GLU  13  -0.438   0.066   9.388
  110    HA   GLU  13           HA       GLU  13   1.662  -1.823  10.230
  111    HB2  GLU  13           HB2      GLU  13   0.066   0.311  11.680
  112    HB3  GLU  13           HB1      GLU  13   1.130  -0.787  12.554
  113    HG2  GLU  13           HG2      GLU  13   2.079   0.882  10.199
  114    HG3  GLU  13           HG1      GLU  13   2.183   1.433  11.869
  115    H    ASP  14           HN       ASP  14  -1.855  -1.687  10.397
  116    HA   ASP  14           HA       ASP  14  -2.202  -3.550  12.538
  117    HB2  ASP  14           HB2      ASP  14  -4.445  -3.958  11.593
  118    HB3  ASP  14           HB1      ASP  14  -4.076  -2.237  11.635
  119    H    LEU  15           HN       LEU  15  -0.681  -4.035   9.599
  120    HA   LEU  15           HA       LEU  15  -1.570  -6.805   9.142
  121    HB2  LEU  15           HB2      LEU  15   0.886  -5.399   8.052
  122    HB3  LEU  15           HB1      LEU  15   0.154  -6.875   7.429
  123    HG   LEU  15           HG       LEU  15  -1.151  -4.133   7.475
  124   HD11  LEU  15          HD11      LEU  15  -0.060  -5.826   5.209
  125   HD12  LEU  15          HD12      LEU  15   0.655  -4.336   5.819
  126   HD13  LEU  15          HD13      LEU  15  -0.913  -4.298   5.010
  127   HD21  LEU  15          HD21      LEU  15  -2.141  -6.875   6.626
  128   HD22  LEU  15          HD22      LEU  15  -2.803  -5.411   5.898
  129   HD23  LEU  15          HD23      LEU  15  -2.955  -5.673   7.628
  130    H    GLU  16           HN       GLU  16  -0.083  -8.647   9.288
  131    HA   GLU  16           HA       GLU  16   1.220  -8.752  11.869
  132    HB2  GLU  16           HB2      GLU  16   0.045 -10.659  10.543
  133    HB3  GLU  16           HB1      GLU  16   1.556 -10.802   9.655
  134    HG2  GLU  16           HG2      GLU  16   1.660 -12.389  11.460
  135    HG3  GLU  16           HG1      GLU  16   2.729 -11.062  11.902
  136    H    ASP  17           HN       ASP  17   3.545  -9.382  12.138
  137    HA   ASP  17           HA       ASP  17   5.287  -7.563  10.789
  138    HB2  ASP  17           HB2      ASP  17   5.994 -10.068  12.349
  139    HB3  ASP  17           HB1      ASP  17   7.100  -8.751  11.955
  140    H    VAL  18           HN       VAL  18   4.895 -11.113  10.424
  141    HA   VAL  18           HA       VAL  18   6.856 -11.329   8.330
  142    HB   VAL  18           HB       VAL  18   4.465 -13.117   8.946
  143   HG11  VAL  18          HG11      VAL  18   5.191 -13.560   6.676
  144   HG12  VAL  18          HG12      VAL  18   5.860 -14.835   7.692
  145   HG13  VAL  18          HG13      VAL  18   6.889 -13.507   7.152
  146   HG21  VAL  18          HG21      VAL  18   7.406 -13.402   9.663
  147   HG22  VAL  18          HG22      VAL  18   6.105 -14.494  10.132
  148   HG23  VAL  18          HG23      VAL  18   6.158 -12.855  10.782
  149    H    ASP  19           HN       ASP  19   3.407 -10.517   8.343
  150    HA   ASP  19           HA       ASP  19   3.093 -10.719   5.463
  151    HB2  ASP  19           HB2      ASP  19   1.490  -9.174   7.529
  152    HB3  ASP  19           HB1      ASP  19   1.002  -9.442   5.855
  153    H    LEU  20           HN       LEU  20   4.222  -8.293   7.714
  154    HA   LEU  20           HA       LEU  20   4.045  -5.993   6.053
  155    HB2  LEU  20           HB2      LEU  20   4.762  -6.333   8.598
  156    HB3  LEU  20           HB1      LEU  20   6.381  -6.409   7.932
  157    HG   LEU  20           HG       LEU  20   6.032  -4.133   8.559
  158   HD11  LEU  20          HD11      LEU  20   6.376  -2.951   6.537
  159   HD12  LEU  20          HD12      LEU  20   5.412  -4.089   5.603
  160   HD13  LEU  20          HD13      LEU  20   6.988  -4.574   6.232
  161   HD21  LEU  20          HD21      LEU  20   3.508  -3.894   6.899
  162   HD22  LEU  20          HD22      LEU  20   4.108  -2.832   8.163
  163   HD23  LEU  20          HD23      LEU  20   3.442  -4.402   8.586
  164    H    LYS  21           HN       LYS  21   6.479  -8.544   6.326
  165    HA   LYS  21           HA       LYS  21   8.378  -7.358   4.509
  166    HB2  LYS  21           HB2      LYS  21   9.007  -9.115   6.117
  167    HB3  LYS  21           HB1      LYS  21   7.959 -10.261   5.280
  168    HG2  LYS  21           HG2      LYS  21   9.322 -10.215   3.306
  169    HG3  LYS  21           HG1      LYS  21  10.226  -8.814   3.878
  170    HD2  LYS  21           HD2      LYS  21  11.519 -10.920   4.127
  171    HD3  LYS  21           HD1      LYS  21  11.218 -10.139   5.678
  172    HE2  LYS  21           HE2      LYS  21  10.816 -12.695   5.544
  173    HE3  LYS  21           HE1      LYS  21   9.545 -11.722   6.279
  174    HZ1  LYS  21           HZ1      LYS  21   8.239 -11.855   4.371
  175    HZ2  LYS  21           HZ2      LYS  21   8.870 -13.423   4.535
  176    HZ3  LYS  21           HZ3      LYS  21   9.531 -12.354   3.392
  177    H    LYS  22           HN       LYS  22   5.712  -9.673   4.055
  178    HA   LYS  22           HA       LYS  22   6.312 -10.220   1.288
  179    HB2  LYS  22           HB2      LYS  22   4.680 -11.459   2.960
  180    HB3  LYS  22           HB1      LYS  22   3.469 -10.329   2.354
  181    HG2  LYS  22           HG2      LYS  22   3.915 -11.079   0.047
  182    HG3  LYS  22           HG1      LYS  22   5.140 -12.200   0.640
  183    HD2  LYS  22           HD2      LYS  22   3.384 -13.304   2.040
  184    HD3  LYS  22           HD1      LYS  22   2.181 -12.253   1.294
  185    HE2  LYS  22           HE2      LYS  22   2.755 -13.148  -0.925
  186    HE3  LYS  22           HE1      LYS  22   3.984 -14.182  -0.198
  187    HZ1  LYS  22           HZ1      LYS  22   1.631 -15.115  -0.659
  188    HZ2  LYS  22           HZ2      LYS  22   1.213 -14.307   0.777
  189    HZ3  LYS  22           HZ3      LYS  22   2.414 -15.509   0.794
  190    H    PHE  23           HN       PHE  23   4.225  -7.807   2.844
  191    HA   PHE  23           HA       PHE  23   3.055  -6.737   0.441
  192    HB2  PHE  23           HB2      PHE  23   2.240  -6.287   2.746
  193    HB3  PHE  23           HB1      PHE  23   3.678  -5.331   3.057
  194    HD1  PHE  23           HD1      PHE  23   4.129  -3.256   1.654
  195    HD2  PHE  23           HD2      PHE  23   0.360  -5.327   1.594
  196    HE1  PHE  23           HE1      PHE  23   3.039  -1.255   0.686
  197    HE2  PHE  23           HE2      PHE  23  -0.722  -3.322   0.635
  198    HZ   PHE  23           HZ       PHE  23   0.614  -1.286   0.175
  199    H    LYS  24           HN       LYS  24   6.004  -5.796   2.250
  200    HA   LYS  24           HA       LYS  24   6.672  -3.639   0.437
  201    HB2  LYS  24           HB2      LYS  24   7.459  -3.810   2.816
  202    HB3  LYS  24           HB1      LYS  24   8.502  -5.146   2.328
  203    HG2  LYS  24           HG2      LYS  24   9.691  -3.696   0.763
  204    HG3  LYS  24           HG1      LYS  24   8.598  -2.360   1.132
  205    HD2  LYS  24           HD2      LYS  24   9.341  -2.474   3.518
  206    HD3  LYS  24           HD1      LYS  24  10.514  -3.708   3.058
  207    HE2  LYS  24           HE2      LYS  24  11.492  -2.086   1.415
  208    HE3  LYS  24           HE1      LYS  24  10.398  -0.855   2.044
  209    HZ1  LYS  24           HZ1      LYS  24  11.366  -1.257   4.262
  210    HZ2  LYS  24           HZ2      LYS  24  12.497  -0.664   3.142
  211    HZ3  LYS  24           HZ3      LYS  24  12.493  -2.311   3.559
  212    H    MET  25           HN       MET  25   7.937  -6.959   0.858
  213    HA   MET  25           HA       MET  25   9.832  -6.805  -1.271
  214    HB2  MET  25           HB2      MET  25   9.703  -8.589   0.540
  215    HB3  MET  25           HB1      MET  25   8.381  -9.316  -0.369
  216    HG2  MET  25           HG2      MET  25  10.376 -10.462  -1.052
  217    HG3  MET  25           HG1      MET  25   9.956  -9.380  -2.378
  218    HE1  MET  25           HE1      MET  25  11.879  -9.477   1.031
  219    HE2  MET  25           HE2      MET  25  13.524  -9.215   0.459
  220    HE3  MET  25           HE3      MET  25  12.618 -10.620  -0.099
  221    H    HIS  26           HN       HIS  26   6.410  -7.753  -1.227
  222    HA   HIS  26           HA       HIS  26   6.350  -8.601  -4.009
  223    HB2  HIS  26           HB2      HIS  26   4.621  -9.238  -2.268
  224    HB3  HIS  26           HB1      HIS  26   4.049  -7.570  -2.299
  225    HD1  HIS  26           HD1      HIS  26   5.058  -8.204  -5.632
  226    HD2  HIS  26           HD2      HIS  26   1.725  -9.322  -3.392
  227    HE1  HIS  26           HE1      HIS  26   3.259  -8.847  -7.297
  228    H    LEU  27           HN       LEU  27   5.976  -5.512  -2.358
  229    HA   LEU  27           HA       LEU  27   4.779  -4.055  -4.527
  230    HB2  LEU  27           HB2      LEU  27   5.048  -3.283  -2.109
  231    HB3  LEU  27           HB1      LEU  27   6.738  -2.963  -2.478
  232    HG   LEU  27           HG       LEU  27   5.771  -1.518  -4.476
  233   HD11  LEU  27          HD11      LEU  27   3.582  -0.457  -3.871
  234   HD12  LEU  27          HD12      LEU  27   3.384  -1.659  -2.599
  235   HD13  LEU  27          HD13      LEU  27   3.420  -2.160  -4.287
  236   HD21  LEU  27          HD21      LEU  27   5.598   0.452  -2.971
  237   HD22  LEU  27          HD22      LEU  27   6.988  -0.558  -2.576
  238   HD23  LEU  27          HD23      LEU  27   5.534  -0.632  -1.582
  239    H    GLU  28           HN       GLU  28   8.229  -4.397  -3.606
  240    HA   GLU  28           HA       GLU  28   9.179  -2.925  -5.899
  241    HB2  GLU  28           HB2      GLU  28  11.397  -3.940  -5.304
  242    HB3  GLU  28           HB1      GLU  28  10.600  -3.145  -3.948
  243    HG2  GLU  28           HG2      GLU  28   9.746  -5.332  -3.169
  244    HG3  GLU  28           HG1      GLU  28  10.561  -6.127  -4.515
  245    H    ASP  29           HN       ASP  29   8.301  -6.278  -5.386
  246    HA   ASP  29           HA       ASP  29   9.668  -7.281  -7.759
  247    HB2  ASP  29           HB2      ASP  29   7.386  -8.490  -6.169
  248    HB3  ASP  29           HB1      ASP  29   8.389  -9.336  -7.348
  249    H    TYR  30           HN       TYR  30   7.454  -5.022  -7.797
  250    HA   TYR  30           HA       TYR  30   5.298  -6.079  -9.337
  251    HB2  TYR  30           HB2      TYR  30   5.445  -3.805  -8.151
  252    HB3  TYR  30           HB1      TYR  30   6.339  -3.238  -9.558
  253    HD1  TYR  30           HD2      TYR  30   3.100  -4.624  -8.382
  254    HD2  TYR  30           HD1      TYR  30   5.198  -2.798 -11.656
  255    HE1  TYR  30           HE2      TYR  30   0.950  -4.277  -9.567
  256    HE2  TYR  30           HE1      TYR  30   3.046  -2.455 -12.839
  257    HH   TYR  30           HH       TYR  30   0.836  -2.612 -12.714
  258    HA   PRO  31           HA       PRO  31   7.918  -6.742 -12.978
  259    HB2  PRO  31           HB2      PRO  31   5.730  -7.123 -14.817
  260    HB3  PRO  31           HB1      PRO  31   6.687  -8.384 -14.027
  261    HG2  PRO  31           HG2      PRO  31   3.934  -7.546 -13.422
  262    HG3  PRO  31           HG1      PRO  31   4.817  -8.950 -12.803
  263    HD2  PRO  31           HD2      PRO  31   4.193  -6.546 -11.355
  264    HD3  PRO  31           HD1      PRO  31   5.230  -7.883 -10.805
  265    HA   PRO  32           HA       PRO  32   7.851  -2.796 -15.004
  266    HB2  PRO  32           HB2      PRO  32   8.408  -3.489 -17.700
  267    HB3  PRO  32           HB1      PRO  32   9.620  -3.234 -16.435
  268    HG2  PRO  32           HG2      PRO  32   8.660  -5.803 -17.604
  269    HG3  PRO  32           HG1      PRO  32  10.180  -5.462 -16.759
  270    HD2  PRO  32           HD2      PRO  32   7.971  -6.850 -15.647
  271    HD3  PRO  32           HD1      PRO  32   9.314  -6.139 -14.725
  272    H    GLN  33           HN       GLN  33   6.251  -1.481 -15.869
  273    HA   GLN  33           HA       GLN  33   3.930  -2.794 -17.266
  274    HB2  GLN  33           HB2      GLN  33   2.622  -0.823 -16.437
  275    HB3  GLN  33           HB1      GLN  33   3.236  -1.851 -15.148
  276    HG2  GLN  33           HG2      GLN  33   4.720   0.628 -16.085
  277    HG3  GLN  33           HG1      GLN  33   3.513   0.675 -14.806
  278   HE21  GLN  33          HE21      GLN  33   3.951  -0.843 -12.896
  279   HE22  GLN  33          HE22      GLN  33   5.568  -1.130 -12.467
  280    H    LYS  34           HN       LYS  34   6.534  -1.596 -18.320
  281    HA   LYS  34           HA       LYS  34   7.274  -0.008 -19.899
  282    HB2  LYS  34           HB2      LYS  34   6.031  -0.236 -22.046
  283    HB3  LYS  34           HB1      LYS  34   6.431  -1.782 -21.306
  284    HG2  LYS  34           HG2      LYS  34   4.172  -2.073 -20.506
  285    HG3  LYS  34           HG1      LYS  34   3.737  -0.427 -20.969
  286    HD2  LYS  34           HD2      LYS  34   4.017  -0.960 -23.321
  287    HD3  LYS  34           HD1      LYS  34   4.630  -2.565 -22.923
  288    HE2  LYS  34           HE2      LYS  34   2.223  -2.590 -23.596
  289    HE3  LYS  34           HE1      LYS  34   2.483  -3.197 -21.961
  290    HZ1  LYS  34           HZ1      LYS  34   0.633  -1.653 -22.036
  291    HZ2  LYS  34           HZ2      LYS  34   1.638  -0.441 -22.674
  292    HZ3  LYS  34           HZ3      LYS  34   1.896  -1.018 -21.097
  293    H    GLY  35           HN       GLY  35   6.081   1.476 -17.957
  294    HA2  GLY  35           HA2      GLY  35   5.252   3.831 -19.414
  295    HA3  GLY  35           HA1      GLY  35   3.885   3.094 -18.575
  296    H    CYS  36           HN       CYS  36   4.255   2.649 -16.192
  297    HA   CYS  36           HA       CYS  36   5.134   5.039 -14.867
  298    HB2  CYS  36           HB2      CYS  36   3.424   3.387 -13.985
  299    HB3  CYS  36           HB1      CYS  36   4.766   2.312 -13.590
  300    HG   CYS  36           HG       CYS  36   5.505   4.837 -12.321
  301    H    ILE  37           HN       ILE  37   6.995   5.332 -13.500
  302    HA   ILE  37           HA       ILE  37   9.382   3.973 -14.493
  303    HB   ILE  37           HB       ILE  37   9.300   6.415 -14.015
  304   HG12  ILE  37          HG12      ILE  37  11.289   4.814 -12.367
  305   HG13  ILE  37          HG11      ILE  37  11.458   5.257 -14.066
  306   HG21  ILE  37          HG21      ILE  37   9.186   7.268 -11.784
  307   HG22  ILE  37          HG22      ILE  37   9.355   5.663 -11.078
  308   HG23  ILE  37          HG23      ILE  37   7.865   6.107 -11.913
  309   HD11  ILE  37          HD11      ILE  37  11.434   7.130 -11.676
  310   HD12  ILE  37          HD12      ILE  37  11.293   7.697 -13.340
  311   HD13  ILE  37          HD13      ILE  37  12.754   6.860 -12.815
  312    HA   PRO  38           HA       PRO  38   9.100   0.911 -11.172
  313    HB2  PRO  38           HB2      PRO  38  11.878   0.184 -11.156
  314    HB3  PRO  38           HB1      PRO  38  10.577  -0.639 -12.028
  315    HG2  PRO  38           HG2      PRO  38  12.682   1.125 -13.113
  316    HG3  PRO  38           HG1      PRO  38  11.589   0.040 -13.988
  317    HD2  PRO  38           HD2      PRO  38  11.411   2.887 -13.901
  318    HD3  PRO  38           HD1      PRO  38  10.173   1.777 -14.530
  319    H    LEU  39           HN       LEU  39   9.405   1.030  -8.936
  320    HA   LEU  39           HA       LEU  39  10.527   3.480  -7.862
  321    HB2  LEU  39           HB2      LEU  39   9.234   1.012  -6.704
  322    HB3  LEU  39           HB1      LEU  39  10.004   2.171  -5.625
  323    HG   LEU  39           HG       LEU  39   8.563   3.961  -6.461
  324   HD11  LEU  39          HD11      LEU  39   7.527   1.805  -8.326
  325   HD12  LEU  39          HD12      LEU  39   8.242   3.358  -8.762
  326   HD13  LEU  39          HD13      LEU  39   6.650   3.304  -8.014
  327   HD21  LEU  39          HD21      LEU  39   7.771   2.460  -4.619
  328   HD22  LEU  39          HD22      LEU  39   6.929   1.484  -5.823
  329   HD23  LEU  39          HD23      LEU  39   6.447   3.159  -5.552
  330    HA   PRO  40           HA       PRO  40  14.655   1.515  -7.714
  331    HB2  PRO  40           HB2      PRO  40  15.581   3.605  -5.852
  332    HB3  PRO  40           HB1      PRO  40  16.094   3.318  -7.522
  333    HG2  PRO  40           HG2      PRO  40  14.430   5.459  -6.605
  334    HG3  PRO  40           HG1      PRO  40  14.771   5.042  -8.291
  335    HD2  PRO  40           HD2      PRO  40  12.266   4.654  -6.815
  336    HD3  PRO  40           HD1      PRO  40  12.578   4.365  -8.543
  337    H    ARG  41           HN       ARG  41  15.365  -0.046  -6.294
  338    HA   ARG  41           HA       ARG  41  13.839  -0.657  -3.936
  339    HB2  ARG  41           HB2      ARG  41  15.167  -2.314  -5.328
  340    HB3  ARG  41           HB1      ARG  41  16.635  -1.649  -4.609
  341    HG2  ARG  41           HG2      ARG  41  15.822  -2.235  -2.363
  342    HG3  ARG  41           HG1      ARG  41  14.330  -2.868  -3.057
  343    HD2  ARG  41           HD2      ARG  41  15.577  -4.572  -4.282
  344    HD3  ARG  41           HD1      ARG  41  17.104  -3.905  -3.705
  345    HE   ARG  41           HE       ARG  41  15.694  -4.472  -1.379
  346   HH11  ARG  41          HH21      ARG  41  16.642  -6.196  -4.218
  347   HH12  ARG  41          HH22      ARG  41  16.763  -7.723  -3.407
  348   HH21  ARG  41          HH11      ARG  41  15.845  -6.454  -0.313
  349   HH22  ARG  41          HH12      ARG  41  16.311  -7.868  -1.199
  350    H    GLY  42           HN       GLY  42  16.820   1.152  -4.449
  351    HA2  GLY  42           HA2      GLY  42  17.723   1.189  -1.723
  352    HA3  GLY  42           HA1      GLY  42  18.109   2.444  -2.904
  353    H    GLN  43           HN       GLN  43  15.350   3.262  -3.414
  354    HA   GLN  43           HA       GLN  43  15.020   5.046  -1.132
  355    HB2  GLN  43           HB2      GLN  43  13.350   4.560  -3.625
  356    HB3  GLN  43           HB1      GLN  43  12.961   5.798  -2.430
  357    HG2  GLN  43           HG2      GLN  43  15.245   6.777  -2.781
  358    HG3  GLN  43           HG1      GLN  43  15.507   5.603  -4.071
  359   HE21  GLN  43          HE21      GLN  43  15.651   7.489  -5.587
  360   HE22  GLN  43          HE22      GLN  43  14.226   8.238  -6.126
  361    H    THR  44           HN       THR  44  12.957   2.458  -2.530
  362    HA   THR  44           HA       THR  44  10.973   2.553  -0.486
  363    HB   THR  44           HB       THR  44  11.873   0.196  -2.177
  364    HG1  THR  44           HG1      THR  44  11.059   1.467  -3.636
  365   HG21  THR  44          HG21      THR  44  10.555  -0.652  -0.350
  366   HG22  THR  44          HG22      THR  44   9.498  -0.580  -1.759
  367   HG23  THR  44          HG23      THR  44   9.384   0.658  -0.510
  368    H    GLU  45           HN       GLU  45  14.064   0.847  -0.667
  369    HA   GLU  45           HA       GLU  45  13.633  -0.778   1.677
  370    HB2  GLU  45           HB2      GLU  45  15.329  -1.397   0.030
  371    HB3  GLU  45           HB1      GLU  45  16.162   0.137   0.246
  372    HG2  GLU  45           HG2      GLU  45  17.264  -1.767   1.426
  373    HG3  GLU  45           HG1      GLU  45  16.802  -0.462   2.511
  374    H    LYS  46           HN       LYS  46  15.203   2.420   1.142
  375    HA   LYS  46           HA       LYS  46  15.802   2.696   4.021
  376    HB2  LYS  46           HB2      LYS  46  16.071   4.630   1.697
  377    HB3  LYS  46           HB1      LYS  46  16.635   4.941   3.340
  378    HG2  LYS  46           HG2      LYS  46  18.119   2.976   3.212
  379    HG3  LYS  46           HG1      LYS  46  17.553   2.653   1.573
  380    HD2  LYS  46           HD2      LYS  46  18.402   4.856   0.845
  381    HD3  LYS  46           HD1      LYS  46  18.978   5.172   2.482
  382    HE2  LYS  46           HE2      LYS  46  20.457   3.202   2.350
  383    HE3  LYS  46           HE1      LYS  46  19.883   2.881   0.712
  384    HZ1  LYS  46           HZ1      LYS  46  20.632   5.242   0.218
  385    HZ2  LYS  46           HZ2      LYS  46  21.848   4.074   0.432
  386    HZ3  LYS  46           HZ3      LYS  46  21.485   5.168   1.681
  387    H    ALA  47           HN       ALA  47  13.129   3.240   1.984
  388    HA   ALA  47           HA       ALA  47  12.037   5.612   3.162
  389    HB1  ALA  47           HB1      ALA  47  10.680   3.248   1.837
  390    HB2  ALA  47           HB2      ALA  47  11.144   4.767   1.069
  391    HB3  ALA  47           HB3      ALA  47   9.854   4.745   2.271
  392    H    ASP  48           HN       ASP  48  11.076   5.911   5.115
  393    HA   ASP  48           HA       ASP  48  10.901   3.665   7.012
  394    HB2  ASP  48           HB2      ASP  48   9.967   6.538   7.346
  395    HB3  ASP  48           HB1      ASP  48  10.283   5.372   8.631
  396    H    HIS  49           HN       HIS  49   8.738   3.521   8.323
  397    HA   HIS  49           HA       HIS  49   6.670   2.655   6.602
  398    HB2  HIS  49           HB2      HIS  49   6.513   3.560   9.490
  399    HB3  HIS  49           HB1      HIS  49   5.222   2.711   8.642
  400    HD1  HIS  49           HD1      HIS  49   7.218   0.787   7.045
  401    HD2  HIS  49           HD2      HIS  49   7.166   1.375  11.173
  402    HE1  HIS  49           HE1      HIS  49   8.292  -1.263   8.075
  403    H    VAL  50           HN       VAL  50   7.004   5.776   8.331
  404    HA   VAL  50           HA       VAL  50   4.516   6.859   7.274
  405    HB   VAL  50           HB       VAL  50   6.999   8.289   8.330
  406   HG11  VAL  50          HG11      VAL  50   5.363  10.176   8.746
  407   HG12  VAL  50          HG12      VAL  50   4.184   9.295   7.777
  408   HG13  VAL  50          HG13      VAL  50   5.683   9.864   7.042
  409   HG21  VAL  50          HG21      VAL  50   5.630   8.515  10.415
  410   HG22  VAL  50          HG22      VAL  50   6.016   6.839  10.033
  411   HG23  VAL  50          HG23      VAL  50   4.405   7.472   9.694
  412    H    ASP  51           HN       ASP  51   7.949   7.424   6.388
  413    HA   ASP  51           HA       ASP  51   7.438   9.082   4.147
  414    HB2  ASP  51           HB2      ASP  51   9.698   7.117   4.648
  415    HB3  ASP  51           HB1      ASP  51   9.696   8.304   3.343
  416    H    LEU  52           HN       LEU  52   7.459   5.555   4.438
  417    HA   LEU  52           HA       LEU  52   7.419   4.861   1.717
  418    HB2  LEU  52           HB2      LEU  52   7.590   3.202   3.525
  419    HB3  LEU  52           HB1      LEU  52   5.936   3.552   4.013
  420    HG   LEU  52           HG       LEU  52   5.104   2.717   1.841
  421   HD11  LEU  52          HD11      LEU  52   8.061   2.417   1.258
  422   HD12  LEU  52          HD12      LEU  52   6.800   3.128   0.247
  423   HD13  LEU  52          HD13      LEU  52   6.879   1.384   0.452
  424   HD21  LEU  52          HD21      LEU  52   7.024   0.774   3.161
  425   HD22  LEU  52          HD22      LEU  52   5.583   0.356   2.234
  426   HD23  LEU  52          HD23      LEU  52   5.426   1.186   3.783
  427    H    ALA  53           HN       ALA  53   4.626   5.578   3.848
  428    HA   ALA  53           HA       ALA  53   2.658   5.323   1.762
  429    HB1  ALA  53           HB1      ALA  53   2.563   6.935   4.331
  430    HB2  ALA  53           HB2      ALA  53   2.071   5.251   4.153
  431    HB3  ALA  53           HB3      ALA  53   1.171   6.525   3.329
  432    H    THR  54           HN       THR  54   4.750   7.969   2.762
  433    HA   THR  54           HA       THR  54   3.283  10.056   1.373
  434    HB   THR  54           HB       THR  54   6.216   9.943   2.162
  435    HG1  THR  54           HG1      THR  54   4.585  11.473   3.667
  436   HG21  THR  54          HG21      THR  54   5.840  11.729   0.570
  437   HG22  THR  54          HG22      THR  54   5.963  12.447   2.175
  438   HG23  THR  54          HG23      THR  54   4.383  12.242   1.422
  439    H    LEU  55           HN       LEU  55   5.877   7.820   0.437
  440    HA   LEU  55           HA       LEU  55   6.444   9.127  -2.086
  441    HB2  LEU  55           HB2      LEU  55   8.004   7.468  -0.875
  442    HB3  LEU  55           HB1      LEU  55   6.942   6.192  -1.468
  443    HG   LEU  55           HG       LEU  55   7.346   7.389  -3.832
  444   HD11  LEU  55          HD11      LEU  55   8.667   9.270  -2.893
  445   HD12  LEU  55          HD12      LEU  55   9.629   8.304  -4.009
  446   HD13  LEU  55          HD13      LEU  55   9.849   8.121  -2.270
  447   HD21  LEU  55          HD21      LEU  55   9.433   5.654  -2.466
  448   HD22  LEU  55          HD22      LEU  55   9.290   5.892  -4.208
  449   HD23  LEU  55          HD23      LEU  55   8.003   5.075  -3.320
  450    H    MET  56           HN       MET  56   4.242   6.599  -1.002
  451    HA   MET  56           HA       MET  56   3.418   5.761  -3.636
  452    HB2  MET  56           HB2      MET  56   3.031   4.515  -1.442
  453    HB3  MET  56           HB1      MET  56   1.734   5.662  -1.110
  454    HG2  MET  56           HG2      MET  56   0.758   5.009  -3.391
  455    HG3  MET  56           HG1      MET  56   1.914   3.679  -3.397
  456    HE1  MET  56           HE1      MET  56   1.872   1.654  -1.850
  457    HE2  MET  56           HE2      MET  56   0.675   1.521  -3.134
  458    HE3  MET  56           HE3      MET  56   0.266   1.000  -1.501
  459    H    ILE  57           HN       ILE  57   2.168   8.234  -1.376
  460    HA   ILE  57           HA       ILE  57  -0.061   8.910  -3.149
  461    HB   ILE  57           HB       ILE  57   1.107  10.537  -0.858
  462   HG12  ILE  57          HG12      ILE  57  -1.304   8.687  -0.841
  463   HG13  ILE  57          HG11      ILE  57   0.292   8.187  -0.286
  464   HG21  ILE  57          HG21      ILE  57  -1.517  10.681  -2.373
  465   HG22  ILE  57          HG22      ILE  57  -0.270  11.924  -2.288
  466   HG23  ILE  57          HG23      ILE  57  -1.215  11.528  -0.857
  467   HD11  ILE  57          HD11      ILE  57  -1.161   8.968   1.581
  468   HD12  ILE  57          HD12      ILE  57  -1.250  10.554   0.818
  469   HD13  ILE  57          HD13      ILE  57   0.296   9.946   1.410
  470    H    ASP  58           HN       ASP  58   3.216  10.190  -2.638
  471    HA   ASP  58           HA       ASP  58   2.772  12.510  -4.350
  472    HB2  ASP  58           HB2      ASP  58   4.489  12.393  -2.494
  473    HB3  ASP  58           HB1      ASP  58   5.415  11.285  -3.502
  474    H    PHE  59           HN       PHE  59   4.650   9.449  -4.850
  475    HA   PHE  59           HA       PHE  59   5.192  10.205  -7.629
  476    HB2  PHE  59           HB2      PHE  59   5.732   7.760  -5.945
  477    HB3  PHE  59           HB1      PHE  59   5.955   7.662  -7.688
  478    HD1  PHE  59           HD1      PHE  59   6.815   9.850  -4.767
  479    HD2  PHE  59           HD2      PHE  59   8.046   8.350  -8.600
  480    HE1  PHE  59           HE1      PHE  59   8.996  11.002  -4.520
  481    HE2  PHE  59           HE2      PHE  59  10.226   9.498  -8.348
  482    HZ   PHE  59           HZ       PHE  59  10.702  10.824  -6.309
  483    H    ASN  60           HN       ASN  60   2.852   7.836  -6.180
  484    HA   ASN  60           HA       ASN  60   1.895   7.205  -8.938
  485    HB2  ASN  60           HB2      ASN  60   1.110   6.125  -6.212
  486    HB3  ASN  60           HB1      ASN  60   0.383   5.594  -7.722
  487   HD21  ASN  60          HD21      ASN  60   1.255   3.517  -7.997
  488   HD22  ASN  60          HD22      ASN  60   2.917   3.173  -8.008
  489    H    GLY  61           HN       GLY  61   0.895   9.074  -6.131
  490    HA2  GLY  61           HA2      GLY  61  -0.660  10.921  -6.318
  491    HA3  GLY  61           HA1      GLY  61  -1.400  10.151  -7.719
  492    H    GLU  62           HN       GLU  62  -2.990  11.059  -5.630
  493    HA   GLU  62           HA       GLU  62  -3.560   9.016  -3.675
  494    HB2  GLU  62           HB2      GLU  62  -4.188  11.429  -3.444
  495    HB3  GLU  62           HB1      GLU  62  -5.400  11.194  -4.704
  496    HG2  GLU  62           HG2      GLU  62  -6.567   9.544  -3.349
  497    HG3  GLU  62           HG1      GLU  62  -5.300   9.601  -2.124
  498    H    GLU  63           HN       GLU  63  -4.807   9.697  -6.920
  499    HA   GLU  63           HA       GLU  63  -7.029   7.870  -6.750
  500    HB2  GLU  63           HB2      GLU  63  -6.596   9.795  -8.445
  501    HB3  GLU  63           HB1      GLU  63  -5.620   8.629  -9.330
  502    HG2  GLU  63           HG2      GLU  63  -8.547   8.245  -8.587
  503    HG3  GLU  63           HG1      GLU  63  -7.958   8.735 -10.173
  504    H    LYS  64           HN       LYS  64  -3.827   7.508  -8.352
  505    HA   LYS  64           HA       LYS  64  -4.298   4.715  -8.957
  506    HB2  LYS  64           HB2      LYS  64  -2.713   6.176 -10.224
  507    HB3  LYS  64           HB1      LYS  64  -1.650   6.174  -8.820
  508    HG2  LYS  64           HG2      LYS  64  -1.383   3.761  -8.953
  509    HG3  LYS  64           HG1      LYS  64  -2.570   3.670 -10.255
  510    HD2  LYS  64           HD2      LYS  64  -1.106   5.046 -11.689
  511    HD3  LYS  64           HD1      LYS  64   0.082   5.136 -10.388
  512    HE2  LYS  64           HE2      LYS  64   0.232   2.638 -10.417
  513    HE3  LYS  64           HE1      LYS  64  -0.845   2.626 -11.814
  514    HZ1  LYS  64           HZ1      LYS  64   0.874   4.277 -12.774
  515    HZ2  LYS  64           HZ2      LYS  64   1.219   2.613 -12.790
  516    HZ3  LYS  64           HZ3      LYS  64   1.917   3.617 -11.611
  517    H    ALA  65           HN       ALA  65  -2.599   6.391  -6.291
  518    HA   ALA  65           HA       ALA  65  -1.327   4.159  -5.129
  519    HB1  ALA  65           HB1      ALA  65  -2.673   6.498  -3.752
  520    HB2  ALA  65           HB2      ALA  65  -0.984   6.404  -4.251
  521    HB3  ALA  65           HB3      ALA  65  -1.581   5.366  -2.957
  522    H    TRP  66           HN       TRP  66  -4.664   5.327  -4.509
  523    HA   TRP  66           HA       TRP  66  -5.363   3.227  -2.705
  524    HB2  TRP  66           HB2      TRP  66  -6.893   5.157  -4.444
  525    HB3  TRP  66           HB1      TRP  66  -7.790   3.790  -3.786
  526    HD1  TRP  66           HD1      TRP  66  -6.987   7.212  -2.934
  527    HE1  TRP  66           HE1      TRP  66  -7.213   7.644  -0.404
  528    HE3  TRP  66           HE3      TRP  66  -7.139   2.401  -1.239
  529    HZ2  TRP  66           HZ2      TRP  66  -7.432   6.147   2.023
  530    HZ3  TRP  66           HZ3      TRP  66  -7.360   1.931   1.206
  531    HH2  TRP  66           HH2      TRP  66  -7.505   3.801   2.823
  532    H    ALA  67           HN       ALA  67  -5.518   3.422  -6.258
  533    HA   ALA  67           HA       ALA  67  -6.894   0.981  -6.720
  534    HB1  ALA  67           HB1      ALA  67  -6.304   2.694  -8.472
  535    HB2  ALA  67           HB2      ALA  67  -5.939   1.036  -8.950
  536    HB3  ALA  67           HB3      ALA  67  -4.643   2.107  -8.416
  537    H    MET  68           HN       MET  68  -3.476   1.610  -6.030
  538    HA   MET  68           HA       MET  68  -2.671  -1.169  -6.461
  539    HB2  MET  68           HB2      MET  68  -1.335   1.270  -5.259
  540    HB3  MET  68           HB1      MET  68  -0.572  -0.314  -5.149
  541    HG2  MET  68           HG2      MET  68  -1.481   0.898  -7.777
  542    HG3  MET  68           HG1      MET  68   0.151   1.089  -7.139
  543    HE1  MET  68           HE1      MET  68   1.887  -2.169  -7.528
  544    HE2  MET  68           HE2      MET  68   1.412  -1.237  -6.112
  545    HE3  MET  68           HE3      MET  68   1.980  -0.403  -7.556
  546    H    ALA  69           HN       ALA  69  -3.686   0.800  -3.705
  547    HA   ALA  69           HA       ALA  69  -2.936  -1.065  -1.660
  548    HB1  ALA  69           HB1      ALA  69  -3.573   1.329  -1.247
  549    HB2  ALA  69           HB2      ALA  69  -4.448   0.200  -0.211
  550    HB3  ALA  69           HB3      ALA  69  -5.246   0.909  -1.616
  551    H    VAL  70           HN       VAL  70  -5.963  -0.686  -3.530
  552    HA   VAL  70           HA       VAL  70  -7.286  -2.860  -2.069
  553    HB   VAL  70           HB       VAL  70  -9.041  -2.638  -3.801
  554   HG11  VAL  70          HG11      VAL  70  -8.021   0.058  -2.837
  555   HG12  VAL  70          HG12      VAL  70  -8.905  -1.084  -1.825
  556   HG13  VAL  70          HG13      VAL  70  -9.691  -0.355  -3.227
  557   HG21  VAL  70          HG21      VAL  70  -7.023  -0.747  -5.055
  558   HG22  VAL  70          HG22      VAL  70  -8.731  -0.750  -5.487
  559   HG23  VAL  70          HG23      VAL  70  -7.744  -2.177  -5.790
  560    H    TRP  71           HN       TRP  71  -5.660  -2.583  -5.238
  561    HA   TRP  71           HA       TRP  71  -6.251  -5.320  -5.986
  562    HB2  TRP  71           HB2      TRP  71  -5.756  -3.512  -7.645
  563    HB3  TRP  71           HB1      TRP  71  -4.085  -3.491  -7.089
  564    HD1  TRP  71           HD1      TRP  71  -6.604  -5.692  -8.933
  565    HE1  TRP  71           HE1      TRP  71  -5.321  -7.530 -10.207
  566    HE3  TRP  71           HE3      TRP  71  -1.887  -4.869  -7.157
  567    HZ2  TRP  71           HZ2      TRP  71  -2.647  -8.520 -10.441
  568    HZ3  TRP  71           HZ3      TRP  71   0.006  -6.273  -7.920
  569    HH2  TRP  71           HH2      TRP  71  -0.366  -8.095  -9.559
  570    H    ILE  72           HN       ILE  72  -3.548  -3.823  -4.207
  571    HA   ILE  72           HA       ILE  72  -1.836  -6.168  -4.511
  572    HB   ILE  72           HB       ILE  72  -1.050  -3.818  -3.938
  573   HG12  ILE  72          HG12      ILE  72  -0.121  -5.976  -2.007
  574   HG13  ILE  72          HG11      ILE  72   0.360  -5.908  -3.699
  575   HG21  ILE  72          HG21      ILE  72  -1.145  -3.045  -1.676
  576   HG22  ILE  72          HG22      ILE  72  -1.809  -4.576  -1.104
  577   HG23  ILE  72          HG23      ILE  72  -2.782  -3.512  -2.115
  578   HD11  ILE  72          HD11      ILE  72   0.824  -3.621  -1.757
  579   HD12  ILE  72          HD12      ILE  72   1.485  -3.800  -3.382
  580   HD13  ILE  72          HD13      ILE  72   2.014  -4.874  -2.091
  581    H    PHE  73           HN       PHE  73  -4.042  -5.082  -1.844
  582    HA   PHE  73           HA       PHE  73  -3.483  -7.270  -0.112
  583    HB2  PHE  73           HB2      PHE  73  -6.230  -6.046  -0.512
  584    HB3  PHE  73           HB1      PHE  73  -5.672  -6.926   0.901
  585    HD1  PHE  73           HD1      PHE  73  -2.968  -5.685   1.405
  586    HD2  PHE  73           HD2      PHE  73  -6.709  -3.867   0.268
  587    HE1  PHE  73           HE1      PHE  73  -2.268  -3.565   2.452
  588    HE2  PHE  73           HE2      PHE  73  -5.985  -1.752   1.318
  589    HZ   PHE  73           HZ       PHE  73  -3.772  -1.597   2.410
  590    H    ALA  74           HN       ALA  74  -5.911  -7.065  -2.749
  591    HA   ALA  74           HA       ALA  74  -7.036  -9.639  -2.396
  592    HB1  ALA  74           HB1      ALA  74  -7.934  -7.959  -3.979
  593    HB2  ALA  74           HB2      ALA  74  -7.652  -9.502  -4.787
  594    HB3  ALA  74           HB3      ALA  74  -6.516  -8.171  -5.006
  595    H    ALA  75           HN       ALA  75  -3.937  -8.713  -3.776
  596    HA   ALA  75           HA       ALA  75  -3.410 -11.153  -5.184
  597    HB1  ALA  75           HB1      ALA  75  -1.096 -10.444  -5.208
  598    HB2  ALA  75           HB2      ALA  75  -1.360  -9.365  -3.838
  599    HB3  ALA  75           HB3      ALA  75  -2.095  -9.002  -5.399
  600    H    ILE  76           HN       ILE  76  -2.582 -10.143  -1.848
  601    HA   ILE  76           HA       ILE  76  -1.455 -12.787  -1.233
  602    HB   ILE  76           HB       ILE  76  -1.406 -11.827   1.154
  603   HG12  ILE  76          HG12      ILE  76  -2.175  -9.272  -0.308
  604   HG13  ILE  76          HG11      ILE  76  -3.270 -10.184   0.722
  605   HG21  ILE  76          HG21      ILE  76   0.536 -11.764  -0.389
  606   HG22  ILE  76          HG22      ILE  76   0.483 -10.336   0.640
  607   HG23  ILE  76          HG23      ILE  76  -0.037 -10.230  -1.042
  608   HD11  ILE  76          HD11      ILE  76  -1.538  -9.931   2.585
  609   HD12  ILE  76          HD12      ILE  76  -2.353  -8.450   2.095
  610   HD13  ILE  76          HD13      ILE  76  -0.715  -8.776   1.535
  611    H    ASN  77           HN       ASN  77  -4.374 -12.319  -2.032
  612    HA   ASN  77           HA       ASN  77  -6.464 -13.207  -1.504
  613    HB2  ASN  77           HB2      ASN  77  -4.694 -15.110   0.073
  614    HB3  ASN  77           HB1      ASN  77  -6.402 -15.387  -0.263
  615   HD21  ASN  77          HD21      ASN  77  -3.179 -15.424  -1.657
  616   HD22  ASN  77          HD22      ASN  77  -3.636 -16.027  -3.176
  617    H    ARG  78           HN       ARG  78  -5.277 -11.119   0.357
  618    HA   ARG  78           HA       ARG  78  -6.569 -11.816   2.954
  619    HB2  ARG  78           HB2      ARG  78  -4.318 -10.649   2.813
  620    HB3  ARG  78           HB1      ARG  78  -5.155  -9.250   2.151
  621    HG2  ARG  78           HG2      ARG  78  -5.668  -8.549   4.274
  622    HG3  ARG  78           HG1      ARG  78  -6.585 -10.022   4.551
  623    HD2  ARG  78           HD2      ARG  78  -4.574 -11.167   5.344
  624    HD3  ARG  78           HD1      ARG  78  -3.586  -9.762   4.949
  625    HE   ARG  78           HE       ARG  78  -5.523  -8.765   6.675
  626   HH11  ARG  78          HH21      ARG  78  -3.205 -11.324   6.716
  627   HH12  ARG  78          HH22      ARG  78  -2.974 -11.263   8.432
  628   HH21  ARG  78          HH11      ARG  78  -5.231  -8.677   8.912
  629   HH22  ARG  78          HH12      ARG  78  -4.120  -9.766   9.674
  630    H    ARG  79           HN       ARG  79  -8.410 -11.784   0.989
  631    HA   ARG  79           HA       ARG  79  -9.618  -9.372   0.220
  632    HB2  ARG  79           HB2      ARG  79 -10.223 -11.673  -0.578
  633    HB3  ARG  79           HB1      ARG  79 -11.088 -11.920   0.939
  634    HG2  ARG  79           HG2      ARG  79 -12.546 -10.017   0.452
  635    HG3  ARG  79           HG1      ARG  79 -11.658  -9.678  -1.028
  636    HD2  ARG  79           HD2      ARG  79 -12.266 -12.088  -1.739
  637    HD3  ARG  79           HD1      ARG  79 -13.431 -12.062  -0.420
  638    HE   ARG  79           HE       ARG  79 -13.736 -10.868  -3.017
  639   HH11  ARG  79          HH21      ARG  79 -14.323 -10.190   0.322
  640   HH12  ARG  79          HH22      ARG  79 -15.428  -8.901  -0.013
  641   HH21  ARG  79          HH11      ARG  79 -15.183  -9.216  -3.449
  642   HH22  ARG  79          HH12      ARG  79 -15.920  -8.356  -2.139
  643    H    ASP  80           HN       ASP  80  -9.747 -10.956   3.360
  644    HA   ASP  80           HA       ASP  80 -12.096  -9.866   4.429
  645    HB2  ASP  80           HB2      ASP  80  -9.417 -10.287   5.790
  646    HB3  ASP  80           HB1      ASP  80 -10.928  -9.976   6.647
  647    H    LEU  81           HN       LEU  81  -8.866  -8.301   4.346
  648    HA   LEU  81           HA       LEU  81  -9.811  -5.904   5.641
  649    HB2  LEU  81           HB2      LEU  81  -7.300  -6.814   4.352
  650    HB3  LEU  81           HB1      LEU  81  -7.556  -5.082   4.189
  651    HG   LEU  81           HG       LEU  81  -7.830  -6.465   6.884
  652   HD11  LEU  81          HD11      LEU  81  -5.585  -7.001   6.102
  653   HD12  LEU  81          HD12      LEU  81  -5.480  -5.747   7.335
  654   HD13  LEU  81          HD13      LEU  81  -5.316  -5.324   5.630
  655   HD21  LEU  81          HD21      LEU  81  -7.204  -3.613   6.032
  656   HD22  LEU  81          HD22      LEU  81  -7.235  -4.174   7.702
  657   HD23  LEU  81          HD23      LEU  81  -8.713  -4.171   6.749
  658    H    TYR  82           HN       TYR  82  -9.945  -6.989   2.291
  659    HA   TYR  82           HA       TYR  82 -10.291  -4.404   1.104
  660    HB2  TYR  82           HB2      TYR  82  -9.908  -6.379  -0.291
  661    HB3  TYR  82           HB1      TYR  82 -11.428  -7.089   0.248
  662    HD1  TYR  82           HD1      TYR  82 -10.132  -3.892  -1.228
  663    HD2  TYR  82           HD2      TYR  82 -13.327  -6.767  -1.149
  664    HE1  TYR  82           HE1      TYR  82 -11.307  -2.642  -3.018
  665    HE2  TYR  82           HE2      TYR  82 -14.494  -5.516  -2.939
  666    HH   TYR  82           HH       TYR  82 -13.517  -3.788  -4.911
  667    H    GLU  83           HN       GLU  83 -12.498  -6.569   2.806
  668    HA   GLU  83           HA       GLU  83 -14.900  -5.091   2.126
  669    HB2  GLU  83           HB2      GLU  83 -14.321  -7.012   4.402
  670    HB3  GLU  83           HB1      GLU  83 -15.922  -6.408   3.974
  671    HG2  GLU  83           HG2      GLU  83 -15.693  -7.391   1.723
  672    HG3  GLU  83           HG1      GLU  83 -14.093  -7.996   2.149
  673    H    LYS  84           HN       LYS  84 -12.672  -5.062   4.919
  674    HA   LYS  84           HA       LYS  84 -14.230  -3.070   6.367
  675    HB2  LYS  84           HB2      LYS  84 -11.287  -3.689   6.762
  676    HB3  LYS  84           HB1      LYS  84 -12.428  -3.054   7.946
  677    HG2  LYS  84           HG2      LYS  84 -12.519  -5.823   6.697
  678    HG3  LYS  84           HG1      LYS  84 -11.995  -5.443   8.336
  679    HD2  LYS  84           HD2      LYS  84 -14.338  -4.396   8.665
  680    HD3  LYS  84           HD1      LYS  84 -14.785  -5.217   7.169
  681    HE2  LYS  84           HE2      LYS  84 -14.143  -7.381   8.148
  682    HE3  LYS  84           HE1      LYS  84 -13.670  -6.573   9.642
  683    HZ1  LYS  84           HZ1      LYS  84 -16.147  -5.641   9.308
  684    HZ2  LYS  84           HZ2      LYS  84 -15.774  -7.021  10.226
  685    HZ3  LYS  84           HZ3      LYS  84 -16.313  -7.182   8.623
  686    H    ALA  85           HN       ALA  85 -11.114  -2.883   4.609
  687    HA   ALA  85           HA       ALA  85 -10.675  -0.122   4.865
  688    HB1  ALA  85           HB1      ALA  85  -9.014  -1.645   3.884
  689    HB2  ALA  85           HB2      ALA  85  -9.344  -0.312   2.777
  690    HB3  ALA  85           HB3      ALA  85 -10.055  -1.897   2.483
  691    H    LYS  86           HN       LYS  86 -12.918  -1.822   2.770
  692    HA   LYS  86           HA       LYS  86 -13.441   0.386   0.988
  693    HB2  LYS  86           HB2      LYS  86 -14.073  -2.011   0.500
  694    HB3  LYS  86           HB1      LYS  86 -15.350  -1.874   1.710
  695    HG2  LYS  86           HG2      LYS  86 -16.398  -0.057   0.461
  696    HG3  LYS  86           HG1      LYS  86 -15.080  -0.068  -0.712
  697    HD2  LYS  86           HD2      LYS  86 -15.653  -2.371  -1.360
  698    HD3  LYS  86           HD1      LYS  86 -16.954  -2.390  -0.169
  699    HE2  LYS  86           HE2      LYS  86 -18.035  -0.490  -1.340
  700    HE3  LYS  86           HE1      LYS  86 -16.755  -0.524  -2.551
  701    HZ1  LYS  86           HZ1      LYS  86 -17.688  -2.247  -3.570
  702    HZ2  LYS  86           HZ2      LYS  86 -19.072  -1.951  -2.631
  703    HZ3  LYS  86           HZ3      LYS  86 -17.927  -3.097  -2.121
  704    H    ARG  87           HN       ARG  87 -14.595  -0.432   4.210
  705    HA   ARG  87           HA       ARG  87 -16.861   1.426   4.103
  706    HB2  ARG  87           HB2      ARG  87 -16.769  -0.621   5.574
  707    HB3  ARG  87           HB1      ARG  87 -15.539   0.191   6.541
  708    HG2  ARG  87           HG2      ARG  87 -17.116   2.038   7.000
  709    HG3  ARG  87           HG1      ARG  87 -18.347   1.225   6.032
  710    HD2  ARG  87           HD2      ARG  87 -18.728   0.731   8.389
  711    HD3  ARG  87           HD1      ARG  87 -18.201  -0.738   7.566
  712    HE   ARG  87           HE       ARG  87 -15.842   0.372   8.514
  713   HH11  ARG  87          HH21      ARG  87 -18.899  -0.516   9.858
  714   HH12  ARG  87          HH22      ARG  87 -18.246  -0.905  11.414
  715   HH21  ARG  87          HH11      ARG  87 -14.983  -0.130  10.538
  716   HH22  ARG  87          HH12      ARG  87 -16.032  -0.687  11.799
  717    H    ASP  88           HN       ASP  88 -13.478   1.568   5.070
  718    HA   ASP  88           HA       ASP  88 -13.827   4.221   6.359
  719    HB2  ASP  88           HB2      ASP  88 -12.228   2.455   7.249
  720    HB3  ASP  88           HB1      ASP  88 -11.252   2.700   5.801
  721    H    GLU  89           HN       GLU  89 -13.541   3.118   3.221
  722    HA   GLU  89           HA       GLU  89 -11.591   4.768   2.056
  723    HB2  GLU  89           HB2      GLU  89 -12.615   4.332  -0.034
  724    HB3  GLU  89           HB1      GLU  89 -13.051   2.951   0.965
  725    HG2  GLU  89           HG2      GLU  89 -15.244   4.224   1.481
  726    HG3  GLU  89           HG1      GLU  89 -14.793   5.302   0.161
  727    HA   PRO  90           HA       PRO  90 -13.564   8.713   3.187
  728    HB2  PRO  90           HB2      PRO  90 -11.790  10.306   1.546
  729    HB3  PRO  90           HB1      PRO  90 -11.697  10.067   3.297
  730    HG2  PRO  90           HG2      PRO  90  -9.954   8.931   1.240
  731    HG3  PRO  90           HG1      PRO  90  -9.791   8.806   2.998
  732    HD2  PRO  90           HD2      PRO  90 -10.631   6.723   1.173
  733    HD3  PRO  90           HD1      PRO  90 -10.545   6.631   2.949
  734    H    LYS  91           HN       LYS  91 -14.988  10.174   2.079
  735    HA   LYS  91           HA       LYS  91 -16.511  10.763   0.412
  736    HB2  LYS  91           HB2      LYS  91 -14.282  11.514  -0.615
  737    HB3  LYS  91           HB1      LYS  91 -14.325  10.033  -1.565
  738    HG2  LYS  91           HG2      LYS  91 -16.440  10.694  -2.585
  739    HG3  LYS  91           HG1      LYS  91 -16.528  12.123  -1.555
  740    HD2  LYS  91           HD2      LYS  91 -14.386  12.925  -2.560
  741    HD3  LYS  91           HD1      LYS  91 -14.422  11.544  -3.657
  742    HE2  LYS  91           HE2      LYS  91 -16.455  13.783  -3.475
  743    HE3  LYS  91           HE1      LYS  91 -15.376  13.432  -4.825
  744    HZ1  LYS  91           HZ1      LYS  91 -17.660  11.815  -3.856
  745    HZ2  LYS  91           HZ2      LYS  91 -16.496  11.205  -4.934
  746    HZ3  LYS  91           HZ3      LYS  91 -17.463  12.529  -5.381
  Start of MODEL   12
    1    H1   MET   1           HT1      MET   1 -10.799  17.209   9.181
    2    H2   MET   1           HT2      MET   1  -9.209  17.790   9.318
    3    H3   MET   1           HT3      MET   1 -10.521  18.803   9.689
    4    HA   MET   1           HA       MET   1  -9.414  17.979  11.688
    5    HB2  MET   1           HB2      MET   1 -11.971  18.432  11.421
    6    HB3  MET   1           HB1      MET   1 -12.149  16.680  11.453
    7    HG2  MET   1           HG2      MET   1 -11.045  16.595  13.654
    8    HG3  MET   1           HG1      MET   1 -10.798  18.339  13.611
    9    HE1  MET   1           HE1      MET   1 -13.476  17.632  16.346
   10    HE2  MET   1           HE2      MET   1 -12.240  18.827  15.964
   11    HE3  MET   1           HE3      MET   1 -11.842  17.111  15.911
   12    H    ALA   2           HN       ALA   2  -8.636  16.112   9.485
   13    HA   ALA   2           HA       ALA   2  -8.046  13.796  11.148
   14    HB1  ALA   2           HB1      ALA   2  -9.978  13.496   8.828
   15    HB2  ALA   2           HB2      ALA   2 -10.318  13.171  10.527
   16    HB3  ALA   2           HB3      ALA   2  -9.184  12.149   9.643
   17    H    SER   3           HN       SER   3  -5.905  13.782  10.591
   18    HA   SER   3           HA       SER   3  -4.962  14.452   7.925
   19    HB2  SER   3           HB2      SER   3  -3.654  14.707  10.121
   20    HB3  SER   3           HB1      SER   3  -3.416  12.962  10.080
   21    HG   SER   3           HG       SER   3  -2.499  14.950   8.300
   22    H    THR   4           HN       THR   4  -4.653  13.101   6.216
   23    HA   THR   4           HA       THR   4  -5.605  10.342   6.367
   24    HB   THR   4           HB       THR   4  -4.100  11.651   4.072
   25    HG1  THR   4           HG1      THR   4  -6.257  12.133   3.344
   26   HG21  THR   4          HG21      THR   4  -5.321  10.043   2.705
   27   HG22  THR   4          HG22      THR   4  -6.175   9.441   4.126
   28   HG23  THR   4          HG23      THR   4  -4.436   9.187   3.967
   29    H    ARG   5           HN       ARG   5  -2.511  11.947   6.546
   30    HA   ARG   5           HA       ARG   5  -0.812   9.766   5.852
   31    HB2  ARG   5           HB2      ARG   5  -0.345  11.994   7.857
   32    HB3  ARG   5           HB1      ARG   5   0.908  10.955   7.177
   33    HG2  ARG   5           HG2      ARG   5   0.315  11.752   4.904
   34    HG3  ARG   5           HG1      ARG   5  -0.895  12.826   5.609
   35    HD2  ARG   5           HD2      ARG   5   2.078  12.905   6.203
   36    HD3  ARG   5           HD1      ARG   5   1.215  14.032   5.155
   37    HE   ARG   5           HE       ARG   5  -0.158  14.168   7.565
   38   HH11  ARG   5          HH21      ARG   5   3.119  14.512   6.531
   39   HH12  ARG   5          HH22      ARG   5   3.528  15.649   7.770
   40   HH21  ARG   5          HH11      ARG   5   0.363  15.650   9.185
   41   HH22  ARG   5          HH12      ARG   5   1.969  16.293   9.272
   42    H    CYS   6           HN       CYS   6  -2.332  10.674   8.930
   43    HA   CYS   6           HA       CYS   6  -1.008   8.627  10.479
   44    HB2  CYS   6           HB2      CYS   6  -3.570  10.173  10.960
   45    HB3  CYS   6           HB1      CYS   6  -2.823   9.103  12.148
   46    HG   CYS   6           HG       CYS   6  -1.798  11.889  11.356
   47    H    LYS   7           HN       LYS   7  -4.149   8.784   8.795
   48    HA   LYS   7           HA       LYS   7  -5.037   6.197   9.727
   49    HB2  LYS   7           HB2      LYS   7  -5.866   7.873   7.336
   50    HB3  LYS   7           HB1      LYS   7  -6.677   6.382   7.815
   51    HG2  LYS   7           HG2      LYS   7  -7.112   7.374  10.059
   52    HG3  LYS   7           HG1      LYS   7  -6.379   8.882   9.511
   53    HD2  LYS   7           HD2      LYS   7  -8.072   9.143   7.787
   54    HD3  LYS   7           HD1      LYS   7  -8.756   7.562   8.168
   55    HE2  LYS   7           HE2      LYS   7  -9.417   8.322  10.382
   56    HE3  LYS   7           HE1      LYS   7  -8.603   9.867  10.135
   57    HZ1  LYS   7           HZ1      LYS   7 -11.205   9.352   9.584
   58    HZ2  LYS   7           HZ2      LYS   7 -10.474   9.222   8.055
   59    HZ3  LYS   7           HZ3      LYS   7 -10.308  10.650   8.962
   60    H    LEU   8           HN       LEU   8  -3.652   7.242   6.581
   61    HA   LEU   8           HA       LEU   8  -3.563   4.640   5.416
   62    HB2  LEU   8           HB2      LEU   8  -2.942   7.161   4.554
   63    HB3  LEU   8           HB1      LEU   8  -1.312   6.550   4.786
   64    HG   LEU   8           HG       LEU   8  -3.440   5.149   3.116
   65   HD11  LEU   8          HD11      LEU   8  -2.812   7.321   2.134
   66   HD12  LEU   8          HD12      LEU   8  -2.171   5.989   1.172
   67   HD13  LEU   8          HD13      LEU   8  -1.107   6.887   2.254
   68   HD21  LEU   8          HD21      LEU   8  -1.758   3.592   3.903
   69   HD22  LEU   8          HD22      LEU   8  -0.459   4.712   3.509
   70   HD23  LEU   8          HD23      LEU   8  -1.390   3.951   2.219
   71    H    ALA   9           HN       ALA   9  -1.264   6.287   7.560
   72    HA   ALA   9           HA       ALA   9   0.748   4.206   7.426
   73    HB1  ALA   9           HB1      ALA   9   1.205   6.564   8.146
   74    HB2  ALA   9           HB2      ALA   9   1.784   5.359   9.297
   75    HB3  ALA   9           HB3      ALA   9   0.294   6.245   9.621
   76    H    ARG  10           HN       ARG  10  -2.142   4.739   9.307
   77    HA   ARG  10           HA       ARG  10  -1.544   2.862  11.412
   78    HB2  ARG  10           HB2      ARG  10  -3.302   4.681  11.500
   79    HB3  ARG  10           HB1      ARG  10  -4.290   3.695  10.425
   80    HG2  ARG  10           HG2      ARG  10  -4.219   1.848  12.078
   81    HG3  ARG  10           HG1      ARG  10  -3.268   2.869  13.160
   82    HD2  ARG  10           HD2      ARG  10  -5.602   2.996  13.837
   83    HD3  ARG  10           HD1      ARG  10  -5.137   4.544  13.133
   84    HE   ARG  10           HE       ARG  10  -6.166   3.117  10.985
   85   HH11  ARG  10          HH21      ARG  10  -7.237   3.986  14.152
   86   HH12  ARG  10          HH22      ARG  10  -8.910   4.049  13.710
   87   HH21  ARG  10          HH11      ARG  10  -8.343   3.197  10.398
   88   HH22  ARG  10          HH12      ARG  10  -9.535   3.604  11.586
   89    H    TYR  11           HN       TYR  11  -3.009   2.554   8.214
   90    HA   TYR  11           HA       TYR  11  -3.961  -0.169   8.662
   91    HB2  TYR  11           HB2      TYR  11  -3.697   1.658   6.275
   92    HB3  TYR  11           HB1      TYR  11  -3.969  -0.058   5.989
   93    HD1  TYR  11           HD2      TYR  11  -5.959  -1.186   7.020
   94    HD2  TYR  11           HD1      TYR  11  -5.505   3.080   7.007
   95    HE1  TYR  11           HE2      TYR  11  -8.387  -0.935   7.478
   96    HE2  TYR  11           HE1      TYR  11  -7.930   3.341   7.465
   97    HH   TYR  11           HH       TYR  11  -9.785   2.175   8.261
   98    H    LEU  12           HN       LEU  12  -1.207   1.157   6.754
   99    HA   LEU  12           HA       LEU  12  -0.104  -1.394   6.113
  100    HB2  LEU  12           HB2      LEU  12   1.578   1.083   6.632
  101    HB3  LEU  12           HB1      LEU  12   1.937  -0.257   5.546
  102    HG   LEU  12           HG       LEU  12  -0.454   1.613   5.120
  103   HD11  LEU  12          HD11      LEU  12   2.286   1.693   3.805
  104   HD12  LEU  12          HD12      LEU  12   1.721   2.844   5.012
  105   HD13  LEU  12          HD13      LEU  12   0.923   2.749   3.444
  106   HD21  LEU  12          HD21      LEU  12   0.928  -0.505   3.417
  107   HD22  LEU  12          HD22      LEU  12  -0.154   0.705   2.731
  108   HD23  LEU  12          HD23      LEU  12  -0.765  -0.449   3.905
  109    H    GLU  13           HN       GLU  13  -0.060   0.439   9.053
  110    HA   GLU  13           HA       GLU  13   2.108  -1.154  10.270
  111    HB2  GLU  13           HB2      GLU  13   0.207   0.964  11.331
  112    HB3  GLU  13           HB1      GLU  13   1.257   0.050  12.411
  113    HG2  GLU  13           HG2      GLU  13   3.239   0.833  11.255
  114    HG3  GLU  13           HG1      GLU  13   2.264   1.627  10.020
  115    H    ASP  14           HN       ASP  14  -1.344  -1.357   9.909
  116    HA   ASP  14           HA       ASP  14  -1.810  -3.103  12.187
  117    HB2  ASP  14           HB2      ASP  14  -3.431  -2.588   9.667
  118    HB3  ASP  14           HB1      ASP  14  -3.983  -3.599  11.004
  119    H    LEU  15           HN       LEU  15  -0.045  -3.629   9.395
  120    HA   LEU  15           HA       LEU  15  -0.899  -6.469   9.039
  121    HB2  LEU  15           HB2      LEU  15   1.413  -5.013   7.716
  122    HB3  LEU  15           HB1      LEU  15   0.703  -6.547   7.224
  123    HG   LEU  15           HG       LEU  15  -0.588  -3.800   7.100
  124   HD11  LEU  15          HD11      LEU  15   0.069  -5.847   4.956
  125   HD12  LEU  15          HD12      LEU  15   1.012  -4.397   5.291
  126   HD13  LEU  15          HD13      LEU  15  -0.639  -4.257   4.685
  127   HD21  LEU  15          HD21      LEU  15  -1.790  -6.566   6.742
  128   HD22  LEU  15          HD22      LEU  15  -2.491  -5.152   5.952
  129   HD23  LEU  15          HD23      LEU  15  -2.405  -5.224   7.708
  130    H    GLU  16           HN       GLU  16   0.499  -8.232   9.464
  131    HA   GLU  16           HA       GLU  16   2.080  -7.962  11.854
  132    HB2  GLU  16           HB2      GLU  16   0.843 -10.046  11.068
  133    HB3  GLU  16           HB1      GLU  16   2.138 -10.284   9.896
  134    HG2  GLU  16           HG2      GLU  16   3.788 -10.454  11.683
  135    HG3  GLU  16           HG1      GLU  16   2.567 -10.062  12.894
  136    H    ASP  17           HN       ASP  17   4.417  -8.493  12.006
  137    HA   ASP  17           HA       ASP  17   6.015  -6.904  10.281
  138    HB2  ASP  17           HB2      ASP  17   6.678  -7.599  12.579
  139    HB3  ASP  17           HB1      ASP  17   6.915  -9.243  11.987
  140    H    VAL  18           HN       VAL  18   5.588 -10.459  10.343
  141    HA   VAL  18           HA       VAL  18   7.337 -10.957   8.129
  142    HB   VAL  18           HB       VAL  18   6.252 -13.150   7.957
  143   HG11  VAL  18          HG11      VAL  18   6.487 -12.357  10.879
  144   HG12  VAL  18          HG12      VAL  18   7.878 -12.626   9.827
  145   HG13  VAL  18          HG13      VAL  18   6.767 -13.951  10.178
  146   HG21  VAL  18          HG21      VAL  18   3.916 -12.585   8.212
  147   HG22  VAL  18          HG22      VAL  18   4.193 -11.909   9.815
  148   HG23  VAL  18          HG23      VAL  18   4.334 -13.645   9.556
  149    H    ASP  19           HN       ASP  19   3.850 -10.249   8.293
  150    HA   ASP  19           HA       ASP  19   3.424 -10.622   5.444
  151    HB2  ASP  19           HB2      ASP  19   1.796  -9.029   7.452
  152    HB3  ASP  19           HB1      ASP  19   1.259  -9.539   5.851
  153    H    LEU  20           HN       LEU  20   4.471  -7.977   7.493
  154    HA   LEU  20           HA       LEU  20   4.047  -5.861   5.597
  155    HB2  LEU  20           HB2      LEU  20   4.457  -5.530   8.051
  156    HB3  LEU  20           HB1      LEU  20   6.121  -6.047   7.803
  157    HG   LEU  20           HG       LEU  20   6.405  -4.139   6.170
  158   HD11  LEU  20          HD11      LEU  20   3.574  -3.554   7.076
  159   HD12  LEU  20          HD12      LEU  20   4.238  -3.540   5.443
  160   HD13  LEU  20          HD13      LEU  20   4.639  -2.246   6.559
  161   HD21  LEU  20          HD21      LEU  20   5.558  -3.418   8.994
  162   HD22  LEU  20          HD22      LEU  20   6.554  -2.413   7.941
  163   HD23  LEU  20          HD23      LEU  20   7.161  -3.971   8.505
  164    H    LYS  21           HN       LYS  21   6.723  -8.089   6.226
  165    HA   LYS  21           HA       LYS  21   8.590  -6.820   4.427
  166    HB2  LYS  21           HB2      LYS  21   8.455  -9.670   5.458
  167    HB3  LYS  21           HB1      LYS  21   9.824  -8.978   4.586
  168    HG2  LYS  21           HG2      LYS  21  10.262  -7.395   6.333
  169    HG3  LYS  21           HG1      LYS  21   8.730  -7.744   7.131
  170    HD2  LYS  21           HD2      LYS  21  10.656  -8.817   8.283
  171    HD3  LYS  21           HD1      LYS  21   9.487  -9.995   7.694
  172    HE2  LYS  21           HE2      LYS  21  11.881  -9.238   6.005
  173    HE3  LYS  21           HE1      LYS  21  12.011 -10.467   7.261
  174    HZ1  LYS  21           HZ1      LYS  21  11.169 -11.897   5.823
  175    HZ2  LYS  21           HZ2      LYS  21  10.858 -10.673   4.686
  176    HZ3  LYS  21           HZ3      LYS  21   9.702 -11.048   5.873
  177    H    LYS  22           HN       LYS  22   6.082  -9.282   4.008
  178    HA   LYS  22           HA       LYS  22   6.946 -10.074   1.352
  179    HB2  LYS  22           HB2      LYS  22   4.317 -10.367   2.848
  180    HB3  LYS  22           HB1      LYS  22   4.520 -10.938   1.191
  181    HG2  LYS  22           HG2      LYS  22   6.251 -12.474   1.837
  182    HG3  LYS  22           HG1      LYS  22   6.371 -11.767   3.447
  183    HD2  LYS  22           HD2      LYS  22   5.114 -13.886   3.508
  184    HD3  LYS  22           HD1      LYS  22   4.087 -12.530   3.968
  185    HE2  LYS  22           HE2      LYS  22   4.161 -13.450   1.087
  186    HE3  LYS  22           HE1      LYS  22   3.148 -14.287   2.263
  187    HZ1  LYS  22           HZ1      LYS  22   1.663 -12.685   2.074
  188    HZ2  LYS  22           HZ2      LYS  22   2.645 -11.865   0.956
  189    HZ3  LYS  22           HZ3      LYS  22   2.789 -11.540   2.617
  190    H    PHE  23           HN       PHE  23   4.980  -7.446   2.611
  191    HA   PHE  23           HA       PHE  23   3.768  -6.737   0.066
  192    HB2  PHE  23           HB2      PHE  23   2.898  -5.979   2.288
  193    HB3  PHE  23           HB1      PHE  23   4.321  -4.957   2.464
  194    HD1  PHE  23           HD1      PHE  23   4.756  -3.109   0.811
  195    HD2  PHE  23           HD2      PHE  23   1.050  -5.290   0.891
  196    HE1  PHE  23           HE1      PHE  23   3.672  -1.322  -0.520
  197    HE2  PHE  23           HE2      PHE  23  -0.029  -3.499  -0.442
  198    HZ   PHE  23           HZ       PHE  23   1.281  -1.516  -1.146
  199    H    LYS  24           HN       LYS  24   6.744  -5.725   1.762
  200    HA   LYS  24           HA       LYS  24   7.485  -3.666  -0.089
  201    HB2  LYS  24           HB2      LYS  24   9.222  -5.444   1.654
  202    HB3  LYS  24           HB1      LYS  24   9.759  -3.960   0.876
  203    HG2  LYS  24           HG2      LYS  24   7.345  -3.879   2.710
  204    HG3  LYS  24           HG1      LYS  24   8.960  -3.906   3.411
  205    HD2  LYS  24           HD2      LYS  24   9.566  -1.904   2.063
  206    HD3  LYS  24           HD1      LYS  24   7.925  -1.855   1.423
  207    HE2  LYS  24           HE2      LYS  24   6.998  -1.300   3.543
  208    HE3  LYS  24           HE1      LYS  24   8.451  -1.803   4.409
  209    HZ1  LYS  24           HZ1      LYS  24   8.756   0.304   2.420
  210    HZ2  LYS  24           HZ2      LYS  24   9.527   0.101   3.920
  211    HZ3  LYS  24           HZ3      LYS  24   7.944   0.713   3.851
  212    H    MET  25           HN       MET  25   8.496  -7.087   0.176
  213    HA   MET  25           HA       MET  25  10.130  -7.050  -2.180
  214    HB2  MET  25           HB2      MET  25  10.208  -8.792  -0.363
  215    HB3  MET  25           HB1      MET  25   8.692  -9.439  -0.987
  216    HG2  MET  25           HG2      MET  25   9.728  -9.878  -3.155
  217    HG3  MET  25           HG1      MET  25  11.236  -9.144  -2.613
  218    HE1  MET  25           HE1      MET  25  12.268  -9.997  -0.132
  219    HE2  MET  25           HE2      MET  25  13.086 -10.338  -1.656
  220    HE3  MET  25           HE3      MET  25  12.956 -11.598  -0.432
  221    H    HIS  26           HN       HIS  26   6.691  -7.692  -1.666
  222    HA   HIS  26           HA       HIS  26   6.198  -8.709  -4.345
  223    HB2  HIS  26           HB2      HIS  26   4.385  -7.470  -2.234
  224    HB3  HIS  26           HB1      HIS  26   3.770  -8.087  -3.769
  225    HD1  HIS  26           HD1      HIS  26   6.633  -9.946  -2.344
  226    HD2  HIS  26           HD2      HIS  26   2.473 -10.180  -2.190
  227    HE1  HIS  26           HE1      HIS  26   6.079 -12.233  -1.409
  228    H    LEU  27           HN       LEU  27   6.355  -5.475  -2.930
  229    HA   LEU  27           HA       LEU  27   5.127  -4.142  -5.218
  230    HB2  LEU  27           HB2      LEU  27   5.339  -3.202  -2.849
  231    HB3  LEU  27           HB1      LEU  27   7.046  -2.947  -3.190
  232    HG   LEU  27           HG       LEU  27   6.176  -1.645  -5.319
  233   HD11  LEU  27          HD11      LEU  27   3.722  -1.601  -3.524
  234   HD12  LEU  27          HD12      LEU  27   3.806  -2.210  -5.175
  235   HD13  LEU  27          HD13      LEU  27   3.989  -0.489  -4.865
  236   HD21  LEU  27          HD21      LEU  27   7.351  -0.559  -3.465
  237   HD22  LEU  27          HD22      LEU  27   5.868  -0.531  -2.512
  238   HD23  LEU  27          HD23      LEU  27   5.994   0.443  -3.976
  239    H    GLU  28           HN       GLU  28   8.404  -5.098  -4.332
  240    HA   GLU  28           HA       GLU  28   9.730  -3.555  -6.389
  241    HB2  GLU  28           HB2      GLU  28  10.593  -6.047  -4.889
  242    HB3  GLU  28           HB1      GLU  28  11.646  -5.096  -5.937
  243    HG2  GLU  28           HG2      GLU  28  11.373  -3.137  -4.529
  244    HG3  GLU  28           HG1      GLU  28  10.179  -3.971  -3.537
  245    H    ASP  29           HN       ASP  29   8.207  -6.727  -6.289
  246    HA   ASP  29           HA       ASP  29   9.319  -7.640  -8.819
  247    HB2  ASP  29           HB2      ASP  29   8.431  -9.177  -7.055
  248    HB3  ASP  29           HB1      ASP  29   6.809  -8.572  -7.393
  249    H    TYR  30           HN       TYR  30   8.152  -4.977  -8.958
  250    HA   TYR  30           HA       TYR  30   5.555  -5.102 -10.183
  251    HB2  TYR  30           HB2      TYR  30   6.702  -3.079  -9.110
  252    HB3  TYR  30           HB1      TYR  30   7.619  -2.922 -10.605
  253    HD1  TYR  30           HD2      TYR  30   4.075  -3.382  -9.433
  254    HD2  TYR  30           HD1      TYR  30   6.693  -1.531 -12.303
  255    HE1  TYR  30           HE2      TYR  30   2.147  -2.187 -10.429
  256    HE2  TYR  30           HE1      TYR  30   4.760  -0.336 -13.285
  257    HH   TYR  30           HH       TYR  30   1.452  -0.905 -12.115
  258    HA   PRO  31           HA       PRO  31   7.369  -6.780 -14.006
  259    HB2  PRO  31           HB2      PRO  31   4.969  -6.392 -15.572
  260    HB3  PRO  31           HB1      PRO  31   5.544  -7.901 -14.852
  261    HG2  PRO  31           HG2      PRO  31   3.311  -6.224 -13.969
  262    HG3  PRO  31           HG1      PRO  31   3.795  -7.813 -13.356
  263    HD2  PRO  31           HD2      PRO  31   4.147  -5.268 -12.044
  264    HD3  PRO  31           HD1      PRO  31   4.732  -6.853 -11.486
  265    HA   PRO  32           HA       PRO  32   8.469  -3.133 -16.264
  266    HB2  PRO  32           HB2      PRO  32   8.288  -4.023 -18.969
  267    HB3  PRO  32           HB1      PRO  32   9.709  -4.162 -17.922
  268    HG2  PRO  32           HG2      PRO  32   7.800  -6.285 -18.744
  269    HG3  PRO  32           HG1      PRO  32   9.439  -6.454 -18.095
  270    HD2  PRO  32           HD2      PRO  32   7.042  -6.956 -16.656
  271    HD3  PRO  32           HD1      PRO  32   8.656  -6.753 -15.942
  272    H    GLN  33           HN       GLN  33   7.342  -1.323 -16.907
  273    HA   GLN  33           HA       GLN  33   4.525  -1.656 -17.913
  274    HB2  GLN  33           HB2      GLN  33   4.821  -0.580 -15.661
  275    HB3  GLN  33           HB1      GLN  33   5.752   0.699 -16.439
  276    HG2  GLN  33           HG2      GLN  33   3.857   1.384 -17.759
  277    HG3  GLN  33           HG1      GLN  33   2.920  -0.019 -17.248
  278   HE21  GLN  33          HE21      GLN  33   2.712   3.106 -16.797
  279   HE22  GLN  33          HE22      GLN  33   2.382   3.214 -15.135
  280    H    LYS  34           HN       LYS  34   7.658  -0.595 -18.724
  281    HA   LYS  34           HA       LYS  34   8.508   0.686 -20.492
  282    HB2  LYS  34           HB2      LYS  34   5.940  -0.418 -21.653
  283    HB3  LYS  34           HB1      LYS  34   7.137   0.441 -22.621
  284    HG2  LYS  34           HG2      LYS  34   8.845  -1.214 -22.001
  285    HG3  LYS  34           HG1      LYS  34   7.672  -2.061 -20.992
  286    HD2  LYS  34           HD2      LYS  34   6.257  -2.440 -23.006
  287    HD3  LYS  34           HD1      LYS  34   7.500  -1.673 -23.994
  288    HE2  LYS  34           HE2      LYS  34   7.767  -4.107 -24.073
  289    HE3  LYS  34           HE1      LYS  34   9.133  -3.385 -23.224
  290    HZ1  LYS  34           HZ1      LYS  34   7.706  -5.403 -22.253
  291    HZ2  LYS  34           HZ2      LYS  34   6.848  -4.100 -21.582
  292    HZ3  LYS  34           HZ3      LYS  34   8.509  -4.277 -21.272
  293    H    GLY  35           HN       GLY  35   7.109   2.181 -18.537
  294    HA2  GLY  35           HA2      GLY  35   6.832   4.696 -19.722
  295    HA3  GLY  35           HA1      GLY  35   5.208   4.000 -19.734
  296    H    CYS  36           HN       CYS  36   7.820   3.709 -17.325
  297    HA   CYS  36           HA       CYS  36   6.519   5.440 -15.396
  298    HB2  CYS  36           HB2      CYS  36   4.995   3.466 -15.325
  299    HB3  CYS  36           HB1      CYS  36   6.370   2.448 -14.902
  300    HG   CYS  36           HG       CYS  36   6.575   3.686 -12.637
  301    H    ILE  37           HN       ILE  37   7.835   5.690 -13.508
  302    HA   ILE  37           HA       ILE  37  10.649   4.966 -13.904
  303    HB   ILE  37           HB       ILE  37   9.306   6.462 -11.628
  304   HG12  ILE  37          HG12      ILE  37  10.599   8.426 -12.986
  305   HG13  ILE  37          HG11      ILE  37  10.334   7.337 -14.343
  306   HG21  ILE  37          HG21      ILE  37  12.220   6.204 -12.424
  307   HG22  ILE  37          HG22      ILE  37  11.472   5.613 -10.940
  308   HG23  ILE  37          HG23      ILE  37  11.611   7.344 -11.228
  309   HD11  ILE  37          HD11      ILE  37   8.099   8.277 -12.493
  310   HD12  ILE  37          HD12      ILE  37   7.923   7.435 -14.033
  311   HD13  ILE  37          HD13      ILE  37   8.524   9.088 -13.999
  312    HA   PRO  38           HA       PRO  38   9.701   1.310 -11.296
  313    HB2  PRO  38           HB2      PRO  38  12.475   0.467 -11.234
  314    HB3  PRO  38           HB1      PRO  38  11.158  -0.244 -12.174
  315    HG2  PRO  38           HG2      PRO  38  13.363   1.371 -13.164
  316    HG3  PRO  38           HG1      PRO  38  12.062   0.624 -14.103
  317    HD2  PRO  38           HD2      PRO  38  12.394   3.439 -13.469
  318    HD3  PRO  38           HD1      PRO  38  11.098   2.688 -14.417
  319    H    LEU  39           HN       LEU  39   9.826   1.116  -9.047
  320    HA   LEU  39           HA       LEU  39  11.086   3.305  -7.589
  321    HB2  LEU  39           HB2      LEU  39   9.418   0.908  -6.840
  322    HB3  LEU  39           HB1      LEU  39  10.145   1.901  -5.583
  323    HG   LEU  39           HG       LEU  39   8.503   3.224  -7.772
  324   HD11  LEU  39          HD11      LEU  39   6.499   3.014  -6.326
  325   HD12  LEU  39          HD12      LEU  39   7.400   1.939  -5.255
  326   HD13  LEU  39          HD13      LEU  39   7.055   1.446  -6.912
  327   HD21  LEU  39          HD21      LEU  39   9.028   3.874  -4.846
  328   HD22  LEU  39          HD22      LEU  39   8.022   4.833  -5.929
  329   HD23  LEU  39          HD23      LEU  39   9.750   4.687  -6.233
  330    HA   PRO  40           HA       PRO  40  14.889   0.771  -7.271
  331    HB2  PRO  40           HB2      PRO  40  15.813   2.576  -5.110
  332    HB3  PRO  40           HB1      PRO  40  16.534   2.304  -6.705
  333    HG2  PRO  40           HG2      PRO  40  15.113   4.630  -5.916
  334    HG3  PRO  40           HG1      PRO  40  15.535   4.192  -7.577
  335    HD2  PRO  40           HD2      PRO  40  12.876   4.129  -6.297
  336    HD3  PRO  40           HD1      PRO  40  13.282   3.935  -8.019
  337    H    ARG  41           HN       ARG  41  15.358  -0.936  -5.886
  338    HA   ARG  41           HA       ARG  41  13.451  -1.638  -3.860
  339    HB2  ARG  41           HB2      ARG  41  16.251  -2.730  -4.337
  340    HB3  ARG  41           HB1      ARG  41  15.000  -3.516  -3.372
  341    HG2  ARG  41           HG2      ARG  41  13.556  -3.698  -5.344
  342    HG3  ARG  41           HG1      ARG  41  14.746  -2.836  -6.318
  343    HD2  ARG  41           HD2      ARG  41  16.395  -4.637  -5.858
  344    HD3  ARG  41           HD1      ARG  41  15.160  -5.512  -4.953
  345    HE   ARG  41           HE       ARG  41  13.989  -5.067  -7.434
  346   HH11  ARG  41          HH21      ARG  41  16.924  -6.461  -6.263
  347   HH12  ARG  41          HH22      ARG  41  17.063  -7.589  -7.572
  348   HH21  ARG  41          HH11      ARG  41  14.159  -6.531  -9.143
  349   HH22  ARG  41          HH12      ARG  41  15.498  -7.627  -9.200
  350    H    GLY  42           HN       GLY  42  16.798  -0.412  -3.630
  351    HA2  GLY  42           HA2      GLY  42  17.028  -0.517  -0.791
  352    HA3  GLY  42           HA1      GLY  42  17.903   0.641  -1.795
  353    H    GLN  43           HN       GLN  43  15.202   1.720  -2.787
  354    HA   GLN  43           HA       GLN  43  14.966   3.766  -0.725
  355    HB2  GLN  43           HB2      GLN  43  13.831   3.270  -3.447
  356    HB3  GLN  43           HB1      GLN  43  12.825   4.258  -2.395
  357    HG2  GLN  43           HG2      GLN  43  15.764   4.824  -2.905
  358    HG3  GLN  43           HG1      GLN  43  14.454   5.564  -3.823
  359   HE21  GLN  43          HE21      GLN  43  16.376   5.948  -1.040
  360   HE22  GLN  43          HE22      GLN  43  15.418   7.100  -0.242
  361    H    THR  44           HN       THR  44  12.631   1.294  -1.941
  362    HA   THR  44           HA       THR  44  10.675   1.957   0.046
  363    HB   THR  44           HB       THR  44   9.542   0.689  -1.495
  364    HG1  THR  44           HG1      THR  44  10.562  -1.667  -0.438
  365   HG21  THR  44          HG21      THR  44  12.091  -0.880  -1.962
  366   HG22  THR  44          HG22      THR  44  11.443   0.400  -2.983
  367   HG23  THR  44          HG23      THR  44  10.581  -1.130  -2.830
  368    H    GLU  45           HN       GLU  45  13.430  -0.273   0.143
  369    HA   GLU  45           HA       GLU  45  12.627  -1.546   2.625
  370    HB2  GLU  45           HB2      GLU  45  15.403  -1.196   1.407
  371    HB3  GLU  45           HB1      GLU  45  15.009  -2.280   2.737
  372    HG2  GLU  45           HG2      GLU  45  13.774  -2.448  -0.036
  373    HG3  GLU  45           HG1      GLU  45  15.111  -3.446   0.530
  374    H    LYS  46           HN       LYS  46  14.672   1.313   1.857
  375    HA   LYS  46           HA       LYS  46  15.242   1.779   4.711
  376    HB2  LYS  46           HB2      LYS  46  16.857   2.350   2.871
  377    HB3  LYS  46           HB1      LYS  46  15.734   3.596   2.328
  378    HG2  LYS  46           HG2      LYS  46  15.925   4.778   4.435
  379    HG3  LYS  46           HG1      LYS  46  16.882   3.471   5.133
  380    HD2  LYS  46           HD2      LYS  46  18.683   3.892   3.534
  381    HD3  LYS  46           HD1      LYS  46  17.718   5.138   2.742
  382    HE2  LYS  46           HE2      LYS  46  17.665   6.411   4.885
  383    HE3  LYS  46           HE1      LYS  46  18.723   5.197   5.603
  384    HZ1  LYS  46           HZ1      LYS  46  19.984   7.086   4.797
  385    HZ2  LYS  46           HZ2      LYS  46  19.358   6.870   3.231
  386    HZ3  LYS  46           HZ3      LYS  46  20.377   5.693   3.913
  387    H    ALA  47           HN       ALA  47  12.743   2.565   2.488
  388    HA   ALA  47           HA       ALA  47  11.915   5.092   3.567
  389    HB1  ALA  47           HB1      ALA  47  10.309   2.928   2.186
  390    HB2  ALA  47           HB2      ALA  47  11.101   4.293   1.401
  391    HB3  ALA  47           HB3      ALA  47   9.737   4.567   2.481
  392    H    ASP  48           HN       ASP  48  10.872   5.542   5.447
  393    HA   ASP  48           HA       ASP  48  10.199   3.359   7.307
  394    HB2  ASP  48           HB2      ASP  48   9.712   6.346   7.575
  395    HB3  ASP  48           HB1      ASP  48   9.686   5.154   8.875
  396    H    HIS  49           HN       HIS  49   7.988   3.359   8.355
  397    HA   HIS  49           HA       HIS  49   5.942   2.952   6.452
  398    HB2  HIS  49           HB2      HIS  49   4.391   3.009   8.422
  399    HB3  HIS  49           HB1      HIS  49   5.795   1.969   8.659
  400    HD1  HIS  49           HD1      HIS  49   7.964   3.676   9.624
  401    HD2  HIS  49           HD2      HIS  49   4.022   4.454  10.736
  402    HE1  HIS  49           HE1      HIS  49   8.077   5.062  11.741
  403    H    VAL  50           HN       VAL  50   6.852   5.886   8.196
  404    HA   VAL  50           HA       VAL  50   4.432   7.361   7.500
  405    HB   VAL  50           HB       VAL  50   7.192   8.361   8.321
  406   HG11  VAL  50          HG11      VAL  50   5.889  10.407   9.044
  407   HG12  VAL  50          HG12      VAL  50   4.495   9.758   8.185
  408   HG13  VAL  50          HG13      VAL  50   5.958  10.182   7.297
  409   HG21  VAL  50          HG21      VAL  50   6.010   6.829   9.956
  410   HG22  VAL  50          HG22      VAL  50   4.696   8.005  10.019
  411   HG23  VAL  50          HG23      VAL  50   6.308   8.453  10.573
  412    H    ASP  51           HN       ASP  51   7.796   7.537   6.221
  413    HA   ASP  51           HA       ASP  51   7.039   9.332   4.089
  414    HB2  ASP  51           HB2      ASP  51   9.308   8.631   3.122
  415    HB3  ASP  51           HB1      ASP  51   9.353   9.313   4.749
  416    H    LEU  52           HN       LEU  52   7.241   5.797   4.339
  417    HA   LEU  52           HA       LEU  52   7.091   5.144   1.603
  418    HB2  LEU  52           HB2      LEU  52   7.332   3.517   3.535
  419    HB3  LEU  52           HB1      LEU  52   5.602   3.700   3.808
  420    HG   LEU  52           HG       LEU  52   5.373   3.038   1.257
  421   HD11  LEU  52          HD11      LEU  52   7.736   3.109   0.645
  422   HD12  LEU  52          HD12      LEU  52   7.170   1.447   0.543
  423   HD13  LEU  52          HD13      LEU  52   8.134   1.964   1.923
  424   HD21  LEU  52          HD21      LEU  52   6.197   1.031   3.381
  425   HD22  LEU  52          HD22      LEU  52   5.371   0.626   1.876
  426   HD23  LEU  52          HD23      LEU  52   4.565   1.626   3.082
  427    H    ALA  53           HN       ALA  53   4.366   5.685   3.866
  428    HA   ALA  53           HA       ALA  53   2.315   5.419   1.876
  429    HB1  ALA  53           HB1      ALA  53   2.367   6.923   4.511
  430    HB2  ALA  53           HB2      ALA  53   1.760   5.290   4.234
  431    HB3  ALA  53           HB3      ALA  53   0.910   6.675   3.548
  432    H    THR  54           HN       THR  54   4.373   8.113   2.811
  433    HA   THR  54           HA       THR  54   2.773  10.155   1.478
  434    HB   THR  54           HB       THR  54   5.709  10.216   2.254
  435    HG1  THR  54           HG1      THR  54   4.040  11.543   3.875
  436   HG21  THR  54          HG21      THR  54   5.290  12.677   2.375
  437   HG22  THR  54          HG22      THR  54   3.685  12.408   1.699
  438   HG23  THR  54          HG23      THR  54   5.119  12.035   0.742
  439    H    LEU  55           HN       LEU  55   5.578   8.159   0.527
  440    HA   LEU  55           HA       LEU  55   5.998   9.565  -1.983
  441    HB2  LEU  55           HB2      LEU  55   6.856   6.755  -1.206
  442    HB3  LEU  55           HB1      LEU  55   7.415   7.630  -2.619
  443    HG   LEU  55           HG       LEU  55   7.781   8.801   0.160
  444   HD11  LEU  55          HD11      LEU  55   9.648   6.892  -1.280
  445   HD12  LEU  55          HD12      LEU  55   8.805   6.578   0.237
  446   HD13  LEU  55          HD13      LEU  55  10.061   7.814   0.167
  447   HD21  LEU  55          HD21      LEU  55   9.737   9.893  -0.973
  448   HD22  LEU  55          HD22      LEU  55   8.197  10.335  -1.699
  449   HD23  LEU  55          HD23      LEU  55   9.234   9.149  -2.488
  450    H    MET  56           HN       MET  56   4.096   6.789  -0.958
  451    HA   MET  56           HA       MET  56   3.453   5.839  -3.584
  452    HB2  MET  56           HB2      MET  56   3.105   4.631  -1.359
  453    HB3  MET  56           HB1      MET  56   1.669   5.628  -1.136
  454    HG2  MET  56           HG2      MET  56   0.847   4.792  -3.380
  455    HG3  MET  56           HG1      MET  56   2.200   3.661  -3.384
  456    HE1  MET  56           HE1      MET  56  -0.710   2.522  -3.645
  457    HE2  MET  56           HE2      MET  56  -0.468   1.127  -2.596
  458    HE3  MET  56           HE3      MET  56   0.846   1.681  -3.631
  459    H    ILE  57           HN       ILE  57   1.796   8.195  -1.450
  460    HA   ILE  57           HA       ILE  57  -0.340   8.599  -3.445
  461    HB   ILE  57           HB       ILE  57  -1.092  10.448  -1.957
  462   HG12  ILE  57          HG12      ILE  57   1.399   9.674  -0.411
  463   HG13  ILE  57          HG11      ILE  57   1.031  11.241  -1.116
  464   HG21  ILE  57          HG21      ILE  57  -1.890   9.033  -0.199
  465   HG22  ILE  57          HG22      ILE  57  -0.495   7.967  -0.311
  466   HG23  ILE  57          HG23      ILE  57  -1.702   7.977  -1.595
  467   HD11  ILE  57          HD11      ILE  57  -1.020  11.301   0.423
  468   HD12  ILE  57          HD12      ILE  57   0.551  11.471   1.207
  469   HD13  ILE  57          HD13      ILE  57  -0.297   9.927   1.263
  470    H    ASP  58           HN       ASP  58   2.555  10.396  -2.441
  471    HA   ASP  58           HA       ASP  58   1.999  12.633  -4.221
  472    HB2  ASP  58           HB2      ASP  58   3.430  12.726  -2.117
  473    HB3  ASP  58           HB1      ASP  58   4.671  11.841  -3.005
  474    H    PHE  59           HN       PHE  59   4.407   9.959  -4.386
  475    HA   PHE  59           HA       PHE  59   5.291  10.782  -7.027
  476    HB2  PHE  59           HB2      PHE  59   6.628   9.482  -5.262
  477    HB3  PHE  59           HB1      PHE  59   5.738   8.052  -5.780
  478    HD1  PHE  59           HD1      PHE  59   5.983   7.173  -8.089
  479    HD2  PHE  59           HD2      PHE  59   8.314  10.503  -6.695
  480    HE1  PHE  59           HE1      PHE  59   7.524   6.902 -10.013
  481    HE2  PHE  59           HE2      PHE  59   9.854  10.230  -8.618
  482    HZ   PHE  59           HZ       PHE  59   9.459   8.432 -10.276
  483    H    ASN  60           HN       ASN  60   3.090   8.138  -5.913
  484    HA   ASN  60           HA       ASN  60   2.655   7.346  -8.755
  485    HB2  ASN  60           HB2      ASN  60   2.867   5.769  -6.620
  486    HB3  ASN  60           HB1      ASN  60   1.156   6.123  -6.424
  487   HD21  ASN  60          HD21      ASN  60   0.038   4.345  -7.248
  488   HD22  ASN  60          HD22      ASN  60   0.368   3.595  -8.734
  489    H    GLY  61           HN       GLY  61   1.054   9.103  -6.180
  490    HA2  GLY  61           HA2      GLY  61  -0.602  10.823  -6.856
  491    HA3  GLY  61           HA1      GLY  61  -1.265   9.674  -8.015
  492    H    GLU  62           HN       GLU  62  -2.466  11.081  -5.613
  493    HA   GLU  62           HA       GLU  62  -2.951   9.161  -3.547
  494    HB2  GLU  62           HB2      GLU  62  -3.458  11.556  -3.264
  495    HB3  GLU  62           HB1      GLU  62  -4.707  11.453  -4.503
  496    HG2  GLU  62           HG2      GLU  62  -6.039   9.955  -3.144
  497    HG3  GLU  62           HG1      GLU  62  -4.738   9.787  -1.966
  498    H    GLU  63           HN       GLU  63  -4.654   9.855  -6.597
  499    HA   GLU  63           HA       GLU  63  -6.789   7.966  -6.110
  500    HB2  GLU  63           HB2      GLU  63  -6.851   9.912  -7.740
  501    HB3  GLU  63           HB1      GLU  63  -5.797   8.974  -8.795
  502    HG2  GLU  63           HG2      GLU  63  -8.051   8.583  -9.541
  503    HG3  GLU  63           HG1      GLU  63  -7.534   7.117  -8.713
  504    H    LYS  64           HN       LYS  64  -3.891   7.809  -8.222
  505    HA   LYS  64           HA       LYS  64  -4.314   5.096  -9.000
  506    HB2  LYS  64           HB2      LYS  64  -2.745   6.765 -10.094
  507    HB3  LYS  64           HB1      LYS  64  -1.615   6.464  -8.777
  508    HG2  LYS  64           HG2      LYS  64  -1.674   4.027  -9.342
  509    HG3  LYS  64           HG1      LYS  64  -2.687   4.406 -10.731
  510    HD2  LYS  64           HD2      LYS  64   0.056   5.629 -10.284
  511    HD3  LYS  64           HD1      LYS  64  -0.206   4.175 -11.240
  512    HE2  LYS  64           HE2      LYS  64  -1.893   5.594 -12.608
  513    HE3  LYS  64           HE1      LYS  64  -1.153   6.990 -11.824
  514    HZ1  LYS  64           HZ1      LYS  64   0.985   5.559 -12.621
  515    HZ2  LYS  64           HZ2      LYS  64   0.313   6.864 -13.476
  516    HZ3  LYS  64           HZ3      LYS  64  -0.112   5.270 -13.883
  517    H    ALA  65           HN       ALA  65  -2.541   6.502  -6.242
  518    HA   ALA  65           HA       ALA  65  -1.255   4.170  -5.312
  519    HB1  ALA  65           HB1      ALA  65  -1.483   5.222  -3.026
  520    HB2  ALA  65           HB2      ALA  65  -2.501   6.456  -3.770
  521    HB3  ALA  65           HB3      ALA  65  -0.816   6.289  -4.261
  522    H    TRP  66           HN       TRP  66  -4.523   5.345  -4.375
  523    HA   TRP  66           HA       TRP  66  -5.208   3.161  -2.723
  524    HB2  TRP  66           HB2      TRP  66  -6.827   5.071  -4.421
  525    HB3  TRP  66           HB1      TRP  66  -7.653   3.732  -3.625
  526    HD1  TRP  66           HD1      TRP  66  -6.805   7.199  -3.012
  527    HE1  TRP  66           HE1      TRP  66  -6.826   7.757  -0.496
  528    HE3  TRP  66           HE3      TRP  66  -6.808   2.478  -1.068
  529    HZ2  TRP  66           HZ2      TRP  66  -6.849   6.385   2.011
  530    HZ3  TRP  66           HZ3      TRP  66  -6.833   2.132   1.407
  531    HH2  TRP  66           HH2      TRP  66  -6.854   4.082   2.933
  532    H    ALA  67           HN       ALA  67  -5.453   3.450  -6.264
  533    HA   ALA  67           HA       ALA  67  -6.834   1.004  -6.730
  534    HB1  ALA  67           HB1      ALA  67  -4.707   2.262  -8.490
  535    HB2  ALA  67           HB2      ALA  67  -6.398   2.763  -8.460
  536    HB3  ALA  67           HB3      ALA  67  -5.968   1.141  -9.004
  537    H    MET  68           HN       MET  68  -3.375   1.679  -6.294
  538    HA   MET  68           HA       MET  68  -2.568  -1.082  -6.822
  539    HB2  MET  68           HB2      MET  68  -1.178   1.360  -5.687
  540    HB3  MET  68           HB1      MET  68  -0.381  -0.212  -5.690
  541    HG2  MET  68           HG2      MET  68  -1.566   0.966  -8.220
  542    HG3  MET  68           HG1      MET  68   0.081   1.328  -7.709
  543    HE1  MET  68           HE1      MET  68   2.061  -0.088  -8.532
  544    HE2  MET  68           HE2      MET  68   2.080  -1.784  -8.057
  545    HE3  MET  68           HE3      MET  68   1.681  -0.548  -6.868
  546    H    ALA  69           HN       ALA  69  -3.438   0.825  -3.988
  547    HA   ALA  69           HA       ALA  69  -2.489  -1.059  -2.025
  548    HB1  ALA  69           HB1      ALA  69  -3.813   0.227  -0.436
  549    HB2  ALA  69           HB2      ALA  69  -4.751   0.944  -1.745
  550    HB3  ALA  69           HB3      ALA  69  -3.045   1.349  -1.561
  551    H    VAL  70           HN       VAL  70  -5.693  -0.566  -3.542
  552    HA   VAL  70           HA       VAL  70  -6.925  -2.725  -2.000
  553    HB   VAL  70           HB       VAL  70  -8.856  -2.388  -3.462
  554   HG11  VAL  70          HG11      VAL  70  -9.183   0.057  -3.031
  555   HG12  VAL  70          HG12      VAL  70  -7.467   0.190  -2.648
  556   HG13  VAL  70          HG13      VAL  70  -8.521  -0.792  -1.631
  557   HG21  VAL  70          HG21      VAL  70  -6.883  -0.767  -5.106
  558   HG22  VAL  70          HG22      VAL  70  -8.626  -0.550  -5.262
  559   HG23  VAL  70          HG23      VAL  70  -7.895  -2.107  -5.640
  560    H    TRP  71           HN       TRP  71  -5.695  -2.461  -5.362
  561    HA   TRP  71           HA       TRP  71  -6.469  -5.132  -6.078
  562    HB2  TRP  71           HB2      TRP  71  -5.888  -3.361  -7.753
  563    HB3  TRP  71           HB1      TRP  71  -4.199  -3.486  -7.269
  564    HD1  TRP  71           HD1      TRP  71  -6.862  -5.217  -9.299
  565    HE1  TRP  71           HE1      TRP  71  -5.826  -7.238 -10.522
  566    HE3  TRP  71           HE3      TRP  71  -2.297  -5.373  -7.033
  567    HZ2  TRP  71           HZ2      TRP  71  -3.378  -8.724 -10.534
  568    HZ3  TRP  71           HZ3      TRP  71  -0.630  -7.090  -7.661
  569    HH2  TRP  71           HH2      TRP  71  -1.164  -8.769  -9.409
  570    H    ILE  72           HN       ILE  72  -3.575  -3.844  -4.459
  571    HA   ILE  72           HA       ILE  72  -2.104  -6.366  -4.698
  572    HB   ILE  72           HB       ILE  72  -1.750  -3.901  -2.960
  573   HG12  ILE  72          HG12      ILE  72  -1.115  -4.000  -5.494
  574   HG13  ILE  72          HG11      ILE  72   0.062  -3.351  -4.368
  575   HG21  ILE  72          HG21      ILE  72   0.492  -4.954  -2.299
  576   HG22  ILE  72          HG22      ILE  72  -0.182  -6.487  -2.847
  577   HG23  ILE  72          HG23      ILE  72  -0.940  -5.619  -1.514
  578   HD11  ILE  72          HD11      ILE  72   1.503  -5.121  -4.630
  579   HD12  ILE  72          HD12      ILE  72   0.717  -5.191  -6.204
  580   HD13  ILE  72          HD13      ILE  72   0.221  -6.294  -4.925
  581    H    PHE  73           HN       PHE  73  -4.381  -4.991  -2.327
  582    HA   PHE  73           HA       PHE  73  -3.958  -6.808  -0.203
  583    HB2  PHE  73           HB2      PHE  73  -6.315  -5.200  -1.174
  584    HB3  PHE  73           HB1      PHE  73  -6.574  -6.371   0.115
  585    HD1  PHE  73           HD2      PHE  73  -3.387  -4.429  -0.327
  586    HD2  PHE  73           HD1      PHE  73  -7.080  -4.791   1.859
  587    HE1  PHE  73           HE2      PHE  73  -2.569  -2.800   1.334
  588    HE2  PHE  73           HE1      PHE  73  -6.246  -3.149   3.514
  589    HZ   PHE  73           HZ       PHE  73  -3.994  -2.156   3.254
  590    H    ALA  74           HN       ALA  74  -6.182  -7.140  -3.018
  591    HA   ALA  74           HA       ALA  74  -7.210  -9.694  -2.261
  592    HB1  ALA  74           HB1      ALA  74  -6.792  -8.558  -5.049
  593    HB2  ALA  74           HB2      ALA  74  -8.221  -8.307  -4.045
  594    HB3  ALA  74           HB3      ALA  74  -7.836  -9.922  -4.645
  595    H    ALA  75           HN       ALA  75  -4.193  -8.755  -3.779
  596    HA   ALA  75           HA       ALA  75  -3.502 -11.334  -4.840
  597    HB1  ALA  75           HB1      ALA  75  -1.269 -10.445  -5.082
  598    HB2  ALA  75           HB2      ALA  75  -1.575  -9.196  -3.874
  599    HB3  ALA  75           HB3      ALA  75  -2.396  -9.135  -5.434
  600    H    ILE  76           HN       ILE  76  -2.847  -9.805  -1.677
  601    HA   ILE  76           HA       ILE  76  -1.213 -12.000  -0.744
  602    HB   ILE  76           HB       ILE  76  -2.668 -10.347   1.312
  603   HG12  ILE  76          HG12      ILE  76  -0.780  -9.103  -0.726
  604   HG13  ILE  76          HG11      ILE  76  -2.448  -8.650  -0.398
  605   HG21  ILE  76          HG21      ILE  76  -0.532 -10.320   2.389
  606   HG22  ILE  76          HG22      ILE  76   0.312 -10.736   0.897
  607   HG23  ILE  76          HG23      ILE  76  -0.695 -11.935   1.706
  608   HD11  ILE  76          HD11      ILE  76  -0.047  -8.265   1.399
  609   HD12  ILE  76          HD12      ILE  76  -1.703  -8.121   1.991
  610   HD13  ILE  76          HD13      ILE  76  -1.118  -7.031   0.734
  611    H    ASN  77           HN       ASN  77  -4.312 -12.094  -1.628
  612    HA   ASN  77           HA       ASN  77  -6.070 -13.564  -1.206
  613    HB2  ASN  77           HB2      ASN  77  -4.013 -15.172  -1.071
  614    HB3  ASN  77           HB1      ASN  77  -4.232 -15.093   0.676
  615   HD21  ASN  77          HD21      ASN  77  -6.204 -16.025   1.587
  616   HD22  ASN  77          HD22      ASN  77  -7.178 -17.077   0.679
  617    H    ARG  78           HN       ARG  78  -6.135 -11.246   0.251
  618    HA   ARG  78           HA       ARG  78  -7.319 -12.139   2.867
  619    HB2  ARG  78           HB2      ARG  78  -5.537  -9.723   2.408
  620    HB3  ARG  78           HB1      ARG  78  -6.417 -10.062   3.899
  621    HG2  ARG  78           HG2      ARG  78  -5.211 -12.217   4.102
  622    HG3  ARG  78           HG1      ARG  78  -4.300 -11.837   2.646
  623    HD2  ARG  78           HD2      ARG  78  -3.728  -9.596   4.008
  624    HD3  ARG  78           HD1      ARG  78  -4.051 -10.634   5.393
  625    HE   ARG  78           HE       ARG  78  -1.667 -10.619   3.850
  626   HH11  ARG  78          HH21      ARG  78  -3.957 -12.879   5.107
  627   HH12  ARG  78          HH22      ARG  78  -2.905 -14.238   4.917
  628   HH21  ARG  78          HH11      ARG  78  -0.288 -12.376   3.630
  629   HH22  ARG  78          HH12      ARG  78  -0.830 -13.954   4.094
  630    H    ARG  79           HN       ARG  79  -8.890 -11.824   0.661
  631    HA   ARG  79           HA       ARG  79  -9.801  -9.236   0.051
  632    HB2  ARG  79           HB2      ARG  79 -11.754 -10.231  -0.877
  633    HB3  ARG  79           HB1      ARG  79 -10.480 -11.421  -1.081
  634    HG2  ARG  79           HG2      ARG  79 -12.507 -11.497   1.200
  635    HG3  ARG  79           HG1      ARG  79 -12.678 -12.373  -0.306
  636    HD2  ARG  79           HD2      ARG  79 -10.440 -12.727   1.703
  637    HD3  ARG  79           HD1      ARG  79 -11.745 -13.855   1.369
  638    HE   ARG  79           HE       ARG  79 -10.532 -13.475  -1.103
  639   HH11  ARG  79          HH21      ARG  79  -9.529 -14.413   2.066
  640   HH12  ARG  79          HH22      ARG  79  -8.257 -15.443   1.496
  641   HH21  ARG  79          HH11      ARG  79  -8.886 -14.812  -1.855
  642   HH22  ARG  79          HH12      ARG  79  -7.897 -15.671  -0.723
  643    H    ASP  80           HN       ASP  80 -10.426 -11.160   2.911
  644    HA   ASP  80           HA       ASP  80 -12.745  -9.904   3.899
  645    HB2  ASP  80           HB2      ASP  80 -10.305 -10.892   5.411
  646    HB3  ASP  80           HB1      ASP  80 -11.837 -10.464   6.175
  647    H    LEU  81           HN       LEU  81  -9.345  -8.868   4.310
  648    HA   LEU  81           HA       LEU  81  -9.970  -6.580   5.890
  649    HB2  LEU  81           HB2      LEU  81  -7.624  -7.805   5.047
  650    HB3  LEU  81           HB1      LEU  81  -7.567  -6.307   4.128
  651    HG   LEU  81           HG       LEU  81  -7.948  -6.487   7.140
  652   HD11  LEU  81          HD11      LEU  81  -5.697  -7.194   6.403
  653   HD12  LEU  81          HD12      LEU  81  -5.637  -5.650   7.251
  654   HD13  LEU  81          HD13      LEU  81  -5.528  -5.693   5.492
  655   HD21  LEU  81          HD21      LEU  81  -8.972  -4.468   6.262
  656   HD22  LEU  81          HD22      LEU  81  -7.579  -4.156   5.230
  657   HD23  LEU  81          HD23      LEU  81  -7.430  -4.015   6.980
  658    H    TYR  82           HN       TYR  82 -10.183  -7.110   2.415
  659    HA   TYR  82           HA       TYR  82 -10.247  -4.294   1.708
  660    HB2  TYR  82           HB2      TYR  82  -9.743  -5.901  -0.031
  661    HB3  TYR  82           HB1      TYR  82 -11.247  -6.767   0.255
  662    HD1  TYR  82           HD2      TYR  82  -9.854  -3.486  -0.827
  663    HD2  TYR  82           HD1      TYR  82 -13.271  -6.090  -0.845
  664    HE1  TYR  82           HE2      TYR  82 -10.993  -1.985  -2.442
  665    HE2  TYR  82           HE1      TYR  82 -14.407  -4.588  -2.458
  666    HH   TYR  82           HH       TYR  82 -13.779  -2.898  -4.149
  667    H    GLU  83           HN       GLU  83 -12.668  -6.677   2.705
  668    HA   GLU  83           HA       GLU  83 -14.977  -5.131   2.043
  669    HB2  GLU  83           HB2      GLU  83 -14.963  -7.566   2.748
  670    HB3  GLU  83           HB1      GLU  83 -14.700  -7.023   4.404
  671    HG2  GLU  83           HG2      GLU  83 -16.786  -5.712   4.313
  672    HG3  GLU  83           HG1      GLU  83 -17.048  -6.242   2.651
  673    H    LYS  84           HN       LYS  84 -12.922  -5.227   4.946
  674    HA   LYS  84           HA       LYS  84 -14.510  -3.249   6.381
  675    HB2  LYS  84           HB2      LYS  84 -13.014  -4.932   7.491
  676    HB3  LYS  84           HB1      LYS  84 -11.626  -4.057   6.846
  677    HG2  LYS  84           HG2      LYS  84 -12.266  -2.048   8.063
  678    HG3  LYS  84           HG1      LYS  84 -13.752  -2.820   8.618
  679    HD2  LYS  84           HD2      LYS  84 -12.409  -4.519   9.819
  680    HD3  LYS  84           HD1      LYS  84 -10.932  -3.712   9.291
  681    HE2  LYS  84           HE2      LYS  84 -11.682  -1.640  10.443
  682    HE3  LYS  84           HE1      LYS  84 -13.105  -2.502  11.025
  683    HZ1  LYS  84           HZ1      LYS  84 -11.680  -2.783  12.770
  684    HZ2  LYS  84           HZ2      LYS  84 -10.292  -2.824  11.791
  685    HZ3  LYS  84           HZ3      LYS  84 -11.318  -4.175  11.872
  686    H    ALA  85           HN       ALA  85 -11.379  -3.154   4.645
  687    HA   ALA  85           HA       ALA  85 -10.780  -0.426   5.013
  688    HB1  ALA  85           HB1      ALA  85  -9.282  -2.107   3.903
  689    HB2  ALA  85           HB2      ALA  85  -9.411  -0.595   3.005
  690    HB3  ALA  85           HB3      ALA  85 -10.307  -2.017   2.471
  691    H    LYS  86           HN       LYS  86 -13.029  -1.966   2.789
  692    HA   LYS  86           HA       LYS  86 -13.559   0.382   1.200
  693    HB2  LYS  86           HB2      LYS  86 -14.157  -1.976   0.504
  694    HB3  LYS  86           HB1      LYS  86 -15.449  -1.953   1.705
  695    HG2  LYS  86           HG2      LYS  86 -16.487  -0.031   0.601
  696    HG3  LYS  86           HG1      LYS  86 -15.166   0.036  -0.567
  697    HD2  LYS  86           HD2      LYS  86 -15.748  -2.241  -1.345
  698    HD3  LYS  86           HD1      LYS  86 -17.088  -2.281  -0.197
  699    HE2  LYS  86           HE2      LYS  86 -16.755  -0.307  -2.475
  700    HE3  LYS  86           HE1      LYS  86 -17.904  -1.645  -2.422
  701    HZ1  LYS  86           HZ1      LYS  86 -19.105   0.227  -1.750
  702    HZ2  LYS  86           HZ2      LYS  86 -17.854   0.795  -0.751
  703    HZ3  LYS  86           HZ3      LYS  86 -18.743  -0.581  -0.303
  704    H    ARG  87           HN       ARG  87 -14.714  -0.738   4.333
  705    HA   ARG  87           HA       ARG  87 -17.007   1.095   4.378
  706    HB2  ARG  87           HB2      ARG  87 -15.647  -0.516   6.562
  707    HB3  ARG  87           HB1      ARG  87 -17.116   0.432   6.794
  708    HG2  ARG  87           HG2      ARG  87 -18.275  -0.900   5.094
  709    HG3  ARG  87           HG1      ARG  87 -16.803  -1.823   4.791
  710    HD2  ARG  87           HD2      ARG  87 -18.340  -3.040   6.305
  711    HD3  ARG  87           HD1      ARG  87 -16.819  -2.645   7.106
  712    HE   ARG  87           HE       ARG  87 -18.478  -0.503   7.722
  713   HH11  ARG  87          HH21      ARG  87 -18.628  -3.943   8.001
  714   HH12  ARG  87          HH22      ARG  87 -19.622  -3.915   9.419
  715   HH21  ARG  87          HH11      ARG  87 -19.774  -0.455   9.568
  716   HH22  ARG  87          HH12      ARG  87 -20.270  -1.941  10.304
  717    H    ASP  88           HN       ASP  88 -13.631   1.191   5.392
  718    HA   ASP  88           HA       ASP  88 -14.035   3.783   6.815
  719    HB2  ASP  88           HB2      ASP  88 -12.545   1.958   7.759
  720    HB3  ASP  88           HB1      ASP  88 -11.466   2.212   6.387
  721    H    GLU  89           HN       GLU  89 -13.501   2.756   3.686
  722    HA   GLU  89           HA       GLU  89 -11.473   4.387   2.601
  723    HB2  GLU  89           HB2      GLU  89 -12.791   2.640   1.407
  724    HB3  GLU  89           HB1      GLU  89 -14.176   3.724   1.391
  725    HG2  GLU  89           HG2      GLU  89 -12.834   5.368   0.078
  726    HG3  GLU  89           HG1      GLU  89 -11.503   4.207   0.040
  727    HA   PRO  90           HA       PRO  90 -13.670   8.270   3.720
  728    HB2  PRO  90           HB2      PRO  90 -11.498   9.932   2.767
  729    HB3  PRO  90           HB1      PRO  90 -11.902   9.564   4.450
  730    HG2  PRO  90           HG2      PRO  90  -9.635   8.570   2.923
  731    HG3  PRO  90           HG1      PRO  90 -10.033   8.229   4.614
  732    HD2  PRO  90           HD2      PRO  90 -10.312   6.450   2.324
  733    HD3  PRO  90           HD1      PRO  90 -10.637   6.088   4.023
  734    H    LYS  91           HN       LYS  91 -14.592   9.994   2.370
  735    HA   LYS  91           HA       LYS  91 -15.422   9.225  -0.181
  736    HB2  LYS  91           HB2      LYS  91 -16.284  11.430  -0.472
  737    HB3  LYS  91           HB1      LYS  91 -16.310  11.146   1.266
  738    HG2  LYS  91           HG2      LYS  91 -14.015  12.321   1.338
  739    HG3  LYS  91           HG1      LYS  91 -14.339  12.823  -0.319
  740    HD2  LYS  91           HD2      LYS  91 -16.456  13.884   0.435
  741    HD3  LYS  91           HD1      LYS  91 -16.067  13.436   2.096
  742    HE2  LYS  91           HE2      LYS  91 -15.414  15.781   1.584
  743    HE3  LYS  91           HE1      LYS  91 -14.024  14.783   2.014
  744    HZ1  LYS  91           HZ1      LYS  91 -13.666  16.185   0.029
  745    HZ2  LYS  91           HZ2      LYS  91 -14.893  15.324  -0.772
  746    HZ3  LYS  91           HZ3      LYS  91 -13.474  14.529  -0.280
  Start of MODEL   13
    1    H1   MET   1           HT1      MET   1  -9.693  15.621   8.889
    2    H2   MET   1           HT2      MET   1 -10.622  17.043   8.859
    3    H3   MET   1           HT3      MET   1 -10.825  15.918  10.116
    4    HA   MET   1           HA       MET   1  -8.837  17.992   9.786
    5    HB2  MET   1           HB2      MET   1 -10.556  17.874  11.608
    6    HB3  MET   1           HB1      MET   1  -9.777  16.405  12.195
    7    HG2  MET   1           HG2      MET   1  -7.707  17.608  12.615
    8    HG3  MET   1           HG1      MET   1  -8.365  19.070  11.883
    9    HE1  MET   1           HE1      MET   1  -7.058  19.388  14.420
   10    HE2  MET   1           HE2      MET   1  -8.181  20.166  15.533
   11    HE3  MET   1           HE3      MET   1  -8.087  20.715  13.862
   12    H    ALA   2           HN       ALA   2  -8.903  14.600  10.929
   13    HA   ALA   2           HA       ALA   2  -6.093  14.468  11.486
   14    HB1  ALA   2           HB1      ALA   2  -6.422  12.021  11.475
   15    HB2  ALA   2           HB2      ALA   2  -8.010  12.237  10.738
   16    HB3  ALA   2           HB3      ALA   2  -7.710  12.824  12.374
   17    H    SER   3           HN       SER   3  -4.368  13.971  10.154
   18    HA   SER   3           HA       SER   3  -4.704  14.299   7.298
   19    HB2  SER   3           HB2      SER   3  -2.614  14.876   8.678
   20    HB3  SER   3           HB1      SER   3  -2.265  13.148   8.708
   21    HG   SER   3           HG       SER   3  -2.176  14.976   6.611
   22    H    THR   4           HN       THR   4  -4.673  12.719   5.678
   23    HA   THR   4           HA       THR   4  -5.621  10.089   6.405
   24    HB   THR   4           HB       THR   4  -4.420  10.806   3.709
   25    HG1  THR   4           HG1      THR   4  -6.360  12.086   4.993
   26   HG21  THR   4          HG21      THR   4  -6.869   9.158   4.385
   27   HG22  THR   4          HG22      THR   4  -5.257   8.458   4.236
   28   HG23  THR   4          HG23      THR   4  -6.013   9.236   2.845
   29    H    ARG   5           HN       ARG   5  -2.454  11.446   5.759
   30    HA   ARG   5           HA       ARG   5  -0.962   9.124   5.184
   31    HB2  ARG   5           HB2      ARG   5  -0.133  11.474   6.915
   32    HB3  ARG   5           HB1      ARG   5   0.964  10.321   6.155
   33    HG2  ARG   5           HG2      ARG   5   0.191  11.002   3.934
   34    HG3  ARG   5           HG1      ARG   5  -0.977  12.107   4.660
   35    HD2  ARG   5           HD2      ARG   5   1.097  13.275   3.918
   36    HD3  ARG   5           HD1      ARG   5   0.826  13.422   5.653
   37    HE   ARG   5           HE       ARG   5   2.439  11.172   5.412
   38   HH11  ARG   5          HH21      ARG   5   2.563  14.465   4.377
   39   HH12  ARG   5          HH22      ARG   5   4.292  14.551   4.428
   40   HH21  ARG   5          HH11      ARG   5   4.693  11.272   5.481
   41   HH22  ARG   5          HH12      ARG   5   5.496  12.745   5.052
   42    H    CYS   6           HN       CYS   6  -1.961  10.435   8.335
   43    HA   CYS   6           HA       CYS   6  -0.622   8.423   9.898
   44    HB2  CYS   6           HB2      CYS   6  -3.007  10.190  10.514
   45    HB3  CYS   6           HB1      CYS   6  -2.197   9.174  11.707
   46    HG   CYS   6           HG       CYS   6  -0.546  10.993  11.961
   47    H    LYS   7           HN       LYS   7  -3.632   8.525   8.148
   48    HA   LYS   7           HA       LYS   7  -4.890   6.296   9.513
   49    HB2  LYS   7           HB2      LYS   7  -6.041   8.113   8.112
   50    HB3  LYS   7           HB1      LYS   7  -5.464   7.252   6.692
   51    HG2  LYS   7           HG2      LYS   7  -7.594   6.285   6.956
   52    HG3  LYS   7           HG1      LYS   7  -6.599   5.139   7.850
   53    HD2  LYS   7           HD2      LYS   7  -7.202   6.219   9.968
   54    HD3  LYS   7           HD1      LYS   7  -8.101   7.466   9.106
   55    HE2  LYS   7           HE2      LYS   7  -9.582   5.683   8.165
   56    HE3  LYS   7           HE1      LYS   7  -8.736   4.502   9.164
   57    HZ1  LYS   7           HZ1      LYS   7  -9.774   5.197  11.002
   58    HZ2  LYS   7           HZ2      LYS   7 -10.902   5.891   9.937
   59    HZ3  LYS   7           HZ3      LYS   7  -9.650   6.837  10.591
   60    H    LEU   8           HN       LEU   8  -3.097   6.605   6.421
   61    HA   LEU   8           HA       LEU   8  -3.297   3.770   5.802
   62    HB2  LEU   8           HB2      LEU   8  -1.322   5.877   4.866
   63    HB3  LEU   8           HB1      LEU   8  -1.467   4.271   4.161
   64    HG   LEU   8           HG       LEU   8  -3.913   6.062   4.334
   65   HD11  LEU   8          HD11      LEU   8  -1.773   6.143   2.185
   66   HD12  LEU   8          HD12      LEU   8  -2.245   7.461   3.257
   67   HD13  LEU   8          HD13      LEU   8  -3.370   6.877   2.032
   68   HD21  LEU   8          HD21      LEU   8  -4.297   3.743   3.636
   69   HD22  LEU   8          HD22      LEU   8  -3.028   3.863   2.420
   70   HD23  LEU   8          HD23      LEU   8  -4.510   4.799   2.245
   71    H    ALA   9           HN       ALA   9  -0.960   5.727   7.592
   72    HA   ALA   9           HA       ALA   9   1.139   3.806   7.740
   73    HB1  ALA   9           HB1      ALA   9   1.955   5.073   9.628
   74    HB2  ALA   9           HB2      ALA   9   0.361   5.770   9.913
   75    HB3  ALA   9           HB3      ALA   9   1.274   6.216   8.471
   76    H    ARG  10           HN       ARG  10  -1.724   4.285   9.785
   77    HA   ARG  10           HA       ARG  10  -1.043   2.230  11.685
   78    HB2  ARG  10           HB2      ARG  10  -3.654   3.578  10.937
   79    HB3  ARG  10           HB1      ARG  10  -3.575   2.329  12.179
   80    HG2  ARG  10           HG2      ARG  10  -1.999   3.652  13.482
   81    HG3  ARG  10           HG1      ARG  10  -1.912   4.870  12.210
   82    HD2  ARG  10           HD2      ARG  10  -4.314   5.355  12.503
   83    HD3  ARG  10           HD1      ARG  10  -4.407   4.134  13.774
   84    HE   ARG  10           HE       ARG  10  -2.378   5.837  14.617
   85   HH11  ARG  10          HH21      ARG  10  -5.675   6.157  13.641
   86   HH12  ARG  10          HH22      ARG  10  -5.977   7.531  14.652
   87   HH21  ARG  10          HH11      ARG  10  -2.758   7.628  15.936
   88   HH22  ARG  10          HH12      ARG  10  -4.327   8.363  15.949
   89    H    TYR  11           HN       TYR  11  -2.717   2.207   8.588
   90    HA   TYR  11           HA       TYR  11  -3.865  -0.404   8.800
   91    HB2  TYR  11           HB2      TYR  11  -3.208   1.488   6.562
   92    HB3  TYR  11           HB1      TYR  11  -3.493  -0.191   6.109
   93    HD1  TYR  11           HD1      TYR  11  -5.001   2.116   8.669
   94    HD2  TYR  11           HD2      TYR  11  -5.704  -0.460   5.300
   95    HE1  TYR  11           HE1      TYR  11  -7.444   2.493   8.883
   96    HE2  TYR  11           HE2      TYR  11  -8.143  -0.087   5.522
   97    HH   TYR  11           HH       TYR  11  -9.449   2.054   8.062
   98    H    LEU  12           HN       LEU  12  -0.803   0.596   7.189
   99    HA   LEU  12           HA       LEU  12   0.057  -2.063   6.614
  100    HB2  LEU  12           HB2      LEU  12   1.947   0.198   7.354
  101    HB3  LEU  12           HB1      LEU  12   2.265  -1.168   6.289
  102    HG   LEU  12           HG       LEU  12   0.157   0.962   5.645
  103   HD11  LEU  12          HD11      LEU  12   3.014   0.753   4.621
  104   HD12  LEU  12          HD12      LEU  12   2.461   1.938   5.801
  105   HD13  LEU  12          HD13      LEU  12   1.820   1.965   4.160
  106   HD21  LEU  12          HD21      LEU  12   1.468  -1.290   4.063
  107   HD22  LEU  12          HD22      LEU  12   0.623   0.043   3.281
  108   HD23  LEU  12          HD23      LEU  12  -0.252  -1.035   4.357
  109    H    GLU  13           HN       GLU  13   0.020  -0.270   9.594
  110    HA   GLU  13           HA       GLU  13   1.859  -2.134  10.967
  111    HB2  GLU  13           HB2      GLU  13   0.119   0.163  11.920
  112    HB3  GLU  13           HB1      GLU  13   0.976  -0.876  13.054
  113    HG2  GLU  13           HG2      GLU  13   2.372   0.565  10.774
  114    HG3  GLU  13           HG1      GLU  13   2.210   1.252  12.389
  115    H    ASP  14           HN       ASP  14  -1.602  -1.764  10.479
  116    HA   ASP  14           HA       ASP  14  -2.424  -3.562  12.580
  117    HB2  ASP  14           HB2      ASP  14  -3.842  -2.906   9.973
  118    HB3  ASP  14           HB1      ASP  14  -4.577  -3.636  11.402
  119    H    LEU  15           HN       LEU  15  -0.507  -4.209   9.980
  120    HA   LEU  15           HA       LEU  15  -1.619  -6.958   9.495
  121    HB2  LEU  15           HB2      LEU  15   0.025  -5.012   7.925
  122    HB3  LEU  15           HB1      LEU  15   0.498  -6.698   7.743
  123    HG   LEU  15           HG       LEU  15  -1.850  -7.264   7.150
  124   HD11  LEU  15          HD11      LEU  15  -3.044  -5.474   8.290
  125   HD12  LEU  15          HD12      LEU  15  -3.392  -5.388   6.566
  126   HD13  LEU  15          HD13      LEU  15  -2.245  -4.264   7.287
  127   HD21  LEU  15          HD21      LEU  15  -0.751  -5.023   5.429
  128   HD22  LEU  15          HD22      LEU  15  -1.774  -6.358   4.904
  129   HD23  LEU  15          HD23      LEU  15  -0.118  -6.667   5.421
  130    H    GLU  16           HN       GLU  16  -0.082  -8.758   9.579
  131    HA   GLU  16           HA       GLU  16   1.465  -8.748  11.988
  132    HB2  GLU  16           HB2      GLU  16   0.377 -10.753  10.853
  133    HB3  GLU  16           HB1      GLU  16   1.718 -10.738   9.710
  134    HG2  GLU  16           HG2      GLU  16   3.323 -11.111  11.493
  135    HG3  GLU  16           HG1      GLU  16   2.068 -10.936  12.719
  136    H    ASP  17           HN       ASP  17   3.835  -9.237  12.098
  137    HA   ASP  17           HA       ASP  17   5.352  -7.294  10.626
  138    HB2  ASP  17           HB2      ASP  17   7.319  -8.344  11.727
  139    HB3  ASP  17           HB1      ASP  17   6.020  -8.007  12.872
  140    H    VAL  18           HN       VAL  18   5.250 -10.878  10.411
  141    HA   VAL  18           HA       VAL  18   7.132 -10.985   8.227
  142    HB   VAL  18           HB       VAL  18   6.568 -12.944   9.682
  143   HG11  VAL  18          HG11      VAL  18   4.515 -14.173   9.363
  144   HG12  VAL  18          HG12      VAL  18   4.028 -13.136   8.024
  145   HG13  VAL  18          HG13      VAL  18   4.065 -12.496   9.666
  146   HG21  VAL  18          HG21      VAL  18   6.637 -14.589   7.862
  147   HG22  VAL  18          HG22      VAL  18   7.638 -13.201   7.436
  148   HG23  VAL  18          HG23      VAL  18   6.036 -13.387   6.721
  149    H    ASP  19           HN       ASP  19   3.570 -10.812   8.364
  150    HA   ASP  19           HA       ASP  19   3.156 -11.112   5.545
  151    HB2  ASP  19           HB2      ASP  19   1.504  -9.608   7.601
  152    HB3  ASP  19           HB1      ASP  19   0.966 -10.016   5.973
  153    H    LEU  20           HN       LEU  20   4.137  -8.414   7.559
  154    HA   LEU  20           HA       LEU  20   3.668  -6.339   5.629
  155    HB2  LEU  20           HB2      LEU  20   4.129  -5.983   8.097
  156    HB3  LEU  20           HB1      LEU  20   5.803  -6.419   7.782
  157    HG   LEU  20           HG       LEU  20   5.749  -4.510   5.986
  158   HD11  LEU  20          HD11      LEU  20   3.364  -4.046   5.933
  159   HD12  LEU  20          HD12      LEU  20   4.171  -2.651   6.635
  160   HD13  LEU  20          HD13      LEU  20   3.330  -3.795   7.676
  161   HD21  LEU  20          HD21      LEU  20   5.606  -3.882   8.952
  162   HD22  LEU  20          HD22      LEU  20   6.282  -2.813   7.724
  163   HD23  LEU  20          HD23      LEU  20   7.050  -4.365   8.060
  164    H    LYS  21           HN       LYS  21   6.227  -8.650   6.187
  165    HA   LYS  21           HA       LYS  21   8.236  -7.466   4.523
  166    HB2  LYS  21           HB2      LYS  21   8.578  -9.328   6.201
  167    HB3  LYS  21           HB1      LYS  21   7.810 -10.423   5.055
  168    HG2  LYS  21           HG2      LYS  21   9.540  -9.813   3.365
  169    HG3  LYS  21           HG1      LYS  21  10.337  -8.816   4.584
  170    HD2  LYS  21           HD2      LYS  21  10.639 -10.782   6.025
  171    HD3  LYS  21           HD1      LYS  21   9.806 -11.790   4.843
  172    HE2  LYS  21           HE2      LYS  21  12.421 -10.316   4.433
  173    HE3  LYS  21           HE1      LYS  21  12.203 -12.062   4.553
  174    HZ1  LYS  21           HZ1      LYS  21  10.466 -11.308   2.596
  175    HZ2  LYS  21           HZ2      LYS  21  11.989 -12.022   2.355
  176    HZ3  LYS  21           HZ3      LYS  21  11.823 -10.331   2.306
  177    H    LYS  22           HN       LYS  22   5.550  -9.695   3.832
  178    HA   LYS  22           HA       LYS  22   6.365 -10.181   1.086
  179    HB2  LYS  22           HB2      LYS  22   3.713 -10.532   2.526
  180    HB3  LYS  22           HB1      LYS  22   3.932 -10.947   0.827
  181    HG2  LYS  22           HG2      LYS  22   5.897 -12.423   1.588
  182    HG3  LYS  22           HG1      LYS  22   5.316 -12.175   3.233
  183    HD2  LYS  22           HD2      LYS  22   3.659 -13.325   0.962
  184    HD3  LYS  22           HD1      LYS  22   4.454 -14.280   2.210
  185    HE2  LYS  22           HE2      LYS  22   3.127 -12.870   3.912
  186    HE3  LYS  22           HE1      LYS  22   2.162 -12.330   2.537
  187    HZ1  LYS  22           HZ1      LYS  22   2.635 -15.201   2.904
  188    HZ2  LYS  22           HZ2      LYS  22   1.314 -14.405   2.192
  189    HZ3  LYS  22           HZ3      LYS  22   1.484 -14.433   3.882
  190    H    PHE  23           HN       PHE  23   4.511  -7.629   2.658
  191    HA   PHE  23           HA       PHE  23   3.277  -6.612   0.243
  192    HB2  PHE  23           HB2      PHE  23   2.586  -6.014   2.597
  193    HB3  PHE  23           HB1      PHE  23   4.042  -5.032   2.720
  194    HD1  PHE  23           HD1      PHE  23   4.398  -3.119   1.090
  195    HD2  PHE  23           HD2      PHE  23   0.642  -5.179   1.455
  196    HE1  PHE  23           HE1      PHE  23   3.252  -1.237  -0.043
  197    HE2  PHE  23           HE2      PHE  23  -0.499  -3.296   0.320
  198    HZ   PHE  23           HZ       PHE  23   0.806  -1.324  -0.429
  199    H    LYS  24           HN       LYS  24   6.349  -5.826   1.904
  200    HA   LYS  24           HA       LYS  24   7.075  -3.754   0.015
  201    HB2  LYS  24           HB2      LYS  24   7.995  -3.847   2.301
  202    HB3  LYS  24           HB1      LYS  24   8.791  -5.372   1.931
  203    HG2  LYS  24           HG2      LYS  24   9.423  -3.139   0.025
  204    HG3  LYS  24           HG1      LYS  24  10.006  -2.893   1.666
  205    HD2  LYS  24           HD2      LYS  24  11.155  -5.086   1.590
  206    HD3  LYS  24           HD1      LYS  24  10.599  -5.316  -0.065
  207    HE2  LYS  24           HE2      LYS  24  12.918  -4.426   0.024
  208    HE3  LYS  24           HE1      LYS  24  11.811  -3.317  -0.785
  209    HZ1  LYS  24           HZ1      LYS  24  13.295  -2.243   0.859
  210    HZ2  LYS  24           HZ2      LYS  24  12.536  -3.138   2.086
  211    HZ3  LYS  24           HZ3      LYS  24  11.647  -2.008   1.181
  212    H    MET  25           HN       MET  25   8.077  -7.162   0.429
  213    HA   MET  25           HA       MET  25   9.887  -7.272  -1.742
  214    HB2  MET  25           HB2      MET  25   9.483  -9.069   0.007
  215    HB3  MET  25           HB1      MET  25   8.039  -9.526  -0.893
  216    HG2  MET  25           HG2      MET  25   9.803 -10.976  -1.640
  217    HG3  MET  25           HG1      MET  25   9.539  -9.809  -2.934
  218    HE1  MET  25           HE1      MET  25  13.292 -10.171  -3.331
  219    HE2  MET  25           HE2      MET  25  11.721 -10.024  -4.113
  220    HE3  MET  25           HE3      MET  25  12.048 -11.402  -3.065
  221    H    HIS  26           HN       HIS  26   6.360  -7.523  -1.681
  222    HA   HIS  26           HA       HIS  26   6.091  -8.345  -4.456
  223    HB2  HIS  26           HB2      HIS  26   4.174  -6.985  -2.518
  224    HB3  HIS  26           HB1      HIS  26   3.697  -7.504  -4.136
  225    HD1  HIS  26           HD1      HIS  26   6.157  -9.662  -2.396
  226    HD2  HIS  26           HD2      HIS  26   2.015  -9.501  -2.834
  227    HE1  HIS  26           HE1      HIS  26   5.267 -11.903  -1.622
  228    H    LEU  27           HN       LEU  27   6.043  -5.178  -2.801
  229    HA   LEU  27           HA       LEU  27   5.539  -3.707  -5.269
  230    HB2  LEU  27           HB2      LEU  27   5.224  -3.065  -2.671
  231    HB3  LEU  27           HB1      LEU  27   6.834  -2.403  -2.870
  232    HG   LEU  27           HG       LEU  27   5.304  -0.612  -3.288
  233   HD11  LEU  27          HD11      LEU  27   7.230  -0.944  -4.932
  234   HD12  LEU  27          HD12      LEU  27   5.918   0.110  -5.454
  235   HD13  LEU  27          HD13      LEU  27   6.020  -1.531  -6.076
  236   HD21  LEU  27          HD21      LEU  27   3.861  -2.094  -5.496
  237   HD22  LEU  27          HD22      LEU  27   3.351  -0.687  -4.574
  238   HD23  LEU  27          HD23      LEU  27   3.344  -2.272  -3.818
  239    H    GLU  28           HN       GLU  28   8.387  -4.768  -3.504
  240    HA   GLU  28           HA       GLU  28  10.309  -3.129  -4.857
  241    HB2  GLU  28           HB2      GLU  28  10.722  -4.466  -2.757
  242    HB3  GLU  28           HB1      GLU  28  10.737  -5.923  -3.750
  243    HG2  GLU  28           HG2      GLU  28  12.646  -5.121  -5.011
  244    HG3  GLU  28           HG1      GLU  28  12.572  -3.551  -4.210
  245    H    ASP  29           HN       ASP  29   8.391  -5.735  -5.933
  246    HA   ASP  29           HA       ASP  29   9.907  -5.847  -8.510
  247    HB2  ASP  29           HB2      ASP  29   9.536  -8.342  -8.538
  248    HB3  ASP  29           HB1      ASP  29  10.684  -7.807  -7.309
  249    H    TYR  30           HN       TYR  30   7.789  -4.321  -8.485
  250    HA   TYR  30           HA       TYR  30   5.241  -5.574  -8.676
  251    HB2  TYR  30           HB2      TYR  30   5.671  -3.107  -8.394
  252    HB3  TYR  30           HB1      TYR  30   6.141  -3.047 -10.092
  253    HD1  TYR  30           HD2      TYR  30   4.483  -3.439 -11.878
  254    HD2  TYR  30           HD1      TYR  30   3.337  -3.411  -7.737
  255    HE1  TYR  30           HE2      TYR  30   2.101  -3.247 -12.539
  256    HE2  TYR  30           HE1      TYR  30   0.955  -3.219  -8.400
  257    HH   TYR  30           HH       TYR  30  -0.105  -3.720 -11.609
  258    HA   PRO  31           HA       PRO  31   5.948  -7.581 -12.637
  259    HB2  PRO  31           HB2      PRO  31   3.222  -7.758 -13.476
  260    HB3  PRO  31           HB1      PRO  31   4.131  -8.991 -12.590
  261    HG2  PRO  31           HG2      PRO  31   2.059  -7.132 -11.567
  262    HG3  PRO  31           HG1      PRO  31   2.674  -8.623 -10.833
  263    HD2  PRO  31           HD2      PRO  31   3.295  -5.983  -9.981
  264    HD3  PRO  31           HD1      PRO  31   4.161  -7.462  -9.504
  265    HA   PRO  32           HA       PRO  32   5.628  -3.654 -14.968
  266    HB2  PRO  32           HB2      PRO  32   6.930  -4.639 -17.320
  267    HB3  PRO  32           HB1      PRO  32   7.694  -3.750 -15.994
  268    HG2  PRO  32           HG2      PRO  32   7.905  -6.623 -16.629
  269    HG3  PRO  32           HG1      PRO  32   8.883  -5.666 -15.506
  270    HD2  PRO  32           HD2      PRO  32   6.833  -7.554 -14.806
  271    HD3  PRO  32           HD1      PRO  32   7.688  -6.454 -13.700
  272    H    GLN  33           HN       GLN  33   3.893  -3.020 -16.219
  273    HA   GLN  33           HA       GLN  33   2.247  -5.133 -17.541
  274    HB2  GLN  33           HB2      GLN  33   1.614  -2.202 -17.064
  275    HB3  GLN  33           HB1      GLN  33   0.488  -3.451 -17.592
  276    HG2  GLN  33           HG2      GLN  33   1.979  -3.499 -14.949
  277    HG3  GLN  33           HG1      GLN  33   0.312  -2.960 -15.148
  278   HE21  GLN  33          HE21      GLN  33  -1.318  -4.589 -15.690
  279   HE22  GLN  33          HE22      GLN  33  -0.999  -6.246 -15.506
  280    H    LYS  34           HN       LYS  34   3.748  -1.975 -18.285
  281    HA   LYS  34           HA       LYS  34   4.345  -2.785 -20.993
  282    HB2  LYS  34           HB2      LYS  34   2.855  -1.152 -22.114
  283    HB3  LYS  34           HB1      LYS  34   1.945  -2.391 -21.254
  284    HG2  LYS  34           HG2      LYS  34   1.739  -0.813 -19.311
  285    HG3  LYS  34           HG1      LYS  34   2.492   0.435 -20.302
  286    HD2  LYS  34           HD2      LYS  34   0.683   0.149 -21.988
  287    HD3  LYS  34           HD1      LYS  34  -0.095  -1.019 -20.919
  288    HE2  LYS  34           HE2      LYS  34   0.466   1.892 -20.282
  289    HE3  LYS  34           HE1      LYS  34  -1.115   1.182 -20.607
  290    HZ1  LYS  34           HZ1      LYS  34  -0.158  -0.402 -18.653
  291    HZ2  LYS  34           HZ2      LYS  34  -1.200   0.916 -18.407
  292    HZ3  LYS  34           HZ3      LYS  34   0.476   1.106 -18.206
  293    H    GLY  35           HN       GLY  35   5.799  -1.697 -18.796
  294    HA2  GLY  35           HA2      GLY  35   7.770  -0.212 -19.260
  295    HA3  GLY  35           HA1      GLY  35   6.641   0.992 -19.876
  296    H    CYS  36           HN       CYS  36   6.346  -1.026 -16.952
  297    HA   CYS  36           HA       CYS  36   5.527   1.240 -15.351
  298    HB2  CYS  36           HB2      CYS  36   4.845  -1.121 -14.883
  299    HB3  CYS  36           HB1      CYS  36   6.510  -1.475 -14.423
  300    HG   CYS  36           HG       CYS  36   6.206  -0.241 -12.271
  301    H    ILE  37           HN       ILE  37   6.730   2.253 -13.647
  302    HA   ILE  37           HA       ILE  37   9.651   2.372 -14.145
  303    HB   ILE  37           HB       ILE  37   7.951   4.014 -12.243
  304   HG12  ILE  37          HG12      ILE  37   8.885   4.769 -15.037
  305   HG13  ILE  37          HG11      ILE  37   7.259   4.179 -14.684
  306   HG21  ILE  37          HG21      ILE  37  10.359   4.064 -11.738
  307   HG22  ILE  37          HG22      ILE  37   9.853   5.611 -12.407
  308   HG23  ILE  37          HG23      ILE  37  10.720   4.460 -13.418
  309   HD11  ILE  37          HD11      ILE  37   6.963   6.049 -13.046
  310   HD12  ILE  37          HD12      ILE  37   7.241   6.634 -14.688
  311   HD13  ILE  37          HD13      ILE  37   8.549   6.668 -13.505
  312    HA   PRO  38           HA       PRO  38   9.729  -0.388 -10.465
  313    HB2  PRO  38           HB2      PRO  38  12.567  -0.764 -10.530
  314    HB3  PRO  38           HB1      PRO  38  11.348  -1.865 -11.187
  315    HG2  PRO  38           HG2      PRO  38  13.185  -0.103 -12.660
  316    HG3  PRO  38           HG1      PRO  38  12.132  -1.375 -13.299
  317    HD2  PRO  38           HD2      PRO  38  11.726   1.479 -13.488
  318    HD3  PRO  38           HD1      PRO  38  10.626   0.201 -14.043
  319    H    LEU  39           HN       LEU  39  10.016   0.250  -8.334
  320    HA   LEU  39           HA       LEU  39  10.986   2.931  -7.801
  321    HB2  LEU  39           HB2      LEU  39   9.744   0.694  -6.237
  322    HB3  LEU  39           HB1      LEU  39  10.637   1.886  -5.301
  323    HG   LEU  39           HG       LEU  39   9.251   3.686  -6.366
  324   HD11  LEU  39          HD11      LEU  39   7.171   2.959  -7.536
  325   HD12  LEU  39          HD12      LEU  39   7.763   1.297  -7.499
  326   HD13  LEU  39          HD13      LEU  39   8.632   2.522  -8.423
  327   HD21  LEU  39          HD21      LEU  39   8.608   2.860  -4.180
  328   HD22  LEU  39          HD22      LEU  39   7.807   1.461  -4.894
  329   HD23  LEU  39          HD23      LEU  39   7.141   3.077  -5.134
  330    HA   PRO  40           HA       PRO  40  15.284   1.480  -7.420
  331    HB2  PRO  40           HB2      PRO  40  15.856   3.754  -5.605
  332    HB3  PRO  40           HB1      PRO  40  16.538   3.419  -7.204
  333    HG2  PRO  40           HG2      PRO  40  14.607   5.426  -6.600
  334    HG3  PRO  40           HG1      PRO  40  15.075   4.885  -8.220
  335    HD2  PRO  40           HD2      PRO  40  12.547   4.385  -6.820
  336    HD3  PRO  40           HD1      PRO  40  12.975   3.966  -8.496
  337    H    ARG  41           HN       ARG  41  16.108   0.031  -5.949
  338    HA   ARG  41           HA       ARG  41  14.604  -0.675  -3.613
  339    HB2  ARG  41           HB2      ARG  41  17.453  -1.377  -4.408
  340    HB3  ARG  41           HB1      ARG  41  16.559  -2.160  -3.103
  341    HG2  ARG  41           HG2      ARG  41  14.794  -2.797  -4.750
  342    HG3  ARG  41           HG1      ARG  41  15.781  -2.110  -6.037
  343    HD2  ARG  41           HD2      ARG  41  17.621  -3.782  -4.868
  344    HD3  ARG  41           HD1      ARG  41  16.141  -4.688  -4.570
  345    HE   ARG  41           HE       ARG  41  17.513  -4.566  -7.038
  346   HH11  ARG  41          HH21      ARG  41  14.308  -4.077  -5.842
  347   HH12  ARG  41          HH22      ARG  41  13.567  -4.289  -7.388
  348   HH21  ARG  41          HH11      ARG  41  16.553  -4.860  -9.043
  349   HH22  ARG  41          HH12      ARG  41  14.832  -4.740  -9.195
  350    H    GLY  42           HN       GLY  42  17.408   1.415  -4.083
  351    HA2  GLY  42           HA2      GLY  42  18.167   1.601  -1.305
  352    HA3  GLY  42           HA1      GLY  42  18.560   2.816  -2.523
  353    H    GLN  43           HN       GLN  43  15.789   3.454  -3.227
  354    HA   GLN  43           HA       GLN  43  15.236   5.318  -1.053
  355    HB2  GLN  43           HB2      GLN  43  13.745   4.641  -3.614
  356    HB3  GLN  43           HB1      GLN  43  13.226   5.907  -2.500
  357    HG2  GLN  43           HG2      GLN  43  15.478   6.985  -2.764
  358    HG3  GLN  43           HG1      GLN  43  15.871   5.774  -3.985
  359   HE21  GLN  43          HE21      GLN  43  16.004   7.559  -5.600
  360   HE22  GLN  43          HE22      GLN  43  14.582   8.231  -6.237
  361    H    THR  44           HN       THR  44  13.414   2.564  -2.451
  362    HA   THR  44           HA       THR  44  11.252   2.620  -0.631
  363    HB   THR  44           HB       THR  44  12.527   0.217  -1.971
  364    HG1  THR  44           HG1      THR  44  10.751   0.631  -3.445
  365   HG21  THR  44          HG21      THR  44   9.824   0.605  -0.655
  366   HG22  THR  44          HG22      THR  44  11.059  -0.583  -0.237
  367   HG23  THR  44          HG23      THR  44  10.182  -0.723  -1.759
  368    H    GLU  45           HN       GLU  45  14.342   0.810  -0.338
  369    HA   GLU  45           HA       GLU  45  13.624  -0.328   2.224
  370    HB2  GLU  45           HB2      GLU  45  15.880  -1.153   2.311
  371    HB3  GLU  45           HB1      GLU  45  15.418  -1.186   0.614
  372    HG2  GLU  45           HG2      GLU  45  17.559  -0.212   0.508
  373    HG3  GLU  45           HG1      GLU  45  16.516   1.203   0.508
  374    H    LYS  46           HN       LYS  46  15.559   2.561   1.294
  375    HA   LYS  46           HA       LYS  46  16.138   3.265   4.052
  376    HB2  LYS  46           HB2      LYS  46  17.507   3.991   2.071
  377    HB3  LYS  46           HB1      LYS  46  16.182   5.054   1.599
  378    HG2  LYS  46           HG2      LYS  46  16.370   6.308   3.668
  379    HG3  LYS  46           HG1      LYS  46  17.565   5.172   4.296
  380    HD2  LYS  46           HD2      LYS  46  19.081   5.780   2.413
  381    HD3  LYS  46           HD1      LYS  46  17.903   6.984   1.889
  382    HE2  LYS  46           HE2      LYS  46  19.399   6.923   4.523
  383    HE3  LYS  46           HE1      LYS  46  19.557   8.119   3.237
  384    HZ1  LYS  46           HZ1      LYS  46  17.229   8.723   3.588
  385    HZ2  LYS  46           HZ2      LYS  46  18.156   8.957   4.993
  386    HZ3  LYS  46           HZ3      LYS  46  17.127   7.611   4.865
  387    H    ALA  47           HN       ALA  47  13.383   3.639   2.012
  388    HA   ALA  47           HA       ALA  47  12.290   6.058   3.057
  389    HB1  ALA  47           HB1      ALA  47  10.095   5.126   2.328
  390    HB2  ALA  47           HB2      ALA  47  10.878   3.575   2.037
  391    HB3  ALA  47           HB3      ALA  47  11.331   4.986   1.081
  392    H    ASP  48           HN       ASP  48  11.297   6.506   4.976
  393    HA   ASP  48           HA       ASP  48  11.342   4.474   7.106
  394    HB2  ASP  48           HB2      ASP  48  10.229   7.301   7.131
  395    HB3  ASP  48           HB1      ASP  48  10.584   6.305   8.542
  396    H    HIS  49           HN       HIS  49   9.293   4.200   8.466
  397    HA   HIS  49           HA       HIS  49   7.218   3.039   6.964
  398    HB2  HIS  49           HB2      HIS  49   7.516   2.566   9.341
  399    HB3  HIS  49           HB1      HIS  49   7.099   4.225   9.754
  400    HD1  HIS  49           HD1      HIS  49   4.930   3.773  11.000
  401    HD2  HIS  49           HD2      HIS  49   4.983   2.057   7.202
  402    HE1  HIS  49           HE1      HIS  49   2.581   2.944  10.559
  403    H    VAL  50           HN       VAL  50   7.263   6.310   8.449
  404    HA   VAL  50           HA       VAL  50   4.689   7.073   7.353
  405    HB   VAL  50           HB       VAL  50   7.056   8.789   8.236
  406   HG11  VAL  50          HG11      VAL  50   5.285  10.585   8.484
  407   HG12  VAL  50          HG12      VAL  50   4.178   9.536   7.601
  408   HG13  VAL  50          HG13      VAL  50   5.635  10.145   6.815
  409   HG21  VAL  50          HG21      VAL  50   6.039   7.321   9.999
  410   HG22  VAL  50          HG22      VAL  50   4.484   8.092   9.700
  411   HG23  VAL  50          HG23      VAL  50   5.830   9.038  10.331
  412    H    ASP  51           HN       ASP  51   8.048   7.635   6.257
  413    HA   ASP  51           HA       ASP  51   7.381   9.129   3.927
  414    HB2  ASP  51           HB2      ASP  51   9.698   8.867   4.851
  415    HB3  ASP  51           HB1      ASP  51   9.704   7.205   4.262
  416    H    LEU  52           HN       LEU  52   7.472   5.639   4.518
  417    HA   LEU  52           HA       LEU  52   7.320   4.713   1.868
  418    HB2  LEU  52           HB2      LEU  52   7.429   3.438   4.177
  419    HB3  LEU  52           HB1      LEU  52   5.681   3.426   4.062
  420    HG   LEU  52           HG       LEU  52   6.433   1.353   3.138
  421   HD11  LEU  52          HD11      LEU  52   5.961   3.082   0.706
  422   HD12  LEU  52          HD12      LEU  52   4.678   2.641   1.835
  423   HD13  LEU  52          HD13      LEU  52   5.532   1.390   0.936
  424   HD21  LEU  52          HD21      LEU  52   8.209   2.689   1.081
  425   HD22  LEU  52          HD22      LEU  52   8.219   1.030   1.657
  426   HD23  LEU  52          HD23      LEU  52   8.839   2.312   2.685
  427    H    ALA  53           HN       ALA  53   4.604   5.527   4.066
  428    HA   ALA  53           HA       ALA  53   2.545   5.151   2.101
  429    HB1  ALA  53           HB1      ALA  53   2.079   5.315   4.522
  430    HB2  ALA  53           HB2      ALA  53   1.144   6.506   3.617
  431    HB3  ALA  53           HB3      ALA  53   2.584   7.005   4.505
  432    H    THR  54           HN       THR  54   4.724   7.828   2.759
  433    HA   THR  54           HA       THR  54   3.229   9.812   1.250
  434    HB   THR  54           HB       THR  54   6.190   9.728   1.932
  435    HG1  THR  54           HG1      THR  54   5.637  10.561   3.812
  436   HG21  THR  54          HG21      THR  54   4.342  11.970   1.066
  437   HG22  THR  54          HG22      THR  54   5.770  11.377   0.217
  438   HG23  THR  54          HG23      THR  54   5.947  12.229   1.750
  439    H    LEU  55           HN       LEU  55   5.732   7.431   0.403
  440    HA   LEU  55           HA       LEU  55   6.235   8.542  -2.234
  441    HB2  LEU  55           HB2      LEU  55   6.717   5.712  -1.225
  442    HB3  LEU  55           HB1      LEU  55   7.305   6.357  -2.746
  443    HG   LEU  55           HG       LEU  55   8.036   7.478  -0.017
  444   HD11  LEU  55          HD11      LEU  55   9.536   5.633  -1.897
  445   HD12  LEU  55          HD12      LEU  55   8.981   5.259  -0.266
  446   HD13  LEU  55          HD13      LEU  55  10.267   6.441  -0.510
  447   HD21  LEU  55          HD21      LEU  55   8.347   9.256  -1.545
  448   HD22  LEU  55          HD22      LEU  55   8.834   8.182  -2.855
  449   HD23  LEU  55          HD23      LEU  55   9.934   8.499  -1.515
  450    H    MET  56           HN       MET  56   3.975   6.196  -0.895
  451    HA   MET  56           HA       MET  56   3.036   5.210  -3.444
  452    HB2  MET  56           HB2      MET  56   1.745   5.311  -0.698
  453    HB3  MET  56           HB1      MET  56   0.980   4.543  -2.088
  454    HG2  MET  56           HG2      MET  56   2.916   3.030  -2.336
  455    HG3  MET  56           HG1      MET  56   3.705   3.803  -0.964
  456    HE1  MET  56           HE1      MET  56   0.048   1.071  -1.024
  457    HE2  MET  56           HE2      MET  56   1.536   0.734  -1.904
  458    HE3  MET  56           HE3      MET  56   0.604   2.179  -2.287
  459    H    ILE  57           HN       ILE  57   1.991   7.900  -1.342
  460    HA   ILE  57           HA       ILE  57  -0.230   8.592  -3.129
  461    HB   ILE  57           HB       ILE  57   0.985  10.297  -0.925
  462   HG12  ILE  57          HG12      ILE  57  -1.398   8.422  -0.764
  463   HG13  ILE  57          HG11      ILE  57   0.209   7.996  -0.183
  464   HG21  ILE  57          HG21      ILE  57  -0.454  11.547  -2.465
  465   HG22  ILE  57          HG22      ILE  57  -1.280  11.330  -0.927
  466   HG23  ILE  57          HG23      ILE  57  -1.715  10.325  -2.306
  467   HD11  ILE  57          HD11      ILE  57  -1.117   8.838   1.680
  468   HD12  ILE  57          HD12      ILE  57  -1.494  10.308   0.787
  469   HD13  ILE  57          HD13      ILE  57   0.160   9.995   1.312
  470    H    ASP  58           HN       ASP  58   3.059   9.902  -2.565
  471    HA   ASP  58           HA       ASP  58   2.672  12.074  -4.477
  472    HB2  ASP  58           HB2      ASP  58   4.305  12.102  -2.524
  473    HB3  ASP  58           HB1      ASP  58   5.301  10.958  -3.426
  474    H    PHE  59           HN       PHE  59   4.295   8.892  -4.622
  475    HA   PHE  59           HA       PHE  59   5.377   9.337  -7.260
  476    HB2  PHE  59           HB2      PHE  59   6.161   7.644  -5.512
  477    HB3  PHE  59           HB1      PHE  59   4.809   6.632  -6.013
  478    HD1  PHE  59           HD1      PHE  59   4.732   5.641  -8.269
  479    HD2  PHE  59           HD2      PHE  59   8.060   8.046  -7.001
  480    HE1  PHE  59           HE1      PHE  59   6.063   4.817 -10.192
  481    HE2  PHE  59           HE2      PHE  59   9.387   7.221  -8.923
  482    HZ   PHE  59           HZ       PHE  59   8.390   5.608 -10.515
  483    H    ASN  60           HN       ASN  60   2.386   7.624  -6.181
  484    HA   ASN  60           HA       ASN  60   1.650   7.242  -9.079
  485    HB2  ASN  60           HB2      ASN  60   0.643   5.933  -6.530
  486    HB3  ASN  60           HB1      ASN  60  -0.019   5.611  -8.133
  487   HD21  ASN  60          HD21      ASN  60   1.766   4.945  -9.819
  488   HD22  ASN  60          HD22      ASN  60   2.979   3.902  -9.249
  489    H    GLY  61           HN       GLY  61   0.594   8.818  -6.103
  490    HA2  GLY  61           HA2      GLY  61  -0.832  10.827  -6.269
  491    HA3  GLY  61           HA1      GLY  61  -1.667  10.094  -7.633
  492    H    GLU  62           HN       GLU  62  -3.207  10.983  -5.549
  493    HA   GLU  62           HA       GLU  62  -3.682   8.976  -3.526
  494    HB2  GLU  62           HB2      GLU  62  -4.326  11.390  -3.321
  495    HB3  GLU  62           HB1      GLU  62  -5.587  11.113  -4.521
  496    HG2  GLU  62           HG2      GLU  62  -6.670   9.472  -3.083
  497    HG3  GLU  62           HG1      GLU  62  -5.353   9.580  -1.912
  498    H    GLU  63           HN       GLU  63  -5.087   9.598  -6.724
  499    HA   GLU  63           HA       GLU  63  -7.252   7.694  -6.413
  500    HB2  GLU  63           HB2      GLU  63  -6.011   9.146  -8.754
  501    HB3  GLU  63           HB1      GLU  63  -7.191   7.872  -9.053
  502    HG2  GLU  63           HG2      GLU  63  -7.728  10.217  -7.197
  503    HG3  GLU  63           HG1      GLU  63  -8.154  10.223  -8.908
  504    H    LYS  64           HN       LYS  64  -4.158   7.484  -8.233
  505    HA   LYS  64           HA       LYS  64  -4.541   4.715  -8.913
  506    HB2  LYS  64           HB2      LYS  64  -2.121   6.525  -8.852
  507    HB3  LYS  64           HB1      LYS  64  -1.971   4.827  -9.289
  508    HG2  LYS  64           HG2      LYS  64  -2.225   6.301 -11.273
  509    HG3  LYS  64           HG1      LYS  64  -3.525   5.120 -11.144
  510    HD2  LYS  64           HD2      LYS  64  -5.085   6.754 -10.368
  511    HD3  LYS  64           HD1      LYS  64  -3.811   7.925 -10.025
  512    HE2  LYS  64           HE2      LYS  64  -4.586   6.928 -12.786
  513    HE3  LYS  64           HE1      LYS  64  -5.025   8.495 -12.104
  514    HZ1  LYS  64           HZ1      LYS  64  -2.533   7.624 -13.239
  515    HZ2  LYS  64           HZ2      LYS  64  -2.348   8.397 -11.737
  516    HZ3  LYS  64           HZ3      LYS  64  -3.131   9.194 -13.017
  517    H    ALA  65           HN       ALA  65  -2.888   6.314  -6.188
  518    HA   ALA  65           HA       ALA  65  -1.582   4.079  -5.085
  519    HB1  ALA  65           HB1      ALA  65  -1.241   6.269  -4.132
  520    HB2  ALA  65           HB2      ALA  65  -1.901   5.231  -2.868
  521    HB3  ALA  65           HB3      ALA  65  -2.943   6.393  -3.689
  522    H    TRP  66           HN       TRP  66  -4.946   5.158  -4.455
  523    HA   TRP  66           HA       TRP  66  -5.603   3.036  -2.673
  524    HB2  TRP  66           HB2      TRP  66  -7.116   5.006  -4.337
  525    HB3  TRP  66           HB1      TRP  66  -8.029   3.565  -3.905
  526    HD1  TRP  66           HD1      TRP  66  -6.605   6.749  -2.463
  527    HE1  TRP  66           HE1      TRP  66  -7.322   6.966   0.004
  528    HE3  TRP  66           HE3      TRP  66  -8.593   2.110  -1.722
  529    HZ2  TRP  66           HZ2      TRP  66  -8.574   5.379   2.026
  530    HZ3  TRP  66           HZ3      TRP  66  -9.548   1.484   0.500
  531    HH2  TRP  66           HH2      TRP  66  -9.535   3.117   2.362
  532    H    ALA  67           HN       ALA  67  -6.003   3.231  -6.229
  533    HA   ALA  67           HA       ALA  67  -7.172   0.689  -6.619
  534    HB1  ALA  67           HB1      ALA  67  -6.887   2.380  -8.416
  535    HB2  ALA  67           HB2      ALA  67  -6.269   0.800  -8.902
  536    HB3  ALA  67           HB3      ALA  67  -5.150   2.072  -8.411
  537    H    MET  68           HN       MET  68  -3.781   1.578  -6.152
  538    HA   MET  68           HA       MET  68  -2.768  -1.116  -6.663
  539    HB2  MET  68           HB2      MET  68  -1.566   1.380  -5.433
  540    HB3  MET  68           HB1      MET  68  -0.663  -0.126  -5.555
  541    HG2  MET  68           HG2      MET  68  -1.987   0.995  -8.035
  542    HG3  MET  68           HG1      MET  68  -0.457   1.674  -7.489
  543    HE1  MET  68           HE1      MET  68   2.168  -0.885  -8.030
  544    HE2  MET  68           HE2      MET  68   1.523   0.046  -6.680
  545    HE3  MET  68           HE3      MET  68   1.727   0.814  -8.253
  546    H    ALA  69           HN       ALA  69  -3.773   0.746  -3.838
  547    HA   ALA  69           HA       ALA  69  -2.752  -1.064  -1.851
  548    HB1  ALA  69           HB1      ALA  69  -5.162   0.768  -1.617
  549    HB2  ALA  69           HB2      ALA  69  -3.495   1.312  -1.434
  550    HB3  ALA  69           HB3      ALA  69  -4.171   0.148  -0.296
  551    H    VAL  70           HN       VAL  70  -5.847  -0.877  -3.586
  552    HA   VAL  70           HA       VAL  70  -7.080  -3.027  -2.029
  553    HB   VAL  70           HB       VAL  70  -7.838  -1.882  -4.739
  554   HG11  VAL  70          HG11      VAL  70 -10.123  -2.778  -4.056
  555   HG12  VAL  70          HG12      VAL  70  -9.316  -3.637  -2.744
  556   HG13  VAL  70          HG13      VAL  70  -8.928  -4.022  -4.421
  557   HG21  VAL  70          HG21      VAL  70  -9.403  -0.487  -3.461
  558   HG22  VAL  70          HG22      VAL  70  -7.762  -0.213  -2.874
  559   HG23  VAL  70          HG23      VAL  70  -8.869  -1.230  -1.953
  560    H    TRP  71           HN       TRP  71  -5.919  -2.868  -5.424
  561    HA   TRP  71           HA       TRP  71  -6.303  -5.585  -6.028
  562    HB2  TRP  71           HB2      TRP  71  -5.695  -3.854  -7.716
  563    HB3  TRP  71           HB1      TRP  71  -4.058  -3.813  -7.063
  564    HD1  TRP  71           HD1      TRP  71  -6.394  -5.918  -9.176
  565    HE1  TRP  71           HE1      TRP  71  -5.063  -7.858 -10.233
  566    HE3  TRP  71           HE3      TRP  71  -1.969  -5.405  -6.692
  567    HZ2  TRP  71           HZ2      TRP  71  -2.459  -9.034 -10.046
  568    HZ3  TRP  71           HZ3      TRP  71  -0.081  -6.940  -7.144
  569    HH2  TRP  71           HH2      TRP  71  -0.319  -8.755  -8.819
  570    H    ILE  72           HN       ILE  72  -3.682  -4.112  -4.144
  571    HA   ILE  72           HA       ILE  72  -1.996  -6.502  -4.296
  572    HB   ILE  72           HB       ILE  72  -1.937  -4.021  -2.542
  573   HG12  ILE  72          HG12      ILE  72   0.092  -5.161  -4.498
  574   HG13  ILE  72          HG11      ILE  72  -1.140  -3.994  -4.957
  575   HG21  ILE  72          HG21      ILE  72  -1.142  -5.721  -1.037
  576   HG22  ILE  72          HG22      ILE  72   0.295  -4.947  -1.692
  577   HG23  ILE  72          HG23      ILE  72  -0.220  -6.513  -2.313
  578   HD11  ILE  72          HD11      ILE  72  -0.200  -2.301  -3.549
  579   HD12  ILE  72          HD12      ILE  72   1.152  -3.028  -4.411
  580   HD13  ILE  72          HD13      ILE  72   0.846  -3.462  -2.731
  581    H    PHE  73           HN       PHE  73  -4.408  -5.348  -1.845
  582    HA   PHE  73           HA       PHE  73  -3.901  -7.411   0.043
  583    HB2  PHE  73           HB2      PHE  73  -6.681  -6.383  -0.577
  584    HB3  PHE  73           HB1      PHE  73  -6.068  -6.972   0.962
  585    HD1  PHE  73           HD1      PHE  73  -3.366  -5.411   0.957
  586    HD2  PHE  73           HD2      PHE  73  -7.415  -4.212   0.089
  587    HE1  PHE  73           HE1      PHE  73  -2.831  -3.100   1.616
  588    HE2  PHE  73           HE2      PHE  73  -6.856  -1.897   0.753
  589    HZ   PHE  73           HZ       PHE  73  -4.571  -1.342   1.521
  590    H    ALA  74           HN       ALA  74  -6.155  -7.457  -2.753
  591    HA   ALA  74           HA       ALA  74  -7.126 -10.097  -2.304
  592    HB1  ALA  74           HB1      ALA  74  -8.141  -8.541  -3.942
  593    HB2  ALA  74           HB2      ALA  74  -7.718 -10.074  -4.707
  594    HB3  ALA  74           HB3      ALA  74  -6.695  -8.658  -4.947
  595    H    ALA  75           HN       ALA  75  -4.110  -8.939  -3.678
  596    HA   ALA  75           HA       ALA  75  -3.349 -11.372  -4.996
  597    HB1  ALA  75           HB1      ALA  75  -1.461  -9.356  -3.736
  598    HB2  ALA  75           HB2      ALA  75  -2.264  -9.086  -5.282
  599    HB3  ALA  75           HB3      ALA  75  -1.134 -10.428  -5.098
  600    H    ILE  76           HN       ILE  76  -2.643 -10.132  -1.716
  601    HA   ILE  76           HA       ILE  76  -1.324 -12.676  -0.982
  602    HB   ILE  76           HB       ILE  76  -1.136 -11.543   1.297
  603   HG12  ILE  76          HG12      ILE  76  -2.262  -9.169  -0.242
  604   HG13  ILE  76          HG11      ILE  76  -3.123 -10.062   1.010
  605   HG21  ILE  76          HG21      ILE  76   0.643 -11.443  -0.468
  606   HG22  ILE  76          HG22      ILE  76   0.626 -10.022   0.568
  607   HG23  ILE  76          HG23      ILE  76  -0.063  -9.938  -1.054
  608   HD11  ILE  76          HD11      ILE  76  -1.185  -9.505   2.573
  609   HD12  ILE  76          HD12      ILE  76  -2.178  -8.135   2.080
  610   HD13  ILE  76          HD13      ILE  76  -0.609  -8.399   1.324
  611    H    ASN  77           HN       ASN  77  -4.323 -12.326  -1.631
  612    HA   ASN  77           HA       ASN  77  -6.322 -13.282  -0.912
  613    HB2  ASN  77           HB2      ASN  77  -4.693 -15.261  -0.682
  614    HB3  ASN  77           HB1      ASN  77  -4.625 -14.885   1.039
  615   HD21  ASN  77          HD21      ASN  77  -6.772 -14.924   2.228
  616   HD22  ASN  77          HD22      ASN  77  -7.988 -15.969   1.670
  617    H    ARG  78           HN       ARG  78  -6.829 -11.158   0.047
  618    HA   ARG  78           HA       ARG  78  -7.512 -11.446   2.901
  619    HB2  ARG  78           HB2      ARG  78  -5.647  -9.267   1.891
  620    HB3  ARG  78           HB1      ARG  78  -6.545  -9.130   3.403
  621    HG2  ARG  78           HG2      ARG  78  -5.482 -11.349   4.090
  622    HG3  ARG  78           HG1      ARG  78  -4.425 -11.181   2.693
  623    HD2  ARG  78           HD2      ARG  78  -3.858  -8.838   3.641
  624    HD3  ARG  78           HD1      ARG  78  -4.592  -9.398   5.139
  625    HE   ARG  78           HE       ARG  78  -1.955 -10.011   4.180
  626   HH11  ARG  78          HH21      ARG  78  -4.672 -11.538   5.674
  627   HH12  ARG  78          HH22      ARG  78  -3.767 -12.923   6.178
  628   HH21  ARG  78          HH11      ARG  78  -0.778 -11.791   4.853
  629   HH22  ARG  78          HH12      ARG  78  -1.568 -13.063   5.723
  630    H    ARG  79           HN       ARG  79  -8.968 -11.344   0.423
  631    HA   ARG  79           HA       ARG  79 -10.054  -8.900  -0.357
  632    HB2  ARG  79           HB2      ARG  79 -11.569 -11.488   0.094
  633    HB3  ARG  79           HB1      ARG  79 -12.119 -10.138  -0.900
  634    HG2  ARG  79           HG2      ARG  79 -10.218 -10.405  -2.398
  635    HG3  ARG  79           HG1      ARG  79  -9.542 -11.665  -1.366
  636    HD2  ARG  79           HD2      ARG  79 -10.761 -12.589  -3.342
  637    HD3  ARG  79           HD1      ARG  79 -11.450 -13.113  -1.805
  638    HE   ARG  79           HE       ARG  79 -12.892 -10.825  -2.444
  639   HH11  ARG  79          HH21      ARG  79 -12.122 -13.815  -3.993
  640   HH12  ARG  79          HH22      ARG  79 -13.591 -13.867  -4.910
  641   HH21  ARG  79          HH11      ARG  79 -14.809 -10.883  -3.633
  642   HH22  ARG  79          HH12      ARG  79 -15.110 -12.208  -4.706
  643    H    ASP  80           HN       ASP  80 -10.612 -10.617   2.663
  644    HA   ASP  80           HA       ASP  80 -12.979  -9.307   3.523
  645    HB2  ASP  80           HB2      ASP  80 -11.847 -11.221   4.709
  646    HB3  ASP  80           HB1      ASP  80 -10.620 -10.085   5.272
  647    H    LEU  81           HN       LEU  81  -9.663  -8.190   3.360
  648    HA   LEU  81           HA       LEU  81 -10.041  -5.868   5.045
  649    HB2  LEU  81           HB2      LEU  81  -7.804  -6.747   4.715
  650    HB3  LEU  81           HB1      LEU  81  -7.918  -6.545   2.974
  651    HG   LEU  81           HG       LEU  81  -7.991  -4.106   3.227
  652   HD11  LEU  81          HD11      LEU  81  -8.077  -4.779   6.182
  653   HD12  LEU  81          HD12      LEU  81  -9.136  -3.703   5.268
  654   HD13  LEU  81          HD13      LEU  81  -7.486  -3.216   5.620
  655   HD21  LEU  81          HD21      LEU  81  -5.710  -3.787   4.044
  656   HD22  LEU  81          HD22      LEU  81  -5.801  -5.298   3.142
  657   HD23  LEU  81          HD23      LEU  81  -5.776  -5.324   4.905
  658    H    TYR  82           HN       TYR  82 -10.686  -6.571   1.656
  659    HA   TYR  82           HA       TYR  82 -10.829  -3.795   0.821
  660    HB2  TYR  82           HB2      TYR  82 -10.523  -5.297  -0.980
  661    HB3  TYR  82           HB1      TYR  82 -11.693  -6.442  -0.344
  662    HD1  TYR  82           HD2      TYR  82 -12.117  -2.743  -0.847
  663    HD2  TYR  82           HD1      TYR  82 -13.243  -6.686  -2.150
  664    HE1  TYR  82           HE2      TYR  82 -13.857  -1.768  -2.308
  665    HE2  TYR  82           HE1      TYR  82 -14.982  -5.700  -3.610
  666    HH   TYR  82           HH       TYR  82 -16.345  -3.200  -3.416
  667    H    GLU  83           HN       GLU  83 -13.112  -6.138   2.175
  668    HA   GLU  83           HA       GLU  83 -15.478  -4.569   1.725
  669    HB2  GLU  83           HB2      GLU  83 -14.858  -6.670   3.827
  670    HB3  GLU  83           HB1      GLU  83 -16.460  -5.990   3.544
  671    HG2  GLU  83           HG2      GLU  83 -16.378  -6.778   1.202
  672    HG3  GLU  83           HG1      GLU  83 -14.785  -7.475   1.497
  673    H    LYS  84           HN       LYS  84 -13.237  -4.801   4.497
  674    HA   LYS  84           HA       LYS  84 -14.683  -2.813   6.059
  675    HB2  LYS  84           HB2      LYS  84 -11.844  -3.848   6.334
  676    HB3  LYS  84           HB1      LYS  84 -12.711  -2.898   7.541
  677    HG2  LYS  84           HG2      LYS  84 -14.440  -4.672   7.675
  678    HG3  LYS  84           HG1      LYS  84 -13.525  -5.632   6.512
  679    HD2  LYS  84           HD2      LYS  84 -11.607  -5.698   8.047
  680    HD3  LYS  84           HD1      LYS  84 -12.490  -4.704   9.207
  681    HE2  LYS  84           HE2      LYS  84 -14.220  -6.453   9.396
  682    HE3  LYS  84           HE1      LYS  84 -13.339  -7.450   8.238
  683    HZ1  LYS  84           HZ1      LYS  84 -12.286  -6.514  10.852
  684    HZ2  LYS  84           HZ2      LYS  84 -11.463  -7.502   9.741
  685    HZ3  LYS  84           HZ3      LYS  84 -12.855  -8.078  10.527
  686    H    ALA  85           HN       ALA  85 -11.884  -2.768   3.880
  687    HA   ALA  85           HA       ALA  85 -10.964  -0.147   4.419
  688    HB1  ALA  85           HB1      ALA  85 -10.000  -0.202   2.153
  689    HB2  ALA  85           HB2      ALA  85 -11.016  -1.585   1.750
  690    HB3  ALA  85           HB3      ALA  85  -9.752  -1.745   2.970
  691    H    LYS  86           HN       LYS  86 -13.640  -1.259   2.403
  692    HA   LYS  86           HA       LYS  86 -14.148   1.323   1.195
  693    HB2  LYS  86           HB2      LYS  86 -14.984  -0.815   0.204
  694    HB3  LYS  86           HB1      LYS  86 -16.080  -1.002   1.575
  695    HG2  LYS  86           HG2      LYS  86 -17.292   0.995   0.992
  696    HG3  LYS  86           HG1      LYS  86 -16.087   1.450  -0.211
  697    HD2  LYS  86           HD2      LYS  86 -18.021   0.495  -1.344
  698    HD3  LYS  86           HD1      LYS  86 -16.652  -0.600  -1.515
  699    HE2  LYS  86           HE2      LYS  86 -17.539  -2.134   0.073
  700    HE3  LYS  86           HE1      LYS  86 -18.667  -0.943   0.724
  701    HZ1  LYS  86           HZ1      LYS  86 -19.849  -0.963  -1.378
  702    HZ2  LYS  86           HZ2      LYS  86 -19.783  -2.524  -0.713
  703    HZ3  LYS  86           HZ3      LYS  86 -18.765  -2.105  -2.006
  704    H    ARG  87           HN       ARG  87 -15.079  -0.150   4.256
  705    HA   ARG  87           HA       ARG  87 -17.183   1.842   4.779
  706    HB2  ARG  87           HB2      ARG  87 -15.882  -0.238   6.564
  707    HB3  ARG  87           HB1      ARG  87 -17.253   0.771   7.026
  708    HG2  ARG  87           HG2      ARG  87 -18.547  -0.145   5.116
  709    HG3  ARG  87           HG1      ARG  87 -17.185  -1.192   4.715
  710    HD2  ARG  87           HD2      ARG  87 -17.347  -2.277   6.913
  711    HD3  ARG  87           HD1      ARG  87 -18.680  -1.209   7.355
  712    HE   ARG  87           HE       ARG  87 -19.535  -2.413   5.002
  713   HH11  ARG  87          HH21      ARG  87 -18.348  -3.474   8.069
  714   HH12  ARG  87          HH22      ARG  87 -19.258  -4.948   8.056
  715   HH21  ARG  87          HH11      ARG  87 -20.724  -4.331   4.976
  716   HH22  ARG  87          HH12      ARG  87 -20.601  -5.433   6.307
  717    H    ASP  88           HN       ASP  88 -13.765   1.405   5.543
  718    HA   ASP  88           HA       ASP  88 -13.791   3.721   7.417
  719    HB2  ASP  88           HB2      ASP  88 -11.600   1.813   6.522
  720    HB3  ASP  88           HB1      ASP  88 -11.334   3.150   7.641
  721    H    GLU  89           HN       GLU  89 -13.633   3.269   4.117
  722    HA   GLU  89           HA       GLU  89 -11.496   4.880   3.267
  723    HB2  GLU  89           HB2      GLU  89 -12.561   4.980   1.154
  724    HB3  GLU  89           HB1      GLU  89 -13.180   3.500   1.876
  725    HG2  GLU  89           HG2      GLU  89 -15.191   4.905   2.669
  726    HG3  GLU  89           HG1      GLU  89 -14.592   6.174   1.602
  727    HA   PRO  90           HA       PRO  90 -12.954   8.735   5.184
  728    HB2  PRO  90           HB2      PRO  90 -11.100  10.418   3.733
  729    HB3  PRO  90           HB1      PRO  90 -10.942   9.849   5.402
  730    HG2  PRO  90           HG2      PRO  90  -9.460   8.941   3.043
  731    HG3  PRO  90           HG1      PRO  90  -9.203   8.489   4.735
  732    HD2  PRO  90           HD2      PRO  90 -10.364   6.850   2.662
  733    HD3  PRO  90           HD1      PRO  90 -10.208   6.447   4.389
  734    H    LYS  91           HN       LYS  91 -14.219  10.561   4.440
  735    HA   LYS  91           HA       LYS  91 -14.505  11.204   1.636
  736    HB2  LYS  91           HB2      LYS  91 -15.654   8.978   1.709
  737    HB3  LYS  91           HB1      LYS  91 -16.775   9.634   2.901
  738    HG2  LYS  91           HG2      LYS  91 -17.574  11.296   1.317
  739    HG3  LYS  91           HG1      LYS  91 -16.357  10.809   0.136
  740    HD2  LYS  91           HD2      LYS  91 -17.369   8.558   0.021
  741    HD3  LYS  91           HD1      LYS  91 -18.595   9.053   1.190
  742    HE2  LYS  91           HE2      LYS  91 -18.156  10.220  -1.574
  743    HE3  LYS  91           HE1      LYS  91 -19.532   9.253  -1.044
  744    HZ1  LYS  91           HZ1      LYS  91 -20.435  11.257  -0.659
  745    HZ2  LYS  91           HZ2      LYS  91 -18.934  12.047  -0.558
  746    HZ3  LYS  91           HZ3      LYS  91 -19.541  11.194   0.780
  Start of MODEL   14
    1    H1   MET   1           HT1      MET   1  -7.428  18.463   9.634
    2    H2   MET   1           HT2      MET   1  -8.926  19.142  10.056
    3    H3   MET   1           HT3      MET   1  -8.844  17.538   9.500
    4    HA   MET   1           HA       MET   1  -7.441  18.409  11.953
    5    HB2  MET   1           HB2      MET   1  -9.381  17.544  13.219
    6    HB3  MET   1           HB1      MET   1  -9.835  18.928  12.226
    7    HG2  MET   1           HG2      MET   1 -10.581  17.272  10.446
    8    HG3  MET   1           HG1      MET   1 -10.353  16.000  11.645
    9    HE1  MET   1           HE1      MET   1 -11.210  16.028  13.886
   10    HE2  MET   1           HE2      MET   1 -12.806  16.590  14.370
   11    HE3  MET   1           HE3      MET   1 -11.432  17.688  14.453
   12    H    ALA   2           HN       ALA   2  -7.719  16.273   9.463
   13    HA   ALA   2           HA       ALA   2  -6.259  14.193  10.882
   14    HB1  ALA   2           HB1      ALA   2  -9.053  13.557   9.878
   15    HB2  ALA   2           HB2      ALA   2  -8.577  13.646  11.575
   16    HB3  ALA   2           HB3      ALA   2  -7.902  12.393  10.534
   17    H    SER   3           HN       SER   3  -4.722  14.361   9.237
   18    HA   SER   3           HA       SER   3  -5.446  14.351   6.416
   19    HB2  SER   3           HB2      SER   3  -3.301  15.332   7.434
   20    HB3  SER   3           HB1      SER   3  -2.729  13.674   7.607
   21    HG   SER   3           HG       SER   3  -3.640  13.833   5.176
   22    H    THR   4           HN       THR   4  -5.347  12.611   4.973
   23    HA   THR   4           HA       THR   4  -5.869   9.984   6.069
   24    HB   THR   4           HB       THR   4  -5.120  10.636   3.194
   25    HG1  THR   4           HG1      THR   4  -7.769  10.460   3.911
   26   HG21  THR   4          HG21      THR   4  -6.788   8.447   4.471
   27   HG22  THR   4          HG22      THR   4  -5.228   8.251   3.669
   28   HG23  THR   4          HG23      THR   4  -6.647   8.714   2.733
   29    H    ARG   5           HN       ARG   5  -3.003  11.701   5.397
   30    HA   ARG   5           HA       ARG   5  -1.222   9.654   4.583
   31    HB2  ARG   5           HB2      ARG   5  -0.649  12.080   4.709
   32    HB3  ARG   5           HB1      ARG   5  -0.625  11.955   6.469
   33    HG2  ARG   5           HG2      ARG   5   1.206  10.372   6.400
   34    HG3  ARG   5           HG1      ARG   5   1.107  10.264   4.641
   35    HD2  ARG   5           HD2      ARG   5   2.955  11.763   5.465
   36    HD3  ARG   5           HD1      ARG   5   1.808  12.565   4.392
   37    HE   ARG   5           HE       ARG   5   0.797  13.039   6.938
   38   HH11  ARG   5          HH21      ARG   5   3.809  13.503   5.311
   39   HH12  ARG   5          HH22      ARG   5   4.238  14.904   6.235
   40   HH21  ARG   5          HH11      ARG   5   1.347  14.863   8.147
   41   HH22  ARG   5          HH12      ARG   5   2.847  15.672   7.838
   42    H    CYS   6           HN       CYS   6  -2.117  10.682   7.894
   43    HA   CYS   6           HA       CYS   6  -0.511   8.644   9.170
   44    HB2  CYS   6           HB2      CYS   6  -1.869   9.216  11.198
   45    HB3  CYS   6           HB1      CYS   6  -1.155  10.628  10.418
   46    HG   CYS   6           HG       CYS   6  -3.662  11.205  10.791
   47    H    LYS   7           HN       LYS   7  -3.817   8.769   7.953
   48    HA   LYS   7           HA       LYS   7  -4.736   6.391   9.299
   49    HB2  LYS   7           HB2      LYS   7  -5.683   7.683   6.723
   50    HB3  LYS   7           HB1      LYS   7  -6.540   6.404   7.584
   51    HG2  LYS   7           HG2      LYS   7  -6.608   7.886   9.608
   52    HG3  LYS   7           HG1      LYS   7  -5.901   9.177   8.635
   53    HD2  LYS   7           HD2      LYS   7  -7.821   8.982   7.051
   54    HD3  LYS   7           HD1      LYS   7  -8.546   7.784   8.123
   55    HE2  LYS   7           HE2      LYS   7  -8.573   9.449   9.956
   56    HE3  LYS   7           HE1      LYS   7  -7.872  10.648   8.870
   57    HZ1  LYS   7           HZ1      LYS   7 -10.259  10.894   8.980
   58    HZ2  LYS   7           HZ2      LYS   7 -10.482   9.277   8.510
   59    HZ3  LYS   7           HZ3      LYS   7  -9.804  10.393   7.424
   60    H    LEU   8           HN       LEU   8  -3.403   6.934   6.020
   61    HA   LEU   8           HA       LEU   8  -3.614   4.214   5.159
   62    HB2  LEU   8           HB2      LEU   8  -3.010   6.317   3.769
   63    HB3  LEU   8           HB1      LEU   8  -1.364   6.079   4.342
   64    HG   LEU   8           HG       LEU   8  -1.766   3.565   3.480
   65   HD11  LEU   8          HD11      LEU   8  -4.124   3.865   2.849
   66   HD12  LEU   8          HD12      LEU   8  -3.150   3.547   1.418
   67   HD13  LEU   8          HD13      LEU   8  -3.685   5.188   1.771
   68   HD21  LEU   8          HD21      LEU   8  -0.039   5.078   2.593
   69   HD22  LEU   8          HD22      LEU   8  -1.247   5.897   1.603
   70   HD23  LEU   8          HD23      LEU   8  -0.833   4.214   1.277
   71    H    ALA   9           HN       ALA   9  -1.098   5.880   7.020
   72    HA   ALA   9           HA       ALA   9   0.767   3.678   6.995
   73    HB1  ALA   9           HB1      ALA   9   1.506   5.941   7.583
   74    HB2  ALA   9           HB2      ALA   9   1.807   4.844   8.933
   75    HB3  ALA   9           HB3      ALA   9   0.431   5.945   8.982
   76    H    ARG  10           HN       ARG  10  -1.954   4.588   9.018
   77    HA   ARG  10           HA       ARG  10  -1.496   2.816  11.180
   78    HB2  ARG  10           HB2      ARG  10  -3.288   4.680  10.898
   79    HB3  ARG  10           HB1      ARG  10  -4.267   3.446  10.110
   80    HG2  ARG  10           HG2      ARG  10  -3.895   2.003  12.179
   81    HG3  ARG  10           HG1      ARG  10  -3.198   3.426  12.949
   82    HD2  ARG  10           HD2      ARG  10  -5.497   4.552  12.102
   83    HD3  ARG  10           HD1      ARG  10  -6.068   2.890  12.223
   84    HE   ARG  10           HE       ARG  10  -5.688   4.674  14.399
   85   HH11  ARG  10          HH21      ARG  10  -4.875   1.439  13.502
   86   HH12  ARG  10          HH22      ARG  10  -4.527   0.947  15.121
   87   HH21  ARG  10          HH11      ARG  10  -5.261   4.033  16.506
   88   HH22  ARG  10          HH12      ARG  10  -4.753   2.407  16.819
   89    H    TYR  11           HN       TYR  11  -2.863   2.250   7.971
   90    HA   TYR  11           HA       TYR  11  -3.781  -0.458   8.610
   91    HB2  TYR  11           HB2      TYR  11  -3.457   1.074   6.010
   92    HB3  TYR  11           HB1      TYR  11  -3.968  -0.611   6.043
   93    HD1  TYR  11           HD2      TYR  11  -6.022  -1.248   7.405
   94    HD2  TYR  11           HD1      TYR  11  -5.043   2.818   6.452
   95    HE1  TYR  11           HE2      TYR  11  -8.364  -0.578   7.871
   96    HE2  TYR  11           HE1      TYR  11  -7.378   3.496   6.918
   97    HH   TYR  11           HH       TYR  11  -9.750   1.163   8.166
   98    H    LEU  12           HN       LEU  12  -1.080   0.798   6.579
   99    HA   LEU  12           HA       LEU  12   0.047  -1.806   6.150
  100    HB2  LEU  12           HB2      LEU  12   1.690   0.746   6.208
  101    HB3  LEU  12           HB1      LEU  12   1.974  -0.705   5.253
  102    HG   LEU  12           HG       LEU  12  -0.501   1.054   4.837
  103   HD11  LEU  12          HD11      LEU  12   0.693   2.053   2.946
  104   HD12  LEU  12          HD12      LEU  12   2.133   1.108   3.321
  105   HD13  LEU  12          HD13      LEU  12   1.584   2.357   4.437
  106   HD21  LEU  12          HD21      LEU  12   0.847  -1.152   3.222
  107   HD22  LEU  12          HD22      LEU  12  -0.373  -0.075   2.546
  108   HD23  LEU  12          HD23      LEU  12  -0.792  -1.149   3.872
  109    H    GLU  13           HN       GLU  13   0.243   0.415   8.802
  110    HA   GLU  13           HA       GLU  13   2.566  -0.903  10.037
  111    HB2  GLU  13           HB2      GLU  13   1.973   1.545  10.359
  112    HB3  GLU  13           HB1      GLU  13   0.585   1.025  11.312
  113    HG2  GLU  13           HG2      GLU  13   3.419   0.152  11.978
  114    HG3  GLU  13           HG1      GLU  13   2.721   1.638  12.614
  115    H    ASP  14           HN       ASP  14  -0.921  -1.191  10.111
  116    HA   ASP  14           HA       ASP  14  -1.040  -2.712  12.588
  117    HB2  ASP  14           HB2      ASP  14  -2.994  -1.482  11.705
  118    HB3  ASP  14           HB1      ASP  14  -3.043  -2.560  10.310
  119    H    LEU  15           HN       LEU  15   0.279  -3.551   9.608
  120    HA   LEU  15           HA       LEU  15  -0.664  -6.377   9.660
  121    HB2  LEU  15           HB2      LEU  15   1.491  -5.131   7.924
  122    HB3  LEU  15           HB1      LEU  15   0.724  -6.697   7.691
  123    HG   LEU  15           HG       LEU  15  -0.554  -3.957   7.398
  124   HD11  LEU  15          HD11      LEU  15  -0.270  -6.260   5.444
  125   HD12  LEU  15          HD12      LEU  15   0.820  -4.878   5.501
  126   HD13  LEU  15          HD13      LEU  15  -0.880  -4.647   5.085
  127   HD21  LEU  15          HD21      LEU  15  -2.301  -5.237   8.395
  128   HD22  LEU  15          HD22      LEU  15  -1.827  -6.709   7.545
  129   HD23  LEU  15          HD23      LEU  15  -2.602  -5.392   6.667
  130    H    GLU  16           HN       GLU  16   0.914  -8.146   9.773
  131    HA   GLU  16           HA       GLU  16   2.624  -7.866  12.081
  132    HB2  GLU  16           HB2      GLU  16   1.406  -9.973  11.331
  133    HB3  GLU  16           HB1      GLU  16   2.624 -10.142  10.070
  134    HG2  GLU  16           HG2      GLU  16   4.396 -10.320  11.723
  135    HG3  GLU  16           HG1      GLU  16   3.270  -9.958  13.030
  136    H    ASP  17           HN       ASP  17   4.977  -8.365  12.064
  137    HA   ASP  17           HA       ASP  17   6.424  -6.684  10.278
  138    HB2  ASP  17           HB2      ASP  17   7.452  -8.991  11.954
  139    HB3  ASP  17           HB1      ASP  17   8.437  -7.704  11.258
  140    H    VAL  18           HN       VAL  18   6.118 -10.247  10.344
  141    HA   VAL  18           HA       VAL  18   7.793 -10.754   8.108
  142    HB   VAL  18           HB       VAL  18   6.945 -12.514   9.655
  143   HG11  VAL  18          HG11      VAL  18   4.686 -13.348   9.479
  144   HG12  VAL  18          HG12      VAL  18   4.339 -12.309   8.099
  145   HG13  VAL  18          HG13      VAL  18   4.567 -11.604   9.699
  146   HG21  VAL  18          HG21      VAL  18   7.829 -13.040   7.353
  147   HG22  VAL  18          HG22      VAL  18   6.168 -13.025   6.760
  148   HG23  VAL  18          HG23      VAL  18   6.669 -14.230   7.946
  149    H    ASP  19           HN       ASP  19   4.324  -9.934   8.249
  150    HA   ASP  19           HA       ASP  19   3.906 -10.317   5.407
  151    HB2  ASP  19           HB2      ASP  19   2.074 -10.351   7.120
  152    HB3  ASP  19           HB1      ASP  19   2.287  -8.612   7.321
  153    H    LEU  20           HN       LEU  20   4.998  -7.624   7.402
  154    HA   LEU  20           HA       LEU  20   4.556  -5.542   5.508
  155    HB2  LEU  20           HB2      LEU  20   6.257  -5.932   7.925
  156    HB3  LEU  20           HB1      LEU  20   6.830  -4.683   6.828
  157    HG   LEU  20           HG       LEU  20   3.924  -4.733   7.716
  158   HD11  LEU  20          HD11      LEU  20   5.152  -4.720   9.800
  159   HD12  LEU  20          HD12      LEU  20   4.592  -3.078   9.496
  160   HD13  LEU  20          HD13      LEU  20   6.276  -3.507   9.188
  161   HD21  LEU  20          HD21      LEU  20   5.813  -2.522   6.818
  162   HD22  LEU  20          HD22      LEU  20   4.135  -2.284   7.296
  163   HD23  LEU  20          HD23      LEU  20   4.512  -3.222   5.857
  164    H    LYS  21           HN       LYS  21   7.172  -7.896   5.849
  165    HA   LYS  21           HA       LYS  21   8.858  -6.703   3.811
  166    HB2  LYS  21           HB2      LYS  21   8.792  -9.568   4.807
  167    HB3  LYS  21           HB1      LYS  21  10.111  -8.802   3.921
  168    HG2  LYS  21           HG2      LYS  21  10.448  -7.204   5.747
  169    HG3  LYS  21           HG1      LYS  21   9.087  -7.901   6.629
  170    HD2  LYS  21           HD2      LYS  21  10.266 -10.077   6.713
  171    HD3  LYS  21           HD1      LYS  21  11.636  -9.358   5.865
  172    HE2  LYS  21           HE2      LYS  21  11.894  -7.719   7.711
  173    HE3  LYS  21           HE1      LYS  21  10.563  -8.496   8.568
  174    HZ1  LYS  21           HZ1      LYS  21  11.788 -10.434   8.868
  175    HZ2  LYS  21           HZ2      LYS  21  12.922  -9.201   9.155
  176    HZ3  LYS  21           HZ3      LYS  21  12.922 -10.032   7.673
  177    H    LYS  22           HN       LYS  22   6.467  -9.336   3.837
  178    HA   LYS  22           HA       LYS  22   6.835 -10.112   1.101
  179    HB2  LYS  22           HB2      LYS  22   5.411 -11.161   3.134
  180    HB3  LYS  22           HB1      LYS  22   4.086 -10.311   2.347
  181    HG2  LYS  22           HG2      LYS  22   4.674 -11.448   0.204
  182    HG3  LYS  22           HG1      LYS  22   5.921 -12.358   1.047
  183    HD2  LYS  22           HD2      LYS  22   3.032 -12.422   1.987
  184    HD3  LYS  22           HD1      LYS  22   3.594 -13.496   0.711
  185    HE2  LYS  22           HE2      LYS  22   4.686 -13.353   3.541
  186    HE3  LYS  22           HE1      LYS  22   3.726 -14.654   2.847
  187    HZ1  LYS  22           HZ1      LYS  22   5.883 -14.216   1.147
  188    HZ2  LYS  22           HZ2      LYS  22   5.585 -15.571   2.129
  189    HZ3  LYS  22           HZ3      LYS  22   6.507 -14.274   2.723
  190    H    PHE  23           HN       PHE  23   4.488  -7.861   2.583
  191    HA   PHE  23           HA       PHE  23   3.159  -7.055   0.196
  192    HB2  PHE  23           HB2      PHE  23   2.519  -6.467   2.582
  193    HB3  PHE  23           HB1      PHE  23   3.805  -5.266   2.566
  194    HD1  PHE  23           HD1      PHE  23   3.761  -3.422   0.806
  195    HD2  PHE  23           HD2      PHE  23   0.392  -5.979   1.584
  196    HE1  PHE  23           HE1      PHE  23   2.266  -1.795  -0.311
  197    HE2  PHE  23           HE2      PHE  23  -1.100  -4.346   0.462
  198    HZ   PHE  23           HZ       PHE  23  -0.163  -2.254  -0.483
  199    H    LYS  24           HN       LYS  24   6.194  -5.912   1.646
  200    HA   LYS  24           HA       LYS  24   6.577  -3.752  -0.242
  201    HB2  LYS  24           HB2      LYS  24   7.667  -3.775   1.961
  202    HB3  LYS  24           HB1      LYS  24   8.550  -5.235   1.529
  203    HG2  LYS  24           HG2      LYS  24   8.889  -2.955  -0.394
  204    HG3  LYS  24           HG1      LYS  24   9.556  -2.672   1.207
  205    HD2  LYS  24           HD2      LYS  24  10.850  -4.789   1.033
  206    HD3  LYS  24           HD1      LYS  24  10.227  -5.019  -0.599
  207    HE2  LYS  24           HE2      LYS  24  11.257  -2.928  -1.328
  208    HE3  LYS  24           HE1      LYS  24  11.810  -2.602   0.315
  209    HZ1  LYS  24           HZ1      LYS  24  13.656  -3.645  -0.356
  210    HZ2  LYS  24           HZ2      LYS  24  12.889  -4.396  -1.673
  211    HZ3  LYS  24           HZ3      LYS  24  12.768  -5.071  -0.119
  212    H    MET  25           HN       MET  25   7.729  -7.110  -0.034
  213    HA   MET  25           HA       MET  25   9.503  -7.039  -2.240
  214    HB2  MET  25           HB2      MET  25   9.306  -8.934  -0.624
  215    HB3  MET  25           HB1      MET  25   7.778  -9.381  -1.379
  216    HG2  MET  25           HG2      MET  25   8.882  -9.778  -3.507
  217    HG3  MET  25           HG1      MET  25  10.410  -9.173  -2.868
  218    HE1  MET  25           HE1      MET  25  11.094 -12.951  -3.325
  219    HE2  MET  25           HE2      MET  25  11.496 -11.299  -3.790
  220    HE3  MET  25           HE3      MET  25   9.969 -12.007  -4.311
  221    H    HIS  26           HN       HIS  26   5.981  -7.675  -2.157
  222    HA   HIS  26           HA       HIS  26   5.819  -8.201  -5.022
  223    HB2  HIS  26           HB2      HIS  26   3.791  -7.554  -2.857
  224    HB3  HIS  26           HB1      HIS  26   3.284  -7.623  -4.545
  225    HD1  HIS  26           HD1      HIS  26   3.234  -9.925  -5.689
  226    HD2  HIS  26           HD2      HIS  26   4.601 -10.083  -1.758
  227    HE1  HIS  26           HE1      HIS  26   3.291 -12.375  -5.050
  228    H    LEU  27           HN       LEU  27   5.667  -5.266  -3.052
  229    HA   LEU  27           HA       LEU  27   4.598  -3.592  -5.175
  230    HB2  LEU  27           HB2      LEU  27   4.598  -3.068  -2.672
  231    HB3  LEU  27           HB1      LEU  27   6.308  -2.686  -2.839
  232    HG   LEU  27           HG       LEU  27   5.489  -1.091  -4.803
  233   HD11  LEU  27          HD11      LEU  27   3.240  -0.118  -4.317
  234   HD12  LEU  27          HD12      LEU  27   2.962  -1.397  -3.138
  235   HD13  LEU  27          HD13      LEU  27   3.137  -1.793  -4.846
  236   HD21  LEU  27          HD21      LEU  27   4.992  -0.450  -1.876
  237   HD22  LEU  27          HD22      LEU  27   5.155   0.745  -3.162
  238   HD23  LEU  27          HD23      LEU  27   6.524  -0.279  -2.732
  239    H    GLU  28           HN       GLU  28   7.939  -3.971  -3.902
  240    HA   GLU  28           HA       GLU  28   9.094  -2.302  -5.946
  241    HB2  GLU  28           HB2      GLU  28  11.249  -3.203  -5.182
  242    HB3  GLU  28           HB1      GLU  28  10.231  -2.790  -3.809
  243    HG2  GLU  28           HG2      GLU  28  11.057  -4.923  -3.210
  244    HG3  GLU  28           HG1      GLU  28   9.470  -5.289  -3.874
  245    H    ASP  29           HN       ASP  29   8.405  -5.757  -5.740
  246    HA   ASP  29           HA       ASP  29   9.888  -6.453  -8.141
  247    HB2  ASP  29           HB2      ASP  29   9.323  -8.087  -6.337
  248    HB3  ASP  29           HB1      ASP  29   7.624  -7.958  -6.798
  249    H    TYR  30           HN       TYR  30   7.469  -4.381  -8.009
  250    HA   TYR  30           HA       TYR  30   5.417  -5.357  -9.688
  251    HB2  TYR  30           HB2      TYR  30   5.323  -3.206  -8.470
  252    HB3  TYR  30           HB1      TYR  30   6.529  -2.544  -9.574
  253    HD1  TYR  30           HD2      TYR  30   3.065  -3.835  -9.290
  254    HD2  TYR  30           HD1      TYR  30   5.932  -1.899 -11.840
  255    HE1  TYR  30           HE2      TYR  30   1.260  -3.270 -10.894
  256    HE2  TYR  30           HE1      TYR  30   4.126  -1.333 -13.440
  257    HH   TYR  30           HH       TYR  30   1.004  -1.296 -12.748
  258    HA   PRO  31           HA       PRO  31   8.186  -5.679 -13.284
  259    HB2  PRO  31           HB2      PRO  31   6.205  -6.559 -15.130
  260    HB3  PRO  31           HB1      PRO  31   7.262  -7.600 -14.166
  261    HG2  PRO  31           HG2      PRO  31   4.379  -7.047 -13.784
  262    HG3  PRO  31           HG1      PRO  31   5.360  -8.346 -13.088
  263    HD2  PRO  31           HD2      PRO  31   4.435  -5.996 -11.727
  264    HD3  PRO  31           HD1      PRO  31   5.597  -7.193 -11.105
  265    HA   PRO  32           HA       PRO  32   7.079  -1.699 -15.093
  266    HB2  PRO  32           HB2      PRO  32   8.541  -1.907 -17.522
  267    HB3  PRO  32           HB1      PRO  32   9.173  -1.284 -15.990
  268    HG2  PRO  32           HG2      PRO  32   9.678  -3.923 -17.274
  269    HG3  PRO  32           HG1      PRO  32  10.648  -3.072 -16.059
  270    HD2  PRO  32           HD2      PRO  32   8.982  -5.308 -15.543
  271    HD3  PRO  32           HD1      PRO  32   9.625  -4.192 -14.316
  272    H    GLN  33           HN       GLN  33   5.645  -0.903 -16.757
  273    HA   GLN  33           HA       GLN  33   4.229  -3.036 -18.350
  274    HB2  GLN  33           HB2      GLN  33   3.227  -0.385 -17.259
  275    HB3  GLN  33           HB1      GLN  33   2.296  -1.455 -18.308
  276    HG2  GLN  33           HG2      GLN  33   2.547  -3.275 -16.631
  277    HG3  GLN  33           HG1      GLN  33   3.384  -2.147 -15.565
  278   HE21  GLN  33          HE21      GLN  33   1.626   0.145 -16.406
  279   HE22  GLN  33          HE22      GLN  33   0.135  -0.126 -15.643
  280    H    LYS  34           HN       LYS  34   5.317   0.367 -18.448
  281    HA   LYS  34           HA       LYS  34   6.072   0.109 -21.242
  282    HB2  LYS  34           HB2      LYS  34   4.455   2.012 -21.912
  283    HB3  LYS  34           HB1      LYS  34   3.765   0.406 -21.710
  284    HG2  LYS  34           HG2      LYS  34   2.985   0.967 -19.457
  285    HG3  LYS  34           HG1      LYS  34   3.764   2.538 -19.553
  286    HD2  LYS  34           HD2      LYS  34   1.599   3.171 -20.151
  287    HD3  LYS  34           HD1      LYS  34   2.217   2.789 -21.751
  288    HE2  LYS  34           HE2      LYS  34   0.659   0.874 -19.978
  289    HE3  LYS  34           HE1      LYS  34  -0.009   1.772 -21.338
  290    HZ1  LYS  34           HZ1      LYS  34   0.539  -0.369 -22.122
  291    HZ2  LYS  34           HZ2      LYS  34   2.081  -0.326 -21.408
  292    HZ3  LYS  34           HZ3      LYS  34   1.728   0.676 -22.733
  293    H    GLY  35           HN       GLY  35   8.000   0.750 -19.882
  294    HA2  GLY  35           HA2      GLY  35   9.622   2.442 -19.570
  295    HA3  GLY  35           HA1      GLY  35   8.445   3.634 -20.124
  296    H    CYS  36           HN       CYS  36   7.091   1.661 -17.757
  297    HA   CYS  36           HA       CYS  36   6.751   3.765 -15.876
  298    HB2  CYS  36           HB2      CYS  36   5.313   1.760 -15.917
  299    HB3  CYS  36           HB1      CYS  36   6.676   0.770 -15.396
  300    HG   CYS  36           HG       CYS  36   6.544   1.757 -13.072
  301    H    ILE  37           HN       ILE  37   7.784   4.141 -13.851
  302    HA   ILE  37           HA       ILE  37  10.638   3.287 -13.748
  303    HB   ILE  37           HB       ILE  37  10.520   5.627 -13.648
  304   HG12  ILE  37          HG12      ILE  37  10.353   4.971 -10.683
  305   HG13  ILE  37          HG11      ILE  37  11.765   4.575 -11.664
  306   HG21  ILE  37          HG21      ILE  37   8.139   5.928 -13.491
  307   HG22  ILE  37          HG22      ILE  37   8.879   6.843 -12.181
  308   HG23  ILE  37          HG23      ILE  37   8.105   5.300 -11.847
  309   HD11  ILE  37          HD11      ILE  37  11.910   6.806 -10.442
  310   HD12  ILE  37          HD12      ILE  37  10.604   7.376 -11.483
  311   HD13  ILE  37          HD13      ILE  37  12.149   6.905 -12.189
  312    HA   PRO  38           HA       PRO  38   8.869   0.573 -10.482
  313    HB2  PRO  38           HB2      PRO  38  11.448  -0.673 -10.005
  314    HB3  PRO  38           HB1      PRO  38  10.052  -1.371 -10.839
  315    HG2  PRO  38           HG2      PRO  38  12.538  -0.476 -12.032
  316    HG3  PRO  38           HG1      PRO  38  11.129  -1.156 -12.861
  317    HD2  PRO  38           HD2      PRO  38  12.010   1.626 -12.821
  318    HD3  PRO  38           HD1      PRO  38  10.649   0.922 -13.722
  319    H    LEU  39           HN       LEU  39   9.169   0.553  -8.149
  320    HA   LEU  39           HA       LEU  39  10.264   3.000  -7.099
  321    HB2  LEU  39           HB2      LEU  39   9.019   0.521  -5.920
  322    HB3  LEU  39           HB1      LEU  39   9.766   1.698  -4.844
  323    HG   LEU  39           HG       LEU  39   8.304   3.465  -5.721
  324   HD11  LEU  39          HD11      LEU  39   6.388   2.742  -7.236
  325   HD12  LEU  39          HD12      LEU  39   7.274   1.242  -7.510
  326   HD13  LEU  39          HD13      LEU  39   7.973   2.785  -8.001
  327   HD21  LEU  39          HD21      LEU  39   6.202   2.643  -4.779
  328   HD22  LEU  39          HD22      LEU  39   7.551   2.021  -3.828
  329   HD23  LEU  39          HD23      LEU  39   6.732   0.974  -4.986
  330    HA   PRO  40           HA       PRO  40  14.471   1.226  -6.937
  331    HB2  PRO  40           HB2      PRO  40  15.196   3.300  -4.945
  332    HB3  PRO  40           HB1      PRO  40  15.847   3.057  -6.573
  333    HG2  PRO  40           HG2      PRO  40  14.066   5.132  -5.791
  334    HG3  PRO  40           HG1      PRO  40  14.469   4.685  -7.456
  335    HD2  PRO  40           HD2      PRO  40  11.941   4.232  -6.026
  336    HD3  PRO  40           HD1      PRO  40  12.295   3.961  -7.748
  337    H    ARG  41           HN       ARG  41  15.179  -0.400  -5.610
  338    HA   ARG  41           HA       ARG  41  13.660  -1.171  -3.299
  339    HB2  ARG  41           HB2      ARG  41  15.063  -2.685  -4.813
  340    HB3  ARG  41           HB1      ARG  41  16.486  -2.079  -3.967
  341    HG2  ARG  41           HG2      ARG  41  15.346  -2.801  -1.792
  342    HG3  ARG  41           HG1      ARG  41  14.165  -3.636  -2.790
  343    HD2  ARG  41           HD2      ARG  41  17.135  -4.157  -2.608
  344    HD3  ARG  41           HD1      ARG  41  15.833  -5.267  -2.207
  345    HE   ARG  41           HE       ARG  41  17.057  -4.877  -4.791
  346   HH11  ARG  41          HH21      ARG  41  13.966  -5.355  -3.325
  347   HH12  ARG  41          HH22      ARG  41  13.208  -5.838  -4.804
  348   HH21  ARG  41          HH11      ARG  41  16.084  -5.516  -6.702
  349   HH22  ARG  41          HH12      ARG  41  14.403  -5.935  -6.708
  350    H    GLY  42           HN       GLY  42  16.695   0.619  -3.676
  351    HA2  GLY  42           HA2      GLY  42  17.444   0.557  -0.890
  352    HA3  GLY  42           HA1      GLY  42  18.007   1.770  -2.041
  353    H    GLN  43           HN       GLN  43  15.379   2.829  -2.726
  354    HA   GLN  43           HA       GLN  43  15.046   4.628  -0.460
  355    HB2  GLN  43           HB2      GLN  43  13.521   4.286  -3.067
  356    HB3  GLN  43           HB1      GLN  43  13.144   5.547  -1.893
  357    HG2  GLN  43           HG2      GLN  43  15.901   5.168  -3.111
  358    HG3  GLN  43           HG1      GLN  43  14.691   6.269  -3.767
  359   HE21  GLN  43          HE21      GLN  43  17.397   6.708  -2.279
  360   HE22  GLN  43          HE22      GLN  43  17.002   7.840  -1.078
  361    H    THR  44           HN       THR  44  12.940   2.161  -1.983
  362    HA   THR  44           HA       THR  44  10.816   2.441  -0.083
  363    HB   THR  44           HB       THR  44  11.604   0.055  -1.786
  364    HG1  THR  44           HG1      THR  44   9.439   1.671  -2.374
  365   HG21  THR  44          HG21      THR  44   9.151  -0.520  -1.531
  366   HG22  THR  44          HG22      THR  44   9.067   0.694  -0.256
  367   HG23  THR  44          HG23      THR  44  10.107  -0.717  -0.065
  368    H    GLU  45           HN       GLU  45  13.735   0.412  -0.105
  369    HA   GLU  45           HA       GLU  45  12.976  -1.176   2.177
  370    HB2  GLU  45           HB2      GLU  45  14.750  -1.926   0.655
  371    HB3  GLU  45           HB1      GLU  45  15.705  -0.491   1.003
  372    HG2  GLU  45           HG2      GLU  45  16.507  -2.501   2.228
  373    HG3  GLU  45           HG1      GLU  45  16.025  -1.207   3.316
  374    H    LYS  46           HN       LYS  46  14.888   1.852   1.811
  375    HA   LYS  46           HA       LYS  46  15.349   2.065   4.695
  376    HB2  LYS  46           HB2      LYS  46  16.898   3.003   2.942
  377    HB3  LYS  46           HB1      LYS  46  15.656   4.192   2.548
  378    HG2  LYS  46           HG2      LYS  46  15.741   5.113   4.791
  379    HG3  LYS  46           HG1      LYS  46  16.834   3.835   5.321
  380    HD2  LYS  46           HD2      LYS  46  18.537   4.633   3.712
  381    HD3  LYS  46           HD1      LYS  46  17.447   5.927   3.211
  382    HE2  LYS  46           HE2      LYS  46  17.425   6.793   5.533
  383    HE3  LYS  46           HE1      LYS  46  18.548   5.520   6.008
  384    HZ1  LYS  46           HZ1      LYS  46  20.264   6.485   4.904
  385    HZ2  LYS  46           HZ2      LYS  46  19.383   7.886   5.286
  386    HZ3  LYS  46           HZ3      LYS  46  19.272   7.208   3.732
  387    H    ALA  47           HN       ALA  47  12.788   2.827   2.544
  388    HA   ALA  47           HA       ALA  47  11.696   5.118   3.883
  389    HB1  ALA  47           HB1      ALA  47   9.576   4.473   2.728
  390    HB2  ALA  47           HB2      ALA  47  10.345   2.967   2.226
  391    HB3  ALA  47           HB3      ALA  47  10.961   4.512   1.637
  392    H    ASP  48           HN       ASP  48  10.645   5.236   5.803
  393    HA   ASP  48           HA       ASP  48  10.207   2.795   7.393
  394    HB2  ASP  48           HB2      ASP  48   9.408   5.659   8.024
  395    HB3  ASP  48           HB1      ASP  48   9.585   4.329   9.170
  396    H    HIS  49           HN       HIS  49   7.955   2.625   8.533
  397    HA   HIS  49           HA       HIS  49   5.964   2.092   6.611
  398    HB2  HIS  49           HB2      HIS  49   5.513   2.796   9.524
  399    HB3  HIS  49           HB1      HIS  49   4.410   1.897   8.485
  400    HD1  HIS  49           HD1      HIS  49   5.586   0.608  11.057
  401    HD2  HIS  49           HD2      HIS  49   7.251   0.174   7.260
  402    HE1  HIS  49           HE1      HIS  49   6.968  -1.514  11.118
  403    H    VAL  50           HN       VAL  50   6.423   5.024   8.605
  404    HA   VAL  50           HA       VAL  50   4.061   6.366   7.553
  405    HB   VAL  50           HB       VAL  50   6.590   7.529   8.807
  406   HG11  VAL  50          HG11      VAL  50   3.870   8.765   8.252
  407   HG12  VAL  50          HG12      VAL  50   5.425   9.283   7.604
  408   HG13  VAL  50          HG13      VAL  50   5.074   9.487   9.317
  409   HG21  VAL  50          HG21      VAL  50   3.899   6.778  10.013
  410   HG22  VAL  50          HG22      VAL  50   5.152   7.686  10.857
  411   HG23  VAL  50          HG23      VAL  50   5.457   6.025  10.358
  412    H    ASP  51           HN       ASP  51   7.560   6.730   6.846
  413    HA   ASP  51           HA       ASP  51   7.280   8.590   4.731
  414    HB2  ASP  51           HB2      ASP  51   9.348   6.406   5.154
  415    HB3  ASP  51           HB1      ASP  51   9.493   7.672   3.934
  416    H    LEU  52           HN       LEU  52   7.061   5.043   4.699
  417    HA   LEU  52           HA       LEU  52   7.017   4.609   1.927
  418    HB2  LEU  52           HB2      LEU  52   7.009   2.799   3.623
  419    HB3  LEU  52           HB1      LEU  52   5.350   3.209   4.039
  420    HG   LEU  52           HG       LEU  52   4.651   2.655   1.707
  421   HD11  LEU  52          HD11      LEU  52   7.608   2.079   1.410
  422   HD12  LEU  52          HD12      LEU  52   6.536   2.961   0.322
  423   HD13  LEU  52          HD13      LEU  52   6.428   1.212   0.425
  424   HD21  LEU  52          HD21      LEU  52   4.918   0.209   1.961
  425   HD22  LEU  52          HD22      LEU  52   4.528   0.973   3.502
  426   HD23  LEU  52          HD23      LEU  52   6.186   0.476   3.158
  427    H    ALA  53           HN       ALA  53   4.288   5.452   4.083
  428    HA   ALA  53           HA       ALA  53   2.272   5.457   2.051
  429    HB1  ALA  53           HB1      ALA  53   1.035   6.961   3.633
  430    HB2  ALA  53           HB2      ALA  53   2.491   7.051   4.624
  431    HB3  ALA  53           HB3      ALA  53   1.665   5.507   4.407
  432    H    THR  54           HN       THR  54   4.721   7.817   2.940
  433    HA   THR  54           HA       THR  54   3.505  10.058   1.561
  434    HB   THR  54           HB       THR  54   6.442   9.623   2.188
  435    HG1  THR  54           HG1      THR  54   4.242  10.437   3.734
  436   HG21  THR  54          HG21      THR  54   4.786  12.132   1.780
  437   HG22  THR  54          HG22      THR  54   6.010  11.507   0.673
  438   HG23  THR  54          HG23      THR  54   6.480  12.098   2.266
  439    H    LEU  55           HN       LEU  55   5.895   7.576   0.555
  440    HA   LEU  55           HA       LEU  55   6.395   8.844  -2.012
  441    HB2  LEU  55           HB2      LEU  55   6.908   5.991  -1.077
  442    HB3  LEU  55           HB1      LEU  55   7.324   6.570  -2.682
  443    HG   LEU  55           HG       LEU  55   8.669   8.431  -1.510
  444   HD11  LEU  55          HD11      LEU  55   9.494   7.737   0.792
  445   HD12  LEU  55          HD12      LEU  55   8.169   6.579   0.838
  446   HD13  LEU  55          HD13      LEU  55   7.831   8.305   0.743
  447   HD21  LEU  55          HD21      LEU  55  10.604   6.909  -1.132
  448   HD22  LEU  55          HD22      LEU  55   9.744   6.528  -2.624
  449   HD23  LEU  55          HD23      LEU  55   9.506   5.529  -1.190
  450    H    MET  56           HN       MET  56   4.115   6.391  -0.859
  451    HA   MET  56           HA       MET  56   3.152   5.702  -3.512
  452    HB2  MET  56           HB2      MET  56   1.945   5.354  -0.750
  453    HB3  MET  56           HB1      MET  56   1.181   4.749  -2.218
  454    HG2  MET  56           HG2      MET  56   3.247   3.433  -2.714
  455    HG3  MET  56           HG1      MET  56   3.935   3.981  -1.188
  456    HE1  MET  56           HE1      MET  56   0.570   2.472  -2.638
  457    HE2  MET  56           HE2      MET  56   0.694   0.864  -1.930
  458    HE3  MET  56           HE3      MET  56   1.957   1.440  -3.012
  459    H    ILE  57           HN       ILE  57   1.997   7.961  -0.985
  460    HA   ILE  57           HA       ILE  57  -0.271   8.806  -2.645
  461    HB   ILE  57           HB       ILE  57   0.893  10.135  -0.167
  462   HG12  ILE  57          HG12      ILE  57  -1.517   8.300  -0.394
  463   HG13  ILE  57          HG11      ILE  57   0.079   7.728   0.086
  464   HG21  ILE  57          HG21      ILE  57  -0.479  11.701  -1.395
  465   HG22  ILE  57          HG22      ILE  57  -1.430  11.113  -0.037
  466   HG23  ILE  57          HG23      ILE  57  -1.724  10.481  -1.654
  467   HD11  ILE  57          HD11      ILE  57   0.089   9.236   2.004
  468   HD12  ILE  57          HD12      ILE  57  -1.377   8.256   2.042
  469   HD13  ILE  57          HD13      ILE  57  -1.450   9.932   1.500
  470    H    ASP  58           HN       ASP  58   2.962  10.118  -1.927
  471    HA   ASP  58           HA       ASP  58   2.489  12.582  -3.413
  472    HB2  ASP  58           HB2      ASP  58   4.159  12.297  -1.511
  473    HB3  ASP  58           HB1      ASP  58   5.160  11.359  -2.621
  474    H    PHE  59           HN       PHE  59   4.410   9.620  -4.120
  475    HA   PHE  59           HA       PHE  59   5.058  10.635  -6.793
  476    HB2  PHE  59           HB2      PHE  59   6.471   9.096  -5.200
  477    HB3  PHE  59           HB1      PHE  59   5.540   7.780  -5.903
  478    HD1  PHE  59           HD1      PHE  59   5.728   7.244  -8.314
  479    HD2  PHE  59           HD2      PHE  59   8.066  10.379  -6.532
  480    HE1  PHE  59           HE1      PHE  59   7.190   7.297 -10.317
  481    HE2  PHE  59           HE2      PHE  59   9.527  10.428  -8.533
  482    HZ   PHE  59           HZ       PHE  59   9.087   8.891 -10.426
  483    H    ASN  60           HN       ASN  60   2.889   8.000  -5.575
  484    HA   ASN  60           HA       ASN  60   2.075   7.434  -8.389
  485    HB2  ASN  60           HB2      ASN  60   2.491   5.654  -6.523
  486    HB3  ASN  60           HB1      ASN  60   0.907   6.121  -5.913
  487   HD21  ASN  60          HD21      ASN  60   1.051   3.531  -6.767
  488   HD22  ASN  60          HD22      ASN  60   0.301   3.334  -8.277
  489    H    GLY  61           HN       GLY  61   0.845   9.051  -5.526
  490    HA2  GLY  61           HA2      GLY  61  -0.841  10.783  -5.680
  491    HA3  GLY  61           HA1      GLY  61  -1.502  10.007  -7.117
  492    H    GLU  62           HN       GLU  62  -3.125  10.755  -4.967
  493    HA   GLU  62           HA       GLU  62  -3.614   8.581  -3.131
  494    HB2  GLU  62           HB2      GLU  62  -4.316  10.953  -2.748
  495    HB3  GLU  62           HB1      GLU  62  -5.513  10.769  -4.029
  496    HG2  GLU  62           HG2      GLU  62  -6.663   9.028  -2.797
  497    HG3  GLU  62           HG1      GLU  62  -5.395   8.995  -1.570
  498    H    GLU  63           HN       GLU  63  -4.887   9.422  -6.326
  499    HA   GLU  63           HA       GLU  63  -7.058   7.526  -6.265
  500    HB2  GLU  63           HB2      GLU  63  -6.663   9.581  -7.831
  501    HB3  GLU  63           HB1      GLU  63  -5.708   8.476  -8.811
  502    HG2  GLU  63           HG2      GLU  63  -8.630   8.103  -8.044
  503    HG3  GLU  63           HG1      GLU  63  -8.029   8.586  -9.627
  504    H    LYS  64           HN       LYS  64  -3.848   7.363  -7.887
  505    HA   LYS  64           HA       LYS  64  -4.260   4.592  -8.671
  506    HB2  LYS  64           HB2      LYS  64  -1.827   6.394  -8.643
  507    HB3  LYS  64           HB1      LYS  64  -1.732   4.711  -9.152
  508    HG2  LYS  64           HG2      LYS  64  -3.438   5.131 -10.884
  509    HG3  LYS  64           HG1      LYS  64  -3.541   6.817 -10.383
  510    HD2  LYS  64           HD2      LYS  64  -1.167   7.144 -10.940
  511    HD3  LYS  64           HD1      LYS  64  -1.042   5.451 -11.421
  512    HE2  LYS  64           HE2      LYS  64  -1.376   6.988 -13.366
  513    HE3  LYS  64           HE1      LYS  64  -2.662   5.792 -13.209
  514    HZ1  LYS  64           HZ1      LYS  64  -3.503   8.046 -13.614
  515    HZ2  LYS  64           HZ2      LYS  64  -2.793   8.567 -12.161
  516    HZ3  LYS  64           HZ3      LYS  64  -4.043   7.418 -12.134
  517    H    ALA  65           HN       ALA  65  -2.495   6.157  -5.970
  518    HA   ALA  65           HA       ALA  65  -1.187   3.878  -4.959
  519    HB1  ALA  65           HB1      ALA  65  -0.815   6.076  -3.989
  520    HB2  ALA  65           HB2      ALA  65  -1.369   4.978  -2.725
  521    HB3  ALA  65           HB3      ALA  65  -2.485   6.146  -3.430
  522    H    TRP  66           HN       TRP  66  -4.557   4.923  -4.369
  523    HA   TRP  66           HA       TRP  66  -5.169   2.776  -2.555
  524    HB2  TRP  66           HB2      TRP  66  -6.736   4.776  -4.156
  525    HB3  TRP  66           HB1      TRP  66  -7.625   3.342  -3.652
  526    HD1  TRP  66           HD1      TRP  66  -6.987   6.677  -2.478
  527    HE1  TRP  66           HE1      TRP  66  -7.250   6.873   0.077
  528    HE3  TRP  66           HE3      TRP  66  -6.897   1.736  -1.209
  529    HZ2  TRP  66           HZ2      TRP  66  -7.406   5.161   2.362
  530    HZ3  TRP  66           HZ3      TRP  66  -7.108   1.042   1.183
  531    HH2  TRP  66           HH2      TRP  66  -7.361   2.752   2.955
  532    H    ALA  67           HN       ALA  67  -5.616   3.113  -6.091
  533    HA   ALA  67           HA       ALA  67  -6.854   0.640  -6.602
  534    HB1  ALA  67           HB1      ALA  67  -5.837   0.782  -8.859
  535    HB2  ALA  67           HB2      ALA  67  -4.756   2.051  -8.281
  536    HB3  ALA  67           HB3      ALA  67  -6.496   2.337  -8.346
  537    H    MET  68           HN       MET  68  -3.386   1.343  -6.204
  538    HA   MET  68           HA       MET  68  -2.532  -1.372  -6.741
  539    HB2  MET  68           HB2      MET  68  -1.073   0.705  -6.861
  540    HB3  MET  68           HB1      MET  68  -1.075   0.730  -5.099
  541    HG2  MET  68           HG2      MET  68   0.919  -0.436  -5.749
  542    HG3  MET  68           HG1      MET  68  -0.201  -1.670  -5.190
  543    HE1  MET  68           HE1      MET  68   1.172   0.275  -8.196
  544    HE2  MET  68           HE2      MET  68   1.513  -1.021  -9.341
  545    HE3  MET  68           HE3      MET  68   2.333  -0.994  -7.781
  546    H    ALA  69           HN       ALA  69  -3.539   0.392  -3.866
  547    HA   ALA  69           HA       ALA  69  -2.628  -1.531  -1.938
  548    HB1  ALA  69           HB1      ALA  69  -4.986   0.364  -1.695
  549    HB2  ALA  69           HB2      ALA  69  -3.310   0.843  -1.433
  550    HB3  ALA  69           HB3      ALA  69  -4.062  -0.347  -0.373
  551    H    VAL  70           HN       VAL  70  -5.613  -1.241  -3.824
  552    HA   VAL  70           HA       VAL  70  -7.013  -3.344  -2.347
  553    HB   VAL  70           HB       VAL  70  -7.545  -2.187  -5.104
  554   HG11  VAL  70          HG11      VAL  70  -9.901  -3.012  -4.583
  555   HG12  VAL  70          HG12      VAL  70  -9.210  -3.902  -3.227
  556   HG13  VAL  70          HG13      VAL  70  -8.722  -4.290  -4.876
  557   HG21  VAL  70          HG21      VAL  70  -9.150  -0.741  -3.944
  558   HG22  VAL  70          HG22      VAL  70  -7.550  -0.524  -3.231
  559   HG23  VAL  70          HG23      VAL  70  -8.757  -1.503  -2.402
  560    H    TRP  71           HN       TRP  71  -5.649  -3.244  -5.663
  561    HA   TRP  71           HA       TRP  71  -6.080  -5.956  -6.263
  562    HB2  TRP  71           HB2      TRP  71  -5.356  -4.267  -7.939
  563    HB3  TRP  71           HB1      TRP  71  -3.752  -4.240  -7.207
  564    HD1  TRP  71           HD1      TRP  71  -6.031  -6.372  -9.371
  565    HE1  TRP  71           HE1      TRP  71  -4.668  -8.333 -10.344
  566    HE3  TRP  71           HE3      TRP  71  -1.686  -5.807  -6.755
  567    HZ2  TRP  71           HZ2      TRP  71  -2.073  -9.507 -10.048
  568    HZ3  TRP  71           HZ3      TRP  71   0.213  -7.354  -7.116
  569    HH2  TRP  71           HH2      TRP  71   0.027  -9.204  -8.759
  570    H    ILE  72           HN       ILE  72  -3.501  -4.542  -4.266
  571    HA   ILE  72           HA       ILE  72  -1.900  -6.997  -4.323
  572    HB   ILE  72           HB       ILE  72  -1.811  -4.527  -2.551
  573   HG12  ILE  72          HG12      ILE  72   0.177  -5.706  -4.532
  574   HG13  ILE  72          HG11      ILE  72  -0.960  -4.426  -4.928
  575   HG21  ILE  72          HG21      ILE  72   0.381  -5.562  -1.682
  576   HG22  ILE  72          HG22      ILE  72  -0.193  -7.089  -2.337
  577   HG23  ILE  72          HG23      ILE  72  -1.102  -6.278  -1.064
  578   HD11  ILE  72          HD11      ILE  72   1.258  -3.495  -4.405
  579   HD12  ILE  72          HD12      ILE  72   1.217  -4.264  -2.818
  580   HD13  ILE  72          HD13      ILE  72   0.078  -2.976  -3.205
  581    H    PHE  73           HN       PHE  73  -4.396  -5.734  -2.018
  582    HA   PHE  73           HA       PHE  73  -4.038  -7.761  -0.059
  583    HB2  PHE  73           HB2      PHE  73  -6.743  -6.670  -0.878
  584    HB3  PHE  73           HB1      PHE  73  -6.276  -7.301   0.694
  585    HD1  PHE  73           HD1      PHE  73  -3.549  -5.840   0.970
  586    HD2  PHE  73           HD2      PHE  73  -7.445  -4.474  -0.264
  587    HE1  PHE  73           HE1      PHE  73  -2.993  -3.562   1.717
  588    HE2  PHE  73           HE2      PHE  73  -6.865  -2.190   0.485
  589    HZ   PHE  73           HZ       PHE  73  -4.645  -1.734   1.481
  590    H    ALA  74           HN       ALA  74  -6.114  -7.840  -2.982
  591    HA   ALA  74           HA       ALA  74  -7.179 -10.438  -2.549
  592    HB1  ALA  74           HB1      ALA  74  -7.546 -10.489  -4.993
  593    HB2  ALA  74           HB2      ALA  74  -6.452  -9.119  -5.190
  594    HB3  ALA  74           HB3      ALA  74  -7.979  -8.910  -4.332
  595    H    ALA  75           HN       ALA  75  -4.008  -9.414  -3.653
  596    HA   ALA  75           HA       ALA  75  -3.216 -11.958  -4.772
  597    HB1  ALA  75           HB1      ALA  75  -0.990 -11.039  -4.835
  598    HB2  ALA  75           HB2      ALA  75  -1.381  -9.846  -3.596
  599    HB3  ALA  75           HB3      ALA  75  -2.097  -9.716  -5.202
  600    H    ILE  76           HN       ILE  76  -2.641 -10.454  -1.566
  601    HA   ILE  76           HA       ILE  76  -1.385 -12.946  -0.584
  602    HB   ILE  76           HB       ILE  76  -1.275 -11.643   1.607
  603   HG12  ILE  76          HG12      ILE  76  -2.261  -9.365  -0.152
  604   HG13  ILE  76          HG11      ILE  76  -3.234 -10.164   1.080
  605   HG21  ILE  76          HG21      ILE  76   0.523 -10.172   0.814
  606   HG22  ILE  76          HG22      ILE  76  -0.081 -10.284  -0.838
  607   HG23  ILE  76          HG23      ILE  76   0.588 -11.707  -0.044
  608   HD11  ILE  76          HD11      ILE  76  -2.325  -8.193   2.105
  609   HD12  ILE  76          HD12      ILE  76  -0.709  -8.536   1.493
  610   HD13  ILE  76          HD13      ILE  76  -1.408  -9.551   2.756
  611    H    ASN  77           HN       ASN  77  -4.353 -12.635  -1.375
  612    HA   ASN  77           HA       ASN  77  -6.412 -13.438  -0.630
  613    HB2  ASN  77           HB2      ASN  77  -4.530 -15.091   1.095
  614    HB3  ASN  77           HB1      ASN  77  -6.258 -15.406   0.945
  615   HD21  ASN  77          HD21      ASN  77  -7.040 -15.747  -1.405
  616   HD22  ASN  77          HD22      ASN  77  -5.983 -16.542  -2.470
  617    H    ARG  78           HN       ARG  78  -6.922 -11.339   0.298
  618    HA   ARG  78           HA       ARG  78  -7.571 -11.543   3.157
  619    HB2  ARG  78           HB2      ARG  78  -5.675  -9.405   2.114
  620    HB3  ARG  78           HB1      ARG  78  -6.533  -9.281   3.651
  621    HG2  ARG  78           HG2      ARG  78  -5.469 -11.574   4.232
  622    HG3  ARG  78           HG1      ARG  78  -4.409 -11.295   2.852
  623    HD2  ARG  78           HD2      ARG  78  -3.656  -9.172   3.858
  624    HD3  ARG  78           HD1      ARG  78  -4.728  -9.441   5.231
  625    HE   ARG  78           HE       ARG  78  -3.142 -11.738   5.098
  626   HH11  ARG  78          HH21      ARG  78  -2.673  -8.328   5.358
  627   HH12  ARG  78          HH22      ARG  78  -1.187  -8.468   6.236
  628   HH21  ARG  78          HH11      ARG  78  -1.205 -11.935   6.241
  629   HH22  ARG  78          HH12      ARG  78  -0.357 -10.508   6.735
  630    H    ARG  79           HN       ARG  79  -9.019 -11.436   0.680
  631    HA   ARG  79           HA       ARG  79 -10.030  -8.983  -0.155
  632    HB2  ARG  79           HB2      ARG  79 -11.634 -11.502   0.369
  633    HB3  ARG  79           HB1      ARG  79 -12.135 -10.163  -0.665
  634    HG2  ARG  79           HG2      ARG  79 -10.233 -10.539  -2.146
  635    HG3  ARG  79           HG1      ARG  79  -9.616 -11.799  -1.077
  636    HD2  ARG  79           HD2      ARG  79 -10.858 -12.721  -3.038
  637    HD3  ARG  79           HD1      ARG  79 -11.579 -13.180  -1.494
  638    HE   ARG  79           HE       ARG  79 -12.920 -10.849  -2.204
  639   HH11  ARG  79          HH21      ARG  79 -12.270 -13.913  -3.662
  640   HH12  ARG  79          HH22      ARG  79 -13.733 -13.928  -4.588
  641   HH21  ARG  79          HH11      ARG  79 -14.828 -10.858  -3.406
  642   HH22  ARG  79          HH12      ARG  79 -15.180 -12.200  -4.444
  643    H    ASP  80           HN       ASP  80 -10.636 -10.580   2.925
  644    HA   ASP  80           HA       ASP  80 -12.961  -9.170   3.737
  645    HB2  ASP  80           HB2      ASP  80 -12.148  -9.584   6.070
  646    HB3  ASP  80           HB1      ASP  80 -12.032 -11.030   5.063
  647    H    LEU  81           HN       LEU  81  -9.583  -8.177   3.632
  648    HA   LEU  81           HA       LEU  81  -9.923  -5.773   5.187
  649    HB2  LEU  81           HB2      LEU  81  -7.721  -7.039   4.537
  650    HB3  LEU  81           HB1      LEU  81  -7.799  -6.112   3.046
  651    HG   LEU  81           HG       LEU  81  -8.091  -4.029   4.675
  652   HD11  LEU  81          HD11      LEU  81  -6.742  -6.076   6.475
  653   HD12  LEU  81          HD12      LEU  81  -8.281  -5.274   6.778
  654   HD13  LEU  81          HD13      LEU  81  -6.788  -4.345   6.788
  655   HD21  LEU  81          HD21      LEU  81  -5.623  -3.773   4.761
  656   HD22  LEU  81          HD22      LEU  81  -6.161  -4.354   3.186
  657   HD23  LEU  81          HD23      LEU  81  -5.441  -5.475   4.341
  658    H    TYR  82           HN       TYR  82 -10.564  -6.577   1.826
  659    HA   TYR  82           HA       TYR  82 -10.631  -3.819   0.903
  660    HB2  TYR  82           HB2      TYR  82 -10.305  -5.393  -0.837
  661    HB3  TYR  82           HB1      TYR  82 -11.532  -6.480  -0.208
  662    HD1  TYR  82           HD2      TYR  82 -11.658  -2.795  -0.966
  663    HD2  TYR  82           HD1      TYR  82 -13.191  -6.704  -1.901
  664    HE1  TYR  82           HE2      TYR  82 -13.318  -1.782  -2.494
  665    HE2  TYR  82           HE1      TYR  82 -14.848  -5.682  -3.430
  666    HH   TYR  82           HH       TYR  82 -14.695  -2.977  -4.767
  667    H    GLU  83           HN       GLU  83 -12.971  -6.079   2.295
  668    HA   GLU  83           HA       GLU  83 -15.316  -4.526   1.726
  669    HB2  GLU  83           HB2      GLU  83 -14.742  -6.499   3.959
  670    HB3  GLU  83           HB1      GLU  83 -16.338  -5.839   3.601
  671    HG2  GLU  83           HG2      GLU  83 -16.208  -6.766   1.314
  672    HG3  GLU  83           HG1      GLU  83 -14.621  -7.442   1.683
  673    H    LYS  84           HN       LYS  84 -13.124  -4.581   4.549
  674    HA   LYS  84           HA       LYS  84 -14.634  -2.522   5.958
  675    HB2  LYS  84           HB2      LYS  84 -13.133  -4.267   7.029
  676    HB3  LYS  84           HB1      LYS  84 -11.755  -3.344   6.436
  677    HG2  LYS  84           HG2      LYS  84 -12.737  -1.321   7.640
  678    HG3  LYS  84           HG1      LYS  84 -13.886  -2.426   8.389
  679    HD2  LYS  84           HD2      LYS  84 -10.865  -2.671   8.576
  680    HD3  LYS  84           HD1      LYS  84 -11.900  -1.999   9.831
  681    HE2  LYS  84           HE2      LYS  84 -13.165  -4.267   9.740
  682    HE3  LYS  84           HE1      LYS  84 -11.751  -4.861   8.867
  683    HZ1  LYS  84           HZ1      LYS  84 -10.437  -4.687  10.682
  684    HZ2  LYS  84           HZ2      LYS  84 -11.916  -4.926  11.484
  685    HZ3  LYS  84           HZ3      LYS  84 -11.277  -3.360  11.322
  686    H    ALA  85           HN       ALA  85 -11.791  -2.575   3.843
  687    HA   ALA  85           HA       ALA  85 -10.812   0.022   4.274
  688    HB1  ALA  85           HB1      ALA  85 -10.949  -1.575   1.704
  689    HB2  ALA  85           HB2      ALA  85  -9.612  -1.523   2.850
  690    HB3  ALA  85           HB3      ALA  85 -10.009  -0.095   1.894
  691    H    LYS  86           HN       LYS  86 -13.442  -0.975   2.045
  692    HA   LYS  86           HA       LYS  86 -13.895   1.685   1.053
  693    HB2  LYS  86           HB2      LYS  86 -16.186   0.755   0.407
  694    HB3  LYS  86           HB1      LYS  86 -14.808  -0.153  -0.220
  695    HG2  LYS  86           HG2      LYS  86 -15.046  -1.849   1.460
  696    HG3  LYS  86           HG1      LYS  86 -16.207  -0.887   2.369
  697    HD2  LYS  86           HD2      LYS  86 -17.393  -2.615   1.121
  698    HD3  LYS  86           HD1      LYS  86 -17.793  -1.035   0.454
  699    HE2  LYS  86           HE2      LYS  86 -16.421  -1.375  -1.462
  700    HE3  LYS  86           HE1      LYS  86 -15.557  -2.718  -0.712
  701    HZ1  LYS  86           HZ1      LYS  86 -18.155  -3.501  -0.637
  702    HZ2  LYS  86           HZ2      LYS  86 -16.999  -4.003  -1.777
  703    HZ3  LYS  86           HZ3      LYS  86 -18.044  -2.712  -2.135
  704    H    ARG  87           HN       ARG  87 -14.912  -0.013   3.951
  705    HA   ARG  87           HA       ARG  87 -17.038   1.854   4.635
  706    HB2  ARG  87           HB2      ARG  87 -16.874  -0.484   5.532
  707    HB3  ARG  87           HB1      ARG  87 -15.471   0.019   6.476
  708    HG2  ARG  87           HG2      ARG  87 -16.806   1.660   7.680
  709    HG3  ARG  87           HG1      ARG  87 -18.206   1.317   6.664
  710    HD2  ARG  87           HD2      ARG  87 -16.844  -0.709   8.462
  711    HD3  ARG  87           HD1      ARG  87 -18.325   0.159   8.868
  712    HE   ARG  87           HE       ARG  87 -18.891  -1.021   6.419
  713   HH11  ARG  87          HH21      ARG  87 -17.737  -2.083   9.497
  714   HH12  ARG  87          HH22      ARG  87 -18.448  -3.657   9.365
  715   HH21  ARG  87          HH11      ARG  87 -19.821  -3.069   6.236
  716   HH22  ARG  87          HH12      ARG  87 -19.626  -4.215   7.521
  717    H    ASP  88           HN       ASP  88 -13.561   1.761   5.128
  718    HA   ASP  88           HA       ASP  88 -13.673   4.060   7.037
  719    HB2  ASP  88           HB2      ASP  88 -12.156   2.074   7.467
  720    HB3  ASP  88           HB1      ASP  88 -11.246   2.529   6.025
  721    H    GLU  89           HN       GLU  89 -13.419   3.508   3.703
  722    HA   GLU  89           HA       GLU  89 -11.514   5.364   2.760
  723    HB2  GLU  89           HB2      GLU  89 -12.796   3.779   1.366
  724    HB3  GLU  89           HB1      GLU  89 -14.260   4.715   1.641
  725    HG2  GLU  89           HG2      GLU  89 -13.194   6.665   0.512
  726    HG3  GLU  89           HG1      GLU  89 -11.767   5.673   0.198
  727    HA   PRO  90           HA       PRO  90 -13.755   8.952   4.564
  728    HB2  PRO  90           HB2      PRO  90 -11.711  10.824   3.727
  729    HB3  PRO  90           HB1      PRO  90 -11.981  10.200   5.360
  730    HG2  PRO  90           HG2      PRO  90  -9.799   9.534   3.555
  731    HG3  PRO  90           HG1      PRO  90 -10.060   8.943   5.202
  732    HD2  PRO  90           HD2      PRO  90 -10.443   7.490   2.707
  733    HD3  PRO  90           HD1      PRO  90 -10.637   6.881   4.355
  734    H    LYS  91           HN       LYS  91 -14.770  10.865   3.534
  735    HA   LYS  91           HA       LYS  91 -15.886  11.890   1.760
  736    HB2  LYS  91           HB2      LYS  91 -13.442  12.459   1.223
  737    HB3  LYS  91           HB1      LYS  91 -13.484  11.141   0.059
  738    HG2  LYS  91           HG2      LYS  91 -15.332  12.213  -1.138
  739    HG3  LYS  91           HG1      LYS  91 -15.380  13.510   0.058
  740    HD2  LYS  91           HD2      LYS  91 -13.094  14.174  -0.541
  741    HD3  LYS  91           HD1      LYS  91 -12.999  12.848  -1.701
  742    HE2  LYS  91           HE2      LYS  91 -14.920  15.192  -1.811
  743    HE3  LYS  91           HE1      LYS  91 -13.544  14.918  -2.879
  744    HZ1  LYS  91           HZ1      LYS  91 -14.880  12.604  -3.093
  745    HZ2  LYS  91           HZ2      LYS  91 -15.056  13.913  -4.162
  746    HZ3  LYS  91           HZ3      LYS  91 -16.162  13.696  -2.890
  Start of MODEL   15
    1    H1   MET   1           HT1      MET   1  -4.705  18.285  13.805
    2    H2   MET   1           HT2      MET   1  -4.154  18.160  12.202
    3    H3   MET   1           HT3      MET   1  -3.682  17.009  13.360
    4    HA   MET   1           HA       MET   1  -6.253  16.651  13.579
    5    HB2  MET   1           HB2      MET   1  -5.863  17.618  10.727
    6    HB3  MET   1           HB1      MET   1  -7.337  16.904  11.380
    7    HG2  MET   1           HG2      MET   1  -6.057  19.421  12.487
    8    HG3  MET   1           HG1      MET   1  -7.365  19.423  11.304
    9    HE1  MET   1           HE1      MET   1  -8.505  21.028  13.245
   10    HE2  MET   1           HE2      MET   1  -7.107  20.685  14.261
   11    HE3  MET   1           HE3      MET   1  -8.732  20.472  14.909
   12    H    ALA   2           HN       ALA   2  -6.982  14.637  12.417
   13    HA   ALA   2           HA       ALA   2  -4.823  12.763  12.197
   14    HB1  ALA   2           HB1      ALA   2  -7.106  12.082  12.834
   15    HB2  ALA   2           HB2      ALA   2  -6.560  11.183  11.418
   16    HB3  ALA   2           HB3      ALA   2  -7.689  12.524  11.229
   17    H    SER   3           HN       SER   3  -3.348  13.325  10.580
   18    HA   SER   3           HA       SER   3  -4.151  14.174   7.931
   19    HB2  SER   3           HB2      SER   3  -1.876  14.587   9.055
   20    HB3  SER   3           HB1      SER   3  -1.491  12.906   8.694
   21    HG   SER   3           HG       SER   3  -1.770  15.100   7.008
   22    H    THR   4           HN       THR   4  -3.735  12.882   5.942
   23    HA   THR   4           HA       THR   4  -4.950  10.265   6.136
   24    HB   THR   4           HB       THR   4  -3.360  11.166   3.717
   25    HG1  THR   4           HG1      THR   4  -5.226  12.600   4.980
   26   HG21  THR   4          HG21      THR   4  -4.693   8.973   3.842
   27   HG22  THR   4          HG22      THR   4  -5.059  10.032   2.480
   28   HG23  THR   4          HG23      THR   4  -6.141   9.979   3.871
   29    H    ARG   5           HN       ARG   5  -1.614  11.418   5.754
   30    HA   ARG   5           HA       ARG   5  -0.342   8.944   5.230
   31    HB2  ARG   5           HB2      ARG   5   0.681  11.269   6.891
   32    HB3  ARG   5           HB1      ARG   5   1.678   9.983   6.211
   33    HG2  ARG   5           HG2      ARG   5   0.947  10.631   3.935
   34    HG3  ARG   5           HG1      ARG   5  -0.016  11.938   4.627
   35    HD2  ARG   5           HD2      ARG   5   2.035  12.925   5.600
   36    HD3  ARG   5           HD1      ARG   5   2.992  11.630   4.879
   37    HE   ARG   5           HE       ARG   5   1.623  12.728   2.726
   38   HH11  ARG   5          HH21      ARG   5   3.671  13.902   5.249
   39   HH12  ARG   5          HH22      ARG   5   4.320  15.196   4.297
   40   HH21  ARG   5          HH11      ARG   5   2.462  14.411   1.476
   41   HH22  ARG   5          HH12      ARG   5   3.636  15.483   2.163
   42    H    CYS   6           HN       CYS   6  -1.019  10.503   8.375
   43    HA   CYS   6           HA       CYS   6   0.022   8.422  10.008
   44    HB2  CYS   6           HB2      CYS   6  -2.251  10.363  10.517
   45    HB3  CYS   6           HB1      CYS   6  -1.530   9.336  11.757
   46    HG   CYS   6           HG       CYS   6  -0.431  11.913  11.268
   47    H    LYS   7           HN       LYS   7  -3.074   8.794   8.370
   48    HA   LYS   7           HA       LYS   7  -4.402   6.610   9.712
   49    HB2  LYS   7           HB2      LYS   7  -5.560   8.441   8.429
   50    HB3  LYS   7           HB1      LYS   7  -4.970   7.706   6.940
   51    HG2  LYS   7           HG2      LYS   7  -6.158   5.631   7.447
   52    HG3  LYS   7           HG1      LYS   7  -6.682   6.283   9.001
   53    HD2  LYS   7           HD2      LYS   7  -7.865   8.119   7.783
   54    HD3  LYS   7           HD1      LYS   7  -7.428   7.345   6.259
   55    HE2  LYS   7           HE2      LYS   7  -8.661   5.328   6.888
   56    HE3  LYS   7           HE1      LYS   7  -9.036   6.021   8.467
   57    HZ1  LYS   7           HZ1      LYS   7 -10.505   7.510   7.571
   58    HZ2  LYS   7           HZ2      LYS   7 -10.731   6.193   6.522
   59    HZ3  LYS   7           HZ3      LYS   7  -9.768   7.509   6.044
   60    H    LEU   8           HN       LEU   8  -2.697   6.845   6.558
   61    HA   LEU   8           HA       LEU   8  -3.086   4.073   5.857
   62    HB2  LEU   8           HB2      LEU   8  -0.911   6.048   5.094
   63    HB3  LEU   8           HB1      LEU   8  -1.072   4.458   4.355
   64    HG   LEU   8           HG       LEU   8  -3.460   6.336   4.384
   65   HD11  LEU   8          HD11      LEU   8  -1.634   7.691   3.467
   66   HD12  LEU   8          HD12      LEU   8  -2.725   7.206   2.168
   67   HD13  LEU   8          HD13      LEU   8  -1.182   6.382   2.376
   68   HD21  LEU   8          HD21      LEU   8  -3.940   5.146   2.231
   69   HD22  LEU   8          HD22      LEU   8  -3.846   4.042   3.596
   70   HD23  LEU   8          HD23      LEU   8  -2.494   4.169   2.472
   71    H    ALA   9           HN       ALA   9  -0.669   5.699   7.854
   72    HA   ALA   9           HA       ALA   9   1.224   3.577   8.015
   73    HB1  ALA   9           HB1      ALA   9   2.035   4.663  10.023
   74    HB2  ALA   9           HB2      ALA   9   0.513   5.532  10.217
   75    HB3  ALA   9           HB3      ALA   9   1.578   5.910   8.863
   76    H    ARG  10           HN       ARG  10  -1.694   4.231   9.941
   77    HA   ARG  10           HA       ARG  10  -1.282   2.025  11.765
   78    HB2  ARG  10           HB2      ARG  10  -3.717   3.673  11.026
   79    HB3  ARG  10           HB1      ARG  10  -3.797   2.369  12.209
   80    HG2  ARG  10           HG2      ARG  10  -2.091   3.472  13.582
   81    HG3  ARG  10           HG1      ARG  10  -1.924   4.754  12.384
   82    HD2  ARG  10           HD2      ARG  10  -4.242   5.440  12.735
   83    HD3  ARG  10           HD1      ARG  10  -4.496   4.099  13.854
   84    HE   ARG  10           HE       ARG  10  -2.348   5.487  14.942
   85   HH11  ARG  10          HH21      ARG  10  -5.560   6.240  13.919
   86   HH12  ARG  10          HH22      ARG  10  -5.768   7.515  15.073
   87   HH21  ARG  10          HH11      ARG  10  -2.609   7.145  16.452
   88   HH22  ARG  10          HH12      ARG  10  -4.098   8.026  16.505
   89    H    TYR  11           HN       TYR  11  -2.864   2.342   8.634
   90    HA   TYR  11           HA       TYR  11  -4.213  -0.217   8.720
   91    HB2  TYR  11           HB2      TYR  11  -3.541   1.803   6.589
   92    HB3  TYR  11           HB1      TYR  11  -4.063   0.203   6.071
   93    HD1  TYR  11           HD1      TYR  11  -5.055   2.644   8.765
   94    HD2  TYR  11           HD2      TYR  11  -6.370   0.103   5.560
   95    HE1  TYR  11           HE1      TYR  11  -7.400   3.317   9.188
   96    HE2  TYR  11           HE2      TYR  11  -8.711   0.761   5.996
   97    HH   TYR  11           HH       TYR  11  -9.521   3.039   8.621
   98    H    LEU  12           HN       LEU  12  -1.136   0.862   7.261
   99    HA   LEU  12           HA       LEU  12  -0.466  -1.775   6.289
  100    HB2  LEU  12           HB2      LEU  12   0.481   0.318   5.333
  101    HB3  LEU  12           HB1      LEU  12   1.289   0.645   6.858
  102    HG   LEU  12           HG       LEU  12   2.501  -1.688   6.470
  103   HD11  LEU  12          HD11      LEU  12   1.173  -2.526   4.604
  104   HD12  LEU  12          HD12      LEU  12   2.787  -2.171   4.015
  105   HD13  LEU  12          HD13      LEU  12   1.466  -1.057   3.676
  106   HD21  LEU  12          HD21      LEU  12   3.638   0.492   6.349
  107   HD22  LEU  12          HD22      LEU  12   3.075   0.707   4.691
  108   HD23  LEU  12          HD23      LEU  12   4.216  -0.581   5.074
  109    H    GLU  13           HN       GLU  13  -0.091  -0.119   9.330
  110    HA   GLU  13           HA       GLU  13   1.946  -1.980  10.368
  111    HB2  GLU  13           HB2      GLU  13   0.337   0.269  11.616
  112    HB3  GLU  13           HB1      GLU  13   1.359  -0.779  12.595
  113    HG2  GLU  13           HG2      GLU  13   2.396   0.721  10.165
  114    HG3  GLU  13           HG1      GLU  13   2.463   1.374  11.800
  115    H    ASP  14           HN       ASP  14  -1.576  -1.766  10.413
  116    HA   ASP  14           HA       ASP  14  -2.013  -3.499  12.647
  117    HB2  ASP  14           HB2      ASP  14  -4.248  -3.897  11.702
  118    HB3  ASP  14           HB1      ASP  14  -3.834  -2.187  11.631
  119    H    LEU  15           HN       LEU  15  -0.651  -4.169   9.591
  120    HA   LEU  15           HA       LEU  15  -1.516  -6.963   9.422
  121    HB2  LEU  15           HB2      LEU  15   0.890  -5.646   8.124
  122    HB3  LEU  15           HB1      LEU  15   0.164  -7.181   7.663
  123    HG   LEU  15           HG       LEU  15  -1.170  -4.458   7.488
  124   HD11  LEU  15          HD11      LEU  15  -0.978  -4.788   5.070
  125   HD12  LEU  15          HD12      LEU  15  -0.241  -6.369   5.320
  126   HD13  LEU  15          HD13      LEU  15   0.620  -4.909   5.808
  127   HD21  LEU  15          HD21      LEU  15  -2.967  -5.964   7.861
  128   HD22  LEU  15          HD22      LEU  15  -2.180  -7.276   6.983
  129   HD23  LEU  15          HD23      LEU  15  -2.867  -5.911   6.106
  130    H    GLU  16           HN       GLU  16   0.521  -8.588   9.205
  131    HA   GLU  16           HA       GLU  16   1.761  -8.595  11.915
  132    HB2  GLU  16           HB2      GLU  16   1.298 -10.646   9.742
  133    HB3  GLU  16           HB1      GLU  16   2.549 -10.957  10.942
  134    HG2  GLU  16           HG2      GLU  16  -0.311 -10.248  11.686
  135    HG3  GLU  16           HG1      GLU  16   0.255 -11.908  11.503
  136    H    ASP  17           HN       ASP  17   4.099  -9.090  12.090
  137    HA   ASP  17           HA       ASP  17   5.710  -7.322  10.570
  138    HB2  ASP  17           HB2      ASP  17   6.329  -8.240  12.805
  139    HB3  ASP  17           HB1      ASP  17   6.617  -9.809  12.049
  140    H    VAL  18           HN       VAL  18   5.350 -10.875  10.264
  141    HA   VAL  18           HA       VAL  18   7.155 -11.112   8.054
  142    HB   VAL  18           HB       VAL  18   6.366 -13.047   9.418
  143   HG11  VAL  18          HG11      VAL  18   3.791 -12.833   7.817
  144   HG12  VAL  18          HG12      VAL  18   3.942 -12.273   9.482
  145   HG13  VAL  18          HG13      VAL  18   4.161 -13.980   9.103
  146   HG21  VAL  18          HG21      VAL  18   6.214 -14.609   7.548
  147   HG22  VAL  18          HG22      VAL  18   7.336 -13.317   7.114
  148   HG23  VAL  18          HG23      VAL  18   5.695 -13.316   6.466
  149    H    ASP  19           HN       ASP  19   3.646 -10.503   8.206
  150    HA   ASP  19           HA       ASP  19   3.229 -10.626   5.360
  151    HB2  ASP  19           HB2      ASP  19   1.372 -10.750   6.999
  152    HB3  ASP  19           HB1      ASP  19   1.675  -9.076   7.460
  153    H    LEU  20           HN       LEU  20   4.401  -8.162   7.548
  154    HA   LEU  20           HA       LEU  20   4.072  -5.911   5.809
  155    HB2  LEU  20           HB2      LEU  20   4.825  -6.186   8.398
  156    HB3  LEU  20           HB1      LEU  20   6.425  -6.005   7.693
  157    HG   LEU  20           HG       LEU  20   4.102  -4.065   7.416
  158   HD11  LEU  20          HD11      LEU  20   5.186  -4.038   9.624
  159   HD12  LEU  20          HD12      LEU  20   5.575  -2.568   8.729
  160   HD13  LEU  20          HD13      LEU  20   6.765  -3.864   8.857
  161   HD21  LEU  20          HD21      LEU  20   5.319  -3.911   5.372
  162   HD22  LEU  20          HD22      LEU  20   6.874  -4.107   6.181
  163   HD23  LEU  20          HD23      LEU  20   5.962  -2.609   6.367
  164    H    LYS  21           HN       LYS  21   6.489  -8.443   6.061
  165    HA   LYS  21           HA       LYS  21   8.453  -7.174   4.338
  166    HB2  LYS  21           HB2      LYS  21   9.061  -8.911   5.983
  167    HB3  LYS  21           HB1      LYS  21   8.098 -10.089   5.090
  168    HG2  LYS  21           HG2      LYS  21   9.546  -9.971   3.180
  169    HG3  LYS  21           HG1      LYS  21  10.369  -8.544   3.806
  170    HD2  LYS  21           HD2      LYS  21  11.726 -10.605   4.094
  171    HD3  LYS  21           HD1      LYS  21  11.330  -9.848   5.636
  172    HE2  LYS  21           HE2      LYS  21  11.027 -12.416   5.467
  173    HE3  LYS  21           HE1      LYS  21   9.691 -11.495   6.153
  174    HZ1  LYS  21           HZ1      LYS  21   8.457 -11.690   4.220
  175    HZ2  LYS  21           HZ2      LYS  21   9.193 -13.216   4.343
  176    HZ3  LYS  21           HZ3      LYS  21   9.806 -12.060   3.260
  177    H    LYS  22           HN       LYS  22   5.943  -9.675   3.795
  178    HA   LYS  22           HA       LYS  22   6.655 -10.091   1.027
  179    HB2  LYS  22           HB2      LYS  22   4.129 -10.657   2.612
  180    HB3  LYS  22           HB1      LYS  22   4.253 -11.043   0.896
  181    HG2  LYS  22           HG2      LYS  22   6.366 -12.367   1.479
  182    HG3  LYS  22           HG1      LYS  22   5.926 -12.161   3.170
  183    HD2  LYS  22           HD2      LYS  22   4.217 -13.482   1.035
  184    HD3  LYS  22           HD1      LYS  22   5.117 -14.320   2.296
  185    HE2  LYS  22           HE2      LYS  22   2.693 -12.532   2.607
  186    HE3  LYS  22           HE1      LYS  22   2.893 -14.201   3.133
  187    HZ1  LYS  22           HZ1      LYS  22   4.265 -11.816   4.245
  188    HZ2  LYS  22           HZ2      LYS  22   4.617 -13.418   4.687
  189    HZ3  LYS  22           HZ3      LYS  22   3.085 -12.761   5.013
  190    H    PHE  23           HN       PHE  23   4.663  -7.686   2.638
  191    HA   PHE  23           HA       PHE  23   3.282  -6.795   0.239
  192    HB2  PHE  23           HB2      PHE  23   2.407  -6.284   2.466
  193    HB3  PHE  23           HB1      PHE  23   3.861  -5.380   2.861
  194    HD1  PHE  23           HD2      PHE  23   4.415  -3.274   1.601
  195    HD2  PHE  23           HD1      PHE  23   0.632  -5.270   1.188
  196    HE1  PHE  23           HE2      PHE  23   3.431  -1.215   0.635
  197    HE2  PHE  23           HE1      PHE  23  -0.345  -3.213   0.210
  198    HZ   PHE  23           HZ       PHE  23   1.053  -1.185  -0.065
  199    H    LYS  24           HN       LYS  24   6.194  -5.584   1.963
  200    HA   LYS  24           HA       LYS  24   6.715  -3.479   0.072
  201    HB2  LYS  24           HB2      LYS  24   7.665  -3.515   2.362
  202    HB3  LYS  24           HB1      LYS  24   8.629  -4.927   1.924
  203    HG2  LYS  24           HG2      LYS  24   9.894  -3.675   0.309
  204    HG3  LYS  24           HG1      LYS  24   8.795  -2.301   0.415
  205    HD2  LYS  24           HD2      LYS  24  10.824  -1.813   1.682
  206    HD3  LYS  24           HD1      LYS  24   9.465  -1.975   2.791
  207    HE2  LYS  24           HE2      LYS  24  10.185  -4.125   3.527
  208    HE3  LYS  24           HE1      LYS  24  11.280  -4.319   2.157
  209    HZ1  LYS  24           HZ1      LYS  24  11.596  -2.694   4.579
  210    HZ2  LYS  24           HZ2      LYS  24  12.346  -2.178   3.144
  211    HZ3  LYS  24           HZ3      LYS  24  12.718  -3.701   3.800
  212    H    MET  25           HN       MET  25   7.856  -6.829   0.375
  213    HA   MET  25           HA       MET  25   9.799  -6.808  -1.677
  214    HB2  MET  25           HB2      MET  25   9.284  -8.706  -0.064
  215    HB3  MET  25           HB1      MET  25   7.912  -9.115  -1.092
  216    HG2  MET  25           HG2      MET  25   9.737 -10.509  -1.797
  217    HG3  MET  25           HG1      MET  25   9.560  -9.266  -3.033
  218    HE1  MET  25           HE1      MET  25  13.333  -9.584  -3.179
  219    HE2  MET  25           HE2      MET  25  11.799  -9.497  -4.041
  220    HE3  MET  25           HE3      MET  25  12.138 -10.876  -2.998
  221    H    HIS  26           HN       HIS  26   6.280  -7.019  -1.858
  222    HA   HIS  26           HA       HIS  26   6.143  -7.740  -4.660
  223    HB2  HIS  26           HB2      HIS  26   4.183  -6.303  -2.820
  224    HB3  HIS  26           HB1      HIS  26   3.781  -6.784  -4.470
  225    HD1  HIS  26           HD1      HIS  26   6.023  -9.079  -2.624
  226    HD2  HIS  26           HD2      HIS  26   1.923  -8.702  -3.278
  227    HE1  HIS  26           HE1      HIS  26   4.982 -11.280  -1.928
  228    H    LEU  27           HN       LEU  27   5.982  -4.574  -2.977
  229    HA   LEU  27           HA       LEU  27   5.862  -3.077  -5.492
  230    HB2  LEU  27           HB2      LEU  27   6.685  -2.083  -2.744
  231    HB3  LEU  27           HB1      LEU  27   6.146  -1.100  -4.101
  232    HG   LEU  27           HG       LEU  27   4.448  -3.205  -2.722
  233   HD11  LEU  27          HD11      LEU  27   4.428  -0.181  -2.482
  234   HD12  LEU  27          HD12      LEU  27   4.927  -1.317  -1.229
  235   HD13  LEU  27          HD13      LEU  27   3.243  -1.267  -1.756
  236   HD21  LEU  27          HD21      LEU  27   3.926  -1.219  -4.960
  237   HD22  LEU  27          HD22      LEU  27   2.606  -1.833  -3.966
  238   HD23  LEU  27          HD23      LEU  27   3.575  -2.948  -4.919
  239    H    GLU  28           HN       GLU  28   8.430  -4.208  -3.364
  240    HA   GLU  28           HA       GLU  28  10.521  -2.560  -4.419
  241    HB2  GLU  28           HB2      GLU  28  10.655  -3.951  -2.318
  242    HB3  GLU  28           HB1      GLU  28  10.792  -5.382  -3.337
  243    HG2  GLU  28           HG2      GLU  28  12.852  -4.564  -4.319
  244    HG3  GLU  28           HG1      GLU  28  12.681  -3.013  -3.497
  245    H    ASP  29           HN       ASP  29   8.752  -5.133  -5.814
  246    HA   ASP  29           HA       ASP  29  10.472  -5.050  -8.223
  247    HB2  ASP  29           HB2      ASP  29   9.875  -7.655  -6.782
  248    HB3  ASP  29           HB1      ASP  29  10.709  -7.494  -8.328
  249    H    TYR  30           HN       TYR  30   8.035  -3.958  -8.204
  250    HA   TYR  30           HA       TYR  30   5.907  -5.840  -8.789
  251    HB2  TYR  30           HB2      TYR  30   5.616  -3.480  -7.896
  252    HB3  TYR  30           HB1      TYR  30   6.015  -2.891  -9.508
  253    HD1  TYR  30           HD2      TYR  30   3.622  -4.975  -7.566
  254    HD2  TYR  30           HD1      TYR  30   4.377  -2.951 -11.281
  255    HE1  TYR  30           HE2      TYR  30   1.267  -5.346  -8.248
  256    HE2  TYR  30           HE1      TYR  30   2.021  -3.325 -11.961
  257    HH   TYR  30           HH       TYR  30   0.064  -5.505 -10.687
  258    HA   PRO  31           HA       PRO  31   7.296  -6.477 -13.009
  259    HB2  PRO  31           HB2      PRO  31   4.775  -7.195 -14.156
  260    HB3  PRO  31           HB1      PRO  31   5.980  -8.307 -13.492
  261    HG2  PRO  31           HG2      PRO  31   3.415  -7.426 -12.288
  262    HG3  PRO  31           HG1      PRO  31   4.421  -8.822 -11.863
  263    HD2  PRO  31           HD2      PRO  31   4.203  -6.421 -10.355
  264    HD3  PRO  31           HD1      PRO  31   5.451  -7.671 -10.148
  265    HA   PRO  32           HA       PRO  32   6.167  -2.484 -14.766
  266    HB2  PRO  32           HB2      PRO  32   6.857  -2.997 -17.479
  267    HB3  PRO  32           HB1      PRO  32   7.952  -2.372 -16.236
  268    HG2  PRO  32           HG2      PRO  32   7.811  -5.118 -17.378
  269    HG3  PRO  32           HG1      PRO  32   9.159  -4.328 -16.542
  270    HD2  PRO  32           HD2      PRO  32   7.485  -6.316 -15.413
  271    HD3  PRO  32           HD1      PRO  32   8.549  -5.221 -14.501
  272    H    GLN  33           HN       GLN  33   4.350  -1.614 -15.876
  273    HA   GLN  33           HA       GLN  33   2.378  -3.611 -16.979
  274    HB2  GLN  33           HB2      GLN  33   1.859  -0.864 -15.792
  275    HB3  GLN  33           HB1      GLN  33   0.643  -2.029 -16.313
  276    HG2  GLN  33           HG2      GLN  33   2.683  -2.560 -14.133
  277    HG3  GLN  33           HG1      GLN  33   1.025  -2.041 -13.835
  278   HE21  GLN  33          HE21      GLN  33   2.859  -4.786 -13.849
  279   HE22  GLN  33          HE22      GLN  33   1.679  -5.924 -14.287
  280    H    LYS  34           HN       LYS  34   3.646  -0.297 -17.394
  281    HA   LYS  34           HA       LYS  34   3.527  -0.552 -20.296
  282    HB2  LYS  34           HB2      LYS  34   1.975   1.451 -20.513
  283    HB3  LYS  34           HB1      LYS  34   1.209  -0.033 -19.954
  284    HG2  LYS  34           HG2      LYS  34   1.278   0.720 -17.651
  285    HG3  LYS  34           HG1      LYS  34   2.201   2.152 -18.105
  286    HD2  LYS  34           HD2      LYS  34   0.322   2.959 -19.461
  287    HD3  LYS  34           HD1      LYS  34  -0.600   1.507 -19.072
  288    HE2  LYS  34           HE2      LYS  34  -1.306   3.341 -17.615
  289    HE3  LYS  34           HE1      LYS  34  -0.479   2.109 -16.660
  290    HZ1  LYS  34           HZ1      LYS  34   1.055   3.572 -16.072
  291    HZ2  LYS  34           HZ2      LYS  34   0.153   4.791 -16.836
  292    HZ3  LYS  34           HZ3      LYS  34   1.380   3.980 -17.685
  293    H    GLY  35           HN       GLY  35   5.766  -0.129 -18.909
  294    HA2  GLY  35           HA2      GLY  35   7.624   1.342 -19.128
  295    HA3  GLY  35           HA1      GLY  35   6.532   2.627 -19.649
  296    H    CYS  36           HN       CYS  36   5.602   0.889 -16.824
  297    HA   CYS  36           HA       CYS  36   5.529   3.196 -15.169
  298    HB2  CYS  36           HB2      CYS  36   4.237   1.147 -14.681
  299    HB3  CYS  36           HB1      CYS  36   5.736   0.283 -14.339
  300    HG   CYS  36           HG       CYS  36   5.747   1.272 -12.073
  301    H    ILE  37           HN       ILE  37   6.933   3.854 -13.455
  302    HA   ILE  37           HA       ILE  37   9.788   3.291 -13.949
  303    HB   ILE  37           HB       ILE  37   8.499   5.168 -11.943
  304   HG12  ILE  37          HG12      ILE  37   9.613   5.809 -14.697
  305   HG13  ILE  37          HG11      ILE  37   7.892   5.628 -14.357
  306   HG21  ILE  37          HG21      ILE  37  10.879   4.589 -11.479
  307   HG22  ILE  37          HG22      ILE  37  10.689   6.278 -11.936
  308   HG23  ILE  37          HG23      ILE  37  11.306   5.117 -13.107
  309   HD11  ILE  37          HD11      ILE  37   9.757   7.661 -13.081
  310   HD12  ILE  37          HD12      ILE  37   8.063   7.438 -12.645
  311   HD13  ILE  37          HD13      ILE  37   8.489   8.006 -14.260
  312    HA   PRO  38           HA       PRO  38   9.259   0.288 -10.511
  313    HB2  PRO  38           HB2      PRO  38  12.054  -0.454 -10.529
  314    HB3  PRO  38           HB1      PRO  38  10.698  -1.376 -11.195
  315    HG2  PRO  38           HG2      PRO  38  12.755   0.080 -12.664
  316    HG3  PRO  38           HG1      PRO  38  11.448  -0.916 -13.321
  317    HD2  PRO  38           HD2      PRO  38  11.638   1.978 -13.343
  318    HD3  PRO  38           HD1      PRO  38  10.322   0.976 -13.987
  319    H    LEU  39           HN       LEU  39   9.534   0.679  -8.318
  320    HA   LEU  39           HA       LEU  39  10.745   3.158  -7.493
  321    HB2  LEU  39           HB2      LEU  39   9.450   0.825  -6.094
  322    HB3  LEU  39           HB1      LEU  39  10.287   2.036  -5.128
  323    HG   LEU  39           HG       LEU  39   8.872   3.804  -6.107
  324   HD11  LEU  39          HD11      LEU  39   7.646   1.477  -7.616
  325   HD12  LEU  39          HD12      LEU  39   8.390   2.926  -8.292
  326   HD13  LEU  39          HD13      LEU  39   6.849   3.042  -7.449
  327   HD21  LEU  39          HD21      LEU  39   6.805   3.193  -4.971
  328   HD22  LEU  39          HD22      LEU  39   8.167   2.556  -4.049
  329   HD23  LEU  39          HD23      LEU  39   7.216   1.481  -5.074
  330    HA   PRO  40           HA       PRO  40  14.879   1.224  -7.327
  331    HB2  PRO  40           HB2      PRO  40  15.812   3.415  -5.576
  332    HB3  PRO  40           HB1      PRO  40  16.327   3.028  -7.226
  333    HG2  PRO  40           HG2      PRO  40  14.667   5.221  -6.450
  334    HG3  PRO  40           HG1      PRO  40  14.985   4.682  -8.106
  335    HD2  PRO  40           HD2      PRO  40  12.502   4.403  -6.572
  336    HD3  PRO  40           HD1      PRO  40  12.787   3.994  -8.279
  337    H    ARG  41           HN       ARG  41  15.569  -0.304  -5.875
  338    HA   ARG  41           HA       ARG  41  14.115  -0.771  -3.446
  339    HB2  ARG  41           HB2      ARG  41  15.996  -2.447  -2.986
  340    HB3  ARG  41           HB1      ARG  41  15.175  -2.658  -4.535
  341    HG2  ARG  41           HG2      ARG  41  16.962  -1.462  -5.685
  342    HG3  ARG  41           HG1      ARG  41  17.771  -1.134  -4.157
  343    HD2  ARG  41           HD2      ARG  41  17.918  -3.627  -3.796
  344    HD3  ARG  41           HD1      ARG  41  17.310  -3.855  -5.431
  345    HE   ARG  41           HE       ARG  41  20.020  -3.237  -4.643
  346   HH11  ARG  41          HH21      ARG  41  17.667  -2.447  -7.049
  347   HH12  ARG  41          HH22      ARG  41  18.834  -1.785  -8.142
  348   HH21  ARG  41          HH11      ARG  41  21.533  -2.396  -6.062
  349   HH22  ARG  41          HH12      ARG  41  21.016  -1.759  -7.588
  350    H    GLY  42           HN       GLY  42  17.114   0.952  -4.131
  351    HA2  GLY  42           HA2      GLY  42  18.008   1.135  -1.381
  352    HA3  GLY  42           HA1      GLY  42  18.521   2.226  -2.672
  353    H    GLN  43           HN       GLN  43  15.869   3.214  -3.353
  354    HA   GLN  43           HA       GLN  43  15.600   5.222  -1.256
  355    HB2  GLN  43           HB2      GLN  43  15.243   5.606  -3.763
  356    HB3  GLN  43           HB1      GLN  43  13.726   4.723  -3.600
  357    HG2  GLN  43           HG2      GLN  43  13.193   7.060  -3.395
  358    HG3  GLN  43           HG1      GLN  43  13.073   6.370  -1.777
  359   HE21  GLN  43          HE21      GLN  43  14.353   7.327  -0.163
  360   HE22  GLN  43          HE22      GLN  43  15.587   8.455  -0.462
  361    H    THR  44           HN       THR  44  13.836   2.320  -2.231
  362    HA   THR  44           HA       THR  44  11.540   2.836  -0.530
  363    HB   THR  44           HB       THR  44  12.491   0.209  -1.701
  364    HG1  THR  44           HG1      THR  44  10.695   2.137  -2.740
  365   HG21  THR  44          HG21      THR  44   9.766   1.151  -0.760
  366   HG22  THR  44          HG22      THR  44  10.768  -0.073   0.019
  367   HG23  THR  44          HG23      THR  44  10.080  -0.380  -1.574
  368    H    GLU  45           HN       GLU  45  14.372   0.631  -0.205
  369    HA   GLU  45           HA       GLU  45  13.608  -0.441   2.315
  370    HB2  GLU  45           HB2      GLU  45  15.945  -1.096   2.588
  371    HB3  GLU  45           HB1      GLU  45  15.501  -1.301   0.892
  372    HG2  GLU  45           HG2      GLU  45  16.479   1.019   0.485
  373    HG3  GLU  45           HG1      GLU  45  17.126   0.946   2.122
  374    H    LYS  46           HN       LYS  46  15.473   2.531   1.556
  375    HA   LYS  46           HA       LYS  46  15.927   3.190   4.346
  376    HB2  LYS  46           HB2      LYS  46  17.304   4.052   2.425
  377    HB3  LYS  46           HB1      LYS  46  15.931   5.050   1.946
  378    HG2  LYS  46           HG2      LYS  46  15.992   6.251   4.054
  379    HG3  LYS  46           HG1      LYS  46  17.236   5.170   4.682
  380    HD2  LYS  46           HD2      LYS  46  18.812   5.943   2.979
  381    HD3  LYS  46           HD1      LYS  46  17.567   6.964   2.259
  382    HE2  LYS  46           HE2      LYS  46  17.388   8.202   4.420
  383    HE3  LYS  46           HE1      LYS  46  18.720   7.234   5.051
  384    HZ1  LYS  46           HZ1      LYS  46  18.749   9.378   3.082
  385    HZ2  LYS  46           HZ2      LYS  46  19.798   8.074   2.792
  386    HZ3  LYS  46           HZ3      LYS  46  19.911   8.954   4.241
  387    H    ALA  47           HN       ALA  47  13.217   3.456   2.240
  388    HA   ALA  47           HA       ALA  47  11.966   5.762   3.455
  389    HB1  ALA  47           HB1      ALA  47   9.995   5.104   2.229
  390    HB2  ALA  47           HB2      ALA  47  10.584   3.454   2.056
  391    HB3  ALA  47           HB3      ALA  47  11.383   4.769   1.199
  392    H    ASP  48           HN       ASP  48  10.983   5.879   5.408
  393    HA   ASP  48           HA       ASP  48  10.747   3.483   7.099
  394    HB2  ASP  48           HB2      ASP  48   9.859   5.151   8.773
  395    HB3  ASP  48           HB1      ASP  48  11.453   5.556   8.136
  396    H    HIS  49           HN       HIS  49   8.589   3.186   8.330
  397    HA   HIS  49           HA       HIS  49   6.549   2.376   6.606
  398    HB2  HIS  49           HB2      HIS  49   6.298   3.306   9.476
  399    HB3  HIS  49           HB1      HIS  49   5.068   2.394   8.604
  400    HD1  HIS  49           HD1      HIS  49   8.083   1.968  10.612
  401    HD2  HIS  49           HD2      HIS  49   6.095  -0.258   7.702
  402    HE1  HIS  49           HE1      HIS  49   8.975  -0.395  10.785
  403    H    VAL  50           HN       VAL  50   6.714   5.509   8.353
  404    HA   VAL  50           HA       VAL  50   4.230   6.489   7.221
  405    HB   VAL  50           HB       VAL  50   6.631   8.027   8.312
  406   HG11  VAL  50          HG11      VAL  50   4.913   9.856   8.670
  407   HG12  VAL  50          HG12      VAL  50   3.797   8.922   7.677
  408   HG13  VAL  50          HG13      VAL  50   5.292   9.542   6.978
  409   HG21  VAL  50          HG21      VAL  50   4.036   7.125   9.621
  410   HG22  VAL  50          HG22      VAL  50   5.200   8.222  10.361
  411   HG23  VAL  50          HG23      VAL  50   5.661   6.561  10.008
  412    H    ASP  51           HN       ASP  51   7.623   6.694   6.196
  413    HA   ASP  51           HA       ASP  51   7.105   8.517   4.009
  414    HB2  ASP  51           HB2      ASP  51   9.351   8.271   4.981
  415    HB3  ASP  51           HB1      ASP  51   9.402   6.588   4.464
  416    H    LEU  52           HN       LEU  52   7.251   4.958   4.251
  417    HA   LEU  52           HA       LEU  52   7.170   4.371   1.492
  418    HB2  LEU  52           HB2      LEU  52   6.092   2.927   3.913
  419    HB3  LEU  52           HB1      LEU  52   5.820   2.263   2.307
  420    HG   LEU  52           HG       LEU  52   8.600   2.994   3.293
  421   HD11  LEU  52          HD11      LEU  52   7.094   0.379   3.600
  422   HD12  LEU  52          HD12      LEU  52   7.808   1.362   4.875
  423   HD13  LEU  52          HD13      LEU  52   8.848   0.505   3.744
  424   HD21  LEU  52          HD21      LEU  52   8.619   2.672   0.914
  425   HD22  LEU  52          HD22      LEU  52   7.510   1.310   1.006
  426   HD23  LEU  52          HD23      LEU  52   9.169   1.137   1.567
  427    H    ALA  53           HN       ALA  53   4.403   4.819   3.725
  428    HA   ALA  53           HA       ALA  53   2.390   4.585   1.693
  429    HB1  ALA  53           HB1      ALA  53   0.910   5.675   3.324
  430    HB2  ALA  53           HB2      ALA  53   2.305   6.182   4.275
  431    HB3  ALA  53           HB3      ALA  53   1.914   4.468   4.129
  432    H    THR  54           HN       THR  54   4.453   7.244   2.694
  433    HA   THR  54           HA       THR  54   2.921   9.343   1.404
  434    HB   THR  54           HB       THR  54   5.876   9.269   2.095
  435    HG1  THR  54           HG1      THR  54   3.735  10.357   3.584
  436   HG21  THR  54          HG21      THR  54   5.390  11.103   0.593
  437   HG22  THR  54          HG22      THR  54   5.554  11.760   2.221
  438   HG23  THR  54          HG23      THR  54   3.953  11.540   1.519
  439    H    LEU  55           HN       LEU  55   5.510   7.160   0.332
  440    HA   LEU  55           HA       LEU  55   6.010   8.571  -2.159
  441    HB2  LEU  55           HB2      LEU  55   6.610   5.676  -1.455
  442    HB3  LEU  55           HB1      LEU  55   7.213   6.522  -2.869
  443    HG   LEU  55           HG       LEU  55   7.772   7.517  -0.053
  444   HD11  LEU  55          HD11      LEU  55   9.980   6.402  -0.245
  445   HD12  LEU  55          HD12      LEU  55   9.453   5.643  -1.747
  446   HD13  LEU  55          HD13      LEU  55   8.658   5.234  -0.228
  447   HD21  LEU  55          HD21      LEU  55   9.001   8.049  -2.781
  448   HD22  LEU  55          HD22      LEU  55   9.772   8.535  -1.272
  449   HD23  LEU  55          HD23      LEU  55   8.211   9.209  -1.715
  450    H    MET  56           HN       MET  56   3.855   5.978  -1.142
  451    HA   MET  56           HA       MET  56   3.060   5.175  -3.789
  452    HB2  MET  56           HB2      MET  56   1.683   4.980  -1.094
  453    HB3  MET  56           HB1      MET  56   0.974   4.316  -2.564
  454    HG2  MET  56           HG2      MET  56   2.905   2.860  -2.894
  455    HG3  MET  56           HG1      MET  56   3.731   3.586  -1.517
  456    HE1  MET  56           HE1      MET  56   1.519   0.901  -2.814
  457    HE2  MET  56           HE2      MET  56   0.224   2.048  -2.480
  458    HE3  MET  56           HE3      MET  56   0.323   0.550  -1.559
  459    H    ILE  57           HN       ILE  57   1.689   7.593  -1.530
  460    HA   ILE  57           HA       ILE  57  -0.438   8.281  -3.450
  461    HB   ILE  57           HB       ILE  57  -0.959  10.141  -1.860
  462   HG12  ILE  57          HG12      ILE  57   1.409   8.981  -0.367
  463   HG13  ILE  57          HG11      ILE  57   1.288  10.602  -1.033
  464   HG21  ILE  57          HG21      ILE  57  -1.849   7.747  -1.619
  465   HG22  ILE  57          HG22      ILE  57  -1.874   8.724  -0.156
  466   HG23  ILE  57          HG23      ILE  57  -0.620   7.511  -0.379
  467   HD11  ILE  57          HD11      ILE  57  -0.260   9.444   1.294
  468   HD12  ILE  57          HD12      ILE  57  -0.740  10.940   0.491
  469   HD13  ILE  57          HD13      ILE  57   0.825  10.833   1.297
  470    H    ASP  58           HN       ASP  58   2.640   9.763  -2.466
  471    HA   ASP  58           HA       ASP  58   2.240  12.105  -4.154
  472    HB2  ASP  58           HB2      ASP  58   4.697  10.956  -2.782
  473    HB3  ASP  58           HB1      ASP  58   4.701  12.492  -3.650
  474    H    PHE  59           HN       PHE  59   4.139   9.080  -4.536
  475    HA   PHE  59           HA       PHE  59   5.227   9.947  -7.100
  476    HB2  PHE  59           HB2      PHE  59   6.242   8.263  -5.426
  477    HB3  PHE  59           HB1      PHE  59   5.129   7.081  -6.107
  478    HD1  PHE  59           HD2      PHE  59   5.288   6.428  -8.503
  479    HD2  PHE  59           HD1      PHE  59   8.157   9.065  -6.694
  480    HE1  PHE  59           HE2      PHE  59   6.829   6.062 -10.411
  481    HE2  PHE  59           HE1      PHE  59   9.697   8.699  -8.601
  482    HZ   PHE  59           HZ       PHE  59   9.033   7.197 -10.458
  483    H    ASN  60           HN       ASN  60   2.577   7.654  -6.204
  484    HA   ASN  60           HA       ASN  60   1.965   7.293  -9.116
  485    HB2  ASN  60           HB2      ASN  60   0.792   5.949  -6.653
  486    HB3  ASN  60           HB1      ASN  60   0.419   5.524  -8.321
  487   HD21  ASN  60          HD21      ASN  60   1.427   3.487  -8.530
  488   HD22  ASN  60          HD22      ASN  60   3.073   3.207  -8.224
  489    H    GLY  61           HN       GLY  61   0.719   8.815  -6.219
  490    HA2  GLY  61           HA2      GLY  61  -0.752  10.812  -6.613
  491    HA3  GLY  61           HA1      GLY  61  -1.665   9.832  -7.759
  492    H    GLU  62           HN       GLU  62  -2.788  11.095  -5.435
  493    HA   GLU  62           HA       GLU  62  -3.057   9.231  -3.263
  494    HB2  GLU  62           HB2      GLU  62  -3.589  11.615  -2.995
  495    HB3  GLU  62           HB1      GLU  62  -4.908  11.471  -4.154
  496    HG2  GLU  62           HG2      GLU  62  -6.138   9.990  -2.690
  497    HG3  GLU  62           HG1      GLU  62  -4.767   9.853  -1.592
  498    H    GLU  63           HN       GLU  63  -5.070   9.858  -6.151
  499    HA   GLU  63           HA       GLU  63  -7.047   7.860  -5.458
  500    HB2  GLU  63           HB2      GLU  63  -6.360   9.143  -8.123
  501    HB3  GLU  63           HB1      GLU  63  -7.771   8.128  -7.836
  502    HG2  GLU  63           HG2      GLU  63  -8.485  10.425  -7.646
  503    HG3  GLU  63           HG1      GLU  63  -8.466   9.751  -6.020
  504    H    LYS  64           HN       LYS  64  -4.291   7.859  -7.744
  505    HA   LYS  64           HA       LYS  64  -4.684   5.213  -8.686
  506    HB2  LYS  64           HB2      LYS  64  -3.087   6.971  -9.628
  507    HB3  LYS  64           HB1      LYS  64  -1.982   6.543  -8.328
  508    HG2  LYS  64           HG2      LYS  64  -1.210   5.138 -10.048
  509    HG3  LYS  64           HG1      LYS  64  -2.324   4.061  -9.214
  510    HD2  LYS  64           HD2      LYS  64  -4.081   4.574 -10.866
  511    HD3  LYS  64           HD1      LYS  64  -3.009   5.722 -11.666
  512    HE2  LYS  64           HE2      LYS  64  -2.941   3.631 -12.890
  513    HE3  LYS  64           HE1      LYS  64  -1.395   3.843 -12.067
  514    HZ1  LYS  64           HZ1      LYS  64  -1.960   2.291 -10.447
  515    HZ2  LYS  64           HZ2      LYS  64  -2.530   1.589 -11.886
  516    HZ3  LYS  64           HZ3      LYS  64  -3.614   2.345 -10.818
  517    H    ALA  65           HN       ALA  65  -2.940   6.390  -5.814
  518    HA   ALA  65           HA       ALA  65  -1.743   3.896  -5.114
  519    HB1  ALA  65           HB1      ALA  65  -2.630   6.221  -3.390
  520    HB2  ALA  65           HB2      ALA  65  -1.015   5.920  -4.033
  521    HB3  ALA  65           HB3      ALA  65  -1.677   4.861  -2.789
  522    H    TRP  66           HN       TRP  66  -4.938   5.257  -4.243
  523    HA   TRP  66           HA       TRP  66  -5.663   3.185  -2.428
  524    HB2  TRP  66           HB2      TRP  66  -7.261   5.092  -4.158
  525    HB3  TRP  66           HB1      TRP  66  -8.098   3.847  -3.232
  526    HD1  TRP  66           HD1      TRP  66  -7.084   7.299  -2.901
  527    HE1  TRP  66           HE1      TRP  66  -6.929   8.027  -0.434
  528    HE3  TRP  66           HE3      TRP  66  -7.157   2.723  -0.629
  529    HZ2  TRP  66           HZ2      TRP  66  -6.856   6.832   2.159
  530    HZ3  TRP  66           HZ3      TRP  66  -7.046   2.552   1.860
  531    HH2  TRP  66           HH2      TRP  66  -6.897   4.600   3.242
  532    H    ALA  67           HN       ALA  67  -5.867   3.330  -5.969
  533    HA   ALA  67           HA       ALA  67  -7.437   0.928  -6.254
  534    HB1  ALA  67           HB1      ALA  67  -7.185   2.586  -8.074
  535    HB2  ALA  67           HB2      ALA  67  -6.693   0.977  -8.604
  536    HB3  ALA  67           HB3      ALA  67  -5.473   2.184  -8.199
  537    H    MET  68           HN       MET  68  -3.936   1.530  -6.145
  538    HA   MET  68           HA       MET  68  -3.255  -1.265  -6.678
  539    HB2  MET  68           HB2      MET  68  -1.685   1.149  -5.725
  540    HB3  MET  68           HB1      MET  68  -0.946  -0.449  -5.800
  541    HG2  MET  68           HG2      MET  68  -1.281  -0.593  -8.173
  542    HG3  MET  68           HG1      MET  68  -2.332   0.822  -8.181
  543    HE1  MET  68           HE1      MET  68   1.203   0.579  -6.094
  544    HE2  MET  68           HE2      MET  68   2.183   0.603  -7.557
  545    HE3  MET  68           HE3      MET  68   0.968  -0.654  -7.341
  546    H    ALA  69           HN       ALA  69  -3.814   0.729  -3.840
  547    HA   ALA  69           HA       ALA  69  -2.722  -1.070  -1.892
  548    HB1  ALA  69           HB1      ALA  69  -4.008   0.248  -0.267
  549    HB2  ALA  69           HB2      ALA  69  -4.970   0.945  -1.570
  550    HB3  ALA  69           HB3      ALA  69  -3.252   1.324  -1.444
  551    H    VAL  70           HN       VAL  70  -6.042  -0.685  -3.175
  552    HA   VAL  70           HA       VAL  70  -7.104  -2.809  -1.465
  553    HB   VAL  70           HB       VAL  70  -9.147  -2.572  -2.808
  554   HG11  VAL  70          HG11      VAL  70  -7.767   0.035  -2.089
  555   HG12  VAL  70          HG12      VAL  70  -8.798  -0.939  -1.041
  556   HG13  VAL  70          HG13      VAL  70  -9.491  -0.104  -2.432
  557   HG21  VAL  70          HG21      VAL  70  -8.273  -2.308  -5.042
  558   HG22  VAL  70          HG22      VAL  70  -7.359  -0.875  -4.579
  559   HG23  VAL  70          HG23      VAL  70  -9.118  -0.810  -4.657
  560    H    TRP  71           HN       TRP  71  -6.026  -2.642  -4.863
  561    HA   TRP  71           HA       TRP  71  -6.853  -5.323  -5.499
  562    HB2  TRP  71           HB2      TRP  71  -6.358  -3.607  -7.238
  563    HB3  TRP  71           HB1      TRP  71  -4.651  -3.672  -6.802
  564    HD1  TRP  71           HD1      TRP  71  -7.361  -5.603  -8.611
  565    HE1  TRP  71           HE1      TRP  71  -6.296  -7.605  -9.840
  566    HE3  TRP  71           HE3      TRP  71  -2.636  -5.392  -6.702
  567    HZ2  TRP  71           HZ2      TRP  71  -3.768  -8.940  -9.991
  568    HZ3  TRP  71           HZ3      TRP  71  -0.919  -7.034  -7.400
  569    HH2  TRP  71           HH2      TRP  71  -1.477  -8.808  -9.042
  570    H    ILE  72           HN       ILE  72  -3.924  -4.029  -3.963
  571    HA   ILE  72           HA       ILE  72  -2.432  -6.529  -4.310
  572    HB   ILE  72           HB       ILE  72  -1.989  -4.069  -2.579
  573   HG12  ILE  72          HG12      ILE  72  -0.312  -5.309  -4.789
  574   HG13  ILE  72          HG11      ILE  72  -1.512  -4.056  -5.075
  575   HG21  ILE  72          HG21      ILE  72  -0.416  -6.665  -2.594
  576   HG22  ILE  72          HG22      ILE  72  -1.118  -5.842  -1.202
  577   HG23  ILE  72          HG23      ILE  72   0.269  -5.143  -2.027
  578   HD11  ILE  72          HD11      ILE  72   0.840  -3.194  -4.849
  579   HD12  ILE  72          HD12      ILE  72   0.827  -3.731  -3.171
  580   HD13  ILE  72          HD13      ILE  72  -0.292  -2.476  -3.705
  581    H    PHE  73           HN       PHE  73  -4.449  -5.197  -1.616
  582    HA   PHE  73           HA       PHE  73  -3.873  -7.262   0.245
  583    HB2  PHE  73           HB2      PHE  73  -6.629  -6.053  -0.092
  584    HB3  PHE  73           HB1      PHE  73  -5.895  -6.665   1.383
  585    HD1  PHE  73           HD1      PHE  73  -3.094  -5.274   0.962
  586    HD2  PHE  73           HD2      PHE  73  -7.154  -3.854   0.703
  587    HE1  PHE  73           HE1      PHE  73  -2.342  -2.998   1.522
  588    HE2  PHE  73           HE2      PHE  73  -6.377  -1.572   1.260
  589    HZ   PHE  73           HZ       PHE  73  -3.974  -1.146   1.674
  590    H    ALA  74           HN       ALA  74  -6.413  -7.193  -2.289
  591    HA   ALA  74           HA       ALA  74  -7.475  -9.772  -1.677
  592    HB1  ALA  74           HB1      ALA  74  -7.316  -8.362  -4.364
  593    HB2  ALA  74           HB2      ALA  74  -8.610  -8.166  -3.182
  594    HB3  ALA  74           HB3      ALA  74  -8.374  -9.720  -3.983
  595    H    ALA  75           HN       ALA  75  -4.599  -8.792  -3.433
  596    HA   ALA  75           HA       ALA  75  -4.165 -11.279  -4.812
  597    HB1  ALA  75           HB1      ALA  75  -3.034  -9.078  -5.334
  598    HB2  ALA  75           HB2      ALA  75  -1.932 -10.451  -5.233
  599    HB3  ALA  75           HB3      ALA  75  -2.046  -9.311  -3.892
  600    H    ILE  76           HN       ILE  76  -2.886 -10.041  -1.696
  601    HA   ILE  76           HA       ILE  76  -1.503 -12.571  -1.159
  602    HB   ILE  76           HB       ILE  76  -1.138 -11.514   1.138
  603   HG12  ILE  76          HG12      ILE  76  -2.393  -9.091  -0.205
  604   HG13  ILE  76          HG11      ILE  76  -3.210 -10.075   1.004
  605   HG21  ILE  76          HG21      ILE  76  -0.332  -9.876  -1.293
  606   HG22  ILE  76          HG22      ILE  76   0.497 -11.318  -0.709
  607   HG23  ILE  76          HG23      ILE  76   0.472  -9.859   0.277
  608   HD11  ILE  76          HD11      ILE  76  -1.230  -9.608   2.552
  609   HD12  ILE  76          HD12      ILE  76  -2.248  -8.219   2.184
  610   HD13  ILE  76          HD13      ILE  76  -0.699  -8.414   1.366
  611    H    ASN  77           HN       ASN  77  -4.555 -12.353  -1.497
  612    HA   ASN  77           HA       ASN  77  -6.436 -13.396  -0.618
  613    HB2  ASN  77           HB2      ASN  77  -4.404 -14.991   0.990
  614    HB3  ASN  77           HB1      ASN  77  -6.069 -15.460   0.659
  615   HD21  ASN  77          HD21      ASN  77  -6.629 -15.890  -1.664
  616   HD22  ASN  77          HD22      ASN  77  -5.407 -16.383  -2.735
  617    H    ARG  78           HN       ARG  78  -6.519 -11.132   0.452
  618    HA   ARG  78           HA       ARG  78  -7.020 -11.539   3.370
  619    HB2  ARG  78           HB2      ARG  78  -5.421  -9.297   2.091
  620    HB3  ARG  78           HB1      ARG  78  -6.158  -9.121   3.680
  621    HG2  ARG  78           HG2      ARG  78  -4.461 -11.574   3.235
  622    HG3  ARG  78           HG1      ARG  78  -3.616 -10.037   3.359
  623    HD2  ARG  78           HD2      ARG  78  -4.015 -11.397   5.549
  624    HD3  ARG  78           HD1      ARG  78  -4.338  -9.663   5.577
  625    HE   ARG  78           HE       ARG  78  -6.793 -10.709   4.922
  626   HH11  ARG  78          HH21      ARG  78  -4.440 -11.326   7.371
  627   HH12  ARG  78          HH22      ARG  78  -5.608 -11.804   8.557
  628   HH21  ARG  78          HH11      ARG  78  -8.327 -11.333   6.459
  629   HH22  ARG  78          HH12      ARG  78  -7.806 -11.808   8.041
  630    H    ARG  79           HN       ARG  79  -8.896 -11.727   1.401
  631    HA   ARG  79           HA       ARG  79 -10.221  -9.509   0.403
  632    HB2  ARG  79           HB2      ARG  79 -11.541 -11.901   1.717
  633    HB3  ARG  79           HB1      ARG  79 -12.301 -10.815   0.556
  634    HG2  ARG  79           HG2      ARG  79  -9.841 -12.503   0.008
  635    HG3  ARG  79           HG1      ARG  79 -11.473 -12.921  -0.500
  636    HD2  ARG  79           HD2      ARG  79 -11.354 -10.449  -1.590
  637    HD3  ARG  79           HD1      ARG  79  -9.633 -10.816  -1.603
  638    HE   ARG  79           HE       ARG  79 -11.551 -11.811  -3.443
  639   HH11  ARG  79          HH21      ARG  79  -9.005 -12.996  -1.430
  640   HH12  ARG  79          HH22      ARG  79  -8.857 -14.489  -2.287
  641   HH21  ARG  79          HH11      ARG  79 -11.343 -13.734  -4.574
  642   HH22  ARG  79          HH12      ARG  79 -10.169 -14.904  -4.070
  643    H    ASP  80           HN       ASP  80 -10.084 -10.504   3.777
  644    HA   ASP  80           HA       ASP  80 -12.292  -9.109   4.833
  645    HB2  ASP  80           HB2      ASP  80 -10.942  -8.931   6.933
  646    HB3  ASP  80           HB1      ASP  80 -10.862 -10.548   6.228
  647    H    LEU  81           HN       LEU  81  -9.142  -7.865   3.812
  648    HA   LEU  81           HA       LEU  81  -9.588  -5.195   4.864
  649    HB2  LEU  81           HB2      LEU  81  -7.485  -6.609   3.347
  650    HB3  LEU  81           HB1      LEU  81  -7.686  -4.963   2.761
  651    HG   LEU  81           HG       LEU  81  -7.388  -5.572   5.725
  652   HD11  LEU  81          HD11      LEU  81  -5.402  -6.482   4.633
  653   HD12  LEU  81          HD12      LEU  81  -4.979  -4.977   5.443
  654   HD13  LEU  81          HD13      LEU  81  -5.205  -5.002   3.695
  655   HD21  LEU  81          HD21      LEU  81  -6.886  -3.098   4.029
  656   HD22  LEU  81          HD22      LEU  81  -6.575  -3.215   5.760
  657   HD23  LEU  81          HD23      LEU  81  -8.223  -3.324   5.155
  658    H    TYR  82           HN       TYR  82 -10.525  -6.856   1.912
  659    HA   TYR  82           HA       TYR  82 -11.018  -4.487   0.344
  660    HB2  TYR  82           HB2      TYR  82 -10.843  -6.693  -0.708
  661    HB3  TYR  82           HB1      TYR  82 -12.262  -7.254   0.171
  662    HD1  TYR  82           HD1      TYR  82 -11.057  -4.914  -2.442
  663    HD2  TYR  82           HD2      TYR  82 -14.499  -6.651  -0.547
  664    HE1  TYR  82           HE1      TYR  82 -12.506  -4.003  -4.237
  665    HE2  TYR  82           HE2      TYR  82 -15.946  -5.741  -2.342
  666    HH   TYR  82           HH       TYR  82 -15.288  -3.381  -4.215
  667    H    GLU  83           HN       GLU  83 -12.948  -6.288   2.709
  668    HA   GLU  83           HA       GLU  83 -15.413  -4.857   2.151
  669    HB2  GLU  83           HB2      GLU  83 -14.524  -6.466   4.566
  670    HB3  GLU  83           HB1      GLU  83 -16.156  -5.840   4.328
  671    HG2  GLU  83           HG2      GLU  83 -16.355  -7.123   2.236
  672    HG3  GLU  83           HG1      GLU  83 -14.716  -7.737   2.449
  673    H    LYS  84           HN       LYS  84 -12.886  -4.532   4.667
  674    HA   LYS  84           HA       LYS  84 -14.181  -2.247   5.906
  675    HB2  LYS  84           HB2      LYS  84 -12.559  -3.860   7.025
  676    HB3  LYS  84           HB1      LYS  84 -11.273  -3.065   6.127
  677    HG2  LYS  84           HG2      LYS  84 -11.221  -1.874   8.158
  678    HG3  LYS  84           HG1      LYS  84 -12.257  -0.842   7.179
  679    HD2  LYS  84           HD2      LYS  84 -14.257  -1.808   8.216
  680    HD3  LYS  84           HD1      LYS  84 -13.270  -2.963   9.109
  681    HE2  LYS  84           HE2      LYS  84 -12.150  -1.103  10.279
  682    HE3  LYS  84           HE1      LYS  84 -13.142   0.053   9.390
  683    HZ1  LYS  84           HZ1      LYS  84 -15.010  -0.517  10.537
  684    HZ2  LYS  84           HZ2      LYS  84 -13.848  -0.790  11.745
  685    HZ3  LYS  84           HZ3      LYS  84 -14.483  -2.096  10.862
  686    H    ALA  85           HN       ALA  85 -11.242  -2.566   3.878
  687    HA   ALA  85           HA       ALA  85 -10.602   0.163   3.691
  688    HB1  ALA  85           HB1      ALA  85  -9.424  -0.393   1.623
  689    HB2  ALA  85           HB2      ALA  85 -10.336  -1.894   1.478
  690    HB3  ALA  85           HB3      ALA  85  -9.189  -1.685   2.800
  691    H    LYS  86           HN       LYS  86 -12.893  -1.711   1.711
  692    HA   LYS  86           HA       LYS  86 -13.557   0.534   0.001
  693    HB2  LYS  86           HB2      LYS  86 -13.944  -1.887  -0.625
  694    HB3  LYS  86           HB1      LYS  86 -15.261  -1.931   0.551
  695    HG2  LYS  86           HG2      LYS  86 -16.431  -0.142  -0.637
  696    HG3  LYS  86           HG1      LYS  86 -15.091   0.009  -1.775
  697    HD2  LYS  86           HD2      LYS  86 -15.455  -2.330  -2.502
  698    HD3  LYS  86           HD1      LYS  86 -16.818  -2.454  -1.389
  699    HE2  LYS  86           HE2      LYS  86 -17.613  -1.943  -3.659
  700    HE3  LYS  86           HE1      LYS  86 -17.944  -0.595  -2.572
  701    HZ1  LYS  86           HZ1      LYS  86 -15.450  -0.687  -4.141
  702    HZ2  LYS  86           HZ2      LYS  86 -16.237   0.658  -3.466
  703    HZ3  LYS  86           HZ3      LYS  86 -16.884  -0.109  -4.837
  704    H    ARG  87           HN       ARG  87 -14.695  -0.576   3.150
  705    HA   ARG  87           HA       ARG  87 -17.075   1.190   3.057
  706    HB2  ARG  87           HB2      ARG  87 -17.138  -1.025   4.198
  707    HB3  ARG  87           HB1      ARG  87 -15.943  -0.436   5.354
  708    HG2  ARG  87           HG2      ARG  87 -17.454   1.276   6.152
  709    HG3  ARG  87           HG1      ARG  87 -18.615   0.918   4.874
  710    HD2  ARG  87           HD2      ARG  87 -19.211  -0.082   7.108
  711    HD3  ARG  87           HD1      ARG  87 -19.070  -1.264   5.807
  712    HE   ARG  87           HE       ARG  87 -16.531  -1.195   6.938
  713   HH11  ARG  87          HH21      ARG  87 -19.762  -1.691   8.054
  714   HH12  ARG  87          HH22      ARG  87 -19.292  -2.747   9.344
  715   HH21  ARG  87          HH11      ARG  87 -15.907  -2.569   8.614
  716   HH22  ARG  87          HH12      ARG  87 -17.112  -3.244   9.661
  717    H    ASP  88           HN       ASP  88 -13.798   1.251   4.321
  718    HA   ASP  88           HA       ASP  88 -14.354   3.698   5.937
  719    HB2  ASP  88           HB2      ASP  88 -12.926   1.808   6.842
  720    HB3  ASP  88           HB1      ASP  88 -11.740   2.187   5.593
  721    H    GLU  89           HN       GLU  89 -13.575   3.006   2.757
  722    HA   GLU  89           HA       GLU  89 -11.453   4.744   2.159
  723    HB2  GLU  89           HB2      GLU  89 -12.124   4.625  -0.115
  724    HB3  GLU  89           HB1      GLU  89 -12.697   3.133   0.606
  725    HG2  GLU  89           HG2      GLU  89 -14.568   3.833  -0.642
  726    HG3  GLU  89           HG1      GLU  89 -14.955   4.424   0.966
  727    HA   PRO  90           HA       PRO  90 -13.512   8.579   3.457
  728    HB2  PRO  90           HB2      PRO  90 -11.541  10.331   2.293
  729    HB3  PRO  90           HB1      PRO  90 -11.640   9.826   3.986
  730    HG2  PRO  90           HG2      PRO  90  -9.717   8.948   1.946
  731    HG3  PRO  90           HG1      PRO  90  -9.700   8.615   3.685
  732    HD2  PRO  90           HD2      PRO  90 -10.372   6.762   1.582
  733    HD3  PRO  90           HD1      PRO  90 -10.495   6.481   3.335
  734    H    LYS  91           HN       LYS  91 -14.837  10.126   2.378
  735    HA   LYS  91           HA       LYS  91 -16.157  10.897   0.596
  736    HB2  LYS  91           HB2      LYS  91 -13.628  10.645  -1.063
  737    HB3  LYS  91           HB1      LYS  91 -14.965  11.771  -1.294
  738    HG2  LYS  91           HG2      LYS  91 -13.018  11.745   1.035
  739    HG3  LYS  91           HG1      LYS  91 -13.065  12.922  -0.276
  740    HD2  LYS  91           HD2      LYS  91 -15.506  13.395   0.475
  741    HD3  LYS  91           HD1      LYS  91 -15.091  12.513   1.945
  742    HE2  LYS  91           HE2      LYS  91 -13.184  14.086   2.308
  743    HE3  LYS  91           HE1      LYS  91 -13.711  15.005   0.897
  744    HZ1  LYS  91           HZ1      LYS  91 -15.949  15.093   2.082
  745    HZ2  LYS  91           HZ2      LYS  91 -14.701  16.079   2.683
  746    HZ3  LYS  91           HZ3      LYS  91 -15.100  14.630   3.475
  Start of MODEL   16
    1    H1   MET   1           HT1      MET   1  -9.373  16.001  14.186
    2    H2   MET   1           HT2      MET   1 -10.814  16.015  13.285
    3    H3   MET   1           HT3      MET   1 -10.053  17.477  13.700
    4    HA   MET   1           HA       MET   1  -9.776  16.532  11.323
    5    HB2  MET   1           HB2      MET   1  -7.483  17.502  11.255
    6    HB3  MET   1           HB1      MET   1  -8.612  18.522  12.147
    7    HG2  MET   1           HG2      MET   1  -7.798  17.450  14.273
    8    HG3  MET   1           HG1      MET   1  -6.571  16.612  13.323
    9    HE1  MET   1           HE1      MET   1  -4.520  19.274  15.200
   10    HE2  MET   1           HE2      MET   1  -5.025  17.591  15.077
   11    HE3  MET   1           HE3      MET   1  -6.088  18.768  15.842
   12    H    ALA   2           HN       ALA   2  -8.134  15.268  10.114
   13    HA   ALA   2           HA       ALA   2  -6.494  13.312  11.514
   14    HB1  ALA   2           HB1      ALA   2  -7.723  11.315  10.728
   15    HB2  ALA   2           HB2      ALA   2  -8.999  12.354  10.094
   16    HB3  ALA   2           HB3      ALA   2  -8.709  12.275  11.831
   17    H    SER   3           HN       SER   3  -4.756  13.470  10.173
   18    HA   SER   3           HA       SER   3  -4.982  14.094   7.355
   19    HB2  SER   3           HB2      SER   3  -2.962  14.560   8.875
   20    HB3  SER   3           HB1      SER   3  -2.576  12.846   8.740
   21    HG   SER   3           HG       SER   3  -2.642  13.197   6.415
   22    H    THR   4           HN       THR   4  -4.786  12.693   5.575
   23    HA   THR   4           HA       THR   4  -5.726   9.986   5.983
   24    HB   THR   4           HB       THR   4  -4.426  10.693   3.365
   25    HG1  THR   4           HG1      THR   4  -6.020  12.410   4.697
   26   HG21  THR   4          HG21      THR   4  -7.296   9.890   3.909
   27   HG22  THR   4          HG22      THR   4  -5.994   8.703   3.835
   28   HG23  THR   4          HG23      THR   4  -6.371   9.687   2.422
   29    H    ARG   5           HN       ARG   5  -2.562  11.455   5.441
   30    HA   ARG   5           HA       ARG   5  -1.044   9.154   4.827
   31    HB2  ARG   5           HB2      ARG   5  -0.171  11.457   6.598
   32    HB3  ARG   5           HB1      ARG   5   0.881  10.377   5.684
   33    HG2  ARG   5           HG2      ARG   5  -0.203  11.162   3.580
   34    HG3  ARG   5           HG1      ARG   5  -1.147  12.311   4.521
   35    HD2  ARG   5           HD2      ARG   5   1.356  12.958   5.407
   36    HD3  ARG   5           HD1      ARG   5   1.750  12.420   3.777
   37    HE   ARG   5           HE       ARG   5   0.622  14.927   4.449
   38   HH11  ARG   5          HH21      ARG   5   0.013  12.309   2.279
   39   HH12  ARG   5          HH22      ARG   5  -0.980  13.252   1.224
   40   HH21  ARG   5          HH11      ARG   5  -0.647  16.161   3.070
   41   HH22  ARG   5          HH12      ARG   5  -1.346  15.429   1.663
   42    H    CYS   6           HN       CYS   6  -2.103  10.401   7.979
   43    HA   CYS   6           HA       CYS   6  -0.659   8.489   9.560
   44    HB2  CYS   6           HB2      CYS   6  -1.611  10.532  10.540
   45    HB3  CYS   6           HB1      CYS   6  -3.239   9.965  10.168
   46    HG   CYS   6           HG       CYS   6  -2.362   7.800  11.769
   47    H    LYS   7           HN       LYS   7  -3.673   8.345   7.784
   48    HA   LYS   7           HA       LYS   7  -4.719   5.997   9.115
   49    HB2  LYS   7           HB2      LYS   7  -5.295   6.958   6.295
   50    HB3  LYS   7           HB1      LYS   7  -6.289   5.871   7.259
   51    HG2  LYS   7           HG2      LYS   7  -5.637   8.739   8.034
   52    HG3  LYS   7           HG1      LYS   7  -7.114   8.250   7.218
   53    HD2  LYS   7           HD2      LYS   7  -8.018   7.956   9.315
   54    HD3  LYS   7           HD1      LYS   7  -7.043   6.497   9.421
   55    HE2  LYS   7           HE2      LYS   7  -5.158   7.999  10.323
   56    HE3  LYS   7           HE1      LYS   7  -6.382   9.258  10.482
   57    HZ1  LYS   7           HZ1      LYS   7  -7.182   8.299  12.296
   58    HZ2  LYS   7           HZ2      LYS   7  -5.844   7.251  12.277
   59    HZ3  LYS   7           HZ3      LYS   7  -7.302   6.786  11.540
   60    H    LEU   8           HN       LEU   8  -3.024   6.414   5.959
   61    HA   LEU   8           HA       LEU   8  -2.887   3.640   5.301
   62    HB2  LEU   8           HB2      LEU   8  -1.128   6.020   4.658
   63    HB3  LEU   8           HB1      LEU   8  -0.637   4.412   4.133
   64    HG   LEU   8           HG       LEU   8  -2.806   4.146   2.958
   65   HD11  LEU   8          HD11      LEU   8  -4.264   5.561   4.244
   66   HD12  LEU   8          HD12      LEU   8  -4.172   6.267   2.633
   67   HD13  LEU   8          HD13      LEU   8  -3.246   6.974   3.959
   68   HD21  LEU   8          HD21      LEU   8  -2.347   5.852   1.179
   69   HD22  LEU   8          HD22      LEU   8  -0.898   4.993   1.704
   70   HD23  LEU   8          HD23      LEU   8  -1.208   6.634   2.275
   71    H    ALA   9           HN       ALA   9  -0.908   5.541   7.529
   72    HA   ALA   9           HA       ALA   9   1.129   3.540   7.915
   73    HB1  ALA   9           HB1      ALA   9   1.752   4.822   9.886
   74    HB2  ALA   9           HB2      ALA   9   0.195   5.650   9.883
   75    HB3  ALA   9           HB3      ALA   9   1.353   5.946   8.587
   76    H    ARG  10           HN       ARG  10  -2.040   4.094   9.322
   77    HA   ARG  10           HA       ARG  10  -1.712   2.180  11.488
   78    HB2  ARG  10           HB2      ARG  10  -4.132   3.526  10.253
   79    HB3  ARG  10           HB1      ARG  10  -4.265   2.386  11.592
   80    HG2  ARG  10           HG2      ARG  10  -2.870   3.791  13.001
   81    HG3  ARG  10           HG1      ARG  10  -2.549   4.890  11.658
   82    HD2  ARG  10           HD2      ARG  10  -4.320   5.764  13.182
   83    HD3  ARG  10           HD1      ARG  10  -4.922   5.495  11.545
   84    HE   ARG  10           HE       ARG  10  -5.461   3.109  12.865
   85   HH11  ARG  10          HH21      ARG  10  -6.130   6.461  13.369
   86   HH12  ARG  10          HH22      ARG  10  -7.626   6.171  14.193
   87   HH21  ARG  10          HH11      ARG  10  -7.408   2.721  13.937
   88   HH22  ARG  10          HH12      ARG  10  -8.348   4.057  14.514
   89    H    TYR  11           HN       TYR  11  -2.904   2.010   8.163
   90    HA   TYR  11           HA       TYR  11  -4.025  -0.664   8.478
   91    HB2  TYR  11           HB2      TYR  11  -3.431   1.127   6.106
   92    HB3  TYR  11           HB1      TYR  11  -3.940  -0.543   5.860
   93    HD1  TYR  11           HD2      TYR  11  -6.080  -1.340   6.957
   94    HD2  TYR  11           HD1      TYR  11  -5.065   2.812   6.626
   95    HE1  TYR  11           HE2      TYR  11  -8.454  -0.736   7.358
   96    HE2  TYR  11           HE1      TYR  11  -7.433   3.427   7.032
   97    HH   TYR  11           HH       TYR  11  -9.931   1.432   6.693
   98    H    LEU  12           HN       LEU  12  -1.089   0.533   6.779
   99    HA   LEU  12           HA       LEU  12  -0.085  -2.074   6.181
  100    HB2  LEU  12           HB2      LEU  12   1.640   0.354   6.793
  101    HB3  LEU  12           HB1      LEU  12   2.050  -1.015   5.764
  102    HG   LEU  12           HG       LEU  12  -0.320   0.803   5.086
  103   HD11  LEU  12          HD11      LEU  12   1.706   2.209   5.267
  104   HD12  LEU  12          HD12      LEU  12   1.180   2.049   3.592
  105   HD13  LEU  12          HD13      LEU  12   2.558   1.118   4.175
  106   HD21  LEU  12          HD21      LEU  12   0.275  -0.006   2.750
  107   HD22  LEU  12          HD22      LEU  12  -0.299  -1.274   3.823
  108   HD23  LEU  12          HD23      LEU  12   1.424  -1.120   3.488
  109    H    GLU  13           HN       GLU  13  -0.100  -0.238   9.134
  110    HA   GLU  13           HA       GLU  13   1.924  -1.947  10.444
  111    HB2  GLU  13           HB2      GLU  13   0.111   0.284  11.423
  112    HB3  GLU  13           HB1      GLU  13   1.054  -0.689  12.548
  113    HG2  GLU  13           HG2      GLU  13   3.129  -0.043  11.457
  114    HG3  GLU  13           HG1      GLU  13   2.248   0.831  10.208
  115    H    ASP  14           HN       ASP  14  -1.575  -1.855  10.103
  116    HA   ASP  14           HA       ASP  14  -2.170  -3.599  12.321
  117    HB2  ASP  14           HB2      ASP  14  -3.684  -3.003   9.754
  118    HB3  ASP  14           HB1      ASP  14  -4.324  -4.039  11.030
  119    H    LEU  15           HN       LEU  15  -0.329  -4.241   9.627
  120    HA   LEU  15           HA       LEU  15  -1.228  -7.101   9.387
  121    HB2  LEU  15           HB2      LEU  15   0.911  -5.676   7.778
  122    HB3  LEU  15           HB1      LEU  15   0.142  -7.217   7.414
  123    HG   LEU  15           HG       LEU  15  -1.139  -4.466   7.352
  124   HD11  LEU  15          HD11      LEU  15   0.267  -5.188   5.398
  125   HD12  LEU  15          HD12      LEU  15  -1.429  -4.937   4.981
  126   HD13  LEU  15          HD13      LEU  15  -0.806  -6.572   5.193
  127   HD21  LEU  15          HD21      LEU  15  -2.873  -5.867   8.212
  128   HD22  LEU  15          HD22      LEU  15  -2.387  -7.230   7.202
  129   HD23  LEU  15          HD23      LEU  15  -3.169  -5.826   6.477
  130    H    GLU  16           HN       GLU  16   0.354  -8.799   9.609
  131    HA   GLU  16           HA       GLU  16   2.051  -8.474  11.902
  132    HB2  GLU  16           HB2      GLU  16   0.977 -10.632  11.126
  133    HB3  GLU  16           HB1      GLU  16   2.177 -10.696   9.836
  134    HG2  GLU  16           HG2      GLU  16   3.991 -10.799  11.444
  135    HG3  GLU  16           HG1      GLU  16   2.875 -10.537  12.785
  136    H    ASP  17           HN       ASP  17   4.423  -8.768  11.922
  137    HA   ASP  17           HA       ASP  17   5.784  -6.981  10.198
  138    HB2  ASP  17           HB2      ASP  17   6.920  -9.305  11.781
  139    HB3  ASP  17           HB1      ASP  17   7.857  -7.969  11.115
  140    H    VAL  18           HN       VAL  18   5.660 -10.563  10.086
  141    HA   VAL  18           HA       VAL  18   7.342 -10.844   7.809
  142    HB   VAL  18           HB       VAL  18   6.615 -12.736   9.264
  143   HG11  VAL  18          HG11      VAL  18   4.186 -11.989   9.363
  144   HG12  VAL  18          HG12      VAL  18   4.416 -13.706   9.042
  145   HG13  VAL  18          HG13      VAL  18   3.998 -12.612   7.725
  146   HG21  VAL  18          HG21      VAL  18   6.430 -14.366   7.453
  147   HG22  VAL  18          HG22      VAL  18   7.534 -13.083   6.953
  148   HG23  VAL  18          HG23      VAL  18   5.880 -13.114   6.340
  149    H    ASP  19           HN       ASP  19   3.837 -10.269   8.053
  150    HA   ASP  19           HA       ASP  19   3.313 -10.501   5.238
  151    HB2  ASP  19           HB2      ASP  19   1.516 -10.573   6.926
  152    HB3  ASP  19           HB1      ASP  19   1.847  -8.895   7.357
  153    H    LEU  20           HN       LEU  20   4.550  -7.915   7.268
  154    HA   LEU  20           HA       LEU  20   4.135  -5.761   5.432
  155    HB2  LEU  20           HB2      LEU  20   4.819  -5.562   7.879
  156    HB3  LEU  20           HB1      LEU  20   6.436  -6.049   7.387
  157    HG   LEU  20           HG       LEU  20   6.265  -4.056   5.669
  158   HD11  LEU  20          HD11      LEU  20   4.126  -3.300   7.693
  159   HD12  LEU  20          HD12      LEU  20   3.907  -3.498   5.956
  160   HD13  LEU  20          HD13      LEU  20   4.875  -2.165   6.572
  161   HD21  LEU  20          HD21      LEU  20   7.820  -4.068   7.563
  162   HD22  LEU  20          HD22      LEU  20   6.526  -3.578   8.656
  163   HD23  LEU  20          HD23      LEU  20   7.087  -2.471   7.404
  164    H    LYS  21           HN       LYS  21   6.744  -8.115   5.837
  165    HA   LYS  21           HA       LYS  21   8.569  -7.013   3.948
  166    HB2  LYS  21           HB2      LYS  21   8.069  -9.890   4.772
  167    HB3  LYS  21           HB1      LYS  21   9.446  -9.375   3.807
  168    HG2  LYS  21           HG2      LYS  21   8.923  -7.991   6.447
  169    HG3  LYS  21           HG1      LYS  21   9.657  -9.586   6.470
  170    HD2  LYS  21           HD2      LYS  21  10.778  -7.339   4.761
  171    HD3  LYS  21           HD1      LYS  21  11.260  -7.559   6.437
  172    HE2  LYS  21           HE2      LYS  21  11.802 -10.028   5.720
  173    HE3  LYS  21           HE1      LYS  21  11.783  -9.379   4.081
  174    HZ1  LYS  21           HZ1      LYS  21  13.535  -8.622   6.333
  175    HZ2  LYS  21           HZ2      LYS  21  13.333  -7.612   4.982
  176    HZ3  LYS  21           HZ3      LYS  21  13.974  -9.174   4.791
  177    H    LYS  22           HN       LYS  22   5.846  -9.277   3.536
  178    HA   LYS  22           HA       LYS  22   6.343  -9.841   0.768
  179    HB2  LYS  22           HB2      LYS  22   3.907  -9.995   2.554
  180    HB3  LYS  22           HB1      LYS  22   3.700 -10.216   0.817
  181    HG2  LYS  22           HG2      LYS  22   5.383 -12.032   0.855
  182    HG3  LYS  22           HG1      LYS  22   5.561 -11.824   2.598
  183    HD2  LYS  22           HD2      LYS  22   3.286 -12.497   3.000
  184    HD3  LYS  22           HD1      LYS  22   2.896 -12.436   1.281
  185    HE2  LYS  22           HE2      LYS  22   4.963 -14.316   2.460
  186    HE3  LYS  22           HE1      LYS  22   3.282 -14.765   2.168
  187    HZ1  LYS  22           HZ1      LYS  22   5.313 -13.948   0.173
  188    HZ2  LYS  22           HZ2      LYS  22   3.654 -14.020  -0.182
  189    HZ3  LYS  22           HZ3      LYS  22   4.489 -15.427   0.275
  190    H    PHE  23           HN       PHE  23   4.782  -7.090   2.355
  191    HA   PHE  23           HA       PHE  23   3.536  -6.046  -0.032
  192    HB2  PHE  23           HB2      PHE  23   3.188  -5.370   2.475
  193    HB3  PHE  23           HB1      PHE  23   4.551  -4.287   2.227
  194    HD1  PHE  23           HD1      PHE  23   4.422  -2.478   0.494
  195    HD2  PHE  23           HD2      PHE  23   1.015  -4.891   1.524
  196    HE1  PHE  23           HE1      PHE  23   2.916  -0.821  -0.574
  197    HE2  PHE  23           HE2      PHE  23  -0.483  -3.233   0.451
  198    HZ   PHE  23           HZ       PHE  23   0.468  -1.198  -0.596
  199    H    LYS  24           HN       LYS  24   6.749  -5.485   1.439
  200    HA   LYS  24           HA       LYS  24   7.566  -3.564  -0.580
  201    HB2  LYS  24           HB2      LYS  24   9.001  -5.182   1.540
  202    HB3  LYS  24           HB1      LYS  24   9.938  -4.296   0.340
  203    HG2  LYS  24           HG2      LYS  24   9.651  -2.925   2.338
  204    HG3  LYS  24           HG1      LYS  24   8.766  -2.205   0.994
  205    HD2  LYS  24           HD2      LYS  24   6.665  -3.028   1.824
  206    HD3  LYS  24           HD1      LYS  24   7.464  -4.046   3.021
  207    HE2  LYS  24           HE2      LYS  24   7.689  -1.022   2.989
  208    HE3  LYS  24           HE1      LYS  24   6.496  -1.900   3.947
  209    HZ1  LYS  24           HZ1      LYS  24   8.307  -1.562   5.364
  210    HZ2  LYS  24           HZ2      LYS  24   9.444  -1.980   4.174
  211    HZ3  LYS  24           HZ3      LYS  24   8.455  -3.176   4.867
  212    H    MET  25           HN       MET  25   8.247  -7.035  -0.056
  213    HA   MET  25           HA       MET  25   9.847  -7.468  -2.340
  214    HB2  MET  25           HB2      MET  25   9.431  -9.137  -0.514
  215    HB3  MET  25           HB1      MET  25   7.822  -9.407  -1.185
  216    HG2  MET  25           HG2      MET  25   8.770 -10.174  -3.288
  217    HG3  MET  25           HG1      MET  25  10.397  -9.770  -2.743
  218    HE1  MET  25           HE1      MET  25  10.297 -12.272  -3.884
  219    HE2  MET  25           HE2      MET  25  10.736 -13.538  -2.741
  220    HE3  MET  25           HE3      MET  25  11.665 -12.042  -2.788
  221    H    HIS  26           HN       HIS  26   6.333  -7.249  -2.031
  222    HA   HIS  26           HA       HIS  26   5.700  -8.256  -4.659
  223    HB2  HIS  26           HB2      HIS  26   4.066  -7.815  -2.706
  224    HB3  HIS  26           HB1      HIS  26   4.123  -6.113  -3.166
  225    HD1  HIS  26           HD1      HIS  26   4.383  -7.008  -6.329
  226    HD2  HIS  26           HD2      HIS  26   1.341  -7.952  -3.641
  227    HE1  HIS  26           HE1      HIS  26   2.344  -7.568  -7.723
  228    H    LEU  27           HN       LEU  27   6.356  -4.936  -3.474
  229    HA   LEU  27           HA       LEU  27   6.015  -3.758  -6.136
  230    HB2  LEU  27           HB2      LEU  27   7.516  -2.606  -3.758
  231    HB3  LEU  27           HB1      LEU  27   6.861  -1.717  -5.130
  232    HG   LEU  27           HG       LEU  27   5.182  -3.297  -3.151
  233   HD11  LEU  27          HD11      LEU  27   5.786  -0.331  -3.348
  234   HD12  LEU  27          HD12      LEU  27   6.180  -1.409  -2.010
  235   HD13  LEU  27          HD13      LEU  27   4.499  -1.011  -2.354
  236   HD21  LEU  27          HD21      LEU  27   4.514  -1.493  -5.503
  237   HD22  LEU  27          HD22      LEU  27   3.348  -1.799  -4.215
  238   HD23  LEU  27          HD23      LEU  27   3.948  -3.133  -5.190
  239    H    GLU  28           HN       GLU  28   8.710  -5.089  -4.289
  240    HA   GLU  28           HA       GLU  28  10.799  -4.043  -5.953
  241    HB2  GLU  28           HB2      GLU  28  11.117  -5.088  -3.677
  242    HB3  GLU  28           HB1      GLU  28  10.837  -6.662  -4.420
  243    HG2  GLU  28           HG2      GLU  28  12.743  -6.294  -5.940
  244    HG3  GLU  28           HG1      GLU  28  13.019  -4.710  -5.213
  245    H    ASP  29           HN       ASP  29   8.753  -6.924  -6.190
  246    HA   ASP  29           HA       ASP  29  10.156  -7.774  -8.694
  247    HB2  ASP  29           HB2      ASP  29   8.698  -9.796  -8.483
  248    HB3  ASP  29           HB1      ASP  29   9.742  -9.551  -7.084
  249    H    TYR  30           HN       TYR  30   8.366  -5.364  -8.452
  250    HA   TYR  30           HA       TYR  30   5.828  -5.875  -9.578
  251    HB2  TYR  30           HB2      TYR  30   6.633  -3.694  -8.603
  252    HB3  TYR  30           HB1      TYR  30   7.536  -3.426 -10.092
  253    HD1  TYR  30           HD1      TYR  30   4.153  -3.763  -8.619
  254    HD2  TYR  30           HD2      TYR  30   6.397  -2.834 -12.165
  255    HE1  TYR  30           HE1      TYR  30   2.100  -2.872  -9.687
  256    HE2  TYR  30           HE2      TYR  30   4.343  -1.942 -13.228
  257    HH   TYR  30           HH       TYR  30   1.579  -2.546 -12.678
  258    HA   PRO  31           HA       PRO  31   7.431  -7.232 -13.582
  259    HB2  PRO  31           HB2      PRO  31   4.936  -7.034 -14.992
  260    HB3  PRO  31           HB1      PRO  31   5.636  -8.491 -14.274
  261    HG2  PRO  31           HG2      PRO  31   3.381  -6.872 -13.283
  262    HG3  PRO  31           HG1      PRO  31   3.908  -8.475 -12.747
  263    HD2  PRO  31           HD2      PRO  31   4.273  -6.006 -11.336
  264    HD3  PRO  31           HD1      PRO  31   4.985  -7.582 -10.918
  265    HA   PRO  32           HA       PRO  32   7.866  -3.013 -15.203
  266    HB2  PRO  32           HB2      PRO  32   9.176  -3.701 -17.637
  267    HB3  PRO  32           HB1      PRO  32   9.974  -3.322 -16.103
  268    HG2  PRO  32           HG2      PRO  32   9.605  -5.970 -17.394
  269    HG3  PRO  32           HG1      PRO  32  10.748  -5.503 -16.122
  270    HD2  PRO  32           HD2      PRO  32   8.381  -7.042 -15.744
  271    HD3  PRO  32           HD1      PRO  32   9.352  -6.284 -14.459
  272    H    GLN  33           HN       GLN  33   6.494  -1.794 -16.490
  273    HA   GLN  33           HA       GLN  33   4.688  -3.248 -18.415
  274    HB2  GLN  33           HB2      GLN  33   4.247  -0.649 -16.905
  275    HB3  GLN  33           HB1      GLN  33   3.098  -1.411 -18.006
  276    HG2  GLN  33           HG2      GLN  33   2.956  -3.376 -16.568
  277    HG3  GLN  33           HG1      GLN  33   4.191  -2.714 -15.496
  278   HE21  GLN  33          HE21      GLN  33   3.443  -0.114 -15.077
  279   HE22  GLN  33          HE22      GLN  33   1.879  -0.021 -14.425
  280    H    LYS  34           HN       LYS  34   7.449  -1.842 -18.733
  281    HA   LYS  34           HA       LYS  34   8.491  -0.494 -20.339
  282    HB2  LYS  34           HB2      LYS  34   7.191  -2.183 -21.759
  283    HB3  LYS  34           HB1      LYS  34   5.971  -0.930 -21.977
  284    HG2  LYS  34           HG2      LYS  34   7.855   0.583 -22.814
  285    HG3  LYS  34           HG1      LYS  34   8.881  -0.848 -22.833
  286    HD2  LYS  34           HD2      LYS  34   6.259  -0.568 -24.343
  287    HD3  LYS  34           HD1      LYS  34   7.858  -0.384 -25.057
  288    HE2  LYS  34           HE2      LYS  34   8.338  -2.770 -24.157
  289    HE3  LYS  34           HE1      LYS  34   6.591  -2.895 -23.942
  290    HZ1  LYS  34           HZ1      LYS  34   6.628  -1.982 -26.391
  291    HZ2  LYS  34           HZ2      LYS  34   6.777  -3.641 -26.058
  292    HZ3  LYS  34           HZ3      LYS  34   8.158  -2.713 -26.401
  293    H    GLY  35           HN       GLY  35   7.561   1.097 -18.456
  294    HA2  GLY  35           HA2      GLY  35   7.211   3.627 -19.533
  295    HA3  GLY  35           HA1      GLY  35   5.563   3.017 -19.355
  296    H    CYS  36           HN       CYS  36   5.763   1.552 -17.016
  297    HA   CYS  36           HA       CYS  36   5.619   3.601 -15.013
  298    HB2  CYS  36           HB2      CYS  36   4.374   1.472 -14.841
  299    HB3  CYS  36           HB1      CYS  36   5.896   0.599 -14.669
  300    HG   CYS  36           HG       CYS  36   4.807   2.621 -12.545
  301    H    ILE  37           HN       ILE  37   7.057   3.994 -13.249
  302    HA   ILE  37           HA       ILE  37   9.917   3.447 -13.864
  303    HB   ILE  37           HB       ILE  37   8.692   5.288 -11.791
  304   HG12  ILE  37          HG12      ILE  37   9.832   5.997 -14.518
  305   HG13  ILE  37          HG11      ILE  37   8.106   5.850 -14.192
  306   HG21  ILE  37          HG21      ILE  37  10.934   6.330 -11.781
  307   HG22  ILE  37          HG22      ILE  37  11.500   5.140 -12.948
  308   HG23  ILE  37          HG23      ILE  37  11.037   4.634 -11.325
  309   HD11  ILE  37          HD11      ILE  37  10.023   7.785 -12.843
  310   HD12  ILE  37          HD12      ILE  37   8.326   7.587 -12.402
  311   HD13  ILE  37          HD13      ILE  37   8.756   8.205 -13.998
  312    HA   PRO  38           HA       PRO  38   9.249   0.354 -10.516
  313    HB2  PRO  38           HB2      PRO  38  11.988  -0.585 -10.706
  314    HB3  PRO  38           HB1      PRO  38  10.530  -1.401 -11.283
  315    HG2  PRO  38           HG2      PRO  38  12.579  -0.120 -12.890
  316    HG3  PRO  38           HG1      PRO  38  11.120  -0.944 -13.459
  317    HD2  PRO  38           HD2      PRO  38  11.640   1.924 -13.395
  318    HD3  PRO  38           HD1      PRO  38  10.202   1.090 -14.023
  319    H    LEU  39           HN       LEU  39   9.640   0.671  -8.332
  320    HA   LEU  39           HA       LEU  39  11.205   2.991  -7.531
  321    HB2  LEU  39           HB2      LEU  39   9.492   0.948  -6.122
  322    HB3  LEU  39           HB1      LEU  39  10.500   2.032  -5.166
  323    HG   LEU  39           HG       LEU  39   9.420   3.981  -6.193
  324   HD11  LEU  39          HD11      LEU  39   8.896   3.193  -8.400
  325   HD12  LEU  39          HD12      LEU  39   7.356   3.550  -7.623
  326   HD13  LEU  39          HD13      LEU  39   7.903   1.879  -7.767
  327   HD21  LEU  39          HD21      LEU  39   7.219   3.714  -5.166
  328   HD22  LEU  39          HD22      LEU  39   8.427   2.900  -4.172
  329   HD23  LEU  39          HD23      LEU  39   7.374   1.958  -5.228
  330    HA   PRO  40           HA       PRO  40  14.900   0.316  -7.193
  331    HB2  PRO  40           HB2      PRO  40  16.221   2.368  -5.534
  332    HB3  PRO  40           HB1      PRO  40  16.655   1.826  -7.162
  333    HG2  PRO  40           HG2      PRO  40  15.429   4.322  -6.480
  334    HG3  PRO  40           HG1      PRO  40  15.663   3.676  -8.113
  335    HD2  PRO  40           HD2      PRO  40  13.151   3.916  -6.618
  336    HD3  PRO  40           HD1      PRO  40  13.378   3.400  -8.305
  337    H    ARG  41           HN       ARG  41  15.759  -0.985  -5.476
  338    HA   ARG  41           HA       ARG  41  14.001  -1.395  -3.241
  339    HB2  ARG  41           HB2      ARG  41  15.547  -3.124  -4.292
  340    HB3  ARG  41           HB1      ARG  41  16.888  -2.327  -3.471
  341    HG2  ARG  41           HG2      ARG  41  15.728  -2.693  -1.291
  342    HG3  ARG  41           HG1      ARG  41  14.460  -3.573  -2.144
  343    HD2  ARG  41           HD2      ARG  41  17.394  -4.314  -1.989
  344    HD3  ARG  41           HD1      ARG  41  16.043  -5.186  -1.265
  345    HE   ARG  41           HE       ARG  41  15.422  -5.123  -3.970
  346   HH11  ARG  41          HH21      ARG  41  18.118  -6.109  -2.048
  347   HH12  ARG  41          HH22      ARG  41  18.609  -7.357  -3.143
  348   HH21  ARG  41          HH11      ARG  41  16.052  -6.746  -5.406
  349   HH22  ARG  41          HH12      ARG  41  17.439  -7.718  -5.044
  350    H    GLY  42           HN       GLY  42  17.194   0.177  -3.502
  351    HA2  GLY  42           HA2      GLY  42  17.665   0.690  -0.759
  352    HA3  GLY  42           HA1      GLY  42  18.212   1.773  -2.042
  353    H    GLN  43           HN       GLN  43  15.307   2.195  -2.881
  354    HA   GLN  43           HA       GLN  43  14.834   4.499  -1.158
  355    HB2  GLN  43           HB2      GLN  43  13.236   3.235  -3.413
  356    HB3  GLN  43           HB1      GLN  43  12.703   4.689  -2.569
  357    HG2  GLN  43           HG2      GLN  43  15.416   4.444  -3.915
  358    HG3  GLN  43           HG1      GLN  43  13.994   5.112  -4.713
  359   HE21  GLN  43          HE21      GLN  43  16.420   6.637  -4.108
  360   HE22  GLN  43          HE22      GLN  43  15.977   7.865  -3.023
  361    H    THR  44           HN       THR  44  13.317   1.297  -1.556
  362    HA   THR  44           HA       THR  44  11.165   1.819   0.297
  363    HB   THR  44           HB       THR  44  10.667  -0.507   0.136
  364    HG1  THR  44           HG1      THR  44  12.190  -1.939   0.097
  365   HG21  THR  44          HG21      THR  44  10.489   0.799  -2.006
  366   HG22  THR  44          HG22      THR  44  10.726  -0.932  -2.245
  367   HG23  THR  44          HG23      THR  44  12.078   0.180  -2.456
  368    H    GLU  45           HN       GLU  45  14.417   0.419   0.674
  369    HA   GLU  45           HA       GLU  45  14.082  -0.442   3.388
  370    HB2  GLU  45           HB2      GLU  45  16.641   0.556   2.064
  371    HB3  GLU  45           HB1      GLU  45  16.537  -0.465   3.496
  372    HG2  GLU  45           HG2      GLU  45  15.528  -1.231   0.734
  373    HG3  GLU  45           HG1      GLU  45  17.039  -1.783   1.453
  374    H    LYS  46           HN       LYS  46  15.165   2.712   2.024
  375    HA   LYS  46           HA       LYS  46  15.531   3.851   4.709
  376    HB2  LYS  46           HB2      LYS  46  15.366   5.282   2.038
  377    HB3  LYS  46           HB1      LYS  46  16.025   5.925   3.537
  378    HG2  LYS  46           HG2      LYS  46  17.149   3.486   2.116
  379    HG3  LYS  46           HG1      LYS  46  17.758   5.120   1.878
  380    HD2  LYS  46           HD2      LYS  46  18.097   5.200   4.436
  381    HD3  LYS  46           HD1      LYS  46  17.826   3.458   4.416
  382    HE2  LYS  46           HE2      LYS  46  20.207   3.839   4.294
  383    HE3  LYS  46           HE1      LYS  46  19.669   3.259   2.718
  384    HZ1  LYS  46           HZ1      LYS  46  19.379   5.994   2.645
  385    HZ2  LYS  46           HZ2      LYS  46  20.574   5.075   1.864
  386    HZ3  LYS  46           HZ3      LYS  46  20.876   5.736   3.399
  387    H    ALA  47           HN       ALA  47  12.889   3.288   2.628
  388    HA   ALA  47           HA       ALA  47  11.277   5.586   3.349
  389    HB1  ALA  47           HB1      ALA  47  10.434   2.849   2.345
  390    HB2  ALA  47           HB2      ALA  47  10.813   4.242   1.331
  391    HB3  ALA  47           HB3      ALA  47   9.410   4.283   2.398
  392    H    ASP  48           HN       ASP  48  10.754   5.926   5.459
  393    HA   ASP  48           HA       ASP  48  10.405   3.699   7.356
  394    HB2  ASP  48           HB2      ASP  48   9.792   6.653   7.722
  395    HB3  ASP  48           HB1      ASP  48  10.009   5.453   8.996
  396    H    HIS  49           HN       HIS  49   8.280   3.739   8.713
  397    HA   HIS  49           HA       HIS  49   6.082   3.039   7.141
  398    HB2  HIS  49           HB2      HIS  49   4.692   3.484   9.188
  399    HB3  HIS  49           HB1      HIS  49   6.125   2.506   9.498
  400    HD1  HIS  49           HD1      HIS  49   8.262   4.734   9.609
  401    HD2  HIS  49           HD2      HIS  49   4.576   4.967  11.541
  402    HE1  HIS  49           HE1      HIS  49   8.548   6.394  11.499
  403    H    VAL  50           HN       VAL  50   6.864   6.262   8.443
  404    HA   VAL  50           HA       VAL  50   4.437   7.507   7.408
  405    HB   VAL  50           HB       VAL  50   7.118   8.740   8.185
  406   HG11  VAL  50          HG11      VAL  50   4.389   9.988   7.698
  407   HG12  VAL  50          HG12      VAL  50   5.881  10.314   6.813
  408   HG13  VAL  50          HG13      VAL  50   5.723  10.824   8.492
  409   HG21  VAL  50          HG21      VAL  50   6.111   9.167  10.346
  410   HG22  VAL  50          HG22      VAL  50   5.900   7.454   9.994
  411   HG23  VAL  50          HG23      VAL  50   4.547   8.567   9.797
  412    H    ASP  51           HN       ASP  51   7.850   7.526   6.290
  413    HA   ASP  51           HA       ASP  51   7.380   9.008   3.911
  414    HB2  ASP  51           HB2      ASP  51   9.447   6.864   4.496
  415    HB3  ASP  51           HB1      ASP  51   9.488   7.923   3.086
  416    H    LEU  52           HN       LEU  52   7.052   5.553   4.600
  417    HA   LEU  52           HA       LEU  52   6.765   4.568   1.977
  418    HB2  LEU  52           HB2      LEU  52   6.760   3.361   4.322
  419    HB3  LEU  52           HB1      LEU  52   5.014   3.539   4.225
  420    HG   LEU  52           HG       LEU  52   6.763   2.176   2.144
  421   HD11  LEU  52          HD11      LEU  52   4.954   1.085   4.321
  422   HD12  LEU  52          HD12      LEU  52   6.691   0.834   4.150
  423   HD13  LEU  52          HD13      LEU  52   5.577   0.111   2.990
  424   HD21  LEU  52          HD21      LEU  52   4.854   2.982   0.990
  425   HD22  LEU  52          HD22      LEU  52   3.777   2.671   2.351
  426   HD23  LEU  52          HD23      LEU  52   4.415   1.329   1.402
  427    H    ALA  53           HN       ALA  53   4.164   5.734   4.170
  428    HA   ALA  53           HA       ALA  53   2.074   5.527   2.204
  429    HB1  ALA  53           HB1      ALA  53   0.826   7.062   3.714
  430    HB2  ALA  53           HB2      ALA  53   2.307   7.334   4.632
  431    HB3  ALA  53           HB3      ALA  53   1.575   5.730   4.594
  432    H    THR  54           HN       THR  54   4.486   7.997   2.857
  433    HA   THR  54           HA       THR  54   3.169  10.092   1.323
  434    HB   THR  54           HB       THR  54   6.103   9.796   2.043
  435    HG1  THR  54           HG1      THR  54   4.801   9.756   3.873
  436   HG21  THR  54          HG21      THR  54   6.048  12.298   1.884
  437   HG22  THR  54          HG22      THR  54   4.415  12.182   1.234
  438   HG23  THR  54          HG23      THR  54   5.771  11.494   0.340
  439    H    LEU  55           HN       LEU  55   5.551   7.556   0.548
  440    HA   LEU  55           HA       LEU  55   6.165   8.621  -2.084
  441    HB2  LEU  55           HB2      LEU  55   6.477   5.783  -1.042
  442    HB3  LEU  55           HB1      LEU  55   7.136   6.377  -2.556
  443    HG   LEU  55           HG       LEU  55   7.844   7.737   0.068
  444   HD11  LEU  55          HD11      LEU  55   9.880   6.320   0.143
  445   HD12  LEU  55          HD12      LEU  55   9.245   5.358  -1.191
  446   HD13  LEU  55          HD13      LEU  55   8.411   5.370   0.362
  447   HD21  LEU  55          HD21      LEU  55   8.479   8.958  -1.951
  448   HD22  LEU  55          HD22      LEU  55   9.213   7.514  -2.639
  449   HD23  LEU  55          HD23      LEU  55   9.932   8.281  -1.225
  450    H    MET  56           HN       MET  56   3.771   6.372  -0.806
  451    HA   MET  56           HA       MET  56   2.856   5.441  -3.390
  452    HB2  MET  56           HB2      MET  56   1.550   5.505  -0.651
  453    HB3  MET  56           HB1      MET  56   0.779   4.781  -2.063
  454    HG2  MET  56           HG2      MET  56   3.549   3.968  -1.121
  455    HG3  MET  56           HG1      MET  56   2.082   3.156  -0.579
  456    HE1  MET  56           HE1      MET  56   1.088   1.260  -1.671
  457    HE2  MET  56           HE2      MET  56   0.809   1.133  -3.405
  458    HE3  MET  56           HE3      MET  56   0.159   2.507  -2.515
  459    H    ILE  57           HN       ILE  57   1.803   8.078  -1.219
  460    HA   ILE  57           HA       ILE  57  -0.368   8.845  -3.039
  461    HB   ILE  57           HB       ILE  57   0.811  10.428  -0.723
  462   HG12  ILE  57          HG12      ILE  57  -1.649   8.647  -0.761
  463   HG13  ILE  57          HG11      ILE  57  -0.085   8.121  -0.143
  464   HG21  ILE  57          HG21      ILE  57  -1.452  11.515  -0.778
  465   HG22  ILE  57          HG22      ILE  57  -1.783  10.647  -2.274
  466   HG23  ILE  57          HG23      ILE  57  -0.486  11.838  -2.215
  467   HD11  ILE  57          HD11      ILE  57  -1.650  10.511   0.879
  468   HD12  ILE  57          HD12      ILE  57  -0.106   9.938   1.511
  469   HD13  ILE  57          HD13      ILE  57  -1.552   8.941   1.677
  470    H    ASP  58           HN       ASP  58   2.915  10.090  -2.356
  471    HA   ASP  58           HA       ASP  58   2.613  12.332  -4.196
  472    HB2  ASP  58           HB2      ASP  58   5.056  11.101  -2.872
  473    HB3  ASP  58           HB1      ASP  58   5.094  12.590  -3.818
  474    H    PHE  59           HN       PHE  59   4.421   9.226  -4.387
  475    HA   PHE  59           HA       PHE  59   5.370   9.820  -7.066
  476    HB2  PHE  59           HB2      PHE  59   6.406   8.278  -5.245
  477    HB3  PHE  59           HB1      PHE  59   5.307   7.043  -5.851
  478    HD1  PHE  59           HD1      PHE  59   8.206   9.185  -6.660
  479    HD2  PHE  59           HD2      PHE  59   5.598   6.085  -8.094
  480    HE1  PHE  59           HE1      PHE  59   9.770   8.734  -8.528
  481    HE2  PHE  59           HE2      PHE  59   7.165   5.635  -9.963
  482    HZ   PHE  59           HZ       PHE  59   9.252   6.962 -10.178
  483    H    ASN  60           HN       ASN  60   2.729   7.643  -5.874
  484    HA   ASN  60           HA       ASN  60   2.055   7.003  -8.721
  485    HB2  ASN  60           HB2      ASN  60   0.926   5.931  -6.111
  486    HB3  ASN  60           HB1      ASN  60   0.501   5.347  -7.717
  487   HD21  ASN  60          HD21      ASN  60   2.162   4.160  -8.930
  488   HD22  ASN  60          HD22      ASN  60   3.529   3.527  -8.149
  489    H    GLY  61           HN       GLY  61   0.820   8.828  -5.976
  490    HA2  GLY  61           HA2      GLY  61  -0.670  10.734  -6.363
  491    HA3  GLY  61           HA1      GLY  61  -1.401   9.872  -7.713
  492    H    GLU  62           HN       GLU  62  -3.037  10.913  -5.764
  493    HA   GLU  62           HA       GLU  62  -3.628   9.046  -3.641
  494    HB2  GLU  62           HB2      GLU  62  -4.240  11.439  -3.554
  495    HB3  GLU  62           HB1      GLU  62  -5.372  11.208  -4.879
  496    HG2  GLU  62           HG2      GLU  62  -5.594   9.541  -2.349
  497    HG3  GLU  62           HG1      GLU  62  -6.298  11.152  -2.422
  498    H    GLU  63           HN       GLU  63  -5.036   9.560  -6.888
  499    HA   GLU  63           HA       GLU  63  -7.109   7.586  -6.521
  500    HB2  GLU  63           HB2      GLU  63  -7.593   7.878  -8.852
  501    HB3  GLU  63           HB1      GLU  63  -7.156   9.456  -8.213
  502    HG2  GLU  63           HG2      GLU  63  -5.408   7.617  -9.880
  503    HG3  GLU  63           HG1      GLU  63  -6.056   9.184 -10.344
  504    H    LYS  64           HN       LYS  64  -3.902   7.414  -8.112
  505    HA   LYS  64           HA       LYS  64  -4.262   4.639  -8.871
  506    HB2  LYS  64           HB2      LYS  64  -2.651   6.313  -9.943
  507    HB3  LYS  64           HB1      LYS  64  -1.624   6.087  -8.534
  508    HG2  LYS  64           HG2      LYS  64  -0.715   4.486  -9.993
  509    HG3  LYS  64           HG1      LYS  64  -1.873   3.500  -9.105
  510    HD2  LYS  64           HD2      LYS  64  -3.516   3.774 -10.929
  511    HD3  LYS  64           HD1      LYS  64  -2.391   4.816 -11.797
  512    HE2  LYS  64           HE2      LYS  64  -2.224   2.587 -12.725
  513    HE3  LYS  64           HE1      LYS  64  -0.749   2.914 -11.817
  514    HZ1  LYS  64           HZ1      LYS  64  -2.712   1.826 -10.105
  515    HZ2  LYS  64           HZ2      LYS  64  -1.180   1.206 -10.500
  516    HZ3  LYS  64           HZ3      LYS  64  -2.528   0.817 -11.456
  517    H    ALA  65           HN       ALA  65  -2.743   6.272  -6.092
  518    HA   ALA  65           HA       ALA  65  -1.462   4.039  -4.934
  519    HB1  ALA  65           HB1      ALA  65  -1.840   5.215  -2.745
  520    HB2  ALA  65           HB2      ALA  65  -2.870   6.365  -3.599
  521    HB3  ALA  65           HB3      ALA  65  -1.156   6.250  -3.998
  522    H    TRP  66           HN       TRP  66  -4.871   5.077  -4.607
  523    HA   TRP  66           HA       TRP  66  -5.605   2.997  -2.770
  524    HB2  TRP  66           HB2      TRP  66  -7.112   4.803  -4.667
  525    HB3  TRP  66           HB1      TRP  66  -7.979   3.449  -3.945
  526    HD1  TRP  66           HD1      TRP  66  -7.314   6.943  -3.298
  527    HE1  TRP  66           HE1      TRP  66  -7.631   7.531  -0.809
  528    HE3  TRP  66           HE3      TRP  66  -7.364   2.251  -1.297
  529    HZ2  TRP  66           HZ2      TRP  66  -7.875   6.186   1.705
  530    HZ3  TRP  66           HZ3      TRP  66  -7.644   1.930   1.166
  531    HH2  TRP  66           HH2      TRP  66  -7.898   3.894   2.654
  532    H    ALA  67           HN       ALA  67  -5.664   3.160  -6.334
  533    HA   ALA  67           HA       ALA  67  -6.872   0.638  -6.804
  534    HB1  ALA  67           HB1      ALA  67  -6.438   2.296  -8.590
  535    HB2  ALA  67           HB2      ALA  67  -5.765   0.720  -9.008
  536    HB3  ALA  67           HB3      ALA  67  -4.705   2.006  -8.431
  537    H    MET  68           HN       MET  68  -3.465   1.476  -6.224
  538    HA   MET  68           HA       MET  68  -2.536  -1.276  -6.550
  539    HB2  MET  68           HB2      MET  68  -1.272   1.274  -5.501
  540    HB3  MET  68           HB1      MET  68  -0.420  -0.268  -5.424
  541    HG2  MET  68           HG2      MET  68  -0.453  -0.507  -7.814
  542    HG3  MET  68           HG1      MET  68  -1.580   0.834  -8.002
  543    HE1  MET  68           HE1      MET  68   2.920   0.933  -7.254
  544    HE2  MET  68           HE2      MET  68   1.943  -0.353  -7.958
  545    HE3  MET  68           HE3      MET  68   1.831  -0.015  -6.232
  546    H    ALA  69           HN       ALA  69  -3.578   0.746  -3.854
  547    HA   ALA  69           HA       ALA  69  -2.621  -0.986  -1.762
  548    HB1  ALA  69           HB1      ALA  69  -4.992   0.905  -1.657
  549    HB2  ALA  69           HB2      ALA  69  -3.316   1.420  -1.462
  550    HB3  ALA  69           HB3      ALA  69  -4.043   0.321  -0.290
  551    H    VAL  70           HN       VAL  70  -5.761  -0.727  -3.435
  552    HA   VAL  70           HA       VAL  70  -6.981  -2.862  -1.849
  553    HB   VAL  70           HB       VAL  70  -7.815  -1.661  -4.513
  554   HG11  VAL  70          HG11      VAL  70  -9.263  -3.408  -2.490
  555   HG12  VAL  70          HG12      VAL  70  -8.943  -3.782  -4.183
  556   HG13  VAL  70          HG13      VAL  70 -10.092  -2.513  -3.764
  557   HG21  VAL  70          HG21      VAL  70  -8.692  -1.029  -1.669
  558   HG22  VAL  70          HG22      VAL  70  -9.314  -0.268  -3.134
  559   HG23  VAL  70          HG23      VAL  70  -7.637  -0.014  -2.652
  560    H    TRP  71           HN       TRP  71  -5.750  -2.679  -5.212
  561    HA   TRP  71           HA       TRP  71  -6.290  -5.383  -5.870
  562    HB2  TRP  71           HB2      TRP  71  -5.669  -3.681  -7.563
  563    HB3  TRP  71           HB1      TRP  71  -4.032  -3.627  -6.912
  564    HD1  TRP  71           HD1      TRP  71  -6.413  -5.898  -8.857
  565    HE1  TRP  71           HE1      TRP  71  -5.036  -7.774  -9.972
  566    HE3  TRP  71           HE3      TRP  71  -1.857  -4.994  -6.766
  567    HZ2  TRP  71           HZ2      TRP  71  -2.343  -8.759  -9.967
  568    HZ3  TRP  71           HZ3      TRP  71   0.095  -6.404  -7.324
  569    HH2  TRP  71           HH2      TRP  71  -0.138  -8.287  -8.926
  570    H    ILE  72           HN       ILE  72  -3.605  -4.014  -3.988
  571    HA   ILE  72           HA       ILE  72  -1.986  -6.446  -4.185
  572    HB   ILE  72           HB       ILE  72  -1.868  -3.990  -2.407
  573   HG12  ILE  72          HG12      ILE  72   0.181  -5.220  -4.280
  574   HG13  ILE  72          HG11      ILE  72  -0.987  -4.008  -4.787
  575   HG21  ILE  72          HG21      ILE  72  -0.279  -6.556  -2.097
  576   HG22  ILE  72          HG22      ILE  72  -1.193  -5.698  -0.857
  577   HG23  ILE  72          HG23      ILE  72   0.301  -5.010  -1.479
  578   HD11  ILE  72          HD11      ILE  72   1.328  -3.136  -4.153
  579   HD12  ILE  72          HD12      ILE  72   0.926  -3.535  -2.486
  580   HD13  ILE  72          HD13      ILE  72  -0.031  -2.343  -3.362
  581    H    PHE  73           HN       PHE  73  -4.355  -5.268  -1.706
  582    HA   PHE  73           HA       PHE  73  -3.926  -7.376   0.143
  583    HB2  PHE  73           HB2      PHE  73  -6.682  -6.277  -0.459
  584    HB3  PHE  73           HB1      PHE  73  -6.055  -6.849   1.081
  585    HD1  PHE  73           HD2      PHE  73  -3.298  -5.325   0.890
  586    HD2  PHE  73           HD1      PHE  73  -7.385  -4.105   0.280
  587    HE1  PHE  73           HE2      PHE  73  -2.701  -3.010   1.485
  588    HE2  PHE  73           HE1      PHE  73  -6.770  -1.787   0.887
  589    HZ   PHE  73           HZ       PHE  73  -4.431  -1.238   1.490
  590    H    ALA  74           HN       ALA  74  -6.150  -7.319  -2.673
  591    HA   ALA  74           HA       ALA  74  -7.205  -9.937  -2.268
  592    HB1  ALA  74           HB1      ALA  74  -6.697  -8.479  -4.887
  593    HB2  ALA  74           HB2      ALA  74  -8.147  -8.320  -3.897
  594    HB3  ALA  74           HB3      ALA  74  -7.774  -9.859  -4.674
  595    H    ALA  75           HN       ALA  75  -4.135  -8.850  -3.581
  596    HA   ALA  75           HA       ALA  75  -3.438 -11.300  -4.922
  597    HB1  ALA  75           HB1      ALA  75  -1.210 -10.393  -5.047
  598    HB2  ALA  75           HB2      ALA  75  -1.505  -9.315  -3.682
  599    HB3  ALA  75           HB3      ALA  75  -2.319  -9.033  -5.220
  600    H    ILE  76           HN       ILE  76  -2.652 -10.077  -1.648
  601    HA   ILE  76           HA       ILE  76  -1.406 -12.671  -0.942
  602    HB   ILE  76           HB       ILE  76  -1.319 -11.393   1.413
  603   HG12  ILE  76          HG12      ILE  76  -1.614  -9.085  -0.548
  604   HG13  ILE  76          HG11      ILE  76  -2.859  -9.570   0.598
  605   HG21  ILE  76          HG21      ILE  76   0.366 -10.515  -0.962
  606   HG22  ILE  76          HG22      ILE  76   0.652 -11.951   0.019
  607   HG23  ILE  76          HG23      ILE  76   0.811 -10.354   0.737
  608   HD11  ILE  76          HD11      ILE  76  -0.120  -8.421   1.180
  609   HD12  ILE  76          HD12      ILE  76  -1.059  -9.250   2.423
  610   HD13  ILE  76          HD13      ILE  76  -1.693  -7.793   1.664
  611    H    ASN  77           HN       ASN  77  -4.369 -12.233  -1.547
  612    HA   ASN  77           HA       ASN  77  -6.409 -13.061  -0.788
  613    HB2  ASN  77           HB2      ASN  77  -4.606 -14.791   0.949
  614    HB3  ASN  77           HB1      ASN  77  -6.300 -15.113   0.590
  615   HD21  ASN  77          HD21      ASN  77  -3.893 -16.752  -0.155
  616   HD22  ASN  77          HD22      ASN  77  -3.941 -16.883  -1.846
  617    H    ARG  78           HN       ARG  78  -6.923 -11.026   0.220
  618    HA   ARG  78           HA       ARG  78  -7.392 -11.287   3.127
  619    HB2  ARG  78           HB2      ARG  78  -5.699  -9.078   1.903
  620    HB3  ARG  78           HB1      ARG  78  -6.491  -8.904   3.468
  621    HG2  ARG  78           HG2      ARG  78  -5.304 -11.005   4.209
  622    HG3  ARG  78           HG1      ARG  78  -4.395 -10.959   2.703
  623    HD2  ARG  78           HD2      ARG  78  -3.669  -8.619   3.318
  624    HD3  ARG  78           HD1      ARG  78  -4.399  -8.864   4.899
  625    HE   ARG  78           HE       ARG  78  -1.818  -9.797   4.011
  626   HH11  ARG  78          HH21      ARG  78  -4.555 -10.816   5.858
  627   HH12  ARG  78          HH22      ARG  78  -3.702 -12.112   6.625
  628   HH21  ARG  78          HH11      ARG  78  -0.711 -11.463   5.014
  629   HH22  ARG  78          HH12      ARG  78  -1.534 -12.475   6.152
  630    H    ARG  79           HN       ARG  79  -8.916 -11.256   0.629
  631    HA   ARG  79           HA       ARG  79 -10.176  -8.889  -0.053
  632    HB2  ARG  79           HB2      ARG  79 -12.066 -10.193  -0.787
  633    HB3  ARG  79           HB1      ARG  79 -10.603 -11.118  -1.094
  634    HG2  ARG  79           HG2      ARG  79 -12.481 -11.526   1.271
  635    HG3  ARG  79           HG1      ARG  79 -12.388 -12.541  -0.156
  636    HD2  ARG  79           HD2      ARG  79  -9.863 -12.818   0.460
  637    HD3  ARG  79           HD1      ARG  79 -10.361 -12.250   2.057
  638    HE   ARG  79           HE       ARG  79 -12.185 -14.253   1.460
  639   HH11  ARG  79          HH21      ARG  79  -8.745 -13.949   1.574
  640   HH12  ARG  79          HH22      ARG  79  -8.485 -15.603   2.017
  641   HH21  ARG  79          HH11      ARG  79 -11.857 -16.408   2.037
  642   HH22  ARG  79          HH12      ARG  79 -10.245 -16.994   2.278
  643    H    ASP  80           HN       ASP  80 -10.606 -10.670   2.940
  644    HA   ASP  80           HA       ASP  80 -13.083  -9.491   3.748
  645    HB2  ASP  80           HB2      ASP  80 -12.379 -10.144   6.055
  646    HB3  ASP  80           HB1      ASP  80 -12.139 -11.455   4.896
  647    H    LEU  81           HN       LEU  81  -9.732  -8.561   4.649
  648    HA   LEU  81           HA       LEU  81 -10.502  -6.284   6.133
  649    HB2  LEU  81           HB2      LEU  81  -8.080  -7.513   5.539
  650    HB3  LEU  81           HB1      LEU  81  -7.904  -5.986   4.684
  651    HG   LEU  81           HG       LEU  81  -8.654  -6.255   7.620
  652   HD11  LEU  81          HD11      LEU  81  -6.346  -5.346   7.981
  653   HD12  LEU  81          HD12      LEU  81  -6.037  -5.561   6.259
  654   HD13  LEU  81          HD13      LEU  81  -6.360  -6.962   7.279
  655   HD21  LEU  81          HD21      LEU  81  -9.542  -4.200   6.683
  656   HD22  LEU  81          HD22      LEU  81  -8.030  -3.875   5.840
  657   HD23  LEU  81          HD23      LEU  81  -8.098  -3.786   7.601
  658    H    TYR  82           HN       TYR  82 -10.335  -6.728   2.653
  659    HA   TYR  82           HA       TYR  82 -10.256  -3.919   1.979
  660    HB2  TYR  82           HB2      TYR  82  -9.726  -5.328   0.157
  661    HB3  TYR  82           HB1      TYR  82 -11.020  -6.451   0.535
  662    HD1  TYR  82           HD1      TYR  82 -11.240  -2.725   0.182
  663    HD2  TYR  82           HD2      TYR  82 -12.258  -6.543  -1.512
  664    HE1  TYR  82           HE1      TYR  82 -12.687  -1.604  -1.480
  665    HE2  TYR  82           HE2      TYR  82 -13.705  -5.414  -3.174
  666    HH   TYR  82           HH       TYR  82 -14.726  -3.455  -3.690
  667    H    GLU  83           HN       GLU  83 -12.848  -6.211   2.752
  668    HA   GLU  83           HA       GLU  83 -15.054  -4.555   2.028
  669    HB2  GLU  83           HB2      GLU  83 -14.801  -6.633   4.226
  670    HB3  GLU  83           HB1      GLU  83 -16.325  -5.905   3.719
  671    HG2  GLU  83           HG2      GLU  83 -15.939  -6.737   1.413
  672    HG3  GLU  83           HG1      GLU  83 -14.448  -7.507   1.956
  673    H    LYS  84           HN       LYS  84 -13.134  -4.765   5.017
  674    HA   LYS  84           HA       LYS  84 -14.725  -2.757   6.416
  675    HB2  LYS  84           HB2      LYS  84 -11.874  -3.608   7.012
  676    HB3  LYS  84           HB1      LYS  84 -13.013  -2.855   8.123
  677    HG2  LYS  84           HG2      LYS  84 -13.429  -5.579   6.841
  678    HG3  LYS  84           HG1      LYS  84 -12.762  -5.333   8.451
  679    HD2  LYS  84           HD2      LYS  84 -14.914  -4.012   8.976
  680    HD3  LYS  84           HD1      LYS  84 -15.559  -4.679   7.478
  681    HE2  LYS  84           HE2      LYS  84 -14.495  -6.316   9.797
  682    HE3  LYS  84           HE1      LYS  84 -16.199  -6.059   9.425
  683    HZ1  LYS  84           HZ1      LYS  84 -14.256  -7.767   8.122
  684    HZ2  LYS  84           HZ2      LYS  84 -15.276  -6.905   7.070
  685    HZ3  LYS  84           HZ3      LYS  84 -15.939  -7.935   8.248
  686    H    ALA  85           HN       ALA  85 -11.551  -2.716   4.776
  687    HA   ALA  85           HA       ALA  85 -10.941   0.010   5.221
  688    HB1  ALA  85           HB1      ALA  85  -9.355  -1.640   4.236
  689    HB2  ALA  85           HB2      ALA  85  -9.466  -0.169   3.270
  690    HB3  ALA  85           HB3      ALA  85 -10.301  -1.630   2.750
  691    H    LYS  86           HN       LYS  86 -13.175  -1.485   2.972
  692    HA   LYS  86           HA       LYS  86 -13.499   0.796   1.243
  693    HB2  LYS  86           HB2      LYS  86 -14.298  -1.493   0.621
  694    HB3  LYS  86           HB1      LYS  86 -15.537  -1.379   1.873
  695    HG2  LYS  86           HG2      LYS  86 -16.608   0.474   0.766
  696    HG3  LYS  86           HG1      LYS  86 -15.272   0.648  -0.369
  697    HD2  LYS  86           HD2      LYS  86 -17.112  -0.493  -1.482
  698    HD3  LYS  86           HD1      LYS  86 -15.776  -1.621  -1.272
  699    HE2  LYS  86           HE2      LYS  86 -16.879  -2.772   0.494
  700    HE3  LYS  86           HE1      LYS  86 -18.024  -1.455   0.755
  701    HZ1  LYS  86           HZ1      LYS  86 -17.947  -3.443  -1.414
  702    HZ2  LYS  86           HZ2      LYS  86 -18.698  -1.939  -1.665
  703    HZ3  LYS  86           HZ3      LYS  86 -19.250  -2.974  -0.435
  704    H    ARG  87           HN       ARG  87 -14.773  -0.007   4.414
  705    HA   ARG  87           HA       ARG  87 -16.906   2.003   4.316
  706    HB2  ARG  87           HB2      ARG  87 -15.716   0.497   6.666
  707    HB3  ARG  87           HB1      ARG  87 -17.201   1.448   6.697
  708    HG2  ARG  87           HG2      ARG  87 -18.206  -0.031   5.011
  709    HG3  ARG  87           HG1      ARG  87 -16.713  -0.967   4.928
  710    HD2  ARG  87           HD2      ARG  87 -18.404  -2.045   6.395
  711    HD3  ARG  87           HD1      ARG  87 -16.945  -1.602   7.282
  712    HE   ARG  87           HE       ARG  87 -18.613   0.599   7.585
  713   HH11  ARG  87          HH21      ARG  87 -18.832  -2.803   8.135
  714   HH12  ARG  87          HH22      ARG  87 -19.938  -2.649   9.460
  715   HH21  ARG  87          HH11      ARG  87 -20.054   0.812   9.309
  716   HH22  ARG  87          HH12      ARG  87 -20.628  -0.604  10.123
  717    H    ASP  88           HN       ASP  88 -13.528   1.931   5.335
  718    HA   ASP  88           HA       ASP  88 -13.754   4.413   6.878
  719    HB2  ASP  88           HB2      ASP  88 -11.502   4.034   7.476
  720    HB3  ASP  88           HB1      ASP  88 -11.962   2.397   7.012
  721    H    GLU  89           HN       GLU  89 -13.894   3.798   3.626
  722    HA   GLU  89           HA       GLU  89 -12.202   5.749   2.454
  723    HB2  GLU  89           HB2      GLU  89 -14.796   4.455   1.660
  724    HB3  GLU  89           HB1      GLU  89 -14.236   5.824   0.704
  725    HG2  GLU  89           HG2      GLU  89 -12.501   3.399   1.296
  726    HG3  GLU  89           HG1      GLU  89 -13.499   3.547  -0.149
  727    HA   PRO  90           HA       PRO  90 -14.362   9.238   4.475
  728    HB2  PRO  90           HB2      PRO  90 -12.907  11.196   2.873
  729    HB3  PRO  90           HB1      PRO  90 -12.676  10.812   4.586
  730    HG2  PRO  90           HG2      PRO  90 -10.932  10.101   2.380
  731    HG3  PRO  90           HG1      PRO  90 -10.716   9.707   4.091
  732    HD2  PRO  90           HD2      PRO  90 -11.480   7.902   1.940
  733    HD3  PRO  90           HD1      PRO  90 -11.242   7.507   3.660
  734    H    LYS  91           HN       LYS  91 -16.170  10.437   3.801
  735    HA   LYS  91           HA       LYS  91 -16.645  11.250   1.087
  736    HB2  LYS  91           HB2      LYS  91 -18.547   9.653   0.622
  737    HB3  LYS  91           HB1      LYS  91 -16.955   8.900   0.596
  738    HG2  LYS  91           HG2      LYS  91 -17.275   8.055   2.869
  739    HG3  LYS  91           HG1      LYS  91 -18.830   8.883   2.982
  740    HD2  LYS  91           HD2      LYS  91 -19.706   7.527   1.131
  741    HD3  LYS  91           HD1      LYS  91 -18.147   6.718   0.971
  742    HE2  LYS  91           HE2      LYS  91 -19.975   6.633   3.390
  743    HE3  LYS  91           HE1      LYS  91 -19.651   5.306   2.274
  744    HZ1  LYS  91           HZ1      LYS  91 -17.254   5.566   2.903
  745    HZ2  LYS  91           HZ2      LYS  91 -18.267   4.980   4.135
  746    HZ3  LYS  91           HZ3      LYS  91 -17.758   6.600   4.150
  Start of MODEL   17
    1    H1   MET   1           HT1      MET   1  -7.821  16.860   7.152
    2    H2   MET   1           HT2      MET   1  -7.899  18.539   6.900
    3    H3   MET   1           HT3      MET   1  -9.293  17.678   7.352
    4    HA   MET   1           HA       MET   1  -7.560  18.982   9.030
    5    HB2  MET   1           HB2      MET   1 -10.011  18.381   9.311
    6    HB3  MET   1           HB1      MET   1  -9.495  16.757   9.759
    7    HG2  MET   1           HG2      MET   1  -9.799  17.974  11.808
    8    HG3  MET   1           HG1      MET   1  -8.058  17.837  11.568
    9    HE1  MET   1           HE1      MET   1  -9.575  19.773  13.470
   10    HE2  MET   1           HE2      MET   1  -8.759  21.321  13.262
   11    HE3  MET   1           HE3      MET   1  -7.809  19.840  13.371
   12    H    ALA   2           HN       ALA   2  -8.187  15.488   9.431
   13    HA   ALA   2           HA       ALA   2  -5.686  15.097  10.832
   14    HB1  ALA   2           HB1      ALA   2  -6.279  12.726  10.799
   15    HB2  ALA   2           HB2      ALA   2  -7.502  13.023   9.564
   16    HB3  ALA   2           HB3      ALA   2  -7.709  13.680  11.188
   17    H    SER   3           HN       SER   3  -3.780  14.099  10.067
   18    HA   SER   3           HA       SER   3  -3.147  14.552   7.281
   19    HB2  SER   3           HB2      SER   3  -1.690  13.148   9.544
   20    HB3  SER   3           HB1      SER   3  -1.000  13.272   7.926
   21    HG   SER   3           HG       SER   3  -0.767  15.386   8.178
   22    H    THR   4           HN       THR   4  -3.268  13.126   5.584
   23    HA   THR   4           HA       THR   4  -4.736  10.651   5.911
   24    HB   THR   4           HB       THR   4  -3.064  11.383   3.484
   25    HG1  THR   4           HG1      THR   4  -5.475  12.253   3.121
   26   HG21  THR   4          HG21      THR   4  -5.790  10.076   3.661
   27   HG22  THR   4          HG22      THR   4  -4.285   9.156   3.648
   28   HG23  THR   4          HG23      THR   4  -4.719  10.155   2.261
   29    H    ARG   5           HN       ARG   5  -1.319  11.483   5.673
   30    HA   ARG   5           HA       ARG   5  -0.227   8.932   5.144
   31    HB2  ARG   5           HB2      ARG   5   0.904  11.063   6.991
   32    HB3  ARG   5           HB1      ARG   5   1.805   9.723   6.294
   33    HG2  ARG   5           HG2      ARG   5   2.325  11.203   4.597
   34    HG3  ARG   5           HG1      ARG   5   0.703  10.869   4.005
   35    HD2  ARG   5           HD2      ARG   5  -0.131  12.805   5.372
   36    HD3  ARG   5           HD1      ARG   5   1.536  13.157   5.817
   37    HE   ARG   5           HE       ARG   5   1.577  13.071   3.037
   38   HH11  ARG   5          HH21      ARG   5  -0.208  14.746   5.474
   39   HH12  ARG   5          HH22      ARG   5  -0.465  16.156   4.500
   40   HH21  ARG   5          HH11      ARG   5   1.249  14.902   1.759
   41   HH22  ARG   5          HH12      ARG   5   0.359  16.244   2.399
   42    H    CYS   6           HN       CYS   6  -1.363  10.346   8.187
   43    HA   CYS   6           HA       CYS   6  -0.444   8.220   9.881
   44    HB2  CYS   6           HB2      CYS   6  -1.229  10.477  10.678
   45    HB3  CYS   6           HB1      CYS   6  -2.879   9.974  10.313
   46    HG   CYS   6           HG       CYS   6  -1.451   7.984  12.133
   47    H    LYS   7           HN       LYS   7  -3.283   8.646   7.855
   48    HA   LYS   7           HA       LYS   7  -4.764   6.411   8.975
   49    HB2  LYS   7           HB2      LYS   7  -5.115   7.600   6.205
   50    HB3  LYS   7           HB1      LYS   7  -6.313   6.745   7.172
   51    HG2  LYS   7           HG2      LYS   7  -5.068   9.416   7.932
   52    HG3  LYS   7           HG1      LYS   7  -6.650   9.220   7.181
   53    HD2  LYS   7           HD2      LYS   7  -7.236   7.693   9.173
   54    HD3  LYS   7           HD1      LYS   7  -5.772   8.311   9.937
   55    HE2  LYS   7           HE2      LYS   7  -6.631  10.626   9.677
   56    HE3  LYS   7           HE1      LYS   7  -8.114   9.981   8.974
   57    HZ1  LYS   7           HZ1      LYS   7  -7.098   9.656  11.733
   58    HZ2  LYS   7           HZ2      LYS   7  -8.286   8.624  11.090
   59    HZ3  LYS   7           HZ3      LYS   7  -8.588  10.291  11.226
   60    H    LEU   8           HN       LEU   8  -2.899   6.796   5.907
   61    HA   LEU   8           HA       LEU   8  -3.201   4.035   5.135
   62    HB2  LEU   8           HB2      LEU   8  -0.866   5.867   4.509
   63    HB3  LEU   8           HB1      LEU   8  -1.336   4.432   3.606
   64    HG   LEU   8           HG       LEU   8  -3.119   6.870   3.950
   65   HD11  LEU   8          HD11      LEU   8  -1.258   6.085   1.684
   66   HD12  LEU   8          HD12      LEU   8  -1.155   7.532   2.687
   67   HD13  LEU   8          HD13      LEU   8  -2.494   7.337   1.555
   68   HD21  LEU   8          HD21      LEU   8  -4.494   4.992   3.394
   69   HD22  LEU   8          HD22      LEU   8  -3.299   4.340   2.272
   70   HD23  LEU   8          HD23      LEU   8  -4.206   5.792   1.854
   71    H    ALA   9           HN       ALA   9  -0.824   5.655   7.213
   72    HA   ALA   9           HA       ALA   9   0.925   3.380   7.454
   73    HB1  ALA   9           HB1      ALA   9   1.646   5.639   8.137
   74    HB2  ALA   9           HB2      ALA   9   1.781   4.502   9.483
   75    HB3  ALA   9           HB3      ALA   9   0.433   5.636   9.417
   76    H    ARG  10           HN       ARG  10  -1.955   4.450   9.185
   77    HA   ARG  10           HA       ARG  10  -1.841   2.626  11.342
   78    HB2  ARG  10           HB2      ARG  10  -3.633   4.574  10.485
   79    HB3  ARG  10           HB1      ARG  10  -4.580   3.116  10.246
   80    HG2  ARG  10           HG2      ARG  10  -4.058   2.475  12.631
   81    HG3  ARG  10           HG1      ARG  10  -3.279   4.048  12.827
   82    HD2  ARG  10           HD2      ARG  10  -5.561   4.237  13.632
   83    HD3  ARG  10           HD1      ARG  10  -5.439   5.130  12.114
   84    HE   ARG  10           HE       ARG  10  -6.251   2.589  11.336
   85   HH11  ARG  10          HH21      ARG  10  -7.343   4.996  13.560
   86   HH12  ARG  10          HH22      ARG  10  -9.013   4.561  13.413
   87   HH21  ARG  10          HH11      ARG  10  -8.425   2.013  11.136
   88   HH22  ARG  10          HH12      ARG  10  -9.624   2.874  12.042
   89    H    TYR  11           HN       TYR  11  -2.854   2.171   7.997
   90    HA   TYR  11           HA       TYR  11  -3.962  -0.497   8.470
   91    HB2  TYR  11           HB2      TYR  11  -3.359   1.184   6.030
   92    HB3  TYR  11           HB1      TYR  11  -3.722  -0.528   5.826
   93    HD1  TYR  11           HD2      TYR  11  -5.861  -1.459   6.759
   94    HD2  TYR  11           HD1      TYR  11  -5.131   2.760   6.476
   95    HE1  TYR  11           HE2      TYR  11  -8.296  -1.031   6.976
   96    HE2  TYR  11           HE1      TYR  11  -7.567   3.196   6.698
   97    HH   TYR  11           HH       TYR  11  -9.592   1.744   7.839
   98    H    LEU  12           HN       LEU  12  -0.991   0.608   6.740
   99    HA   LEU  12           HA       LEU  12   0.042  -2.054   6.446
  100    HB2  LEU  12           HB2      LEU  12   1.802   0.407   6.716
  101    HB3  LEU  12           HB1      LEU  12   2.123  -1.058   5.798
  102    HG   LEU  12           HG       LEU  12  -0.192   0.818   5.083
  103   HD11  LEU  12          HD11      LEU  12   1.968   2.045   4.971
  104   HD12  LEU  12          HD12      LEU  12   1.289   1.771   3.368
  105   HD13  LEU  12          HD13      LEU  12   2.627   0.775   3.941
  106   HD21  LEU  12          HD21      LEU  12   0.179  -0.296   2.818
  107   HD22  LEU  12          HD22      LEU  12  -0.433  -1.371   4.065
  108   HD23  LEU  12          HD23      LEU  12   1.273  -1.421   3.619
  109    H    GLU  13           HN       GLU  13   0.041   0.158   9.108
  110    HA   GLU  13           HA       GLU  13   2.144  -1.251  10.600
  111    HB2  GLU  13           HB2      GLU  13   1.642   1.220  10.839
  112    HB3  GLU  13           HB1      GLU  13   0.126   0.778  11.623
  113    HG2  GLU  13           HG2      GLU  13   1.756   1.231  13.341
  114    HG3  GLU  13           HG1      GLU  13   1.471  -0.507  13.323
  115    H    ASP  14           HN       ASP  14  -1.336  -1.467  10.275
  116    HA   ASP  14           HA       ASP  14  -1.673  -3.004  12.766
  117    HB2  ASP  14           HB2      ASP  14  -3.542  -2.325  10.470
  118    HB3  ASP  14           HB1      ASP  14  -4.027  -3.361  11.813
  119    H    LEU  15           HN       LEU  15  -0.383  -3.825   9.750
  120    HA   LEU  15           HA       LEU  15  -1.569  -6.559   9.690
  121    HB2  LEU  15           HB2      LEU  15   0.737  -5.469   8.043
  122    HB3  LEU  15           HB1      LEU  15  -0.167  -6.949   7.744
  123    HG   LEU  15           HG       LEU  15  -1.158  -4.093   7.490
  124   HD11  LEU  15          HD11      LEU  15  -1.109  -6.371   5.488
  125   HD12  LEU  15          HD12      LEU  15   0.146  -5.138   5.600
  126   HD13  LEU  15          HD13      LEU  15  -1.502  -4.684   5.163
  127   HD21  LEU  15          HD21      LEU  15  -3.337  -5.278   6.706
  128   HD22  LEU  15          HD22      LEU  15  -3.048  -5.201   8.438
  129   HD23  LEU  15          HD23      LEU  15  -2.720  -6.695   7.559
  130    H    GLU  16           HN       GLU  16  -0.059  -8.453   9.667
  131    HA   GLU  16           HA       GLU  16   1.467  -8.514  12.091
  132    HB2  GLU  16           HB2      GLU  16   0.338 -10.483  10.940
  133    HB3  GLU  16           HB1      GLU  16   1.666 -10.476   9.784
  134    HG2  GLU  16           HG2      GLU  16   2.227 -12.091  11.480
  135    HG3  GLU  16           HG1      GLU  16   3.255 -10.688  11.756
  136    H    ASP  17           HN       ASP  17   3.748  -8.654  12.374
  137    HA   ASP  17           HA       ASP  17   5.330  -6.907  10.810
  138    HB2  ASP  17           HB2      ASP  17   7.268  -7.920  11.995
  139    HB3  ASP  17           HB1      ASP  17   5.948  -7.528  13.096
  140    H    VAL  18           HN       VAL  18   5.146 -10.484  10.713
  141    HA   VAL  18           HA       VAL  18   7.115 -10.762   8.641
  142    HB   VAL  18           HB       VAL  18   4.802 -12.596   9.400
  143   HG11  VAL  18          HG11      VAL  18   6.246 -14.349   8.260
  144   HG12  VAL  18          HG12      VAL  18   7.221 -13.031   7.612
  145   HG13  VAL  18          HG13      VAL  18   5.523 -13.177   7.158
  146   HG21  VAL  18          HG21      VAL  18   7.758 -12.738  10.090
  147   HG22  VAL  18          HG22      VAL  18   6.487 -13.808  10.679
  148   HG23  VAL  18          HG23      VAL  18   6.518 -12.117  11.180
  149    H    ASP  19           HN       ASP  19   3.621 -10.133   8.575
  150    HA   ASP  19           HA       ASP  19   3.374 -10.525   5.703
  151    HB2  ASP  19           HB2      ASP  19   1.624  -9.052   7.700
  152    HB3  ASP  19           HB1      ASP  19   1.192  -9.336   6.014
  153    H    LEU  20           HN       LEU  20   4.261  -7.875   7.822
  154    HA   LEU  20           HA       LEU  20   3.901  -5.716   6.006
  155    HB2  LEU  20           HB2      LEU  20   4.396  -5.469   8.444
  156    HB3  LEU  20           HB1      LEU  20   6.033  -6.033   8.141
  157    HG   LEU  20           HG       LEU  20   6.377  -4.093   6.590
  158   HD11  LEU  20          HD11      LEU  20   3.536  -3.479   7.439
  159   HD12  LEU  20          HD12      LEU  20   4.254  -3.413   5.829
  160   HD13  LEU  20          HD13      LEU  20   4.635  -2.167   7.007
  161   HD21  LEU  20          HD21      LEU  20   5.492  -3.394   9.408
  162   HD22  LEU  20          HD22      LEU  20   6.550  -2.413   8.394
  163   HD23  LEU  20          HD23      LEU  20   7.084  -3.999   8.950
  164    H    LYS  21           HN       LYS  21   6.669  -7.881   6.566
  165    HA   LYS  21           HA       LYS  21   8.407  -6.621   4.651
  166    HB2  LYS  21           HB2      LYS  21   8.375  -9.476   5.684
  167    HB3  LYS  21           HB1      LYS  21   9.698  -8.735   4.782
  168    HG2  LYS  21           HG2      LYS  21  10.125  -7.147   6.536
  169    HG3  LYS  21           HG1      LYS  21   8.638  -7.577   7.376
  170    HD2  LYS  21           HD2      LYS  21  10.534  -8.623   8.505
  171    HD3  LYS  21           HD1      LYS  21   9.539  -9.868   7.755
  172    HE2  LYS  21           HE2      LYS  21  11.106 -10.214   5.995
  173    HE3  LYS  21           HE1      LYS  21  11.944  -8.696   6.329
  174    HZ1  LYS  21           HZ1      LYS  21  13.116 -10.692   7.150
  175    HZ2  LYS  21           HZ2      LYS  21  11.824 -10.984   8.214
  176    HZ3  LYS  21           HZ3      LYS  21  12.758  -9.574   8.372
  177    H    LYS  22           HN       LYS  22   5.955  -9.158   4.401
  178    HA   LYS  22           HA       LYS  22   6.664  -9.975   1.722
  179    HB2  LYS  22           HB2      LYS  22   4.117 -10.223   3.352
  180    HB3  LYS  22           HB1      LYS  22   4.228 -10.846   1.710
  181    HG2  LYS  22           HG2      LYS  22   6.332 -11.637   3.746
  182    HG3  LYS  22           HG1      LYS  22   4.768 -12.443   3.759
  183    HD2  LYS  22           HD2      LYS  22   5.079 -13.052   1.367
  184    HD3  LYS  22           HD1      LYS  22   6.676 -12.308   1.400
  185    HE2  LYS  22           HE2      LYS  22   6.814 -14.751   1.755
  186    HE3  LYS  22           HE1      LYS  22   7.383 -13.861   3.167
  187    HZ1  LYS  22           HZ1      LYS  22   4.576 -14.753   2.929
  188    HZ2  LYS  22           HZ2      LYS  22   5.430 -14.302   4.327
  189    HZ3  LYS  22           HZ3      LYS  22   5.776 -15.775   3.553
  190    H    PHE  23           HN       PHE  23   4.778  -7.316   3.021
  191    HA   PHE  23           HA       PHE  23   3.414  -6.667   0.538
  192    HB2  PHE  23           HB2      PHE  23   2.697  -5.882   2.818
  193    HB3  PHE  23           HB1      PHE  23   4.095  -4.811   2.842
  194    HD1  PHE  23           HD2      PHE  23   4.338  -3.026   1.070
  195    HD2  PHE  23           HD1      PHE  23   0.717  -5.287   1.584
  196    HE1  PHE  23           HE2      PHE  23   3.089  -1.324  -0.229
  197    HE2  PHE  23           HE1      PHE  23  -0.529  -3.581   0.284
  198    HZ   PHE  23           HZ       PHE  23   0.657  -1.601  -0.621
  199    H    LYS  24           HN       LYS  24   6.448  -5.486   2.049
  200    HA   LYS  24           HA       LYS  24   6.977  -3.569  -0.055
  201    HB2  LYS  24           HB2      LYS  24   8.868  -4.852   1.943
  202    HB3  LYS  24           HB1      LYS  24   9.225  -3.437   0.952
  203    HG2  LYS  24           HG2      LYS  24   7.530  -2.130   2.050
  204    HG3  LYS  24           HG1      LYS  24   6.881  -3.548   2.874
  205    HD2  LYS  24           HD2      LYS  24   8.275  -2.166   4.388
  206    HD3  LYS  24           HD1      LYS  24   8.946  -3.780   4.170
  207    HE2  LYS  24           HE2      LYS  24   9.878  -1.515   2.396
  208    HE3  LYS  24           HE1      LYS  24  10.562  -1.722   4.007
  209    HZ1  LYS  24           HZ1      LYS  24  11.045  -3.230   1.645
  210    HZ2  LYS  24           HZ2      LYS  24  10.546  -4.237   2.919
  211    HZ3  LYS  24           HZ3      LYS  24  11.896  -3.223   3.111
  212    H    MET  25           HN       MET  25   8.225  -6.847   0.648
  213    HA   MET  25           HA       MET  25  10.034  -7.028  -1.517
  214    HB2  MET  25           HB2      MET  25   9.819  -8.701   0.336
  215    HB3  MET  25           HB1      MET  25   8.331  -9.281  -0.410
  216    HG2  MET  25           HG2      MET  25   9.529  -9.914  -2.428
  217    HG3  MET  25           HG1      MET  25  11.019  -9.199  -1.811
  218    HE1  MET  25           HE1      MET  25  10.034 -12.303  -2.809
  219    HE2  MET  25           HE2      MET  25  11.246 -13.201  -1.900
  220    HE3  MET  25           HE3      MET  25  11.701 -11.715  -2.731
  221    H    HIS  26           HN       HIS  26   6.529  -7.535  -1.423
  222    HA   HIS  26           HA       HIS  26   6.340  -8.594  -4.125
  223    HB2  HIS  26           HB2      HIS  26   4.543  -8.820  -2.342
  224    HB3  HIS  26           HB1      HIS  26   4.207  -7.099  -2.540
  225    HD1  HIS  26           HD1      HIS  26   3.916  -6.502  -5.328
  226    HD2  HIS  26           HD2      HIS  26   2.851 -10.287  -3.942
  227    HE1  HIS  26           HE1      HIS  26   2.353  -7.487  -7.061
  228    H    LEU  27           HN       LEU  27   6.076  -5.321  -2.733
  229    HA   LEU  27           HA       LEU  27   5.435  -4.087  -5.300
  230    HB2  LEU  27           HB2      LEU  27   5.097  -3.263  -2.767
  231    HB3  LEU  27           HB1      LEU  27   6.673  -2.536  -3.016
  232    HG   LEU  27           HG       LEU  27   5.056  -0.860  -3.561
  233   HD11  LEU  27          HD11      LEU  27   5.810  -1.932  -6.281
  234   HD12  LEU  27          HD12      LEU  27   7.005  -1.235  -5.183
  235   HD13  LEU  27          HD13      LEU  27   5.658  -0.258  -5.760
  236   HD21  LEU  27          HD21      LEU  27   3.109  -1.126  -4.829
  237   HD22  LEU  27          HD22      LEU  27   3.183  -2.663  -3.978
  238   HD23  LEU  27          HD23      LEU  27   3.695  -2.559  -5.662
  239    H    GLU  28           HN       GLU  28   8.391  -4.758  -3.488
  240    HA   GLU  28           HA       GLU  28  10.138  -3.121  -5.065
  241    HB2  GLU  28           HB2      GLU  28  10.681  -4.187  -2.822
  242    HB3  GLU  28           HB1      GLU  28  10.876  -5.716  -3.673
  243    HG2  GLU  28           HG2      GLU  28  13.069  -4.749  -3.483
  244    HG3  GLU  28           HG1      GLU  28  12.580  -4.553  -5.164
  245    H    ASP  29           HN       ASP  29   8.927  -6.428  -5.484
  246    HA   ASP  29           HA       ASP  29  10.530  -6.737  -7.996
  247    HB2  ASP  29           HB2      ASP  29   9.677  -9.088  -7.911
  248    HB3  ASP  29           HB1      ASP  29  10.612  -8.639  -6.485
  249    H    TYR  30           HN       TYR  30   8.326  -4.837  -7.917
  250    HA   TYR  30           HA       TYR  30   5.944  -5.969  -8.991
  251    HB2  TYR  30           HB2      TYR  30   6.309  -3.606  -8.040
  252    HB3  TYR  30           HB1      TYR  30   6.961  -3.178  -9.619
  253    HD1  TYR  30           HD1      TYR  30   3.948  -4.407  -7.823
  254    HD2  TYR  30           HD2      TYR  30   5.492  -2.844 -11.515
  255    HE1  TYR  30           HE1      TYR  30   1.635  -4.102  -8.663
  256    HE2  TYR  30           HE2      TYR  30   3.178  -2.541 -12.353
  257    HH   TYR  30           HH       TYR  30   1.020  -2.720 -11.894
  258    HA   PRO  31           HA       PRO  31   7.649  -6.986 -13.013
  259    HB2  PRO  31           HB2      PRO  31   5.219  -6.961 -14.513
  260    HB3  PRO  31           HB1      PRO  31   5.932  -8.365 -13.704
  261    HG2  PRO  31           HG2      PRO  31   3.606  -6.721 -12.858
  262    HG3  PRO  31           HG1      PRO  31   4.057  -8.355 -12.345
  263    HD2  PRO  31           HD2      PRO  31   4.373  -6.000 -10.790
  264    HD3  PRO  31           HD1      PRO  31   5.147  -7.568 -10.469
  265    HA   PRO  32           HA       PRO  32   7.982  -2.891 -14.835
  266    HB2  PRO  32           HB2      PRO  32   8.705  -3.627 -17.486
  267    HB3  PRO  32           HB1      PRO  32   9.830  -3.377 -16.143
  268    HG2  PRO  32           HG2      PRO  32   8.911  -5.942 -17.344
  269    HG3  PRO  32           HG1      PRO  32  10.366  -5.619 -16.385
  270    HD2  PRO  32           HD2      PRO  32   8.052  -6.951 -15.434
  271    HD3  PRO  32           HD1      PRO  32   9.330  -6.247 -14.418
  272    H    GLN  33           HN       GLN  33   6.572  -1.508 -15.955
  273    HA   GLN  33           HA       GLN  33   4.230  -2.774 -17.369
  274    HB2  GLN  33           HB2      GLN  33   4.404  -0.064 -16.010
  275    HB3  GLN  33           HB1      GLN  33   2.963  -0.794 -16.717
  276    HG2  GLN  33           HG2      GLN  33   4.537  -2.006 -14.425
  277    HG3  GLN  33           HG1      GLN  33   3.070  -1.047 -14.230
  278   HE21  GLN  33          HE21      GLN  33   1.224  -1.928 -15.888
  279   HE22  GLN  33          HE22      GLN  33   1.012  -3.612 -15.843
  280    H    LYS  34           HN       LYS  34   7.078  -1.310 -18.039
  281    HA   LYS  34           HA       LYS  34   7.895  -0.073 -19.854
  282    HB2  LYS  34           HB2      LYS  34   6.735  -2.022 -21.005
  283    HB3  LYS  34           HB1      LYS  34   5.343  -0.966 -21.235
  284    HG2  LYS  34           HG2      LYS  34   6.778   0.642 -22.463
  285    HG3  LYS  34           HG1      LYS  34   8.153  -0.442 -22.255
  286    HD2  LYS  34           HD2      LYS  34   7.003  -2.194 -23.520
  287    HD3  LYS  34           HD1      LYS  34   5.575  -1.170 -23.678
  288    HE2  LYS  34           HE2      LYS  34   6.900   0.494 -24.928
  289    HE3  LYS  34           HE1      LYS  34   8.331  -0.526 -24.772
  290    HZ1  LYS  34           HZ1      LYS  34   6.258  -0.685 -26.670
  291    HZ2  LYS  34           HZ2      LYS  34   6.287  -2.124 -25.767
  292    HZ3  LYS  34           HZ3      LYS  34   7.684  -1.597 -26.579
  293    H    GLY  35           HN       GLY  35   7.169   1.782 -18.293
  294    HA2  GLY  35           HA2      GLY  35   6.324   4.011 -19.701
  295    HA3  GLY  35           HA1      GLY  35   4.819   3.321 -19.086
  296    H    CYS  36           HN       CYS  36   5.012   2.691 -16.640
  297    HA   CYS  36           HA       CYS  36   5.558   5.107 -15.174
  298    HB2  CYS  36           HB2      CYS  36   3.849   3.465 -14.460
  299    HB3  CYS  36           HB1      CYS  36   5.123   2.287 -14.140
  300    HG   CYS  36           HG       CYS  36   6.052   4.256 -12.415
  301    H    ILE  37           HN       ILE  37   7.216   5.485 -13.615
  302    HA   ILE  37           HA       ILE  37   9.808   4.291 -14.290
  303    HB   ILE  37           HB       ILE  37   9.122   6.312 -12.130
  304   HG12  ILE  37          HG12      ILE  37  10.085   6.826 -14.963
  305   HG13  ILE  37          HG11      ILE  37   8.408   7.013 -14.446
  306   HG21  ILE  37          HG21      ILE  37  11.743   5.803 -13.569
  307   HG22  ILE  37          HG22      ILE  37  11.366   5.197 -11.956
  308   HG23  ILE  37          HG23      ILE  37  11.466   6.929 -12.244
  309   HD11  ILE  37          HD11      ILE  37   9.179   8.645 -12.696
  310   HD12  ILE  37          HD12      ILE  37   9.492   9.197 -14.342
  311   HD13  ILE  37          HD13      ILE  37  10.807   8.536 -13.368
  312    HA   PRO  38           HA       PRO  38   8.913   1.238 -10.983
  313    HB2  PRO  38           HB2      PRO  38  11.689   0.289 -11.087
  314    HB3  PRO  38           HB1      PRO  38  10.219  -0.567 -11.576
  315    HG2  PRO  38           HG2      PRO  38  12.213   0.539 -13.322
  316    HG3  PRO  38           HG1      PRO  38  10.662  -0.167 -13.800
  317    HD2  PRO  38           HD2      PRO  38  11.431   2.652 -13.817
  318    HD3  PRO  38           HD1      PRO  38   9.926   1.924 -14.411
  319    H    LEU  39           HN       LEU  39   9.307   1.333  -8.751
  320    HA   LEU  39           HA       LEU  39  10.591   3.705  -7.746
  321    HB2  LEU  39           HB2      LEU  39   9.340   1.258  -6.498
  322    HB3  LEU  39           HB1      LEU  39  10.163   2.438  -5.481
  323    HG   LEU  39           HG       LEU  39   8.679   4.213  -6.289
  324   HD11  LEU  39          HD11      LEU  39   7.566   2.009  -8.050
  325   HD12  LEU  39          HD12      LEU  39   8.211   3.575  -8.546
  326   HD13  LEU  39          HD13      LEU  39   6.668   3.488  -7.705
  327   HD21  LEU  39          HD21      LEU  39   7.093   1.753  -5.487
  328   HD22  LEU  39          HD22      LEU  39   6.617   3.433  -5.242
  329   HD23  LEU  39          HD23      LEU  39   7.994   2.770  -4.363
  330    HA   PRO  40           HA       PRO  40  14.677   1.651  -7.830
  331    HB2  PRO  40           HB2      PRO  40  15.752   3.735  -6.041
  332    HB3  PRO  40           HB1      PRO  40  16.166   3.421  -7.733
  333    HG2  PRO  40           HG2      PRO  40  14.610   5.611  -6.755
  334    HG3  PRO  40           HG1      PRO  40  14.835   5.159  -8.452
  335    HD2  PRO  40           HD2      PRO  40  12.420   4.847  -6.810
  336    HD3  PRO  40           HD1      PRO  40  12.612   4.544  -8.554
  337    H    ARG  41           HN       ARG  41  15.571   0.166  -6.393
  338    HA   ARG  41           HA       ARG  41  14.103  -0.492  -4.015
  339    HB2  ARG  41           HB2      ARG  41  16.014  -2.085  -3.587
  340    HB3  ARG  41           HB1      ARG  41  15.356  -2.220  -5.220
  341    HG2  ARG  41           HG2      ARG  41  17.168  -0.733  -6.050
  342    HG3  ARG  41           HG1      ARG  41  17.845  -0.677  -4.422
  343    HD2  ARG  41           HD2      ARG  41  18.072  -3.158  -4.467
  344    HD3  ARG  41           HD1      ARG  41  17.499  -3.153  -6.135
  345    HE   ARG  41           HE       ARG  41  19.630  -1.374  -6.157
  346   HH11  ARG  41          HH21      ARG  41  19.112  -4.640  -5.162
  347   HH12  ARG  41          HH22      ARG  41  20.735  -5.137  -5.499
  348   HH21  ARG  41          HH11      ARG  41  21.749  -2.011  -6.601
  349   HH22  ARG  41          HH12      ARG  41  22.227  -3.650  -6.313
  350    H    GLY  42           HN       GLY  42  16.994   1.446  -4.572
  351    HA2  GLY  42           HA2      GLY  42  17.900   1.566  -1.845
  352    HA3  GLY  42           HA1      GLY  42  18.250   2.802  -3.056
  353    H    GLN  43           HN       GLN  43  15.481   3.534  -3.590
  354    HA   GLN  43           HA       GLN  43  15.081   5.341  -1.335
  355    HB2  GLN  43           HB2      GLN  43  13.461   4.788  -3.849
  356    HB3  GLN  43           HB1      GLN  43  13.028   6.031  -2.674
  357    HG2  GLN  43           HG2      GLN  43  15.291   7.058  -3.003
  358    HG3  GLN  43           HG1      GLN  43  15.603   5.874  -4.273
  359   HE21  GLN  43          HE21      GLN  43  15.599   8.596  -4.970
  360   HE22  GLN  43          HE22      GLN  43  14.220   8.944  -5.896
  361    H    THR  44           HN       THR  44  13.301   2.540  -2.656
  362    HA   THR  44           HA       THR  44  11.158   2.653  -0.764
  363    HB   THR  44           HB       THR  44  12.259   0.290  -2.309
  364    HG1  THR  44           HG1      THR  44  11.066   2.473  -3.098
  365   HG21  THR  44          HG21      THR  44   9.892  -0.572  -2.016
  366   HG22  THR  44          HG22      THR  44   9.657   0.690  -0.808
  367   HG23  THR  44          HG23      THR  44  10.865  -0.569  -0.546
  368    H    GLU  45           HN       GLU  45  14.160   0.661  -0.730
  369    HA   GLU  45           HA       GLU  45  13.553  -0.687   1.701
  370    HB2  GLU  45           HB2      GLU  45  15.897  -1.273   1.811
  371    HB3  GLU  45           HB1      GLU  45  15.450  -1.246   0.105
  372    HG2  GLU  45           HG2      GLU  45  16.325   1.158   0.053
  373    HG3  GLU  45           HG1      GLU  45  17.000   0.855   1.651
  374    H    LYS  46           HN       LYS  46  15.276   2.429   1.179
  375    HA   LYS  46           HA       LYS  46  15.696   2.850   4.026
  376    HB2  LYS  46           HB2      LYS  46  17.060   3.875   2.131
  377    HB3  LYS  46           HB1      LYS  46  15.703   4.958   1.843
  378    HG2  LYS  46           HG2      LYS  46  15.858   5.773   4.179
  379    HG3  LYS  46           HG1      LYS  46  17.201   4.674   4.467
  380    HD2  LYS  46           HD2      LYS  46  18.424   6.596   3.958
  381    HD3  LYS  46           HD1      LYS  46  18.249   5.952   2.330
  382    HE2  LYS  46           HE2      LYS  46  16.413   8.019   3.594
  383    HE3  LYS  46           HE1      LYS  46  17.708   8.375   2.455
  384    HZ1  LYS  46           HZ1      LYS  46  16.547   6.758   0.923
  385    HZ2  LYS  46           HZ2      LYS  46  15.772   8.248   1.178
  386    HZ3  LYS  46           HZ3      LYS  46  15.220   6.852   1.975
  387    H    ALA  47           HN       ALA  47  13.015   3.308   1.890
  388    HA   ALA  47           HA       ALA  47  11.732   5.500   3.216
  389    HB1  ALA  47           HB1      ALA  47   9.697   4.750   2.092
  390    HB2  ALA  47           HB2      ALA  47  10.423   3.178   1.768
  391    HB3  ALA  47           HB3      ALA  47  11.056   4.620   0.981
  392    H    ASP  48           HN       ASP  48  11.025   5.550   5.271
  393    HA   ASP  48           HA       ASP  48  10.712   3.088   6.850
  394    HB2  ASP  48           HB2      ASP  48   9.992   5.922   7.677
  395    HB3  ASP  48           HB1      ASP  48  10.433   4.568   8.721
  396    H    HIS  49           HN       HIS  49   8.571   3.189   8.360
  397    HA   HIS  49           HA       HIS  49   6.375   2.484   6.753
  398    HB2  HIS  49           HB2      HIS  49   6.282   3.592   9.569
  399    HB3  HIS  49           HB1      HIS  49   5.025   2.634   8.789
  400    HD1  HIS  49           HD1      HIS  49   7.466   2.125  11.195
  401    HD2  HIS  49           HD2      HIS  49   6.605   0.104   7.652
  402    HE1  HIS  49           HE1      HIS  49   8.492  -0.179  11.418
  403    H    VAL  50           HN       VAL  50   7.039   5.646   8.304
  404    HA   VAL  50           HA       VAL  50   4.610   6.874   7.264
  405    HB   VAL  50           HB       VAL  50   7.219   8.156   8.197
  406   HG11  VAL  50          HG11      VAL  50   4.470   9.341   7.671
  407   HG12  VAL  50          HG12      VAL  50   5.984   9.770   6.876
  408   HG13  VAL  50          HG13      VAL  50   5.736  10.174   8.572
  409   HG21  VAL  50          HG21      VAL  50   4.615   7.572   9.657
  410   HG22  VAL  50          HG22      VAL  50   5.914   8.573  10.302
  411   HG23  VAL  50          HG23      VAL  50   6.195   6.863   9.991
  412    H    ASP  51           HN       ASP  51   8.040   7.021   6.229
  413    HA   ASP  51           HA       ASP  51   7.566   8.679   3.959
  414    HB2  ASP  51           HB2      ASP  51   9.731   6.622   4.481
  415    HB3  ASP  51           HB1      ASP  51   9.758   7.761   3.135
  416    H    LEU  52           HN       LEU  52   7.431   5.137   4.323
  417    HA   LEU  52           HA       LEU  52   7.234   4.459   1.588
  418    HB2  LEU  52           HB2      LEU  52   6.124   3.205   4.098
  419    HB3  LEU  52           HB1      LEU  52   5.705   2.514   2.536
  420    HG   LEU  52           HG       LEU  52   8.603   3.007   3.301
  421   HD11  LEU  52          HD11      LEU  52   7.807   1.605   5.078
  422   HD12  LEU  52          HD12      LEU  52   8.648   0.550   3.949
  423   HD13  LEU  52          HD13      LEU  52   6.883   0.602   3.961
  424   HD21  LEU  52          HD21      LEU  52   7.208   1.150   1.329
  425   HD22  LEU  52          HD22      LEU  52   8.927   1.058   1.700
  426   HD23  LEU  52          HD23      LEU  52   8.273   2.498   0.937
  427    H    ALA  53           HN       ALA  53   4.577   5.221   3.868
  428    HA   ALA  53           HA       ALA  53   2.503   5.098   1.885
  429    HB1  ALA  53           HB1      ALA  53   1.221   6.505   3.552
  430    HB2  ALA  53           HB2      ALA  53   2.692   6.589   4.519
  431    HB3  ALA  53           HB3      ALA  53   1.916   5.032   4.229
  432    H    THR  54           HN       THR  54   4.789   7.603   2.788
  433    HA   THR  54           HA       THR  54   3.397   9.800   1.521
  434    HB   THR  54           HB       THR  54   6.373   9.491   2.042
  435    HG1  THR  54           HG1      THR  54   5.151  11.004   3.823
  436   HG21  THR  54          HG21      THR  54   6.283  11.982   2.178
  437   HG22  THR  54          HG22      THR  54   4.598  11.923   1.664
  438   HG23  THR  54          HG23      THR  54   5.872  11.375   0.573
  439    H    LEU  55           HN       LEU  55   5.835   7.462   0.368
  440    HA   LEU  55           HA       LEU  55   6.229   8.787  -2.181
  441    HB2  LEU  55           HB2      LEU  55   6.800   5.910  -1.387
  442    HB3  LEU  55           HB1      LEU  55   7.314   6.653  -2.891
  443    HG   LEU  55           HG       LEU  55   8.098   7.881  -0.225
  444   HD11  LEU  55          HD11      LEU  55   8.849   5.554  -0.123
  445   HD12  LEU  55          HD12      LEU  55  10.234   6.612  -0.388
  446   HD13  LEU  55          HD13      LEU  55   9.560   5.688  -1.731
  447   HD21  LEU  55          HD21      LEU  55   9.303   7.935  -3.019
  448   HD22  LEU  55          HD22      LEU  55  10.056   8.659  -1.601
  449   HD23  LEU  55          HD23      LEU  55   8.518   9.277  -2.187
  450    H    MET  56           HN       MET  56   4.082   6.248  -0.995
  451    HA   MET  56           HA       MET  56   3.120   5.405  -3.561
  452    HB2  MET  56           HB2      MET  56   2.768   4.246  -1.310
  453    HB3  MET  56           HB1      MET  56   1.505   5.433  -0.989
  454    HG2  MET  56           HG2      MET  56   0.252   3.680  -1.948
  455    HG3  MET  56           HG1      MET  56   0.589   4.660  -3.370
  456    HE1  MET  56           HE1      MET  56   1.839   0.419  -2.502
  457    HE2  MET  56           HE2      MET  56   0.343   1.290  -2.173
  458    HE3  MET  56           HE3      MET  56   1.776   1.621  -1.205
  459    H    ILE  57           HN       ILE  57   1.967   7.943  -1.328
  460    HA   ILE  57           HA       ILE  57  -0.263   8.638  -3.120
  461    HB   ILE  57           HB       ILE  57  -0.648  10.531  -1.575
  462   HG12  ILE  57          HG12      ILE  57   1.892   9.498  -0.288
  463   HG13  ILE  57          HG11      ILE  57   1.634  11.088  -0.992
  464   HG21  ILE  57          HG21      ILE  57  -0.132   8.010   0.039
  465   HG22  ILE  57          HG22      ILE  57  -1.460   8.132  -1.112
  466   HG23  ILE  57          HG23      ILE  57  -1.394   9.213   0.275
  467   HD11  ILE  57          HD11      ILE  57   1.432  11.395   1.367
  468   HD12  ILE  57          HD12      ILE  57   0.409   9.970   1.540
  469   HD13  ILE  57          HD13      ILE  57  -0.218  11.415   0.745
  470    H    ASP  58           HN       ASP  58   2.959   9.978  -2.456
  471    HA   ASP  58           HA       ASP  58   2.515  12.324  -4.124
  472    HB2  ASP  58           HB2      ASP  58   5.039  11.061  -2.999
  473    HB3  ASP  58           HB1      ASP  58   5.028  12.587  -3.883
  474    H    PHE  59           HN       PHE  59   4.481   9.330  -4.653
  475    HA   PHE  59           HA       PHE  59   5.113  10.134  -7.376
  476    HB2  PHE  59           HB2      PHE  59   6.647   8.686  -6.217
  477    HB3  PHE  59           HB1      PHE  59   5.393   7.485  -5.933
  478    HD1  PHE  59           HD2      PHE  59   7.602   9.008  -8.481
  479    HD2  PHE  59           HD1      PHE  59   4.643   5.990  -7.706
  480    HE1  PHE  59           HE2      PHE  59   8.125   7.931 -10.654
  481    HE2  PHE  59           HE1      PHE  59   5.166   4.917  -9.878
  482    HZ   PHE  59           HZ       PHE  59   6.904   5.887 -11.351
  483    H    ASN  60           HN       ASN  60   2.697   7.767  -6.070
  484    HA   ASN  60           HA       ASN  60   1.763   7.268  -8.864
  485    HB2  ASN  60           HB2      ASN  60   2.064   5.413  -7.120
  486    HB3  ASN  60           HB1      ASN  60   0.653   6.076  -6.298
  487   HD21  ASN  60          HD21      ASN  60   0.145   6.693  -9.543
  488   HD22  ASN  60          HD22      ASN  60  -0.744   5.305  -9.950
  489    H    GLY  61           HN       GLY  61   0.756   8.952  -5.952
  490    HA2  GLY  61           HA2      GLY  61  -0.781  10.892  -6.259
  491    HA3  GLY  61           HA1      GLY  61  -1.725   9.909  -7.374
  492    H    GLU  62           HN       GLU  62  -2.741  11.153  -4.962
  493    HA   GLU  62           HA       GLU  62  -2.930   9.214  -2.834
  494    HB2  GLU  62           HB2      GLU  62  -3.363  11.600  -2.444
  495    HB3  GLU  62           HB1      GLU  62  -4.742  11.551  -3.541
  496    HG2  GLU  62           HG2      GLU  62  -5.962  10.070  -2.074
  497    HG3  GLU  62           HG1      GLU  62  -4.544   9.815  -1.059
  498    H    GLU  63           HN       GLU  63  -4.985   9.972  -5.643
  499    HA   GLU  63           HA       GLU  63  -7.083   8.115  -4.921
  500    HB2  GLU  63           HB2      GLU  63  -6.345   9.326  -7.606
  501    HB3  GLU  63           HB1      GLU  63  -7.827   8.431  -7.280
  502    HG2  GLU  63           HG2      GLU  63  -8.358  10.774  -7.096
  503    HG3  GLU  63           HG1      GLU  63  -8.344  10.123  -5.461
  504    H    LYS  64           HN       LYS  64  -4.345   7.904  -7.218
  505    HA   LYS  64           HA       LYS  64  -4.980   5.206  -8.033
  506    HB2  LYS  64           HB2      LYS  64  -2.479   6.897  -8.217
  507    HB3  LYS  64           HB1      LYS  64  -2.497   5.230  -8.786
  508    HG2  LYS  64           HG2      LYS  64  -4.327   5.750 -10.332
  509    HG3  LYS  64           HG1      LYS  64  -4.387   7.409  -9.742
  510    HD2  LYS  64           HD2      LYS  64  -2.062   7.763 -10.495
  511    HD3  LYS  64           HD1      LYS  64  -2.006   6.106 -11.096
  512    HE2  LYS  64           HE2      LYS  64  -3.930   8.253 -12.041
  513    HE3  LYS  64           HE1      LYS  64  -2.507   7.695 -12.921
  514    HZ1  LYS  64           HZ1      LYS  64  -5.080   6.407 -12.547
  515    HZ2  LYS  64           HZ2      LYS  64  -3.727   5.384 -12.429
  516    HZ3  LYS  64           HZ3      LYS  64  -3.986   6.296 -13.839
  517    H    ALA  65           HN       ALA  65  -2.899   6.559  -5.478
  518    HA   ALA  65           HA       ALA  65  -1.551   4.215  -4.686
  519    HB1  ALA  65           HB1      ALA  65  -1.527   5.226  -2.397
  520    HB2  ALA  65           HB2      ALA  65  -2.677   6.438  -2.961
  521    HB3  ALA  65           HB3      ALA  65  -1.060   6.362  -3.660
  522    H    TRP  66           HN       TRP  66  -4.773   5.360  -3.641
  523    HA   TRP  66           HA       TRP  66  -5.330   3.150  -1.917
  524    HB2  TRP  66           HB2      TRP  66  -7.306   4.781  -3.554
  525    HB3  TRP  66           HB1      TRP  66  -7.686   3.831  -2.121
  526    HD1  TRP  66           HD1      TRP  66  -4.555   5.231  -1.111
  527    HE1  TRP  66           HE1      TRP  66  -4.827   7.452   0.150
  528    HE3  TRP  66           HE3      TRP  66  -9.353   6.412  -2.415
  529    HZ2  TRP  66           HZ2      TRP  66  -6.797   9.472   0.557
  530    HZ3  TRP  66           HZ3      TRP  66 -10.402   8.513  -1.563
  531    HH2  TRP  66           HH2      TRP  66  -9.126  10.031  -0.086
  532    H    ALA  67           HN       ALA  67  -5.705   3.584  -5.410
  533    HA   ALA  67           HA       ALA  67  -7.239   1.188  -5.860
  534    HB1  ALA  67           HB1      ALA  67  -5.325   2.577  -7.762
  535    HB2  ALA  67           HB2      ALA  67  -7.007   3.047  -7.520
  536    HB3  ALA  67           HB3      ALA  67  -6.623   1.468  -8.206
  537    H    MET  68           HN       MET  68  -3.767   1.858  -5.697
  538    HA   MET  68           HA       MET  68  -2.988  -0.840  -6.522
  539    HB2  MET  68           HB2      MET  68  -1.519   1.505  -5.282
  540    HB3  MET  68           HB1      MET  68  -0.722  -0.049  -5.517
  541    HG2  MET  68           HG2      MET  68  -2.140   1.306  -7.827
  542    HG3  MET  68           HG1      MET  68  -0.487   1.744  -7.400
  543    HE1  MET  68           HE1      MET  68   1.530   0.527  -8.493
  544    HE2  MET  68           HE2      MET  68   1.680  -1.186  -8.116
  545    HE3  MET  68           HE3      MET  68   1.284  -0.042  -6.837
  546    H    ALA  69           HN       ALA  69  -3.637   0.837  -3.500
  547    HA   ALA  69           HA       ALA  69  -2.515  -1.131  -1.741
  548    HB1  ALA  69           HB1      ALA  69  -3.773   0.001   0.010
  549    HB2  ALA  69           HB2      ALA  69  -4.827   0.755  -1.186
  550    HB3  ALA  69           HB3      ALA  69  -3.129   1.220  -1.092
  551    H    VAL  70           HN       VAL  70  -5.845  -0.678  -2.985
  552    HA   VAL  70           HA       VAL  70  -6.901  -2.945  -1.493
  553    HB   VAL  70           HB       VAL  70  -8.876  -2.705  -2.967
  554   HG11  VAL  70          HG11      VAL  70  -8.610  -1.248  -0.986
  555   HG12  VAL  70          HG12      VAL  70  -9.431  -0.387  -2.289
  556   HG13  VAL  70          HG13      VAL  70  -7.725  -0.077  -1.964
  557   HG21  VAL  70          HG21      VAL  70  -8.833  -0.768  -4.612
  558   HG22  VAL  70          HG22      VAL  70  -7.845  -2.149  -5.087
  559   HG23  VAL  70          HG23      VAL  70  -7.085  -0.716  -4.398
  560    H    TRP  71           HN       TRP  71  -5.673  -2.556  -4.822
  561    HA   TRP  71           HA       TRP  71  -6.418  -5.187  -5.677
  562    HB2  TRP  71           HB2      TRP  71  -5.778  -3.361  -7.257
  563    HB3  TRP  71           HB1      TRP  71  -4.111  -3.482  -6.697
  564    HD1  TRP  71           HD1      TRP  71  -6.666  -5.201  -8.885
  565    HE1  TRP  71           HE1      TRP  71  -5.538  -7.154 -10.138
  566    HE3  TRP  71           HE3      TRP  71  -2.171  -5.303  -6.481
  567    HZ2  TRP  71           HZ2      TRP  71  -3.049  -8.571 -10.116
  568    HZ3  TRP  71           HZ3      TRP  71  -0.440  -6.956  -7.107
  569    HH2  TRP  71           HH2      TRP  71  -0.872  -8.593  -8.923
  570    H    ILE  72           HN       ILE  72  -3.633  -4.004  -3.833
  571    HA   ILE  72           HA       ILE  72  -2.105  -6.476  -4.183
  572    HB   ILE  72           HB       ILE  72  -1.874  -4.153  -2.243
  573   HG12  ILE  72          HG12      ILE  72  -1.133  -4.034  -4.746
  574   HG13  ILE  72          HG11      ILE  72  -0.013  -3.464  -3.521
  575   HG21  ILE  72          HG21      ILE  72  -0.254  -6.710  -2.277
  576   HG22  ILE  72          HG22      ILE  72  -1.096  -5.980  -0.911
  577   HG23  ILE  72          HG23      ILE  72   0.350  -5.215  -1.564
  578   HD11  ILE  72          HD11      ILE  72   0.746  -5.138  -5.473
  579   HD12  ILE  72          HD12      ILE  72   0.222  -6.348  -4.308
  580   HD13  ILE  72          HD13      ILE  72   1.468  -5.185  -3.869
  581    H    PHE  73           HN       PHE  73  -4.434  -5.309  -1.709
  582    HA   PHE  73           HA       PHE  73  -4.059  -7.386   0.177
  583    HB2  PHE  73           HB2      PHE  73  -6.743  -6.185  -0.539
  584    HB3  PHE  73           HB1      PHE  73  -6.255  -6.868   1.004
  585    HD1  PHE  73           HD1      PHE  73  -3.321  -5.235   0.507
  586    HD2  PHE  73           HD2      PHE  73  -7.507  -4.245   0.840
  587    HE1  PHE  73           HE1      PHE  73  -2.734  -2.980   1.290
  588    HE2  PHE  73           HE2      PHE  73  -6.892  -1.981   1.621
  589    HZ   PHE  73           HZ       PHE  73  -4.509  -1.348   1.848
  590    H    ALA  74           HN       ALA  74  -6.253  -7.330  -2.668
  591    HA   ALA  74           HA       ALA  74  -7.347  -9.929  -2.237
  592    HB1  ALA  74           HB1      ALA  74  -6.836  -8.496  -4.868
  593    HB2  ALA  74           HB2      ALA  74  -8.279  -8.314  -3.870
  594    HB3  ALA  74           HB3      ALA  74  -7.928  -9.863  -4.640
  595    H    ALA  75           HN       ALA  75  -4.265  -8.910  -3.581
  596    HA   ALA  75           HA       ALA  75  -3.624 -11.364  -4.926
  597    HB1  ALA  75           HB1      ALA  75  -2.432  -9.151  -5.216
  598    HB2  ALA  75           HB2      ALA  75  -1.354 -10.529  -4.991
  599    HB3  ALA  75           HB3      ALA  75  -1.667  -9.424  -3.651
  600    H    ILE  76           HN       ILE  76  -2.816 -10.204  -1.632
  601    HA   ILE  76           HA       ILE  76  -1.508 -12.727  -0.948
  602    HB   ILE  76           HB       ILE  76  -2.216 -11.286   1.472
  603   HG12  ILE  76          HG12      ILE  76  -1.196  -9.467  -0.743
  604   HG13  ILE  76          HG11      ILE  76  -2.785  -9.384   0.008
  605   HG21  ILE  76          HG21      ILE  76   0.433 -11.182  -0.006
  606   HG22  ILE  76          HG22      ILE  76  -0.089 -12.563   0.957
  607   HG23  ILE  76          HG23      ILE  76   0.159 -11.003   1.728
  608   HD11  ILE  76          HD11      ILE  76  -0.101  -8.823   1.287
  609   HD12  ILE  76          HD12      ILE  76  -1.564  -9.079   2.242
  610   HD13  ILE  76          HD13      ILE  76  -1.470  -7.729   1.113
  611    H    ASN  77           HN       ASN  77  -4.448 -12.546  -1.806
  612    HA   ASN  77           HA       ASN  77  -6.452 -13.616  -1.282
  613    HB2  ASN  77           HB2      ASN  77  -4.624 -15.301   0.479
  614    HB3  ASN  77           HB1      ASN  77  -6.249 -15.747  -0.036
  615   HD21  ASN  77          HD21      ASN  77  -5.814 -17.462  -1.478
  616   HD22  ASN  77          HD22      ASN  77  -4.814 -17.320  -2.842
  617    H    ARG  78           HN       ARG  78  -6.751 -11.433  -0.108
  618    HA   ARG  78           HA       ARG  78  -7.657 -12.009   2.678
  619    HB2  ARG  78           HB2      ARG  78  -5.888  -9.679   1.851
  620    HB3  ARG  78           HB1      ARG  78  -6.755  -9.762   3.385
  621    HG2  ARG  78           HG2      ARG  78  -5.586 -11.909   3.883
  622    HG3  ARG  78           HG1      ARG  78  -4.652 -11.716   2.405
  623    HD2  ARG  78           HD2      ARG  78  -4.042  -9.353   3.423
  624    HD3  ARG  78           HD1      ARG  78  -4.506 -10.097   4.952
  625    HE   ARG  78           HE       ARG  78  -2.035 -10.471   3.572
  626   HH11  ARG  78          HH21      ARG  78  -4.470 -12.321   5.182
  627   HH12  ARG  78          HH22      ARG  78  -3.468 -13.720   5.347
  628   HH21  ARG  78          HH11      ARG  78  -0.727 -12.274   3.807
  629   HH22  ARG  78          HH12      ARG  78  -1.353 -13.692   4.580
  630    H    ARG  79           HN       ARG  79  -9.115 -11.851   0.255
  631    HA   ARG  79           HA       ARG  79 -10.222  -9.418  -0.513
  632    HB2  ARG  79           HB2      ARG  79 -11.762 -11.987  -0.047
  633    HB3  ARG  79           HB1      ARG  79 -12.257 -10.655  -1.090
  634    HG2  ARG  79           HG2      ARG  79 -10.273 -10.990  -2.496
  635    HG3  ARG  79           HG1      ARG  79  -9.729 -12.292  -1.438
  636    HD2  ARG  79           HD2      ARG  79 -11.806 -13.550  -1.945
  637    HD3  ARG  79           HD1      ARG  79 -12.299 -12.264  -3.047
  638    HE   ARG  79           HE       ARG  79  -9.777 -12.996  -3.953
  639   HH11  ARG  79          HH21      ARG  79 -12.754 -14.608  -3.266
  640   HH12  ARG  79          HH22      ARG  79 -12.518 -15.833  -4.468
  641   HH21  ARG  79          HH11      ARG  79  -9.459 -14.588  -5.523
  642   HH22  ARG  79          HH12      ARG  79 -10.655 -15.822  -5.745
  643    H    ASP  80           HN       ASP  80 -10.769 -11.127   2.518
  644    HA   ASP  80           HA       ASP  80 -13.142  -9.807   3.357
  645    HB2  ASP  80           HB2      ASP  80 -10.771 -10.792   4.978
  646    HB3  ASP  80           HB1      ASP  80 -12.301 -10.273   5.686
  647    H    LEU  81           HN       LEU  81  -9.771  -8.769   3.387
  648    HA   LEU  81           HA       LEU  81 -10.174  -6.442   5.021
  649    HB2  LEU  81           HB2      LEU  81  -7.939  -7.380   4.693
  650    HB3  LEU  81           HB1      LEU  81  -8.016  -7.062   2.966
  651    HG   LEU  81           HG       LEU  81  -8.108  -4.633   3.405
  652   HD11  LEU  81          HD11      LEU  81  -7.518  -3.973   5.869
  653   HD12  LEU  81          HD12      LEU  81  -8.168  -5.556   6.289
  654   HD13  LEU  81          HD13      LEU  81  -9.190  -4.361   5.487
  655   HD21  LEU  81          HD21      LEU  81  -5.930  -5.817   3.160
  656   HD22  LEU  81          HD22      LEU  81  -5.860  -6.004   4.912
  657   HD23  LEU  81          HD23      LEU  81  -5.806  -4.394   4.195
  658    H    TYR  82           HN       TYR  82 -10.765  -7.093   1.616
  659    HA   TYR  82           HA       TYR  82 -10.850  -4.298   0.812
  660    HB2  TYR  82           HB2      TYR  82 -10.514  -5.771  -1.002
  661    HB3  TYR  82           HB1      TYR  82 -11.707  -6.920  -0.420
  662    HD1  TYR  82           HD1      TYR  82 -11.449  -3.371  -1.617
  663    HD2  TYR  82           HD2      TYR  82 -13.852  -6.933  -1.461
  664    HE1  TYR  82           HE1      TYR  82 -13.137  -2.301  -3.083
  665    HE2  TYR  82           HE2      TYR  82 -15.535  -5.859  -2.927
  666    HH   TYR  82           HH       TYR  82 -16.252  -3.708  -3.629
  667    H    GLU  83           HN       GLU  83 -13.248  -6.654   1.980
  668    HA   GLU  83           HA       GLU  83 -15.547  -5.047   1.472
  669    HB2  GLU  83           HB2      GLU  83 -15.519  -7.502   2.145
  670    HB3  GLU  83           HB1      GLU  83 -15.229  -6.971   3.800
  671    HG2  GLU  83           HG2      GLU  83 -17.309  -5.619   3.712
  672    HG3  GLU  83           HG1      GLU  83 -17.605  -6.208   2.076
  673    H    LYS  84           HN       LYS  84 -13.501  -5.299   4.407
  674    HA   LYS  84           HA       LYS  84 -14.985  -3.210   5.799
  675    HB2  LYS  84           HB2      LYS  84 -12.208  -4.289   6.354
  676    HB3  LYS  84           HB1      LYS  84 -13.213  -3.360   7.466
  677    HG2  LYS  84           HG2      LYS  84 -14.902  -5.139   7.465
  678    HG3  LYS  84           HG1      LYS  84 -13.947  -6.065   6.307
  679    HD2  LYS  84           HD2      LYS  84 -12.088  -6.174   7.941
  680    HD3  LYS  84           HD1      LYS  84 -13.075  -5.289   9.106
  681    HE2  LYS  84           HE2      LYS  84 -13.218  -7.692   9.559
  682    HE3  LYS  84           HE1      LYS  84 -14.780  -7.096   8.997
  683    HZ1  LYS  84           HZ1      LYS  84 -14.403  -7.973   6.858
  684    HZ2  LYS  84           HZ2      LYS  84 -13.971  -9.207   7.944
  685    HZ3  LYS  84           HZ3      LYS  84 -12.767  -8.286   7.178
  686    H    ALA  85           HN       ALA  85 -11.779  -3.347   4.222
  687    HA   ALA  85           HA       ALA  85 -10.986  -0.694   4.672
  688    HB1  ALA  85           HB1      ALA  85  -9.520  -2.402   3.659
  689    HB2  ALA  85           HB2      ALA  85  -9.566  -0.940   2.672
  690    HB3  ALA  85           HB3      ALA  85 -10.492  -2.360   2.188
  691    H    LYS  86           HN       LYS  86 -13.102  -1.969   2.123
  692    HA   LYS  86           HA       LYS  86 -13.305   0.352   0.530
  693    HB2  LYS  86           HB2      LYS  86 -14.315  -1.878  -0.054
  694    HB3  LYS  86           HB1      LYS  86 -15.586  -1.573   1.131
  695    HG2  LYS  86           HG2      LYS  86 -16.306   0.415  -0.080
  696    HG3  LYS  86           HG1      LYS  86 -14.960   0.253  -1.210
  697    HD2  LYS  86           HD2      LYS  86 -15.847  -1.915  -1.972
  698    HD3  LYS  86           HD1      LYS  86 -17.188  -1.772  -0.834
  699    HE2  LYS  86           HE2      LYS  86 -17.906   0.316  -1.964
  700    HE3  LYS  86           HE1      LYS  86 -16.594   0.123  -3.127
  701    HZ1  LYS  86           HZ1      LYS  86 -18.961  -1.607  -2.733
  702    HZ2  LYS  86           HZ2      LYS  86 -17.587  -2.142  -3.577
  703    HZ3  LYS  86           HZ3      LYS  86 -18.468  -0.805  -4.144
  704    H    ARG  87           HN       ARG  87 -14.711  -0.286   3.698
  705    HA   ARG  87           HA       ARG  87 -16.586   1.984   3.495
  706    HB2  ARG  87           HB2      ARG  87 -15.794   0.182   5.801
  707    HB3  ARG  87           HB1      ARG  87 -17.028   1.438   5.903
  708    HG2  ARG  87           HG2      ARG  87 -18.252   0.335   4.027
  709    HG3  ARG  87           HG1      ARG  87 -17.057  -0.961   4.046
  710    HD2  ARG  87           HD2      ARG  87 -17.673  -1.589   6.296
  711    HD3  ARG  87           HD1      ARG  87 -18.717  -0.177   6.460
  712    HE   ARG  87           HE       ARG  87 -19.748  -1.516   4.259
  713   HH11  ARG  87          HH21      ARG  87 -18.982  -2.312   7.531
  714   HH12  ARG  87          HH22      ARG  87 -20.232  -3.502   7.670
  715   HH21  ARG  87          HH11      ARG  87 -21.381  -3.063   4.429
  716   HH22  ARG  87          HH12      ARG  87 -21.588  -3.927   5.916
  717    H    ASP  88           HN       ASP  88 -13.270   1.578   4.365
  718    HA   ASP  88           HA       ASP  88 -13.249   4.023   6.081
  719    HB2  ASP  88           HB2      ASP  88 -11.927   1.933   6.682
  720    HB3  ASP  88           HB1      ASP  88 -10.903   2.264   5.283
  721    H    GLU  89           HN       GLU  89 -12.803   3.204   2.769
  722    HA   GLU  89           HA       GLU  89 -10.739   5.006   2.015
  723    HB2  GLU  89           HB2      GLU  89 -13.106   3.783   0.632
  724    HB3  GLU  89           HB1      GLU  89 -12.281   5.103  -0.194
  725    HG2  GLU  89           HG2      GLU  89 -11.389   2.873  -0.847
  726    HG3  GLU  89           HG1      GLU  89 -10.162   3.890  -0.096
  727    HA   PRO  90           HA       PRO  90 -13.146   8.686   3.274
  728    HB2  PRO  90           HB2      PRO  90 -11.175  10.518   2.177
  729    HB3  PRO  90           HB1      PRO  90 -11.440  10.121   3.881
  730    HG2  PRO  90           HG2      PRO  90  -9.221   9.284   2.195
  731    HG3  PRO  90           HG1      PRO  90  -9.474   8.921   3.908
  732    HD2  PRO  90           HD2      PRO  90  -9.767   7.105   1.656
  733    HD3  PRO  90           HD1      PRO  90 -10.011   6.746   3.381
  734    H    LYS  91           HN       LYS  91 -14.578   9.990   2.070
  735    HA   LYS  91           HA       LYS  91 -14.961   9.313  -0.701
  736    HB2  LYS  91           HB2      LYS  91 -16.793  10.039   0.850
  737    HB3  LYS  91           HB1      LYS  91 -16.117  11.667   0.825
  738    HG2  LYS  91           HG2      LYS  91 -16.481  11.836  -1.575
  739    HG3  LYS  91           HG1      LYS  91 -17.020  10.158  -1.645
  740    HD2  LYS  91           HD2      LYS  91 -18.938  10.681  -0.212
  741    HD3  LYS  91           HD1      LYS  91 -18.387  12.348  -0.050
  742    HE2  LYS  91           HE2      LYS  91 -18.677  12.707  -2.460
  743    HE3  LYS  91           HE1      LYS  91 -19.162  11.024  -2.670
  744    HZ1  LYS  91           HZ1      LYS  91 -20.826  13.110  -2.152
  745    HZ2  LYS  91           HZ2      LYS  91 -20.660  12.366  -0.632
  746    HZ3  LYS  91           HZ3      LYS  91 -21.207  11.467  -1.966
  Start of MODEL   18
    1    H1   MET   1           HT1      MET   1 -11.156  16.497  10.305
    2    H2   MET   1           HT2      MET   1 -10.879  17.080  11.877
    3    H3   MET   1           HT3      MET   1 -10.290  15.554  11.418
    4    HA   MET   1           HA       MET   1  -9.357  17.576   9.654
    5    HB2  MET   1           HB2      MET   1  -9.673  18.882  11.828
    6    HB3  MET   1           HB1      MET   1  -8.471  17.816  12.550
    7    HG2  MET   1           HG2      MET   1  -6.772  18.567  11.007
    8    HG3  MET   1           HG1      MET   1  -7.956  19.446  10.042
    9    HE1  MET   1           HE1      MET   1  -7.393  21.952  10.111
   10    HE2  MET   1           HE2      MET   1  -5.877  21.088  10.352
   11    HE3  MET   1           HE3      MET   1  -6.236  22.510  11.327
   12    H    ALA   2           HN       ALA   2  -9.327  14.687  11.291
   13    HA   ALA   2           HA       ALA   2  -6.609  14.012  11.626
   14    HB1  ALA   2           HB1      ALA   2  -8.846  12.229  10.615
   15    HB2  ALA   2           HB2      ALA   2  -8.481  12.547  12.311
   16    HB3  ALA   2           HB3      ALA   2  -7.321  11.674  11.308
   17    H    SER   3           HN       SER   3  -4.972  13.960  10.175
   18    HA   SER   3           HA       SER   3  -5.427  14.335   7.342
   19    HB2  SER   3           HB2      SER   3  -3.355  15.059   8.676
   20    HB3  SER   3           HB1      SER   3  -2.853  13.371   8.648
   21    HG   SER   3           HG       SER   3  -3.057  15.236   6.572
   22    H    THR   4           HN       THR   4  -5.236  12.822   5.664
   23    HA   THR   4           HA       THR   4  -5.937  10.085   6.317
   24    HB   THR   4           HB       THR   4  -4.914  11.041   3.618
   25    HG1  THR   4           HG1      THR   4  -7.289  11.614   4.981
   26   HG21  THR   4          HG21      THR   4  -5.449   8.593   4.037
   27   HG22  THR   4          HG22      THR   4  -6.366   9.344   2.731
   28   HG23  THR   4          HG23      THR   4  -7.123   9.083   4.303
   29    H    ARG   5           HN       ARG   5  -2.965  11.771   6.057
   30    HA   ARG   5           HA       ARG   5  -1.221   9.727   5.129
   31    HB2  ARG   5           HB2      ARG   5  -0.576  12.122   5.521
   32    HB3  ARG   5           HB1      ARG   5  -0.611  11.804   7.255
   33    HG2  ARG   5           HG2      ARG   5   1.137  10.126   7.032
   34    HG3  ARG   5           HG1      ARG   5   1.114  10.287   5.276
   35    HD2  ARG   5           HD2      ARG   5   2.986  11.563   6.262
   36    HD3  ARG   5           HD1      ARG   5   1.829  12.636   5.472
   37    HE   ARG   5           HE       ARG   5   0.965  12.544   8.111
   38   HH11  ARG   5          HH21      ARG   5   3.921  13.252   6.469
   39   HH12  ARG   5          HH22      ARG   5   4.466  14.379   7.667
   40   HH21  ARG   5          HH11      ARG   5   1.667  14.010   9.676
   41   HH22  ARG   5          HH12      ARG   5   3.191  14.807   9.480
   42    H    CYS   6           HN       CYS   6  -2.161  10.552   8.488
   43    HA   CYS   6           HA       CYS   6  -0.761   8.338   9.666
   44    HB2  CYS   6           HB2      CYS   6  -3.149   9.917  10.665
   45    HB3  CYS   6           HB1      CYS   6  -2.229   8.771  11.643
   46    HG   CYS   6           HG       CYS   6  -0.514  10.982  10.363
   47    H    LYS   7           HN       LYS   7  -3.869   8.648   8.108
   48    HA   LYS   7           HA       LYS   7  -5.045   6.253   9.207
   49    HB2  LYS   7           HB2      LYS   7  -5.637   7.694   6.602
   50    HB3  LYS   7           HB1      LYS   7  -6.649   6.452   7.335
   51    HG2  LYS   7           HG2      LYS   7  -6.828   7.893   9.393
   52    HG3  LYS   7           HG1      LYS   7  -5.935   9.145   8.539
   53    HD2  LYS   7           HD2      LYS   7  -8.052   9.895   7.963
   54    HD3  LYS   7           HD1      LYS   7  -7.918   8.682   6.694
   55    HE2  LYS   7           HE2      LYS   7 -10.059   8.394   7.804
   56    HE3  LYS   7           HE1      LYS   7  -9.035   7.036   8.269
   57    HZ1  LYS   7           HZ1      LYS   7  -9.905   9.338   9.857
   58    HZ2  LYS   7           HZ2      LYS   7  -8.393   8.646  10.204
   59    HZ3  LYS   7           HZ3      LYS   7  -9.803   7.703  10.292
   60    H    LEU   8           HN       LEU   8  -3.368   6.893   6.084
   61    HA   LEU   8           HA       LEU   8  -3.565   4.190   5.152
   62    HB2  LEU   8           HB2      LEU   8  -2.764   6.372   3.905
   63    HB3  LEU   8           HB1      LEU   8  -1.170   5.931   4.505
   64    HG   LEU   8           HG       LEU   8  -1.816   3.521   3.488
   65   HD11  LEU   8          HD11      LEU   8  -3.132   3.760   1.404
   66   HD12  LEU   8          HD12      LEU   8  -3.469   5.442   1.810
   67   HD13  LEU   8          HD13      LEU   8  -4.107   4.146   2.819
   68   HD21  LEU   8          HD21      LEU   8  -0.784   4.233   1.308
   69   HD22  LEU   8          HD22      LEU   8   0.110   4.784   2.723
   70   HD23  LEU   8          HD23      LEU   8  -0.921   5.909   1.841
   71    H    ALA   9           HN       ALA   9  -1.087   5.777   7.160
   72    HA   ALA   9           HA       ALA   9   0.683   3.516   7.261
   73    HB1  ALA   9           HB1      ALA   9   1.582   4.594   9.327
   74    HB2  ALA   9           HB2      ALA   9   0.254   5.752   9.263
   75    HB3  ALA   9           HB3      ALA   9   1.458   5.723   7.975
   76    H    ARG  10           HN       ARG  10  -2.146   4.476   9.112
   77    HA   ARG  10           HA       ARG  10  -1.923   2.625  11.237
   78    HB2  ARG  10           HB2      ARG  10  -3.622   4.538  10.934
   79    HB3  ARG  10           HB1      ARG  10  -4.540   3.422   9.930
   80    HG2  ARG  10           HG2      ARG  10  -5.538   3.023  12.010
   81    HG3  ARG  10           HG1      ARG  10  -4.280   1.791  12.033
   82    HD2  ARG  10           HD2      ARG  10  -2.822   3.329  13.339
   83    HD3  ARG  10           HD1      ARG  10  -4.093   4.549  13.304
   84    HE   ARG  10           HE       ARG  10  -5.331   2.304  14.383
   85   HH11  ARG  10          HH21      ARG  10  -2.519   4.195  15.056
   86   HH12  ARG  10          HH22      ARG  10  -2.564   3.890  16.761
   87   HH21  ARG  10          HH11      ARG  10  -5.396   1.898  16.603
   88   HH22  ARG  10          HH12      ARG  10  -4.190   2.591  17.635
   89    H    TYR  11           HN       TYR  11  -3.036   2.182   7.914
   90    HA   TYR  11           HA       TYR  11  -4.066  -0.514   8.415
   91    HB2  TYR  11           HB2      TYR  11  -3.538   1.095   5.897
   92    HB3  TYR  11           HB1      TYR  11  -4.054  -0.588   5.825
   93    HD1  TYR  11           HD2      TYR  11  -6.193  -1.262   7.054
   94    HD2  TYR  11           HD1      TYR  11  -5.162   2.823   6.257
   95    HE1  TYR  11           HE2      TYR  11  -8.556  -0.601   7.402
   96    HE2  TYR  11           HE1      TYR  11  -7.522   3.491   6.606
   97    HH   TYR  11           HH       TYR  11  -9.533   2.467   7.964
   98    H    LEU  12           HN       LEU  12  -1.188   0.702   6.600
   99    HA   LEU  12           HA       LEU  12  -0.098  -1.927   6.212
  100    HB2  LEU  12           HB2      LEU  12   1.622   0.563   6.490
  101    HB3  LEU  12           HB1      LEU  12   1.934  -0.869   5.515
  102    HG   LEU  12           HG       LEU  12  -0.425   1.001   4.942
  103   HD11  LEU  12          HD11      LEU  12   0.979   2.016   3.204
  104   HD12  LEU  12          HD12      LEU  12   2.341   1.004   3.678
  105   HD13  LEU  12          HD13      LEU  12   1.735   2.236   4.780
  106   HD21  LEU  12          HD21      LEU  12   0.991  -1.194   3.370
  107   HD22  LEU  12          HD22      LEU  12  -0.133  -0.053   2.635
  108   HD23  LEU  12          HD23      LEU  12  -0.698  -1.160   3.878
  109    H    GLU  13           HN       GLU  13  -0.063   0.248   8.906
  110    HA   GLU  13           HA       GLU  13   2.091  -1.160  10.329
  111    HB2  GLU  13           HB2      GLU  13   1.581   1.308  10.609
  112    HB3  GLU  13           HB1      GLU  13   0.087   0.847  11.423
  113    HG2  GLU  13           HG2      GLU  13   1.751   1.284  13.111
  114    HG3  GLU  13           HG1      GLU  13   1.481  -0.457  13.073
  115    H    ASP  14           HN       ASP  14  -1.385  -1.377  10.065
  116    HA   ASP  14           HA       ASP  14  -1.728  -2.902  12.545
  117    HB2  ASP  14           HB2      ASP  14  -3.573  -1.546  11.645
  118    HB3  ASP  14           HB1      ASP  14  -3.605  -2.533  10.184
  119    H    LEU  15           HN       LEU  15  -0.340  -3.733   9.586
  120    HA   LEU  15           HA       LEU  15  -1.442  -6.499   9.524
  121    HB2  LEU  15           HB2      LEU  15   0.868  -5.345   7.928
  122    HB3  LEU  15           HB1      LEU  15   0.025  -6.858   7.618
  123    HG   LEU  15           HG       LEU  15  -1.063  -4.038   7.318
  124   HD11  LEU  15          HD11      LEU  15  -0.848  -6.332   5.341
  125   HD12  LEU  15          HD12      LEU  15   0.331  -5.028   5.471
  126   HD13  LEU  15          HD13      LEU  15  -1.328  -4.674   4.982
  127   HD21  LEU  15          HD21      LEU  15  -2.523  -6.699   7.359
  128   HD22  LEU  15          HD22      LEU  15  -3.169  -5.314   6.477
  129   HD23  LEU  15          HD23      LEU  15  -2.935  -5.214   8.217
  130    H    GLU  16           HN       GLU  16  -0.062  -8.367   9.775
  131    HA   GLU  16           HA       GLU  16   1.598  -8.213  12.120
  132    HB2  GLU  16           HB2      GLU  16   1.210 -10.410  10.061
  133    HB3  GLU  16           HB1      GLU  16   2.142 -10.615  11.542
  134    HG2  GLU  16           HG2      GLU  16  -0.092 -11.438  11.964
  135    HG3  GLU  16           HG1      GLU  16   0.092  -9.921  12.842
  136    H    ASP  17           HN       ASP  17   3.903  -8.720  12.231
  137    HA   ASP  17           HA       ASP  17   5.504  -7.201  10.452
  138    HB2  ASP  17           HB2      ASP  17   6.338  -9.513  12.232
  139    HB3  ASP  17           HB1      ASP  17   7.426  -8.315  11.529
  140    H    VAL  18           HN       VAL  18   4.779 -10.688  10.488
  141    HA   VAL  18           HA       VAL  18   6.593 -11.427   8.417
  142    HB   VAL  18           HB       VAL  18   5.398 -13.052   9.881
  143   HG11  VAL  18          HG11      VAL  18   3.155 -11.861   9.707
  144   HG12  VAL  18          HG12      VAL  18   3.082 -13.610   9.502
  145   HG13  VAL  18          HG13      VAL  18   2.990 -12.555   8.094
  146   HG21  VAL  18          HG21      VAL  18   4.849 -13.483   6.923
  147   HG22  VAL  18          HG22      VAL  18   5.060 -14.737   8.145
  148   HG23  VAL  18          HG23      VAL  18   6.423 -13.716   7.686
  149    H    ASP  19           HN       ASP  19   3.233 -10.232   8.260
  150    HA   ASP  19           HA       ASP  19   3.051 -10.507   5.376
  151    HB2  ASP  19           HB2      ASP  19   1.041 -10.435   6.807
  152    HB3  ASP  19           HB1      ASP  19   1.436  -8.785   7.285
  153    H    LEU  20           HN       LEU  20   4.199  -8.016   7.575
  154    HA   LEU  20           HA       LEU  20   4.146  -5.807   5.799
  155    HB2  LEU  20           HB2      LEU  20   4.620  -5.535   8.182
  156    HB3  LEU  20           HB1      LEU  20   6.099  -6.472   8.021
  157    HG   LEU  20           HG       LEU  20   7.086  -4.743   6.591
  158   HD11  LEU  20          HD11      LEU  20   4.333  -3.497   6.804
  159   HD12  LEU  20          HD12      LEU  20   5.294  -3.802   5.357
  160   HD13  LEU  20          HD13      LEU  20   5.752  -2.508   6.454
  161   HD21  LEU  20          HD21      LEU  20   5.814  -3.608   9.100
  162   HD22  LEU  20          HD22      LEU  20   7.224  -2.943   8.276
  163   HD23  LEU  20          HD23      LEU  20   7.314  -4.533   9.032
  164    H    LYS  21           HN       LYS  21   6.486  -8.432   6.194
  165    HA   LYS  21           HA       LYS  21   8.434  -7.298   4.353
  166    HB2  LYS  21           HB2      LYS  21   8.086 -10.143   5.340
  167    HB3  LYS  21           HB1      LYS  21   9.504  -9.519   4.495
  168    HG2  LYS  21           HG2      LYS  21   9.680  -7.772   6.366
  169    HG3  LYS  21           HG1      LYS  21   8.482  -8.726   7.238
  170    HD2  LYS  21           HD2      LYS  21  11.155  -9.767   6.240
  171    HD3  LYS  21           HD1      LYS  21  10.801  -9.314   7.905
  172    HE2  LYS  21           HE2      LYS  21   8.875 -11.035   7.784
  173    HE3  LYS  21           HE1      LYS  21   9.662 -11.626   6.319
  174    HZ1  LYS  21           HZ1      LYS  21  10.573 -11.732   9.093
  175    HZ2  LYS  21           HZ2      LYS  21  11.750 -11.557   7.881
  176    HZ3  LYS  21           HZ3      LYS  21  10.701 -12.893   7.866
  177    H    LYS  22           HN       LYS  22   5.818  -9.705   4.072
  178    HA   LYS  22           HA       LYS  22   6.468 -10.429   1.343
  179    HB2  LYS  22           HB2      LYS  22   3.955 -10.734   3.021
  180    HB3  LYS  22           HB1      LYS  22   4.029 -11.272   1.343
  181    HG2  LYS  22           HG2      LYS  22   5.781 -12.838   1.825
  182    HG3  LYS  22           HG1      LYS  22   6.043 -12.161   3.431
  183    HD2  LYS  22           HD2      LYS  22   4.770 -14.267   3.563
  184    HD3  LYS  22           HD1      LYS  22   3.799 -12.909   4.124
  185    HE2  LYS  22           HE2      LYS  22   3.632 -13.791   1.235
  186    HE3  LYS  22           HE1      LYS  22   2.704 -14.627   2.479
  187    HZ1  LYS  22           HZ1      LYS  22   2.329 -11.959   2.985
  188    HZ2  LYS  22           HZ2      LYS  22   1.213 -13.025   2.274
  189    HZ3  LYS  22           HZ3      LYS  22   2.235 -12.085   1.296
  190    H    PHE  23           HN       PHE  23   4.619  -7.808   2.786
  191    HA   PHE  23           HA       PHE  23   3.262  -7.046   0.316
  192    HB2  PHE  23           HB2      PHE  23   2.467  -6.413   2.607
  193    HB3  PHE  23           HB1      PHE  23   3.861  -5.352   2.765
  194    HD1  PHE  23           HD1      PHE  23   4.168  -3.434   1.163
  195    HD2  PHE  23           HD2      PHE  23   0.538  -5.728   1.338
  196    HE1  PHE  23           HE1      PHE  23   2.964  -1.626  -0.031
  197    HE2  PHE  23           HE2      PHE  23  -0.661  -3.921   0.136
  198    HZ   PHE  23           HZ       PHE  23   0.552  -1.869  -0.548
  199    H    LYS  24           HN       LYS  24   6.169  -5.785   2.025
  200    HA   LYS  24           HA       LYS  24   6.779  -3.854  -0.034
  201    HB2  LYS  24           HB2      LYS  24   7.632  -3.657   2.286
  202    HB3  LYS  24           HB1      LYS  24   8.586  -5.120   2.047
  203    HG2  LYS  24           HG2      LYS  24   9.943  -4.069   0.362
  204    HG3  LYS  24           HG1      LYS  24   8.871  -2.672   0.280
  205    HD2  LYS  24           HD2      LYS  24  10.851  -2.084   1.575
  206    HD3  LYS  24           HD1      LYS  24   9.450  -2.122   2.641
  207    HE2  LYS  24           HE2      LYS  24  10.110  -4.197   3.611
  208    HE3  LYS  24           HE1      LYS  24  11.253  -4.538   2.311
  209    HZ1  LYS  24           HZ1      LYS  24  12.826  -3.409   3.355
  210    HZ2  LYS  24           HZ2      LYS  24  11.800  -3.322   4.707
  211    HZ3  LYS  24           HZ3      LYS  24  11.826  -2.057   3.574
  212    H    MET  25           HN       MET  25   8.014  -7.114   0.735
  213    HA   MET  25           HA       MET  25   9.972  -7.338  -1.270
  214    HB2  MET  25           HB2      MET  25   9.499  -9.046   0.506
  215    HB3  MET  25           HB1      MET  25   8.070  -9.537  -0.404
  216    HG2  MET  25           HG2      MET  25   9.439 -10.170  -2.311
  217    HG3  MET  25           HG1      MET  25  10.887  -9.542  -1.526
  218    HE1  MET  25           HE1      MET  25  12.254 -11.710  -1.737
  219    HE2  MET  25           HE2      MET  25  10.910 -12.274  -2.727
  220    HE3  MET  25           HE3      MET  25  11.572 -13.321  -1.475
  221    H    HIS  26           HN       HIS  26   6.463  -7.599  -1.518
  222    HA   HIS  26           HA       HIS  26   6.411  -8.654  -4.216
  223    HB2  HIS  26           HB2      HIS  26   4.446  -8.588  -2.564
  224    HB3  HIS  26           HB1      HIS  26   4.306  -6.866  -2.919
  225    HD1  HIS  26           HD1      HIS  26   4.966  -7.087  -5.999
  226    HD2  HIS  26           HD2      HIS  26   2.157  -9.415  -3.981
  227    HE1  HIS  26           HE1      HIS  26   3.330  -7.914  -7.748
  228    H    LEU  27           HN       LEU  27   6.348  -5.325  -2.895
  229    HA   LEU  27           HA       LEU  27   6.169  -4.097  -5.547
  230    HB2  LEU  27           HB2      LEU  27   7.005  -2.975  -2.854
  231    HB3  LEU  27           HB1      LEU  27   6.782  -1.999  -4.301
  232    HG   LEU  27           HG       LEU  27   4.613  -3.751  -3.091
  233   HD11  LEU  27          HD11      LEU  27   5.127  -2.025  -1.487
  234   HD12  LEU  27          HD12      LEU  27   3.650  -1.541  -2.320
  235   HD13  LEU  27          HD13      LEU  27   5.188  -0.791  -2.747
  236   HD21  LEU  27          HD21      LEU  27   3.201  -2.010  -4.511
  237   HD22  LEU  27          HD22      LEU  27   3.946  -3.377  -5.320
  238   HD23  LEU  27          HD23      LEU  27   4.706  -1.789  -5.402
  239    H    GLU  28           HN       GLU  28   8.803  -5.067  -3.410
  240    HA   GLU  28           HA       GLU  28  10.882  -3.626  -4.762
  241    HB2  GLU  28           HB2      GLU  28  10.952  -6.179  -3.129
  242    HB3  GLU  28           HB1      GLU  28  12.400  -5.353  -3.704
  243    HG2  GLU  28           HG2      GLU  28  10.275  -3.992  -2.017
  244    HG3  GLU  28           HG1      GLU  28  11.702  -4.766  -1.332
  245    H    ASP  29           HN       ASP  29   9.012  -6.320  -5.739
  246    HA   ASP  29           HA       ASP  29  10.808  -6.734  -8.101
  247    HB2  ASP  29           HB2      ASP  29  10.453  -9.197  -7.897
  248    HB3  ASP  29           HB1      ASP  29  11.386  -8.532  -6.556
  249    H    TYR  30           HN       TYR  30   8.495  -5.218  -8.188
  250    HA   TYR  30           HA       TYR  30   6.187  -6.819  -8.917
  251    HB2  TYR  30           HB2      TYR  30   5.989  -4.511  -8.066
  252    HB3  TYR  30           HB1      TYR  30   6.811  -3.917  -9.509
  253    HD1  TYR  30           HD2      TYR  30   3.751  -5.598  -8.249
  254    HD2  TYR  30           HD1      TYR  30   5.654  -3.759 -11.634
  255    HE1  TYR  30           HE2      TYR  30   1.587  -5.582  -9.458
  256    HE2  TYR  30           HE1      TYR  30   3.489  -3.744 -12.841
  257    HH   TYR  30           HH       TYR  30   0.790  -3.791 -11.774
  258    HA   PRO  31           HA       PRO  31   8.113  -7.523 -12.983
  259    HB2  PRO  31           HB2      PRO  31   5.816  -8.801 -14.144
  260    HB3  PRO  31           HB1      PRO  31   7.223  -9.602 -13.431
  261    HG2  PRO  31           HG2      PRO  31   4.512  -9.346 -12.310
  262    HG3  PRO  31           HG1      PRO  31   5.850 -10.355 -11.738
  263    HD2  PRO  31           HD2      PRO  31   4.892  -7.925 -10.530
  264    HD3  PRO  31           HD1      PRO  31   6.331  -8.857 -10.055
  265    HA   PRO  32           HA       PRO  32   6.396  -4.134 -15.300
  266    HB2  PRO  32           HB2      PRO  32   6.697  -5.042 -17.968
  267    HB3  PRO  32           HB1      PRO  32   7.950  -4.234 -17.015
  268    HG2  PRO  32           HG2      PRO  32   7.707  -7.126 -17.701
  269    HG3  PRO  32           HG1      PRO  32   9.151  -6.207 -17.240
  270    HD2  PRO  32           HD2      PRO  32   7.752  -8.002 -15.548
  271    HD3  PRO  32           HD1      PRO  32   8.920  -6.774 -15.011
  272    H    GLN  33           HN       GLN  33   4.275  -3.588 -15.768
  273    HA   GLN  33           HA       GLN  33   2.384  -5.766 -16.642
  274    HB2  GLN  33           HB2      GLN  33   1.957  -4.761 -14.385
  275    HB3  GLN  33           HB1      GLN  33   1.757  -3.189 -15.162
  276    HG2  GLN  33           HG2      GLN  33  -0.127  -4.005 -16.455
  277    HG3  GLN  33           HG1      GLN  33   0.121  -5.644 -15.854
  278   HE21  GLN  33          HE21      GLN  33  -1.230  -2.505 -15.078
  279   HE22  GLN  33          HE22      GLN  33  -1.879  -2.941 -13.571
  280    H    LYS  34           HN       LYS  34   3.111  -2.279 -16.995
  281    HA   LYS  34           HA       LYS  34   2.654  -2.340 -19.838
  282    HB2  LYS  34           HB2      LYS  34   0.280  -2.492 -19.048
  283    HB3  LYS  34           HB1      LYS  34   0.507  -0.969 -18.191
  284    HG2  LYS  34           HG2      LYS  34   0.854   0.242 -20.233
  285    HG3  LYS  34           HG1      LYS  34   1.003  -1.242 -21.171
  286    HD2  LYS  34           HD2      LYS  34  -1.214  -0.156 -21.472
  287    HD3  LYS  34           HD1      LYS  34  -1.348  -1.774 -20.787
  288    HE2  LYS  34           HE2      LYS  34  -1.237   0.648 -18.976
  289    HE3  LYS  34           HE1      LYS  34  -2.758   0.130 -19.700
  290    HZ1  LYS  34           HZ1      LYS  34  -2.901  -1.290 -18.023
  291    HZ2  LYS  34           HZ2      LYS  34  -1.291  -1.034 -17.546
  292    HZ3  LYS  34           HZ3      LYS  34  -1.652  -2.174 -18.753
  293    H    GLY  35           HN       GLY  35   4.781  -1.294 -19.420
  294    HA2  GLY  35           HA2      GLY  35   6.116   0.635 -19.390
  295    HA3  GLY  35           HA1      GLY  35   4.635   1.552 -19.662
  296    H    CYS  36           HN       CYS  36   4.731  -0.514 -16.885
  297    HA   CYS  36           HA       CYS  36   4.310   1.712 -15.089
  298    HB2  CYS  36           HB2      CYS  36   4.251   0.034 -13.339
  299    HB3  CYS  36           HB1      CYS  36   3.454  -0.648 -14.754
  300    HG   CYS  36           HG       CYS  36   5.282  -2.327 -15.005
  301    H    ILE  37           HN       ILE  37   5.818   2.811 -13.813
  302    HA   ILE  37           HA       ILE  37   8.634   2.454 -14.482
  303    HB   ILE  37           HB       ILE  37   7.694   4.688 -14.216
  304   HG12  ILE  37          HG12      ILE  37   9.652   4.087 -11.974
  305   HG13  ILE  37          HG11      ILE  37  10.102   4.235 -13.675
  306   HG21  ILE  37          HG21      ILE  37   6.761   5.520 -12.202
  307   HG22  ILE  37          HG22      ILE  37   7.416   4.207 -11.234
  308   HG23  ILE  37          HG23      ILE  37   6.069   3.906 -12.332
  309   HD11  ILE  37          HD11      ILE  37  10.476   6.387 -12.557
  310   HD12  ILE  37          HD12      ILE  37   8.817   6.393 -11.959
  311   HD13  ILE  37          HD13      ILE  37   9.130   6.547 -13.687
  312    HA   PRO  38           HA       PRO  38   8.960  -0.364 -10.907
  313    HB2  PRO  38           HB2      PRO  38  11.790  -0.662 -11.007
  314    HB3  PRO  38           HB1      PRO  38  10.609  -1.717 -11.794
  315    HG2  PRO  38           HG2      PRO  38  12.383   0.302 -13.031
  316    HG3  PRO  38           HG1      PRO  38  11.479  -1.006 -13.811
  317    HD2  PRO  38           HD2      PRO  38  10.811   1.781 -13.856
  318    HD3  PRO  38           HD1      PRO  38   9.796   0.438 -14.435
  319    H    LEU  39           HN       LEU  39   9.341   0.079  -8.730
  320    HA   LEU  39           HA       LEU  39  10.177   2.769  -8.014
  321    HB2  LEU  39           HB2      LEU  39   9.225   0.331  -6.527
  322    HB3  LEU  39           HB1      LEU  39   9.887   1.679  -5.611
  323    HG   LEU  39           HG       LEU  39   7.714   2.187  -7.675
  324   HD11  LEU  39          HD11      LEU  39   6.812   0.407  -6.265
  325   HD12  LEU  39          HD12      LEU  39   6.029   1.936  -5.867
  326   HD13  LEU  39          HD13      LEU  39   7.283   1.288  -4.811
  327   HD21  LEU  39          HD21      LEU  39   7.164   4.041  -6.099
  328   HD22  LEU  39          HD22      LEU  39   8.822   4.150  -6.681
  329   HD23  LEU  39          HD23      LEU  39   8.496   3.536  -5.062
  330    HA   PRO  40           HA       PRO  40  14.528   1.377  -7.878
  331    HB2  PRO  40           HB2      PRO  40  15.155   3.708  -6.159
  332    HB3  PRO  40           HB1      PRO  40  15.751   3.344  -7.786
  333    HG2  PRO  40           HG2      PRO  40  13.829   5.337  -7.130
  334    HG3  PRO  40           HG1      PRO  40  14.201   4.751  -8.759
  335    HD2  PRO  40           HD2      PRO  40  11.783   4.245  -7.164
  336    HD3  PRO  40           HD1      PRO  40  12.089   3.818  -8.863
  337    H    ARG  41           HN       ARG  41  15.679   0.181  -6.328
  338    HA   ARG  41           HA       ARG  41  14.248  -0.659  -3.986
  339    HB2  ARG  41           HB2      ARG  41  16.350  -1.893  -3.422
  340    HB3  ARG  41           HB1      ARG  41  15.868  -2.138  -5.103
  341    HG2  ARG  41           HG2      ARG  41  17.462  -0.201  -5.686
  342    HG3  ARG  41           HG1      ARG  41  18.080  -0.355  -4.042
  343    HD2  ARG  41           HD2      ARG  41  18.666  -2.701  -4.458
  344    HD3  ARG  41           HD1      ARG  41  18.011  -2.587  -6.092
  345    HE   ARG  41           HE       ARG  41  19.890  -0.545  -5.978
  346   HH11  ARG  41          HH21      ARG  41  19.849  -3.945  -5.370
  347   HH12  ARG  41          HH22      ARG  41  21.503  -4.178  -5.827
  348   HH21  ARG  41          HH11      ARG  41  22.047  -0.837  -6.576
  349   HH22  ARG  41          HH12      ARG  41  22.747  -2.420  -6.509
  350    H    GLY  42           HN       GLY  42  17.082   1.488  -4.376
  351    HA2  GLY  42           HA2      GLY  42  17.449   1.997  -1.569
  352    HA3  GLY  42           HA1      GLY  42  17.986   3.089  -2.849
  353    H    GLN  43           HN       GLN  43  15.097   3.230  -3.843
  354    HA   GLN  43           HA       GLN  43  14.357   5.578  -2.310
  355    HB2  GLN  43           HB2      GLN  43  13.874   5.373  -4.726
  356    HB3  GLN  43           HB1      GLN  43  12.839   3.981  -4.408
  357    HG2  GLN  43           HG2      GLN  43  11.223   5.316  -3.241
  358    HG3  GLN  43           HG1      GLN  43  12.319   6.694  -3.155
  359   HE21  GLN  43          HE21      GLN  43   9.632   5.631  -4.840
  360   HE22  GLN  43          HE22      GLN  43   9.872   6.473  -6.293
  361    H    THR  44           HN       THR  44  12.796   2.365  -2.704
  362    HA   THR  44           HA       THR  44  10.837   2.924  -0.624
  363    HB   THR  44           HB       THR  44  11.626   0.315  -1.945
  364    HG1  THR  44           HG1      THR  44   9.321   1.077  -2.780
  365   HG21  THR  44          HG21      THR  44   9.264   1.077  -0.207
  366   HG22  THR  44          HG22      THR  44  10.453  -0.190   0.097
  367   HG23  THR  44          HG23      THR  44   9.296  -0.365  -1.222
  368    H    GLU  45           HN       GLU  45  13.671   0.709  -0.760
  369    HA   GLU  45           HA       GLU  45  13.471  -0.302   1.863
  370    HB2  GLU  45           HB2      GLU  45  16.020   0.354   0.324
  371    HB3  GLU  45           HB1      GLU  45  15.924  -0.710   1.724
  372    HG2  GLU  45           HG2      GLU  45  14.424  -1.161  -0.884
  373    HG3  GLU  45           HG1      GLU  45  15.936  -1.954  -0.443
  374    H    LYS  46           HN       LYS  46  15.118   2.749   0.827
  375    HA   LYS  46           HA       LYS  46  15.967   3.365   3.538
  376    HB2  LYS  46           HB2      LYS  46  15.663   5.140   1.098
  377    HB3  LYS  46           HB1      LYS  46  16.446   5.621   2.602
  378    HG2  LYS  46           HG2      LYS  46  18.088   3.804   2.341
  379    HG3  LYS  46           HG1      LYS  46  17.305   3.306   0.842
  380    HD2  LYS  46           HD2      LYS  46  17.822   5.460  -0.188
  381    HD3  LYS  46           HD1      LYS  46  18.518   6.043   1.324
  382    HE2  LYS  46           HE2      LYS  46  20.217   4.238   1.219
  383    HE3  LYS  46           HE1      LYS  46  19.543   3.712  -0.323
  384    HZ1  LYS  46           HZ1      LYS  46  20.902   6.262   0.305
  385    HZ2  LYS  46           HZ2      LYS  46  19.941   6.075  -1.083
  386    HZ3  LYS  46           HZ3      LYS  46  21.320   5.108  -0.865
  387    H    ALA  47           HN       ALA  47  12.962   3.442   1.999
  388    HA   ALA  47           HA       ALA  47  11.867   5.793   3.343
  389    HB1  ALA  47           HB1      ALA  47  10.250   3.518   2.161
  390    HB2  ALA  47           HB2      ALA  47  11.072   4.694   1.142
  391    HB3  ALA  47           HB3      ALA  47   9.825   5.227   2.268
  392    H    ASP  48           HN       ASP  48  11.076   5.869   5.391
  393    HA   ASP  48           HA       ASP  48  11.048   3.439   7.060
  394    HB2  ASP  48           HB2      ASP  48  11.776   5.651   7.960
  395    HB3  ASP  48           HB1      ASP  48  10.142   6.267   7.710
  396    H    HIS  49           HN       HIS  49   8.966   3.114   8.457
  397    HA   HIS  49           HA       HIS  49   6.829   2.327   6.825
  398    HB2  HIS  49           HB2      HIS  49   6.729   3.172   9.732
  399    HB3  HIS  49           HB1      HIS  49   5.478   2.246   8.902
  400    HD1  HIS  49           HD1      HIS  49   9.109   1.999   9.962
  401    HD2  HIS  49           HD2      HIS  49   6.034  -0.486   8.642
  402    HE1  HIS  49           HE1      HIS  49   9.948  -0.377  10.220
  403    H    VAL  50           HN       VAL  50   7.047   5.372   8.724
  404    HA   VAL  50           HA       VAL  50   4.529   6.414   7.745
  405    HB   VAL  50           HB       VAL  50   6.992   7.883   8.794
  406   HG11  VAL  50          HG11      VAL  50   5.624   9.472   7.579
  407   HG12  VAL  50          HG12      VAL  50   5.318   9.718   9.295
  408   HG13  VAL  50          HG13      VAL  50   4.147   8.842   8.311
  409   HG21  VAL  50          HG21      VAL  50   6.064   6.359  10.464
  410   HG22  VAL  50          HG22      VAL  50   4.437   6.967  10.168
  411   HG23  VAL  50          HG23      VAL  50   5.648   8.012  10.904
  412    H    ASP  51           HN       ASP  51   7.910   7.013   6.728
  413    HA   ASP  51           HA       ASP  51   7.276   8.778   4.592
  414    HB2  ASP  51           HB2      ASP  51   9.584   6.839   4.905
  415    HB3  ASP  51           HB1      ASP  51   9.507   8.091   3.667
  416    H    LEU  52           HN       LEU  52   7.315   5.230   4.736
  417    HA   LEU  52           HA       LEU  52   7.203   4.665   1.980
  418    HB2  LEU  52           HB2      LEU  52   7.171   3.095   4.140
  419    HB3  LEU  52           HB1      LEU  52   5.438   3.087   3.859
  420    HG   LEU  52           HG       LEU  52   7.603   2.240   1.906
  421   HD11  LEU  52          HD11      LEU  52   5.381   0.659   3.233
  422   HD12  LEU  52          HD12      LEU  52   7.064   0.655   3.758
  423   HD13  LEU  52          HD13      LEU  52   6.636   0.019   2.170
  424   HD21  LEU  52          HD21      LEU  52   5.881   3.234   0.582
  425   HD22  LEU  52          HD22      LEU  52   4.601   2.539   1.577
  426   HD23  LEU  52          HD23      LEU  52   5.567   1.503   0.523
  427    H    ALA  53           HN       ALA  53   4.459   5.286   4.207
  428    HA   ALA  53           HA       ALA  53   2.416   5.187   2.208
  429    HB1  ALA  53           HB1      ALA  53   1.125   6.627   3.862
  430    HB2  ALA  53           HB2      ALA  53   2.591   6.680   4.841
  431    HB3  ALA  53           HB3      ALA  53   1.792   5.139   4.534
  432    H    THR  54           HN       THR  54   4.681   7.739   3.083
  433    HA   THR  54           HA       THR  54   3.225   9.854   1.686
  434    HB   THR  54           HB       THR  54   6.141   9.740   2.529
  435    HG1  THR  54           HG1      THR  54   5.220   9.716   4.414
  436   HG21  THR  54          HG21      THR  54   4.297  12.039   1.810
  437   HG22  THR  54          HG22      THR  54   5.754  11.542   0.949
  438   HG23  THR  54          HG23      THR  54   5.878  12.236   2.564
  439    H    LEU  55           HN       LEU  55   5.869   7.624   0.804
  440    HA   LEU  55           HA       LEU  55   6.440   8.962  -1.714
  441    HB2  LEU  55           HB2      LEU  55   7.051   6.088  -0.948
  442    HB3  LEU  55           HB1      LEU  55   7.733   6.962  -2.307
  443    HG   LEU  55           HG       LEU  55   8.111   7.761   0.601
  444   HD11  LEU  55          HD11      LEU  55   9.204   5.595  -0.041
  445   HD12  LEU  55          HD12      LEU  55  10.347   6.862   0.405
  446   HD13  LEU  55          HD13      LEU  55  10.087   6.468  -1.292
  447   HD21  LEU  55          HD21      LEU  55   9.131   8.875  -2.027
  448   HD22  LEU  55          HD22      LEU  55  10.030   9.118  -0.530
  449   HD23  LEU  55          HD23      LEU  55   8.392   9.737  -0.677
  450    H    MET  56           HN       MET  56   4.278   6.374  -0.692
  451    HA   MET  56           HA       MET  56   3.565   5.541  -3.369
  452    HB2  MET  56           HB2      MET  56   2.161   5.270  -0.691
  453    HB3  MET  56           HB1      MET  56   1.507   4.588  -2.181
  454    HG2  MET  56           HG2      MET  56   3.571   3.266  -2.492
  455    HG3  MET  56           HG1      MET  56   4.239   3.952  -1.013
  456    HE1  MET  56           HE1      MET  56   0.938   2.263  -2.371
  457    HE2  MET  56           HE2      MET  56   1.055   0.729  -1.515
  458    HE3  MET  56           HE3      MET  56   2.338   1.210  -2.621
  459    H    ILE  57           HN       ILE  57   2.139   7.891  -1.078
  460    HA   ILE  57           HA       ILE  57  -0.021   8.556  -2.949
  461    HB   ILE  57           HB       ILE  57   0.894  10.102  -0.491
  462   HG12  ILE  57          HG12      ILE  57  -1.348   8.073  -0.752
  463   HG13  ILE  57          HG11      ILE  57   0.230   7.690  -0.079
  464   HG21  ILE  57          HG21      ILE  57  -1.464  10.960  -0.589
  465   HG22  ILE  57          HG22      ILE  57  -1.654  10.144  -2.139
  466   HG23  ILE  57          HG23      ILE  57  -0.491  11.457  -1.969
  467   HD11  ILE  57          HD11      ILE  57  -0.078   9.351   1.687
  468   HD12  ILE  57          HD12      ILE  57  -1.448   8.240   1.680
  469   HD13  ILE  57          HD13      ILE  57  -1.617   9.849   0.984
  470    H    ASP  58           HN       ASP  58   3.099  10.047  -2.065
  471    HA   ASP  58           HA       ASP  58   2.647  12.384  -3.753
  472    HB2  ASP  58           HB2      ASP  58   4.169  12.307  -1.713
  473    HB3  ASP  58           HB1      ASP  58   5.292  11.343  -2.673
  474    H    PHE  59           HN       PHE  59   4.481   9.334  -4.158
  475    HA   PHE  59           HA       PHE  59   5.549  10.204  -6.746
  476    HB2  PHE  59           HB2      PHE  59   6.620   8.587  -5.030
  477    HB3  PHE  59           HB1      PHE  59   5.560   7.355  -5.702
  478    HD1  PHE  59           HD1      PHE  59   8.417   9.596  -6.376
  479    HD2  PHE  59           HD2      PHE  59   5.871   6.538  -8.001
  480    HE1  PHE  59           HE1      PHE  59  10.003   9.273  -8.253
  481    HE2  PHE  59           HE2      PHE  59   7.459   6.218  -9.879
  482    HZ   PHE  59           HZ       PHE  59   9.525   7.585 -10.003
  483    H    ASN  60           HN       ASN  60   2.978   7.838  -5.779
  484    HA   ASN  60           HA       ASN  60   2.398   7.352  -8.671
  485    HB2  ASN  60           HB2      ASN  60   1.252   6.122  -6.140
  486    HB3  ASN  60           HB1      ASN  60   0.787   5.654  -7.774
  487   HD21  ASN  60          HD21      ASN  60   2.555   4.732  -9.172
  488   HD22  ASN  60          HD22      ASN  60   3.870   3.951  -8.436
  489    H    GLY  61           HN       GLY  61   1.058   9.039  -5.898
  490    HA2  GLY  61           HA2      GLY  61  -0.479  10.900  -6.181
  491    HA3  GLY  61           HA1      GLY  61  -1.094  10.163  -7.659
  492    H    GLU  62           HN       GLU  62  -2.933  10.958  -5.839
  493    HA   GLU  62           HA       GLU  62  -3.626   8.963  -3.875
  494    HB2  GLU  62           HB2      GLU  62  -4.356  11.333  -3.773
  495    HB3  GLU  62           HB1      GLU  62  -5.366  11.075  -5.193
  496    HG2  GLU  62           HG2      GLU  62  -5.700   9.351  -2.719
  497    HG3  GLU  62           HG1      GLU  62  -6.498  10.914  -2.839
  498    H    GLU  63           HN       GLU  63  -4.577   9.474  -7.255
  499    HA   GLU  63           HA       GLU  63  -6.712   7.516  -7.209
  500    HB2  GLU  63           HB2      GLU  63  -5.189   8.956  -9.384
  501    HB3  GLU  63           HB1      GLU  63  -6.288   7.649  -9.816
  502    HG2  GLU  63           HG2      GLU  63  -7.132  10.009  -8.098
  503    HG3  GLU  63           HG1      GLU  63  -7.308   9.983  -9.851
  504    H    LYS  64           HN       LYS  64  -3.385   7.329  -8.568
  505    HA   LYS  64           HA       LYS  64  -3.676   4.512  -9.190
  506    HB2  LYS  64           HB2      LYS  64  -1.308   6.390  -9.082
  507    HB3  LYS  64           HB1      LYS  64  -1.106   4.685  -9.465
  508    HG2  LYS  64           HG2      LYS  64  -3.152   6.313 -10.998
  509    HG3  LYS  64           HG1      LYS  64  -1.453   6.459 -11.427
  510    HD2  LYS  64           HD2      LYS  64  -2.669   3.694 -11.178
  511    HD3  LYS  64           HD1      LYS  64  -2.968   4.637 -12.632
  512    HE2  LYS  64           HE2      LYS  64  -0.221   3.944 -11.534
  513    HE3  LYS  64           HE1      LYS  64  -1.004   3.168 -12.908
  514    HZ1  LYS  64           HZ1      LYS  64  -0.021   4.737 -14.116
  515    HZ2  LYS  64           HZ2      LYS  64   0.350   5.693 -12.761
  516    HZ3  LYS  64           HZ3      LYS  64  -1.179   5.809 -13.493
  517    H    ALA  65           HN       ALA  65  -2.189   6.263  -6.452
  518    HA   ALA  65           HA       ALA  65  -0.905   4.035  -5.260
  519    HB1  ALA  65           HB1      ALA  65  -1.049   5.297  -3.151
  520    HB2  ALA  65           HB2      ALA  65  -2.212   6.397  -3.893
  521    HB3  ALA  65           HB3      ALA  65  -0.554   6.331  -4.490
  522    H    TRP  66           HN       TRP  66  -4.166   5.327  -4.406
  523    HA   TRP  66           HA       TRP  66  -4.770   3.143  -2.662
  524    HB2  TRP  66           HB2      TRP  66  -6.309   5.346  -3.968
  525    HB3  TRP  66           HB1      TRP  66  -7.279   3.946  -3.524
  526    HD1  TRP  66           HD1      TRP  66  -7.726   3.512  -0.995
  527    HE1  TRP  66           HE1      TRP  66  -7.241   4.853   1.154
  528    HE3  TRP  66           HE3      TRP  66  -4.509   7.005  -2.845
  529    HZ2  TRP  66           HZ2      TRP  66  -5.700   7.108   1.981
  530    HZ3  TRP  66           HZ3      TRP  66  -3.545   8.757  -1.347
  531    HH2  TRP  66           HH2      TRP  66  -4.138   8.800   1.057
  532    H    ALA  67           HN       ALA  67  -5.151   3.539  -6.154
  533    HA   ALA  67           HA       ALA  67  -6.766   1.231  -6.622
  534    HB1  ALA  67           HB1      ALA  67  -6.307   2.919  -8.368
  535    HB2  ALA  67           HB2      ALA  67  -5.855   1.307  -8.922
  536    HB3  ALA  67           HB3      ALA  67  -4.611   2.438  -8.389
  537    H    MET  68           HN       MET  68  -3.276   1.645  -6.218
  538    HA   MET  68           HA       MET  68  -2.649  -1.145  -6.823
  539    HB2  MET  68           HB2      MET  68  -1.101   1.176  -5.636
  540    HB3  MET  68           HB1      MET  68  -0.405  -0.442  -5.687
  541    HG2  MET  68           HG2      MET  68  -1.509   0.938  -8.151
  542    HG3  MET  68           HG1      MET  68   0.179   1.053  -7.663
  543    HE1  MET  68           HE1      MET  68   1.483  -1.300  -6.893
  544    HE2  MET  68           HE2      MET  68   1.911  -0.454  -8.377
  545    HE3  MET  68           HE3      MET  68   1.777  -2.211  -8.381
  546    H    ALA  69           HN       ALA  69  -3.043   0.789  -3.856
  547    HA   ALA  69           HA       ALA  69  -2.318  -1.189  -1.973
  548    HB1  ALA  69           HB1      ALA  69  -2.818   1.218  -1.447
  549    HB2  ALA  69           HB2      ALA  69  -3.628   0.088  -0.359
  550    HB3  ALA  69           HB3      ALA  69  -4.532   0.863  -1.659
  551    H    VAL  70           HN       VAL  70  -5.514  -0.537  -3.428
  552    HA   VAL  70           HA       VAL  70  -6.834  -2.690  -1.988
  553    HB   VAL  70           HB       VAL  70  -7.614  -1.235  -4.539
  554   HG11  VAL  70          HG11      VAL  70  -9.944  -2.014  -3.838
  555   HG12  VAL  70          HG12      VAL  70  -9.152  -3.099  -2.697
  556   HG13  VAL  70          HG13      VAL  70  -8.880  -3.291  -4.428
  557   HG21  VAL  70          HG21      VAL  70  -7.373   0.264  -2.610
  558   HG22  VAL  70          HG22      VAL  70  -8.347  -0.819  -1.615
  559   HG23  VAL  70          HG23      VAL  70  -9.087   0.043  -2.966
  560    H    TRP  71           HN       TRP  71  -5.533  -2.426  -5.318
  561    HA   TRP  71           HA       TRP  71  -6.342  -5.027  -6.139
  562    HB2  TRP  71           HB2      TRP  71  -5.518  -3.264  -7.708
  563    HB3  TRP  71           HB1      TRP  71  -3.887  -3.490  -7.082
  564    HD1  TRP  71           HD1      TRP  71  -6.482  -5.073  -9.332
  565    HE1  TRP  71           HE1      TRP  71  -5.439  -7.103 -10.534
  566    HE3  TRP  71           HE3      TRP  71  -2.062  -5.416  -6.808
  567    HZ2  TRP  71           HZ2      TRP  71  -3.043  -8.666 -10.434
  568    HZ3  TRP  71           HZ3      TRP  71  -0.418  -7.177  -7.374
  569    HH2  TRP  71           HH2      TRP  71  -0.902  -8.804  -9.184
  570    H    ILE  72           HN       ILE  72  -3.532  -4.003  -4.211
  571    HA   ILE  72           HA       ILE  72  -2.195  -6.600  -4.481
  572    HB   ILE  72           HB       ILE  72  -1.792  -4.229  -2.621
  573   HG12  ILE  72          HG12      ILE  72   0.072  -5.553  -4.625
  574   HG13  ILE  72          HG11      ILE  72  -0.991  -4.215  -5.040
  575   HG21  ILE  72          HG21      ILE  72  -0.448  -6.949  -2.506
  576   HG22  ILE  72          HG22      ILE  72  -1.243  -6.083  -1.193
  577   HG23  ILE  72          HG23      ILE  72   0.291  -5.500  -1.826
  578   HD11  ILE  72          HD11      ILE  72   0.999  -4.010  -2.767
  579   HD12  ILE  72          HD12      ILE  72   0.171  -2.704  -3.616
  580   HD13  ILE  72          HD13      ILE  72   1.432  -3.625  -4.430
  581    H    PHE  73           HN       PHE  73  -4.515  -5.227  -2.100
  582    HA   PHE  73           HA       PHE  73  -4.322  -7.300  -0.172
  583    HB2  PHE  73           HB2      PHE  73  -6.916  -5.969  -0.998
  584    HB3  PHE  73           HB1      PHE  73  -6.525  -6.669   0.565
  585    HD1  PHE  73           HD2      PHE  73  -3.503  -5.209   0.247
  586    HD2  PHE  73           HD1      PHE  73  -7.632  -3.965   0.284
  587    HE1  PHE  73           HE2      PHE  73  -2.833  -2.982   1.045
  588    HE2  PHE  73           HE1      PHE  73  -6.935  -1.734   1.088
  589    HZ   PHE  73           HZ       PHE  73  -4.541  -1.240   1.469
  590    H    ALA  74           HN       ALA  74  -6.399  -7.161  -3.100
  591    HA   ALA  74           HA       ALA  74  -7.643  -9.694  -2.693
  592    HB1  ALA  74           HB1      ALA  74  -8.113  -9.627  -5.121
  593    HB2  ALA  74           HB2      ALA  74  -6.947  -8.317  -5.311
  594    HB3  ALA  74           HB3      ALA  74  -8.422  -8.055  -4.380
  595    H    ALA  75           HN       ALA  75  -4.457  -8.844  -3.911
  596    HA   ALA  75           HA       ALA  75  -3.876 -11.338  -5.205
  597    HB1  ALA  75           HB1      ALA  75  -1.566 -10.639  -5.154
  598    HB2  ALA  75           HB2      ALA  75  -1.872  -9.529  -3.818
  599    HB3  ALA  75           HB3      ALA  75  -2.539  -9.190  -5.414
  600    H    ILE  76           HN       ILE  76  -3.203 -10.209  -1.869
  601    HA   ILE  76           HA       ILE  76  -2.175 -12.863  -1.113
  602    HB   ILE  76           HB       ILE  76  -2.671 -11.397   1.289
  603   HG12  ILE  76          HG12      ILE  76  -1.657  -9.526  -0.885
  604   HG13  ILE  76          HG11      ILE  76  -3.239  -9.428  -0.123
  605   HG21  ILE  76          HG21      ILE  76  -0.621 -12.716   0.681
  606   HG22  ILE  76          HG22      ILE  76  -0.263 -11.158   1.411
  607   HG23  ILE  76          HG23      ILE  76  -0.103 -11.370  -0.332
  608   HD11  ILE  76          HD11      ILE  76  -1.981  -9.247   2.116
  609   HD12  ILE  76          HD12      ILE  76  -1.888  -7.851   1.043
  610   HD13  ILE  76          HD13      ILE  76  -0.531  -8.970   1.148
  611    H    ASN  77           HN       ASN  77  -5.025 -12.310  -2.074
  612    HA   ASN  77           HA       ASN  77  -7.167 -13.126  -1.618
  613    HB2  ASN  77           HB2      ASN  77  -5.748 -15.244  -1.351
  614    HB3  ASN  77           HB1      ASN  77  -5.779 -14.947   0.387
  615   HD21  ASN  77          HD21      ASN  77  -7.687 -15.494   1.536
  616   HD22  ASN  77          HD22      ASN  77  -9.074 -16.136   0.796
  617    H    ARG  78           HN       ARG  78  -5.643 -11.154   0.353
  618    HA   ARG  78           HA       ARG  78  -7.100 -11.503   2.858
  619    HB2  ARG  78           HB2      ARG  78  -4.848 -10.263   2.456
  620    HB3  ARG  78           HB1      ARG  78  -5.832  -8.920   1.895
  621    HG2  ARG  78           HG2      ARG  78  -5.748  -8.323   4.145
  622    HG3  ARG  78           HG1      ARG  78  -7.131  -9.406   4.238
  623    HD2  ARG  78           HD2      ARG  78  -4.254 -10.254   4.740
  624    HD3  ARG  78           HD1      ARG  78  -5.406  -9.830   6.004
  625    HE   ARG  78           HE       ARG  78  -6.741 -11.791   4.605
  626   HH11  ARG  78          HH21      ARG  78  -3.607 -11.482   6.021
  627   HH12  ARG  78          HH22      ARG  78  -3.468 -13.167   6.397
  628   HH21  ARG  78          HH11      ARG  78  -6.572 -13.989   5.089
  629   HH22  ARG  78          HH12      ARG  78  -5.146 -14.585   5.870
  630    H    ARG  79           HN       ARG  79  -9.013 -11.675   0.960
  631    HA   ARG  79           HA       ARG  79 -10.215  -9.242   0.097
  632    HB2  ARG  79           HB2      ARG  79 -12.285 -10.617  -0.157
  633    HB3  ARG  79           HB1      ARG  79 -10.865 -11.373  -0.877
  634    HG2  ARG  79           HG2      ARG  79 -10.574 -12.725   1.202
  635    HG3  ARG  79           HG1      ARG  79 -12.064 -12.023   1.833
  636    HD2  ARG  79           HD2      ARG  79 -13.308 -12.929  -0.096
  637    HD3  ARG  79           HD1      ARG  79 -11.820 -13.640  -0.720
  638    HE   ARG  79           HE       ARG  79 -12.020 -14.657   1.856
  639   HH11  ARG  79          HH21      ARG  79 -14.043 -14.513  -0.940
  640   HH12  ARG  79          HH22      ARG  79 -14.856 -16.002  -0.589
  641   HH21  ARG  79          HH11      ARG  79 -13.072 -16.599   2.323
  642   HH22  ARG  79          HH12      ARG  79 -14.306 -17.181   1.256
  643    H    ASP  80           HN       ASP  80 -10.378 -10.925   3.181
  644    HA   ASP  80           HA       ASP  80 -12.730  -9.690   4.213
  645    HB2  ASP  80           HB2      ASP  80 -10.225 -10.642   5.639
  646    HB3  ASP  80           HB1      ASP  80 -11.717 -10.184   6.460
  647    H    LEU  81           HN       LEU  81  -9.310  -8.679   4.501
  648    HA   LEU  81           HA       LEU  81  -9.785  -6.345   6.023
  649    HB2  LEU  81           HB2      LEU  81  -7.534  -7.420   5.483
  650    HB3  LEU  81           HB1      LEU  81  -7.618  -6.625   3.919
  651    HG   LEU  81           HG       LEU  81  -7.994  -4.424   5.306
  652   HD11  LEU  81          HD11      LEU  81  -6.822  -6.278   7.414
  653   HD12  LEU  81          HD12      LEU  81  -8.316  -5.353   7.526
  654   HD13  LEU  81          HD13      LEU  81  -6.768  -4.522   7.525
  655   HD21  LEU  81          HD21      LEU  81  -5.507  -4.165   5.567
  656   HD22  LEU  81          HD22      LEU  81  -5.979  -4.810   3.997
  657   HD23  LEU  81          HD23      LEU  81  -5.334  -5.888   5.235
  658    H    TYR  82           HN       TYR  82 -10.341  -6.935   2.603
  659    HA   TYR  82           HA       TYR  82 -10.464  -4.114   1.878
  660    HB2  TYR  82           HB2      TYR  82 -10.031  -5.594   0.064
  661    HB3  TYR  82           HB1      TYR  82 -11.326  -6.686   0.533
  662    HD1  TYR  82           HD1      TYR  82 -10.991  -3.011  -0.185
  663    HD2  TYR  82           HD2      TYR  82 -13.201  -6.625  -0.931
  664    HE1  TYR  82           HE1      TYR  82 -12.523  -1.769  -1.686
  665    HE2  TYR  82           HE2      TYR  82 -14.726  -5.378  -2.432
  666    HH   TYR  82           HH       TYR  82 -14.282  -1.887  -3.022
  667    H    GLU  83           HN       GLU  83 -12.832  -6.572   2.899
  668    HA   GLU  83           HA       GLU  83 -15.164  -5.057   2.350
  669    HB2  GLU  83           HB2      GLU  83 -14.937  -7.529   3.125
  670    HB3  GLU  83           HB1      GLU  83 -14.924  -6.882   4.764
  671    HG2  GLU  83           HG2      GLU  83 -17.084  -5.708   4.253
  672    HG3  GLU  83           HG1      GLU  83 -17.104  -6.522   2.687
  673    H    LYS  84           HN       LYS  84 -13.101  -5.129   5.261
  674    HA   LYS  84           HA       LYS  84 -14.708  -3.150   6.667
  675    HB2  LYS  84           HB2      LYS  84 -13.160  -4.877   7.733
  676    HB3  LYS  84           HB1      LYS  84 -11.815  -3.885   7.191
  677    HG2  LYS  84           HG2      LYS  84 -12.136  -3.062   9.372
  678    HG3  LYS  84           HG1      LYS  84 -13.096  -1.924   8.434
  679    HD2  LYS  84           HD2      LYS  84 -15.146  -3.160   8.977
  680    HD3  LYS  84           HD1      LYS  84 -14.208  -4.394   9.815
  681    HE2  LYS  84           HE2      LYS  84 -15.179  -2.787  11.414
  682    HE3  LYS  84           HE1      LYS  84 -13.417  -2.701  11.425
  683    HZ1  LYS  84           HZ1      LYS  84 -14.467  -0.504  11.360
  684    HZ2  LYS  84           HZ2      LYS  84 -15.199  -0.898   9.879
  685    HZ3  LYS  84           HZ3      LYS  84 -13.507  -0.788   9.990
  686    H    ALA  85           HN       ALA  85 -11.578  -3.055   4.936
  687    HA   ALA  85           HA       ALA  85 -10.969  -0.335   5.328
  688    HB1  ALA  85           HB1      ALA  85  -9.580  -0.488   3.343
  689    HB2  ALA  85           HB2      ALA  85 -10.495  -1.876   2.756
  690    HB3  ALA  85           HB3      ALA  85  -9.487  -2.030   4.194
  691    H    LYS  86           HN       LYS  86 -13.063  -1.820   2.866
  692    HA   LYS  86           HA       LYS  86 -13.603   0.572   1.424
  693    HB2  LYS  86           HB2      LYS  86 -14.212  -1.674   0.551
  694    HB3  LYS  86           HB1      LYS  86 -15.415  -1.848   1.823
  695    HG2  LYS  86           HG2      LYS  86 -16.491  -1.170  -0.268
  696    HG3  LYS  86           HG1      LYS  86 -16.650   0.116   0.922
  697    HD2  LYS  86           HD2      LYS  86 -15.048   1.493  -0.163
  698    HD3  LYS  86           HD1      LYS  86 -14.338   0.138  -1.041
  699    HE2  LYS  86           HE2      LYS  86 -15.695   1.556  -2.535
  700    HE3  LYS  86           HE1      LYS  86 -16.395  -0.055  -2.394
  701    HZ1  LYS  86           HZ1      LYS  86 -17.367   1.678  -0.360
  702    HZ2  LYS  86           HZ2      LYS  86 -18.234   0.784  -1.516
  703    HZ3  LYS  86           HZ3      LYS  86 -17.654   2.335  -1.898
  704    H    ARG  87           HN       ARG  87 -14.828  -0.607   4.504
  705    HA   ARG  87           HA       ARG  87 -17.081   1.291   4.537
  706    HB2  ARG  87           HB2      ARG  87 -15.890  -0.499   6.678
  707    HB3  ARG  87           HB1      ARG  87 -17.320   0.506   6.911
  708    HG2  ARG  87           HG2      ARG  87 -18.444  -0.660   5.047
  709    HG3  ARG  87           HG1      ARG  87 -17.019  -1.674   4.823
  710    HD2  ARG  87           HD2      ARG  87 -17.272  -2.591   7.073
  711    HD3  ARG  87           HD1      ARG  87 -18.634  -1.516   7.384
  712    HE   ARG  87           HE       ARG  87 -19.391  -2.920   5.109
  713   HH11  ARG  87          HH21      ARG  87 -18.295  -3.710   8.288
  714   HH12  ARG  87          HH22      ARG  87 -19.180  -5.196   8.364
  715   HH21  ARG  87          HH11      ARG  87 -20.549  -4.854   5.198
  716   HH22  ARG  87          HH12      ARG  87 -20.456  -5.844   6.616
  717    H    ASP  88           HN       ASP  88 -13.761   1.200   5.778
  718    HA   ASP  88           HA       ASP  88 -14.187   3.786   7.225
  719    HB2  ASP  88           HB2      ASP  88 -11.907   1.780   7.190
  720    HB3  ASP  88           HB1      ASP  88 -11.817   3.323   8.041
  721    H    GLU  89           HN       GLU  89 -13.097   2.685   4.175
  722    HA   GLU  89           HA       GLU  89 -11.025   4.691   3.781
  723    HB2  GLU  89           HB2      GLU  89 -12.491   2.738   2.028
  724    HB3  GLU  89           HB1      GLU  89 -11.598   4.039   1.247
  725    HG2  GLU  89           HG2      GLU  89 -10.348   2.207   3.323
  726    HG3  GLU  89           HG1      GLU  89 -10.295   1.871   1.594
  727    HA   PRO  90           HA       PRO  90 -14.192   7.910   3.211
  728    HB2  PRO  90           HB2      PRO  90 -12.352   9.783   1.978
  729    HB3  PRO  90           HB1      PRO  90 -12.929   9.795   3.652
  730    HG2  PRO  90           HG2      PRO  90 -10.279   9.033   2.674
  731    HG3  PRO  90           HG1      PRO  90 -10.824   9.171   4.353
  732    HD2  PRO  90           HD2      PRO  90 -10.302   6.733   2.892
  733    HD3  PRO  90           HD1      PRO  90 -10.948   6.879   4.545
  734    H    LYS  91           HN       LYS  91 -15.506   8.373   1.435
  735    HA   LYS  91           HA       LYS  91 -14.625   7.313  -1.229
  736    HB2  LYS  91           HB2      LYS  91 -17.362   7.921  -0.062
  737    HB3  LYS  91           HB1      LYS  91 -17.096   7.443  -1.740
  738    HG2  LYS  91           HG2      LYS  91 -16.196   5.309  -1.079
  739    HG3  LYS  91           HG1      LYS  91 -16.142   5.787   0.616
  740    HD2  LYS  91           HD2      LYS  91 -18.079   4.333   0.202
  741    HD3  LYS  91           HD1      LYS  91 -18.610   5.950   0.653
  742    HE2  LYS  91           HE2      LYS  91 -19.260   6.479  -1.571
  743    HE3  LYS  91           HE1      LYS  91 -18.304   5.164  -2.259
  744    HZ1  LYS  91           HZ1      LYS  91 -20.130   4.104  -0.406
  745    HZ2  LYS  91           HZ2      LYS  91 -20.036   3.831  -2.080
  746    HZ3  LYS  91           HZ3      LYS  91 -20.974   5.113  -1.477
  Start of MODEL   19
    1    H1   MET   1           HT1      MET   1  -9.517  16.387  13.179
    2    H2   MET   1           HT2      MET   1  -8.840  15.918  11.693
    3    H3   MET   1           HT3      MET   1  -8.767  17.542  12.188
    4    HA   MET   1           HA       MET   1  -6.763  17.113  13.005
    5    HB2  MET   1           HB2      MET   1  -8.187  17.002  15.067
    6    HB3  MET   1           HB1      MET   1  -8.255  15.250  14.878
    7    HG2  MET   1           HG2      MET   1  -5.843  15.077  15.112
    8    HG3  MET   1           HG1      MET   1  -5.681  16.832  15.134
    9    HE1  MET   1           HE1      MET   1  -4.188  16.098  17.334
   10    HE2  MET   1           HE2      MET   1  -4.764  14.438  17.201
   11    HE3  MET   1           HE3      MET   1  -4.893  15.286  18.740
   12    H    ALA   2           HN       ALA   2  -8.554  14.032  12.759
   13    HA   ALA   2           HA       ALA   2  -6.228  12.372  12.555
   14    HB1  ALA   2           HB1      ALA   2  -8.465  11.461  13.045
   15    HB2  ALA   2           HB2      ALA   2  -7.777  10.686  11.619
   16    HB3  ALA   2           HB3      ALA   2  -9.014  11.929  11.436
   17    H    SER   3           HN       SER   3  -4.740  13.151  11.044
   18    HA   SER   3           HA       SER   3  -5.517  14.019   8.383
   19    HB2  SER   3           HB2      SER   3  -2.853  13.304   9.653
   20    HB3  SER   3           HB1      SER   3  -2.980  13.809   7.968
   21    HG   SER   3           HG       SER   3  -3.494  15.786   8.592
   22    H    THR   4           HN       THR   4  -5.403  12.835   6.448
   23    HA   THR   4           HA       THR   4  -5.868  10.005   6.613
   24    HB   THR   4           HB       THR   4  -4.955  11.511   4.137
   25    HG1  THR   4           HG1      THR   4  -7.186  11.923   3.851
   26   HG21  THR   4          HG21      THR   4  -5.117   9.042   3.968
   27   HG22  THR   4          HG22      THR   4  -6.324   9.850   2.969
   28   HG23  THR   4          HG23      THR   4  -6.794   9.128   4.507
   29    H    ARG   5           HN       ARG   5  -2.981  11.893   6.470
   30    HA   ARG   5           HA       ARG   5  -1.229   9.912   5.329
   31    HB2  ARG   5           HB2      ARG   5  -0.705  12.364   5.553
   32    HB3  ARG   5           HB1      ARG   5  -0.515  12.115   7.289
   33    HG2  ARG   5           HG2      ARG   5   1.286  10.506   6.892
   34    HG3  ARG   5           HG1      ARG   5   1.065  10.659   5.148
   35    HD2  ARG   5           HD2      ARG   5   2.934  12.063   5.824
   36    HD3  ARG   5           HD1      ARG   5   1.589  13.099   5.346
   37    HE   ARG   5           HE       ARG   5   1.251  12.782   8.084
   38   HH11  ARG   5          HH21      ARG   5   3.793  13.800   5.979
   39   HH12  ARG   5          HH22      ARG   5   4.490  14.886   7.133
   40   HH21  ARG   5          HH11      ARG   5   2.150  14.194   9.596
   41   HH22  ARG   5          HH12      ARG   5   3.560  15.110   9.179
   42    H    CYS   6           HN       CYS   6  -1.866  10.854   8.728
   43    HA   CYS   6           HA       CYS   6  -0.253   8.698   9.805
   44    HB2  CYS   6           HB2      CYS   6  -2.417  10.366  11.119
   45    HB3  CYS   6           HB1      CYS   6  -1.268   9.328  11.964
   46    HG   CYS   6           HG       CYS   6  -0.684  12.125  11.115
   47    H    LYS   7           HN       LYS   7  -3.677   9.098   9.027
   48    HA   LYS   7           HA       LYS   7  -4.544   6.682  10.365
   49    HB2  LYS   7           HB2      LYS   7  -6.030   8.621   9.719
   50    HB3  LYS   7           HB1      LYS   7  -5.894   8.091   8.044
   51    HG2  LYS   7           HG2      LYS   7  -6.864   5.918   8.614
   52    HG3  LYS   7           HG1      LYS   7  -6.929   6.369  10.318
   53    HD2  LYS   7           HD2      LYS   7  -8.421   8.288   9.697
   54    HD3  LYS   7           HD1      LYS   7  -8.445   7.679   8.042
   55    HE2  LYS   7           HE2      LYS   7  -9.416   5.560   8.807
   56    HE3  LYS   7           HE1      LYS   7  -9.336   6.109  10.482
   57    HZ1  LYS   7           HZ1      LYS   7 -10.746   7.752   8.496
   58    HZ2  LYS   7           HZ2      LYS   7 -11.011   7.618  10.169
   59    HZ3  LYS   7           HZ3      LYS   7 -11.517   6.378   9.123
   60    H    LEU   8           HN       LEU   8  -3.740   7.431   6.950
   61    HA   LEU   8           HA       LEU   8  -4.266   4.699   6.072
   62    HB2  LEU   8           HB2      LEU   8  -4.276   6.824   4.644
   63    HB3  LEU   8           HB1      LEU   8  -2.521   6.764   4.674
   64    HG   LEU   8           HG       LEU   8  -3.982   4.247   3.817
   65   HD11  LEU   8          HD11      LEU   8  -5.172   5.969   2.554
   66   HD12  LEU   8          HD12      LEU   8  -4.104   5.064   1.482
   67   HD13  LEU   8          HD13      LEU   8  -3.641   6.674   2.032
   68   HD21  LEU   8          HD21      LEU   8  -1.524   4.220   3.920
   69   HD22  LEU   8          HD22      LEU   8  -1.443   5.636   2.878
   70   HD23  LEU   8          HD23      LEU   8  -2.049   4.108   2.244
   71    H    ALA   9           HN       ALA   9  -1.362   6.474   7.110
   72    HA   ALA   9           HA       ALA   9   0.509   4.410   6.407
   73    HB1  ALA   9           HB1      ALA   9   1.113   6.787   7.010
   74    HB2  ALA   9           HB2      ALA   9   2.076   5.564   7.838
   75    HB3  ALA   9           HB3      ALA   9   0.771   6.383   8.692
   76    H    ARG  10           HN       ARG  10  -1.425   5.044   9.290
   77    HA   ARG  10           HA       ARG  10  -0.282   3.027  10.957
   78    HB2  ARG  10           HB2      ARG  10  -1.846   4.896  11.678
   79    HB3  ARG  10           HB1      ARG  10  -3.172   3.959  10.993
   80    HG2  ARG  10           HG2      ARG  10  -2.489   2.043  12.481
   81    HG3  ARG  10           HG1      ARG  10  -1.320   3.123  13.242
   82    HD2  ARG  10           HD2      ARG  10  -4.313   3.613  13.108
   83    HD3  ARG  10           HD1      ARG  10  -3.442   3.033  14.529
   84    HE   ARG  10           HE       ARG  10  -2.125   5.382  13.848
   85   HH11  ARG  10          HH21      ARG  10  -5.384   4.439  14.498
   86   HH12  ARG  10          HH22      ARG  10  -5.837   5.980  15.145
   87   HH21  ARG  10          HH11      ARG  10  -2.705   7.394  14.688
   88   HH22  ARG  10          HH12      ARG  10  -4.322   7.651  15.254
   89    H    TYR  11           HN       TYR  11  -2.726   2.933   8.440
   90    HA   TYR  11           HA       TYR  11  -3.800   0.349   8.995
   91    HB2  TYR  11           HB2      TYR  11  -3.904   2.307   6.792
   92    HB3  TYR  11           HB1      TYR  11  -3.912   0.665   6.169
   93    HD1  TYR  11           HD1      TYR  11  -5.445   2.574   9.029
   94    HD2  TYR  11           HD2      TYR  11  -6.065  -0.270   5.865
   95    HE1  TYR  11           HE1      TYR  11  -7.840   2.398   9.650
   96    HE2  TYR  11           HE2      TYR  11  -8.454  -0.446   6.491
   97    HH   TYR  11           HH       TYR  11 -10.089   0.400   7.755
   98    H    LEU  12           HN       LEU  12  -1.230   1.273   6.652
   99    HA   LEU  12           HA       LEU  12  -0.562  -1.401   5.930
  100    HB2  LEU  12           HB2      LEU  12   1.497   0.822   6.148
  101    HB3  LEU  12           HB1      LEU  12   1.504  -0.551   5.047
  102    HG   LEU  12           HG       LEU  12  -0.631   1.645   4.940
  103   HD11  LEU  12          HD11      LEU  12   0.623   2.595   3.083
  104   HD12  LEU  12          HD12      LEU  12   1.829   1.313   3.180
  105   HD13  LEU  12          HD13      LEU  12   1.700   2.498   4.476
  106   HD21  LEU  12          HD21      LEU  12  -1.431  -0.344   3.839
  107   HD22  LEU  12          HD22      LEU  12   0.141  -0.667   3.110
  108   HD23  LEU  12          HD23      LEU  12  -0.829   0.693   2.553
  109    H    GLU  13           HN       GLU  13   0.119   0.410   8.801
  110    HA   GLU  13           HA       GLU  13   2.255  -1.408   9.718
  111    HB2  GLU  13           HB2      GLU  13   0.734   0.863  11.041
  112    HB3  GLU  13           HB1      GLU  13   1.858  -0.144  11.948
  113    HG2  GLU  13           HG2      GLU  13   2.639   1.316   9.401
  114    HG3  GLU  13           HG1      GLU  13   2.853   1.999  11.011
  115    H    ASP  14           HN       ASP  14  -1.210  -1.273   9.832
  116    HA   ASP  14           HA       ASP  14  -1.565  -2.922  12.183
  117    HB2  ASP  14           HB2      ASP  14  -3.397  -2.437   9.809
  118    HB3  ASP  14           HB1      ASP  14  -3.869  -3.275  11.286
  119    H    LEU  15           HN       LEU  15  -0.068  -3.673   9.323
  120    HA   LEU  15           HA       LEU  15  -1.171  -6.436   9.085
  121    HB2  LEU  15           HB2      LEU  15   1.178  -5.210   7.605
  122    HB3  LEU  15           HB1      LEU  15   0.306  -6.680   7.186
  123    HG   LEU  15           HG       LEU  15  -0.766  -3.841   7.107
  124   HD11  LEU  15          HD11      LEU  15  -0.236  -5.928   4.966
  125   HD12  LEU  15          HD12      LEU  15   0.671  -4.437   5.216
  126   HD13  LEU  15          HD13      LEU  15  -1.008  -4.369   4.677
  127   HD21  LEU  15          HD21      LEU  15  -2.650  -5.133   7.786
  128   HD22  LEU  15          HD22      LEU  15  -2.166  -6.518   6.807
  129   HD23  LEU  15          HD23      LEU  15  -2.799  -5.066   6.034
  130    H    GLU  16           HN       GLU  16   0.460  -8.260   9.040
  131    HA   GLU  16           HA       GLU  16   1.938  -8.273  11.539
  132    HB2  GLU  16           HB2      GLU  16   0.801 -10.282  10.554
  133    HB3  GLU  16           HB1      GLU  16   2.022 -10.300   9.283
  134    HG2  GLU  16           HG2      GLU  16   3.794 -10.628  10.918
  135    HG3  GLU  16           HG1      GLU  16   2.645 -10.460  12.247
  136    H    ASP  17           HN       ASP  17   4.235  -8.532  11.775
  137    HA   ASP  17           HA       ASP  17   5.854  -6.823  10.220
  138    HB2  ASP  17           HB2      ASP  17   6.733  -9.240  11.828
  139    HB3  ASP  17           HB1      ASP  17   7.769  -7.905  11.323
  140    H    VAL  18           HN       VAL  18   5.443 -10.363   9.962
  141    HA   VAL  18           HA       VAL  18   7.363 -10.744   7.888
  142    HB   VAL  18           HB       VAL  18   4.807 -12.299   8.469
  143   HG11  VAL  18          HG11      VAL  18   7.198 -12.931   6.703
  144   HG12  VAL  18          HG12      VAL  18   5.509 -12.817   6.206
  145   HG13  VAL  18          HG13      VAL  18   6.037 -14.148   7.234
  146   HG21  VAL  18          HG21      VAL  18   7.707 -12.794   9.242
  147   HG22  VAL  18          HG22      VAL  18   6.347 -13.848   9.627
  148   HG23  VAL  18          HG23      VAL  18   6.442 -12.237  10.337
  149    H    ASP  19           HN       ASP  19   4.011  -9.605   7.820
  150    HA   ASP  19           HA       ASP  19   3.738  -9.800   4.934
  151    HB2  ASP  19           HB2      ASP  19   1.778  -9.741   6.432
  152    HB3  ASP  19           HB1      ASP  19   2.212  -8.110   6.938
  153    H    LEU  20           HN       LEU  20   4.997  -7.371   7.162
  154    HA   LEU  20           HA       LEU  20   4.941  -5.152   5.350
  155    HB2  LEU  20           HB2      LEU  20   6.434  -5.835   7.865
  156    HB3  LEU  20           HB1      LEU  20   7.113  -4.543   6.882
  157    HG   LEU  20           HG       LEU  20   4.867  -3.402   6.942
  158   HD11  LEU  20          HD11      LEU  20   3.553  -5.485   7.447
  159   HD12  LEU  20          HD12      LEU  20   3.198  -4.151   8.540
  160   HD13  LEU  20          HD13      LEU  20   4.239  -5.469   9.070
  161   HD21  LEU  20          HD21      LEU  20   5.078  -2.690   9.327
  162   HD22  LEU  20          HD22      LEU  20   6.629  -2.723   8.488
  163   HD23  LEU  20          HD23      LEU  20   6.197  -4.026   9.597
  164    H    LYS  21           HN       LYS  21   7.283  -7.766   5.851
  165    HA   LYS  21           HA       LYS  21   9.238  -6.664   3.997
  166    HB2  LYS  21           HB2      LYS  21   8.919  -9.485   5.056
  167    HB3  LYS  21           HB1      LYS  21  10.339  -8.856   4.218
  168    HG2  LYS  21           HG2      LYS  21  10.448  -7.057   6.047
  169    HG3  LYS  21           HG1      LYS  21   9.258  -8.018   6.925
  170    HD2  LYS  21           HD2      LYS  21  11.966  -9.024   5.987
  171    HD3  LYS  21           HD1      LYS  21  11.584  -8.534   7.635
  172    HE2  LYS  21           HE2      LYS  21   9.698 -10.298   7.546
  173    HE3  LYS  21           HE1      LYS  21  10.507 -10.910   6.102
  174    HZ1  LYS  21           HZ1      LYS  21  12.293 -10.420   8.294
  175    HZ2  LYS  21           HZ2      LYS  21  12.137 -11.792   7.304
  176    HZ3  LYS  21           HZ3      LYS  21  11.115 -11.587   8.647
  177    H    LYS  22           HN       LYS  22   6.699  -9.171   3.733
  178    HA   LYS  22           HA       LYS  22   7.430  -9.839   0.988
  179    HB2  LYS  22           HB2      LYS  22   5.016 -10.494   2.710
  180    HB3  LYS  22           HB1      LYS  22   5.150 -11.026   1.035
  181    HG2  LYS  22           HG2      LYS  22   7.255 -12.189   1.561
  182    HG3  LYS  22           HG1      LYS  22   7.147 -11.644   3.234
  183    HD2  LYS  22           HD2      LYS  22   5.033 -12.861   3.516
  184    HD3  LYS  22           HD1      LYS  22   5.094 -13.378   1.831
  185    HE2  LYS  22           HE2      LYS  22   7.222 -14.559   2.274
  186    HE3  LYS  22           HE1      LYS  22   7.142 -14.058   3.963
  187    HZ1  LYS  22           HZ1      LYS  22   4.692 -15.188   3.380
  188    HZ2  LYS  22           HZ2      LYS  22   5.926 -15.853   4.340
  189    HZ3  LYS  22           HZ3      LYS  22   5.841 -16.224   2.684
  190    H    PHE  23           HN       PHE  23   5.165  -7.541   2.454
  191    HA   PHE  23           HA       PHE  23   3.691  -7.026   0.007
  192    HB2  PHE  23           HB2      PHE  23   2.708  -6.423   2.133
  193    HB3  PHE  23           HB1      PHE  23   4.078  -5.404   2.542
  194    HD1  PHE  23           HD2      PHE  23   4.513  -3.296   1.243
  195    HD2  PHE  23           HD1      PHE  23   0.912  -5.584   0.752
  196    HE1  PHE  23           HE2      PHE  23   3.418  -1.346   0.174
  197    HE2  PHE  23           HE1      PHE  23  -0.181  -3.635  -0.320
  198    HZ   PHE  23           HZ       PHE  23   1.072  -1.515  -0.610
  199    H    LYS  24           HN       LYS  24   6.429  -5.312   1.594
  200    HA   LYS  24           HA       LYS  24   6.700  -3.283  -0.394
  201    HB2  LYS  24           HB2      LYS  24   8.823  -4.492   1.406
  202    HB3  LYS  24           HB1      LYS  24   8.950  -2.952   0.557
  203    HG2  LYS  24           HG2      LYS  24   7.255  -1.936   1.892
  204    HG3  LYS  24           HG1      LYS  24   6.664  -3.485   2.480
  205    HD2  LYS  24           HD2      LYS  24   7.889  -2.491   4.285
  206    HD3  LYS  24           HD1      LYS  24   8.899  -3.787   3.655
  207    HE2  LYS  24           HE2      LYS  24  10.187  -1.703   4.081
  208    HE3  LYS  24           HE1      LYS  24  10.230  -2.166   2.384
  209    HZ1  LYS  24           HZ1      LYS  24   9.767   0.227   2.798
  210    HZ2  LYS  24           HZ2      LYS  24   8.292  -0.224   3.510
  211    HZ3  LYS  24           HZ3      LYS  24   8.583  -0.555   1.869
  212    H    MET  25           HN       MET  25   8.405  -6.395   0.012
  213    HA   MET  25           HA       MET  25  10.053  -6.139  -2.303
  214    HB2  MET  25           HB2      MET  25  10.383  -7.808  -0.463
  215    HB3  MET  25           HB1      MET  25   8.995  -8.703  -1.081
  216    HG2  MET  25           HG2      MET  25  10.110  -9.067  -3.210
  217    HG3  MET  25           HG1      MET  25  11.459  -8.040  -2.720
  218    HE1  MET  25           HE1      MET  25  12.892 -11.681  -2.843
  219    HE2  MET  25           HE2      MET  25  12.999 -10.041  -3.482
  220    HE3  MET  25           HE3      MET  25  11.582 -11.028  -3.838
  221    H    HIS  26           HN       HIS  26   6.744  -7.335  -1.901
  222    HA   HIS  26           HA       HIS  26   6.500  -8.579  -4.481
  223    HB2  HIS  26           HB2      HIS  26   4.474  -7.310  -2.599
  224    HB3  HIS  26           HB1      HIS  26   3.977  -8.036  -4.130
  225    HD1  HIS  26           HD1      HIS  26   6.843  -9.677  -2.463
  226    HD2  HIS  26           HD2      HIS  26   2.696 -10.106  -2.505
  227    HE1  HIS  26           HE1      HIS  26   6.347 -11.937  -1.435
  228    H    LEU  27           HN       LEU  27   6.226  -5.173  -3.487
  229    HA   LEU  27           HA       LEU  27   5.001  -4.202  -5.899
  230    HB2  LEU  27           HB2      LEU  27   7.037  -2.815  -4.127
  231    HB3  LEU  27           HB1      LEU  27   6.006  -2.017  -5.310
  232    HG   LEU  27           HG       LEU  27   4.957  -3.620  -2.953
  233   HD11  LEU  27          HD11      LEU  27   4.412  -1.354  -2.001
  234   HD12  LEU  27          HD12      LEU  27   5.374  -0.635  -3.290
  235   HD13  LEU  27          HD13      LEU  27   6.140  -1.685  -2.099
  236   HD21  LEU  27          HD21      LEU  27   3.647  -1.906  -5.091
  237   HD22  LEU  27          HD22      LEU  27   2.867  -2.143  -3.528
  238   HD23  LEU  27          HD23      LEU  27   3.206  -3.527  -4.553
  239    H    GLU  28           HN       GLU  28   8.358  -5.061  -5.195
  240    HA   GLU  28           HA       GLU  28   9.328  -3.938  -7.744
  241    HB2  GLU  28           HB2      GLU  28  10.611  -5.618  -5.567
  242    HB3  GLU  28           HB1      GLU  28  11.466  -5.183  -7.046
  243    HG2  GLU  28           HG2      GLU  28  11.994  -3.572  -5.279
  244    HG3  GLU  28           HG1      GLU  28  11.062  -2.783  -6.551
  245    H    ASP  29           HN       ASP  29   7.905  -6.888  -6.676
  246    HA   ASP  29           HA       ASP  29   9.132  -8.706  -8.515
  247    HB2  ASP  29           HB2      ASP  29   7.751  -9.397  -6.562
  248    HB3  ASP  29           HB1      ASP  29   6.317  -8.800  -7.398
  249    H    TYR  30           HN       TYR  30   6.877  -6.147  -9.063
  250    HA   TYR  30           HA       TYR  30   5.601  -7.282 -11.399
  251    HB2  TYR  30           HB2      TYR  30   5.857  -4.447 -10.385
  252    HB3  TYR  30           HB1      TYR  30   4.894  -4.889 -11.795
  253    HD1  TYR  30           HD2      TYR  30   5.359  -5.586  -8.162
  254    HD2  TYR  30           HD1      TYR  30   2.683  -5.778 -11.517
  255    HE1  TYR  30           HE2      TYR  30   3.514  -6.257  -6.652
  256    HE2  TYR  30           HE1      TYR  30   0.837  -6.448 -10.005
  257    HH   TYR  30           HH       TYR  30   1.398  -7.325  -6.699
  258    HA   PRO  31           HA       PRO  31   9.332  -6.360 -13.879
  259    HB2  PRO  31           HB2      PRO  31   8.087  -7.116 -16.372
  260    HB3  PRO  31           HB1      PRO  31   9.194  -8.095 -15.399
  261    HG2  PRO  31           HG2      PRO  31   6.305  -8.438 -15.729
  262    HG3  PRO  31           HG1      PRO  31   7.443  -9.499 -14.883
  263    HD2  PRO  31           HD2      PRO  31   5.497  -7.716 -13.693
  264    HD3  PRO  31           HD1      PRO  31   6.684  -8.739 -12.850
  265    HA   PRO  32           HA       PRO  32   8.384  -2.349 -15.486
  266    HB2  PRO  32           HB2      PRO  32   9.531  -2.577 -18.146
  267    HB3  PRO  32           HB1      PRO  32  10.259  -1.825 -16.720
  268    HG2  PRO  32           HG2      PRO  32  10.923  -4.412 -17.935
  269    HG3  PRO  32           HG1      PRO  32  11.769  -3.567 -16.630
  270    HD2  PRO  32           HD2      PRO  32  10.152  -5.915 -16.351
  271    HD3  PRO  32           HD1      PRO  32  10.800  -4.920 -15.031
  272    H    GLN  33           HN       GLN  33   6.490  -1.572 -16.343
  273    HA   GLN  33           HA       GLN  33   4.922  -3.330 -18.188
  274    HB2  GLN  33           HB2      GLN  33   4.059  -2.389 -15.885
  275    HB3  GLN  33           HB1      GLN  33   3.855  -0.874 -16.756
  276    HG2  GLN  33           HG2      GLN  33   1.754  -2.013 -16.890
  277    HG3  GLN  33           HG1      GLN  33   2.500  -2.187 -18.474
  278   HE21  GLN  33          HE21      GLN  33   4.224  -4.160 -16.356
  279   HE22  GLN  33          HE22      GLN  33   3.401  -5.617 -16.632
  280    H    LYS  34           HN       LYS  34   7.179  -1.298 -18.825
  281    HA   LYS  34           HA       LYS  34   7.617   0.281 -20.497
  282    HB2  LYS  34           HB2      LYS  34   6.420  -1.655 -21.761
  283    HB3  LYS  34           HB1      LYS  34   5.010  -0.600 -21.782
  284    HG2  LYS  34           HG2      LYS  34   6.376   1.158 -22.903
  285    HG3  LYS  34           HG1      LYS  34   7.748   0.051 -22.923
  286    HD2  LYS  34           HD2      LYS  34   6.467  -1.541 -24.286
  287    HD3  LYS  34           HD1      LYS  34   5.067  -0.470 -24.240
  288    HE2  LYS  34           HE2      LYS  34   7.770   0.217 -25.432
  289    HE3  LYS  34           HE1      LYS  34   6.317  -0.186 -26.347
  290    HZ1  LYS  34           HZ1      LYS  34   6.816   2.182 -24.649
  291    HZ2  LYS  34           HZ2      LYS  34   5.243   1.713 -25.087
  292    HZ3  LYS  34           HZ3      LYS  34   6.372   2.134 -26.284
  293    H    GLY  35           HN       GLY  35   6.235   1.192 -18.188
  294    HA2  GLY  35           HA2      GLY  35   5.515   3.795 -18.767
  295    HA3  GLY  35           HA1      GLY  35   4.002   2.906 -18.962
  296    H    CYS  36           HN       CYS  36   6.688   2.524 -16.639
  297    HA   CYS  36           HA       CYS  36   5.115   3.499 -14.395
  298    HB2  CYS  36           HB2      CYS  36   4.074   1.253 -14.795
  299    HB3  CYS  36           HB1      CYS  36   5.654   0.516 -14.533
  300    HG   CYS  36           HG       CYS  36   4.244   0.619 -12.256
  301    H    ILE  37           HN       ILE  37   6.399   3.624 -12.482
  302    HA   ILE  37           HA       ILE  37   9.341   3.156 -12.897
  303    HB   ILE  37           HB       ILE  37   9.425   4.919 -10.947
  304   HG12  ILE  37          HG12      ILE  37   6.746   4.691 -10.827
  305   HG13  ILE  37          HG11      ILE  37   7.538   6.225 -10.496
  306   HG21  ILE  37          HG21      ILE  37   9.200   6.803 -12.655
  307   HG22  ILE  37          HG22      ILE  37   8.723   5.570 -13.820
  308   HG23  ILE  37          HG23      ILE  37  10.321   5.507 -13.077
  309   HD11  ILE  37          HD11      ILE  37   6.656   5.595 -13.321
  310   HD12  ILE  37          HD12      ILE  37   6.885   7.160 -12.551
  311   HD13  ILE  37          HD13      ILE  37   5.484   6.172 -12.137
  312    HA   PRO  38           HA       PRO  38   8.065   0.159  -9.608
  313    HB2  PRO  38           HB2      PRO  38  10.713  -1.090  -9.910
  314    HB3  PRO  38           HB1      PRO  38   9.122  -1.794 -10.238
  315    HG2  PRO  38           HG2      PRO  38  11.028  -1.015 -12.203
  316    HG3  PRO  38           HG1      PRO  38   9.332  -1.425 -12.506
  317    HD2  PRO  38           HD2      PRO  38  10.611   1.234 -12.537
  318    HD3  PRO  38           HD1      PRO  38   9.003   0.773 -13.135
  319    H    LEU  39           HN       LEU  39   8.519   0.395  -7.431
  320    HA   LEU  39           HA       LEU  39  10.292   2.520  -6.616
  321    HB2  LEU  39           HB2      LEU  39   8.626   0.481  -5.137
  322    HB3  LEU  39           HB1      LEU  39   9.631   1.634  -4.270
  323    HG   LEU  39           HG       LEU  39   7.261   2.377  -4.505
  324   HD11  LEU  39          HD11      LEU  39   8.866   4.312  -6.171
  325   HD12  LEU  39          HD12      LEU  39   9.362   3.982  -4.511
  326   HD13  LEU  39          HD13      LEU  39   7.756   4.618  -4.841
  327   HD21  LEU  39          HD21      LEU  39   6.268   2.877  -6.601
  328   HD22  LEU  39          HD22      LEU  39   7.026   1.306  -6.840
  329   HD23  LEU  39          HD23      LEU  39   7.803   2.766  -7.458
  330    HA   PRO  40           HA       PRO  40  13.835  -0.372  -6.551
  331    HB2  PRO  40           HB2      PRO  40  15.325   1.565  -4.886
  332    HB3  PRO  40           HB1      PRO  40  15.687   1.021  -6.531
  333    HG2  PRO  40           HG2      PRO  40  14.651   3.575  -5.808
  334    HG3  PRO  40           HG1      PRO  40  14.748   2.915  -7.449
  335    HD2  PRO  40           HD2      PRO  40  12.347   3.306  -5.798
  336    HD3  PRO  40           HD1      PRO  40  12.440   2.821  -7.507
  337    H    ARG  41           HN       ARG  41  14.362  -1.940  -5.018
  338    HA   ARG  41           HA       ARG  41  12.799  -2.121  -2.630
  339    HB2  ARG  41           HB2      ARG  41  13.881  -4.058  -3.871
  340    HB3  ARG  41           HB1      ARG  41  15.422  -3.565  -3.171
  341    HG2  ARG  41           HG2      ARG  41  14.485  -3.834  -0.902
  342    HG3  ARG  41           HG1      ARG  41  12.942  -4.329  -1.599
  343    HD2  ARG  41           HD2      ARG  41  15.598  -5.762  -1.892
  344    HD3  ARG  41           HD1      ARG  41  14.198  -6.320  -0.976
  345    HE   ARG  41           HE       ARG  41  13.213  -5.974  -3.547
  346   HH11  ARG  41          HH21      ARG  41  15.850  -7.666  -2.092
  347   HH12  ARG  41          HH22      ARG  41  15.851  -8.939  -3.266
  348   HH21  ARG  41          HH11      ARG  41  13.204  -7.629  -5.083
  349   HH22  ARG  41          HH12      ARG  41  14.354  -8.918  -4.958
  350    H    GLY  42           HN       GLY  42  16.283  -1.363  -3.038
  351    HA2  GLY  42           HA2      GLY  42  16.871  -0.946  -0.283
  352    HA3  GLY  42           HA1      GLY  42  17.730  -0.126  -1.591
  353    H    GLN  43           HN       GLN  43  15.099   1.088  -2.524
  354    HA   GLN  43           HA       GLN  43  15.282   3.504  -0.907
  355    HB2  GLN  43           HB2      GLN  43  14.756   3.393  -3.414
  356    HB3  GLN  43           HB1      GLN  43  13.149   2.825  -2.967
  357    HG2  GLN  43           HG2      GLN  43  12.974   5.204  -3.252
  358    HG3  GLN  43           HG1      GLN  43  12.931   4.908  -1.515
  359   HE21  GLN  43          HE21      GLN  43  14.261   6.321  -0.380
  360   HE22  GLN  43          HE22      GLN  43  15.704   6.994  -0.968
  361    H    THR  44           HN       THR  44  12.909   0.869  -1.251
  362    HA   THR  44           HA       THR  44  10.948   2.053   0.500
  363    HB   THR  44           HB       THR  44   9.932  -0.174   0.546
  364    HG1  THR  44           HG1      THR  44  11.685  -1.482   0.769
  365   HG21  THR  44          HG21      THR  44  11.088   0.606  -2.142
  366   HG22  THR  44          HG22      THR  44   9.527   1.085  -1.476
  367   HG23  THR  44          HG23      THR  44   9.813  -0.594  -1.931
  368    H    GLU  45           HN       GLU  45  13.556  -0.331   1.061
  369    HA   GLU  45           HA       GLU  45  12.974  -0.838   3.803
  370    HB2  GLU  45           HB2      GLU  45  15.728  -0.724   2.496
  371    HB3  GLU  45           HB1      GLU  45  15.324  -1.558   3.994
  372    HG2  GLU  45           HG2      GLU  45  14.151  -2.210   1.267
  373    HG3  GLU  45           HG1      GLU  45  15.434  -3.116   2.064
  374    H    LYS  46           HN       LYS  46  14.917   1.786   2.294
  375    HA   LYS  46           HA       LYS  46  15.704   2.898   4.866
  376    HB2  LYS  46           HB2      LYS  46  16.959   3.269   2.717
  377    HB3  LYS  46           HB1      LYS  46  15.622   4.274   2.160
  378    HG2  LYS  46           HG2      LYS  46  15.954   5.834   3.988
  379    HG3  LYS  46           HG1      LYS  46  17.171   4.786   4.717
  380    HD2  LYS  46           HD2      LYS  46  18.606   5.070   2.724
  381    HD3  LYS  46           HD1      LYS  46  17.394   6.134   2.010
  382    HE2  LYS  46           HE2      LYS  46  17.630   7.681   3.925
  383    HE3  LYS  46           HE1      LYS  46  18.859   6.625   4.620
  384    HZ1  LYS  46           HZ1      LYS  46  20.318   7.056   2.860
  385    HZ2  LYS  46           HZ2      LYS  46  19.670   8.575   3.260
  386    HZ3  LYS  46           HZ3      LYS  46  19.105   7.741   1.892
  387    H    ALA  47           HN       ALA  47  12.846   3.013   2.951
  388    HA   ALA  47           HA       ALA  47  11.880   5.591   3.936
  389    HB1  ALA  47           HB1      ALA  47  10.304   3.314   2.697
  390    HB2  ALA  47           HB2      ALA  47  11.142   4.557   1.769
  391    HB3  ALA  47           HB3      ALA  47   9.803   4.999   2.826
  392    H    ASP  48           HN       ASP  48  10.752   5.947   5.804
  393    HA   ASP  48           HA       ASP  48  10.444   3.739   7.727
  394    HB2  ASP  48           HB2      ASP  48  11.123   6.032   8.433
  395    HB3  ASP  48           HB1      ASP  48   9.548   6.635   7.918
  396    H    HIS  49           HN       HIS  49   8.212   3.690   8.930
  397    HA   HIS  49           HA       HIS  49   6.238   2.761   7.120
  398    HB2  HIS  49           HB2      HIS  49   5.894   3.753   9.962
  399    HB3  HIS  49           HB1      HIS  49   4.703   2.811   9.067
  400    HD1  HIS  49           HD1      HIS  49   6.741   2.100  11.660
  401    HD2  HIS  49           HD2      HIS  49   6.676   0.500   7.811
  402    HE1  HIS  49           HE1      HIS  49   7.872  -0.161  11.805
  403    H    VAL  50           HN       VAL  50   6.396   5.885   8.881
  404    HA   VAL  50           HA       VAL  50   4.014   6.965   7.641
  405    HB   VAL  50           HB       VAL  50   6.451   8.394   8.801
  406   HG11  VAL  50          HG11      VAL  50   5.258   9.958   7.386
  407   HG12  VAL  50          HG12      VAL  50   4.827  10.324   9.054
  408   HG13  VAL  50          HG13      VAL  50   3.701   9.435   8.029
  409   HG21  VAL  50          HG21      VAL  50   4.956   8.708  10.783
  410   HG22  VAL  50          HG22      VAL  50   5.318   7.014  10.474
  411   HG23  VAL  50          HG23      VAL  50   3.752   7.679  10.012
  412    H    ASP  51           HN       ASP  51   7.485   7.262   6.849
  413    HA   ASP  51           HA       ASP  51   7.168   8.954   4.586
  414    HB2  ASP  51           HB2      ASP  51   9.363   8.419   5.645
  415    HB3  ASP  51           HB1      ASP  51   9.251   6.784   4.995
  416    H    LEU  52           HN       LEU  52   6.917   5.422   4.905
  417    HA   LEU  52           HA       LEU  52   6.868   4.721   2.185
  418    HB2  LEU  52           HB2      LEU  52   6.680   3.262   4.371
  419    HB3  LEU  52           HB1      LEU  52   4.952   3.446   4.150
  420    HG   LEU  52           HG       LEU  52   5.567   1.379   3.110
  421   HD11  LEU  52          HD11      LEU  52   4.792   1.662   0.884
  422   HD12  LEU  52          HD12      LEU  52   5.404   3.310   0.792
  423   HD13  LEU  52          HD13      LEU  52   4.022   2.937   1.825
  424   HD21  LEU  52          HD21      LEU  52   8.072   2.123   2.861
  425   HD22  LEU  52          HD22      LEU  52   7.579   2.691   1.266
  426   HD23  LEU  52          HD23      LEU  52   7.393   0.996   1.693
  427    H    ALA  53           HN       ALA  53   4.086   5.654   4.243
  428    HA   ALA  53           HA       ALA  53   2.114   5.598   2.188
  429    HB1  ALA  53           HB1      ALA  53   0.827   7.116   3.646
  430    HB2  ALA  53           HB2      ALA  53   2.277   7.435   4.599
  431    HB3  ALA  53           HB3      ALA  53   1.568   5.820   4.586
  432    H    THR  54           HN       THR  54   4.583   7.993   2.939
  433    HA   THR  54           HA       THR  54   3.387  10.141   1.397
  434    HB   THR  54           HB       THR  54   6.319   9.762   2.085
  435    HG1  THR  54           HG1      THR  54   4.122  10.235   3.624
  436   HG21  THR  54          HG21      THR  54   5.848  11.560   0.461
  437   HG22  THR  54          HG22      THR  54   6.353  12.227   2.012
  438   HG23  THR  54          HG23      THR  54   4.649  12.242   1.562
  439    H    LEU  55           HN       LEU  55   5.828   7.632   0.592
  440    HA   LEU  55           HA       LEU  55   6.358   8.727  -2.029
  441    HB2  LEU  55           HB2      LEU  55   6.918   5.982  -0.850
  442    HB3  LEU  55           HB1      LEU  55   7.279   6.368  -2.523
  443    HG   LEU  55           HG       LEU  55   8.655   8.343  -1.657
  444   HD11  LEU  55          HD11      LEU  55   9.488   8.057   0.703
  445   HD12  LEU  55          HD12      LEU  55   8.224   6.855   0.949
  446   HD13  LEU  55          HD13      LEU  55   7.795   8.530   0.606
  447   HD21  LEU  55          HD21      LEU  55  10.587   6.901  -1.103
  448   HD22  LEU  55          HD22      LEU  55   9.676   6.244  -2.462
  449   HD23  LEU  55          HD23      LEU  55   9.497   5.536  -0.856
  450    H    MET  56           HN       MET  56   4.092   6.316  -0.776
  451    HA   MET  56           HA       MET  56   3.198   5.395  -3.357
  452    HB2  MET  56           HB2      MET  56   1.865   5.419  -0.632
  453    HB3  MET  56           HB1      MET  56   1.119   4.686  -2.050
  454    HG2  MET  56           HG2      MET  56   3.898   3.927  -1.087
  455    HG3  MET  56           HG1      MET  56   2.441   3.080  -0.569
  456    HE1  MET  56           HE1      MET  56   1.502   1.170  -1.690
  457    HE2  MET  56           HE2      MET  56   1.246   1.053  -3.428
  458    HE3  MET  56           HE3      MET  56   0.558   2.405  -2.534
  459    H    ILE  57           HN       ILE  57   2.106   8.032  -1.226
  460    HA   ILE  57           HA       ILE  57  -0.095   8.746  -3.033
  461    HB   ILE  57           HB       ILE  57   1.118  10.330  -0.737
  462   HG12  ILE  57          HG12      ILE  57  -1.425   8.668  -0.780
  463   HG13  ILE  57          HG11      ILE  57   0.113   8.037  -0.199
  464   HG21  ILE  57          HG21      ILE  57  -1.435  10.662  -2.336
  465   HG22  ILE  57          HG22      ILE  57  -0.111  11.816  -2.190
  466   HG23  ILE  57          HG23      ILE  57  -1.135  11.474  -0.801
  467   HD11  ILE  57          HD11      ILE  57   0.228   9.840   1.479
  468   HD12  ILE  57          HD12      ILE  57  -1.251   8.898   1.668
  469   HD13  ILE  57          HD13      ILE  57  -1.309  10.483   0.897
  470    H    ASP  58           HN       ASP  58   3.236   9.904  -2.519
  471    HA   ASP  58           HA       ASP  58   2.893  12.199  -4.287
  472    HB2  ASP  58           HB2      ASP  58   4.606  12.015  -2.406
  473    HB3  ASP  58           HB1      ASP  58   5.507  10.908  -3.438
  474    H    PHE  59           HN       PHE  59   4.682   9.081  -4.698
  475    HA   PHE  59           HA       PHE  59   5.326   9.715  -7.460
  476    HB2  PHE  59           HB2      PHE  59   5.500   7.193  -5.798
  477    HB3  PHE  59           HB1      PHE  59   5.892   7.164  -7.515
  478    HD1  PHE  59           HD1      PHE  59   6.661   9.026  -4.361
  479    HD2  PHE  59           HD2      PHE  59   8.091   7.777  -8.212
  480    HE1  PHE  59           HE1      PHE  59   8.903   9.932  -3.821
  481    HE2  PHE  59           HE2      PHE  59  10.333   8.683  -7.673
  482    HZ   PHE  59           HZ       PHE  59  10.740   9.761  -5.478
  483    H    ASN  60           HN       ASN  60   2.747   7.589  -6.057
  484    HA   ASN  60           HA       ASN  60   1.785   7.036  -8.835
  485    HB2  ASN  60           HB2      ASN  60   0.890   5.982  -6.131
  486    HB3  ASN  60           HB1      ASN  60   0.216   5.471  -7.676
  487   HD21  ASN  60          HD21      ASN  60   1.058   3.397  -8.016
  488   HD22  ASN  60          HD22      ASN  60   2.703   2.995  -7.904
  489    H    GLY  61           HN       GLY  61   0.844   8.890  -5.985
  490    HA2  GLY  61           HA2      GLY  61  -0.643  10.811  -6.172
  491    HA3  GLY  61           HA1      GLY  61  -1.428  10.061  -7.557
  492    H    GLU  62           HN       GLU  62  -2.998  10.985  -5.484
  493    HA   GLU  62           HA       GLU  62  -3.558   8.967  -3.492
  494    HB2  GLU  62           HB2      GLU  62  -4.152  11.393  -3.281
  495    HB3  GLU  62           HB1      GLU  62  -5.391  11.155  -4.514
  496    HG2  GLU  62           HG2      GLU  62  -6.543   9.527  -3.112
  497    HG3  GLU  62           HG1      GLU  62  -5.253   9.602  -1.909
  498    H    GLU  63           HN       GLU  63  -4.808   9.607  -6.738
  499    HA   GLU  63           HA       GLU  63  -7.064   7.797  -6.508
  500    HB2  GLU  63           HB2      GLU  63  -5.662   9.174  -8.802
  501    HB3  GLU  63           HB1      GLU  63  -6.877   7.945  -9.144
  502    HG2  GLU  63           HG2      GLU  63  -7.403  10.331  -7.337
  503    HG3  GLU  63           HG1      GLU  63  -7.754  10.329  -9.064
  504    H    LYS  64           HN       LYS  64  -3.903   7.429  -8.194
  505    HA   LYS  64           HA       LYS  64  -4.410   4.651  -8.804
  506    HB2  LYS  64           HB2      LYS  64  -2.858   6.020 -10.137
  507    HB3  LYS  64           HB1      LYS  64  -1.805   6.195  -8.744
  508    HG2  LYS  64           HG2      LYS  64  -0.940   4.478 -10.255
  509    HG3  LYS  64           HG1      LYS  64  -1.408   3.746  -8.726
  510    HD2  LYS  64           HD2      LYS  64  -3.353   2.744  -9.657
  511    HD3  LYS  64           HD1      LYS  64  -3.360   3.833 -11.046
  512    HE2  LYS  64           HE2      LYS  64  -2.588   1.501 -11.583
  513    HE3  LYS  64           HE1      LYS  64  -1.400   2.745 -11.974
  514    HZ1  LYS  64           HZ1      LYS  64  -1.019   0.551 -10.362
  515    HZ2  LYS  64           HZ2      LYS  64  -1.116   1.864  -9.289
  516    HZ3  LYS  64           HZ3      LYS  64   0.029   1.872 -10.543
  517    H    ALA  65           HN       ALA  65  -2.621   6.289  -6.179
  518    HA   ALA  65           HA       ALA  65  -1.379   4.036  -5.029
  519    HB1  ALA  65           HB1      ALA  65  -0.932   6.260  -4.178
  520    HB2  ALA  65           HB2      ALA  65  -1.572   5.283  -2.857
  521    HB3  ALA  65           HB3      ALA  65  -2.612   6.447  -3.675
  522    H    TRP  66           HN       TRP  66  -4.660   5.302  -4.355
  523    HA   TRP  66           HA       TRP  66  -5.407   3.290  -2.485
  524    HB2  TRP  66           HB2      TRP  66  -7.007   4.996  -4.420
  525    HB3  TRP  66           HB1      TRP  66  -7.798   3.863  -3.329
  526    HD1  TRP  66           HD1      TRP  66  -4.737   5.500  -1.868
  527    HE1  TRP  66           HE1      TRP  66  -5.455   7.264  -0.135
  528    HE3  TRP  66           HE3      TRP  66  -9.746   5.713  -2.839
  529    HZ2  TRP  66           HZ2      TRP  66  -7.822   8.602   0.723
  530    HZ3  TRP  66           HZ3      TRP  66 -11.215   7.258  -1.537
  531    HH2  TRP  66           HH2      TRP  66 -10.252   8.693   0.233
  532    H    ALA  67           HN       ALA  67  -5.802   3.392  -6.038
  533    HA   ALA  67           HA       ALA  67  -7.161   0.924  -6.328
  534    HB1  ALA  67           HB1      ALA  67  -6.183   0.912  -8.640
  535    HB2  ALA  67           HB2      ALA  67  -5.174   2.280  -8.172
  536    HB3  ALA  67           HB3      ALA  67  -6.929   2.450  -8.205
  537    H    MET  68           HN       MET  68  -3.688   1.611  -6.045
  538    HA   MET  68           HA       MET  68  -2.891  -1.163  -6.497
  539    HB2  MET  68           HB2      MET  68  -1.467   1.302  -5.457
  540    HB3  MET  68           HB1      MET  68  -0.671  -0.269  -5.474
  541    HG2  MET  68           HG2      MET  68  -1.961   0.814  -7.992
  542    HG3  MET  68           HG1      MET  68  -0.331   1.302  -7.535
  543    HE1  MET  68           HE1      MET  68   1.864  -1.685  -7.844
  544    HE2  MET  68           HE2      MET  68   1.406  -0.458  -6.667
  545    HE3  MET  68           HE3      MET  68   1.723   0.008  -8.335
  546    H    ALA  69           HN       ALA  69  -3.674   0.835  -3.702
  547    HA   ALA  69           HA       ALA  69  -2.663  -1.001  -1.714
  548    HB1  ALA  69           HB1      ALA  69  -3.142   1.426  -1.300
  549    HB2  ALA  69           HB2      ALA  69  -3.921   0.366  -0.125
  550    HB3  ALA  69           HB3      ALA  69  -4.865   1.073  -1.436
  551    H    VAL  70           HN       VAL  70  -5.944  -0.447  -3.047
  552    HA   VAL  70           HA       VAL  70  -7.120  -2.582  -1.430
  553    HB   VAL  70           HB       VAL  70  -9.149  -2.154  -2.701
  554   HG11  VAL  70          HG11      VAL  70  -9.368   0.264  -2.253
  555   HG12  VAL  70          HG12      VAL  70  -7.613   0.415  -2.169
  556   HG13  VAL  70          HG13      VAL  70  -8.475  -0.528  -0.952
  557   HG21  VAL  70          HG21      VAL  70  -8.980  -0.340  -4.563
  558   HG22  VAL  70          HG22      VAL  70  -8.430  -1.961  -4.975
  559   HG23  VAL  70          HG23      VAL  70  -7.253  -0.708  -4.586
  560    H    TRP  71           HN       TRP  71  -6.242  -2.313  -4.894
  561    HA   TRP  71           HA       TRP  71  -7.090  -4.956  -5.563
  562    HB2  TRP  71           HB2      TRP  71  -6.619  -3.185  -7.260
  563    HB3  TRP  71           HB1      TRP  71  -4.899  -3.320  -6.899
  564    HD1  TRP  71           HD1      TRP  71  -7.715  -5.038  -8.736
  565    HE1  TRP  71           HE1      TRP  71  -6.773  -7.046 -10.054
  566    HE3  TRP  71           HE3      TRP  71  -2.981  -5.184  -6.849
  567    HZ2  TRP  71           HZ2      TRP  71  -4.326  -8.519 -10.275
  568    HZ3  TRP  71           HZ3      TRP  71  -1.364  -6.888  -7.622
  569    HH2  TRP  71           HH2      TRP  71  -2.029  -8.559  -9.333
  570    H    ILE  72           HN       ILE  72  -4.101  -3.775  -4.081
  571    HA   ILE  72           HA       ILE  72  -2.644  -6.261  -4.576
  572    HB   ILE  72           HB       ILE  72  -2.176  -3.924  -2.701
  573   HG12  ILE  72          HG12      ILE  72  -1.716  -3.888  -5.297
  574   HG13  ILE  72          HG11      ILE  72  -0.500  -3.244  -4.208
  575   HG21  ILE  72          HG21      ILE  72  -0.608  -6.504  -2.877
  576   HG22  ILE  72          HG22      ILE  72  -1.271  -5.731  -1.439
  577   HG23  ILE  72          HG23      ILE  72   0.103  -5.008  -2.271
  578   HD11  ILE  72          HD11      ILE  72   0.217  -4.885  -6.119
  579   HD12  ILE  72          HD12      ILE  72  -0.356  -6.143  -5.027
  580   HD13  ILE  72          HD13      ILE  72   0.934  -5.056  -4.520
  581    H    PHE  73           HN       PHE  73  -4.635  -5.062  -1.808
  582    HA   PHE  73           HA       PHE  73  -4.047  -7.201  -0.036
  583    HB2  PHE  73           HB2      PHE  73  -6.800  -5.971  -0.324
  584    HB3  PHE  73           HB1      PHE  73  -6.075  -6.661   1.123
  585    HD1  PHE  73           HD1      PHE  73  -3.244  -5.213   0.635
  586    HD2  PHE  73           HD2      PHE  73  -7.334  -3.861   0.715
  587    HE1  PHE  73           HE1      PHE  73  -2.494  -2.971   1.312
  588    HE2  PHE  73           HE2      PHE  73  -6.561  -1.611   1.392
  589    HZ   PHE  73           HZ       PHE  73  -4.144  -1.167   1.695
  590    H    ALA  74           HN       ALA  74  -6.583  -7.045  -2.576
  591    HA   ALA  74           HA       ALA  74  -7.702  -9.607  -2.080
  592    HB1  ALA  74           HB1      ALA  74  -8.428  -9.545  -4.445
  593    HB2  ALA  74           HB2      ALA  74  -7.307  -8.220  -4.756
  594    HB3  ALA  74           HB3      ALA  74  -8.678  -7.977  -3.673
  595    H    ALA  75           HN       ALA  75  -4.681  -8.696  -3.610
  596    HA   ALA  75           HA       ALA  75  -4.192 -11.232  -4.911
  597    HB1  ALA  75           HB1      ALA  75  -2.087  -9.257  -3.972
  598    HB2  ALA  75           HB2      ALA  75  -3.047  -9.011  -5.429
  599    HB3  ALA  75           HB3      ALA  75  -1.972 -10.404  -5.307
  600    H    ILE  76           HN       ILE  76  -3.212  -9.895  -1.741
  601    HA   ILE  76           HA       ILE  76  -1.676 -12.253  -1.033
  602    HB   ILE  76           HB       ILE  76  -2.780 -10.469   1.143
  603   HG12  ILE  76          HG12      ILE  76  -0.804  -9.500  -0.964
  604   HG13  ILE  76          HG11      ILE  76  -2.385  -8.819  -0.607
  605   HG21  ILE  76          HG21      ILE  76  -1.040 -12.331   1.430
  606   HG22  ILE  76          HG22      ILE  76  -0.608 -10.762   2.103
  607   HG23  ILE  76          HG23      ILE  76   0.086 -11.284   0.568
  608   HD11  ILE  76          HD11      ILE  76  -0.852  -7.401   0.512
  609   HD12  ILE  76          HD12      ILE  76   0.085  -8.760   1.127
  610   HD13  ILE  76          HD13      ILE  76  -1.521  -8.427   1.779
  611    H    ASN  77           HN       ASN  77  -4.648 -12.418  -1.813
  612    HA   ASN  77           HA       ASN  77  -6.486 -13.728  -1.255
  613    HB2  ASN  77           HB2      ASN  77  -4.574 -15.083   0.689
  614    HB3  ASN  77           HB1      ASN  77  -6.069 -15.756   0.048
  615   HD21  ASN  77          HD21      ASN  77  -2.851 -16.103  -0.344
  616   HD22  ASN  77          HD22      ASN  77  -2.773 -16.443  -2.005
  617    H    ARG  78           HN       ARG  78  -5.206 -11.510   0.796
  618    HA   ARG  78           HA       ARG  78  -6.842 -12.102   3.180
  619    HB2  ARG  78           HB2      ARG  78  -5.173  -9.706   2.341
  620    HB3  ARG  78           HB1      ARG  78  -6.079  -9.768   3.854
  621    HG2  ARG  78           HG2      ARG  78  -4.846 -11.795   4.514
  622    HG3  ARG  78           HG1      ARG  78  -3.932 -11.741   3.012
  623    HD2  ARG  78           HD2      ARG  78  -3.244  -9.349   3.735
  624    HD3  ARG  78           HD1      ARG  78  -3.823  -9.800   5.336
  625    HE   ARG  78           HE       ARG  78  -1.308 -10.521   4.148
  626   HH11  ARG  78          HH21      ARG  78  -3.873 -11.893   6.014
  627   HH12  ARG  78          HH22      ARG  78  -2.935 -13.256   6.520
  628   HH21  ARG  78          HH11      ARG  78  -0.087 -12.274   4.818
  629   HH22  ARG  78          HH12      ARG  78  -0.796 -13.468   5.851
  630    H    ARG  79           HN       ARG  79  -8.623 -12.230   1.258
  631    HA   ARG  79           HA       ARG  79  -9.770  -9.881   0.197
  632    HB2  ARG  79           HB2      ARG  79 -11.165 -12.417   1.095
  633    HB3  ARG  79           HB1      ARG  79 -11.856 -11.200   0.022
  634    HG2  ARG  79           HG2      ARG  79  -9.993 -11.565  -1.572
  635    HG3  ARG  79           HG1      ARG  79  -9.355 -12.824  -0.524
  636    HD2  ARG  79           HD2      ARG  79 -12.001 -12.814  -1.987
  637    HD3  ARG  79           HD1      ARG  79 -10.654 -13.913  -2.251
  638    HE   ARG  79           HE       ARG  79 -12.789 -14.204  -0.330
  639   HH11  ARG  79          HH21      ARG  79  -9.374 -14.638  -0.640
  640   HH12  ARG  79          HH22      ARG  79  -9.262 -15.675   0.742
  641   HH21  ARG  79          HH11      ARG  79 -12.648 -15.557   1.448
  642   HH22  ARG  79          HH12      ARG  79 -11.108 -16.197   1.917
  643    H    ASP  80           HN       ASP  80 -10.005 -11.232   3.436
  644    HA   ASP  80           HA       ASP  80 -12.309  -9.910   4.385
  645    HB2  ASP  80           HB2      ASP  80 -10.933 -11.575   5.675
  646    HB3  ASP  80           HB1      ASP  80  -9.728 -10.311   5.935
  647    H    LEU  81           HN       LEU  81  -8.978  -8.684   4.110
  648    HA   LEU  81           HA       LEU  81  -9.531  -6.157   5.343
  649    HB2  LEU  81           HB2      LEU  81  -7.238  -7.421   4.562
  650    HB3  LEU  81           HB1      LEU  81  -7.375  -6.265   3.245
  651    HG   LEU  81           HG       LEU  81  -7.342  -5.601   6.210
  652   HD11  LEU  81          HD11      LEU  81  -5.172  -4.499   5.584
  653   HD12  LEU  81          HD12      LEU  81  -5.313  -5.232   3.986
  654   HD13  LEU  81          HD13      LEU  81  -5.148  -6.254   5.414
  655   HD21  LEU  81          HD21      LEU  81  -7.680  -3.885   3.728
  656   HD22  LEU  81          HD22      LEU  81  -7.097  -3.214   5.251
  657   HD23  LEU  81          HD23      LEU  81  -8.697  -3.934   5.169
  658    H    TYR  82           HN       TYR  82 -10.118  -7.389   2.107
  659    HA   TYR  82           HA       TYR  82 -10.373  -4.829   0.808
  660    HB2  TYR  82           HB2      TYR  82 -10.124  -6.988  -0.418
  661    HB3  TYR  82           HB1      TYR  82 -11.748  -7.441   0.094
  662    HD1  TYR  82           HD1      TYR  82  -9.773  -5.062  -1.945
  663    HD2  TYR  82           HD2      TYR  82 -13.714  -6.427  -0.915
  664    HE1  TYR  82           HE1      TYR  82 -10.716  -3.775  -3.843
  665    HE2  TYR  82           HE2      TYR  82 -14.656  -5.139  -2.812
  666    HH   TYR  82           HH       TYR  82 -14.228  -3.669  -4.426
  667    H    GLU  83           HN       GLU  83 -12.587  -6.838   2.695
  668    HA   GLU  83           HA       GLU  83 -14.967  -5.334   2.018
  669    HB2  GLU  83           HB2      GLU  83 -14.334  -7.121   4.388
  670    HB3  GLU  83           HB1      GLU  83 -15.935  -6.478   4.021
  671    HG2  GLU  83           HG2      GLU  83 -15.887  -7.599   1.823
  672    HG3  GLU  83           HG1      GLU  83 -14.286  -8.243   2.188
  673    H    LYS  84           HN       LYS  84 -12.668  -5.184   4.755
  674    HA   LYS  84           HA       LYS  84 -14.112  -3.008   6.052
  675    HB2  LYS  84           HB2      LYS  84 -11.533  -4.477   6.483
  676    HB3  LYS  84           HB1      LYS  84 -11.617  -2.864   7.168
  677    HG2  LYS  84           HG2      LYS  84 -12.333  -4.404   8.875
  678    HG3  LYS  84           HG1      LYS  84 -13.749  -3.520   8.329
  679    HD2  LYS  84           HD2      LYS  84 -14.553  -5.734   8.374
  680    HD3  LYS  84           HD1      LYS  84 -14.086  -5.566   6.690
  681    HE2  LYS  84           HE2      LYS  84 -13.287  -7.701   7.651
  682    HE3  LYS  84           HE1      LYS  84 -11.933  -6.686   7.170
  683    HZ1  LYS  84           HZ1      LYS  84 -11.195  -6.808   9.239
  684    HZ2  LYS  84           HZ2      LYS  84 -12.557  -7.701   9.719
  685    HZ3  LYS  84           HZ3      LYS  84 -12.585  -6.003   9.783
  686    H    ALA  85           HN       ALA  85 -11.310  -3.238   3.887
  687    HA   ALA  85           HA       ALA  85 -10.421  -0.569   3.980
  688    HB1  ALA  85           HB1      ALA  85  -9.548  -0.955   1.702
  689    HB2  ALA  85           HB2      ALA  85 -10.555  -2.397   1.562
  690    HB3  ALA  85           HB3      ALA  85  -9.244  -2.349   2.741
  691    H    LYS  86           HN       LYS  86 -13.161  -1.962   2.235
  692    HA   LYS  86           HA       LYS  86 -13.718   0.416   0.679
  693    HB2  LYS  86           HB2      LYS  86 -14.574  -1.893   0.100
  694    HB3  LYS  86           HB1      LYS  86 -15.689  -1.769   1.462
  695    HG2  LYS  86           HG2      LYS  86 -16.728   0.215   0.480
  696    HG3  LYS  86           HG1      LYS  86 -15.565   0.195  -0.848
  697    HD2  LYS  86           HD2      LYS  86 -16.398  -2.009  -1.560
  698    HD3  LYS  86           HD1      LYS  86 -17.549  -2.014  -0.223
  699    HE2  LYS  86           HE2      LYS  86 -18.645  -1.288  -2.308
  700    HE3  LYS  86           HE1      LYS  86 -18.610   0.024  -1.131
  701    HZ1  LYS  86           HZ1      LYS  86 -17.941   0.715  -3.383
  702    HZ2  LYS  86           HZ2      LYS  86 -16.613  -0.342  -3.296
  703    HZ3  LYS  86           HZ3      LYS  86 -16.726   0.976  -2.230
  704    H    ARG  87           HN       ARG  87 -14.544  -0.585   3.957
  705    HA   ARG  87           HA       ARG  87 -16.638   1.474   4.229
  706    HB2  ARG  87           HB2      ARG  87 -15.309  -0.216   6.368
  707    HB3  ARG  87           HB1      ARG  87 -16.808   0.701   6.527
  708    HG2  ARG  87           HG2      ARG  87 -17.774  -0.696   4.664
  709    HG3  ARG  87           HG1      ARG  87 -16.313  -1.685   4.722
  710    HD2  ARG  87           HD2      ARG  87 -18.383  -1.307   6.900
  711    HD3  ARG  87           HD1      ARG  87 -17.922  -2.809   6.097
  712    HE   ARG  87           HE       ARG  87 -15.564  -1.925   7.268
  713   HH11  ARG  87          HH21      ARG  87 -18.793  -2.562   8.317
  714   HH12  ARG  87          HH22      ARG  87 -18.320  -3.026   9.918
  715   HH21  ARG  87          HH11      ARG  87 -14.936  -2.526   9.353
  716   HH22  ARG  87          HH12      ARG  87 -16.139  -3.005  10.504
  717    H    ASP  88           HN       ASP  88 -13.196   1.165   4.931
  718    HA   ASP  88           HA       ASP  88 -13.179   3.600   6.610
  719    HB2  ASP  88           HB2      ASP  88 -11.630   1.625   6.998
  720    HB3  ASP  88           HB1      ASP  88 -10.808   2.055   5.497
  721    H    GLU  89           HN       GLU  89 -13.064   2.897   3.274
  722    HA   GLU  89           HA       GLU  89 -11.268   4.784   2.178
  723    HB2  GLU  89           HB2      GLU  89 -12.591   3.074   0.928
  724    HB3  GLU  89           HB1      GLU  89 -14.040   4.037   1.185
  725    HG2  GLU  89           HG2      GLU  89 -12.969   5.919  -0.059
  726    HG3  GLU  89           HG1      GLU  89 -11.581   4.876  -0.381
  727    HA   PRO  90           HA       PRO  90 -13.558   8.340   3.992
  728    HB2  PRO  90           HB2      PRO  90 -11.658  10.243   2.876
  729    HB3  PRO  90           HB1      PRO  90 -11.830   9.758   4.569
  730    HG2  PRO  90           HG2      PRO  90  -9.686   9.038   2.761
  731    HG3  PRO  90           HG1      PRO  90  -9.894   8.517   4.439
  732    HD2  PRO  90           HD2      PRO  90 -10.296   6.944   2.016
  733    HD3  PRO  90           HD1      PRO  90 -10.396   6.398   3.692
  734    H    LYS  91           HN       LYS  91 -14.848  10.033   2.994
  735    HA   LYS  91           HA       LYS  91 -16.244  10.806   1.275
  736    HB2  LYS  91           HB2      LYS  91 -14.130  11.998   0.723
  737    HB3  LYS  91           HB1      LYS  91 -13.660  10.645  -0.305
  738    HG2  LYS  91           HG2      LYS  91 -15.497  11.029  -1.809
  739    HG3  LYS  91           HG1      LYS  91 -16.249  12.174  -0.701
  740    HD2  LYS  91           HD2      LYS  91 -15.092  13.316  -2.578
  741    HD3  LYS  91           HD1      LYS  91 -14.412  13.753  -1.013
  742    HE2  LYS  91           HE2      LYS  91 -12.748  13.170  -2.921
  743    HE3  LYS  91           HE1      LYS  91 -12.474  12.416  -1.351
  744    HZ1  LYS  91           HZ1      LYS  91 -14.178  11.053  -3.319
  745    HZ2  LYS  91           HZ2      LYS  91 -13.211  10.393  -2.088
  746    HZ3  LYS  91           HZ3      LYS  91 -12.494  10.991  -3.507
  Start of MODEL   20
    1    H1   MET   1           HT1      MET   1 -11.039  17.401  13.201
    2    H2   MET   1           HT2      MET   1 -11.051  16.486  11.770
    3    H3   MET   1           HT3      MET   1 -10.887  18.176  11.699
    4    HA   MET   1           HA       MET   1  -8.708  17.767  11.535
    5    HB2  MET   1           HB2      MET   1  -9.206  17.149  14.466
    6    HB3  MET   1           HB1      MET   1  -7.614  17.467  13.777
    7    HG2  MET   1           HG2      MET   1  -8.383  19.546  14.694
    8    HG3  MET   1           HG1      MET   1  -8.548  19.691  12.945
    9    HE1  MET   1           HE1      MET   1 -10.021  21.483  15.194
   10    HE2  MET   1           HE2      MET   1 -11.551  21.708  14.352
   11    HE3  MET   1           HE3      MET   1 -10.042  21.735  13.443
   12    H    ALA   2           HN       ALA   2  -8.362  15.971  10.215
   13    HA   ALA   2           HA       ALA   2  -7.379  13.555  11.509
   14    HB1  ALA   2           HB1      ALA   2  -9.013  12.016  10.441
   15    HB2  ALA   2           HB2      ALA   2  -9.942  13.411   9.891
   16    HB3  ALA   2           HB3      ALA   2  -9.785  13.081  11.617
   17    H    SER   3           HN       SER   3  -5.504  13.838  10.278
   18    HA   SER   3           HA       SER   3  -5.605  14.312   7.395
   19    HB2  SER   3           HB2      SER   3  -3.703  15.008   8.975
   20    HB3  SER   3           HB1      SER   3  -3.229  13.312   9.015
   21    HG   SER   3           HG       SER   3  -3.579  13.852   6.501
   22    H    THR   4           HN       THR   4  -5.681  12.771   5.812
   23    HA   THR   4           HA       THR   4  -6.267  10.036   6.452
   24    HB   THR   4           HB       THR   4  -5.189  11.004   3.781
   25    HG1  THR   4           HG1      THR   4  -6.782  12.397   4.073
   26   HG21  THR   4          HG21      THR   4  -7.320   8.946   4.410
   27   HG22  THR   4          HG22      THR   4  -5.617   8.539   4.195
   28   HG23  THR   4          HG23      THR   4  -6.531   9.239   2.860
   29    H    ARG   5           HN       ARG   5  -3.270  11.723   5.726
   30    HA   ARG   5           HA       ARG   5  -1.553   9.586   5.109
   31    HB2  ARG   5           HB2      ARG   5  -0.945  12.030   5.153
   32    HB3  ARG   5           HB1      ARG   5  -0.870  11.929   6.912
   33    HG2  ARG   5           HG2      ARG   5   0.884  10.221   6.763
   34    HG3  ARG   5           HG1      ARG   5   0.783  10.246   5.002
   35    HD2  ARG   5           HD2      ARG   5   1.457  12.615   4.987
   36    HD3  ARG   5           HD1      ARG   5   1.543  12.607   6.748
   37    HE   ARG   5           HE       ARG   5   3.232  10.537   5.982
   38   HH11  ARG   5          HH21      ARG   5   2.891  13.896   5.249
   39   HH12  ARG   5          HH22      ARG   5   4.582  14.138   4.962
   40   HH21  ARG   5          HH11      ARG   5   5.439  10.843   5.610
   41   HH22  ARG   5          HH12      ARG   5   6.022  12.412   5.166
   42    H    CYS   6           HN       CYS   6  -2.757  10.658   8.256
   43    HA   CYS   6           HA       CYS   6  -1.110   8.851   9.805
   44    HB2  CYS   6           HB2      CYS   6  -3.671  10.341  10.436
   45    HB3  CYS   6           HB1      CYS   6  -2.780   9.391  11.627
   46    HG   CYS   6           HG       CYS   6  -0.679  11.037  10.961
   47    H    LYS   7           HN       LYS   7  -4.233   8.586   8.195
   48    HA   LYS   7           HA       LYS   7  -5.040   6.158   9.578
   49    HB2  LYS   7           HB2      LYS   7  -5.969   7.658   7.130
   50    HB3  LYS   7           HB1      LYS   7  -6.543   6.008   7.363
   51    HG2  LYS   7           HG2      LYS   7  -8.131   7.606   8.346
   52    HG3  LYS   7           HG1      LYS   7  -7.389   6.634   9.616
   53    HD2  LYS   7           HD2      LYS   7  -5.860   8.430  10.181
   54    HD3  LYS   7           HD1      LYS   7  -6.410   9.385   8.803
   55    HE2  LYS   7           HE2      LYS   7  -8.627   9.608   9.775
   56    HE3  LYS   7           HE1      LYS   7  -8.201   8.511  11.089
   57    HZ1  LYS   7           HZ1      LYS   7  -6.316  10.204  11.497
   58    HZ2  LYS   7           HZ2      LYS   7  -7.885  10.566  12.036
   59    HZ3  LYS   7           HZ3      LYS   7  -7.292  11.268  10.607
   60    H    LEU   8           HN       LEU   8  -3.696   6.724   6.273
   61    HA   LEU   8           HA       LEU   8  -3.453   3.982   5.541
   62    HB2  LEU   8           HB2      LEU   8  -1.470   6.189   4.894
   63    HB3  LEU   8           HB1      LEU   8  -1.685   4.691   3.996
   64    HG   LEU   8           HG       LEU   8  -3.925   6.713   4.359
   65   HD11  LEU   8          HD11      LEU   8  -1.924   6.460   2.091
   66   HD12  LEU   8          HD12      LEU   8  -2.086   7.824   3.195
   67   HD13  LEU   8          HD13      LEU   8  -3.373   7.465   2.043
   68   HD21  LEU   8          HD21      LEU   8  -3.492   4.323   2.528
   69   HD22  LEU   8          HD22      LEU   8  -4.727   5.539   2.214
   70   HD23  LEU   8          HD23      LEU   8  -4.800   4.576   3.682
   71    H    ALA   9           HN       ALA   9  -1.405   5.933   7.642
   72    HA   ALA   9           HA       ALA   9   0.746   4.005   7.806
   73    HB1  ALA   9           HB1      ALA   9   0.964   6.424   8.421
   74    HB2  ALA   9           HB2      ALA   9   1.529   5.331   9.683
   75    HB3  ALA   9           HB3      ALA   9  -0.043   6.114   9.835
   76    H    ARG  10           HN       ARG  10  -2.237   4.545   9.628
   77    HA   ARG  10           HA       ARG  10  -1.598   2.604  11.701
   78    HB2  ARG  10           HB2      ARG  10  -4.167   3.987  10.879
   79    HB3  ARG  10           HB1      ARG  10  -4.095   2.838  12.214
   80    HG2  ARG  10           HG2      ARG  10  -2.480   4.216  13.393
   81    HG3  ARG  10           HG1      ARG  10  -2.352   5.316  12.021
   82    HD2  ARG  10           HD2      ARG  10  -4.715   5.944  12.280
   83    HD3  ARG  10           HD1      ARG  10  -4.880   4.813  13.623
   84    HE   ARG  10           HE       ARG  10  -2.777   6.463  14.384
   85   HH11  ARG  10          HH21      ARG  10  -6.044   6.886  13.344
   86   HH12  ARG  10          HH22      ARG  10  -6.285   8.334  14.263
   87   HH21  ARG  10          HH11      ARG  10  -3.080   8.350  15.585
   88   HH22  ARG  10          HH12      ARG  10  -4.608   9.162  15.530
   89    H    TYR  11           HN       TYR  11  -3.336   2.456   8.609
   90    HA   TYR  11           HA       TYR  11  -4.343  -0.247   9.118
   91    HB2  TYR  11           HB2      TYR  11  -4.260   1.551   6.677
   92    HB3  TYR  11           HB1      TYR  11  -4.778  -0.127   6.543
   93    HD1  TYR  11           HD1      TYR  11  -6.668  -0.947   8.077
   94    HD2  TYR  11           HD2      TYR  11  -5.811   3.216   7.445
   95    HE1  TYR  11           HE1      TYR  11  -8.943  -0.359   8.866
   96    HE2  TYR  11           HE2      TYR  11  -8.086   3.803   8.239
   97    HH   TYR  11           HH       TYR  11  -9.951   1.965   9.996
   98    H    LEU  12           HN       LEU  12  -1.770   1.090   6.994
   99    HA   LEU  12           HA       LEU  12  -0.851  -1.441   6.078
  100    HB2  LEU  12           HB2      LEU  12  -0.134   0.616   4.983
  101    HB3  LEU  12           HB1      LEU  12   0.611   1.195   6.463
  102    HG   LEU  12           HG       LEU  12   2.238  -0.833   6.292
  103   HD11  LEU  12          HD11      LEU  12   2.467  -1.670   3.877
  104   HD12  LEU  12          HD12      LEU  12   0.850  -1.030   3.597
  105   HD13  LEU  12          HD13      LEU  12   1.102  -2.309   4.783
  106   HD21  LEU  12          HD21      LEU  12   3.652   0.290   4.663
  107   HD22  LEU  12          HD22      LEU  12   2.826   1.506   5.634
  108   HD23  LEU  12          HD23      LEU  12   2.267   1.156   3.998
  109    H    GLU  13           HN       GLU  13  -0.396   0.236   9.091
  110    HA   GLU  13           HA       GLU  13   1.857  -1.456   9.964
  111    HB2  GLU  13           HB2      GLU  13   0.160   0.661  11.324
  112    HB3  GLU  13           HB1      GLU  13   1.286  -0.329  12.249
  113    HG2  GLU  13           HG2      GLU  13   3.167   0.452  10.966
  114    HG3  GLU  13           HG1      GLU  13   2.121   1.261   9.804
  115    H    ASP  14           HN       ASP  14  -1.646  -1.492  10.193
  116    HA   ASP  14           HA       ASP  14  -1.821  -3.370  12.375
  117    HB2  ASP  14           HB2      ASP  14  -3.755  -2.018  11.624
  118    HB3  ASP  14           HB1      ASP  14  -3.780  -2.902  10.097
  119    H    LEU  15           HN       LEU  15  -0.426  -3.772   9.393
  120    HA   LEU  15           HA       LEU  15  -1.359  -6.514   8.865
  121    HB2  LEU  15           HB2      LEU  15   0.105  -4.439   7.436
  122    HB3  LEU  15           HB1      LEU  15   1.073  -5.902   7.416
  123    HG   LEU  15           HG       LEU  15  -1.006  -7.129   6.598
  124   HD11  LEU  15          HD11      LEU  15  -2.739  -5.545   7.248
  125   HD12  LEU  15          HD12      LEU  15  -2.727  -5.667   5.493
  126   HD13  LEU  15          HD13      LEU  15  -1.988  -4.279   6.283
  127   HD21  LEU  15          HD21      LEU  15   0.019  -4.874   4.844
  128   HD22  LEU  15          HD22      LEU  15  -0.720  -6.372   4.280
  129   HD23  LEU  15          HD23      LEU  15   0.845  -6.412   5.091
  130    H    GLU  16           HN       GLU  16   0.069  -8.384   8.992
  131    HA   GLU  16           HA       GLU  16   1.561  -8.465  11.457
  132    HB2  GLU  16           HB2      GLU  16   0.343 -10.413  10.296
  133    HB3  GLU  16           HB1      GLU  16   1.738 -10.522   9.228
  134    HG2  GLU  16           HG2      GLU  16   3.217 -10.918  11.131
  135    HG3  GLU  16           HG1      GLU  16   1.876 -10.694  12.255
  136    H    ASP  17           HN       ASP  17   3.887  -9.078  11.598
  137    HA   ASP  17           HA       ASP  17   5.518  -7.277  10.048
  138    HB2  ASP  17           HB2      ASP  17   7.409  -8.331  11.268
  139    HB3  ASP  17           HB1      ASP  17   6.099  -7.856  12.352
  140    H    VAL  18           HN       VAL  18   5.046 -10.819   9.935
  141    HA   VAL  18           HA       VAL  18   7.125 -11.275   8.007
  142    HB   VAL  18           HB       VAL  18   4.635 -12.914   8.621
  143   HG11  VAL  18          HG11      VAL  18   7.122 -13.547   6.992
  144   HG12  VAL  18          HG12      VAL  18   5.450 -13.571   6.430
  145   HG13  VAL  18          HG13      VAL  18   6.010 -14.780   7.584
  146   HG21  VAL  18          HG21      VAL  18   7.529 -13.185   9.513
  147   HG22  VAL  18          HG22      VAL  18   6.205 -14.257   9.965
  148   HG23  VAL  18          HG23      VAL  18   6.211 -12.582  10.519
  149    H    ASP  19           HN       ASP  19   3.634 -10.525   7.611
  150    HA   ASP  19           HA       ASP  19   3.742 -10.845   4.726
  151    HB2  ASP  19           HB2      ASP  19   1.537  -9.787   4.709
  152    HB3  ASP  19           HB1      ASP  19   1.610 -11.013   5.968
  153    H    LEU  20           HN       LEU  20   4.447  -8.275   6.984
  154    HA   LEU  20           HA       LEU  20   4.325  -6.034   5.283
  155    HB2  LEU  20           HB2      LEU  20   4.792  -5.992   7.758
  156    HB3  LEU  20           HB1      LEU  20   6.424  -6.544   7.405
  157    HG   LEU  20           HG       LEU  20   6.748  -4.510   5.961
  158   HD11  LEU  20          HD11      LEU  20   3.941  -3.933   6.927
  159   HD12  LEU  20          HD12      LEU  20   4.633  -3.722   5.318
  160   HD13  LEU  20          HD13      LEU  20   5.043  -2.594   6.600
  161   HD21  LEU  20          HD21      LEU  20   7.561  -4.572   8.276
  162   HD22  LEU  20          HD22      LEU  20   5.987  -4.031   8.860
  163   HD23  LEU  20          HD23      LEU  20   6.983  -2.952   7.883
  164    H    LYS  21           HN       LYS  21   7.091  -8.205   5.909
  165    HA   LYS  21           HA       LYS  21   8.869  -6.992   4.042
  166    HB2  LYS  21           HB2      LYS  21   8.906  -9.972   4.596
  167    HB3  LYS  21           HB1      LYS  21  10.268  -8.884   4.340
  168    HG2  LYS  21           HG2      LYS  21   8.461  -8.995   6.770
  169    HG3  LYS  21           HG1      LYS  21  10.152  -9.468   6.688
  170    HD2  LYS  21           HD2      LYS  21  10.694  -7.077   6.047
  171    HD3  LYS  21           HD1      LYS  21   9.017  -6.669   6.413
  172    HE2  LYS  21           HE2      LYS  21  10.332  -6.206   8.389
  173    HE3  LYS  21           HE1      LYS  21   9.356  -7.640   8.714
  174    HZ1  LYS  21           HZ1      LYS  21  11.178  -9.030   8.477
  175    HZ2  LYS  21           HZ2      LYS  21  11.830  -7.696   9.302
  176    HZ3  LYS  21           HZ3      LYS  21  12.092  -7.877   7.633
  177    H    LYS  22           HN       LYS  22   6.459  -9.574   3.640
  178    HA   LYS  22           HA       LYS  22   7.167 -10.168   0.908
  179    HB2  LYS  22           HB2      LYS  22   4.630 -10.620   2.507
  180    HB3  LYS  22           HB1      LYS  22   4.795 -11.156   0.840
  181    HG2  LYS  22           HG2      LYS  22   6.928 -11.941   2.840
  182    HG3  LYS  22           HG1      LYS  22   5.400 -12.808   2.851
  183    HD2  LYS  22           HD2      LYS  22   7.133 -12.469   0.376
  184    HD3  LYS  22           HD1      LYS  22   7.189 -13.874   1.432
  185    HE2  LYS  22           HE2      LYS  22   5.635 -14.693  -0.079
  186    HE3  LYS  22           HE1      LYS  22   4.492 -13.781   0.903
  187    HZ1  LYS  22           HZ1      LYS  22   5.445 -13.280  -1.765
  188    HZ2  LYS  22           HZ2      LYS  22   5.462 -11.904  -0.769
  189    HZ3  LYS  22           HZ3      LYS  22   4.017 -12.766  -1.007
  190    H    PHE  23           HN       PHE  23   5.196  -7.659   2.363
  191    HA   PHE  23           HA       PHE  23   3.704  -6.948  -0.002
  192    HB2  PHE  23           HB2      PHE  23   3.187  -6.210   2.356
  193    HB3  PHE  23           HB1      PHE  23   4.550  -5.100   2.251
  194    HD1  PHE  23           HD1      PHE  23   4.571  -3.315   0.455
  195    HD2  PHE  23           HD2      PHE  23   1.076  -5.651   1.357
  196    HE1  PHE  23           HE1      PHE  23   3.150  -1.640  -0.691
  197    HE2  PHE  23           HE2      PHE  23  -0.339  -3.974   0.203
  198    HZ   PHE  23           HZ       PHE  23   0.697  -1.968  -0.820
  199    H    LYS  24           HN       LYS  24   6.834  -5.755   1.287
  200    HA   LYS  24           HA       LYS  24   7.192  -3.767  -0.760
  201    HB2  LYS  24           HB2      LYS  24   9.067  -5.206   1.135
  202    HB3  LYS  24           HB1      LYS  24   9.724  -4.142  -0.105
  203    HG2  LYS  24           HG2      LYS  24   9.466  -2.864   1.931
  204    HG3  LYS  24           HG1      LYS  24   8.261  -2.299   0.777
  205    HD2  LYS  24           HD2      LYS  24   6.510  -3.538   1.877
  206    HD3  LYS  24           HD1      LYS  24   7.673  -4.381   2.900
  207    HE2  LYS  24           HE2      LYS  24   6.443  -2.441   4.008
  208    HE3  LYS  24           HE1      LYS  24   8.203  -2.374   4.101
  209    HZ1  LYS  24           HZ1      LYS  24   7.379  -0.246   3.440
  210    HZ2  LYS  24           HZ2      LYS  24   6.468  -0.926   2.178
  211    HZ3  LYS  24           HZ3      LYS  24   8.165  -0.944   2.109
  212    H    MET  25           HN       MET  25   8.340  -7.138  -0.487
  213    HA   MET  25           HA       MET  25   9.809  -7.220  -2.904
  214    HB2  MET  25           HB2      MET  25   9.713  -9.010  -1.105
  215    HB3  MET  25           HB1      MET  25   8.165  -9.512  -1.783
  216    HG2  MET  25           HG2      MET  25   9.840 -10.922  -2.772
  217    HG3  MET  25           HG1      MET  25   9.362  -9.773  -4.020
  218    HE1  MET  25           HE1      MET  25  11.520 -10.709  -5.147
  219    HE2  MET  25           HE2      MET  25  12.141 -11.578  -3.746
  220    HE3  MET  25           HE3      MET  25  13.173 -10.426  -4.587
  221    H    HIS  26           HN       HIS  26   6.335  -7.525  -2.332
  222    HA   HIS  26           HA       HIS  26   5.686  -8.428  -5.016
  223    HB2  HIS  26           HB2      HIS  26   4.065  -7.087  -2.820
  224    HB3  HIS  26           HB1      HIS  26   3.344  -7.560  -4.360
  225    HD1  HIS  26           HD1      HIS  26   4.625 -10.266  -4.852
  226    HD2  HIS  26           HD2      HIS  26   3.243  -9.089  -1.099
  227    HE1  HIS  26           HE1      HIS  26   4.186 -12.394  -3.550
  228    H    LEU  27           HN       LEU  27   5.763  -5.166  -3.500
  229    HA   LEU  27           HA       LEU  27   4.799  -3.848  -5.899
  230    HB2  LEU  27           HB2      LEU  27   5.185  -3.056  -3.286
  231    HB3  LEU  27           HB1      LEU  27   6.560  -2.269  -4.046
  232    HG   LEU  27           HG       LEU  27   3.673  -1.989  -4.960
  233   HD11  LEU  27          HD11      LEU  27   5.417   0.039  -3.539
  234   HD12  LEU  27          HD12      LEU  27   4.193  -0.942  -2.733
  235   HD13  LEU  27          HD13      LEU  27   3.715   0.214  -3.976
  236   HD21  LEU  27          HD21      LEU  27   4.666  -0.068  -6.283
  237   HD22  LEU  27          HD22      LEU  27   5.182  -1.664  -6.818
  238   HD23  LEU  27          HD23      LEU  27   6.262  -0.674  -5.838
  239    H    GLU  28           HN       GLU  28   8.025  -4.680  -4.691
  240    HA   GLU  28           HA       GLU  28   9.436  -3.241  -6.792
  241    HB2  GLU  28           HB2      GLU  28  10.312  -5.503  -4.968
  242    HB3  GLU  28           HB1      GLU  28  11.391  -4.602  -6.034
  243    HG2  GLU  28           HG2      GLU  28  10.722  -2.498  -4.876
  244    HG3  GLU  28           HG1      GLU  28   9.745  -3.455  -3.761
  245    H    ASP  29           HN       ASP  29   7.994  -6.417  -6.466
  246    HA   ASP  29           HA       ASP  29   9.374  -7.621  -8.718
  247    HB2  ASP  29           HB2      ASP  29   8.307  -8.955  -6.915
  248    HB3  ASP  29           HB1      ASP  29   6.727  -8.379  -7.447
  249    H    TYR  30           HN       TYR  30   7.484  -5.010  -8.804
  250    HA   TYR  30           HA       TYR  30   5.488  -5.671 -10.747
  251    HB2  TYR  30           HB2      TYR  30   5.693  -3.566  -9.245
  252    HB3  TYR  30           HB1      TYR  30   6.762  -2.931 -10.490
  253    HD1  TYR  30           HD2      TYR  30   3.316  -4.063  -9.735
  254    HD2  TYR  30           HD1      TYR  30   5.883  -2.245 -12.663
  255    HE1  TYR  30           HE2      TYR  30   1.331  -3.394 -11.058
  256    HE2  TYR  30           HE1      TYR  30   3.896  -1.577 -13.987
  257    HH   TYR  30           HH       TYR  30   0.597  -2.264 -12.827
  258    HA   PRO  31           HA       PRO  31   8.639  -6.155 -13.995
  259    HB2  PRO  31           HB2      PRO  31   6.725  -6.239 -16.157
  260    HB3  PRO  31           HB1      PRO  31   7.536  -7.614 -15.395
  261    HG2  PRO  31           HG2      PRO  31   4.743  -6.777 -15.092
  262    HG3  PRO  31           HG1      PRO  31   5.518  -8.244 -14.478
  263    HD2  PRO  31           HD2      PRO  31   4.718  -5.939 -12.942
  264    HD3  PRO  31           HD1      PRO  31   5.611  -7.360 -12.354
  265    HA   PRO  32           HA       PRO  32   9.045  -2.039 -15.576
  266    HB2  PRO  32           HB2      PRO  32   9.855  -2.511 -18.271
  267    HB3  PRO  32           HB1      PRO  32  10.929  -2.392 -16.869
  268    HG2  PRO  32           HG2      PRO  32  10.078  -4.823 -18.352
  269    HG3  PRO  32           HG1      PRO  32  11.465  -4.610 -17.271
  270    HD2  PRO  32           HD2      PRO  32   9.076  -6.002 -16.621
  271    HD3  PRO  32           HD1      PRO  32  10.301  -5.448 -15.459
  272    H    GLN  33           HN       GLN  33   7.696  -0.508 -16.539
  273    HA   GLN  33           HA       GLN  33   5.415  -1.516 -18.221
  274    HB2  GLN  33           HB2      GLN  33   5.020  -0.460 -15.864
  275    HB3  GLN  33           HB1      GLN  33   5.433   1.072 -16.625
  276    HG2  GLN  33           HG2      GLN  33   3.619   0.769 -18.256
  277    HG3  GLN  33           HG1      GLN  33   3.235  -0.802 -17.556
  278   HE21  GLN  33          HE21      GLN  33   2.126  -0.843 -15.494
  279   HE22  GLN  33          HE22      GLN  33   1.475   0.560 -14.795
  280    H    LYS  34           HN       LYS  34   8.308  -0.189 -18.642
  281    HA   LYS  34           HA       LYS  34   9.267   1.226 -20.237
  282    HB2  LYS  34           HB2      LYS  34   7.818  -0.353 -21.667
  283    HB3  LYS  34           HB1      LYS  34   6.642   0.954 -21.732
  284    HG2  LYS  34           HG2      LYS  34   7.878   1.393 -23.680
  285    HG3  LYS  34           HG1      LYS  34   8.731   2.411 -22.523
  286    HD2  LYS  34           HD2      LYS  34  10.422   0.633 -22.203
  287    HD3  LYS  34           HD1      LYS  34   9.549  -0.403 -23.329
  288    HE2  LYS  34           HE2      LYS  34  11.361   0.660 -24.533
  289    HE3  LYS  34           HE1      LYS  34   9.846   1.374 -25.085
  290    HZ1  LYS  34           HZ1      LYS  34  11.647   2.996 -24.566
  291    HZ2  LYS  34           HZ2      LYS  34  11.516   2.545 -22.932
  292    HZ3  LYS  34           HZ3      LYS  34  10.197   3.264 -23.726
  293    H    GLY  35           HN       GLY  35   8.240   2.595 -18.109
  294    HA2  GLY  35           HA2      GLY  35   8.013   5.243 -18.985
  295    HA3  GLY  35           HA1      GLY  35   6.354   4.657 -18.837
  296    H    CYS  36           HN       CYS  36   6.030   3.359 -16.670
  297    HA   CYS  36           HA       CYS  36   6.440   5.183 -14.500
  298    HB2  CYS  36           HB2      CYS  36   5.676   2.246 -14.543
  299    HB3  CYS  36           HB1      CYS  36   5.651   3.237 -13.085
  300    HG   CYS  36           HG       CYS  36   4.044   4.735 -15.035
  301    H    ILE  37           HN       ILE  37   8.199   5.409 -13.156
  302    HA   ILE  37           HA       ILE  37  10.552   3.745 -13.634
  303    HB   ILE  37           HB       ILE  37  11.720   5.335 -12.242
  304   HG12  ILE  37          HG12      ILE  37   8.933   6.079 -11.274
  305   HG13  ILE  37          HG11      ILE  37  10.322   5.572 -10.313
  306   HG21  ILE  37          HG21      ILE  37  11.277   7.350 -13.463
  307   HG22  ILE  37          HG22      ILE  37   9.583   6.922 -13.695
  308   HG23  ILE  37          HG23      ILE  37  10.843   6.034 -14.552
  309   HD11  ILE  37          HD11      ILE  37  11.489   7.712 -11.132
  310   HD12  ILE  37          HD12      ILE  37  10.178   7.926  -9.972
  311   HD13  ILE  37          HD13      ILE  37   9.898   8.238 -11.686
  312    HA   PRO  38           HA       PRO  38   9.092   0.957 -10.345
  313    HB2  PRO  38           HB2      PRO  38  11.669  -0.359 -10.081
  314    HB3  PRO  38           HB1      PRO  38  10.217  -0.980 -10.877
  315    HG2  PRO  38           HG2      PRO  38  12.654  -0.010 -12.139
  316    HG3  PRO  38           HG1      PRO  38  11.221  -0.688 -12.925
  317    HD2  PRO  38           HD2      PRO  38  12.053   2.080 -12.897
  318    HD3  PRO  38           HD1      PRO  38  10.584   1.404 -13.636
  319    H    LEU  39           HN       LEU  39   9.379   0.909  -8.052
  320    HA   LEU  39           HA       LEU  39  10.698   3.210  -6.928
  321    HB2  LEU  39           HB2      LEU  39   9.267   0.802  -5.803
  322    HB3  LEU  39           HB1      LEU  39  10.087   1.919  -4.716
  323    HG   LEU  39           HG       LEU  39   8.742   3.784  -5.583
  324   HD11  LEU  39          HD11      LEU  39   7.598   1.643  -7.402
  325   HD12  LEU  39          HD12      LEU  39   8.343   3.176  -7.861
  326   HD13  LEU  39          HD13      LEU  39   6.762   3.165  -7.090
  327   HD21  LEU  39          HD21      LEU  39   7.002   1.403  -4.864
  328   HD22  LEU  39          HD22      LEU  39   6.601   3.104  -4.629
  329   HD23  LEU  39          HD23      LEU  39   7.905   2.370  -3.697
  330    HA   PRO  40           HA       PRO  40  14.691   0.983  -6.823
  331    HB2  PRO  40           HB2      PRO  40  15.749   2.982  -4.931
  332    HB3  PRO  40           HB1      PRO  40  16.245   2.686  -6.604
  333    HG2  PRO  40           HG2      PRO  40  14.721   4.919  -5.661
  334    HG3  PRO  40           HG1      PRO  40  15.033   4.498  -7.352
  335    HD2  PRO  40           HD2      PRO  40  12.511   4.254  -5.875
  336    HD3  PRO  40           HD1      PRO  40  12.800   3.970  -7.607
  337    H    ARG  41           HN       ARG  41  15.370  -0.607  -5.398
  338    HA   ARG  41           HA       ARG  41  13.769  -1.201  -3.089
  339    HB2  ARG  41           HB2      ARG  41  15.079  -2.885  -4.452
  340    HB3  ARG  41           HB1      ARG  41  16.551  -2.257  -3.712
  341    HG2  ARG  41           HG2      ARG  41  15.714  -2.843  -1.482
  342    HG3  ARG  41           HG1      ARG  41  14.198  -3.411  -2.182
  343    HD2  ARG  41           HD2      ARG  41  15.690  -5.309  -1.744
  344    HD3  ARG  41           HD1      ARG  41  15.450  -5.111  -3.481
  345    HE   ARG  41           HE       ARG  41  17.735  -3.628  -2.954
  346   HH11  ARG  41          HH21      ARG  41  16.667  -6.861  -2.369
  347   HH12  ARG  41          HH22      ARG  41  18.258  -7.540  -2.455
  348   HH21  ARG  41          HH11      ARG  41  19.812  -4.501  -3.067
  349   HH22  ARG  41          HH12      ARG  41  20.038  -6.205  -2.850
  350    H    GLY  42           HN       GLY  42  16.860   0.471  -3.489
  351    HA2  GLY  42           HA2      GLY  42  17.584   0.493  -0.694
  352    HA3  GLY  42           HA1      GLY  42  18.183   1.652  -1.883
  353    H    GLN  43           HN       GLN  43  15.653   2.793  -2.654
  354    HA   GLN  43           HA       GLN  43  15.267   4.612  -0.407
  355    HB2  GLN  43           HB2      GLN  43  13.883   4.332  -3.099
  356    HB3  GLN  43           HB1      GLN  43  13.494   5.609  -1.945
  357    HG2  GLN  43           HG2      GLN  43  16.294   5.112  -3.012
  358    HG3  GLN  43           HG1      GLN  43  15.172   6.269  -3.726
  359   HE21  GLN  43          HE21      GLN  43  17.730   6.151  -1.627
  360   HE22  GLN  43          HE22      GLN  43  17.353   7.479  -0.640
  361    H    THR  44           HN       THR  44  13.486   1.893  -1.800
  362    HA   THR  44           HA       THR  44  11.058   2.337  -0.305
  363    HB   THR  44           HB       THR  44  12.168  -0.197  -1.549
  364    HG1  THR  44           HG1      THR  44  10.455   0.475  -3.107
  365   HG21  THR  44          HG21      THR  44   9.418   0.487  -0.476
  366   HG22  THR  44          HG22      THR  44  10.467  -0.837   0.028
  367   HG23  THR  44          HG23      THR  44   9.721  -0.863  -1.569
  368    H    GLU  45           HN       GLU  45  13.924   0.265   0.304
  369    HA   GLU  45           HA       GLU  45  12.810  -0.830   2.755
  370    HB2  GLU  45           HB2      GLU  45  15.007  -1.805   3.110
  371    HB3  GLU  45           HB1      GLU  45  14.633  -1.928   1.390
  372    HG2  GLU  45           HG2      GLU  45  15.941   0.247   1.085
  373    HG3  GLU  45           HG1      GLU  45  16.487   0.050   2.747
  374    H    LYS  46           HN       LYS  46  15.099   1.866   2.064
  375    HA   LYS  46           HA       LYS  46  15.513   2.477   4.867
  376    HB2  LYS  46           HB2      LYS  46  15.943   4.081   2.326
  377    HB3  LYS  46           HB1      LYS  46  16.345   4.705   3.925
  378    HG2  LYS  46           HG2      LYS  46  17.819   2.713   4.281
  379    HG3  LYS  46           HG1      LYS  46  17.489   2.218   2.620
  380    HD2  LYS  46           HD2      LYS  46  18.494   4.237   1.744
  381    HD3  LYS  46           HD1      LYS  46  18.664   4.911   3.366
  382    HE2  LYS  46           HE2      LYS  46  20.780   3.884   2.386
  383    HE3  LYS  46           HE1      LYS  46  20.308   3.273   3.972
  384    HZ1  LYS  46           HZ1      LYS  46  20.873   1.459   2.514
  385    HZ2  LYS  46           HZ2      LYS  46  19.745   1.983   1.357
  386    HZ3  LYS  46           HZ3      LYS  46  19.215   1.406   2.865
  387    H    ALA  47           HN       ALA  47  12.922   3.061   2.679
  388    HA   ALA  47           HA       ALA  47  11.918   5.497   3.859
  389    HB1  ALA  47           HB1      ALA  47  11.127   4.863   1.667
  390    HB2  ALA  47           HB2      ALA  47   9.747   4.793   2.762
  391    HB3  ALA  47           HB3      ALA  47  10.556   3.307   2.266
  392    H    ASP  48           HN       ASP  48  10.799   5.764   5.733
  393    HA   ASP  48           HA       ASP  48  10.351   3.445   7.491
  394    HB2  ASP  48           HB2      ASP  48   9.532   6.344   7.890
  395    HB3  ASP  48           HB1      ASP  48   9.675   5.104   9.136
  396    H    HIS  49           HN       HIS  49   8.090   3.313   8.592
  397    HA   HIS  49           HA       HIS  49   6.132   2.654   6.669
  398    HB2  HIS  49           HB2      HIS  49   5.795   3.420   9.584
  399    HB3  HIS  49           HB1      HIS  49   4.515   2.720   8.596
  400    HD1  HIS  49           HD1      HIS  49   4.321   0.309   9.187
  401    HD2  HIS  49           HD2      HIS  49   8.305   1.526   9.037
  402    HE1  HIS  49           HE1      HIS  49   5.718  -1.760   9.611
  403    H    VAL  50           HN       VAL  50   6.673   5.715   8.392
  404    HA   VAL  50           HA       VAL  50   4.265   6.988   7.308
  405    HB   VAL  50           HB       VAL  50   6.798   8.228   8.477
  406   HG11  VAL  50          HG11      VAL  50   4.045   9.395   7.926
  407   HG12  VAL  50          HG12      VAL  50   5.572   9.893   7.198
  408   HG13  VAL  50          HG13      VAL  50   5.275  10.189   8.909
  409   HG21  VAL  50          HG21      VAL  50   5.698   6.774  10.109
  410   HG22  VAL  50          HG22      VAL  50   4.136   7.519   9.768
  411   HG23  VAL  50          HG23      VAL  50   5.411   8.457  10.543
  412    H    ASP  51           HN       ASP  51   7.765   7.307   6.592
  413    HA   ASP  51           HA       ASP  51   7.474   9.037   4.361
  414    HB2  ASP  51           HB2      ASP  51   9.584   6.938   4.958
  415    HB3  ASP  51           HB1      ASP  51   9.723   8.131   3.666
  416    H    LEU  52           HN       LEU  52   7.246   5.511   4.590
  417    HA   LEU  52           HA       LEU  52   7.292   4.923   1.821
  418    HB2  LEU  52           HB2      LEU  52   7.296   3.262   3.768
  419    HB3  LEU  52           HB1      LEU  52   5.554   3.501   3.856
  420    HG   LEU  52           HG       LEU  52   5.654   2.949   1.233
  421   HD11  LEU  52          HD11      LEU  52   7.398   1.248   0.743
  422   HD12  LEU  52          HD12      LEU  52   8.143   1.574   2.307
  423   HD13  LEU  52          HD13      LEU  52   8.104   2.828   1.069
  424   HD21  LEU  52          HD21      LEU  52   5.901   0.874   3.433
  425   HD22  LEU  52          HD22      LEU  52   5.378   0.515   1.786
  426   HD23  LEU  52          HD23      LEU  52   4.414   1.583   2.805
  427    H    ALA  53           HN       ALA  53   4.464   5.565   3.936
  428    HA   ALA  53           HA       ALA  53   2.481   5.421   1.911
  429    HB1  ALA  53           HB1      ALA  53   2.547   7.193   4.373
  430    HB2  ALA  53           HB2      ALA  53   1.941   5.537   4.309
  431    HB3  ALA  53           HB3      ALA  53   1.108   6.817   3.424
  432    H    THR  54           HN       THR  54   4.757   7.984   2.698
  433    HA   THR  54           HA       THR  54   3.405  10.069   1.202
  434    HB   THR  54           HB       THR  54   6.351   9.805   1.899
  435    HG1  THR  54           HG1      THR  54   5.800  10.463   3.808
  436   HG21  THR  54          HG21      THR  54   6.045  11.478   0.182
  437   HG22  THR  54          HG22      THR  54   6.268  12.313   1.719
  438   HG23  THR  54          HG23      THR  54   4.655  12.158   1.028
  439    H    LEU  55           HN       LEU  55   5.722   7.530   0.355
  440    HA   LEU  55           HA       LEU  55   6.342   8.593  -2.266
  441    HB2  LEU  55           HB2      LEU  55   6.557   5.713  -1.315
  442    HB3  LEU  55           HB1      LEU  55   7.275   6.373  -2.773
  443    HG   LEU  55           HG       LEU  55   7.963   7.260   0.052
  444   HD11  LEU  55          HD11      LEU  55   8.727   4.978  -0.422
  445   HD12  LEU  55          HD12      LEU  55  10.100   6.084  -0.384
  446   HD13  LEU  55          HD13      LEU  55   9.463   5.522  -1.929
  447   HD21  LEU  55          HD21      LEU  55   8.429   9.124  -1.342
  448   HD22  LEU  55          HD22      LEU  55   8.925   8.110  -2.697
  449   HD23  LEU  55          HD23      LEU  55   9.969   8.274  -1.286
  450    H    MET  56           HN       MET  56   3.907   6.437  -0.934
  451    HA   MET  56           HA       MET  56   2.886   5.551  -3.504
  452    HB2  MET  56           HB2      MET  56   1.624   5.625  -0.745
  453    HB3  MET  56           HB1      MET  56   0.874   4.871  -2.148
  454    HG2  MET  56           HG2      MET  56   3.672   4.090  -1.277
  455    HG3  MET  56           HG1      MET  56   2.252   3.326  -0.571
  456    HE1  MET  56           HE1      MET  56   0.805   1.080  -2.613
  457    HE2  MET  56           HE2      MET  56   0.196   2.465  -3.508
  458    HE3  MET  56           HE3      MET  56   0.367   2.565  -1.761
  459    H    ILE  57           HN       ILE  57   1.912   8.136  -1.223
  460    HA   ILE  57           HA       ILE  57  -0.277   9.000  -2.975
  461    HB   ILE  57           HB       ILE  57   0.982  10.506  -0.655
  462   HG12  ILE  57          HG12      ILE  57  -1.457   8.695  -0.676
  463   HG13  ILE  57          HG11      ILE  57   0.120   8.204  -0.070
  464   HG21  ILE  57          HG21      ILE  57  -1.700  10.747  -2.053
  465   HG22  ILE  57          HG22      ILE  57  -0.391  11.928  -2.103
  466   HG23  ILE  57          HG23      ILE  57  -1.244  11.624  -0.594
  467   HD11  ILE  57          HD11      ILE  57  -0.772  10.743   1.131
  468   HD12  ILE  57          HD12      ILE  57  -0.210   9.261   1.904
  469   HD13  ILE  57          HD13      ILE  57  -1.897   9.415   1.421
  470    H    ASP  58           HN       ASP  58   3.099   9.977  -2.484
  471    HA   ASP  58           HA       ASP  58   2.830  12.424  -4.046
  472    HB2  ASP  58           HB2      ASP  58   4.594  12.008  -2.265
  473    HB3  ASP  58           HB1      ASP  58   5.382  10.909  -3.398
  474    H    PHE  59           HN       PHE  59   4.433   9.264  -4.792
  475    HA   PHE  59           HA       PHE  59   4.885  10.144  -7.563
  476    HB2  PHE  59           HB2      PHE  59   5.431   7.600  -6.022
  477    HB3  PHE  59           HB1      PHE  59   5.645   7.639  -7.770
  478    HD1  PHE  59           HD1      PHE  59   6.819   9.036  -4.550
  479    HD2  PHE  59           HD2      PHE  59   7.445   8.919  -8.794
  480    HE1  PHE  59           HE1      PHE  59   9.025  10.124  -4.251
  481    HE2  PHE  59           HE2      PHE  59   9.654  10.008  -8.498
  482    HZ   PHE  59           HZ       PHE  59  10.443  10.610  -6.226
  483    H    ASN  60           HN       ASN  60   2.620   7.728  -6.077
  484    HA   ASN  60           HA       ASN  60   1.503   7.203  -8.796
  485    HB2  ASN  60           HB2      ASN  60   0.867   6.024  -6.070
  486    HB3  ASN  60           HB1      ASN  60   0.092   5.524  -7.571
  487   HD21  ASN  60          HD21      ASN  60   1.450   4.418  -9.189
  488   HD22  ASN  60          HD22      ASN  60   2.933   3.721  -8.745
  489    H    GLY  61           HN       GLY  61   0.658   8.935  -5.856
  490    HA2  GLY  61           HA2      GLY  61  -0.934  10.761  -5.854
  491    HA3  GLY  61           HA1      GLY  61  -1.745  10.050  -7.248
  492    H    GLU  62           HN       GLU  62  -3.334  10.762  -5.166
  493    HA   GLU  62           HA       GLU  62  -3.693   8.688  -3.188
  494    HB2  GLU  62           HB2      GLU  62  -4.472  11.095  -3.005
  495    HB3  GLU  62           HB1      GLU  62  -5.757  10.695  -4.142
  496    HG2  GLU  62           HG2      GLU  62  -6.695  10.464  -1.935
  497    HG3  GLU  62           HG1      GLU  62  -6.444   8.831  -2.545
  498    H    GLU  63           HN       GLU  63  -5.088   9.280  -6.390
  499    HA   GLU  63           HA       GLU  63  -7.182   7.324  -6.163
  500    HB2  GLU  63           HB2      GLU  63  -7.167   9.155  -7.843
  501    HB3  GLU  63           HB1      GLU  63  -5.816   8.372  -8.660
  502    HG2  GLU  63           HG2      GLU  63  -7.183   6.414  -9.155
  503    HG3  GLU  63           HG1      GLU  63  -8.524   7.070  -8.215
  504    H    LYS  64           HN       LYS  64  -4.009   7.121  -7.856
  505    HA   LYS  64           HA       LYS  64  -4.378   4.297  -8.430
  506    HB2  LYS  64           HB2      LYS  64  -1.995   6.146  -8.582
  507    HB3  LYS  64           HB1      LYS  64  -1.858   4.440  -8.983
  508    HG2  LYS  64           HG2      LYS  64  -4.019   6.111 -10.305
  509    HG3  LYS  64           HG1      LYS  64  -2.366   6.200 -10.903
  510    HD2  LYS  64           HD2      LYS  64  -2.356   3.735 -11.215
  511    HD3  LYS  64           HD1      LYS  64  -4.030   3.668 -10.669
  512    HE2  LYS  64           HE2      LYS  64  -3.897   3.700 -13.135
  513    HE3  LYS  64           HE1      LYS  64  -4.707   5.141 -12.520
  514    HZ1  LYS  64           HZ1      LYS  64  -2.943   6.469 -13.034
  515    HZ2  LYS  64           HZ2      LYS  64  -2.806   5.322 -14.279
  516    HZ3  LYS  64           HZ3      LYS  64  -1.803   5.219 -12.912
  517    H    ALA  65           HN       ALA  65  -2.678   6.092  -5.856
  518    HA   ALA  65           HA       ALA  65  -1.215   3.961  -4.739
  519    HB1  ALA  65           HB1      ALA  65  -0.965   6.203  -3.867
  520    HB2  ALA  65           HB2      ALA  65  -1.487   5.153  -2.550
  521    HB3  ALA  65           HB3      ALA  65  -2.646   6.228  -3.334
  522    H    TRP  66           HN       TRP  66  -4.567   4.935  -3.832
  523    HA   TRP  66           HA       TRP  66  -5.007   2.689  -2.117
  524    HB2  TRP  66           HB2      TRP  66  -7.006   4.265  -3.778
  525    HB3  TRP  66           HB1      TRP  66  -7.453   3.119  -2.524
  526    HD1  TRP  66           HD1      TRP  66  -4.968   4.250  -0.513
  527    HE1  TRP  66           HE1      TRP  66  -5.467   6.417   0.758
  528    HE3  TRP  66           HE3      TRP  66  -8.802   6.086  -3.353
  529    HZ2  TRP  66           HZ2      TRP  66  -7.240   8.644   0.616
  530    HZ3  TRP  66           HZ3      TRP  66  -9.883   8.255  -2.744
  531    HH2  TRP  66           HH2      TRP  66  -9.102   9.523  -0.768
  532    H    ALA  67           HN       ALA  67  -5.434   3.096  -5.612
  533    HA   ALA  67           HA       ALA  67  -6.758   0.626  -6.111
  534    HB1  ALA  67           HB1      ALA  67  -4.728   1.971  -7.922
  535    HB2  ALA  67           HB2      ALA  67  -6.414   2.469  -7.793
  536    HB3  ALA  67           HB3      ALA  67  -6.013   0.866  -8.408
  537    H    MET  68           HN       MET  68  -3.304   1.396  -5.783
  538    HA   MET  68           HA       MET  68  -2.428  -1.310  -6.418
  539    HB2  MET  68           HB2      MET  68  -1.015   0.813  -6.630
  540    HB3  MET  68           HB1      MET  68  -0.876   0.804  -4.873
  541    HG2  MET  68           HG2      MET  68   1.068  -0.326  -5.692
  542    HG3  MET  68           HG1      MET  68   0.001  -1.588  -5.088
  543    HE1  MET  68           HE1      MET  68   1.455   0.304  -7.978
  544    HE2  MET  68           HE2      MET  68   1.487  -0.865  -9.294
  545    HE3  MET  68           HE3      MET  68   2.428  -1.167  -7.836
  546    H    ALA  69           HN       ALA  69  -3.288   0.457  -3.499
  547    HA   ALA  69           HA       ALA  69  -2.223  -1.472  -1.635
  548    HB1  ALA  69           HB1      ALA  69  -4.504   0.469  -1.153
  549    HB2  ALA  69           HB2      ALA  69  -2.807   0.948  -1.134
  550    HB3  ALA  69           HB3      ALA  69  -3.408  -0.215   0.047
  551    H    VAL  70           HN       VAL  70  -5.486  -0.994  -3.034
  552    HA   VAL  70           HA       VAL  70  -6.640  -3.181  -1.468
  553    HB   VAL  70           HB       VAL  70  -8.621  -2.871  -2.865
  554   HG11  VAL  70          HG11      VAL  70  -8.294  -1.290  -1.040
  555   HG12  VAL  70          HG12      VAL  70  -8.963  -0.421  -2.423
  556   HG13  VAL  70          HG13      VAL  70  -7.246  -0.290  -2.045
  557   HG21  VAL  70          HG21      VAL  70  -6.731  -1.197  -4.555
  558   HG22  VAL  70          HG22      VAL  70  -8.482  -1.014  -4.655
  559   HG23  VAL  70          HG23      VAL  70  -7.733  -2.552  -5.071
  560    H    TRP  71           HN       TRP  71  -5.522  -2.884  -4.857
  561    HA   TRP  71           HA       TRP  71  -6.314  -5.521  -5.614
  562    HB2  TRP  71           HB2      TRP  71  -5.690  -3.755  -7.260
  563    HB3  TRP  71           HB1      TRP  71  -4.011  -3.878  -6.739
  564    HD1  TRP  71           HD1      TRP  71  -6.657  -5.658  -8.775
  565    HE1  TRP  71           HE1      TRP  71  -5.578  -7.644 -10.017
  566    HE3  TRP  71           HE3      TRP  71  -2.050  -5.668  -6.581
  567    HZ2  TRP  71           HZ2      TRP  71  -3.085  -9.051 -10.070
  568    HZ3  TRP  71           HZ3      TRP  71  -0.343  -7.336  -7.241
  569    HH2  TRP  71           HH2      TRP  71  -0.853  -9.028  -8.982
  570    H    ILE  72           HN       ILE  72  -3.450  -4.354  -3.887
  571    HA   ILE  72           HA       ILE  72  -1.988  -6.869  -4.240
  572    HB   ILE  72           HB       ILE  72  -1.605  -4.458  -2.434
  573   HG12  ILE  72          HG12      ILE  72   0.163  -5.727  -4.558
  574   HG13  ILE  72          HG11      ILE  72  -0.947  -4.399  -4.872
  575   HG21  ILE  72          HG21      ILE  72  -0.878  -6.246  -1.005
  576   HG22  ILE  72          HG22      ILE  72   0.586  -5.608  -1.736
  577   HG23  ILE  72          HG23      ILE  72  -0.120  -7.101  -2.344
  578   HD11  ILE  72          HD11      ILE  72   1.312  -3.530  -4.529
  579   HD12  ILE  72          HD12      ILE  72   1.414  -4.341  -2.967
  580   HD13  ILE  72          HD13      ILE  72   0.279  -3.014  -3.198
  581    H    PHE  73           HN       PHE  73  -4.129  -5.593  -1.621
  582    HA   PHE  73           HA       PHE  73  -3.684  -7.696   0.226
  583    HB2  PHE  73           HB2      PHE  73  -6.397  -6.448  -0.286
  584    HB3  PHE  73           HB1      PHE  73  -5.797  -7.127   1.220
  585    HD1  PHE  73           HD1      PHE  73  -2.911  -5.697   0.909
  586    HD2  PHE  73           HD2      PHE  73  -6.997  -4.336   0.721
  587    HE1  PHE  73           HE1      PHE  73  -2.204  -3.453   1.624
  588    HE2  PHE  73           HE2      PHE  73  -6.263  -2.084   1.436
  589    HZ   PHE  73           HZ       PHE  73  -3.870  -1.643   1.892
  590    H    ALA  74           HN       ALA  74  -6.056  -7.583  -2.466
  591    HA   ALA  74           HA       ALA  74  -7.172 -10.162  -1.967
  592    HB1  ALA  74           HB1      ALA  74  -8.170  -8.533  -3.542
  593    HB2  ALA  74           HB2      ALA  74  -7.885 -10.082  -4.336
  594    HB3  ALA  74           HB3      ALA  74  -6.788  -8.731  -4.621
  595    H    ALA  75           HN       ALA  75  -4.155  -9.189  -3.481
  596    HA   ALA  75           HA       ALA  75  -3.643 -11.710  -4.809
  597    HB1  ALA  75           HB1      ALA  75  -1.614  -9.653  -3.878
  598    HB2  ALA  75           HB2      ALA  75  -2.536  -9.516  -5.376
  599    HB3  ALA  75           HB3      ALA  75  -1.403 -10.850  -5.156
  600    H    ILE  76           HN       ILE  76  -2.485 -10.336  -1.703
  601    HA   ILE  76           HA       ILE  76  -1.148 -12.880  -1.019
  602    HB   ILE  76           HB       ILE  76  -0.624 -11.690   1.146
  603   HG12  ILE  76          HG12      ILE  76  -2.027  -9.366  -0.223
  604   HG13  ILE  76          HG11      ILE  76  -2.641 -10.239   1.174
  605   HG21  ILE  76          HG21      ILE  76   0.845 -11.586  -0.898
  606   HG22  ILE  76          HG22      ILE  76   0.997 -10.182   0.153
  607   HG23  ILE  76          HG23      ILE  76   0.056 -10.071  -1.334
  608   HD11  ILE  76          HD11      ILE  76  -1.580  -8.284   2.042
  609   HD12  ILE  76          HD12      ILE  76  -0.164  -8.506   1.018
  610   HD13  ILE  76          HD13      ILE  76  -0.464  -9.610   2.362
  611    H    ASN  77           HN       ASN  77  -4.189 -12.534  -1.321
  612    HA   ASN  77           HA       ASN  77  -6.111 -13.363  -0.297
  613    HB2  ASN  77           HB2      ASN  77  -4.097 -14.943   1.358
  614    HB3  ASN  77           HB1      ASN  77  -5.815 -15.305   1.210
  615   HD21  ASN  77          HD21      ASN  77  -6.061 -17.052  -0.179
  616   HD22  ASN  77          HD22      ASN  77  -5.204 -17.279  -1.626
  617    H    ARG  78           HN       ARG  78  -6.676 -11.356   0.617
  618    HA   ARG  78           HA       ARG  78  -6.905 -11.347   3.505
  619    HB2  ARG  78           HB2      ARG  78  -4.519 -10.573   3.132
  620    HB3  ARG  78           HB1      ARG  78  -5.164  -9.184   2.270
  621    HG2  ARG  78           HG2      ARG  78  -5.508  -8.076   4.250
  622    HG3  ARG  78           HG1      ARG  78  -6.559  -9.365   4.821
  623    HD2  ARG  78           HD2      ARG  78  -4.629 -10.589   5.700
  624    HD3  ARG  78           HD1      ARG  78  -3.529  -9.383   5.031
  625    HE   ARG  78           HE       ARG  78  -5.240  -7.911   6.652
  626   HH11  ARG  78          HH21      ARG  78  -3.207 -10.678   7.021
  627   HH12  ARG  78          HH22      ARG  78  -2.867 -10.367   8.690
  628   HH21  ARG  78          HH11      ARG  78  -4.804  -7.496   8.827
  629   HH22  ARG  78          HH12      ARG  78  -3.770  -8.568   9.712
  630    H    ARG  79           HN       ARG  79  -8.508 -11.189   1.095
  631    HA   ARG  79           HA       ARG  79  -9.461  -8.710   0.297
  632    HB2  ARG  79           HB2      ARG  79 -11.668  -9.834  -0.037
  633    HB3  ARG  79           HB1      ARG  79 -10.313 -10.772  -0.661
  634    HG2  ARG  79           HG2      ARG  79 -10.291 -12.101   1.443
  635    HG3  ARG  79           HG1      ARG  79 -11.700 -11.200   2.003
  636    HD2  ARG  79           HD2      ARG  79 -12.997 -11.993   0.072
  637    HD3  ARG  79           HD1      ARG  79 -11.588 -12.870  -0.524
  638    HE   ARG  79           HE       ARG  79 -11.943 -13.847   2.051
  639   HH11  ARG  79          HH21      ARG  79 -13.892 -13.491  -0.778
  640   HH12  ARG  79          HH22      ARG  79 -14.871 -14.879  -0.436
  641   HH21  ARG  79          HH11      ARG  79 -13.213 -15.658   2.506
  642   HH22  ARG  79          HH12      ARG  79 -14.487 -16.103   1.420
  643    H    ASP  80           HN       ASP  80  -9.966 -10.226   3.433
  644    HA   ASP  80           HA       ASP  80 -12.242  -8.854   4.340
  645    HB2  ASP  80           HB2      ASP  80  -9.711  -9.563   5.859
  646    HB3  ASP  80           HB1      ASP  80 -11.209  -9.039   6.629
  647    H    LEU  81           HN       LEU  81  -9.052  -7.605   3.703
  648    HA   LEU  81           HA       LEU  81  -9.443  -5.125   5.210
  649    HB2  LEU  81           HB2      LEU  81  -7.216  -6.427   4.297
  650    HB3  LEU  81           HB1      LEU  81  -7.376  -5.228   3.023
  651    HG   LEU  81           HG       LEU  81  -7.238  -4.633   6.000
  652   HD11  LEU  81          HD11      LEU  81  -5.021  -3.651   5.372
  653   HD12  LEU  81          HD12      LEU  81  -5.221  -4.331   3.757
  654   HD13  LEU  81          HD13      LEU  81  -5.096  -5.399   5.154
  655   HD21  LEU  81          HD21      LEU  81  -6.893  -2.253   5.078
  656   HD22  LEU  81          HD22      LEU  81  -8.525  -2.899   4.975
  657   HD23  LEU  81          HD23      LEU  81  -7.499  -2.873   3.541
  658    H    TYR  82           HN       TYR  82 -10.163  -6.278   1.963
  659    HA   TYR  82           HA       TYR  82 -10.465  -3.661   0.768
  660    HB2  TYR  82           HB2      TYR  82 -10.194  -5.483  -0.752
  661    HB3  TYR  82           HB1      TYR  82 -11.444  -6.433   0.038
  662    HD1  TYR  82           HD2      TYR  82 -11.250  -2.926  -1.340
  663    HD2  TYR  82           HD1      TYR  82 -13.356  -6.679  -1.348
  664    HE1  TYR  82           HE2      TYR  82 -12.912  -1.996  -2.918
  665    HE2  TYR  82           HE1      TYR  82 -15.013  -5.738  -2.927
  666    HH   TYR  82           HH       TYR  82 -14.656  -2.446  -4.226
  667    H    GLU  83           HN       GLU  83 -12.586  -5.813   2.601
  668    HA   GLU  83           HA       GLU  83 -15.007  -4.302   2.082
  669    HB2  GLU  83           HB2      GLU  83 -14.325  -6.205   4.349
  670    HB3  GLU  83           HB1      GLU  83 -15.940  -5.610   3.971
  671    HG2  GLU  83           HG2      GLU  83 -14.211  -7.149   2.009
  672    HG3  GLU  83           HG1      GLU  83 -15.440  -7.896   3.027
  673    H    LYS  84           HN       LYS  84 -12.591  -4.304   4.705
  674    HA   LYS  84           HA       LYS  84 -13.992  -2.276   6.254
  675    HB2  LYS  84           HB2      LYS  84 -11.086  -3.139   6.369
  676    HB3  LYS  84           HB1      LYS  84 -11.939  -2.201   7.595
  677    HG2  LYS  84           HG2      LYS  84 -13.505  -4.071   7.950
  678    HG3  LYS  84           HG1      LYS  84 -12.664  -5.012   6.718
  679    HD2  LYS  84           HD2      LYS  84 -10.598  -4.941   8.046
  680    HD3  LYS  84           HD1      LYS  84 -11.408  -3.965   9.271
  681    HE2  LYS  84           HE2      LYS  84 -13.016  -5.795   9.671
  682    HE3  LYS  84           HE1      LYS  84 -12.201  -6.775   8.450
  683    HZ1  LYS  84           HZ1      LYS  84 -10.327  -5.766  10.311
  684    HZ2  LYS  84           HZ2      LYS  84 -10.687  -7.380   9.924
  685    HZ3  LYS  84           HZ3      LYS  84 -11.569  -6.577  11.133
  686    H    ALA  85           HN       ALA  85 -11.011  -2.196   4.266
  687    HA   ALA  85           HA       ALA  85 -10.501   0.566   4.449
  688    HB1  ALA  85           HB1      ALA  85  -9.355   0.294   2.226
  689    HB2  ALA  85           HB2      ALA  85 -10.034  -1.331   2.131
  690    HB3  ALA  85           HB3      ALA  85  -8.893  -0.927   3.412
  691    H    LYS  86           HN       LYS  86 -12.695  -1.172   2.269
  692    HA   LYS  86           HA       LYS  86 -13.399   1.173   0.721
  693    HB2  LYS  86           HB2      LYS  86 -13.742  -1.206  -0.070
  694    HB3  LYS  86           HB1      LYS  86 -15.061  -1.352   1.093
  695    HG2  LYS  86           HG2      LYS  86 -16.260   0.491   0.025
  696    HG3  LYS  86           HG1      LYS  86 -14.921   0.743  -1.095
  697    HD2  LYS  86           HD2      LYS  86 -15.240  -1.522  -2.007
  698    HD3  LYS  86           HD1      LYS  86 -16.569  -1.793  -0.878
  699    HE2  LYS  86           HE2      LYS  86 -16.483   0.351  -3.022
  700    HE3  LYS  86           HE1      LYS  86 -17.433  -1.134  -3.088
  701    HZ1  LYS  86           HZ1      LYS  86 -18.993   0.215  -2.209
  702    HZ2  LYS  86           HZ2      LYS  86 -17.863   1.283  -1.523
  703    HZ3  LYS  86           HZ3      LYS  86 -18.224  -0.187  -0.752
  704    H    ARG  87           HN       ARG  87 -14.520  -0.166   3.776
  705    HA   ARG  87           HA       ARG  87 -16.976   1.420   3.824
  706    HB2  ARG  87           HB2      ARG  87 -16.664  -0.759   5.060
  707    HB3  ARG  87           HB1      ARG  87 -15.543   0.069   6.133
  708    HG2  ARG  87           HG2      ARG  87 -17.716   0.033   7.199
  709    HG3  ARG  87           HG1      ARG  87 -17.367   1.689   6.722
  710    HD2  ARG  87           HD2      ARG  87 -18.896  -0.008   4.759
  711    HD3  ARG  87           HD1      ARG  87 -19.749   0.568   6.189
  712    HE   ARG  87           HE       ARG  87 -18.484   2.839   5.224
  713   HH11  ARG  87          HH21      ARG  87 -20.594   0.417   3.953
  714   HH12  ARG  87          HH22      ARG  87 -21.348   1.486   2.818
  715   HH21  ARG  87          HH11      ARG  87 -19.460   4.241   3.749
  716   HH22  ARG  87          HH12      ARG  87 -20.706   3.648   2.703
  717    H    ASP  88           HN       ASP  88 -13.648   1.825   4.885
  718    HA   ASP  88           HA       ASP  88 -14.312   4.308   6.393
  719    HB2  ASP  88           HB2      ASP  88 -11.715   2.791   5.957
  720    HB3  ASP  88           HB1      ASP  88 -11.832   4.284   6.887
  721    H    GLU  89           HN       GLU  89 -13.736   3.476   3.213
  722    HA   GLU  89           HA       GLU  89 -11.874   5.353   2.254
  723    HB2  GLU  89           HB2      GLU  89 -12.835   3.650   0.815
  724    HB3  GLU  89           HB1      GLU  89 -14.440   4.345   0.998
  725    HG2  GLU  89           HG2      GLU  89 -13.361   4.939  -1.177
  726    HG3  GLU  89           HG1      GLU  89 -13.757   6.357  -0.215
  727    HA   PRO  90           HA       PRO  90 -14.352   8.970   3.601
  728    HB2  PRO  90           HB2      PRO  90 -12.510  10.845   2.359
  729    HB3  PRO  90           HB1      PRO  90 -12.674  10.481   4.083
  730    HG2  PRO  90           HG2      PRO  90 -10.511   9.683   2.309
  731    HG3  PRO  90           HG1      PRO  90 -10.669   9.347   4.040
  732    HD2  PRO  90           HD2      PRO  90 -11.005   7.478   1.837
  733    HD3  PRO  90           HD1      PRO  90 -11.151   7.143   3.578
  734    H    LYS  91           HN       LYS  91 -15.839  10.294   2.466
  735    HA   LYS  91           HA       LYS  91 -17.228  10.832   0.655
  736    HB2  LYS  91           HB2      LYS  91 -15.211  12.263   0.192
  737    HB3  LYS  91           HB1      LYS  91 -14.599  10.982  -0.852
  738    HG2  LYS  91           HG2      LYS  91 -16.569  11.157  -2.287
  739    HG3  LYS  91           HG1      LYS  91 -17.274  12.365  -1.213
  740    HD2  LYS  91           HD2      LYS  91 -15.302  13.839  -1.641
  741    HD3  LYS  91           HD1      LYS  91 -14.712  12.654  -2.807
  742    HE2  LYS  91           HE2      LYS  91 -15.970  14.482  -3.917
  743    HE3  LYS  91           HE1      LYS  91 -16.755  12.919  -4.143
  744    HZ1  LYS  91           HZ1      LYS  91 -18.343  13.421  -2.496
  745    HZ2  LYS  91           HZ2      LYS  91 -18.244  14.806  -3.475
  746    HZ3  LYS  91           HZ3      LYS  91 -17.484  14.780  -1.956