*HEADER    MEMBRANE PROTEIN                        11-SEP-13   2MDK              
*TITLE     NMR SOLUTION STRUCTURE OF MSP-P56S DOMAIN/VAPB IN DPC                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VESICLE-ASSOCIATED MEMBRANE PROTEIN-ASSOCIATED PROTEIN B/C;
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 1-125;                                        
*COMPND   5 SYNONYM: VAMP-B/VAMP-C, VAMP-ASSOCIATED PROTEIN B/C, VAP-B/VAP-C;    
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: VAPB;                                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PGEX-4T-1                                  
*KEYWDS    MSP-P56S DOMAIN, VAPB, MEMBRANE PROTEIN                               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    H.QIN, L.LIM, J.SONG                                                  
*REVDAT   1   30-OCT-13 2MDK    0                                                


! phi 
! 3-4 : 
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(resid  4 and name ca  ) (resid  4 and name c  ) 1 -73.000 20.0 2
 
 
! psi
! 4-5 : 
assign (resid  4 and name n  ) (resid  4 and name ca  )
(resid 4 and name c ) (resid 5 and name n ) 1 -28.000 15.0 2
 
 
! phi 
! 4-5 : 
assign (resid  4 and name c  ) (resid  5 and name n  )
(resid  5 and name ca  ) (resid  5 and name c  ) 1 -70.160 12.76 2
 
 
! psi
! 5-6 : 
assign (resid  5 and name n  ) (resid  5 and name ca  )
(resid 5 and name c ) (resid 6 and name n ) 1 -33.750 15.21 2
 
 
! phi 
! 5-6 : 
assign (resid  5 and name c  ) (resid  6 and name n  )
(resid  6 and name ca  ) (resid  6 and name c  ) 1 -62.660 6.79 2
 
 
! psi
! 6-7 : 
assign (resid  6 and name n  ) (resid  6 and name ca  )
(resid 6 and name c ) (resid 7 and name n ) 1 -33.750 15.21 2
 
 
! phi 
! 6-7 : 
assign (resid  6 and name c  ) (resid  7 and name n  )
(resid  7 and name ca  ) (resid  7 and name c  ) 1 -70.160 12.76 2
 
 
! psi
! 7-8 : 
assign (resid  7 and name n  ) (resid  7 and name ca  )
(resid 7 and name c ) (resid 8 and name n ) 1 -33.750 15.21 2
 
 
! phi 
! 7-8 : 
assign (resid  7 and name c  ) (resid  8 and name n  )
(resid  8 and name ca  ) (resid  8 and name c  ) 1 -70.160 12.76 2
 
 
! psi
! 8-9 : 
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(resid 8 and name c ) (resid 9 and name n ) 1 -33.750 15.21 2
 
 
! phi 
! 9-10 : 
assign (resid  9 and name c  ) (resid  10 and name n  )
(resid  10 and name ca  ) (resid  10 and name c  ) 1 -70.160 12.76 2
 
 
! psi
! 10-11 : 
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(resid 10 and name c ) (resid 11 and name n ) 1 -33.750 15.21 2
 
 
! phi 
! 10-11 : 
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(resid  11 and name ca  ) (resid  11 and name c  ) 1 -82.000 15.61 2
 
 
! psi
! 11-12 : 
assign (resid  11 and name n  ) (resid  11 and name ca  )
(resid 11 and name c ) (resid 12 and name n ) 1 -33.750 15.21 2
 
 
! phi 
! 12-13 : 
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(resid  13 and name ca  ) (resid  13 and name c  ) 1 -79.000 15.61 2
 
 
! psi
! 13-14 : 
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(resid 13 and name c ) (resid 14 and name n ) 1 -33.750 15.21 2
 
 


! phi 
! 21-22 : 
assign (resid  21 and name c  ) (resid  22 and name n  )
(resid  22 and name ca  ) (resid  22 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 22-23 : 
assign (resid  22 and name n  ) (resid  22 and name ca  )
(resid 22 and name c ) (resid 23 and name n ) 1 -39.000 17.0 2
 
 
! phi 
! 22-23 : 
assign (resid  22 and name c  ) (resid  23 and name n  )
(resid  23 and name ca  ) (resid  23 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 23-24 : 
assign (resid  23 and name n  ) (resid  23 and name ca  )
(resid 23 and name c ) (resid 24 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 23-24 : 
assign (resid  23 and name c  ) (resid  24 and name n  )
(resid  24 and name ca  ) (resid  24 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 24-25 : 
assign (resid  24 and name n  ) (resid  24 and name ca  )
(resid 24 and name c ) (resid 25 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 24-25 : 
assign (resid  24 and name c  ) (resid  25 and name n  )
(resid  25 and name ca  ) (resid  25 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 25-26 : 
assign (resid  25 and name n  ) (resid  25 and name ca  )
(resid 25 and name c ) (resid 26 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 25-26 : 
assign (resid  25 and name c  ) (resid  26 and name n  )
(resid  26 and name ca  ) (resid  26 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 26-27 : 
assign (resid  26 and name n  ) (resid  26 and name ca  )
(resid 26 and name c ) (resid 27 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 26-27 : 
assign (resid  26 and name c  ) (resid  27 and name n  )
(resid  27 and name ca  ) (resid  27 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 27-28 : 
assign (resid  27 and name n  ) (resid  27 and name ca  )
(resid 27 and name c ) (resid 28 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 27-28 : 
assign (resid  27 and name c  ) (resid  28 and name n  )
(resid  28 and name ca  ) (resid  28 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 28-29 : 
assign (resid  28 and name n  ) (resid  28 and name ca  )
(resid 28 and name c ) (resid 29 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 28-29 : 
assign (resid  28 and name c  ) (resid  29 and name n  )
(resid  29 and name ca  ) (resid  29 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 29-30 : 
assign (resid  29 and name n  ) (resid  29 and name ca  )
(resid 29 and name c ) (resid 30 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 29-30 : 
assign (resid  29 and name c  ) (resid  30 and name n  )
(resid  30 and name ca  ) (resid  30 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 30-31 : 
assign (resid  30 and name n  ) (resid  30 and name ca  )
(resid 30 and name c ) (resid 31 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 30-31 : 
assign (resid  30 and name c  ) (resid  31 and name n  )
(resid  31 and name ca  ) (resid  31 and name c  ) 1 -84.000 10.0 2
 
 


 
! phi 
! 56-57 : 
assign (resid  56 and name c  ) (resid  57 and name n  )
(resid  57 and name ca  ) (resid  57 and name c  ) 1 -75.000 10.0 2
 
 
! psi
! 57-58 : 
assign (resid  57 and name n  ) (resid  57 and name ca  )
(resid 57 and name c ) (resid 58 and name n ) 1 -24.000 9.0 2
 
 
! phi 
! 57-58 : 
assign (resid  57 and name c  ) (resid  58 and name n  )
(resid  58 and name ca  ) (resid  58 and name c  ) 1 -75.000 10.0 2
 
 
! psi
! 58-59 : 
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(resid 58 and name c ) (resid 59 and name n ) 1 -24.000 9.0 2
 
 
! phi 
! 60-61 : 
assign (resid  60 and name c  ) (resid  61 and name n  )
(resid  61 and name ca  ) (resid  61 and name c  ) 1 -75.000 10.0 2
 
 
! psi
! 61-62 : 
assign (resid  61 and name n  ) (resid  61 and name ca  )
(resid 61 and name c ) (resid 62 and name n ) 1 -24.000 9.0 2
 
 
! phi 
! 61-62 : 
assign (resid  61 and name c  ) (resid  62 and name n  )
(resid  62 and name ca  ) (resid  62 and name c  ) 1 -75.000 10.0 2
 
 
! psi
! 62-63 : 
assign (resid  62 and name n  ) (resid  62 and name ca  )
(resid 62 and name c ) (resid 63 and name n ) 1 -24.000 9.0 2
 
 
! phi 
! 62-63 : 
assign (resid  62 and name c  ) (resid  63 and name n  )
(resid  63 and name ca  ) (resid  63 and name c  ) 1 -75.000 10.0 2
 
 
! psi
! 63-64 : 
assign (resid  63 and name n  ) (resid  63 and name ca  )
(resid 63 and name c ) (resid 64 and name n ) 1 -24.000 9.0 2
 
 
! phi 
! 66-67 : 
assign (resid  66 and name c  ) (resid  67 and name n  )
(resid  67 and name ca  ) (resid  67 and name c  ) 1 -75.000 10.0 2
 
 
! psi
! 67-68 : 
assign (resid  67 and name n  ) (resid  67 and name ca  )
(resid 67 and name c ) (resid 68 and name n ) 1 -24.000 9.0 2
 
 
! phi 
! 68-69 : 
assign (resid  68 and name c  ) (resid  69 and name n  )
(resid  69 and name ca  ) (resid  69 and name c  ) 1 -75.000 10.0 2
 
 
! psi
! 69-70 : 
assign (resid  69 and name n  ) (resid  69 and name ca  )
(resid 69 and name c ) (resid 70 and name n ) 1 -24.000 9.0 2
 

! phi 
! 69-70 : 
assign (resid  69 and name c  ) (resid  70 and name n  )
(resid  70 and name ca  ) (resid  70 and name c  ) 1 -71.000 16.0 2
 
 
! psi
! 70-71 : 
assign (resid  70 and name n  ) (resid  70 and name ca  )
(resid 70 and name c ) (resid 71 and name n ) 1 -30.000 16.0 2
 
 


! phi 
! 81-82 : 
assign (resid  81 and name c  ) (resid  82 and name n  )
(resid  82 and name ca  ) (resid  82 and name c  ) 1 -68.000 6.0 2
 
 
! psi
! 82-83 : 
assign (resid  82 and name n  ) (resid  82 and name ca  )
(resid 82 and name c ) (resid 83 and name n ) 1 -33.000 15.0 2
 
 
! phi 
! 82-83 : 
assign (resid  82 and name c  ) (resid  83 and name n  )
(resid  83 and name ca  ) (resid  83 and name c  ) 1 -68.000 6.0 2
 
 
! psi
! 83-84 : 
assign (resid  83 and name n  ) (resid  83 and name ca  )
(resid 83 and name c ) (resid 84 and name n ) 1 -33.000 15.0 2
 
 
! phi 
! 83-84 : 
assign (resid  83 and name c  ) (resid  84 and name n  )
(resid  84 and name ca  ) (resid  84 and name c  ) 1 -68.000 6.0 2
 
 
! psi
! 84-85 : 
assign (resid  84 and name n  ) (resid  84 and name ca  )
(resid 84 and name c ) (resid 85 and name n ) 1 -33.000 15.0 2
 
 
! phi 
! 87-88 : 
assign (resid  87 and name c  ) (resid  88 and name n  )
(resid  88 and name ca  ) (resid  88 and name c  ) 1 -68.000 6.0 2
 
 
! psi
! 88-89 : 
assign (resid  88 and name n  ) (resid  88 and name ca  )
(resid 88 and name c ) (resid 89 and name n ) 1 -33.000 15.0 2
 
 
! phi 
! 88-89 : 
assign (resid  88 and name c  ) (resid  89 and name n  )
(resid  89 and name ca  ) (resid  89 and name c  ) 1 -68.000 6.0 2
 
 
! psi
! 89-90 : 
assign (resid  89 and name n  ) (resid  89 and name ca  )
(resid 89 and name c ) (resid 90 and name n ) 1 -33.000 15.0 2
 
 
! phi 
! 89-90 : 
assign (resid  89 and name c  ) (resid  90 and name n  )
(resid  90 and name ca  ) (resid  90 and name c  ) 1 -68.000 6.0 2
 
 
! psi
! 90-91 : 
assign (resid  90 and name n  ) (resid  90 and name ca  )
(resid 90 and name c ) (resid 91 and name n ) 1 -33.000 15.0 2
 
 
! phi 
! 90-91 : 
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(resid  91 and name ca  ) (resid  91 and name c  ) 1 -68.000 6.0 2
 
 
! psi
! 91-92 : 
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(resid 91 and name c ) (resid 92 and name n ) 1 -33.000 15.0 2
 
 
! phi 
! 91-92 : 
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(resid  92 and name ca  ) (resid  92 and name c  ) 1 -68.000 6.0 2
 
 
! psi
! 92-93 : 
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(resid 92 and name c ) (resid 93 and name n ) 1 -33.000 15.0 2
 
 
! phi 
! 92-93 : 
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(resid  93 and name ca  ) (resid  93 and name c  ) 1 -68.000 6.0 2
 
 
! psi
! 93-94 : 
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(resid 93 and name c ) (resid 94 and name n ) 1 -33.000 15.0 2
 
 



 

! phi 
! 96-97 : 
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(resid  97 and name ca  ) (resid  97 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 97-98 : 
assign (resid  97 and name n  ) (resid  97 and name ca  )
(resid 97 and name c ) (resid 98 and name n ) 1 -38.750 15.21 2
 
 
! phi 
! 97-98 : 
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(resid  98 and name ca  ) (resid  98 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 98-99 : 
assign (resid  98 and name n  ) (resid  98 and name ca  )
(resid 98 and name c ) (resid 99 and name n ) 1 -38.750 15.21 2
 
 
! phi 
! 98-99 : 
assign (resid  98 and name c  ) (resid  99 and name n  )
(resid  99 and name ca  ) (resid  99 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 99-100 : 
assign (resid  99 and name n  ) (resid  99 and name ca  )
(resid 99 and name c ) (resid 100 and name n ) 1 -38.750 15.21 2
 
 
! phi 
! 99-100 : 
assign (resid  99 and name c  ) (resid  100 and name n  )
(resid  100 and name ca  ) (resid  100 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 100-101 : 
assign (resid  100 and name n  ) (resid  100 and name ca  )
(resid 100 and name c ) (resid 101 and name n ) 1 -38.750 15.21 2
 
 
! phi 
! 100-101 : 
assign (resid  100 and name c  ) (resid  101 and name n  )
(resid  101 and name ca  ) (resid  101 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 101-102 : 
assign (resid  101 and name n  ) (resid  101 and name ca  )
(resid 101 and name c ) (resid 102 and name n ) 1 -38.750 15.21 2
 
 
! phi 
! 101-102 : 
assign (resid  101 and name c  ) (resid  102 and name n  )
(resid  102 and name ca  ) (resid  102 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 102-103 : 
assign (resid  102 and name n  ) (resid  102 and name ca  )
(resid 102 and name c ) (resid 103 and name n ) 1 -38.750 15.21 2
 
 
! phi 
! 102-103 : 
assign (resid  102 and name c  ) (resid  103 and name n  )
(resid  103 and name ca  ) (resid  103 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 103-104 : 
assign (resid  103 and name n  ) (resid  103 and name ca  )
(resid 103 and name c ) (resid 104 and name n ) 1 -38.750 15.21 2
 
 
! phi 
! 103-104 : 
assign (resid  103 and name c  ) (resid  104 and name n  )
(resid  104 and name ca  ) (resid  104 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 104-105 : 
assign (resid  104 and name n  ) (resid  104 and name ca  )
(resid 104 and name c ) (resid 105 and name n ) 1 -38.750 15.21 2
 
 
! phi 
! 104-105 : 
assign (resid  104 and name c  ) (resid  105 and name n  )
(resid  105 and name ca  ) (resid  105 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 105-106 : 
assign (resid  105 and name n  ) (resid  105 and name ca  )
(resid 105 and name c ) (resid 106 and name n ) 1 -38.750 15.21 2
 
 
! phi 
! 105-106 : 
assign (resid  105 and name c  ) (resid  106 and name n  )
(resid  106 and name ca  ) (resid  106 and name c  ) 1 -70.160 12.76 2
 
 
! psi
! 106-107 : 
assign (resid  106 and name n  ) (resid  106 and name ca  )
(resid 106 and name c ) (resid 107 and name n ) 1 -33.750 15.21 2
 

 
! phi 
! 109-110 : 
assign (resid  109 and name c  ) (resid  110 and name n  )
(resid  110 and name ca  ) (resid  110 and name c  ) 1 -74.000 20.0 2
 
 
! psi
! 110-111 : 
assign (resid  110 and name n  ) (resid  110 and name ca  )
(resid 110 and name c ) (resid 111 and name n ) 1 -33.750 15.21 2
 
 
! phi 
! 111-112 : 
assign (resid  111 and name c  ) (resid  112 and name n  )
(resid  112 and name ca  ) (resid  112 and name c  ) 1 -65.000 9.0 2
 
 
! psi
! 112-113 : 
assign (resid  112 and name n  ) (resid  112 and name ca  )
(resid 112 and name c ) (resid 113 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 112-113 : 
assign (resid  112 and name c  ) (resid  113 and name n  )
(resid  113 and name ca  ) (resid  113 and name c  ) 1 -83.000 18.0 2
 
 
! psi
! 113-114 : 
assign (resid  113 and name n  ) (resid  113 and name ca  )
(resid 113 and name c ) (resid 114 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 113-114 : 
assign (resid  113 and name c  ) (resid  114 and name n  )
(resid  114 and name ca  ) (resid  114 and name c  ) 1 -72.000 18.0 2
 
 
! psi
! 114-115 : 
assign (resid  114 and name n  ) (resid  114 and name ca  )
(resid 114 and name c ) (resid 115 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 114-115 : 
assign (resid  114 and name c  ) (resid  115 and name n  )
(resid  115 and name ca  ) (resid  115 and name c  ) 1 -65.790 7.79 2
 
 
! psi
! 115-116 : 
assign (resid  115 and name n  ) (resid  115 and name ca  )
(resid 115 and name c ) (resid 116 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 115-116 : 
assign (resid  115 and name c  ) (resid  116 and name n  )
(resid  116 and name ca  ) (resid  116 and name c  ) 1 -65.690 6.53 2
 
 
! psi
! 116-117 : 
assign (resid  116 and name n  ) (resid  116 and name ca  )
(resid 116 and name c ) (resid 117 and name n ) 1 -39.370 7.66 2
 
 
! phi 
! 116-117 : 
assign (resid  116 and name c  ) (resid  117 and name n  )
(resid  117 and name ca  ) (resid  117 and name c  ) 1 -63.100 6.21 2
 
 
! psi
! 117-118 : 
assign (resid  117 and name n  ) (resid  117 and name ca  )
(resid 117 and name c ) (resid 118 and name n ) 1 -42.830 6.57 2
 
 
! phi 
! 117-118 : 
assign (resid  117 and name c  ) (resid  118 and name n  )
(resid  118 and name ca  ) (resid  118 and name c  ) 1 -60.720 3.77 2
 
 
! psi
! 118-119 : 
assign (resid  118 and name n  ) (resid  118 and name ca  )
(resid 118 and name c ) (resid 119 and name n ) 1 -39.080 8.75 2
 
 
! phi 
! 118-119 : 
assign (resid  118 and name c  ) (resid  119 and name n  )
(resid  119 and name ca  ) (resid  119 and name c  ) 1 -65.000 6.0 2
 
 
! psi
! 119-120 : 
assign (resid  119 and name n  ) (resid  119 and name ca  )
(resid 119 and name c ) (resid 120 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 119-120 : 
assign (resid  119 and name c  ) (resid  120 and name n  )
(resid  120 and name ca  ) (resid  120 and name c  ) 1 -64.230 7.28 2
 
 
! psi
! 120-121 : 
assign (resid  120 and name n  ) (resid  120 and name ca  )
(resid 120 and name c ) (resid 121 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 120-121 : 
assign (resid  120 and name c  ) (resid  121 and name n  )
(resid  121 and name ca  ) (resid  121 and name c  ) 1 -63.500 5.6 2
 
 
! psi
! 121-122 : 
assign (resid  121 and name n  ) (resid  121 and name ca  )
(resid 121 and name c ) (resid 122 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 121-122 : 
assign (resid  121 and name c  ) (resid  122 and name n  )
(resid  122 and name ca  ) (resid  122 and name c  ) 1 -68.050 6.77 2
 
 
! psi
! 122-123 : 
assign (resid  122 and name n  ) (resid  122 and name ca  )
(resid 122 and name c ) (resid 123 and name n ) 1 -42.020 5.14 2
 
 
! phi 
! 122-123 : 
assign (resid  122 and name c  ) (resid  123 and name n  )
(resid  123 and name ca  ) (resid  123 and name c  ) 1 -64.470 5.4 2
 
 
! psi
! 123-124 : 
assign (resid  123 and name n  ) (resid  123 and name ca  )
(resid 123 and name c ) (resid 124 and name n ) 1 -41.990 8.31 2
 
 
! phi 
! 123-124 : 
assign (resid  123 and name c  ) (resid  124 and name n  )
(resid  124 and name ca  ) (resid  124 and name c  ) 1 -64.000 4.0 2
 
 
! psi
! 124-125 : 
assign (resid  124 and name n  ) (resid  124 and name ca  )
(resid 124 and name c ) (resid 125 and name n ) 1 -45.000 8.0 2
 
 
 !Short, medium range NOE
assign (resid 3 and name HN )(resid 2 and name HA ) 2.80 0.80 0.80
assign (resid 4 and name HN )(resid 3 and name HA ) 2.80 0.80 0.80
assign (resid 4 and name HN )(resid 3 and name HB2 ) 3.40 1.00 1.00
assign (resid 4 and name HN )(resid 3 and name HG2# ) 4.20 1.60 1.60
assign (resid 4 and name HN )(resid 3 and name HN ) 3.40 1.00 1.00
assign (resid 5 and name HN )(resid 4 and name HG1# ) 4.20 1.60 1.60
assign (resid 5 and name HN )(resid 4 and name HG2# ) 4.20 1.60 1.60
assign (resid 5 and name HN )(resid 4 and name HN ) 3.40 1.00 1.00
assign (resid 5 and name HN )(resid 4 and name HA ) 4.20 1.60 1.60
assign (resid 5 and name HN )(resid 3 and name HA ) 4.20 1.60 1.60
assign (resid 6 and name HN )(resid 5 and name HG# ) 4.20 1.60 1.60
assign (resid 6 and name HN )(resid 5 and name HA ) 2.80 0.80 0.80
assign (resid 6 and name HN )(resid 3 and name HA ) 3.40 1.00 1.00
assign (resid 6 and name HN )(resid 7 and name HN ) 2.80 0.80 0.80
assign (resid 9 and name HN )(resid 8 and name HA ) 3.40 1.00 1.00
assign (resid 9 and name HN )(resid 7 and name HA ) 4.20 1.60 1.60
assign (resid 9 and name HN )(resid 8 and name HB2 ) 4.20 1.60 1.60
assign (resid 9 and name HN )(resid 8 and name HD1# ) 4.20 1.60 1.60
assign (resid 9 and name HN )(resid 8 and name HG ) 4.20 1.60 1.60
assign (resid 10 and name HN )(resid 8 and name HD2# ) 4.20 1.60 1.60
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assign (resid 98 and name HN )(resid 96 and name HA ) 3.40 1.00 1.00
assign (resid 98 and name HN )(resid 97 and name HA ) 2.80 0.80 0.80
assign (resid 99 and name HN )(resid 97 and name HA ) 3.40 1.00 1.00
assign (resid 98 and name HN )(resid 97 and name HG2# ) 4.20 1.60 1.60
assign (resid 97 and name HN )(resid 98 and name HN ) 2.80 0.80 0.80
assign (resid 99 and name HN )(resid 98 and name HA ) 3.40 1.00 1.00
assign (resid 99 and name HN )(resid 98 and name HB2 ) 3.40 1.00 1.00
assign (resid 100 and name HN )(resid 98 and name HA ) 3.40 1.00 1.00
assign (resid 100 and name HN )(resid 98 and name HB2 ) 4.20 1.60 1.60
assign (resid 100 and name HN )(resid 99 and name HA ) 2.80 0.80 0.80
assign (resid 100 and name HN )(resid 99 and name HG2# ) 4.20 1.60 1.60
assign (resid 100 and name HN )(resid 99 and name HA ) 3.40 1.00 1.00
assign (resid 99 and name HN )(resid 100 and name HN ) 2.80 0.80 0.80
assign (resid 101 and name HN )(resid 98 and name HA ) 4.20 1.60 1.60
assign (resid 101 and name HN )(resid 99 and name HA ) 4.20 1.60 1.60
assign (resid 101 and name HN )(resid 100 and name HA ) 3.40 1.00 1.00
assign (resid 101 and name HN )(resid 100 and name HG ) 3.40 1.00 1.00
assign (resid 102 and name HN )(resid 98 and name HA ) 4.20 1.60 1.60
assign (resid 102 and name HN )(resid 99 and name HA ) 4.20 1.60 1.60
assign (resid 102 and name HN )(resid 100 and name HA ) 3.40 1.00 1.00
assign (resid 102 and name HN )(resid 101 and name HA ) 4.20 1.60 1.60
assign (resid 102 and name HN )(resid 101 and name HG ) 3.40 1.00 1.00
assign (resid 102 and name HN )(resid 101 and name HB2 ) 3.40 1.00 1.00
assign (resid 102 and name HN )(resid 101 and name HN ) 2.80 0.80 0.80
assign (resid 103 and name HN )(resid 100 and name HA ) 4.20 1.60 1.60
assign (resid 103 and name HN )(resid 102 and name HA ) 3.40 1.00 1.00
assign (resid 104 and name HN )(resid 100 and name HA ) 4.20 1.60 1.60
assign (resid 104 and name HN )(resid 102 and name HA ) 4.20 1.60 1.60
assign (resid 104 and name HN )(resid 103 and name HA ) 3.40 1.00 1.00
assign (resid 104 and name HN )(resid 103 and name HB2 ) 3.40 1.00 1.00
assign (resid 104 and name HN )(resid 103 and name HN ) 2.80 0.80 0.80
assign (resid 105 and name HN )(resid 102 and name HA ) 3.40 1.00 1.00
assign (resid 105 and name HN )(resid 103 and name HA ) 4.20 1.60 1.60
assign (resid 104 and name HN )(resid 105 and name HA ) 4.20 1.60 1.60
assign (resid 105 and name HN )(resid 104 and name HA ) 3.40 1.00 1.00
assign (resid 105 and name HN )(resid 104 and name HG ) 3.40 1.00 1.00
assign (resid 105 and name HN )(resid 104 and name HN ) 2.80 0.80 0.80
assign (resid 106 and name HN )(resid 103 and name HA ) 3.40 1.00 1.00
assign (resid 105 and name HN )(resid 106 and name HA ) 4.20 1.60 1.60
assign (resid 105 and name HN )(resid 106 and name HG ) 4.20 1.60 1.60
assign (resid 105 and name HN )(resid 106 and name HB2 ) 4.20 1.60 1.60
assign (resid 106 and name HN )(resid 105 and name HA ) 3.40 1.00 1.00
assign (resid 106 and name HN )(resid 102 and name HA ) 4.20 1.60 1.60
assign (resid 106 and name HN )(resid 104 and name HA ) 4.20 1.60 1.60
assign (resid 106 and name HN )(resid 105 and name HB ) 3.40 1.00 1.00
assign (resid 106 and name HN )(resid 105 and name HA ) 3.40 1.00 1.00
assign (resid 106 and name HN )(resid 105 and name HG1# ) 4.20 1.60 1.60
assign (resid 106 and name HN )(resid 105 and name HG2# ) 4.20 1.60 1.60
assign (resid 105 and name HN )(resid 106 and name HN ) 2.80 0.80 0.80
assign (resid 107 and name HN )(resid 104 and name HA ) 3.40 1.00 1.00
assign (resid 107 and name HN )(resid 103 and name HA ) 4.20 1.60 1.60
assign (resid 107 and name HN )(resid 105 and name HA ) 4.20 1.60 1.60
assign (resid 107 and name HN )(resid 106 and name HA ) 3.40 1.00 1.00
assign (resid 107 and name HN )(resid 106 and name HG ) 3.40 1.00 1.00
assign (resid 107 and name HN )(resid 106 and name HB2 ) 3.40 1.00 1.00
assign (resid 108 and name HN )(resid 104 and name HA ) 4.20 1.60 1.60
assign (resid 108 and name HN )(resid 105 and name HA ) 3.40 1.00 1.00
assign (resid 108 and name HN )(resid 106 and name HA ) 4.20 1.60 1.60
assign (resid 108 and name HN )(resid 107 and name HA ) 3.40 1.00 1.00
assign (resid 108 and name HN )(resid 107 and name HB2 ) 3.40 1.00 1.00
assign (resid 108 and name HN )(resid 107 and name HD2# ) 4.20 1.60 1.60
assign (resid 108 and name HN )(resid 107 and name HG2# ) 4.20 1.60 1.60
assign (resid 108 and name HN )(resid 107 and name HN ) 2.80 0.80 0.80
assign (resid 109 and name HN )(resid 105 and name HA ) 4.20 1.60 1.60
assign (resid 109 and name HN )(resid 105 and name HG1# ) 4.20 1.60 1.60
assign (resid 109 and name HN )(resid 105 and name HG2# ) 4.20 1.60 1.60
assign (resid 109 and name HN )(resid 106 and name HA ) 3.40 1.00 1.00
assign (resid 109 and name HN )(resid 107 and name HA ) 4.20 1.60 1.60
assign (resid 109 and name HN )(resid 107 and name HB2 ) 4.20 1.60 1.60
assign (resid 109 and name HN )(resid 108 and name HA ) 3.40 1.00 1.00
assign (resid 109 and name HN )(resid 108 and name HG ) 4.20 1.60 1.60
assign (resid 109 and name HN )(resid 108 and name HB2 ) 4.20 1.60 1.60
assign (resid 109 and name HN )(resid 108 and name HG2# ) 4.20 1.60 1.60
assign (resid 109 and name HN )(resid 108 and name HN ) 2.80 0.80 0.80
assign (resid 110 and name HN )(resid 109 and name HA ) 3.40 1.00 1.00
assign (resid 110 and name HN )(resid 109 and name HG ) 4.20 1.60 1.60
assign (resid 109 and name HN )(resid 110 and name HN ) 4.20 1.60 1.60
assign (resid 110 and name HN )(resid 106 and name HA ) 4.20 1.60 1.60
assign (resid 110 and name HN )(resid 111 and name HD# ) 4.00 1.60 1.60
assign (resid 110 and name HN )(resid 111 and name HD2# ) 4.20 1.60 1.60
assign (resid 112 and name HN )(resid 109 and name HG ) 4.20 1.60 1.60
assign (resid 112 and name HN )(resid 110 and name HA ) 4.20 1.60 1.60
assign (resid 112 and name HN )(resid 110 and name HD2# ) 4.20 1.60 1.60
assign (resid 112 and name HN )(resid 110 and name HG2# ) 4.20 1.60 1.60
assign (resid 112 and name HN )(resid 111 and name HA ) 3.40 1.00 1.00
assign (resid 112 and name HN )(resid 111 and name HG ) 4.20 1.60 1.60
assign (resid 112 and name HN )(resid 111 and name HB2 ) 4.20 1.60 1.60
assign (resid 112 and name HN )(resid 111 and name HD# ) 4.20 1.60 1.60
assign (resid 112 and name HN )(resid 111 and name HD2# ) 4.20 1.60 1.60
assign (resid 113 and name HN )(resid 109 and name HA ) 4.20 1.60 1.60
assign (resid 113 and name HN )(resid 109 and name HG ) 4.20 1.60 1.60
assign (resid 113 and name HN )(resid 110 and name HB2 ) 4.20 1.60 1.60
assign (resid 113 and name HN )(resid 110 and name HD2# ) 4.20 1.60 1.60
assign (resid 113 and name HN )(resid 110 and name HG2# ) 4.20 1.60 1.60
assign (resid 113 and name HN )(resid 111 and name HB2 ) 4.20 1.60 1.60
assign (resid 113 and name HN )(resid 112 and name HA ) 3.40 1.00 1.00
assign (resid 113 and name HN )(resid 112 and name HG# ) 4.20 1.60 1.60
assign (resid 113 and name HN )(resid 112 and name HN ) 3.40 1.00 1.00
assign (resid 114 and name HN )(resid 112 and name HA ) 4.20 1.60 1.60
assign (resid 114 and name HN )(resid 113 and name HA ) 3.40 1.00 1.00
assign (resid 114 and name HN )(resid 113 and name HB2 ) 3.40 1.00 1.00
assign (resid 113 and name HN )(resid 114 and name HN ) 3.40 1.00 1.00
assign (resid 115 and name HN )(resid 112 and name HA ) 4.20 1.60 1.60
assign (resid 115 and name HN )(resid 113 and name HB2 ) 4.20 1.60 1.60
assign (resid 115 and name HN )(resid 113 and name HA ) 4.20 1.60 1.60
assign (resid 115 and name HN )(resid 114 and name HA ) 3.40 1.00 1.00
assign (resid 115 and name HN )(resid 114 and name HG ) 4.20 1.60 1.60
assign (resid 115 and name HN )(resid 114 and name HB2 ) 4.20 1.60 1.60
assign (resid 115 and name HN )(resid 114 and name HD2# ) 4.20 1.60 1.60
assign (resid 115 and name HN )(resid 114 and name HG ) 4.20 1.60 1.60
assign (resid 116 and name HN )(resid 112 and name HA ) 4.20 1.60 1.60
assign (resid 116 and name HN )(resid 113 and name HA ) 3.40 1.00 1.00
assign (resid 116 and name HN )(resid 114 and name HA ) 4.20 1.60 1.60
assign (resid 116 and name HN )(resid 114 and name HB2 ) 4.50 1.60 1.60
assign (resid 116 and name HN )(resid 114 and name HG ) 4.20 1.60 1.60
assign (resid 116 and name HN )(resid 115 and name HA ) 3.40 1.00 1.00
assign (resid 116 and name HN )(resid 115 and name HB2 ) 3.40 1.00 1.00
assign (resid 116 and name HN )(resid 115 and name HG# ) 4.20 1.60 1.60
assign (resid 116 and name HN )(resid 115 and name HG2# ) 4.20 1.60 1.60
assign (resid 117 and name HN )(resid 114 and name HA ) 4.20 1.60 1.60
assign (resid 117 and name HN )(resid 116 and name HA ) 3.40 1.00 1.00
assign (resid 118 and name HN )(resid 117 and name HA ) 3.40 1.00 1.00
assign (resid 118 and name HN )(resid 117 and name HB2 ) 3.40 1.00 1.00
assign (resid 118 and name HN )(resid 115 and name HA ) 4.20 1.60 1.60
assign (resid 118 and name HN )(resid 116 and name HA ) 4.20 1.60 1.60
assign (resid 119 and name HN )(resid 115 and name HA ) 4.20 1.60 1.60
assign (resid 119 and name HN )(resid 117 and name HB2 ) 3.40 1.00 1.00
assign (resid 119 and name HN )(resid 116 and name HA ) 3.40 1.00 1.00
assign (resid 119 and name HN )(resid 118 and name HA ) 3.40 1.00 1.00
assign (resid 119 and name HN )(resid 118 and name HB2 ) 3.40 1.00 1.00
assign (resid 119 and name HN )(resid 118 and name HN ) 3.40 1.00 1.00
assign (resid 120 and name HN )(resid 119 and name HA ) 3.40 1.00 1.00
assign (resid 120 and name HN )(resid 119 and name HB2 ) 3.40 1.00 1.00
assign (resid 120 and name HN )(resid 119 and name HD1# ) 4.20 1.60 1.60
assign (resid 120 and name HN )(resid 119 and name HD2# ) 4.20 1.60 1.60
assign (resid 120 and name HN )(resid 119 and name HG ) 4.20 1.60 1.60
assign (resid 119 and name HN )(resid 120 and name HN ) 3.40 1.00 1.00
assign (resid 121 and name HN )(resid 118 and name HA ) 3.40 1.00 1.00
assign (resid 121 and name HN )(resid 119 and name HA ) 4.20 1.60 1.60
assign (resid 121 and name HN )(resid 119 and name HB2 ) 4.20 1.60 1.60
assign (resid 121 and name HN )(resid 119 and name HD2# ) 4.20 1.60 1.60
assign (resid 121 and name HN )(resid 119 and name HG ) 4.20 1.60 1.60
assign (resid 121 and name HN )(resid 120 and name HA ) 3.40 1.00 1.00
assign (resid 121 and name HN )(resid 120 and name HN ) 3.40 1.00 1.00
assign (resid 122 and name HN )(resid 119 and name HA ) 3.40 1.00 1.00
assign (resid 122 and name HN )(resid 120 and name HA ) 4.20 1.60 1.60
assign (resid 122 and name HN )(resid 121 and name HA ) 3.40 1.00 1.00
assign (resid 122 and name HN )(resid 121 and name HB2 ) 3.40 1.00 1.00
assign (resid 122 and name HN )(resid 121 and name HN ) 3.40 1.00 1.00
assign (resid 123 and name HN )(resid 122 and name HA ) 3.40 1.00 1.00
assign (resid 123 and name HN )(resid 119 and name HA ) 4.20 1.60 1.60
assign (resid 123 and name HN )(resid 120 and name HA ) 3.40 1.00 1.00
assign (resid 123 and name HN )(resid 121 and name HA ) 4.20 1.60 1.60
assign (resid 123 and name HN )(resid 122 and name HG2# ) 4.20 1.60 1.60
assign (resid 122 and name HN )(resid 123 and name HN ) 3.40 1.00 1.00
assign (resid 124 and name HN )(resid 121 and name HA ) 3.40 1.00 1.00
assign (resid 124 and name HN )(resid 120 and name HA ) 4.20 1.60 1.60
assign (resid 124 and name HN )(resid 122 and name HA ) 4.20 1.60 1.60
assign (resid 124 and name HN )(resid 122 and name HG1# ) 4.20 1.60 1.60
assign (resid 124 and name HN )(resid 123 and name HA ) 3.40 1.00 1.00
assign (resid 124 and name HN )(resid 123 and name HG ) 3.40 1.00 1.00
assign (resid 124 and name HN )(resid 123 and name HB2 ) 3.40 1.00 1.00
assign (resid 123 and name HN )(resid 124 and name HN ) 2.80 0.80 0.80
assign (resid 125 and name HN )(resid 122 and name HA ) 3.40 1.00 1.00
assign (resid 125 and name HN )(resid 121 and name HA ) 4.20 1.60 1.60
assign (resid 125 and name HN )(resid 123 and name HA ) 4.20 1.60 1.60
assign (resid 125 and name HN )(resid 124 and name HA ) 3.40 1.00 1.00
assign (resid 125 and name HN )(resid 124 and name HB2 ) 3.40 1.00 1.00
assign (resid 125 and name HN )(resid 124 and name HG2# ) 4.20 1.60 1.60
assign (resid 125 and name HN )(resid 124 and name HN ) 2.80 0.80 0.80

!Long Range NOE Sidechain
assign (resid 8 and name HA )(resid 32 and name HG ) 4.2 1.6 1.6  !8HA and 32HB
assign (resid 32 and name HG )(resid 7 and name HG ) 4.2 1.6 1.6 !32HB and 7HB
assign (resid 32 and name HG )(resid 9 and name HG ) 4.2 1.6 1.6 !32HB and 9HB

!Confirmed Long Range NOE  20130619
assign (resid 60 and name HD# )(resid 36 and name HB# ) 4.2 1.6 1.6 !60HD and 36HB
assign (resid 60 and name HD# )(resid 37 and name HB# ) 4.2 1.6 1.6 !60HD and 37HB
assign (resid 60 and name HD# )(resid 39 and name HB# ) 4.2 1.6 1.6  !60HD and 39 HB
assign (resid 10 and name HB# )(resid 13 and name HA ) 4.2 1.6 1.6  !10HB and 13HA
assign (resid 10 and name HG# )(resid 13 and name HA ) 4.2 1.6 1.6  !10HG and 13 HA
assign (resid 106 and name HA )(resid 109 and name HB# ) 4.2 1.6 1.6  !106HA and 109HB
assign (resid 123 and name HB# )(resid 120 and name HA ) 4.2 1.6 1.6  !123HB and 120HA


!PRE distances 20130614
!Q6C     
assign (resid 6 and name HE# )(resid  2 and name HN ) 14.70964471 5.0 5.0
assign (resid 6 and name HE# )(resid  13 and name HN ) 20.889804910 5.0 5.0
assign (resid 6 and name HE# )(resid  15 and name HN ) 20.77276161 5.0 5.0
assign (resid 6 and name HE# )(resid  16 and name HN ) 19.3914426 5.0 5.0
assign (resid 6 and name HE# )(resid  17 and name HN ) 20.25399962 5.0 5.0
assign (resid 6 and name HE# )(resid  20 and name HN ) 20.81365275 5.0 5.0
assign (resid 6 and name HE# )(resid  22 and name HN ) 19.50934913 5.0 5.0
assign (resid 6 and name HE# )(resid  23 and name HN ) 18.98400777 5.0 5.0
assign (resid 6 and name HE# )(resid  26 and name HN ) 20.45287671 5.0 5.0
assign (resid 6 and name HE# )(resid  32 and name HN ) 21.02153821 5.0 5.0
assign (resid 6 and name HE# )(resid  33 and name HN ) 19.44068198 5.0 5.0
assign (resid 6 and name HE# )(resid  34 and name HN ) 23.05004603 5.0 5.0
assign (resid 6 and name HE# )(resid  36 and name HN ) 23.59990691 5.0 5.0
assign (resid 6 and name HE# )(resid  38 and name HN ) 24.09039466 5.0 5.0
assign (resid 6 and name HE# )(resid  43 and name HN ) 24.52117797 5.0 5.0
assign (resid 6 and name HE# )(resid  48 and name HN ) 24.22651066 5.0 5.0
assign (resid 6 and name HE# )(resid  53 and name HN ) 22.67110374 5.0 5.0
assign (resid 6 and name HE# )(resid  55 and name HN ) 20.95383377 5.0 5.0
assign (resid 6 and name HE# )(resid  56 and name HN ) 23.92602507 5.0 5.0
assign (resid 6 and name HE# )(resid  57 and name HN ) 21.50947578 5.0 5.0
assign (resid 6 and name HE# )(resid  58 and name HN ) 26.07725164 5.0 5.0
assign (resid 6 and name HE# )(resid  59 and name HN ) 25.74986698 5.0 5.0
assign (resid 6 and name HE# )(resid  60 and name HN ) 22.26314464 5.0 5.0
assign (resid 6 and name HE# )(resid  62 and name HN ) 24.755684310 5.0 5.0
assign (resid 6 and name HE# )(resid  63 and name HN ) 23.02328621 5.0 5.0
assign (resid 6 and name HE# )(resid  64 and name HN ) 23.15838461 5.0 5.0
assign (resid 6 and name HE# )(resid  65 and name HN ) 23.21619256 5.0 5.0
assign (resid 6 and name HE# )(resid  66 and name HN ) 24.63505194 5.0 5.0
assign (resid 6 and name HE# )(resid  68 and name HN ) 21.15717493 5.0 5.0
assign (resid 6 and name HE# )(resid  74 and name HN ) 21.22868466 5.0 5.0
assign (resid 6 and name HE# )(resid  76 and name HN ) 18.52375337 5.0 5.0
assign (resid 6 and name HE# )(resid  78 and name HN ) 22.55793873 5.0 5.0
assign (resid 6 and name HE# )(resid  79 and name HN ) 23.60094610 5.0 5.0
assign (resid 6 and name HE# )(resid  84 and name HN ) 25.45493831 5.0 5.0
assign (resid 6 and name HE# )(resid  86 and name HN ) 23.76923581 5.0 5.0
assign (resid 6 and name HE# )(resid  87 and name HN ) 20.29417266 5.0 5.0
assign (resid 6 and name HE# )(resid  88 and name HN ) 20.55675264 5.0 5.0
assign (resid 6 and name HE# )(resid  89 and name HN ) 20.28842817 5.0 5.0
assign (resid 6 and name HE# )(resid  90 and name HN ) 20.09508058 5.0 5.0
assign (resid 6 and name HE# )(resid  91 and name HN ) 21.84751497 5.0 5.0
assign (resid 6 and name HE# )(resid  92 and name HN ) 22.52630967 5.0 5.0
assign (resid 6 and name HE# )(resid  93 and name HN ) 18.73073427 5.0 5.0
assign (resid 6 and name HE# )(resid  95 and name HN ) 19.78924033 5.0 5.0
assign (resid 6 and name HE# )(resid  97 and name HN ) 18.58637707 5.0 5.0
assign (resid 6 and name HE# )(resid  98 and name HN ) 20.46815955 5.0 5.0
assign (resid 6 and name HE# )(resid  99 and name HN ) 20.04093587 5.0 5.0
assign (resid 6 and name HE# )(resid  100 and name HN ) 21.222109410 5.0 5.0
assign (resid 6 and name HE# )(resid  101 and name HN ) 18.86112007 5.0 5.0
assign (resid 6 and name HE# )(resid  102 and name HN ) 18.24416697 5.0 5.0
assign (resid 6 and name HE# )(resid  103 and name HN ) 19.86184987 5.0 5.0
assign (resid 6 and name HE# )(resid  104 and name HN ) 18.88926287 5.0 5.0
assign (resid 6 and name HE# )(resid  105 and name HN ) 17.83674214 5.0 5.0
assign (resid 6 and name HE# )(resid  106 and name HN ) 19.33225688 5.0 5.0
assign (resid 6 and name HE# )(resid  107 and name HN ) 19.63797041 5.0 5.0
assign (resid 6 and name HE# )(resid  108 and name HN ) 20.33397702 5.0 5.0
assign (resid 6 and name HE# )(resid  109 and name HN ) 19.94621897 5.0 5.0
assign (resid 6 and name HE# )(resid  112 and name HN ) 20.62955635 5.0 5.0
assign (resid 6 and name HE# )(resid  113 and name HN ) 18.68845793 5.0 5.0
assign (resid 6 and name HE# )(resid  114 and name HN ) 22.87600378 5.0 5.0
assign (resid 6 and name HE# )(resid  115 and name HN ) 18.79638936 5.0 5.0
assign (resid 6 and name HE# )(resid  117 and name HN ) 21.05443405 5.0 5.0
assign (resid 6 and name HE# )(resid  118 and name HN ) 19.07497643 5.0 5.0
assign (resid 6 and name HE# )(resid  124 and name HN ) 21.69684111 5.0 5.0

!D24C     
assign (resid 24 and name OD# )(resid  2 and name HN ) 15.39382626 5.0 5.0
assign (resid 24 and name OD# )(resid  3 and name HN ) 18.71324895 5.0 5.0
assign (resid 24 and name OD# )(resid  4 and name HN ) 15.682977810 5.0 5.0
assign (resid 24 and name OD# )(resid  5 and name HN ) 16.7275294 5.0 5.0
assign (resid 24 and name OD# )(resid  9 and name HN ) 15.81033242 5.0 5.0
assign (resid 24 and name OD# )(resid  10 and name HN ) 16.55343295 5.0 5.0
assign (resid 24 and name OD# )(resid  11 and name HN ) 16.02736832 5.0 5.0
assign (resid 24 and name OD# )(resid  14 and name HN ) 18.57811246 5.0 5.0
assign (resid 24 and name OD# )(resid  15 and name HN ) 16.637967010 5.0 5.0
assign (resid 24 and name OD# )(resid  16 and name HN ) 14.903293510 5.0 5.0
assign (resid 24 and name OD# )(resid  17 and name HN ) 15.05647798 5.0 5.0
assign (resid 24 and name OD# )(resid  32 and name HN ) 17.28257438 5.0 5.0
assign (resid 24 and name OD# )(resid  34 and name HN ) 17.41619123 5.0 5.0
assign (resid 24 and name OD# )(resid  36 and name HN ) 16.64316843 5.0 5.0
assign (resid 24 and name OD# )(resid  38 and name HN ) 17.70735987 5.0 5.0
assign (resid 24 and name OD# )(resid  39 and name HN ) 18.11486311 5.0 5.0
assign (resid 24 and name OD# )(resid  43 and name HN ) 15.51787367 5.0 5.0
assign (resid 24 and name OD# )(resid  45 and name HN ) 15.761127810 5.0 5.0
assign (resid 24 and name OD# )(resid  46 and name HN ) 20.76365597 5.0 5.0
assign (resid 24 and name OD# )(resid  47 and name HN ) 17.12158474 5.0 5.0
assign (resid 24 and name OD# )(resid  48 and name HN ) 16.04683643 5.0 5.0
assign (resid 24 and name OD# )(resid  53 and name HN ) 17.56397004 5.0 5.0
assign (resid 24 and name OD# )(resid  54 and name HN ) 16.24720225 5.0 5.0
assign (resid 24 and name OD# )(resid  55 and name HN ) 16.18350586 5.0 5.0
assign (resid 24 and name OD# )(resid  56 and name HN ) 17.53253981 5.0 5.0
assign (resid 24 and name OD# )(resid  57 and name HN ) 17.802452510 5.0 5.0
assign (resid 24 and name OD# )(resid  58 and name HN ) 19.37471388 5.0 5.0
assign (resid 24 and name OD# )(resid  59 and name HN ) 18.7295933 5.0 5.0
assign (resid 24 and name OD# )(resid  60 and name HN ) 16.0612587 5.0 5.0
assign (resid 24 and name OD# )(resid  62 and name HN ) 19.44174498 5.0 5.0
assign (resid 24 and name OD# )(resid  63 and name HN ) 17.78356804 5.0 5.0
assign (resid 24 and name OD# )(resid  64 and name HN ) 17.65569882 5.0 5.0
assign (resid 24 and name OD# )(resid  65 and name HN ) 17.05455995 5.0 5.0
assign (resid 24 and name OD# )(resid  66 and name HN ) 17.60931096 5.0 5.0
assign (resid 24 and name OD# )(resid  67 and name HN ) 17.67541075 5.0 5.0
assign (resid 24 and name OD# )(resid  68 and name HN ) 16.11045164 5.0 5.0
assign (resid 24 and name OD# )(resid  69 and name HN ) 17.62146836 5.0 5.0
assign (resid 24 and name OD# )(resid  76 and name HN ) 14.46337597 5.0 5.0
assign (resid 24 and name OD# )(resid  78 and name HN ) 18.51357901 5.0 5.0
assign (resid 24 and name OD# )(resid  79 and name HN ) 19.11925256 5.0 5.0
assign (resid 24 and name OD# )(resid  81 and name HN ) 19.84546893 5.0 5.0
assign (resid 24 and name OD# )(resid  82 and name HN ) 19.90354766 5.0 5.0
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!M102C     
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assign (resid 102 and name HE# )(resid  20 and name HN ) 20.450834610 5.0 5.0
assign (resid 102 and name HE# )(resid  22 and name HN ) 18.38167618 5.0 5.0
assign (resid 102 and name HE# )(resid  23 and name HN ) 18.47223291 5.0 5.0
assign (resid 102 and name HE# )(resid  26 and name HN ) 19.09232918 5.0 5.0
assign (resid 102 and name HE# )(resid  27 and name HN ) 16.24241523 5.0 5.0
assign (resid 102 and name HE# )(resid  30 and name HN ) 15.1321314 5.0 5.0
assign (resid 102 and name HE# )(resid  32 and name HN ) 17.09507077 5.0 5.0
assign (resid 102 and name HE# )(resid  33 and name HN ) 17.23692951 5.0 5.0
assign (resid 102 and name HE# )(resid  34 and name HN ) 21.78627664 5.0 5.0
assign (resid 102 and name HE# )(resid  36 and name HN ) 20.7844277 5.0 5.0
assign (resid 102 and name HE# )(resid  37 and name HN ) 18.22649326 5.0 5.0
assign (resid 102 and name HE# )(resid  38 and name HN ) 22.375375110 5.0 5.0
assign (resid 102 and name HE# )(resid  39 and name HN ) 21.95469914 5.0 5.0
assign (resid 102 and name HE# )(resid  42 and name HN ) 19.617654210 5.0 5.0
assign (resid 102 and name HE# )(resid  43 and name HN ) 20.981478810 5.0 5.0
assign (resid 102 and name HE# )(resid  44 and name HN ) 18.84080583 5.0 5.0
assign (resid 102 and name HE# )(resid  45 and name HN ) 16.46002295 5.0 5.0
assign (resid 102 and name HE# )(resid  46 and name HN ) 19.91913732 5.0 5.0
assign (resid 102 and name HE# )(resid  47 and name HN ) 19.909064210 5.0 5.0
assign (resid 102 and name HE# )(resid  48 and name HN ) 20.07510436 5.0 5.0
assign (resid 102 and name HE# )(resid  53 and name HN ) 18.02204678 5.0 5.0
assign (resid 102 and name HE# )(resid  55 and name HN ) 16.23924444 5.0 5.0
assign (resid 102 and name HE# )(resid  56 and name HN ) 19.06020931 5.0 5.0
assign (resid 102 and name HE# )(resid  57 and name HN ) 19.35330061 5.0 5.0
assign (resid 102 and name HE# )(resid  58 and name HN ) 20.78828733 5.0 5.0
assign (resid 102 and name HE# )(resid  59 and name HN ) 19.3774746 5.0 5.0
assign (resid 102 and name HE# )(resid  60 and name HN ) 18.84382043 5.0 5.0
assign (resid 102 and name HE# )(resid  62 and name HN ) 16.33288961 5.0 5.0
assign (resid 102 and name HE# )(resid  63 and name HN ) 17.632586610 5.0 5.0
assign (resid 102 and name HE# )(resid  64 and name HN ) 17.50978285 5.0 5.0
assign (resid 102 and name HE# )(resid  65 and name HN ) 16.96209516 5.0 5.0
assign (resid 102 and name HE# )(resid  66 and name HN ) 16.65869203 5.0 5.0
assign (resid 102 and name HE# )(resid  67 and name HN ) 14.62937083 5.0 5.0
assign (resid 102 and name HE# )(resid  70 and name HN ) 13.08554082 5.0 5.0
assign (resid 102 and name HE# )(resid  71 and name HN ) 16.7286792 5.0 5.0
assign (resid 102 and name HE# )(resid  78 and name HN ) 15.81498494 5.0 5.0
assign (resid 102 and name HE# )(resid  79 and name HN ) 17.20431557 5.0 5.0
assign (resid 102 and name HE# )(resid  81 and name HN ) 19.49544984 5.0 5.0
assign (resid 102 and name HE# )(resid  82 and name HN ) 20.44155246 5.0 5.0
assign (resid 102 and name HE# )(resid  84 and name HN ) 16.58872622 5.0 5.0
assign (resid 102 and name HE# )(resid  85 and name HN ) 19.1930413 5.0 5.0
assign (resid 102 and name HE# )(resid  86 and name HN ) 18.40813257 5.0 5.0
assign (resid 102 and name HE# )(resid  95 and name HN ) 15.64329807 5.0 5.0
assign (resid 102 and name HE# )(resid  108 and name HN ) 14.866456110 5.0 5.0
assign (resid 102 and name HE# )(resid  110 and name HN ) 19.41539461 5.0 5.0
assign (resid 102 and name HE# )(resid  113 and name HN ) 16.2220258 5.0 5.0
assign (resid 102 and name HE# )(resid  114 and name HN ) 18.06353565 5.0 5.0
assign (resid 102 and name HE# )(resid  116 and name HN ) 16.71458692 5.0 5.0
assign (resid 102 and name HE# )(resid  117 and name HN ) 16.86049887 5.0 5.0
assign (resid 102 and name HE# )(resid  119 and name HN ) 16.38017383 5.0 5.0
assign (resid 102 and name HE# )(resid  120 and name HN ) 16.90180521 5.0 5.0
assign (resid 102 and name HE# )(resid  124 and name HN ) 17.95236893 5.0 5.0
assign (resid 102 and name HE# )(resid  14 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  15 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  68 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  69 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  76 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  88 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  89 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  90 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  91 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  92 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  93 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  94 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  97 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  109 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  112 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  118 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  122 and name HN ) 10 5.0 5.0
assign (resid 102 and name HE# )(resid  123 and name HN ) 10 5.0 5.0


!C121     
assign (resid 121 and name HG )(resid  2 and name HN ) 22.12155222 5 5
assign (resid 121 and name HG )(resid  4 and name HN ) 21.6476849 5 5
assign (resid 121 and name HG )(resid  30 and name HN ) 23.56047139 5 5
assign (resid 121 and name HG )(resid  60 and name HN ) 21.57104275 5 5
assign (resid 121 and name HG )(resid  63 and name HN ) 22.73079201 5 5
assign (resid 121 and name HG )(resid  64 and name HN ) 23.97187055 5 5
assign (resid 121 and name HG )(resid  65 and name HN ) 23.46964963 5 5
assign (resid 121 and name HG )(resid  66 and name HN ) 22.90672763 5 5
assign (resid 121 and name HG )(resid  67 and name HN ) 21.15448676 5 5
assign (resid 121 and name HG )(resid  68 and name HN ) 18.93654806 5 5
assign (resid 121 and name HG )(resid  69 and name HN ) 21.62527403 5 5
assign (resid 121 and name HG )(resid  70 and name HN ) 20.67880978 5 5

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1 -12.904  11.074   2.417
    2    H2   MET   1           HT2      MET   1 -11.999  12.214   1.509
    3    H3   MET   1           HT3      MET   1 -11.267  10.750   2.027
    4    HA   MET   1           HA       MET   1 -12.501   9.476   0.583
    5    HB2  MET   1           HB2      MET   1 -14.350  10.462  -0.743
    6    HB3  MET   1           HB1      MET   1 -14.652  10.517   0.989
    7    HG2  MET   1           HG2      MET   1 -14.001  12.865   1.037
    8    HG3  MET   1           HG1      MET   1 -13.678  12.814  -0.696
    9    HE1  MET   1           HE1      MET   1 -15.213  15.047  -0.390
   10    HE2  MET   1           HE2      MET   1 -15.924  14.716   1.190
   11    HE3  MET   1           HE3      MET   1 -16.966  14.993  -0.206
   12    H    ALA   2           HN       ALA   2 -12.672   9.715  -1.938
   13    HA   ALA   2           HA       ALA   2 -11.066  11.774  -3.120
   14    HB1  ALA   2           HB1      ALA   2  -9.266  10.487  -2.176
   15    HB2  ALA   2           HB2      ALA   2  -9.275  10.264  -3.926
   16    HB3  ALA   2           HB3      ALA   2  -9.912   9.001  -2.871
   17    H    LYS   3           HN       LYS   3 -10.406  10.874  -5.485
   18    HA   LYS   3           HA       LYS   3 -12.799  10.607  -6.893
   19    HB2  LYS   3           HB2      LYS   3 -10.145   9.663  -7.959
   20    HB3  LYS   3           HB1      LYS   3 -11.487  10.369  -8.848
   21    HG2  LYS   3           HG2      LYS   3 -10.577  12.373  -8.652
   22    HG3  LYS   3           HG1      LYS   3 -10.648  12.247  -6.894
   23    HD2  LYS   3           HD2      LYS   3  -8.494  10.683  -7.462
   24    HD3  LYS   3           HD1      LYS   3  -8.377  11.911  -8.724
   25    HE2  LYS   3           HE2      LYS   3  -8.998  13.171  -6.233
   26    HE3  LYS   3           HE1      LYS   3  -7.607  12.111  -6.016
   27    HZ1  LYS   3           HZ1      LYS   3  -6.878  14.288  -6.671
   28    HZ2  LYS   3           HZ2      LYS   3  -7.877  14.270  -8.037
   29    HZ3  LYS   3           HZ3      LYS   3  -6.566  13.206  -7.934
   30    H    VAL   4           HN       VAL   4 -14.019   8.906  -6.049
   31    HA   VAL   4           HA       VAL   4 -13.221   6.309  -5.569
   32    HB   VAL   4           HB       VAL   4 -15.902   7.072  -6.722
   33   HG11  VAL   4          HG11      VAL   4 -16.616   5.174  -5.174
   34   HG12  VAL   4          HG12      VAL   4 -14.906   4.750  -5.098
   35   HG13  VAL   4          HG13      VAL   4 -15.751   4.730  -6.646
   36   HG21  VAL   4          HG21      VAL   4 -14.796   7.370  -3.949
   37   HG22  VAL   4          HG22      VAL   4 -16.527   7.201  -4.238
   38   HG23  VAL   4          HG23      VAL   4 -15.645   8.559  -4.937
   39    H    GLU   5           HN       GLU   5 -14.125   7.811  -8.623
   40    HA   GLU   5           HA       GLU   5 -14.022   5.315 -10.056
   41    HB2  GLU   5           HB2      GLU   5 -15.593   7.096 -10.690
   42    HB3  GLU   5           HB1      GLU   5 -14.237   8.140 -11.097
   43    HG2  GLU   5           HG2      GLU   5 -14.923   7.313 -13.146
   44    HG3  GLU   5           HG1      GLU   5 -13.554   6.282 -12.727
   45    H    GLN   6           HN       GLN   6 -12.011   8.291 -10.050
   46    HA   GLN   6           HA       GLN   6 -10.166   7.267 -11.946
   47    HB2  GLN   6           HB2      GLN   6 -10.683   9.723 -11.015
   48    HB3  GLN   6           HB1      GLN   6  -9.280   9.354 -10.026
   49    HG2  GLN   6           HG2      GLN   6  -8.498   8.619 -12.576
   50    HG3  GLN   6           HG1      GLN   6  -9.445  10.086 -12.825
   51   HE21  GLN   6          1HE2      GLN   6  -8.093  11.764 -13.021
   52   HE22  GLN   6          2HE2      GLN   6  -6.712  12.067 -12.027
   53    H    VAL   7           HN       VAL   7  -9.797   7.706  -8.399
   54    HA   VAL   7           HA       VAL   7  -7.314   6.231  -8.499
   55    HB   VAL   7           HB       VAL   7  -7.314   8.170  -7.115
   56   HG11  VAL   7          HG11      VAL   7  -9.636   6.890  -5.725
   57   HG12  VAL   7          HG12      VAL   7  -9.519   8.500  -6.428
   58   HG13  VAL   7          HG13      VAL   7  -8.646   8.119  -4.946
   59   HG21  VAL   7          HG21      VAL   7  -5.888   6.338  -6.418
   60   HG22  VAL   7          HG22      VAL   7  -7.198   5.661  -5.448
   61   HG23  VAL   7          HG23      VAL   7  -6.490   7.216  -5.011
   62    H    LEU   8           HN       LEU   8 -10.433   5.714  -6.834
   63    HA   LEU   8           HA       LEU   8  -9.557   3.292  -5.640
   64    HB2  LEU   8           HB2      LEU   8 -12.198   4.665  -5.857
   65    HB3  LEU   8           HB1      LEU   8 -12.082   3.057  -5.169
   66    HG   LEU   8           HG       LEU   8 -10.156   4.320  -3.747
   67   HD11  LEU   8          HD11      LEU   8 -10.377   6.529  -3.600
   68   HD12  LEU   8          HD12      LEU   8 -12.133   6.426  -3.469
   69   HD13  LEU   8          HD13      LEU   8 -11.366   6.426  -5.056
   70   HD21  LEU   8          HD21      LEU   8 -13.096   4.006  -3.242
   71   HD22  LEU   8          HD22      LEU   8 -12.006   4.654  -2.016
   72   HD23  LEU   8          HD23      LEU   8 -11.760   3.023  -2.643
   73    H    SER   9           HN       SER   9 -10.966   3.867  -8.763
   74    HA   SER   9           HA       SER   9 -12.248   1.380  -9.080
   75    HB2  SER   9           HB2      SER   9 -11.090   3.266 -11.128
   76    HB3  SER   9           HB1      SER   9 -12.100   1.870 -11.519
   77    HG   SER   9           HG       SER   9 -13.249   3.336  -9.558
   78    H    LEU  10           HN       LEU  10 -10.634   0.079  -8.005
   79    HA   LEU  10           HA       LEU  10  -8.192  -0.600  -9.373
   80    HB2  LEU  10           HB2      LEU  10  -7.537  -1.679  -7.500
   81    HB3  LEU  10           HB1      LEU  10  -8.689  -0.555  -6.799
   82    HG   LEU  10           HG       LEU  10  -9.274  -3.443  -7.475
   83   HD11  LEU  10          HD11      LEU  10  -8.177  -3.913  -5.600
   84   HD12  LEU  10          HD12      LEU  10  -9.474  -3.088  -4.736
   85   HD13  LEU  10          HD13      LEU  10  -8.010  -2.210  -5.179
   86   HD21  LEU  10          HD21      LEU  10 -11.362  -2.548  -7.504
   87   HD22  LEU  10          HD22      LEU  10 -10.912  -1.175  -6.491
   88   HD23  LEU  10          HD23      LEU  10 -11.192  -2.755  -5.760
   89    H    GLU  11           HN       GLU  11 -11.403  -1.691  -9.626
   90    HA   GLU  11           HA       GLU  11 -11.057  -4.429  -9.863
   91    HB2  GLU  11           HB2      GLU  11 -13.120  -4.352 -11.331
   92    HB3  GLU  11           HB1      GLU  11 -13.269  -3.631  -9.736
   93    HG2  GLU  11           HG2      GLU  11 -12.617  -1.438 -11.056
   94    HG3  GLU  11           HG1      GLU  11 -13.279  -2.351 -12.411
   95    HA   PRO  12           HA       PRO  12 -10.188  -3.823 -14.616
   96    HB2  PRO  12           HB2      PRO  12  -8.542  -1.671 -15.098
   97    HB3  PRO  12           HB1      PRO  12 -10.285  -1.655 -15.385
   98    HG2  PRO  12           HG2      PRO  12  -8.735  -0.584 -13.064
   99    HG3  PRO  12           HG1      PRO  12 -10.131   0.120 -13.901
  100    HD2  PRO  12           HD2      PRO  12 -10.374  -1.127 -11.535
  101    HD3  PRO  12           HD1      PRO  12 -11.641  -1.215 -12.773
  102    H    GLN  13           HN       GLN  13  -8.970  -5.610 -13.782
  103    HA   GLN  13           HA       GLN  13  -6.610  -5.362 -12.308
  104    HB2  GLN  13           HB2      GLN  13  -7.395  -7.625 -14.156
  105    HB3  GLN  13           HB1      GLN  13  -6.231  -7.710 -12.840
  106    HG2  GLN  13           HG2      GLN  13  -7.819  -8.027 -11.316
  107    HG3  GLN  13           HG1      GLN  13  -8.826  -6.737 -11.972
  108   HE21  GLN  13          1HE2      GLN  13 -10.467  -8.392 -11.286
  109   HE22  GLN  13          2HE2      GLN  13 -10.946  -9.557 -12.468
  110    H    HIS  14           HN       HIS  14  -7.097  -4.794 -15.666
  111    HA   HIS  14           HA       HIS  14  -4.896  -5.618 -16.977
  112    HB2  HIS  14           HB2      HIS  14  -6.411  -3.055 -17.104
  113    HB3  HIS  14           HB1      HIS  14  -4.953  -3.226 -18.071
  114    HD1  HIS  14           HD1      HIS  14  -7.955  -3.024 -19.159
  115    HD2  HIS  14           HD2      HIS  14  -5.654  -6.469 -18.835
  116    HE1  HIS  14           HE1      HIS  14  -8.925  -4.640 -20.824
  117    HE2  HIS  14           HE2      HIS  14  -7.556  -6.739 -20.566
  118    H    GLU  15           HN       GLU  15  -2.866  -5.686 -16.427
  119    HA   GLU  15           HA       GLU  15  -0.763  -5.086 -15.811
  120    HB2  GLU  15           HB2      GLU  15  -1.692  -2.222 -15.780
  121    HB3  GLU  15           HB1      GLU  15  -0.063  -2.829 -16.048
  122    HG2  GLU  15           HG2      GLU  15  -2.392  -3.265 -17.903
  123    HG3  GLU  15           HG1      GLU  15  -1.152  -2.028 -18.102
  124    H    LEU  16           HN       LEU  16  -0.509  -5.908 -13.823
  125    HA   LEU  16           HA       LEU  16   0.157  -4.571 -11.628
  126    HB2  LEU  16           HB2      LEU  16  -1.851  -4.605 -10.122
  127    HB3  LEU  16           HB1      LEU  16  -1.885  -3.390 -11.382
  128    HG   LEU  16           HG       LEU  16  -3.177  -5.631 -12.470
  129   HD11  LEU  16          HD11      LEU  16  -3.792  -5.235  -9.573
  130   HD12  LEU  16          HD12      LEU  16  -3.614  -6.734 -10.488
  131   HD13  LEU  16          HD13      LEU  16  -5.059  -5.742 -10.691
  132   HD21  LEU  16          HD21      LEU  16  -3.860  -2.888 -11.617
  133   HD22  LEU  16          HD22      LEU  16  -5.211  -3.998 -11.846
  134   HD23  LEU  16          HD23      LEU  16  -4.092  -3.685 -13.173
  135    H    LYS  17           HN       LYS  17   1.320  -6.199 -10.815
  136    HA   LYS  17           HA       LYS  17   1.904  -8.224  -9.968
  137    HB2  LYS  17           HB2      LYS  17  -0.731  -7.649  -8.965
  138    HB3  LYS  17           HB1      LYS  17  -0.552  -9.382  -9.198
  139    HG2  LYS  17           HG2      LYS  17   0.306  -9.311  -7.128
  140    HG3  LYS  17           HG1      LYS  17   1.780  -8.824  -7.969
  141    HD2  LYS  17           HD2      LYS  17   1.074  -6.446  -7.663
  142    HD3  LYS  17           HD1      LYS  17  -0.258  -7.026  -6.661
  143    HE2  LYS  17           HE2      LYS  17   1.101  -7.033  -4.906
  144    HE3  LYS  17           HE1      LYS  17   2.089  -8.260  -5.698
  145    HZ1  LYS  17           HZ1      LYS  17   3.616  -6.740  -6.355
  146    HZ2  LYS  17           HZ2      LYS  17   3.060  -5.930  -4.979
  147    HZ3  LYS  17           HZ3      LYS  17   2.493  -5.484  -6.508
  148    H    PHE  18           HN       PHE  18  -1.326  -9.229 -11.010
  149    HA   PHE  18           HA       PHE  18  -0.575 -10.382 -13.466
  150    HB2  PHE  18           HB2      PHE  18   0.686 -11.895 -11.907
  151    HB3  PHE  18           HB1      PHE  18  -0.857 -12.383 -11.213
  152    HD1  PHE  18           HD1      PHE  18  -2.624 -13.245 -12.972
  153    HD2  PHE  18           HD2      PHE  18   1.587 -13.166 -13.591
  154    HE1  PHE  18           HE1      PHE  18  -2.849 -14.980 -14.700
  155    HE2  PHE  18           HE2      PHE  18   1.369 -14.902 -15.320
  156    HZ   PHE  18           HZ       PHE  18  -0.852 -15.812 -15.877
  157    H    ARG  19           HN       ARG  19  -2.628 -10.925 -10.628
  158    HA   ARG  19           HA       ARG  19  -5.000 -10.556 -12.281
  159    HB2  ARG  19           HB2      ARG  19  -4.171 -13.111 -11.728
  160    HB3  ARG  19           HB1      ARG  19  -5.269 -12.796 -10.392
  161    HG2  ARG  19           HG2      ARG  19  -6.883 -13.450 -11.775
  162    HG3  ARG  19           HG1      ARG  19  -6.685 -11.879 -12.553
  163    HD2  ARG  19           HD2      ARG  19  -5.995 -12.857 -14.423
  164    HD3  ARG  19           HD1      ARG  19  -4.700 -13.677 -13.551
  165    HE   ARG  19           HE       ARG  19  -7.156 -14.819 -14.452
  166   HH11  ARG  19          HH11      ARG  19  -4.708 -15.022 -11.974
  167   HH12  ARG  19          HH12      ARG  19  -5.011 -16.692 -11.635
  168   HH21  ARG  19          HH21      ARG  19  -7.557 -17.016 -14.008
  169   HH22  ARG  19          HH22      ARG  19  -6.628 -17.826 -12.791
  170    H    GLY  20           HN       GLY  20  -6.854 -11.344 -10.251
  171    HA2  GLY  20           HA2      GLY  20  -6.390  -9.115  -8.384
  172    HA3  GLY  20           HA1      GLY  20  -7.951  -9.833  -8.741
  173    HA   PRO  21           HA       PRO  21  -5.250 -12.259  -5.332
  174    HB2  PRO  21           HB2      PRO  21  -5.633  -9.903  -3.562
  175    HB3  PRO  21           HB1      PRO  21  -4.287 -11.040  -3.640
  176    HG2  PRO  21           HG2      PRO  21  -4.077  -8.567  -4.648
  177    HG3  PRO  21           HG1      PRO  21  -3.294  -9.956  -5.421
  178    HD2  PRO  21           HD2      PRO  21  -5.725  -8.451  -6.243
  179    HD3  PRO  21           HD1      PRO  21  -4.512  -9.274  -7.243
  180    H    PHE  22           HN       PHE  22  -6.380 -13.242  -3.579
  181    HA   PHE  22           HA       PHE  22  -9.209 -13.148  -3.879
  182    HB2  PHE  22           HB2      PHE  22  -7.267 -14.772  -2.409
  183    HB3  PHE  22           HB1      PHE  22  -8.784 -14.553  -1.545
  184    HD1  PHE  22           HD2      PHE  22  -7.350 -15.665  -4.775
  185    HD2  PHE  22           HD1      PHE  22 -10.682 -15.778  -2.132
  186    HE1  PHE  22           HE2      PHE  22  -8.382 -17.418  -6.159
  187    HE2  PHE  22           HE1      PHE  22 -11.720 -17.531  -3.510
  188    HZ   PHE  22           HZ       PHE  22 -10.571 -18.353  -5.527
  189    H    THR  23           HN       THR  23  -7.150 -12.443  -1.068
  190    HA   THR  23           HA       THR  23  -9.254 -11.249   0.423
  191    HB   THR  23           HB       THR  23  -6.411 -10.604   1.030
  192    HG1  THR  23           HG1      THR  23  -7.529 -13.201   1.204
  193   HG21  THR  23          HG21      THR  23  -7.455 -10.035   2.909
  194   HG22  THR  23          HG22      THR  23  -7.520 -11.767   3.232
  195   HG23  THR  23          HG23      THR  23  -8.901 -10.954   2.496
  196    H    ASP  24           HN       ASP  24  -6.532  -9.940  -1.418
  197    HA   ASP  24           HA       ASP  24  -6.961  -7.245  -0.790
  198    HB2  ASP  24           HB2      ASP  24  -5.747  -8.148  -3.384
  199    HB3  ASP  24           HB1      ASP  24  -5.367  -6.720  -2.429
  200    H    VAL  25           HN       VAL  25  -8.019  -9.041  -3.732
  201    HA   VAL  25           HA       VAL  25  -9.191  -6.844  -4.967
  202    HB   VAL  25           HB       VAL  25  -8.860  -9.186  -5.939
  203   HG11  VAL  25          HG11      VAL  25 -10.144 -10.382  -4.184
  204   HG12  VAL  25          HG12      VAL  25 -10.690 -10.739  -5.822
  205   HG13  VAL  25          HG13      VAL  25 -11.616  -9.636  -4.805
  206   HG21  VAL  25          HG21      VAL  25 -11.304  -7.513  -6.412
  207   HG22  VAL  25          HG22      VAL  25 -10.927  -8.918  -7.410
  208   HG23  VAL  25          HG23      VAL  25  -9.801  -7.562  -7.334
  209    H    VAL  26           HN       VAL  26 -10.713  -9.206  -2.766
  210    HA   VAL  26           HA       VAL  26 -13.192  -7.825  -2.735
  211    HB   VAL  26           HB       VAL  26 -13.805  -9.296  -0.860
  212   HG11  VAL  26          HG11      VAL  26 -13.854  -9.981  -3.317
  213   HG12  VAL  26          HG12      VAL  26 -13.940 -11.269  -2.116
  214   HG13  VAL  26          HG13      VAL  26 -12.422 -10.944  -2.953
  215   HG21  VAL  26          HG21      VAL  26 -10.887  -9.906  -0.934
  216   HG22  VAL  26          HG22      VAL  26 -12.018 -11.171  -0.457
  217   HG23  VAL  26          HG23      VAL  26 -11.953  -9.660   0.450
  218    H    THR  27           HN       THR  27 -10.577  -8.052  -0.330
  219    HA   THR  27           HA       THR  27 -11.808  -6.341   1.536
  220    HB   THR  27           HB       THR  27  -8.860  -6.893   1.178
  221    HG1  THR  27           HG1      THR  27  -9.539  -8.836   1.634
  222   HG21  THR  27          HG21      THR  27 -10.434  -5.646   3.367
  223   HG22  THR  27          HG22      THR  27  -8.831  -5.244   2.754
  224   HG23  THR  27          HG23      THR  27  -9.054  -6.665   3.775
  225    H    THR  28           HN       THR  28  -9.539  -5.699  -1.099
  226    HA   THR  28           HA       THR  28  -9.146  -2.963  -0.391
  227    HB   THR  28           HB       THR  28  -8.746  -4.228  -3.107
  228    HG1  THR  28           HG1      THR  28  -7.589  -5.262  -1.361
  229   HG21  THR  28          HG21      THR  28  -8.620  -1.839  -3.256
  230   HG22  THR  28          HG22      THR  28  -6.992  -2.511  -3.352
  231   HG23  THR  28          HG23      THR  28  -7.552  -1.768  -1.854
  232    H    ASN  29           HN       ASN  29 -11.118  -4.559  -2.869
  233    HA   ASN  29           HA       ASN  29 -12.335  -2.173  -3.791
  234    HB2  ASN  29           HB2      ASN  29 -12.210  -4.322  -5.079
  235    HB3  ASN  29           HB1      ASN  29 -13.424  -4.986  -3.991
  236   HD21  ASN  29          1HE2      ASN  29 -13.965  -4.984  -6.608
  237   HD22  ASN  29          2HE2      ASN  29 -15.161  -3.800  -6.991
  238    H    LEU  30           HN       LEU  30 -13.139  -4.516  -1.294
  239    HA   LEU  30           HA       LEU  30 -15.778  -3.529  -0.831
  240    HB2  LEU  30           HB2      LEU  30 -15.106  -5.782  -0.150
  241    HB3  LEU  30           HB1      LEU  30 -13.953  -5.108   0.985
  242    HG   LEU  30           HG       LEU  30 -16.140  -5.971   1.947
  243   HD11  LEU  30          HD11      LEU  30 -15.995  -3.149   2.754
  244   HD12  LEU  30          HD12      LEU  30 -14.466  -4.027   2.792
  245   HD13  LEU  30          HD13      LEU  30 -15.846  -4.620   3.716
  246   HD21  LEU  30          HD21      LEU  30 -18.123  -5.011   1.485
  247   HD22  LEU  30          HD22      LEU  30 -17.320  -4.541  -0.013
  248   HD23  LEU  30          HD23      LEU  30 -17.427  -3.398   1.326
  249    H    LYS  31           HN       LYS  31 -12.627  -2.917   0.622
  250    HA   LYS  31           HA       LYS  31 -13.790  -0.933   2.404
  251    HB2  LYS  31           HB2      LYS  31 -11.751  -2.739   2.730
  252    HB3  LYS  31           HB1      LYS  31 -10.877  -1.242   2.444
  253    HG2  LYS  31           HG2      LYS  31 -11.096  -1.019   4.667
  254    HG3  LYS  31           HG1      LYS  31 -12.682  -0.379   4.231
  255    HD2  LYS  31           HD2      LYS  31 -13.557  -1.952   5.546
  256    HD3  LYS  31           HD1      LYS  31 -13.061  -3.125   4.326
  257    HE2  LYS  31           HE2      LYS  31 -12.003  -4.038   6.115
  258    HE3  LYS  31           HE1      LYS  31 -10.750  -2.898   5.627
  259    HZ1  LYS  31           HZ1      LYS  31 -12.827  -2.254   7.641
  260    HZ2  LYS  31           HZ2      LYS  31 -11.416  -1.386   7.298
  261    HZ3  LYS  31           HZ3      LYS  31 -11.316  -2.899   8.047
  262    H    LEU  32           HN       LEU  32 -14.297   0.261   0.245
  263    HA   LEU  32           HA       LEU  32 -12.050   1.760  -0.823
  264    HB2  LEU  32           HB2      LEU  32 -14.972   1.570  -1.427
  265    HB3  LEU  32           HB1      LEU  32 -14.142   3.038  -1.887
  266    HG   LEU  32           HG       LEU  32 -13.308   2.083  -3.748
  267   HD11  LEU  32          HD11      LEU  32 -12.193  -0.191  -3.681
  268   HD12  LEU  32          HD12      LEU  32 -12.479  -0.179  -1.941
  269   HD13  LEU  32          HD13      LEU  32 -11.466   1.062  -2.676
  270   HD21  LEU  32          HD21      LEU  32 -14.298  -0.348  -4.151
  271   HD22  LEU  32          HD22      LEU  32 -15.286   1.107  -4.272
  272   HD23  LEU  32          HD23      LEU  32 -15.332   0.130  -2.805
  273    H    GLY  33           HN       GLY  33 -12.058   2.170   1.839
  274    HA2  GLY  33           HA2      GLY  33 -12.049   4.887   2.207
  275    HA3  GLY  33           HA1      GLY  33 -13.685   4.403   2.625
  276    H    ASN  34           HN       ASN  34 -14.070   3.708   4.666
  277    HA   ASN  34           HA       ASN  34 -12.199   3.986   6.689
  278    HB2  ASN  34           HB2      ASN  34 -14.856   3.616   6.654
  279    HB3  ASN  34           HB1      ASN  34 -14.355   1.993   7.120
  280   HD21  ASN  34          1HE2      ASN  34 -14.691   1.819   9.217
  281   HD22  ASN  34          2HE2      ASN  34 -14.190   2.952  10.421
  282    HA   PRO  35           HA       PRO  35 -10.092   0.046   5.999
  283    HB2  PRO  35           HB2      PRO  35  -7.650   0.843   6.686
  284    HB3  PRO  35           HB1      PRO  35  -8.382   1.385   5.172
  285    HG2  PRO  35           HG2      PRO  35  -7.997   2.860   7.727
  286    HG3  PRO  35           HG1      PRO  35  -7.968   3.466   6.062
  287    HD2  PRO  35           HD2      PRO  35 -10.137   3.584   7.882
  288    HD3  PRO  35           HD1      PRO  35 -10.170   3.986   6.155
  289    H    THR  36           HN       THR  36 -11.494   0.977   8.565
  290    HA   THR  36           HA       THR  36  -9.910  -0.694  10.398
  291    HB   THR  36           HB       THR  36  -9.526   1.394  11.341
  292    HG1  THR  36           HG1      THR  36 -10.605   1.327  13.210
  293   HG21  THR  36          HG21      THR  36 -11.739   2.883  11.702
  294   HG22  THR  36          HG22      THR  36 -12.107   2.135  10.148
  295   HG23  THR  36          HG23      THR  36 -10.629   3.076  10.344
  296    H    ASP  37           HN       ASP  37 -11.243  -1.462  12.281
  297    HA   ASP  37           HA       ASP  37 -13.833  -2.388  11.272
  298    HB2  ASP  37           HB2      ASP  37 -11.808  -3.465  13.163
  299    HB3  ASP  37           HB1      ASP  37 -13.494  -3.843  13.503
  300    H    ARG  38           HN       ARG  38 -12.364  -0.494  13.793
  301    HA   ARG  38           HA       ARG  38 -15.043   0.203  14.778
  302    HB2  ARG  38           HB2      ARG  38 -14.258   0.219  17.069
  303    HB3  ARG  38           HB1      ARG  38 -13.958  -1.362  16.364
  304    HG2  ARG  38           HG2      ARG  38 -11.767  -1.205  16.701
  305    HG3  ARG  38           HG1      ARG  38 -11.699   0.423  16.025
  306    HD2  ARG  38           HD2      ARG  38 -11.277   1.123  18.099
  307    HD3  ARG  38           HD1      ARG  38 -12.971   0.784  18.450
  308    HE   ARG  38           HE       ARG  38 -10.673  -0.730  19.313
  309   HH11  ARG  38          HH11      ARG  38 -14.121  -0.786  18.768
  310   HH12  ARG  38          HH12      ARG  38 -14.398  -2.094  19.865
  311   HH21  ARG  38          HH21      ARG  38 -11.039  -2.451  20.758
  312   HH22  ARG  38          HH22      ARG  38 -12.650  -3.039  20.996
  313    H    ASN  39           HN       ASN  39 -14.969   2.276  16.099
  314    HA   ASN  39           HA       ASN  39 -14.407   4.470  16.371
  315    HB2  ASN  39           HB2      ASN  39 -11.911   3.246  15.987
  316    HB3  ASN  39           HB1      ASN  39 -11.927   4.620  14.885
  317   HD21  ASN  39          1HE2      ASN  39 -12.143   6.708  15.727
  318   HD22  ASN  39          2HE2      ASN  39 -11.811   7.054  17.386
  319    H    VAL  40           HN       VAL  40 -14.219   6.472  15.099
  320    HA   VAL  40           HA       VAL  40 -14.992   6.030  12.288
  321    HB   VAL  40           HB       VAL  40 -16.885   6.812  13.638
  322   HG11  VAL  40          HG11      VAL  40 -15.063   8.273  15.035
  323   HG12  VAL  40          HG12      VAL  40 -16.809   8.509  15.104
  324   HG13  VAL  40          HG13      VAL  40 -15.825   9.514  14.042
  325   HG21  VAL  40          HG21      VAL  40 -16.290   9.241  12.080
  326   HG22  VAL  40          HG22      VAL  40 -17.668   8.144  11.995
  327   HG23  VAL  40          HG23      VAL  40 -16.150   7.716  11.206
  328    H    CYS  41           HN       CYS  41 -13.328   6.587  11.044
  329    HA   CYS  41           HA       CYS  41 -12.440   9.227  10.798
  330    HB2  CYS  41           HB2      CYS  41 -10.956   7.591  12.728
  331    HB3  CYS  41           HB1      CYS  41  -9.937   8.310  11.487
  332    HG   CYS  41           HG       CYS  41  -9.996  10.317  12.876
  333    H    PHE  42           HN       PHE  42  -9.979   8.989   9.654
  334    HA   PHE  42           HA       PHE  42 -10.384   6.938   7.577
  335    HB2  PHE  42           HB2      PHE  42 -10.840   9.381   6.934
  336    HB3  PHE  42           HB1      PHE  42  -9.100   9.610   7.053
  337    HD1  PHE  42           HD2      PHE  42 -11.026   6.720   5.719
  338    HD2  PHE  42           HD1      PHE  42  -8.385   9.949   4.880
  339    HE1  PHE  42           HE2      PHE  42 -10.764   5.901   3.413
  340    HE2  PHE  42           HE1      PHE  42  -8.119   9.138   2.573
  341    HZ   PHE  42           HZ       PHE  42  -9.308   7.111   1.837
  342    H    LYS  43           HN       LYS  43  -7.962   8.978   9.190
  343    HA   LYS  43           HA       LYS  43  -6.132   6.870   9.547
  344    HB2  LYS  43           HB2      LYS  43  -4.451   7.294   7.933
  345    HB3  LYS  43           HB1      LYS  43  -5.963   7.204   7.039
  346    HG2  LYS  43           HG2      LYS  43  -4.702   9.794   7.906
  347    HG3  LYS  43           HG1      LYS  43  -4.395   9.031   6.349
  348    HD2  LYS  43           HD2      LYS  43  -6.726   9.201   5.751
  349    HD3  LYS  43           HD1      LYS  43  -7.127   9.820   7.354
  350    HE2  LYS  43           HE2      LYS  43  -6.603  11.901   6.766
  351    HE3  LYS  43           HE1      LYS  43  -5.041  11.393   6.127
  352    HZ1  LYS  43           HZ1      LYS  43  -5.993  12.114   4.223
  353    HZ2  LYS  43           HZ2      LYS  43  -7.573  11.805   4.741
  354    HZ3  LYS  43           HZ3      LYS  43  -6.602  10.535   4.190
  355    H    VAL  44           HN       VAL  44  -4.038   7.624  10.423
  356    HA   VAL  44           HA       VAL  44  -4.235  10.403  11.399
  357    HB   VAL  44           HB       VAL  44  -3.716   7.959  13.054
  358   HG11  VAL  44          HG11      VAL  44  -2.552  10.654  13.414
  359   HG12  VAL  44          HG12      VAL  44  -1.959   9.082  13.950
  360   HG13  VAL  44          HG13      VAL  44  -3.249   9.888  14.841
  361   HG21  VAL  44          HG21      VAL  44  -5.523  10.351  13.262
  362   HG22  VAL  44          HG22      VAL  44  -5.313   9.174  14.557
  363   HG23  VAL  44          HG23      VAL  44  -5.981   8.668  13.006
  364    H    LYS  45           HN       LYS  45  -1.783   7.749  11.508
  365    HA   LYS  45           HA       LYS  45   0.132   8.541   9.868
  366    HB2  LYS  45           HB2      LYS  45   0.281  10.797  10.516
  367    HB3  LYS  45           HB1      LYS  45   0.130  10.415  12.225
  368    HG2  LYS  45           HG2      LYS  45   2.346   9.872  12.439
  369    HG3  LYS  45           HG1      LYS  45   2.515   9.433  10.739
  370    HD2  LYS  45           HD2      LYS  45   2.553  11.710  10.065
  371    HD3  LYS  45           HD1      LYS  45   2.042  12.259  11.663
  372    HE2  LYS  45           HE2      LYS  45   4.245  12.645  11.944
  373    HE3  LYS  45           HE1      LYS  45   4.286  10.922  12.317
  374    HZ1  LYS  45           HZ1      LYS  45   4.523  11.603   9.507
  375    HZ2  LYS  45           HZ2      LYS  45   5.360  10.448  10.417
  376    HZ3  LYS  45           HZ3      LYS  45   5.827  12.072  10.479
  377    H    THR  46           HN       THR  46   0.736   8.741  13.370
  378    HA   THR  46           HA       THR  46   2.750   6.831  13.424
  379    HB   THR  46           HB       THR  46   2.025   6.585  15.903
  380    HG1  THR  46           HG1      THR  46  -0.066   7.282  15.796
  381   HG21  THR  46          HG21      THR  46   3.722   8.270  14.832
  382   HG22  THR  46          HG22      THR  46   3.207   8.435  16.510
  383   HG23  THR  46          HG23      THR  46   2.481   9.447  15.261
  384    H    THR  47           HN       THR  47   2.808   4.636  14.112
  385    HA   THR  47           HA       THR  47   0.272   3.186  14.139
  386    HB   THR  47           HB       THR  47   0.767   1.765  12.379
  387    HG1  THR  47           HG1      THR  47   2.783   1.065  12.927
  388   HG21  THR  47          HG21      THR  47   1.277   2.993  10.471
  389   HG22  THR  47          HG22      THR  47   2.338   4.094  11.351
  390   HG23  THR  47          HG23      THR  47   0.592   4.179  11.581
  391    H    ALA  48           HN       ALA  48   0.820   0.729  14.537
  392    HA   ALA  48           HA       ALA  48   2.554   0.691  16.885
  393    HB1  ALA  48           HB1      ALA  48   1.454  -1.728  16.955
  394    HB2  ALA  48           HB2      ALA  48   0.255  -0.925  15.941
  395    HB3  ALA  48           HB3      ALA  48   0.615  -0.295  17.548
  396    HA   PRO  49           HA       PRO  49   5.766  -1.525  14.797
  397    HB2  PRO  49           HB2      PRO  49   6.987  -2.702  16.902
  398    HB3  PRO  49           HB1      PRO  49   7.095  -0.965  16.591
  399    HG2  PRO  49           HG2      PRO  49   5.334  -2.440  18.512
  400    HG3  PRO  49           HG1      PRO  49   6.249  -0.940  18.758
  401    HD2  PRO  49           HD2      PRO  49   3.586  -0.975  18.225
  402    HD3  PRO  49           HD1      PRO  49   4.652   0.350  17.720
  403    H    ARG  50           HN       ARG  50   4.695  -3.076  13.581
  404    HA   ARG  50           HA       ARG  50   4.188  -5.654  14.914
  405    HB2  ARG  50           HB2      ARG  50   2.815  -4.218  12.699
  406    HB3  ARG  50           HB1      ARG  50   2.883  -5.972  12.606
  407    HG2  ARG  50           HG2      ARG  50   1.392  -6.248  14.255
  408    HG3  ARG  50           HG1      ARG  50   2.052  -4.920  15.212
  409    HD2  ARG  50           HD2      ARG  50   0.989  -3.479  13.259
  410    HD3  ARG  50           HD1      ARG  50  -0.050  -4.896  13.112
  411    HE   ARG  50           HE       ARG  50   0.178  -3.944  15.806
  412   HH11  ARG  50          HH11      ARG  50  -1.503  -3.517  12.778
  413   HH12  ARG  50          HH12      ARG  50  -2.909  -2.821  13.513
  414   HH21  ARG  50          HH21      ARG  50  -1.669  -3.030  16.775
  415   HH22  ARG  50          HH22      ARG  50  -3.003  -2.545  15.783
  416    H    ARG  51           HN       ARG  51   5.710  -4.059  12.186
  417    HA   ARG  51           HA       ARG  51   7.347  -4.707  10.748
  418    HB2  ARG  51           HB2      ARG  51   8.233  -5.560  13.068
  419    HB3  ARG  51           HB1      ARG  51   7.902  -7.147  12.389
  420    HG2  ARG  51           HG2      ARG  51  10.089  -6.884  11.795
  421    HG3  ARG  51           HG1      ARG  51   9.292  -6.224  10.365
  422    HD2  ARG  51           HD2      ARG  51  10.746  -4.524  10.745
  423    HD3  ARG  51           HD1      ARG  51   9.445  -3.991  11.809
  424    HE   ARG  51           HE       ARG  51  10.963  -5.525  13.431
  425   HH11  ARG  51          HH11      ARG  51  11.714  -2.871  11.293
  426   HH12  ARG  51          HH12      ARG  51  13.048  -2.317  12.246
  427   HH21  ARG  51          HH21      ARG  51  12.718  -4.798  14.687
  428   HH22  ARG  51          HH22      ARG  51  13.620  -3.411  14.173
  429    H    TYR  52           HN       TYR  52   4.539  -5.956  10.737
  430    HA   TYR  52           HA       TYR  52   5.199  -8.130   8.863
  431    HB2  TYR  52           HB2      TYR  52   3.947  -8.535  11.235
  432    HB3  TYR  52           HB1      TYR  52   2.562  -8.255  10.186
  433    HD1  TYR  52           HD2      TYR  52   5.430 -10.454  10.856
  434    HD2  TYR  52           HD1      TYR  52   1.947  -9.848   8.488
  435    HE1  TYR  52           HE2      TYR  52   5.569 -12.780  10.068
  436    HE2  TYR  52           HE1      TYR  52   2.076 -12.173   7.693
  437    HH   TYR  52           HH       TYR  52   3.935 -13.929   7.431
  438    H    CYS  53           HN       CYS  53   3.870  -5.098   9.198
  439    HA   CYS  53           HA       CYS  53   3.139  -3.923   7.188
  440    HB2  CYS  53           HB2      CYS  53   2.958  -6.028   5.801
  441    HB3  CYS  53           HB1      CYS  53   1.414  -6.355   6.575
  442    HG   CYS  53           HG       CYS  53   0.893  -5.192   4.263
  443    H    VAL  54           HN       VAL  54   1.858  -2.351   7.849
  444    HA   VAL  54           HA       VAL  54   0.209  -2.357  10.017
  445    HB   VAL  54           HB       VAL  54  -0.972  -0.394   8.982
  446   HG11  VAL  54          HG11      VAL  54   0.851   0.219  10.259
  447   HG12  VAL  54          HG12      VAL  54   1.257   0.916   8.691
  448   HG13  VAL  54          HG13      VAL  54   2.001  -0.599   9.201
  449   HG21  VAL  54          HG21      VAL  54  -1.062  -0.519   6.730
  450   HG22  VAL  54          HG22      VAL  54   0.439  -1.437   6.614
  451   HG23  VAL  54          HG23      VAL  54   0.489   0.313   6.831
  452    H    ARG  55           HN       ARG  55  -1.356  -3.797  10.405
  453    HA   ARG  55           HA       ARG  55  -3.124  -4.690   8.288
  454    HB2  ARG  55           HB2      ARG  55  -2.112  -6.056  10.310
  455    HB3  ARG  55           HB1      ARG  55  -3.527  -5.440  11.151
  456    HG2  ARG  55           HG2      ARG  55  -4.399  -7.377  10.370
  457    HG3  ARG  55           HG1      ARG  55  -4.744  -6.351   8.977
  458    HD2  ARG  55           HD2      ARG  55  -2.409  -7.114   8.153
  459    HD3  ARG  55           HD1      ARG  55  -2.605  -8.417   9.326
  460    HE   ARG  55           HE       ARG  55  -4.126  -9.393   7.926
  461   HH11  ARG  55          HH11      ARG  55  -3.692  -6.069   6.958
  462   HH12  ARG  55          HH12      ARG  55  -4.632  -6.235   5.513
  463   HH21  ARG  55          HH21      ARG  55  -5.365  -9.614   6.028
  464   HH22  ARG  55          HH22      ARG  55  -5.585  -8.248   4.987
  465    H    SER  56           HN       SER  56  -3.423  -2.996  11.403
  466    HA   SER  56           HA       SER  56  -4.979  -1.533  12.189
  467    HB2  SER  56           HB2      SER  56  -4.563  -0.569   9.840
  468    HB3  SER  56           HB1      SER  56  -6.115  -1.285   9.417
  469    HG   SER  56           HG       SER  56  -6.754  -0.096  11.510
  470    H    ASN  57           HN       ASN  57  -5.511  -4.316  12.129
  471    HA   ASN  57           HA       ASN  57  -8.296  -4.684  11.463
  472    HB2  ASN  57           HB2      ASN  57  -6.074  -6.383  12.002
  473    HB3  ASN  57           HB1      ASN  57  -7.334  -6.770  13.170
  474   HD21  ASN  57          1HE2      ASN  57  -6.764  -6.288   9.718
  475   HD22  ASN  57          2HE2      ASN  57  -7.949  -7.426   9.184
  476    H    SER  58           HN       SER  58  -6.356  -4.028  14.285
  477    HA   SER  58           HA       SER  58  -8.331  -4.513  16.256
  478    HB2  SER  58           HB2      SER  58  -6.835  -2.963  17.643
  479    HB3  SER  58           HB1      SER  58  -6.078  -4.418  16.994
  480    HG   SER  58           HG       SER  58  -5.969  -1.862  15.747
  481    H    GLY  59           HN       GLY  59  -7.956  -2.032  13.951
  482    HA2  GLY  59           HA2      GLY  59  -9.350  -0.283  13.471
  483    HA3  GLY  59           HA1      GLY  59 -10.249  -0.592  14.968
  484    H    ILE  60           HN       ILE  60  -6.830  -0.297  14.838
  485    HA   ILE  60           HA       ILE  60  -7.011   2.238  16.251
  486    HB   ILE  60           HB       ILE  60  -4.505   0.738  15.420
  487   HG12  ILE  60          HG12      ILE  60  -4.972  -0.785  17.009
  488   HG13  ILE  60          HG11      ILE  60  -4.700   0.494  18.180
  489   HG21  ILE  60          HG21      ILE  60  -5.011   2.991  17.350
  490   HG22  ILE  60          HG22      ILE  60  -4.071   3.039  15.860
  491   HG23  ILE  60          HG23      ILE  60  -3.485   2.115  17.242
  492   HD11  ILE  60          HD11      ILE  60  -6.736  -0.359  18.824
  493   HD12  ILE  60          HD12      ILE  60  -7.273  -0.624  17.165
  494   HD13  ILE  60          HD13      ILE  60  -7.213   1.011  17.823
  495    H    ILE  61           HN       ILE  61  -8.174   2.891  14.276
  496    HA   ILE  61           HA       ILE  61  -6.995   2.886  11.750
  497    HB   ILE  61           HB       ILE  61  -9.307   3.275  11.836
  498   HG12  ILE  61          HG12      ILE  61  -7.881   4.707  10.209
  499   HG13  ILE  61          HG11      ILE  61  -9.589   5.086  10.393
  500   HG21  ILE  61          HG21      ILE  61  -8.767   5.603  13.663
  501   HG22  ILE  61          HG22      ILE  61  -9.564   4.083  14.070
  502   HG23  ILE  61          HG23      ILE  61 -10.340   5.219  12.969
  503   HD11  ILE  61          HD11      ILE  61  -7.203   6.644  11.158
  504   HD12  ILE  61          HD12      ILE  61  -8.591   6.740  12.237
  505   HD13  ILE  61          HD13      ILE  61  -8.763   7.175  10.540
  506    H    ASP  62           HN       ASP  62  -6.386   4.685  14.547
  507    HA   ASP  62           HA       ASP  62  -5.082   6.878  13.266
  508    HB2  ASP  62           HB2      ASP  62  -4.112   7.279  15.537
  509    HB3  ASP  62           HB1      ASP  62  -5.870   7.169  15.555
  510    H    ALA  63           HN       ALA  63  -4.462   3.544  14.031
  511    HA   ALA  63           HA       ALA  63  -1.559   3.840  13.786
  512    HB1  ALA  63           HB1      ALA  63  -3.282   1.393  14.120
  513    HB2  ALA  63           HB2      ALA  63  -2.340   2.210  15.367
  514    HB3  ALA  63           HB3      ALA  63  -1.522   1.380  14.044
  515    H    GLY  64           HN       GLY  64  -4.284   2.808  11.841
  516    HA2  GLY  64           HA2      GLY  64  -2.545   1.853   9.705
  517    HA3  GLY  64           HA1      GLY  64  -4.299   1.770   9.736
  518    H    ALA  65           HN       ALA  65  -1.721   4.212   9.691
  519    HA   ALA  65           HA       ALA  65  -3.363   5.777   7.813
  520    HB1  ALA  65           HB1      ALA  65  -2.765   7.674   8.858
  521    HB2  ALA  65           HB2      ALA  65  -1.109   7.129   9.121
  522    HB3  ALA  65           HB3      ALA  65  -2.396   6.596  10.202
  523    H    SER  66           HN       SER  66  -0.167   4.483   8.461
  524    HA   SER  66           HA       SER  66   1.003   5.635   6.100
  525    HB2  SER  66           HB2      SER  66   2.027   3.521   8.006
  526    HB3  SER  66           HB1      SER  66   2.971   4.234   6.698
  527    HG   SER  66           HG       SER  66   1.743   5.792   8.716
  528    H    ILE  67           HN       ILE  67  -1.375   3.756   5.880
  529    HA   ILE  67           HA       ILE  67  -0.509   1.335   4.735
  530    HB   ILE  67           HB       ILE  67  -2.816   1.684   5.507
  531   HG12  ILE  67          HG12      ILE  67  -2.771   1.093   2.541
  532   HG13  ILE  67          HG11      ILE  67  -2.222  -0.043   3.770
  533   HG21  ILE  67          HG21      ILE  67  -3.190   3.956   4.853
  534   HG22  ILE  67          HG22      ILE  67  -4.389   2.945   4.047
  535   HG23  ILE  67          HG23      ILE  67  -2.997   3.549   3.148
  536   HD11  ILE  67          HD11      ILE  67  -4.665  -0.116   2.789
  537   HD12  ILE  67          HD12      ILE  67  -4.947   1.086   4.048
  538   HD13  ILE  67          HD13      ILE  67  -4.329  -0.509   4.476
  539    H    ASN  68           HN       ASN  68  -0.999   4.560   3.409
  540    HA   ASN  68           HA       ASN  68   0.754   4.382   1.337
  541    HB2  ASN  68           HB2      ASN  68  -0.551   2.527   0.423
  542    HB3  ASN  68           HB1      ASN  68  -1.989   3.536   0.371
  543   HD21  ASN  68          1HE2      ASN  68  -0.885   2.181  -1.819
  544   HD22  ASN  68          2HE2      ASN  68  -0.356   3.359  -2.965
  545    H    VAL  69           HN       VAL  69  -2.263   5.355  -0.003
  546    HA   VAL  69           HA       VAL  69  -1.448   8.119   0.085
  547    HB   VAL  69           HB       VAL  69  -3.489   8.475  -1.340
  548   HG11  VAL  69          HG11      VAL  69  -1.904   8.327  -2.892
  549   HG12  VAL  69          HG12      VAL  69  -2.320   6.623  -3.069
  550   HG13  VAL  69          HG13      VAL  69  -1.030   7.105  -1.968
  551   HG21  VAL  69          HG21      VAL  69  -3.595   5.470  -1.478
  552   HG22  VAL  69          HG22      VAL  69  -4.712   6.634  -2.188
  553   HG23  VAL  69          HG23      VAL  69  -4.656   6.421  -0.439
  554    H    SER  70           HN       SER  70  -3.473   6.139   1.970
  555    HA   SER  70           HA       SER  70  -5.609   7.772   2.602
  556    HB2  SER  70           HB2      SER  70  -4.977   5.359   3.413
  557    HB3  SER  70           HB1      SER  70  -4.252   6.214   4.774
  558    HG   SER  70           HG       SER  70  -6.900   5.824   4.145
  559    H    VAL  71           HN       VAL  71  -2.308   7.878   3.856
  560    HA   VAL  71           HA       VAL  71  -2.583   9.605   5.987
  561    HB   VAL  71           HB       VAL  71  -0.281  10.481   5.327
  562   HG11  VAL  71          HG11      VAL  71   0.616   8.768   6.467
  563   HG12  VAL  71          HG12      VAL  71  -0.008   7.561   5.342
  564   HG13  VAL  71          HG13      VAL  71  -1.053   8.212   6.604
  565   HG21  VAL  71          HG21      VAL  71  -0.024   8.248   3.420
  566   HG22  VAL  71          HG22      VAL  71   0.743   9.835   3.422
  567   HG23  VAL  71          HG23      VAL  71  -0.915   9.657   2.849
  568    H    MET  72           HN       MET  72  -2.090  11.910   6.151
  569    HA   MET  72           HA       MET  72  -3.147  13.416   3.850
  570    HB2  MET  72           HB2      MET  72  -4.340  13.280   6.241
  571    HB3  MET  72           HB1      MET  72  -3.228  14.602   6.574
  572    HG2  MET  72           HG2      MET  72  -5.051  14.598   4.192
  573    HG3  MET  72           HG1      MET  72  -5.547  15.217   5.766
  574    HE1  MET  72           HE1      MET  72  -5.562  17.982   5.805
  575    HE2  MET  72           HE2      MET  72  -6.199  17.218   4.349
  576    HE3  MET  72           HE3      MET  72  -5.127  18.613   4.216
  577    H    LEU  73           HN       LEU  73  -0.564  13.072   6.123
  578    HA   LEU  73           HA       LEU  73   0.622  15.625   5.336
  579    HB2  LEU  73           HB2      LEU  73   0.520  14.413   7.752
  580    HB3  LEU  73           HB1      LEU  73   2.071  13.829   7.180
  581    HG   LEU  73           HG       LEU  73   2.475  16.390   6.665
  582   HD11  LEU  73          HD11      LEU  73   0.555  17.483   7.233
  583   HD12  LEU  73          HD12      LEU  73   1.407  17.559   8.775
  584   HD13  LEU  73          HD13      LEU  73   0.154  16.345   8.519
  585   HD21  LEU  73          HD21      LEU  73   3.099  16.494   9.265
  586   HD22  LEU  73          HD22      LEU  73   4.027  15.563   8.090
  587   HD23  LEU  73          HD23      LEU  73   2.829  14.758   9.104
  588    H    GLN  74           HN       GLN  74   1.951  12.345   5.845
  589    HA   GLN  74           HA       GLN  74   3.240  12.511   3.229
  590    HB2  GLN  74           HB2      GLN  74   4.668  12.170   5.856
  591    HB3  GLN  74           HB1      GLN  74   5.375  11.635   4.337
  592    HG2  GLN  74           HG2      GLN  74   5.717  13.760   3.584
  593    HG3  GLN  74           HG1      GLN  74   4.375  14.424   4.515
  594   HE21  GLN  74          1HE2      GLN  74   4.833  13.848   7.022
  595   HE22  GLN  74          2HE2      GLN  74   6.354  14.458   7.571
  596    HA   PRO  75           HA       PRO  75   1.910   8.279   3.007
  597    HB2  PRO  75           HB2      PRO  75   4.114   7.905   1.082
  598    HB3  PRO  75           HB1      PRO  75   2.376   7.697   0.854
  599    HG2  PRO  75           HG2      PRO  75   3.683   9.762  -0.232
  600    HG3  PRO  75           HG1      PRO  75   2.035   9.940   0.402
  601    HD2  PRO  75           HD2      PRO  75   4.641  10.742   1.644
  602    HD3  PRO  75           HD1      PRO  75   3.093  11.615   1.603
  603    H    PHE  76           HN       PHE  76   5.073   9.238   3.924
  604    HA   PHE  76           HA       PHE  76   5.867   6.501   4.560
  605    HB2  PHE  76           HB2      PHE  76   7.993   7.872   5.384
  606    HB3  PHE  76           HB1      PHE  76   7.757   7.446   3.695
  607    HD1  PHE  76           HD1      PHE  76   6.945   9.154   2.096
  608    HD2  PHE  76           HD2      PHE  76   7.993  10.131   6.103
  609    HE1  PHE  76           HE1      PHE  76   7.101  11.529   1.472
  610    HE2  PHE  76           HE2      PHE  76   8.150  12.508   5.487
  611    HZ   PHE  76           HZ       PHE  76   7.703  13.209   3.169
  612    H    ASP  77           HN       ASP  77   5.790   9.654   6.241
  613    HA   ASP  77           HA       ASP  77   5.564  10.184   8.445
  614    HB2  ASP  77           HB2      ASP  77   3.688   7.881   8.069
  615    HB3  ASP  77           HB1      ASP  77   3.935   8.532   9.686
  616    H    TYR  78           HN       TYR  78   7.904   8.834   7.891
  617    HA   TYR  78           HA       TYR  78   8.256   6.743   9.871
  618    HB2  TYR  78           HB2      TYR  78  10.425   6.434   8.952
  619    HB3  TYR  78           HB1      TYR  78   9.341   6.699   7.592
  620    HD1  TYR  78           HD1      TYR  78   9.419   8.830   6.349
  621    HD2  TYR  78           HD2      TYR  78  12.176   7.988   9.476
  622    HE1  TYR  78           HE1      TYR  78  10.862  10.657   5.559
  623    HE2  TYR  78           HE2      TYR  78  13.628   9.813   8.695
  624    HH   TYR  78           HH       TYR  78  13.144  11.385   5.679
  625    H    ASP  79           HN       ASP  79   7.950   9.890  10.263
  626    HA   ASP  79           HA       ASP  79  10.145  10.998  11.421
  627    HB2  ASP  79           HB2      ASP  79   7.270  11.361  11.692
  628    HB3  ASP  79           HB1      ASP  79   8.133  11.770  13.172
  629    HA   PRO  80           HA       PRO  80   9.580   8.956  15.658
  630    HB2  PRO  80           HB2      PRO  80   7.366   7.638  16.341
  631    HB3  PRO  80           HB1      PRO  80   7.387   9.407  16.293
  632    HG2  PRO  80           HG2      PRO  80   6.307   7.467  14.283
  633    HG3  PRO  80           HG1      PRO  80   5.601   8.988  14.862
  634    HD2  PRO  80           HD2      PRO  80   7.006   8.714  12.502
  635    HD3  PRO  80           HD1      PRO  80   6.802  10.240  13.384
  636    H    ASN  81           HN       ASN  81  11.071   7.650  14.129
  637    HA   ASN  81           HA       ASN  81  11.338   5.064  14.892
  638    HB2  ASN  81           HB2      ASN  81   9.189   5.299  12.921
  639    HB3  ASN  81           HB1      ASN  81  10.423   4.137  12.452
  640   HD21  ASN  81          1HE2      ASN  81  11.182   2.937  14.664
  641   HD22  ASN  81          2HE2      ASN  81   9.862   2.160  15.464
  642    H    GLU  82           HN       GLU  82  13.078   6.940  14.330
  643    HA   GLU  82           HA       GLU  82  14.140   7.044  11.739
  644    HB2  GLU  82           HB2      GLU  82  16.268   7.771  12.936
  645    HB3  GLU  82           HB1      GLU  82  14.827   8.733  13.238
  646    HG2  GLU  82           HG2      GLU  82  14.740   8.168  15.411
  647    HG3  GLU  82           HG1      GLU  82  15.291   6.519  15.117
  648    H    LYS  83           HN       LYS  83  14.632   4.714  14.339
  649    HA   LYS  83           HA       LYS  83  16.946   3.477  13.297
  650    HB2  LYS  83           HB2      LYS  83  14.689   2.468  15.029
  651    HB3  LYS  83           HB1      LYS  83  16.010   1.418  14.535
  652    HG2  LYS  83           HG2      LYS  83  16.834   3.979  15.712
  653    HG3  LYS  83           HG1      LYS  83  15.983   2.885  16.804
  654    HD2  LYS  83           HD2      LYS  83  17.665   1.135  15.692
  655    HD3  LYS  83           HD1      LYS  83  18.632   2.598  15.503
  656    HE2  LYS  83           HE2      LYS  83  19.252   1.638  17.580
  657    HE3  LYS  83           HE1      LYS  83  18.247   3.039  17.950
  658    HZ1  LYS  83           HZ1      LYS  83  17.592   1.206  19.322
  659    HZ2  LYS  83           HZ2      LYS  83  17.397   0.194  17.981
  660    HZ3  LYS  83           HZ3      LYS  83  16.353   1.506  18.208
  661    H    SER  84           HN       SER  84  13.508   2.821  12.910
  662    HA   SER  84           HA       SER  84  13.721   0.730  11.033
  663    HB2  SER  84           HB2      SER  84  11.411   2.607  10.888
  664    HB3  SER  84           HB1      SER  84  11.427   0.844  10.849
  665    HG   SER  84           HG       SER  84  12.011   0.951  13.112
  666    H    LYS  85           HN       LYS  85  14.152   4.115  10.705
  667    HA   LYS  85           HA       LYS  85  14.334   5.518   8.882
  668    HB2  LYS  85           HB2      LYS  85  16.515   4.684   8.990
  669    HB3  LYS  85           HB1      LYS  85  16.070   3.145   8.273
  670    HG2  LYS  85           HG2      LYS  85  16.108   3.973   6.145
  671    HG3  LYS  85           HG1      LYS  85  15.692   5.610   6.656
  672    HD2  LYS  85           HD2      LYS  85  17.951   5.862   7.608
  673    HD3  LYS  85           HD1      LYS  85  18.358   4.245   7.030
  674    HE2  LYS  85           HE2      LYS  85  18.608   4.930   4.899
  675    HE3  LYS  85           HE1      LYS  85  17.251   6.052   4.995
  676    HZ1  LYS  85           HZ1      LYS  85  19.742   6.675   6.426
  677    HZ2  LYS  85           HZ2      LYS  85  18.577   7.726   5.794
  678    HZ3  LYS  85           HZ3      LYS  85  19.660   6.943   4.757
  679    H    HIS  86           HN       HIS  86  12.250   5.606   7.956
  680    HA   HIS  86           HA       HIS  86  11.866   3.894   5.565
  681    HB2  HIS  86           HB2      HIS  86   9.927   4.807   7.641
  682    HB3  HIS  86           HB1      HIS  86   9.351   4.520   6.003
  683    HD1  HIS  86           HD1      HIS  86  10.684   2.756   9.015
  684    HD2  HIS  86           HD2      HIS  86   9.288   1.833   5.211
  685    HE1  HIS  86           HE1      HIS  86  10.349   0.264   9.008
  686    HE2  HIS  86           HE2      HIS  86   9.417  -0.260   6.726
  687    H    LYS  87           HN       LYS  87  10.324   4.827   3.898
  688    HA   LYS  87           HA       LYS  87   9.725   7.532   3.591
  689    HB2  LYS  87           HB2      LYS  87  12.491   6.862   2.951
  690    HB3  LYS  87           HB1      LYS  87  11.649   7.613   1.608
  691    HG2  LYS  87           HG2      LYS  87  11.293   9.587   2.762
  692    HG3  LYS  87           HG1      LYS  87  11.534   8.825   4.335
  693    HD2  LYS  87           HD2      LYS  87  13.740   9.049   2.305
  694    HD3  LYS  87           HD1      LYS  87  13.405  10.326   3.476
  695    HE2  LYS  87           HE2      LYS  87  14.977   9.132   4.629
  696    HE3  LYS  87           HE1      LYS  87  13.511   8.325   5.183
  697    HZ1  LYS  87           HZ1      LYS  87  14.672   7.232   2.768
  698    HZ2  LYS  87           HZ2      LYS  87  14.052   6.439   4.128
  699    HZ3  LYS  87           HZ3      LYS  87  15.627   7.056   4.155
  700    H    PHE  88           HN       PHE  88   8.258   7.692   1.831
  701    HA   PHE  88           HA       PHE  88   7.700   5.297   0.379
  702    HB2  PHE  88           HB2      PHE  88   6.281   7.592   1.105
  703    HB3  PHE  88           HB1      PHE  88   6.258   7.558  -0.655
  704    HD1  PHE  88           HD2      PHE  88   5.444   5.613   2.377
  705    HD2  PHE  88           HD1      PHE  88   4.921   6.015  -1.827
  706    HE1  PHE  88           HE2      PHE  88   3.661   3.919   2.441
  707    HE2  PHE  88           HE1      PHE  88   3.135   4.323  -1.771
  708    HZ   PHE  88           HZ       PHE  88   2.504   3.272   0.365
  709    H    MET  89           HN       MET  89   8.719   8.560  -0.881
  710    HA   MET  89           HA       MET  89   8.905   7.487  -3.553
  711    HB2  MET  89           HB2      MET  89   9.169  10.147  -2.339
  712    HB3  MET  89           HB1      MET  89  10.405   9.869  -3.548
  713    HG2  MET  89           HG2      MET  89   8.625   9.388  -5.227
  714    HG3  MET  89           HG1      MET  89   7.404   9.730  -4.005
  715    HE1  MET  89           HE1      MET  89   7.660  12.036  -7.060
  716    HE2  MET  89           HE2      MET  89   6.756  13.036  -5.929
  717    HE3  MET  89           HE3      MET  89   6.417  11.312  -6.034
  718    H    VAL  90           HN       VAL  90  11.069   8.148  -0.905
  719    HA   VAL  90           HA       VAL  90  13.532   7.464  -2.212
  720    HB   VAL  90           HB       VAL  90  13.284   7.480   0.758
  721   HG11  VAL  90          HG11      VAL  90  15.393   8.948  -0.682
  722   HG12  VAL  90          HG12      VAL  90  15.391   7.197  -0.889
  723   HG13  VAL  90          HG13      VAL  90  15.499   7.895   0.727
  724   HG21  VAL  90          HG21      VAL  90  12.702   9.746  -1.050
  725   HG22  VAL  90          HG22      VAL  90  13.780  10.079   0.306
  726   HG23  VAL  90          HG23      VAL  90  12.162   9.444   0.602
  727    H    GLN  91           HN       GLN  91  11.090   5.533  -0.869
  728    HA   GLN  91           HA       GLN  91  12.445   3.542   0.470
  729    HB2  GLN  91           HB2      GLN  91   9.837   3.975  -0.392
  730    HB3  GLN  91           HB1      GLN  91  10.282   2.435  -1.109
  731    HG2  GLN  91           HG2      GLN  91  10.825   1.523   1.042
  732    HG3  GLN  91           HG1      GLN  91  10.573   3.087   1.813
  733   HE21  GLN  91          1HE2      GLN  91   9.180   1.404   3.041
  734   HE22  GLN  91          2HE2      GLN  91   7.527   1.326   2.548
  735    H    SER  92           HN       SER  92  12.682   4.117  -2.909
  736    HA   SER  92           HA       SER  92  12.974   1.511  -3.878
  737    HB2  SER  92           HB2      SER  92  12.879   3.784  -5.135
  738    HB3  SER  92           HB1      SER  92  14.633   3.769  -4.951
  739    HG   SER  92           HG       SER  92  14.502   1.600  -5.919
  740    H    MET  93           HN       MET  93  15.188   3.359  -1.937
  741    HA   MET  93           HA       MET  93  17.536   1.892  -2.637
  742    HB2  MET  93           HB2      MET  93  17.698   4.193  -1.815
  743    HB3  MET  93           HB1      MET  93  16.966   3.712  -0.291
  744    HG2  MET  93           HG2      MET  93  19.055   2.001  -0.405
  745    HG3  MET  93           HG1      MET  93  19.719   3.396  -1.254
  746    HE1  MET  93           HE1      MET  93  20.627   1.925   1.216
  747    HE2  MET  93           HE2      MET  93  19.433   2.019   2.511
  748    HE3  MET  93           HE3      MET  93  20.883   3.021   2.574
  749    H    PHE  94           HN       PHE  94  15.324   1.997   0.108
  750    HA   PHE  94           HA       PHE  94  16.493   0.095   1.739
  751    HB2  PHE  94           HB2      PHE  94  14.672   1.398   2.569
  752    HB3  PHE  94           HB1      PHE  94  13.588   0.804   1.316
  753    HD1  PHE  94           HD1      PHE  94  12.922  -1.626   1.362
  754    HD2  PHE  94           HD2      PHE  94  14.861   0.295   4.624
  755    HE1  PHE  94           HE1      PHE  94  12.150  -3.410   2.862
  756    HE2  PHE  94           HE2      PHE  94  14.091  -1.489   6.136
  757    HZ   PHE  94           HZ       PHE  94  12.734  -3.346   5.255
  758    H    ALA  95           HN       ALA  95  14.899  -0.372  -1.281
  759    HA   ALA  95           HA       ALA  95  15.717  -2.854  -1.876
  760    HB1  ALA  95           HB1      ALA  95  13.521  -3.037   0.107
  761    HB2  ALA  95           HB2      ALA  95  14.890  -4.113  -0.174
  762    HB3  ALA  95           HB3      ALA  95  13.490  -4.170  -1.243
  763    HA   PRO  96           HA       PRO  96  10.933  -2.417  -3.717
  764    HB2  PRO  96           HB2      PRO  96  11.416   0.512  -3.313
  765    HB3  PRO  96           HB1      PRO  96   9.886  -0.363  -3.444
  766    HG2  PRO  96           HG2      PRO  96  11.123   0.306  -1.056
  767    HG3  PRO  96           HG1      PRO  96   9.915  -0.973  -1.252
  768    HD2  PRO  96           HD2      PRO  96  12.637  -1.295  -0.523
  769    HD3  PRO  96           HD1      PRO  96  11.483  -2.576  -0.919
  770    H    THR  97           HN       THR  97  12.533  -3.240  -5.300
  771    HA   THR  97           HA       THR  97  13.962  -1.505  -7.035
  772    HB   THR  97           HB       THR  97  12.935  -4.311  -7.526
  773    HG1  THR  97           HG1      THR  97  15.105  -4.865  -6.954
  774   HG21  THR  97          HG21      THR  97  15.224  -4.143  -8.934
  775   HG22  THR  97          HG22      THR  97  14.591  -2.511  -9.145
  776   HG23  THR  97          HG23      THR  97  13.617  -3.902  -9.620
  777    H    ASP  98           HN       ASP  98  10.716  -2.389  -6.675
  778    HA   ASP  98           HA       ASP  98   9.617  -2.226  -9.188
  779    HB2  ASP  98           HB2      ASP  98   8.541  -1.571  -6.461
  780    HB3  ASP  98           HB1      ASP  98   7.543  -1.398  -7.902
  781    H    THR  99           HN       THR  99  11.031   0.348  -7.371
  782    HA   THR  99           HA       THR  99   9.499   2.524  -8.163
  783    HB   THR  99           HB       THR  99  12.512   2.441  -7.893
  784    HG1  THR  99           HG1      THR  99  10.544   3.016  -5.936
  785   HG21  THR  99          HG21      THR  99  12.232   4.561  -8.649
  786   HG22  THR  99          HG22      THR  99  11.902   4.823  -6.936
  787   HG23  THR  99          HG23      THR  99  10.566   4.667  -8.078
  788    H    SER 100           HN       SER 100  12.296   1.082  -9.868
  789    HA   SER 100           HA       SER 100  11.991   2.761 -12.165
  790    HB2  SER 100           HB2      SER 100  13.257   0.094 -12.497
  791    HB3  SER 100           HB1      SER 100  13.839   1.685 -12.988
  792    HG   SER 100           HG       SER 100  14.381   2.073 -10.800
  793    H    ASP 101           HN       ASP 101  10.596  -0.142 -10.996
  794    HA   ASP 101           HA       ASP 101   9.554  -1.207 -13.400
  795    HB2  ASP 101           HB2      ASP 101   9.898  -2.415 -11.182
  796    HB3  ASP 101           HB1      ASP 101   8.401  -1.653 -10.655
  797    H    MET 102           HN       MET 102   8.535   1.419 -11.404
  798    HA   MET 102           HA       MET 102   5.783   1.368 -11.660
  799    HB2  MET 102           HB2      MET 102   7.756   3.266 -10.901
  800    HB3  MET 102           HB1      MET 102   6.702   4.068 -12.052
  801    HG2  MET 102           HG2      MET 102   5.122   4.326 -10.522
  802    HG3  MET 102           HG1      MET 102   5.138   2.607 -10.138
  803    HE1  MET 102           HE1      MET 102   5.021   5.703  -8.948
  804    HE2  MET 102           HE2      MET 102   6.552   6.211  -8.236
  805    HE3  MET 102           HE3      MET 102   5.342   5.402  -7.240
  806    H    GLU 103           HN       GLU 103   8.110   2.898 -13.915
  807    HA   GLU 103           HA       GLU 103   6.100   3.521 -15.844
  808    HB2  GLU 103           HB2      GLU 103   8.894   4.015 -15.498
  809    HB3  GLU 103           HB1      GLU 103   8.650   3.325 -17.096
  810    HG2  GLU 103           HG2      GLU 103   7.274   5.077 -17.775
  811    HG3  GLU 103           HG1      GLU 103   6.972   5.603 -16.120
  812    H    ALA 104           HN       ALA 104   8.308   0.878 -15.294
  813    HA   ALA 104           HA       ALA 104   7.953  -0.468 -17.755
  814    HB1  ALA 104           HB1      ALA 104   9.718  -0.687 -15.748
  815    HB2  ALA 104           HB2      ALA 104   9.469  -1.930 -16.974
  816    HB3  ALA 104           HB3      ALA 104   8.685  -2.074 -15.401
  817    H    VAL 105           HN       VAL 105   5.995  -0.391 -14.887
  818    HA   VAL 105           HA       VAL 105   4.834  -2.910 -14.947
  819    HB   VAL 105           HB       VAL 105   3.541  -0.287 -14.183
  820   HG11  VAL 105          HG11      VAL 105   2.402  -2.419 -12.743
  821   HG12  VAL 105          HG12      VAL 105   2.387  -2.897 -14.440
  822   HG13  VAL 105          HG13      VAL 105   1.627  -1.387 -13.944
  823   HG21  VAL 105          HG21      VAL 105   5.007  -0.394 -12.503
  824   HG22  VAL 105          HG22      VAL 105   5.458  -2.054 -12.889
  825   HG23  VAL 105          HG23      VAL 105   4.037  -1.735 -11.895
  826    H    TRP 106           HN       TRP 106   3.571   0.043 -16.544
  827    HA   TRP 106           HA       TRP 106   1.632  -1.549 -17.992
  828    HB2  TRP 106           HB2      TRP 106   1.829   1.153 -17.223
  829    HB3  TRP 106           HB1      TRP 106   1.891   1.156 -18.983
  830    HD1  TRP 106           HD1      TRP 106  -0.458   0.517 -16.073
  831    HE1  TRP 106           HE1      TRP 106  -2.847   0.199 -16.974
  832    HE3  TRP 106           HE3      TRP 106   0.586   0.275 -21.071
  833    HZ2  TRP 106           HZ2      TRP 106  -4.121  -0.113 -19.474
  834    HZ3  TRP 106           HZ3      TRP 106  -1.274  -0.034 -22.651
  835    HH2  TRP 106           HH2      TRP 106  -3.578  -0.226 -21.867
  836    H    LYS 107           HN       LYS 107   4.743  -0.085 -18.566
  837    HA   LYS 107           HA       LYS 107   4.709  -0.163 -21.389
  838    HB2  LYS 107           HB2      LYS 107   6.345   1.031 -19.752
  839    HB3  LYS 107           HB1      LYS 107   7.225  -0.491 -19.788
  840    HG2  LYS 107           HG2      LYS 107   8.140   1.093 -21.384
  841    HG3  LYS 107           HG1      LYS 107   7.459  -0.313 -22.206
  842    HD2  LYS 107           HD2      LYS 107   6.062   0.975 -23.367
  843    HD3  LYS 107           HD1      LYS 107   5.447   1.715 -21.888
  844    HE2  LYS 107           HE2      LYS 107   7.630   3.104 -21.963
  845    HE3  LYS 107           HE1      LYS 107   7.702   2.598 -23.651
  846    HZ1  LYS 107           HZ1      LYS 107   5.309   3.468 -23.749
  847    HZ2  LYS 107           HZ2      LYS 107   6.566   4.599 -23.722
  848    HZ3  LYS 107           HZ3      LYS 107   5.683   4.283 -22.314
  849    H    GLU 108           HN       GLU 108   5.951  -2.455 -18.970
  850    HA   GLU 108           HA       GLU 108   6.503  -4.390 -21.085
  851    HB2  GLU 108           HB2      GLU 108   7.326  -4.063 -18.257
  852    HB3  GLU 108           HB1      GLU 108   7.214  -5.710 -18.863
  853    HG2  GLU 108           HG2      GLU 108   8.747  -3.606 -20.342
  854    HG3  GLU 108           HG1      GLU 108   9.466  -4.508 -19.010
  855    H    ALA 109           HN       ALA 109   4.015  -3.635 -18.897
  856    HA   ALA 109           HA       ALA 109   1.966  -4.587 -18.596
  857    HB1  ALA 109           HB1      ALA 109   2.307  -5.410 -20.964
  858    HB2  ALA 109           HB2      ALA 109   1.205  -6.353 -19.962
  859    HB3  ALA 109           HB3      ALA 109   2.841  -6.935 -20.260
  860    H    LYS 110           HN       LYS 110   1.373  -7.399 -18.291
  861    HA   LYS 110           HA       LYS 110   1.866  -7.749 -15.606
  862    HB2  LYS 110           HB2      LYS 110   0.112  -8.945 -16.741
  863    HB3  LYS 110           HB1      LYS 110   1.280  -9.820 -17.719
  864    HG2  LYS 110           HG2      LYS 110   1.572 -10.097 -14.798
  865    HG3  LYS 110           HG1      LYS 110   0.135 -10.828 -15.518
  866    HD2  LYS 110           HD2      LYS 110   2.927 -11.297 -16.550
  867    HD3  LYS 110           HD1      LYS 110   2.149 -12.332 -15.350
  868    HE2  LYS 110           HE2      LYS 110   0.578 -13.117 -16.858
  869    HE3  LYS 110           HE1      LYS 110   0.761 -11.727 -17.928
  870    HZ1  LYS 110           HZ1      LYS 110   2.302 -14.185 -17.799
  871    HZ2  LYS 110           HZ2      LYS 110   3.198 -12.775 -18.062
  872    HZ3  LYS 110           HZ3      LYS 110   1.952 -13.193 -19.125
  873    HA   PRO 111           HA       PRO 111   5.474 -10.920 -17.013
  874    HB2  PRO 111           HB2      PRO 111   6.588  -8.916 -18.937
  875    HB3  PRO 111           HB1      PRO 111   6.695 -10.680 -18.960
  876    HG2  PRO 111           HG2      PRO 111   4.981  -9.421 -20.550
  877    HG3  PRO 111           HG1      PRO 111   4.528 -10.937 -19.748
  878    HD2  PRO 111           HD2      PRO 111   3.699  -8.147 -19.134
  879    HD3  PRO 111           HD1      PRO 111   2.791  -9.662 -18.949
  880    H    GLU 112           HN       GLU 112   5.799  -7.369 -17.037
  881    HA   GLU 112           HA       GLU 112   8.275  -7.412 -15.601
  882    HB2  GLU 112           HB2      GLU 112   6.660  -5.457 -16.918
  883    HB3  GLU 112           HB1      GLU 112   7.010  -4.888 -15.293
  884    HG2  GLU 112           HG2      GLU 112   8.985  -5.672 -17.418
  885    HG3  GLU 112           HG1      GLU 112   8.697  -4.064 -16.757
  886    H    ASP 113           HN       ASP 113   4.888  -6.951 -14.737
  887    HA   ASP 113           HA       ASP 113   5.312  -6.183 -12.058
  888    HB2  ASP 113           HB2      ASP 113   2.966  -7.408 -13.496
  889    HB3  ASP 113           HB1      ASP 113   2.910  -7.048 -11.773
  890    H    LEU 114           HN       LEU 114   4.798  -9.354 -13.556
  891    HA   LEU 114           HA       LEU 114   4.601 -10.875 -11.226
  892    HB2  LEU 114           HB2      LEU 114   4.082 -11.779 -13.419
  893    HB3  LEU 114           HB1      LEU 114   5.757 -11.622 -13.911
  894    HG   LEU 114           HG       LEU 114   6.190 -13.221 -11.865
  895   HD11  LEU 114          HD11      LEU 114   4.210 -13.623 -10.838
  896   HD12  LEU 114          HD12      LEU 114   4.126 -14.894 -12.058
  897   HD13  LEU 114          HD13      LEU 114   3.267 -13.373 -12.308
  898   HD21  LEU 114          HD21      LEU 114   4.960 -14.668 -14.127
  899   HD22  LEU 114          HD22      LEU 114   6.556 -14.841 -13.399
  900   HD23  LEU 114          HD23      LEU 114   6.240 -13.523 -14.527
  901    H    MET 115           HN       MET 115   7.436  -9.735 -12.980
  902    HA   MET 115           HA       MET 115   9.314 -11.228 -11.432
  903    HB2  MET 115           HB2      MET 115   9.605  -8.875 -13.296
  904    HB3  MET 115           HB1      MET 115  10.974  -9.616 -12.478
  905    HG2  MET 115           HG2      MET 115  10.017 -11.812 -13.541
  906    HG3  MET 115           HG1      MET 115   9.263 -10.682 -14.664
  907    HE1  MET 115           HE1      MET 115  12.903 -12.612 -14.244
  908    HE2  MET 115           HE2      MET 115  12.286 -11.728 -12.848
  909    HE3  MET 115           HE3      MET 115  13.674 -11.108 -13.742
  910    H    ASP 116           HN       ASP 116   8.281  -7.823 -11.417
  911    HA   ASP 116           HA       ASP 116   9.951  -7.112  -9.221
  912    HB2  ASP 116           HB2      ASP 116   7.897  -5.787 -10.878
  913    HB3  ASP 116           HB1      ASP 116   8.067  -5.159  -9.241
  914    H    SER 117           HN       SER 117   6.687  -8.295  -9.551
  915    HA   SER 117           HA       SER 117   5.784  -7.656  -6.936
  916    HB2  SER 117           HB2      SER 117   4.919  -9.744  -8.929
  917    HB3  SER 117           HB1      SER 117   4.062  -9.434  -7.419
  918    HG   SER 117           HG       SER 117   3.362  -7.553  -8.177
  919    H    LYS 118           HN       LYS 118   7.053 -10.631  -8.401
  920    HA   LYS 118           HA       LYS 118   7.035 -12.148  -6.010
  921    HB2  LYS 118           HB2      LYS 118   7.373 -12.812  -8.578
  922    HB3  LYS 118           HB1      LYS 118   9.066 -12.721  -8.113
  923    HG2  LYS 118           HG2      LYS 118   8.976 -14.657  -7.025
  924    HG3  LYS 118           HG1      LYS 118   7.481 -14.217  -6.199
  925    HD2  LYS 118           HD2      LYS 118   6.622 -14.637  -8.764
  926    HD3  LYS 118           HD1      LYS 118   7.901 -15.843  -8.597
  927    HE2  LYS 118           HE2      LYS 118   5.829 -15.522  -6.461
  928    HE3  LYS 118           HE1      LYS 118   5.472 -16.453  -7.915
  929    HZ1  LYS 118           HZ1      LYS 118   6.846 -18.109  -7.301
  930    HZ2  LYS 118           HZ2      LYS 118   6.570 -17.506  -5.744
  931    HZ3  LYS 118           HZ3      LYS 118   7.977 -17.077  -6.580
  932    H    LEU 119           HN       LEU 119   9.207  -9.871  -7.439
  933    HA   LEU 119           HA       LEU 119  11.493 -10.496  -5.843
  934    HB2  LEU 119           HB2      LEU 119  11.495  -9.262  -8.044
  935    HB3  LEU 119           HB1      LEU 119  10.884  -7.866  -7.178
  936    HG   LEU 119           HG       LEU 119  13.062  -8.427  -5.679
  937   HD11  LEU 119          HD11      LEU 119  13.827 -10.258  -7.025
  938   HD12  LEU 119          HD12      LEU 119  14.916  -8.892  -7.265
  939   HD13  LEU 119          HD13      LEU 119  13.713  -9.286  -8.492
  940   HD21  LEU 119          HD21      LEU 119  14.193  -6.641  -6.963
  941   HD22  LEU 119          HD22      LEU 119  12.522  -6.249  -6.558
  942   HD23  LEU 119          HD23      LEU 119  12.934  -6.767  -8.192
  943    H    ARG 120           HN       ARG 120   8.941  -8.039  -5.615
  944    HA   ARG 120           HA       ARG 120   9.995  -6.837  -3.258
  945    HB2  ARG 120           HB2      ARG 120   8.416  -5.767  -4.937
  946    HB3  ARG 120           HB1      ARG 120   7.131  -6.705  -4.189
  947    HG2  ARG 120           HG2      ARG 120   6.925  -4.733  -3.060
  948    HG3  ARG 120           HG1      ARG 120   8.026  -5.602  -1.989
  949    HD2  ARG 120           HD2      ARG 120   8.792  -3.565  -4.077
  950    HD3  ARG 120           HD1      ARG 120   8.793  -3.324  -2.333
  951    HE   ARG 120           HE       ARG 120  10.697  -4.685  -2.160
  952   HH11  ARG 120          HH11      ARG 120   9.653  -4.331  -5.480
  953   HH12  ARG 120          HH12      ARG 120  11.159  -4.875  -6.136
  954   HH21  ARG 120          HH21      ARG 120  12.670  -5.400  -3.030
  955   HH22  ARG 120          HH22      ARG 120  12.868  -5.485  -4.749
  956    H    CYS 121           HN       CYS 121   7.633  -9.358  -3.890
  957    HA   CYS 121           HA       CYS 121   6.565  -9.558  -1.299
  958    HB2  CYS 121           HB2      CYS 121   6.773 -11.452  -3.618
  959    HB3  CYS 121           HB1      CYS 121   6.141 -12.011  -2.073
  960    HG   CYS 121           HG       CYS 121   4.763  -9.625  -3.500
  961    H    VAL 122           HN       VAL 122   9.365 -11.082  -2.815
  962    HA   VAL 122           HA       VAL 122   9.974 -12.730  -0.552
  963    HB   VAL 122           HB       VAL 122  10.669 -13.387  -2.805
  964   HG11  VAL 122          HG11      VAL 122  11.146 -11.241  -3.780
  965   HG12  VAL 122          HG12      VAL 122  12.589 -12.248  -3.875
  966   HG13  VAL 122          HG13      VAL 122  12.478 -10.980  -2.654
  967   HG21  VAL 122          HG21      VAL 122  13.301 -13.000  -1.553
  968   HG22  VAL 122          HG22      VAL 122  12.483 -14.483  -2.047
  969   HG23  VAL 122          HG23      VAL 122  12.070 -13.716  -0.514
  970    H    PHE 123           HN       PHE 123  11.129  -9.621  -1.772
  971    HA   PHE 123           HA       PHE 123  13.235  -9.337   0.112
  972    HB2  PHE 123           HB2      PHE 123  12.165  -7.852  -2.088
  973    HB3  PHE 123           HB1      PHE 123  12.340  -6.770  -0.710
  974    HD1  PHE 123           HD1      PHE 123  14.720  -7.728   0.618
  975    HD2  PHE 123           HD2      PHE 123  13.887  -7.410  -3.542
  976    HE1  PHE 123           HE1      PHE 123  17.128  -7.532   0.155
  977    HE2  PHE 123           HE2      PHE 123  16.294  -7.214  -4.014
  978    HZ   PHE 123           HZ       PHE 123  17.918  -7.275  -2.164
  979    H    GLU 124           HN       GLU 124   9.847  -8.376   0.076
  980    HA   GLU 124           HA       GLU 124   9.898  -6.695   2.328
  981    HB2  GLU 124           HB2      GLU 124   7.845  -8.060   0.722
  982    HB3  GLU 124           HB1      GLU 124   7.380  -7.758   2.391
  983    HG2  GLU 124           HG2      GLU 124   7.798  -5.399   2.126
  984    HG3  GLU 124           HG1      GLU 124   8.399  -5.661   0.489
  985    H    LEU 125           HN       LEU 125   9.273 -10.170   2.012
  986    HA   LEU 125           HA       LEU 125   9.350 -11.875   3.515
  987    HB2  LEU 125           HB2      LEU 125  11.451 -10.211   4.181
  988    HB3  LEU 125           HB1      LEU 125  10.609 -10.408   5.706
  989    HG   LEU 125           HG       LEU 125  12.317 -12.070   5.595
  990   HD11  LEU 125          HD11      LEU 125  11.066 -13.807   6.299
  991   HD12  LEU 125          HD12      LEU 125  10.059 -13.811   4.851
  992   HD13  LEU 125          HD13      LEU 125   9.749 -12.645   6.138
  993   HD21  LEU 125          HD21      LEU 125  12.996 -12.460   3.470
  994   HD22  LEU 125          HD22      LEU 125  11.364 -12.356   2.812
  995   HD23  LEU 125          HD23      LEU 125  11.896 -13.830   3.622
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1 -13.876  11.785  -1.784
    2    H2   MET   1           HT2      MET   1 -14.247  11.134  -0.240
    3    H3   MET   1           HT3      MET   1 -13.030  10.410  -1.210
    4    HA   MET   1           HA       MET   1 -12.873  13.190  -0.293
    5    HB2  MET   1           HB2      MET   1 -12.330  10.625   1.129
    6    HB3  MET   1           HB1      MET   1 -11.197  11.949   1.368
    7    HG2  MET   1           HG2      MET   1 -12.548  12.732   2.930
    8    HG3  MET   1           HG1      MET   1 -13.719  13.095   1.663
    9    HE1  MET   1           HE1      MET   1 -15.093  11.258   5.080
   10    HE2  MET   1           HE2      MET   1 -15.664  12.598   4.086
   11    HE3  MET   1           HE3      MET   1 -14.007  12.590   4.687
   12    H    ALA   2           HN       ALA   2 -11.049  10.196  -0.966
   13    HA   ALA   2           HA       ALA   2  -8.929  11.837  -2.173
   14    HB1  ALA   2           HB1      ALA   2  -7.806   9.413  -2.074
   15    HB2  ALA   2           HB2      ALA   2  -8.968   9.238  -0.760
   16    HB3  ALA   2           HB3      ALA   2  -7.777  10.538  -0.716
   17    H    LYS   3           HN       LYS   3 -10.310  12.120  -4.075
   18    HA   LYS   3           HA       LYS   3 -11.189  11.545  -6.123
   19    HB2  LYS   3           HB2      LYS   3  -8.681   9.977  -6.570
   20    HB3  LYS   3           HB1      LYS   3  -9.499  11.104  -7.643
   21    HG2  LYS   3           HG2      LYS   3  -8.678  12.979  -6.441
   22    HG3  LYS   3           HG1      LYS   3  -8.078  11.955  -5.135
   23    HD2  LYS   3           HD2      LYS   3  -7.057  11.401  -7.861
   24    HD3  LYS   3           HD1      LYS   3  -6.504  12.885  -7.082
   25    HE2  LYS   3           HE2      LYS   3  -5.234  11.775  -5.600
   26    HE3  LYS   3           HE1      LYS   3  -6.448  10.522  -5.352
   27    HZ1  LYS   3           HZ1      LYS   3  -4.220   9.921  -6.469
   28    HZ2  LYS   3           HZ2      LYS   3  -4.905  10.599  -7.859
   29    HZ3  LYS   3           HZ3      LYS   3  -5.652   9.281  -7.103
   30    H    VAL   4           HN       VAL   4 -12.668  10.003  -4.794
   31    HA   VAL   4           HA       VAL   4 -12.326   7.266  -4.682
   32    HB   VAL   4           HB       VAL   4 -14.962   8.608  -5.278
   33   HG11  VAL   4          HG11      VAL   4 -15.267   6.291  -5.394
   34   HG12  VAL   4          HG12      VAL   4 -15.741   6.707  -3.746
   35   HG13  VAL   4          HG13      VAL   4 -14.161   5.987  -4.054
   36   HG21  VAL   4          HG21      VAL   4 -14.954   8.343  -2.598
   37   HG22  VAL   4          HG22      VAL   4 -14.476   9.820  -3.435
   38   HG23  VAL   4          HG23      VAL   4 -13.247   8.683  -2.880
   39    H    GLU   5           HN       GLU   5 -13.648   9.190  -7.372
   40    HA   GLU   5           HA       GLU   5 -14.312   7.009  -9.023
   41    HB2  GLU   5           HB2      GLU   5 -14.615   9.739  -9.156
   42    HB3  GLU   5           HB1      GLU   5 -13.455   9.429 -10.440
   43    HG2  GLU   5           HG2      GLU   5 -15.245   9.037 -11.702
   44    HG3  GLU   5           HG1      GLU   5 -15.305   7.479 -10.880
   45    H    GLN   6           HN       GLN   6 -11.403   9.067  -8.951
   46    HA   GLN   6           HA       GLN   6 -10.053   7.698 -11.033
   47    HB2  GLN   6           HB2      GLN   6  -9.425   9.805  -9.081
   48    HB3  GLN   6           HB1      GLN   6  -8.042   8.816  -9.524
   49    HG2  GLN   6           HG2      GLN   6  -9.117   9.348 -11.962
   50    HG3  GLN   6           HG1      GLN   6  -9.509  10.822 -11.077
   51   HE21  GLN   6          1HE2      GLN   6  -8.064  12.329 -11.630
   52   HE22  GLN   6          2HE2      GLN   6  -6.352  12.102 -11.712
   53    H    VAL   7           HN       VAL   7 -10.039   7.365  -7.519
   54    HA   VAL   7           HA       VAL   7  -7.997   5.330  -7.550
   55    HB   VAL   7           HB       VAL   7  -8.235   5.241  -5.157
   56   HG11  VAL   7          HG11      VAL   7  -6.887   7.040  -5.886
   57   HG12  VAL   7          HG12      VAL   7  -7.932   7.693  -4.625
   58   HG13  VAL   7          HG13      VAL   7  -8.290   8.015  -6.322
   59   HG21  VAL   7          HG21      VAL   7 -10.858   6.442  -5.732
   60   HG22  VAL   7          HG22      VAL   7 -10.022   7.096  -4.324
   61   HG23  VAL   7          HG23      VAL   7 -10.361   5.369  -4.425
   62    H    LEU   8           HN       LEU   8 -11.428   5.323  -7.831
   63    HA   LEU   8           HA       LEU   8 -12.117   2.955  -6.548
   64    HB2  LEU   8           HB2      LEU   8 -13.298   4.715  -8.491
   65    HB3  LEU   8           HB1      LEU   8 -13.635   3.049  -8.923
   66    HG   LEU   8           HG       LEU   8 -14.282   4.349  -6.275
   67   HD11  LEU   8          HD11      LEU   8 -15.765   5.178  -7.938
   68   HD12  LEU   8          HD12      LEU   8 -16.633   3.937  -7.036
   69   HD13  LEU   8          HD13      LEU   8 -15.982   3.572  -8.633
   70   HD21  LEU   8          HD21      LEU   8 -15.681   2.110  -6.203
   71   HD22  LEU   8          HD22      LEU   8 -14.011   2.173  -5.639
   72   HD23  LEU   8          HD23      LEU   8 -14.377   1.542  -7.246
   73    H    SER   9           HN       SER   9 -11.079   3.390  -9.926
   74    HA   SER   9           HA       SER   9 -10.442   1.865 -11.521
   75    HB2  SER   9           HB2      SER   9  -8.700   0.196 -10.312
   76    HB3  SER   9           HB1      SER   9  -8.321   1.873 -10.703
   77    HG   SER   9           HG       SER   9  -9.338   0.945  -8.207
   78    H    LEU  10           HN       LEU  10 -12.858   0.986  -9.861
   79    HA   LEU  10           HA       LEU  10 -12.548  -1.884  -9.778
   80    HB2  LEU  10           HB2      LEU  10 -13.814  -0.937  -8.038
   81    HB3  LEU  10           HB1      LEU  10 -14.842  -0.061  -9.154
   82    HG   LEU  10           HG       LEU  10 -15.390  -2.585  -9.927
   83   HD11  LEU  10          HD11      LEU  10 -15.335  -4.141  -8.224
   84   HD12  LEU  10          HD12      LEU  10 -15.173  -2.913  -6.968
   85   HD13  LEU  10          HD13      LEU  10 -13.800  -3.298  -8.007
   86   HD21  LEU  10          HD21      LEU  10 -17.332  -2.427  -8.281
   87   HD22  LEU  10          HD22      LEU  10 -17.137  -1.104  -9.430
   88   HD23  LEU  10          HD23      LEU  10 -16.609  -0.906  -7.759
   89    H    GLU  11           HN       GLU  11 -13.674   0.417 -12.113
   90    HA   GLU  11           HA       GLU  11 -15.485  -1.280 -13.487
   91    HB2  GLU  11           HB2      GLU  11 -14.212   1.297 -13.954
   92    HB3  GLU  11           HB1      GLU  11 -14.322   0.353 -15.433
   93    HG2  GLU  11           HG2      GLU  11 -16.710   0.664 -13.671
   94    HG3  GLU  11           HG1      GLU  11 -16.245   1.953 -14.781
   95    HA   PRO  12           HA       PRO  12 -11.680  -2.909 -15.780
   96    HB2  PRO  12           HB2      PRO  12  -9.367  -1.570 -15.721
   97    HB3  PRO  12           HB1      PRO  12 -10.731  -0.952 -16.660
   98    HG2  PRO  12           HG2      PRO  12  -9.579   0.062 -14.145
   99    HG3  PRO  12           HG1      PRO  12 -10.576   0.902 -15.342
  100    HD2  PRO  12           HD2      PRO  12 -11.393  -0.351 -12.849
  101    HD3  PRO  12           HD1      PRO  12 -12.354   0.647 -13.956
  102    H    GLN  13           HN       GLN  13 -11.203  -4.780 -14.608
  103    HA   GLN  13           HA       GLN  13 -10.363  -4.723 -11.929
  104    HB2  GLN  13           HB2      GLN  13 -10.217  -6.878 -14.046
  105    HB3  GLN  13           HB1      GLN  13  -9.689  -7.150 -12.391
  106    HG2  GLN  13           HG2      GLN  13 -11.966  -6.495 -11.629
  107    HG3  GLN  13           HG1      GLN  13 -12.457  -6.436 -13.322
  108   HE21  GLN  13          1HE2      GLN  13 -12.358  -8.397 -14.551
  109   HE22  GLN  13          2HE2      GLN  13 -12.525  -9.923 -13.760
  110    H    HIS  14           HN       HIS  14  -8.597  -4.268 -14.852
  111    HA   HIS  14           HA       HIS  14  -6.404  -3.914 -15.314
  112    HB2  HIS  14           HB2      HIS  14  -6.903  -2.812 -12.717
  113    HB3  HIS  14           HB1      HIS  14  -5.267  -3.460 -12.756
  114    HD1  HIS  14           HD1      HIS  14  -4.796  -0.764 -12.496
  115    HD2  HIS  14           HD2      HIS  14  -6.121  -2.132 -16.189
  116    HE1  HIS  14           HE1      HIS  14  -4.209   1.051 -14.134
  117    HE2  HIS  14           HE2      HIS  14  -5.104   0.242 -16.346
  118    H    GLU  15           HN       GLU  15  -4.305  -4.825 -15.263
  119    HA   GLU  15           HA       GLU  15  -4.003  -7.262 -13.657
  120    HB2  GLU  15           HB2      GLU  15  -2.933  -8.314 -15.707
  121    HB3  GLU  15           HB1      GLU  15  -4.680  -8.123 -15.760
  122    HG2  GLU  15           HG2      GLU  15  -4.450  -6.155 -17.153
  123    HG3  GLU  15           HG1      GLU  15  -2.693  -6.268 -17.054
  124    H    LEU  16           HN       LEU  16  -2.774  -5.393 -12.543
  125    HA   LEU  16           HA       LEU  16  -0.413  -4.338 -13.590
  126    HB2  LEU  16           HB2      LEU  16  -1.199  -4.950 -10.739
  127    HB3  LEU  16           HB1      LEU  16   0.267  -4.088 -11.165
  128    HG   LEU  16           HG       LEU  16  -1.347  -2.467 -10.522
  129   HD11  LEU  16          HD11      LEU  16  -1.670  -1.171 -12.606
  130   HD12  LEU  16          HD12      LEU  16  -1.108  -2.569 -13.520
  131   HD13  LEU  16          HD13      LEU  16  -0.025  -1.761 -12.387
  132   HD21  LEU  16          HD21      LEU  16  -3.560  -2.342 -11.267
  133   HD22  LEU  16          HD22      LEU  16  -3.296  -4.057 -10.952
  134   HD23  LEU  16          HD23      LEU  16  -3.266  -3.450 -12.608
  135    H    LYS  17           HN       LYS  17   0.257  -6.249 -10.776
  136    HA   LYS  17           HA       LYS  17   2.417  -7.563 -12.124
  137    HB2  LYS  17           HB2      LYS  17   1.450  -8.173  -9.339
  138    HB3  LYS  17           HB1      LYS  17   3.068  -8.362  -9.995
  139    HG2  LYS  17           HG2      LYS  17   3.622  -6.324  -9.331
  140    HG3  LYS  17           HG1      LYS  17   2.282  -5.628 -10.240
  141    HD2  LYS  17           HD2      LYS  17   0.846  -5.689  -8.415
  142    HD3  LYS  17           HD1      LYS  17   1.800  -6.919  -7.581
  143    HE2  LYS  17           HE2      LYS  17   2.456  -5.121  -6.366
  144    HE3  LYS  17           HE1      LYS  17   3.623  -4.974  -7.679
  145    HZ1  LYS  17           HZ1      LYS  17   2.736  -2.857  -7.475
  146    HZ2  LYS  17           HZ2      LYS  17   1.159  -3.415  -7.222
  147    HZ3  LYS  17           HZ3      LYS  17   1.851  -3.508  -8.763
  148    H    PHE  18           HN       PHE  18  -0.782  -8.212 -12.162
  149    HA   PHE  18           HA       PHE  18  -2.006  -9.981 -12.855
  150    HB2  PHE  18           HB2      PHE  18  -0.142 -10.429 -14.397
  151    HB3  PHE  18           HB1      PHE  18   0.647 -11.402 -13.163
  152    HD1  PHE  18           HD1      PHE  18  -2.090 -11.234 -15.571
  153    HD2  PHE  18           HD2      PHE  18  -0.187 -13.601 -12.591
  154    HE1  PHE  18           HE1      PHE  18  -3.322 -13.212 -16.361
  155    HE2  PHE  18           HE2      PHE  18  -1.415 -15.583 -13.375
  156    HZ   PHE  18           HZ       PHE  18  -2.984 -15.391 -15.264
  157    H    ARG  19           HN       ARG  19   0.512 -12.011 -11.404
  158    HA   ARG  19           HA       ARG  19  -1.275 -13.565  -9.944
  159    HB2  ARG  19           HB2      ARG  19   1.648 -13.207 -10.031
  160    HB3  ARG  19           HB1      ARG  19   1.027 -13.853  -8.518
  161    HG2  ARG  19           HG2      ARG  19   0.622 -15.009 -11.268
  162    HG3  ARG  19           HG1      ARG  19   1.642 -15.658  -9.984
  163    HD2  ARG  19           HD2      ARG  19  -0.511 -15.742  -8.589
  164    HD3  ARG  19           HD1      ARG  19  -1.353 -15.531 -10.124
  165    HE   ARG  19           HE       ARG  19  -0.833 -17.695 -10.676
  166   HH11  ARG  19          HH11      ARG  19   1.082 -16.728  -7.924
  167   HH12  ARG  19          HH12      ARG  19   1.673 -18.327  -7.617
  168   HH21  ARG  19          HH21      ARG  19  -0.059 -19.798 -10.272
  169   HH22  ARG  19          HH22      ARG  19   1.026 -20.069  -8.950
  170    H    GLY  20           HN       GLY  20  -2.717 -12.280  -8.786
  171    HA2  GLY  20           HA2      GLY  20  -3.045 -11.881  -6.363
  172    HA3  GLY  20           HA1      GLY  20  -1.550 -10.970  -6.393
  173    HA   PRO  21           HA       PRO  21  -3.108  -6.947  -7.136
  174    HB2  PRO  21           HB2      PRO  21  -2.793  -7.101 -10.050
  175    HB3  PRO  21           HB1      PRO  21  -2.045  -5.997  -8.898
  176    HG2  PRO  21           HG2      PRO  21  -0.956  -8.413 -10.050
  177    HG3  PRO  21           HG1      PRO  21  -0.156  -7.219  -9.023
  178    HD2  PRO  21           HD2      PRO  21  -0.702  -9.784  -8.243
  179    HD3  PRO  21           HD1      PRO  21  -0.552  -8.426  -7.112
  180    H    PHE  22           HN       PHE  22  -4.100  -9.288  -9.620
  181    HA   PHE  22           HA       PHE  22  -6.586  -8.009 -10.129
  182    HB2  PHE  22           HB2      PHE  22  -5.208  -9.784 -11.526
  183    HB3  PHE  22           HB1      PHE  22  -6.201 -10.929 -10.634
  184    HD1  PHE  22           HD2      PHE  22  -8.699 -10.769 -10.818
  185    HD2  PHE  22           HD1      PHE  22  -6.063  -8.595 -13.355
  186    HE1  PHE  22           HE2      PHE  22 -10.531 -10.430 -12.424
  187    HE2  PHE  22           HE1      PHE  22  -7.891  -8.250 -14.966
  188    HZ   PHE  22           HZ       PHE  22 -10.129  -9.169 -14.502
  189    H    THR  23           HN       THR  23  -5.804 -11.051  -8.444
  190    HA   THR  23           HA       THR  23  -8.435 -11.385  -7.426
  191    HB   THR  23           HB       THR  23  -6.157 -12.756  -6.110
  192    HG1  THR  23           HG1      THR  23  -5.924 -14.102  -7.942
  193   HG21  THR  23          HG21      THR  23  -7.580 -14.746  -6.593
  194   HG22  THR  23          HG22      THR  23  -8.803 -13.641  -7.218
  195   HG23  THR  23          HG23      THR  23  -8.312 -13.548  -5.527
  196    H    ASP  24           HN       ASP  24  -5.393 -10.508  -5.759
  197    HA   ASP  24           HA       ASP  24  -6.654 -10.184  -3.246
  198    HB2  ASP  24           HB2      ASP  24  -4.116 -10.541  -3.929
  199    HB3  ASP  24           HB1      ASP  24  -4.087  -8.785  -3.786
  200    H    VAL  25           HN       VAL  25  -5.418  -7.708  -5.526
  201    HA   VAL  25           HA       VAL  25  -6.179  -5.536  -3.906
  202    HB   VAL  25           HB       VAL  25  -5.905  -5.489  -6.904
  203   HG11  VAL  25          HG11      VAL  25  -6.772  -3.432  -6.544
  204   HG12  VAL  25          HG12      VAL  25  -5.108  -3.067  -6.089
  205   HG13  VAL  25          HG13      VAL  25  -6.307  -3.415  -4.844
  206   HG21  VAL  25          HG21      VAL  25  -3.787  -4.691  -4.945
  207   HG22  VAL  25          HG22      VAL  25  -3.623  -5.113  -6.649
  208   HG23  VAL  25          HG23      VAL  25  -3.953  -6.371  -5.457
  209    H    VAL  26           HN       VAL  26  -8.073  -7.245  -6.379
  210    HA   VAL  26           HA       VAL  26 -10.115  -5.363  -6.650
  211    HB   VAL  26           HB       VAL  26 -11.619  -7.287  -7.224
  212   HG11  VAL  26          HG11      VAL  26 -10.150  -8.021  -9.199
  213   HG12  VAL  26          HG12      VAL  26  -8.958  -6.895  -8.545
  214   HG13  VAL  26          HG13      VAL  26 -10.546  -6.308  -9.042
  215   HG21  VAL  26          HG21      VAL  26 -10.409  -9.495  -7.525
  216   HG22  VAL  26          HG22      VAL  26 -10.822  -9.042  -5.871
  217   HG23  VAL  26          HG23      VAL  26  -9.170  -8.845  -6.453
  218    H    THR  27           HN       THR  27  -9.625  -7.822  -4.179
  219    HA   THR  27           HA       THR  27 -12.126  -7.689  -2.941
  220    HB   THR  27           HB       THR  27  -9.670  -7.979  -1.266
  221    HG1  THR  27           HG1      THR  27  -9.361 -10.067  -2.099
  222   HG21  THR  27          HG21      THR  27 -11.928  -9.918  -1.440
  223   HG22  THR  27          HG22      THR  27 -12.106  -8.419  -0.530
  224   HG23  THR  27          HG23      THR  27 -10.845  -9.571  -0.092
  225    H    THR  28           HN       THR  28  -9.169  -5.827  -2.346
  226    HA   THR  28           HA       THR  28 -10.302  -4.182  -0.320
  227    HB   THR  28           HB       THR  28  -7.997  -3.246  -1.974
  228    HG1  THR  28           HG1      THR  28  -6.653  -4.702  -0.806
  229   HG21  THR  28          HG21      THR  28  -7.124  -3.103   0.517
  230   HG22  THR  28          HG22      THR  28  -8.856  -3.057   0.851
  231   HG23  THR  28          HG23      THR  28  -8.127  -1.844  -0.203
  232    H    ASN  29           HN       ASN  29  -9.729  -3.763  -3.788
  233    HA   ASN  29           HA       ASN  29 -10.528  -1.105  -4.034
  234    HB2  ASN  29           HB2      ASN  29 -10.590  -3.420  -5.960
  235    HB3  ASN  29           HB1      ASN  29 -11.121  -1.808  -6.431
  236   HD21  ASN  29          1HE2      ASN  29  -9.527  -1.402  -7.880
  237   HD22  ASN  29          2HE2      ASN  29  -7.863  -1.222  -7.452
  238    H    LEU  30           HN       LEU  30 -12.442  -4.074  -4.042
  239    HA   LEU  30           HA       LEU  30 -14.896  -2.851  -4.772
  240    HB2  LEU  30           HB2      LEU  30 -14.659  -5.220  -5.029
  241    HB3  LEU  30           HB1      LEU  30 -14.254  -5.425  -3.337
  242    HG   LEU  30           HG       LEU  30 -16.592  -6.132  -4.094
  243   HD11  LEU  30          HD11      LEU  30 -15.686  -5.537  -1.706
  244   HD12  LEU  30          HD12      LEU  30 -17.405  -5.817  -1.978
  245   HD13  LEU  30          HD13      LEU  30 -16.789  -4.169  -1.863
  246   HD21  LEU  30          HD21      LEU  30 -16.911  -3.969  -5.399
  247   HD22  LEU  30          HD22      LEU  30 -17.210  -3.205  -3.838
  248   HD23  LEU  30          HD23      LEU  30 -18.258  -4.508  -4.397
  249    H    LYS  31           HN       LYS  31 -13.556  -3.840  -1.644
  250    HA   LYS  31           HA       LYS  31 -15.642  -2.348  -0.259
  251    HB2  LYS  31           HB2      LYS  31 -14.778  -3.411   1.774
  252    HB3  LYS  31           HB1      LYS  31 -15.155  -4.611   0.546
  253    HG2  LYS  31           HG2      LYS  31 -12.514  -4.075   0.057
  254    HG3  LYS  31           HG1      LYS  31 -12.616  -3.960   1.815
  255    HD2  LYS  31           HD2      LYS  31 -13.566  -6.287   0.145
  256    HD3  LYS  31           HD1      LYS  31 -12.072  -6.237   1.085
  257    HE2  LYS  31           HE2      LYS  31 -13.219  -6.232   3.123
  258    HE3  LYS  31           HE1      LYS  31 -14.739  -5.752   2.368
  259    HZ1  LYS  31           HZ1      LYS  31 -14.996  -8.004   2.835
  260    HZ2  LYS  31           HZ2      LYS  31 -13.430  -8.400   2.337
  261    HZ3  LYS  31           HZ3      LYS  31 -14.601  -7.988   1.189
  262    H    LEU  32           HN       LEU  32 -14.639  -0.372  -1.222
  263    HA   LEU  32           HA       LEU  32 -12.085   0.501  -0.332
  264    HB2  LEU  32           HB2      LEU  32 -14.224   1.510  -1.990
  265    HB3  LEU  32           HB1      LEU  32 -13.623   2.776  -0.941
  266    HG   LEU  32           HG       LEU  32 -12.089   1.224  -3.028
  267   HD11  LEU  32          HD11      LEU  32 -11.542   3.800  -3.455
  268   HD12  LEU  32          HD12      LEU  32 -13.131   3.973  -2.711
  269   HD13  LEU  32          HD13      LEU  32 -12.939   2.987  -4.160
  270   HD21  LEU  32          HD21      LEU  32 -11.116   2.660  -0.621
  271   HD22  LEU  32          HD22      LEU  32 -10.255   2.935  -2.135
  272   HD23  LEU  32          HD23      LEU  32 -10.411   1.300  -1.494
  273    H    GLY  33           HN       GLY  33 -12.954  -0.350   1.951
  274    HA2  GLY  33           HA2      GLY  33 -12.890   1.865   3.685
  275    HA3  GLY  33           HA1      GLY  33 -14.548   1.291   3.563
  276    H    ASN  34           HN       ASN  34 -13.017   1.262   5.961
  277    HA   ASN  34           HA       ASN  34 -13.373  -1.481   6.697
  278    HB2  ASN  34           HB2      ASN  34 -10.623  -0.405   6.247
  279    HB3  ASN  34           HB1      ASN  34 -10.884  -1.526   7.581
  280   HD21  ASN  34          1HE2      ASN  34 -10.458  -1.175   4.236
  281   HD22  ASN  34          2HE2      ASN  34 -10.671  -2.831   3.793
  282    HA   PRO  35           HA       PRO  35 -13.733   0.400  10.676
  283    HB2  PRO  35           HB2      PRO  35 -13.454  -1.680  12.319
  284    HB3  PRO  35           HB1      PRO  35 -14.790  -1.609  11.163
  285    HG2  PRO  35           HG2      PRO  35 -12.237  -3.152  11.016
  286    HG3  PRO  35           HG1      PRO  35 -13.870  -3.641  10.536
  287    HD2  PRO  35           HD2      PRO  35 -11.900  -2.708   8.810
  288    HD3  PRO  35           HD1      PRO  35 -13.638  -2.739   8.459
  289    H    THR  36           HN       THR  36 -12.231   1.805  11.368
  290    HA   THR  36           HA       THR  36  -9.489   1.004  11.812
  291    HB   THR  36           HB       THR  36  -9.113   3.370  12.360
  292    HG1  THR  36           HG1      THR  36 -11.080   3.841  13.362
  293   HG21  THR  36          HG21      THR  36  -8.883   3.411  10.134
  294   HG22  THR  36          HG22      THR  36 -10.421   4.272  10.177
  295   HG23  THR  36          HG23      THR  36 -10.389   2.538   9.859
  296    H    ASP  37           HN       ASP  37  -9.848  -0.525  13.504
  297    HA   ASP  37           HA       ASP  37  -9.990  -1.235  15.665
  298    HB2  ASP  37           HB2      ASP  37  -8.298   1.012  15.558
  299    HB3  ASP  37           HB1      ASP  37  -9.277   1.216  17.007
  300    H    ARG  38           HN       ARG  38 -12.350   0.235  14.485
  301    HA   ARG  38           HA       ARG  38 -14.268   1.362  15.152
  302    HB2  ARG  38           HB2      ARG  38 -15.571  -0.116  16.664
  303    HB3  ARG  38           HB1      ARG  38 -14.808  -0.970  15.331
  304    HG2  ARG  38           HG2      ARG  38 -13.598  -2.248  16.697
  305    HG3  ARG  38           HG1      ARG  38 -13.152  -0.885  17.724
  306    HD2  ARG  38           HD2      ARG  38 -15.187  -1.040  18.950
  307    HD3  ARG  38           HD1      ARG  38 -15.861  -2.196  17.800
  308    HE   ARG  38           HE       ARG  38 -14.062  -2.754  19.973
  309   HH11  ARG  38          HH11      ARG  38 -15.243  -3.854  16.879
  310   HH12  ARG  38          HH12      ARG  38 -14.837  -5.511  17.172
  311   HH21  ARG  38          HH21      ARG  38 -13.525  -4.933  20.361
  312   HH22  ARG  38          HH22      ARG  38 -13.861  -6.125  19.149
  313    H    ASN  39           HN       ASN  39 -13.697   3.343  16.043
  314    HA   ASN  39           HA       ASN  39 -14.153   3.560  18.889
  315    HB2  ASN  39           HB2      ASN  39 -11.594   3.208  18.355
  316    HB3  ASN  39           HB1      ASN  39 -11.666   4.914  17.925
  317   HD21  ASN  39          1HE2      ASN  39 -11.296   2.703  20.408
  318   HD22  ASN  39          2HE2      ASN  39 -11.457   3.785  21.745
  319    H    VAL  40           HN       VAL  40 -12.648   5.645  16.416
  320    HA   VAL  40           HA       VAL  40 -14.889   7.526  16.786
  321    HB   VAL  40           HB       VAL  40 -12.042   8.294  16.126
  322   HG11  VAL  40          HG11      VAL  40 -14.070   9.740  15.430
  323   HG12  VAL  40          HG12      VAL  40 -12.714  10.511  16.253
  324   HG13  VAL  40          HG13      VAL  40 -14.183  10.120  17.149
  325   HG21  VAL  40          HG21      VAL  40 -12.010   9.206  18.457
  326   HG22  VAL  40          HG22      VAL  40 -12.028   7.445  18.358
  327   HG23  VAL  40          HG23      VAL  40 -13.505   8.321  18.760
  328    H    CYS  41           HN       CYS  41 -12.159   7.141  14.520
  329    HA   CYS  41           HA       CYS  41 -13.954   7.746  12.306
  330    HB2  CYS  41           HB2      CYS  41 -11.103   8.016  12.814
  331    HB3  CYS  41           HB1      CYS  41 -11.418   7.269  11.252
  332    HG   CYS  41           HG       CYS  41 -12.476  10.092  12.027
  333    H    PHE  42           HN       PHE  42 -12.890   6.394  10.215
  334    HA   PHE  42           HA       PHE  42 -12.598   3.594  10.794
  335    HB2  PHE  42           HB2      PHE  42 -15.098   4.514   9.359
  336    HB3  PHE  42           HB1      PHE  42 -14.612   2.844   9.626
  337    HD1  PHE  42           HD1      PHE  42 -14.736   1.858  11.860
  338    HD2  PHE  42           HD2      PHE  42 -16.100   5.816  11.094
  339    HE1  PHE  42           HE1      PHE  42 -15.967   1.842  13.990
  340    HE2  PHE  42           HE2      PHE  42 -17.333   5.807  13.224
  341    HZ   PHE  42           HZ       PHE  42 -17.267   3.818  14.674
  342    H    LYS  43           HN       LYS  43 -13.252   6.100   8.416
  343    HA   LYS  43           HA       LYS  43 -12.434   4.667   6.135
  344    HB2  LYS  43           HB2      LYS  43 -12.353   7.648   6.617
  345    HB3  LYS  43           HB1      LYS  43 -12.288   6.856   5.047
  346    HG2  LYS  43           HG2      LYS  43 -14.503   6.619   4.952
  347    HG3  LYS  43           HG1      LYS  43 -14.604   6.062   6.624
  348    HD2  LYS  43           HD2      LYS  43 -14.059   8.945   6.089
  349    HD3  LYS  43           HD1      LYS  43 -15.703   8.333   5.891
  350    HE2  LYS  43           HE2      LYS  43 -15.836   8.855   8.090
  351    HE3  LYS  43           HE1      LYS  43 -15.122   7.252   8.268
  352    HZ1  LYS  43           HZ1      LYS  43 -13.086   8.115   8.795
  353    HZ2  LYS  43           HZ2      LYS  43 -14.089   9.299   9.470
  354    HZ3  LYS  43           HZ3      LYS  43 -13.348   9.572   7.974
  355    H    VAL  44           HN       VAL  44 -10.501   3.615   7.073
  356    HA   VAL  44           HA       VAL  44  -8.243   3.434   7.512
  357    HB   VAL  44           HB       VAL  44  -6.854   4.269   5.648
  358   HG11  VAL  44          HG11      VAL  44  -8.540   3.251   3.813
  359   HG12  VAL  44          HG12      VAL  44  -9.319   2.691   5.292
  360   HG13  VAL  44          HG13      VAL  44  -7.640   2.265   4.963
  361   HG21  VAL  44          HG21      VAL  44  -9.389   5.485   4.572
  362   HG22  VAL  44          HG22      VAL  44  -7.763   5.598   3.894
  363   HG23  VAL  44          HG23      VAL  44  -8.147   6.410   5.415
  364    H    LYS  45           HN       LYS  45  -9.364   5.493   9.078
  365    HA   LYS  45           HA       LYS  45  -7.313   7.597   9.023
  366    HB2  LYS  45           HB2      LYS  45 -10.146   7.571   9.631
  367    HB3  LYS  45           HB1      LYS  45  -9.225   8.272  10.955
  368    HG2  LYS  45           HG2      LYS  45  -8.701  10.115   9.786
  369    HG3  LYS  45           HG1      LYS  45  -8.464   9.220   8.284
  370    HD2  LYS  45           HD2      LYS  45 -11.168   8.998   8.686
  371    HD3  LYS  45           HD1      LYS  45 -10.827  10.622   9.287
  372    HE2  LYS  45           HE2      LYS  45 -11.311  10.894   7.002
  373    HE3  LYS  45           HE1      LYS  45  -9.555  10.992   7.120
  374    HZ1  LYS  45           HZ1      LYS  45 -10.961   9.361   5.452
  375    HZ2  LYS  45           HZ2      LYS  45 -10.474   8.316   6.691
  376    HZ3  LYS  45           HZ3      LYS  45  -9.319   9.209   5.836
  377    H    THR  46           HN       THR  46  -9.229   6.396  11.753
  378    HA   THR  46           HA       THR  46  -7.196   6.625  13.635
  379    HB   THR  46           HB       THR  46  -9.266   4.486  13.939
  380    HG1  THR  46           HG1      THR  46  -9.833   7.252  14.136
  381   HG21  THR  46          HG21      THR  46  -8.207   4.698  15.944
  382   HG22  THR  46          HG22      THR  46  -9.502   5.879  16.142
  383   HG23  THR  46          HG23      THR  46  -7.877   6.416  15.716
  384    H    THR  47           HN       THR  47  -7.570   4.277  11.188
  385    HA   THR  47           HA       THR  47  -6.532   2.336  10.665
  386    HB   THR  47           HB       THR  47  -4.627   4.004  10.765
  387    HG1  THR  47           HG1      THR  47  -3.556   2.414   9.959
  388   HG21  THR  47          HG21      THR  47  -2.885   3.317  12.526
  389   HG22  THR  47          HG22      THR  47  -4.273   2.758  13.458
  390   HG23  THR  47          HG23      THR  47  -4.155   4.451  12.982
  391    H    ALA  48           HN       ALA  48  -5.179   0.430  11.636
  392    HA   ALA  48           HA       ALA  48  -5.603  -0.129  14.412
  393    HB1  ALA  48           HB1      ALA  48  -7.840  -0.518  13.023
  394    HB2  ALA  48           HB2      ALA  48  -7.372  -1.554  14.372
  395    HB3  ALA  48           HB3      ALA  48  -7.060  -2.069  12.714
  396    HA   PRO  49           HA       PRO  49  -2.003  -2.506  13.207
  397    HB2  PRO  49           HB2      PRO  49  -1.635  -3.736  15.631
  398    HB3  PRO  49           HB1      PRO  49  -1.087  -2.098  15.261
  399    HG2  PRO  49           HG2      PRO  49  -3.546  -2.992  16.711
  400    HG3  PRO  49           HG1      PRO  49  -2.446  -1.654  17.091
  401    HD2  PRO  49           HD2      PRO  49  -4.816  -1.241  15.893
  402    HD3  PRO  49           HD1      PRO  49  -3.388  -0.262  15.499
  403    H    ARG  50           HN       ARG  50  -2.044  -4.334  12.082
  404    HA   ARG  50           HA       ARG  50  -4.018  -6.387  12.765
  405    HB2  ARG  50           HB2      ARG  50  -3.189  -5.278  10.331
  406    HB3  ARG  50           HB1      ARG  50  -2.515  -6.903  10.342
  407    HG2  ARG  50           HG2      ARG  50  -4.518  -7.869  10.089
  408    HG3  ARG  50           HG1      ARG  50  -5.311  -6.751  11.200
  409    HD2  ARG  50           HD2      ARG  50  -4.423  -5.677   8.583
  410    HD3  ARG  50           HD1      ARG  50  -5.806  -6.770   8.580
  411    HE   ARG  50           HE       ARG  50  -6.436  -5.006  10.523
  412   HH11  ARG  50          HH11      ARG  50  -5.404  -4.614   7.212
  413   HH12  ARG  50          HH12      ARG  50  -6.264  -3.127   6.989
  414   HH21  ARG  50          HH21      ARG  50  -7.569  -3.053  10.231
  415   HH22  ARG  50          HH22      ARG  50  -7.493  -2.241   8.702
  416    H    ARG  51           HN       ARG  51  -0.697  -6.423  11.456
  417    HA   ARG  51           HA       ARG  51   0.327  -8.033  13.561
  418    HB2  ARG  51           HB2      ARG  51  -0.783  -9.373  11.176
  419    HB3  ARG  51           HB1      ARG  51   0.825  -9.901  11.651
  420    HG2  ARG  51           HG2      ARG  51  -0.247 -10.080  14.024
  421    HG3  ARG  51           HG1      ARG  51  -1.759 -10.141  13.115
  422    HD2  ARG  51           HD2      ARG  51  -1.332 -12.200  12.292
  423    HD3  ARG  51           HD1      ARG  51   0.395 -11.886  12.123
  424    HE   ARG  51           HE       ARG  51  -0.277 -12.089  14.853
  425   HH11  ARG  51          HH11      ARG  51   0.084 -14.061  11.997
  426   HH12  ARG  51          HH12      ARG  51   0.495 -15.490  12.883
  427   HH21  ARG  51          HH21      ARG  51   0.263 -13.968  16.021
  428   HH22  ARG  51          HH22      ARG  51   0.596 -15.438  15.168
  429    H    TYR  52           HN       TYR  52   0.838  -7.781  10.033
  430    HA   TYR  52           HA       TYR  52   3.254  -6.260  10.428
  431    HB2  TYR  52           HB2      TYR  52   4.649  -7.932   9.134
  432    HB3  TYR  52           HB1      TYR  52   4.244  -8.392  10.784
  433    HD1  TYR  52           HD2      TYR  52   3.615  -9.072   7.230
  434    HD2  TYR  52           HD1      TYR  52   2.790 -10.266  11.230
  435    HE1  TYR  52           HE2      TYR  52   2.681 -11.190   6.399
  436    HE2  TYR  52           HE1      TYR  52   1.856 -12.388  10.410
  437    HH   TYR  52           HH       TYR  52   2.405 -13.703   7.668
  438    H    CYS  53           HN       CYS  53   3.058  -4.717   8.977
  439    HA   CYS  53           HA       CYS  53   3.193  -5.040   6.229
  440    HB2  CYS  53           HB2      CYS  53   0.727  -5.980   6.811
  441    HB3  CYS  53           HB1      CYS  53   0.341  -4.273   6.654
  442    HG   CYS  53           HG       CYS  53   0.022  -5.303   4.283
  443    H    VAL  54           HN       VAL  54   1.600  -3.171   8.749
  444    HA   VAL  54           HA       VAL  54   2.908  -0.760   7.739
  445    HB   VAL  54           HB       VAL  54   0.788   0.541   8.212
  446   HG11  VAL  54          HG11      VAL  54   1.115   0.511   5.975
  447   HG12  VAL  54          HG12      VAL  54  -0.308  -0.531   6.008
  448   HG13  VAL  54          HG13      VAL  54   1.303  -1.241   5.916
  449   HG21  VAL  54          HG21      VAL  54  -1.175  -0.459   8.700
  450   HG22  VAL  54          HG22      VAL  54  -0.136  -1.756   9.289
  451   HG23  VAL  54          HG23      VAL  54  -0.839  -1.855   7.675
  452    H    ARG  55           HN       ARG  55   3.339   0.790   9.344
  453    HA   ARG  55           HA       ARG  55   3.567  -0.285  11.988
  454    HB2  ARG  55           HB2      ARG  55   4.358   2.277  10.672
  455    HB3  ARG  55           HB1      ARG  55   4.382   2.166  12.425
  456    HG2  ARG  55           HG2      ARG  55   5.940   0.486  10.473
  457    HG3  ARG  55           HG1      ARG  55   6.573   1.700  11.586
  458    HD2  ARG  55           HD2      ARG  55   7.004  -0.136  12.841
  459    HD3  ARG  55           HD1      ARG  55   5.335   0.125  13.349
  460    HE   ARG  55           HE       ARG  55   5.462  -1.549  11.058
  461   HH11  ARG  55          HH11      ARG  55   5.940  -1.547  14.516
  462   HH12  ARG  55          HH12      ARG  55   5.597  -3.236  14.690
  463   HH21  ARG  55          HH21      ARG  55   5.011  -3.771  11.285
  464   HH22  ARG  55          HH22      ARG  55   5.072  -4.499  12.856
  465    H    SER  56           HN       SER  56   1.011  -0.452  11.738
  466    HA   SER  56           HA       SER  56  -0.348   1.939  12.679
  467    HB2  SER  56           HB2      SER  56  -1.395   0.440  10.988
  468    HB3  SER  56           HB1      SER  56  -1.465  -0.832  12.206
  469    HG   SER  56           HG       SER  56  -2.658   0.843  13.479
  470    H    ASN  57           HN       ASN  57   1.636   0.105  14.202
  471    HA   ASN  57           HA       ASN  57   0.050  -0.796  16.452
  472    HB2  ASN  57           HB2      ASN  57   2.244  -1.831  15.368
  473    HB3  ASN  57           HB1      ASN  57   3.020  -0.799  16.567
  474   HD21  ASN  57          1HE2      ASN  57   2.569  -3.792  16.214
  475   HD22  ASN  57          2HE2      ASN  57   2.003  -4.303  17.764
  476    H    SER  58           HN       SER  58   1.900   2.021  15.667
  477    HA   SER  58           HA       SER  58   2.684   2.818  18.245
  478    HB2  SER  58           HB2      SER  58   2.019   4.898  16.220
  479    HB3  SER  58           HB1      SER  58   3.431   4.753  17.267
  480    HG   SER  58           HG       SER  58   3.081   3.881  14.732
  481    H    GLY  59           HN       GLY  59  -0.454   2.764  16.915
  482    HA2  GLY  59           HA2      GLY  59  -2.468   3.352  17.879
  483    HA3  GLY  59           HA1      GLY  59  -1.575   3.839  19.302
  484    H    ILE  60           HN       ILE  60  -3.273   4.977  16.521
  485    HA   ILE  60           HA       ILE  60  -3.979   7.049  15.931
  486    HB   ILE  60           HB       ILE  60  -2.524   8.039  18.389
  487   HG12  ILE  60          HG12      ILE  60  -4.196   6.473  19.087
  488   HG13  ILE  60          HG11      ILE  60  -4.859   8.083  19.354
  489   HG21  ILE  60          HG21      ILE  60  -4.407   9.850  18.063
  490   HG22  ILE  60          HG22      ILE  60  -4.292   9.337  16.380
  491   HG23  ILE  60          HG23      ILE  60  -2.869   9.968  17.208
  492   HD11  ILE  60          HD11      ILE  60  -6.530   6.592  18.425
  493   HD12  ILE  60          HD12      ILE  60  -5.495   6.270  17.034
  494   HD13  ILE  60          HD13      ILE  60  -6.153   7.887  17.289
  495    H    ILE  61           HN       ILE  61  -0.723   7.514  17.312
  496    HA   ILE  61           HA       ILE  61   0.128   9.225  15.192
  497    HB   ILE  61           HB       ILE  61   1.697   7.594  17.204
  498   HG12  ILE  61          HG12      ILE  61   0.448   9.453  18.163
  499   HG13  ILE  61          HG11      ILE  61   2.172   9.809  18.196
  500   HG21  ILE  61          HG21      ILE  61   2.671   9.417  15.027
  501   HG22  ILE  61          HG22      ILE  61   3.188   7.775  15.406
  502   HG23  ILE  61          HG23      ILE  61   3.622   9.105  16.479
  503   HD11  ILE  61          HD11      ILE  61   1.164  11.797  17.523
  504   HD12  ILE  61          HD12      ILE  61   0.054  10.971  16.430
  505   HD13  ILE  61          HD13      ILE  61   1.767  11.084  16.026
  506    H    ASP  62           HN       ASP  62  -0.303   5.912  15.643
  507    HA   ASP  62           HA       ASP  62   1.443   4.916  13.611
  508    HB2  ASP  62           HB2      ASP  62   0.351   2.809  14.033
  509    HB3  ASP  62           HB1      ASP  62   0.628   3.609  15.565
  510    H    ALA  63           HN       ALA  63  -1.568   6.497  13.622
  511    HA   ALA  63           HA       ALA  63  -2.881   5.258  11.470
  512    HB1  ALA  63           HB1      ALA  63  -4.057   6.764  12.926
  513    HB2  ALA  63           HB2      ALA  63  -4.143   7.381  11.277
  514    HB3  ALA  63           HB3      ALA  63  -3.027   8.109  12.433
  515    H    GLY  64           HN       GLY  64  -0.180   7.425  11.498
  516    HA2  GLY  64           HA2      GLY  64  -0.477   8.113   8.669
  517    HA3  GLY  64           HA1      GLY  64   0.824   8.632   9.740
  518    H    ALA  65           HN       ALA  65   1.096   5.714  10.585
  519    HA   ALA  65           HA       ALA  65   3.264   4.993   9.049
  520    HB1  ALA  65           HB1      ALA  65   1.306   3.334  10.601
  521    HB2  ALA  65           HB2      ALA  65   2.948   3.805  11.039
  522    HB3  ALA  65           HB3      ALA  65   2.681   2.609   9.770
  523    H    SER  66           HN       SER  66  -0.117   4.656   8.322
  524    HA   SER  66           HA       SER  66   0.503   3.122   5.892
  525    HB2  SER  66           HB2      SER  66  -2.331   3.479   6.539
  526    HB3  SER  66           HB1      SER  66  -1.432   2.006   6.177
  527    HG   SER  66           HG       SER  66  -1.112   1.679   8.247
  528    H    ILE  67           HN       ILE  67   1.314   5.487   5.375
  529    HA   ILE  67           HA       ILE  67  -0.493   7.519   4.778
  530    HB   ILE  67           HB       ILE  67   1.253   8.599   3.571
  531   HG12  ILE  67          HG12      ILE  67   1.895   6.425   2.307
  532   HG13  ILE  67          HG11      ILE  67   3.154   7.597   2.655
  533   HG21  ILE  67          HG21      ILE  67   1.474   8.443   6.018
  534   HG22  ILE  67          HG22      ILE  67   3.028   8.594   5.196
  535   HG23  ILE  67          HG23      ILE  67   2.505   7.028   5.810
  536   HD11  ILE  67          HD11      ILE  67   3.079   5.810   4.835
  537   HD12  ILE  67          HD12      ILE  67   4.332   5.997   3.611
  538   HD13  ILE  67          HD13      ILE  67   3.021   4.846   3.360
  539    H    ASN  68           HN       ASN  68   0.408   4.714   2.763
  540    HA   ASN  68           HA       ASN  68  -0.743   5.990   0.413
  541    HB2  ASN  68           HB2      ASN  68   0.968   3.761   0.779
  542    HB3  ASN  68           HB1      ASN  68  -0.491   3.156  -0.001
  543   HD21  ASN  68          1HE2      ASN  68  -0.415   3.196  -2.203
  544   HD22  ASN  68          2HE2      ASN  68   0.495   4.325  -3.146
  545    H    VAL  69           HN       VAL  69  -1.786   3.652   2.813
  546    HA   VAL  69           HA       VAL  69  -4.253   3.116   1.385
  547    HB   VAL  69           HB       VAL  69  -3.151   1.329   2.694
  548   HG11  VAL  69          HG11      VAL  69  -2.858   1.376   4.966
  549   HG12  VAL  69          HG12      VAL  69  -4.143   2.559   5.219
  550   HG13  VAL  69          HG13      VAL  69  -2.586   3.073   4.567
  551   HG21  VAL  69          HG21      VAL  69  -5.791   1.777   2.373
  552   HG22  VAL  69          HG22      VAL  69  -5.702   1.662   4.130
  553   HG23  VAL  69          HG23      VAL  69  -5.127   0.329   3.130
  554    H    SER  70           HN       SER  70  -3.174   5.062   4.103
  555    HA   SER  70           HA       SER  70  -5.872   5.780   4.858
  556    HB2  SER  70           HB2      SER  70  -3.233   6.887   5.844
  557    HB3  SER  70           HB1      SER  70  -4.813   7.143   6.585
  558    HG   SER  70           HG       SER  70  -4.369   5.401   7.664
  559    H    VAL  71           HN       VAL  71  -3.079   7.328   3.338
  560    HA   VAL  71           HA       VAL  71  -2.821   9.351   2.303
  561    HB   VAL  71           HB       VAL  71  -4.419   9.793   0.503
  562   HG11  VAL  71          HG11      VAL  71  -2.999   8.266  -0.355
  563   HG12  VAL  71          HG12      VAL  71  -4.427   7.233  -0.323
  564   HG13  VAL  71          HG13      VAL  71  -3.240   7.135   0.976
  565   HG21  VAL  71          HG21      VAL  71  -6.426   8.534   0.203
  566   HG22  VAL  71          HG22      VAL  71  -6.455   9.206   1.834
  567   HG23  VAL  71          HG23      VAL  71  -6.054   7.506   1.587
  568    H    MET  72           HN       MET  72  -4.047   9.507   4.933
  569    HA   MET  72           HA       MET  72  -6.131  11.470   4.840
  570    HB2  MET  72           HB2      MET  72  -5.360   9.734   6.733
  571    HB3  MET  72           HB1      MET  72  -4.490  11.156   7.294
  572    HG2  MET  72           HG2      MET  72  -7.318  11.574   6.597
  573    HG3  MET  72           HG1      MET  72  -7.008  10.557   8.002
  574    HE1  MET  72           HE1      MET  72  -8.247  12.841   9.762
  575    HE2  MET  72           HE2      MET  72  -8.674  12.868   8.050
  576    HE3  MET  72           HE3      MET  72  -8.081  14.333   8.835
  577    H    LEU  73           HN       LEU  73  -2.864  11.689   6.256
  578    HA   LEU  73           HA       LEU  73  -2.134  14.023   4.849
  579    HB2  LEU  73           HB2      LEU  73  -3.759  14.398   7.219
  580    HB3  LEU  73           HB1      LEU  73  -2.193  15.167   7.396
  581    HG   LEU  73           HG       LEU  73  -4.187  15.673   5.186
  582   HD11  LEU  73          HD11      LEU  73  -4.844  17.532   6.284
  583   HD12  LEU  73          HD12      LEU  73  -3.250  17.817   6.981
  584   HD13  LEU  73          HD13      LEU  73  -4.321  16.613   7.696
  585   HD21  LEU  73          HD21      LEU  73  -2.408  17.646   4.927
  586   HD22  LEU  73          HD22      LEU  73  -2.279  16.123   4.048
  587   HD23  LEU  73          HD23      LEU  73  -1.332  16.378   5.514
  588    H    GLN  74           HN       GLN  74  -1.740  13.022   8.250
  589    HA   GLN  74           HA       GLN  74   0.936  13.530   8.533
  590    HB2  GLN  74           HB2      GLN  74   0.907  11.651  10.245
  591    HB3  GLN  74           HB1      GLN  74  -0.280  12.930  10.464
  592    HG2  GLN  74           HG2      GLN  74  -1.589  11.072   8.889
  593    HG3  GLN  74           HG1      GLN  74  -0.661  10.094  10.025
  594   HE21  GLN  74          1HE2      GLN  74  -1.754   9.575  11.764
  595   HE22  GLN  74          2HE2      GLN  74  -2.962  10.534  12.542
  596    HA   PRO  75           HA       PRO  75   2.455  10.359   5.677
  597    HB2  PRO  75           HB2      PRO  75   4.623  11.652   4.842
  598    HB3  PRO  75           HB1      PRO  75   3.012  12.170   4.329
  599    HG2  PRO  75           HG2      PRO  75   4.805  13.339   6.414
  600    HG3  PRO  75           HG1      PRO  75   3.769  14.164   5.236
  601    HD2  PRO  75           HD2      PRO  75   3.121  13.682   7.903
  602    HD3  PRO  75           HD1      PRO  75   1.964  14.076   6.619
  603    H    PHE  76           HN       PHE  76   2.893   8.923   7.521
  604    HA   PHE  76           HA       PHE  76   4.297   7.617   8.746
  605    HB2  PHE  76           HB2      PHE  76   5.863   8.496   6.620
  606    HB3  PHE  76           HB1      PHE  76   6.844   8.836   8.042
  607    HD1  PHE  76           HD1      PHE  76   4.876   6.129   6.424
  608    HD2  PHE  76           HD2      PHE  76   8.091   7.149   9.020
  609    HE1  PHE  76           HE1      PHE  76   5.544   3.762   6.522
  610    HE2  PHE  76           HE2      PHE  76   8.765   4.785   9.121
  611    HZ   PHE  76           HZ       PHE  76   7.490   3.088   7.871
  612    H    ASP  77           HN       ASP  77   5.993  10.756   8.623
  613    HA   ASP  77           HA       ASP  77   6.366  12.323  10.246
  614    HB2  ASP  77           HB2      ASP  77   5.019  10.574  12.294
  615    HB3  ASP  77           HB1      ASP  77   5.213  12.323  12.305
  616    H    TYR  78           HN       TYR  78   8.321  10.579   9.555
  617    HA   TYR  78           HA       TYR  78  10.201   9.440  10.242
  618    HB2  TYR  78           HB2      TYR  78  11.408  10.812  12.080
  619    HB3  TYR  78           HB1      TYR  78  11.085  11.573  10.527
  620    HD1  TYR  78           HD1      TYR  78   9.223  13.214  10.326
  621    HD2  TYR  78           HD2      TYR  78  10.435  11.638  14.087
  622    HE1  TYR  78           HE1      TYR  78   8.051  15.051  11.466
  623    HE2  TYR  78           HE2      TYR  78   9.266  13.470  15.238
  624    HH   TYR  78           HH       TYR  78   8.033  16.208  13.556
  625    H    ASP  79           HN       ASP  79   9.021   7.553  11.042
  626    HA   ASP  79           HA       ASP  79   8.157   7.226  13.670
  627    HB2  ASP  79           HB2      ASP  79   7.892   5.694  11.578
  628    HB3  ASP  79           HB1      ASP  79   9.378   4.951  12.160
  629    HA   PRO  80           HA       PRO  80  11.896   7.102  16.049
  630    HB2  PRO  80           HB2      PRO  80  10.433   5.443  17.987
  631    HB3  PRO  80           HB1      PRO  80  11.102   7.064  18.185
  632    HG2  PRO  80           HG2      PRO  80   8.450   6.621  18.059
  633    HG3  PRO  80           HG1      PRO  80   9.194   8.092  17.405
  634    HD2  PRO  80           HD2      PRO  80   8.256   5.639  15.964
  635    HD3  PRO  80           HD1      PRO  80   8.083   7.349  15.512
  636    H    ASN  81           HN       ASN  81  12.319   5.515  14.113
  637    HA   ASN  81           HA       ASN  81  13.796   3.361  15.052
  638    HB2  ASN  81           HB2      ASN  81  11.596   2.346  15.528
  639    HB3  ASN  81           HB1      ASN  81  11.165   2.504  13.829
  640   HD21  ASN  81          1HE2      ASN  81  11.435   0.138  15.561
  641   HD22  ASN  81          2HE2      ASN  81  12.562  -0.896  14.758
  642    H    GLU  82           HN       GLU  82  15.362   3.515  13.496
  643    HA   GLU  82           HA       GLU  82  14.844   4.509  10.900
  644    HB2  GLU  82           HB2      GLU  82  17.284   3.920  10.512
  645    HB3  GLU  82           HB1      GLU  82  16.949   5.071  11.797
  646    HG2  GLU  82           HG2      GLU  82  18.048   3.802  13.228
  647    HG3  GLU  82           HG1      GLU  82  16.922   2.479  12.935
  648    H    LYS  83           HN       LYS  83  15.597   1.274  12.148
  649    HA   LYS  83           HA       LYS  83  15.789   0.031   9.627
  650    HB2  LYS  83           HB2      LYS  83  16.439  -0.990  11.849
  651    HB3  LYS  83           HB1      LYS  83  14.726  -1.230  12.165
  652    HG2  LYS  83           HG2      LYS  83  15.137  -3.260  11.293
  653    HG3  LYS  83           HG1      LYS  83  14.915  -2.412   9.761
  654    HD2  LYS  83           HD2      LYS  83  16.928  -3.281   9.258
  655    HD3  LYS  83           HD1      LYS  83  17.545  -1.946  10.234
  656    HE2  LYS  83           HE2      LYS  83  18.600  -3.575  11.369
  657    HE3  LYS  83           HE1      LYS  83  17.035  -3.787  12.153
  658    HZ1  LYS  83           HZ1      LYS  83  16.538  -5.437  10.342
  659    HZ2  LYS  83           HZ2      LYS  83  17.721  -5.909  11.454
  660    HZ3  LYS  83           HZ3      LYS  83  18.175  -5.362   9.919
  661    H    SER  84           HN       SER  84  13.111   0.478  11.883
  662    HA   SER  84           HA       SER  84  11.153  -0.605  10.066
  663    HB2  SER  84           HB2      SER  84  10.759   1.022  12.588
  664    HB3  SER  84           HB1      SER  84   9.504   0.123  11.735
  665    HG   SER  84           HG       SER  84  10.285  -1.714  12.482
  666    H    LYS  85           HN       LYS  85  12.632   2.460  10.405
  667    HA   LYS  85           HA       LYS  85  10.705   4.297   9.809
  668    HB2  LYS  85           HB2      LYS  85  12.985   4.929  10.278
  669    HB3  LYS  85           HB1      LYS  85  13.536   4.220   8.769
  670    HG2  LYS  85           HG2      LYS  85  13.083   6.076   7.639
  671    HG3  LYS  85           HG1      LYS  85  11.453   6.167   8.311
  672    HD2  LYS  85           HD2      LYS  85  12.312   8.086   9.192
  673    HD3  LYS  85           HD1      LYS  85  12.799   6.959  10.460
  674    HE2  LYS  85           HE2      LYS  85  14.617   7.452   8.144
  675    HE3  LYS  85           HE1      LYS  85  14.527   8.638   9.445
  676    HZ1  LYS  85           HZ1      LYS  85  14.851   6.505  10.906
  677    HZ2  LYS  85           HZ2      LYS  85  16.177   7.300  10.220
  678    HZ3  LYS  85           HZ3      LYS  85  15.562   5.900   9.495
  679    H    HIS  86           HN       HIS  86  12.744   4.139   7.039
  680    HA   HIS  86           HA       HIS  86  12.384   3.743   4.802
  681    HB2  HIS  86           HB2      HIS  86   9.767   2.483   5.641
  682    HB3  HIS  86           HB1      HIS  86  10.494   2.387   4.042
  683    HD1  HIS  86           HD1      HIS  86  10.319  -0.261   4.555
  684    HD2  HIS  86           HD2      HIS  86  13.111   1.881   6.764
  685    HE1  HIS  86           HE1      HIS  86  11.891  -1.980   5.498
  686    HE2  HIS  86           HE2      HIS  86  13.636  -0.652   6.736
  687    H    LYS  87           HN       LYS  87  10.875   4.402   2.944
  688    HA   LYS  87           HA       LYS  87   8.886   6.435   3.578
  689    HB2  LYS  87           HB2      LYS  87  11.505   7.257   3.196
  690    HB3  LYS  87           HB1      LYS  87  10.765   7.501   1.620
  691    HG2  LYS  87           HG2      LYS  87   9.128   8.461   3.835
  692    HG3  LYS  87           HG1      LYS  87  10.692   9.268   3.697
  693    HD2  LYS  87           HD2      LYS  87  10.062   9.408   1.162
  694    HD3  LYS  87           HD1      LYS  87   8.417   9.184   1.760
  695    HE2  LYS  87           HE2      LYS  87   8.384  11.205   2.836
  696    HE3  LYS  87           HE1      LYS  87  10.131  11.227   3.076
  697    HZ1  LYS  87           HZ1      LYS  87  10.315  12.507   1.298
  698    HZ2  LYS  87           HZ2      LYS  87   8.642  12.466   1.053
  699    HZ3  LYS  87           HZ3      LYS  87   9.631  11.303   0.325
  700    H    PHE  88           HN       PHE  88   7.792   7.300   1.545
  701    HA   PHE  88           HA       PHE  88   7.137   5.102  -0.153
  702    HB2  PHE  88           HB2      PHE  88   5.484   6.744   0.629
  703    HB3  PHE  88           HB1      PHE  88   6.255   7.977  -0.364
  704    HD1  PHE  88           HD1      PHE  88   5.097   4.462  -0.885
  705    HD2  PHE  88           HD2      PHE  88   5.077   8.493  -2.251
  706    HE1  PHE  88           HE1      PHE  88   3.687   3.805  -2.791
  707    HE2  PHE  88           HE2      PHE  88   3.665   7.843  -4.159
  708    HZ   PHE  88           HZ       PHE  88   2.968   5.497  -4.431
  709    H    MET  89           HN       MET  89   8.606   8.321  -1.043
  710    HA   MET  89           HA       MET  89   8.986   7.398  -3.757
  711    HB2  MET  89           HB2      MET  89   9.430   9.948  -2.323
  712    HB3  MET  89           HB1      MET  89  10.679   9.602  -3.502
  713    HG2  MET  89           HG2      MET  89   8.801   9.327  -5.223
  714    HG3  MET  89           HG1      MET  89   7.715   9.994  -4.007
  715    HE1  MET  89           HE1      MET  89   8.274  12.121  -7.096
  716    HE2  MET  89           HE2      MET  89   7.764  13.338  -5.931
  717    HE3  MET  89           HE3      MET  89   6.993  11.754  -5.934
  718    H    VAL  90           HN       VAL  90  10.653   7.307  -0.783
  719    HA   VAL  90           HA       VAL  90  13.304   6.655  -1.671
  720    HB   VAL  90           HB       VAL  90  12.130   6.277   1.073
  721   HG11  VAL  90          HG11      VAL  90  14.715   6.847   1.472
  722   HG12  VAL  90          HG12      VAL  90  14.834   6.050  -0.096
  723   HG13  VAL  90          HG13      VAL  90  14.113   5.201   1.271
  724   HG21  VAL  90          HG21      VAL  90  11.968   8.620   0.053
  725   HG22  VAL  90          HG22      VAL  90  13.727   8.652   0.166
  726   HG23  VAL  90          HG23      VAL  90  12.753   8.468   1.625
  727    H    GLN  91           HN       GLN  91  10.499   4.770  -1.453
  728    HA   GLN  91           HA       GLN  91  11.377   2.379  -0.395
  729    HB2  GLN  91           HB2      GLN  91   9.410   2.942  -2.604
  730    HB3  GLN  91           HB1      GLN  91   9.672   1.325  -1.971
  731    HG2  GLN  91           HG2      GLN  91   9.175   2.422   0.325
  732    HG3  GLN  91           HG1      GLN  91   8.452   3.702  -0.648
  733   HE21  GLN  91          1HE2      GLN  91   7.194   1.854   1.215
  734   HE22  GLN  91          2HE2      GLN  91   5.988   1.008   0.312
  735    H    SER  92           HN       SER  92  12.459   3.803  -3.320
  736    HA   SER  92           HA       SER  92  13.043   1.529  -4.848
  737    HB2  SER  92           HB2      SER  92  14.881   3.074  -5.816
  738    HB3  SER  92           HB1      SER  92  13.197   3.560  -5.994
  739    HG   SER  92           HG       SER  92  14.726   5.205  -5.208
  740    H    MET  93           HN       MET  93  14.521   2.570  -1.910
  741    HA   MET  93           HA       MET  93  17.107   1.471  -2.392
  742    HB2  MET  93           HB2      MET  93  16.413   3.298  -0.682
  743    HB3  MET  93           HB1      MET  93  15.928   1.947   0.333
  744    HG2  MET  93           HG2      MET  93  18.047   1.355   0.797
  745    HG3  MET  93           HG1      MET  93  18.630   1.768  -0.814
  746    HE1  MET  93           HE1      MET  93  19.505   2.349   2.493
  747    HE2  MET  93           HE2      MET  93  20.436   3.832   2.283
  748    HE3  MET  93           HE3      MET  93  20.704   2.462   1.205
  749    H    PHE  94           HN       PHE  94  14.220   0.522  -0.594
  750    HA   PHE  94           HA       PHE  94  15.325  -2.049   0.100
  751    HB2  PHE  94           HB2      PHE  94  13.504  -2.319   1.436
  752    HB3  PHE  94           HB1      PHE  94  13.391  -0.579   1.226
  753    HD1  PHE  94           HD1      PHE  94  12.084  -3.810  -0.030
  754    HD2  PHE  94           HD2      PHE  94  11.487   0.391   0.280
  755    HE1  PHE  94           HE1      PHE  94   9.800  -4.075  -0.896
  756    HE2  PHE  94           HE2      PHE  94   9.199   0.129  -0.582
  757    HZ   PHE  94           HZ       PHE  94   8.353  -2.104  -1.173
  758    H    ALA  95           HN       ALA  95  14.266  -0.859  -2.770
  759    HA   ALA  95           HA       ALA  95  14.303  -3.317  -4.104
  760    HB1  ALA  95           HB1      ALA  95  12.206  -3.928  -3.338
  761    HB2  ALA  95           HB2      ALA  95  11.824  -3.146  -4.872
  762    HB3  ALA  95           HB3      ALA  95  11.602  -2.272  -3.355
  763    HA   PRO  96           HA       PRO  96  15.275   0.604  -6.477
  764    HB2  PRO  96           HB2      PRO  96  16.747  -1.050  -8.254
  765    HB3  PRO  96           HB1      PRO  96  17.390   0.036  -7.022
  766    HG2  PRO  96           HG2      PRO  96  16.946  -2.895  -6.916
  767    HG3  PRO  96           HG1      PRO  96  18.166  -1.909  -6.090
  768    HD2  PRO  96           HD2      PRO  96  16.073  -2.937  -4.771
  769    HD3  PRO  96           HD1      PRO  96  16.712  -1.326  -4.376
  770    H    THR  97           HN       THR  97  14.493  -2.620  -7.754
  771    HA   THR  97           HA       THR  97  13.529  -1.777 -10.241
  772    HB   THR  97           HB       THR  97  14.029  -4.090  -9.938
  773    HG1  THR  97           HG1      THR  97  11.208  -3.905 -10.089
  774   HG21  THR  97          HG21      THR  97  12.823  -5.582  -8.483
  775   HG22  THR  97          HG22      THR  97  11.839  -4.249  -7.881
  776   HG23  THR  97          HG23      THR  97  13.567  -4.295  -7.537
  777    H    ASP  98           HN       ASP  98  12.130  -1.597  -7.097
  778    HA   ASP  98           HA       ASP  98   9.414  -1.614  -7.691
  779    HB2  ASP  98           HB2      ASP  98  10.635  -1.502  -5.400
  780    HB3  ASP  98           HB1      ASP  98  10.550   0.242  -5.624
  781    H    THR  99           HN       THR  99  11.722   1.089  -7.770
  782    HA   THR  99           HA       THR  99   9.859   3.111  -8.344
  783    HB   THR  99           HB       THR  99  12.176   3.827  -9.723
  784    HG1  THR  99           HG1      THR  99  13.815   2.868  -8.826
  785   HG21  THR  99          HG21      THR  99  12.763   5.118  -7.721
  786   HG22  THR  99          HG22      THR  99  11.518   4.253  -6.820
  787   HG23  THR  99          HG23      THR  99  11.067   5.294  -8.171
  788    H    SER 100           HN       SER 100  11.749   0.999 -10.435
  789    HA   SER 100           HA       SER 100  10.713   2.007 -12.888
  790    HB2  SER 100           HB2      SER 100  12.796   0.919 -13.064
  791    HB3  SER 100           HB1      SER 100  12.248  -0.470 -12.125
  792    HG   SER 100           HG       SER 100  11.123   0.205 -14.631
  793    H    ASP 101           HN       ASP 101   9.586  -0.223 -10.531
  794    HA   ASP 101           HA       ASP 101   8.002  -1.941 -12.013
  795    HB2  ASP 101           HB2      ASP 101   8.536  -2.015  -9.525
  796    HB3  ASP 101           HB1      ASP 101   7.214  -0.872  -9.309
  797    H    MET 102           HN       MET 102   7.247   1.343 -10.880
  798    HA   MET 102           HA       MET 102   4.505   1.317 -11.416
  799    HB2  MET 102           HB2      MET 102   6.595   3.417 -11.192
  800    HB3  MET 102           HB1      MET 102   5.106   3.878 -12.004
  801    HG2  MET 102           HG2      MET 102   4.289   2.545  -9.698
  802    HG3  MET 102           HG1      MET 102   5.648   3.548  -9.195
  803    HE1  MET 102           HE1      MET 102   3.930   6.710  -8.424
  804    HE2  MET 102           HE2      MET 102   5.527   6.207  -8.976
  805    HE3  MET 102           HE3      MET 102   4.683   5.267  -7.747
  806    H    GLU 103           HN       GLU 103   7.144   2.464 -13.517
  807    HA   GLU 103           HA       GLU 103   5.466   2.747 -15.805
  808    HB2  GLU 103           HB2      GLU 103   7.587   3.067 -17.036
  809    HB3  GLU 103           HB1      GLU 103   7.476   4.082 -15.604
  810    HG2  GLU 103           HG2      GLU 103   8.971   2.664 -14.398
  811    HG3  GLU 103           HG1      GLU 103   8.954   1.464 -15.689
  812    H    ALA 104           HN       ALA 104   7.596   0.246 -14.586
  813    HA   ALA 104           HA       ALA 104   7.742  -1.370 -16.858
  814    HB1  ALA 104           HB1      ALA 104   9.315  -1.898 -15.285
  815    HB2  ALA 104           HB2      ALA 104   8.152  -3.203 -15.051
  816    HB3  ALA 104           HB3      ALA 104   8.166  -1.825 -13.950
  817    H    VAL 105           HN       VAL 105   5.125  -0.999 -14.587
  818    HA   VAL 105           HA       VAL 105   3.921  -3.502 -14.821
  819    HB   VAL 105           HB       VAL 105   2.527  -0.834 -14.520
  820   HG11  VAL 105          HG11      VAL 105   0.586  -1.914 -14.450
  821   HG12  VAL 105          HG12      VAL 105   1.210  -3.055 -13.258
  822   HG13  VAL 105          HG13      VAL 105   1.424  -3.373 -14.979
  823   HG21  VAL 105          HG21      VAL 105   2.534  -2.172 -12.087
  824   HG22  VAL 105          HG22      VAL 105   3.522  -0.781 -12.530
  825   HG23  VAL 105          HG23      VAL 105   4.161  -2.412 -12.726
  826    H    TRP 106           HN       TRP 106   3.235  -0.576 -16.765
  827    HA   TRP 106           HA       TRP 106   1.641  -2.130 -18.611
  828    HB2  TRP 106           HB2      TRP 106   2.411   0.785 -18.500
  829    HB3  TRP 106           HB1      TRP 106   1.482   0.097 -19.829
  830    HD1  TRP 106           HD1      TRP 106  -0.693  -1.562 -18.532
  831    HE1  TRP 106           HE1      TRP 106  -2.451  -0.554 -16.946
  832    HE3  TRP 106           HE3      TRP 106   1.827   2.649 -17.098
  833    HZ2  TRP 106           HZ2      TRP 106  -2.733   1.726 -15.304
  834    HZ3  TRP 106           HZ3      TRP 106   0.742   4.191 -15.516
  835    HH2  TRP 106           HH2      TRP 106  -1.492   3.738 -14.640
  836    H    LYS 107           HN       LYS 107   4.667  -0.273 -18.783
  837    HA   LYS 107           HA       LYS 107   5.209  -0.874 -21.484
  838    HB2  LYS 107           HB2      LYS 107   6.237   0.863 -19.686
  839    HB3  LYS 107           HB1      LYS 107   7.513  -0.346 -19.718
  840    HG2  LYS 107           HG2      LYS 107   7.355  -0.099 -22.287
  841    HG3  LYS 107           HG1      LYS 107   6.526   1.416 -21.920
  842    HD2  LYS 107           HD2      LYS 107   9.022   0.949 -20.430
  843    HD3  LYS 107           HD1      LYS 107   9.212   1.167 -22.171
  844    HE2  LYS 107           HE2      LYS 107   9.217   3.356 -21.681
  845    HE3  LYS 107           HE1      LYS 107   7.468   3.164 -21.566
  846    HZ1  LYS 107           HZ1      LYS 107   9.450   3.452 -19.432
  847    HZ2  LYS 107           HZ2      LYS 107   8.084   2.506 -19.118
  848    HZ3  LYS 107           HZ3      LYS 107   7.904   4.126 -19.567
  849    H    GLU 108           HN       GLU 108   6.129  -2.517 -18.492
  850    HA   GLU 108           HA       GLU 108   7.739  -4.402 -20.041
  851    HB2  GLU 108           HB2      GLU 108   7.865  -3.376 -17.375
  852    HB3  GLU 108           HB1      GLU 108   7.735  -5.128 -17.305
  853    HG2  GLU 108           HG2      GLU 108  10.042  -4.558 -17.338
  854    HG3  GLU 108           HG1      GLU 108   9.639  -5.259 -18.904
  855    H    ALA 109           HN       ALA 109   4.599  -4.155 -18.786
  856    HA   ALA 109           HA       ALA 109   2.836  -5.590 -18.806
  857    HB1  ALA 109           HB1      ALA 109   4.693  -7.522 -20.185
  858    HB2  ALA 109           HB2      ALA 109   3.737  -6.281 -20.992
  859    HB3  ALA 109           HB3      ALA 109   2.932  -7.599 -20.139
  860    H    LYS 110           HN       LYS 110   2.182  -7.905 -18.108
  861    HA   LYS 110           HA       LYS 110   2.746  -8.196 -15.444
  862    HB2  LYS 110           HB2      LYS 110   1.499 -10.225 -15.487
  863    HB3  LYS 110           HB1      LYS 110   0.763  -9.082 -16.599
  864    HG2  LYS 110           HG2      LYS 110   2.680 -11.187 -17.537
  865    HG3  LYS 110           HG1      LYS 110   0.958 -11.509 -17.337
  866    HD2  LYS 110           HD2      LYS 110   2.187  -9.398 -19.109
  867    HD3  LYS 110           HD1      LYS 110   1.450 -10.910 -19.644
  868    HE2  LYS 110           HE2      LYS 110  -0.482  -9.691 -18.047
  869    HE3  LYS 110           HE1      LYS 110   0.212  -8.380 -19.001
  870    HZ1  LYS 110           HZ1      LYS 110  -1.380 -10.655 -19.856
  871    HZ2  LYS 110           HZ2      LYS 110  -0.100 -10.229 -20.878
  872    HZ3  LYS 110           HZ3      LYS 110  -1.292  -9.091 -20.497
  873    HA   PRO 111           HA       PRO 111   5.786 -11.860 -16.388
  874    HB2  PRO 111           HB2      PRO 111   7.476 -11.463 -18.487
  875    HB3  PRO 111           HB1      PRO 111   5.981 -12.398 -18.597
  876    HG2  PRO 111           HG2      PRO 111   6.504  -9.562 -19.386
  877    HG3  PRO 111           HG1      PRO 111   5.590 -10.814 -20.246
  878    HD2  PRO 111           HD2      PRO 111   4.384  -8.894 -18.821
  879    HD3  PRO 111           HD1      PRO 111   3.722 -10.529 -18.931
  880    H    GLU 112           HN       GLU 112   6.983  -8.720 -17.590
  881    HA   GLU 112           HA       GLU 112   9.432  -8.948 -16.141
  882    HB2  GLU 112           HB2      GLU 112   8.177  -6.960 -17.925
  883    HB3  GLU 112           HB1      GLU 112   9.334  -6.326 -16.762
  884    HG2  GLU 112           HG2      GLU 112  10.142  -8.714 -18.309
  885    HG3  GLU 112           HG1      GLU 112  10.038  -7.182 -19.175
  886    H    ASP 113           HN       ASP 113   6.330  -7.395 -15.503
  887    HA   ASP 113           HA       ASP 113   7.362  -5.913 -13.265
  888    HB2  ASP 113           HB2      ASP 113   5.040  -5.235 -12.871
  889    HB3  ASP 113           HB1      ASP 113   5.512  -5.003 -14.549
  890    H    LEU 114           HN       LEU 114   5.689  -8.996 -13.635
  891    HA   LEU 114           HA       LEU 114   4.854  -9.354 -11.006
  892    HB2  LEU 114           HB2      LEU 114   5.019 -11.797 -11.460
  893    HB3  LEU 114           HB1      LEU 114   4.110 -10.892 -12.653
  894    HG   LEU 114           HG       LEU 114   6.254 -10.882 -14.041
  895   HD11  LEU 114          HD11      LEU 114   7.359 -13.280 -13.216
  896   HD12  LEU 114          HD12      LEU 114   7.126 -12.379 -11.718
  897   HD13  LEU 114          HD13      LEU 114   8.071 -11.678 -13.031
  898   HD21  LEU 114          HD21      LEU 114   5.808 -13.179 -14.873
  899   HD22  LEU 114          HD22      LEU 114   4.353 -12.202 -14.676
  900   HD23  LEU 114          HD23      LEU 114   4.756 -13.434 -13.481
  901    H    MET 115           HN       MET 115   8.034  -9.726 -12.423
  902    HA   MET 115           HA       MET 115   9.256 -11.143 -10.321
  903    HB2  MET 115           HB2      MET 115  10.276 -10.894 -12.541
  904    HB3  MET 115           HB1      MET 115  10.489  -9.172 -12.255
  905    HG2  MET 115           HG2      MET 115  12.331  -9.479 -11.030
  906    HG3  MET 115           HG1      MET 115  11.658 -10.871 -10.186
  907    HE1  MET 115           HE1      MET 115  11.641 -10.652 -14.019
  908    HE2  MET 115           HE2      MET 115  13.184 -11.359 -14.500
  909    HE3  MET 115           HE3      MET 115  13.141  -9.769 -13.738
  910    H    ASP 116           HN       ASP 116   8.595  -7.732 -10.790
  911    HA   ASP 116           HA       ASP 116  10.256  -6.766  -8.702
  912    HB2  ASP 116           HB2      ASP 116   9.502  -5.266 -10.446
  913    HB3  ASP 116           HB1      ASP 116   7.818  -5.564 -10.029
  914    H    SER 117           HN       SER 117   7.004  -8.024  -8.827
  915    HA   SER 117           HA       SER 117   6.128  -7.109  -6.292
  916    HB2  SER 117           HB2      SER 117   5.165  -9.682  -7.444
  917    HB3  SER 117           HB1      SER 117   4.241  -8.400  -6.658
  918    HG   SER 117           HG       SER 117   5.180  -8.565  -9.299
  919    H    LYS 118           HN       LYS 118   7.465 -10.198  -7.404
  920    HA   LYS 118           HA       LYS 118   7.422 -11.556  -4.967
  921    HB2  LYS 118           HB2      LYS 118   9.373 -11.779  -7.270
  922    HB3  LYS 118           HB1      LYS 118   9.289 -12.920  -5.935
  923    HG2  LYS 118           HG2      LYS 118   6.920 -13.374  -6.566
  924    HG3  LYS 118           HG1      LYS 118   7.165 -12.363  -7.992
  925    HD2  LYS 118           HD2      LYS 118   9.077 -13.868  -8.609
  926    HD3  LYS 118           HD1      LYS 118   8.578 -14.933  -7.294
  927    HE2  LYS 118           HE2      LYS 118   6.928 -14.143  -9.692
  928    HE3  LYS 118           HE1      LYS 118   7.671 -15.715  -9.406
  929    HZ1  LYS 118           HZ1      LYS 118   6.232 -15.438  -7.187
  930    HZ2  LYS 118           HZ2      LYS 118   5.646 -16.185  -8.586
  931    HZ3  LYS 118           HZ3      LYS 118   5.259 -14.570  -8.266
  932    H    LEU 119           HN       LEU 119   9.516  -9.116  -6.223
  933    HA   LEU 119           HA       LEU 119  11.638  -9.455  -4.334
  934    HB2  LEU 119           HB2      LEU 119  11.769  -8.270  -6.577
  935    HB3  LEU 119           HB1      LEU 119  10.950  -6.922  -5.811
  936    HG   LEU 119           HG       LEU 119  13.009  -7.323  -4.077
  937   HD11  LEU 119          HD11      LEU 119  14.898  -8.106  -5.029
  938   HD12  LEU 119          HD12      LEU 119  14.475  -7.501  -6.631
  939   HD13  LEU 119          HD13      LEU 119  13.752  -8.995  -6.033
  940   HD21  LEU 119          HD21      LEU 119  13.964  -5.587  -6.107
  941   HD22  LEU 119          HD22      LEU 119  13.204  -5.171  -4.571
  942   HD23  LEU 119          HD23      LEU 119  12.213  -5.401  -6.011
  943    H    ARG 120           HN       ARG 120   8.832  -7.306  -4.542
  944    HA   ARG 120           HA       ARG 120   9.401  -5.923  -2.117
  945    HB2  ARG 120           HB2      ARG 120   7.967  -5.080  -4.026
  946    HB3  ARG 120           HB1      ARG 120   6.713  -6.177  -3.466
  947    HG2  ARG 120           HG2      ARG 120   6.315  -4.965  -1.548
  948    HG3  ARG 120           HG1      ARG 120   7.914  -4.217  -1.566
  949    HD2  ARG 120           HD2      ARG 120   6.824  -2.429  -2.377
  950    HD3  ARG 120           HD1      ARG 120   6.877  -3.304  -3.904
  951    HE   ARG 120           HE       ARG 120   4.566  -2.844  -2.230
  952   HH11  ARG 120          HH11      ARG 120   5.934  -4.735  -4.829
  953   HH12  ARG 120          HH12      ARG 120   4.393  -5.194  -5.470
  954   HH21  ARG 120          HH21      ARG 120   2.542  -3.449  -3.074
  955   HH22  ARG 120          HH22      ARG 120   2.468  -4.465  -4.475
  956    H    CYS 121           HN       CYS 121   7.490  -8.740  -2.973
  957    HA   CYS 121           HA       CYS 121   6.150  -9.000  -0.484
  958    HB2  CYS 121           HB2      CYS 121   6.751 -11.134  -2.543
  959    HB3  CYS 121           HB1      CYS 121   5.554 -11.242  -1.256
  960    HG   CYS 121           HG       CYS 121   5.199  -9.795  -3.913
  961    H    VAL 122           HN       VAL 122   9.219 -10.188  -1.724
  962    HA   VAL 122           HA       VAL 122   9.681 -11.984   0.455
  963    HB   VAL 122           HB       VAL 122  10.760 -12.320  -1.729
  964   HG11  VAL 122          HG11      VAL 122  11.249 -10.153  -2.498
  965   HG12  VAL 122          HG12      VAL 122  12.814 -10.908  -2.204
  966   HG13  VAL 122          HG13      VAL 122  12.161  -9.753  -1.045
  967   HG21  VAL 122          HG21      VAL 122  12.559 -13.337  -0.816
  968   HG22  VAL 122          HG22      VAL 122  11.778 -12.863   0.693
  969   HG23  VAL 122          HG23      VAL 122  13.088 -11.883   0.033
  970    H    PHE 123           HN       PHE 123  10.553  -8.645  -0.248
  971    HA   PHE 123           HA       PHE 123  12.420  -8.299   1.831
  972    HB2  PHE 123           HB2      PHE 123  11.737  -6.753  -0.203
  973    HB3  PHE 123           HB1      PHE 123  10.661  -6.034   0.990
  974    HD1  PHE 123           HD1      PHE 123  11.619  -5.031   3.058
  975    HD2  PHE 123           HD2      PHE 123  14.053  -6.316  -0.188
  976    HE1  PHE 123           HE1      PHE 123  13.479  -3.671   3.921
  977    HE2  PHE 123           HE2      PHE 123  15.918  -4.960   0.668
  978    HZ   PHE 123           HZ       PHE 123  15.633  -3.635   2.726
  979    H    GLU 124           HN       GLU 124   8.918  -7.769   1.702
  980    HA   GLU 124           HA       GLU 124   8.686  -6.777   4.347
  981    HB2  GLU 124           HB2      GLU 124   6.808  -7.748   2.253
  982    HB3  GLU 124           HB1      GLU 124   6.216  -7.699   3.909
  983    HG2  GLU 124           HG2      GLU 124   6.748  -5.331   4.046
  984    HG3  GLU 124           HG1      GLU 124   7.390  -5.370   2.404
  985    H    LEU 125           HN       LEU 125   7.979  -9.976   2.947
  986    HA   LEU 125           HA       LEU 125   7.271 -11.239   5.344
  987    HB2  LEU 125           HB2      LEU 125   6.956 -12.071   2.960
  988    HB3  LEU 125           HB1      LEU 125   8.628 -12.594   3.023
  989    HG   LEU 125           HG       LEU 125   7.961 -13.956   5.082
  990   HD11  LEU 125          HD11      LEU 125   5.394 -14.582   4.671
  991   HD12  LEU 125          HD12      LEU 125   5.350 -12.878   4.217
  992   HD13  LEU 125          HD13      LEU 125   5.912 -13.350   5.821
  993   HD21  LEU 125          HD21      LEU 125   6.758 -15.667   3.524
  994   HD22  LEU 125          HD22      LEU 125   8.441 -15.233   3.226
  995   HD23  LEU 125          HD23      LEU 125   7.158 -14.504   2.260
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1 -15.565  13.040   0.427
    2    H2   MET   1           HT2      MET   1 -15.485  13.900  -1.057
    3    H3   MET   1           HT3      MET   1 -14.055  13.605  -0.155
    4    HA   MET   1           HA       MET   1 -14.579  11.188  -0.432
    5    HB2  MET   1           HB2      MET   1 -16.896  12.209  -1.470
    6    HB3  MET   1           HB1      MET   1 -15.979  11.873  -2.931
    7    HG2  MET   1           HG2      MET   1 -15.581   9.555  -1.866
    8    HG3  MET   1           HG1      MET   1 -16.943   9.981  -0.831
    9    HE1  MET   1           HE1      MET   1 -17.953   7.787  -1.641
   10    HE2  MET   1           HE2      MET   1 -16.937   7.367  -3.020
   11    HE3  MET   1           HE3      MET   1 -18.682   7.521  -3.225
   12    H    ALA   2           HN       ALA   2 -13.817  10.130  -2.597
   13    HA   ALA   2           HA       ALA   2 -11.801  11.908  -3.811
   14    HB1  ALA   2           HB1      ALA   2 -11.398   8.952  -3.553
   15    HB2  ALA   2           HB2      ALA   2 -11.029  10.034  -2.210
   16    HB3  ALA   2           HB3      ALA   2 -10.199  10.229  -3.753
   17    H    LYS   3           HN       LYS   3 -11.036  11.149  -5.973
   18    HA   LYS   3           HA       LYS   3 -13.161  10.949  -7.774
   19    HB2  LYS   3           HB2      LYS   3 -10.239  10.290  -8.167
   20    HB3  LYS   3           HB1      LYS   3 -11.405  10.457  -9.471
   21    HG2  LYS   3           HG2      LYS   3 -10.978  12.684  -7.525
   22    HG3  LYS   3           HG1      LYS   3  -9.872  12.446  -8.880
   23    HD2  LYS   3           HD2      LYS   3 -11.513  12.895 -10.461
   24    HD3  LYS   3           HD1      LYS   3 -12.829  12.538  -9.340
   25    HE2  LYS   3           HE2      LYS   3 -12.995  14.776  -9.194
   26    HE3  LYS   3           HE1      LYS   3 -11.635  14.618  -8.082
   27    HZ1  LYS   3           HZ1      LYS   3 -11.715  15.712 -10.764
   28    HZ2  LYS   3           HZ2      LYS   3 -10.372  14.740 -10.428
   29    HZ3  LYS   3           HZ3      LYS   3 -10.697  16.093  -9.467
   30    H    VAL   4           HN       VAL   4 -14.516   9.280  -7.855
   31    HA   VAL   4           HA       VAL   4 -13.992   6.666  -7.036
   32    HB   VAL   4           HB       VAL   4 -16.049   7.459  -9.096
   33   HG11  VAL   4          HG11      VAL   4 -17.311   5.569  -8.135
   34   HG12  VAL   4          HG12      VAL   4 -15.927   5.195  -7.108
   35   HG13  VAL   4          HG13      VAL   4 -15.785   5.068  -8.861
   36   HG21  VAL   4          HG21      VAL   4 -15.882   8.011  -6.199
   37   HG22  VAL   4          HG22      VAL   4 -17.434   7.425  -6.795
   38   HG23  VAL   4          HG23      VAL   4 -16.724   8.888  -7.476
   39    H    GLU   5           HN       GLU   5 -13.878   8.104 -10.279
   40    HA   GLU   5           HA       GLU   5 -13.357   5.708 -11.670
   41    HB2  GLU   5           HB2      GLU   5 -12.763   8.589 -12.343
   42    HB3  GLU   5           HB1      GLU   5 -12.458   7.262 -13.455
   43    HG2  GLU   5           HG2      GLU   5 -15.171   7.576 -12.269
   44    HG3  GLU   5           HG1      GLU   5 -14.671   8.632 -13.590
   45    H    GLN   6           HN       GLN   6 -11.143   8.243 -10.497
   46    HA   GLN   6           HA       GLN   6  -8.785   6.899 -11.347
   47    HB2  GLN   6           HB2      GLN   6  -9.276   9.148  -9.397
   48    HB3  GLN   6           HB1      GLN   6  -7.667   8.520  -9.711
   49    HG2  GLN   6           HG2      GLN   6  -8.505   9.000 -12.234
   50    HG3  GLN   6           HG1      GLN   6  -9.382  10.252 -11.356
   51   HE21  GLN   6          1HE2      GLN   6  -8.274  12.076 -11.839
   52   HE22  GLN   6          2HE2      GLN   6  -6.580  12.300 -11.573
   53    H    VAL   7           HN       VAL   7 -10.550   7.061  -8.303
   54    HA   VAL   7           HA       VAL   7  -8.624   5.459  -6.882
   55    HB   VAL   7           HB       VAL   7 -11.365   6.343  -5.985
   56   HG11  VAL   7          HG11      VAL   7 -10.348   6.035  -3.712
   57   HG12  VAL   7          HG12      VAL   7  -8.990   5.234  -4.502
   58   HG13  VAL   7          HG13      VAL   7 -10.608   4.544  -4.618
   59   HG21  VAL   7          HG21      VAL   7  -9.330   8.009  -6.634
   60   HG22  VAL   7          HG22      VAL   7  -8.972   7.691  -4.937
   61   HG23  VAL   7          HG23      VAL   7 -10.541   8.353  -5.398
   62    H    LEU   8           HN       LEU   8 -11.400   4.726  -8.799
   63    HA   LEU   8           HA       LEU   8 -12.447   2.519  -7.477
   64    HB2  LEU   8           HB2      LEU   8 -12.498   3.574 -10.187
   65    HB3  LEU   8           HB1      LEU   8 -12.579   1.823 -10.164
   66    HG   LEU   8           HG       LEU   8 -14.436   3.592  -8.578
   67   HD11  LEU   8          HD11      LEU   8 -16.072   2.739 -10.404
   68   HD12  LEU   8          HD12      LEU   8 -14.608   2.540 -11.368
   69   HD13  LEU   8          HD13      LEU   8 -15.041   4.130 -10.740
   70   HD21  LEU   8          HD21      LEU   8 -15.778   1.352  -8.820
   71   HD22  LEU   8          HD22      LEU   8 -14.559   1.541  -7.561
   72   HD23  LEU   8          HD23      LEU   8 -14.171   0.660  -9.039
   73    H    SER   9           HN       SER   9  -9.838   2.537  -9.911
   74    HA   SER   9           HA       SER   9  -8.186   1.046 -10.380
   75    HB2  SER   9           HB2      SER   9  -8.079  -0.380  -7.873
   76    HB3  SER   9           HB1      SER   9  -6.933   0.776  -8.549
   77    HG   SER   9           HG       SER   9  -9.057   1.197  -6.766
   78    H    LEU  10           HN       LEU  10 -11.269  -0.125  -9.694
   79    HA   LEU  10           HA       LEU  10 -10.613  -2.926  -9.848
   80    HB2  LEU  10           HB2      LEU  10 -13.064  -1.348  -9.408
   81    HB3  LEU  10           HB1      LEU  10 -13.272  -2.914 -10.172
   82    HG   LEU  10           HG       LEU  10 -11.877  -3.845  -8.223
   83   HD11  LEU  10          HD11      LEU  10 -11.041  -1.754  -7.350
   84   HD12  LEU  10          HD12      LEU  10 -12.068  -2.529  -6.144
   85   HD13  LEU  10          HD13      LEU  10 -12.684  -1.171  -7.085
   86   HD21  LEU  10          HD21      LEU  10 -14.012  -4.585  -8.087
   87   HD22  LEU  10          HD22      LEU  10 -14.702  -2.972  -8.268
   88   HD23  LEU  10          HD23      LEU  10 -14.058  -3.486  -6.709
   89    H    GLU  11           HN       GLU  11 -11.247  -0.466 -12.152
   90    HA   GLU  11           HA       GLU  11 -12.519  -1.996 -14.141
   91    HB2  GLU  11           HB2      GLU  11 -11.053   0.575 -14.042
   92    HB3  GLU  11           HB1      GLU  11 -11.144  -0.198 -15.619
   93    HG2  GLU  11           HG2      GLU  11 -13.691  -0.400 -15.006
   94    HG3  GLU  11           HG1      GLU  11 -13.307   0.949 -13.938
   95    HA   PRO  12           HA       PRO  12  -8.199  -3.115 -15.788
   96    HB2  PRO  12           HB2      PRO  12  -5.979  -2.280 -14.569
   97    HB3  PRO  12           HB1      PRO  12  -6.905  -1.186 -15.604
   98    HG2  PRO  12           HG2      PRO  12  -6.808  -1.349 -12.624
   99    HG3  PRO  12           HG1      PRO  12  -6.901   0.081 -13.668
  100    HD2  PRO  12           HD2      PRO  12  -9.054  -1.125 -12.362
  101    HD3  PRO  12           HD1      PRO  12  -9.174   0.009 -13.720
  102    H    GLN  13           HN       GLN  13  -9.028  -5.155 -14.904
  103    HA   GLN  13           HA       GLN  13  -8.392  -6.075 -12.328
  104    HB2  GLN  13           HB2      GLN  13  -8.993  -7.611 -14.865
  105    HB3  GLN  13           HB1      GLN  13  -8.899  -8.336 -13.266
  106    HG2  GLN  13           HG2      GLN  13 -10.852  -7.353 -12.554
  107    HG3  GLN  13           HG1      GLN  13 -10.749  -6.047 -13.734
  108   HE21  GLN  13          1HE2      GLN  13 -12.839  -8.115 -13.027
  109   HE22  GLN  13          2HE2      GLN  13 -13.279  -8.807 -14.548
  110    H    HIS  14           HN       HIS  14  -6.498  -5.820 -15.210
  111    HA   HIS  14           HA       HIS  14  -4.508  -7.730 -14.253
  112    HB2  HIS  14           HB2      HIS  14  -3.655  -7.760 -16.405
  113    HB3  HIS  14           HB1      HIS  14  -5.343  -7.394 -16.722
  114    HD1  HIS  14           HD1      HIS  14  -5.903  -4.918 -17.415
  115    HD2  HIS  14           HD2      HIS  14  -1.850  -5.801 -17.160
  116    HE1  HIS  14           HE1      HIS  14  -4.729  -3.034 -18.595
  117    HE2  HIS  14           HE2      HIS  14  -2.280  -3.614 -18.473
  118    H    GLU  15           HN       GLU  15  -2.136  -6.834 -14.846
  119    HA   GLU  15           HA       GLU  15  -0.454  -5.333 -14.460
  120    HB2  GLU  15           HB2      GLU  15  -2.222  -3.580 -15.143
  121    HB3  GLU  15           HB1      GLU  15  -2.422  -3.315 -13.416
  122    HG2  GLU  15           HG2      GLU  15   0.363  -3.282 -14.254
  123    HG3  GLU  15           HG1      GLU  15  -0.618  -2.051 -15.050
  124    H    LEU  16           HN       LEU  16   0.804  -5.826 -12.832
  125    HA   LEU  16           HA       LEU  16   1.660  -5.927 -10.722
  126    HB2  LEU  16           HB2      LEU  16   0.201  -3.856 -10.342
  127    HB3  LEU  16           HB1      LEU  16  -0.957  -4.951  -9.613
  128    HG   LEU  16           HG       LEU  16   1.809  -5.116  -8.579
  129   HD11  LEU  16          HD11      LEU  16   1.927  -3.103  -7.549
  130   HD12  LEU  16          HD12      LEU  16   0.176  -2.934  -7.431
  131   HD13  LEU  16          HD13      LEU  16   0.992  -2.606  -8.959
  132   HD21  LEU  16          HD21      LEU  16   0.790  -5.910  -6.726
  133   HD22  LEU  16          HD22      LEU  16  -0.527  -6.221  -7.856
  134   HD23  LEU  16          HD23      LEU  16  -0.555  -4.777  -6.845
  135    H    LYS  17           HN       LYS  17   1.963  -7.937 -10.123
  136    HA   LYS  17           HA       LYS  17   1.606 -10.083  -9.454
  137    HB2  LYS  17           HB2      LYS  17   0.273  -8.392  -7.684
  138    HB3  LYS  17           HB1      LYS  17  -0.890  -9.663  -8.034
  139    HG2  LYS  17           HG2      LYS  17   1.089 -11.264  -7.550
  140    HG3  LYS  17           HG1      LYS  17   1.793  -9.863  -6.741
  141    HD2  LYS  17           HD2      LYS  17  -1.023 -10.477  -6.090
  142    HD3  LYS  17           HD1      LYS  17   0.182 -11.627  -5.511
  143    HE2  LYS  17           HE2      LYS  17   0.961  -8.858  -5.067
  144    HE3  LYS  17           HE1      LYS  17  -0.559  -9.273  -4.274
  145    HZ1  LYS  17           HZ1      LYS  17   1.002  -9.851  -2.705
  146    HZ2  LYS  17           HZ2      LYS  17   2.125 -10.403  -3.843
  147    HZ3  LYS  17           HZ3      LYS  17   0.757 -11.333  -3.484
  148    H    PHE  18           HN       PHE  18   0.145  -9.025 -11.900
  149    HA   PHE  18           HA       PHE  18  -1.189  -9.885 -13.520
  150    HB2  PHE  18           HB2      PHE  18  -0.029 -12.044 -12.554
  151    HB3  PHE  18           HB1      PHE  18  -1.651 -12.398 -11.967
  152    HD1  PHE  18           HD1      PHE  18  -3.467 -11.715 -13.975
  153    HD2  PHE  18           HD2      PHE  18   0.487 -13.218 -14.444
  154    HE1  PHE  18           HE1      PHE  18  -4.073 -12.608 -16.186
  155    HE2  PHE  18           HE2      PHE  18  -0.111 -14.113 -16.656
  156    HZ   PHE  18           HZ       PHE  18  -2.394 -13.809 -17.529
  157    H    ARG  19           HN       ARG  19  -2.626 -11.399 -10.615
  158    HA   ARG  19           HA       ARG  19  -5.141 -10.028 -11.303
  159    HB2  ARG  19           HB2      ARG  19  -4.562 -12.800 -10.393
  160    HB3  ARG  19           HB1      ARG  19  -6.050 -12.052  -9.828
  161    HG2  ARG  19           HG2      ARG  19  -6.852 -11.768 -12.042
  162    HG3  ARG  19           HG1      ARG  19  -5.286 -12.198 -12.731
  163    HD2  ARG  19           HD2      ARG  19  -5.605 -14.425 -12.417
  164    HD3  ARG  19           HD1      ARG  19  -6.565 -14.192 -10.957
  165    HE   ARG  19           HE       ARG  19  -7.936 -13.286 -13.284
  166   HH11  ARG  19          HH11      ARG  19  -7.102 -16.150 -11.474
  167   HH12  ARG  19          HH12      ARG  19  -8.468 -17.054 -12.036
  168   HH21  ARG  19          HH21      ARG  19  -9.732 -14.473 -14.024
  169   HH22  ARG  19          HH22      ARG  19  -9.961 -16.102 -13.484
  170    H    GLY  20           HN       GLY  20  -3.426 -11.448  -8.520
  171    HA2  GLY  20           HA2      GLY  20  -4.335 -10.936  -6.252
  172    HA3  GLY  20           HA1      GLY  20  -2.884 -10.025  -6.597
  173    HA   PRO  21           HA       PRO  21  -4.490  -5.954  -6.161
  174    HB2  PRO  21           HB2      PRO  21  -5.246  -5.414  -8.895
  175    HB3  PRO  21           HB1      PRO  21  -3.893  -4.753  -7.976
  176    HG2  PRO  21           HG2      PRO  21  -3.943  -6.987  -9.890
  177    HG3  PRO  21           HG1      PRO  21  -2.579  -5.993  -9.353
  178    HD2  PRO  21           HD2      PRO  21  -2.844  -8.568  -8.608
  179    HD3  PRO  21           HD1      PRO  21  -2.160  -7.345  -7.514
  180    H    PHE  22           HN       PHE  22  -6.354  -7.850  -8.517
  181    HA   PHE  22           HA       PHE  22  -8.811  -6.551  -7.953
  182    HB2  PHE  22           HB2      PHE  22  -8.021  -8.107  -9.969
  183    HB3  PHE  22           HB1      PHE  22  -8.803  -9.343  -8.986
  184    HD1  PHE  22           HD1      PHE  22  -9.690  -5.781  -9.617
  185    HD2  PHE  22           HD2      PHE  22 -10.801  -9.871 -10.002
  186    HE1  PHE  22           HE1      PHE  22 -11.879  -5.098 -10.509
  187    HE2  PHE  22           HE2      PHE  22 -12.991  -9.197 -10.897
  188    HZ   PHE  22           HZ       PHE  22 -13.532  -6.807 -11.152
  189    H    THR  23           HN       THR  23  -7.653  -9.823  -7.078
  190    HA   THR  23           HA       THR  23  -9.850 -10.272  -5.330
  191    HB   THR  23           HB       THR  23  -7.337 -11.826  -4.995
  192    HG1  THR  23           HG1      THR  23  -7.547 -12.802  -6.942
  193   HG21  THR  23          HG21      THR  23 -10.086 -12.221  -4.462
  194   HG22  THR  23          HG22      THR  23  -8.731 -13.304  -4.141
  195   HG23  THR  23          HG23      THR  23  -9.589 -13.395  -5.679
  196    H    ASP  24           HN       ASP  24  -6.393  -9.667  -4.626
  197    HA   ASP  24           HA       ASP  24  -6.792  -9.613  -1.820
  198    HB2  ASP  24           HB2      ASP  24  -4.642 -10.023  -3.273
  199    HB3  ASP  24           HB1      ASP  24  -4.432  -8.287  -3.069
  200    H    VAL  25           HN       VAL  25  -6.079  -6.923  -4.084
  201    HA   VAL  25           HA       VAL  25  -6.270  -4.968  -2.030
  202    HB   VAL  25           HB       VAL  25  -6.470  -4.474  -4.993
  203   HG11  VAL  25          HG11      VAL  25  -5.829  -2.682  -2.662
  204   HG12  VAL  25          HG12      VAL  25  -7.187  -2.549  -3.779
  205   HG13  VAL  25          HG13      VAL  25  -5.545  -2.247  -4.348
  206   HG21  VAL  25          HG21      VAL  25  -4.440  -5.768  -4.145
  207   HG22  VAL  25          HG22      VAL  25  -3.994  -4.282  -3.306
  208   HG23  VAL  25          HG23      VAL  25  -4.129  -4.296  -5.065
  209    H    VAL  26           HN       VAL  26  -8.656  -6.023  -4.446
  210    HA   VAL  26           HA       VAL  26 -10.505  -3.991  -4.039
  211    HB   VAL  26           HB       VAL  26 -11.065  -6.856  -4.791
  212   HG11  VAL  26          HG11      VAL  26 -13.100  -5.491  -5.875
  213   HG12  VAL  26          HG12      VAL  26 -12.841  -4.524  -4.423
  214   HG13  VAL  26          HG13      VAL  26 -13.187  -6.248  -4.285
  215   HG21  VAL  26          HG21      VAL  26 -10.919  -4.408  -6.544
  216   HG22  VAL  26          HG22      VAL  26 -11.039  -6.093  -7.052
  217   HG23  VAL  26          HG23      VAL  26  -9.562  -5.506  -6.287
  218    H    THR  27           HN       THR  27  -9.904  -6.824  -2.045
  219    HA   THR  27           HA       THR  27 -12.297  -6.876  -0.619
  220    HB   THR  27           HB       THR  27  -9.564  -7.362   0.575
  221    HG1  THR  27           HG1      THR  27  -9.462  -9.179  -0.491
  222   HG21  THR  27          HG21      THR  27 -12.265  -8.519   1.209
  223   HG22  THR  27          HG22      THR  27 -11.281  -7.477   2.239
  224   HG23  THR  27          HG23      THR  27 -10.737  -9.112   1.859
  225    H    THR  28           HN       THR  28  -9.313  -5.064   0.103
  226    HA   THR  28           HA       THR  28 -10.468  -3.632   2.295
  227    HB   THR  28           HB       THR  28  -8.073  -2.770   0.671
  228    HG1  THR  28           HG1      THR  28  -7.664  -4.876   1.209
  229   HG21  THR  28          HG21      THR  28  -8.544  -1.124   2.266
  230   HG22  THR  28          HG22      THR  28  -7.260  -2.105   2.975
  231   HG23  THR  28          HG23      THR  28  -8.929  -2.317   3.506
  232    H    ASN  29           HN       ASN  29  -9.961  -3.075  -1.105
  233    HA   ASN  29           HA       ASN  29 -10.708  -0.383  -1.284
  234    HB2  ASN  29           HB2      ASN  29  -9.676  -2.165  -3.018
  235    HB3  ASN  29           HB1      ASN  29 -11.349  -2.154  -3.570
  236   HD21  ASN  29          1HE2      ASN  29 -12.258  -0.179  -4.287
  237   HD22  ASN  29          2HE2      ASN  29 -11.250   1.098  -4.867
  238    H    LEU  30           HN       LEU  30 -12.622  -3.305  -1.151
  239    HA   LEU  30           HA       LEU  30 -15.002  -2.424  -2.272
  240    HB2  LEU  30           HB2      LEU  30 -14.670  -4.734  -1.678
  241    HB3  LEU  30           HB1      LEU  30 -14.542  -4.326   0.022
  242    HG   LEU  30           HG       LEU  30 -16.729  -5.378  -0.802
  243   HD11  LEU  30          HD11      LEU  30 -17.842  -4.443   0.957
  244   HD12  LEU  30          HD12      LEU  30 -17.294  -2.809   0.581
  245   HD13  LEU  30          HD13      LEU  30 -16.193  -3.954   1.347
  246   HD21  LEU  30          HD21      LEU  30 -18.147  -4.256  -2.141
  247   HD22  LEU  30          HD22      LEU  30 -16.682  -3.432  -2.676
  248   HD23  LEU  30          HD23      LEU  30 -17.718  -2.687  -1.459
  249    H    LYS  31           HN       LYS  31 -13.907  -2.072   1.099
  250    HA   LYS  31           HA       LYS  31 -16.261  -0.438   1.677
  251    HB2  LYS  31           HB2      LYS  31 -14.066  -1.591   3.385
  252    HB3  LYS  31           HB1      LYS  31 -15.160  -0.360   4.003
  253    HG2  LYS  31           HG2      LYS  31 -16.554  -2.567   2.720
  254    HG3  LYS  31           HG1      LYS  31 -15.561  -3.075   4.088
  255    HD2  LYS  31           HD2      LYS  31 -16.774  -1.831   5.601
  256    HD3  LYS  31           HD1      LYS  31 -17.320  -0.681   4.377
  257    HE2  LYS  31           HE2      LYS  31 -19.261  -1.802   4.508
  258    HE3  LYS  31           HE1      LYS  31 -18.448  -2.984   3.483
  259    HZ1  LYS  31           HZ1      LYS  31 -19.499  -4.020   5.402
  260    HZ2  LYS  31           HZ2      LYS  31 -18.566  -3.077   6.449
  261    HZ3  LYS  31           HZ3      LYS  31 -17.819  -4.221   5.452
  262    H    LEU  32           HN       LEU  32 -13.686   0.182   0.033
  263    HA   LEU  32           HA       LEU  32 -12.042   1.814  -0.098
  264    HB2  LEU  32           HB2      LEU  32 -14.629   2.568  -0.816
  265    HB3  LEU  32           HB1      LEU  32 -13.989   3.948   0.056
  266    HG   LEU  32           HG       LEU  32 -12.485   2.655  -2.223
  267   HD11  LEU  32          HD11      LEU  32 -14.249   3.334  -3.468
  268   HD12  LEU  32          HD12      LEU  32 -13.435   4.893  -3.332
  269   HD13  LEU  32          HD13      LEU  32 -14.789   4.510  -2.270
  270   HD21  LEU  32          HD21      LEU  32 -12.165   5.040  -0.500
  271   HD22  LEU  32          HD22      LEU  32 -11.776   5.235  -2.209
  272   HD23  LEU  32          HD23      LEU  32 -10.949   4.007  -1.251
  273    H    GLY  33           HN       GLY  33 -12.095   1.080   2.552
  274    HA2  GLY  33           HA2      GLY  33 -10.659   2.822   3.930
  275    HA3  GLY  33           HA1      GLY  33 -12.253   3.533   4.126
  276    H    ASN  34           HN       ASN  34 -13.485   0.799   4.109
  277    HA   ASN  34           HA       ASN  34 -14.192  -0.727   5.644
  278    HB2  ASN  34           HB2      ASN  34 -11.253  -0.582   6.091
  279    HB3  ASN  34           HB1      ASN  34 -12.216  -1.415   7.307
  280   HD21  ASN  34          1HE2      ASN  34 -14.101  -2.691   5.921
  281   HD22  ASN  34          2HE2      ASN  34 -13.406  -3.822   4.816
  282    HA   PRO  35           HA       PRO  35 -15.413   1.368   9.328
  283    HB2  PRO  35           HB2      PRO  35 -15.616  -0.613  11.174
  284    HB3  PRO  35           HB1      PRO  35 -16.764  -0.421   9.844
  285    HG2  PRO  35           HG2      PRO  35 -14.429  -2.281  10.077
  286    HG3  PRO  35           HG1      PRO  35 -16.061  -2.605   9.462
  287    HD2  PRO  35           HD2      PRO  35 -13.950  -2.157   7.827
  288    HD3  PRO  35           HD1      PRO  35 -15.605  -1.677   7.403
  289    H    THR  36           HN       THR  36 -12.870   1.975   9.015
  290    HA   THR  36           HA       THR  36 -11.869   2.290  11.651
  291    HB   THR  36           HB       THR  36  -9.603   1.132  10.925
  292    HG1  THR  36           HG1      THR  36 -10.317   0.483   8.883
  293   HG21  THR  36          HG21      THR  36 -11.539   0.425  12.685
  294   HG22  THR  36          HG22      THR  36 -10.027  -0.448  12.442
  295   HG23  THR  36          HG23      THR  36 -11.494  -0.983  11.624
  296    H    ASP  37           HN       ASP  37  -9.287   2.974  11.243
  297    HA   ASP  37           HA       ASP  37  -8.065   4.796  10.601
  298    HB2  ASP  37           HB2      ASP  37  -8.859   4.442   7.762
  299    HB3  ASP  37           HB1      ASP  37  -7.256   4.587   8.474
  300    H    ARG  38           HN       ARG  38 -10.719   5.465  11.371
  301    HA   ARG  38           HA       ARG  38 -11.252   7.759   9.596
  302    HB2  ARG  38           HB2      ARG  38 -13.071   5.872  11.000
  303    HB3  ARG  38           HB1      ARG  38 -13.578   7.552  10.896
  304    HG2  ARG  38           HG2      ARG  38 -12.623   6.608   8.347
  305    HG3  ARG  38           HG1      ARG  38 -13.903   5.568   8.973
  306    HD2  ARG  38           HD2      ARG  38 -14.032   8.560   8.613
  307    HD3  ARG  38           HD1      ARG  38 -14.849   7.350   7.624
  308    HE   ARG  38           HE       ARG  38 -15.624   6.978  10.285
  309   HH11  ARG  38          HH11      ARG  38 -15.979   9.330   7.732
  310   HH12  ARG  38          HH12      ARG  38 -17.510   9.903   8.302
  311   HH21  ARG  38          HH21      ARG  38 -17.636   7.731  11.037
  312   HH22  ARG  38          HH22      ARG  38 -18.452   8.995  10.180
  313    H    ASN  39           HN       ASN  39 -12.804   9.341  11.101
  314    HA   ASN  39           HA       ASN  39 -12.755  10.944  12.689
  315    HB2  ASN  39           HB2      ASN  39 -12.875   8.606  14.028
  316    HB3  ASN  39           HB1      ASN  39 -11.356   9.231  14.663
  317   HD21  ASN  39          1HE2      ASN  39 -11.732  10.049  16.588
  318   HD22  ASN  39          2HE2      ASN  39 -13.035  11.103  17.009
  319    H    VAL  40           HN       VAL  40 -11.155  11.859  14.487
  320    HA   VAL  40           HA       VAL  40  -9.063  13.095  13.201
  321    HB   VAL  40           HB       VAL  40  -8.134  13.619  15.440
  322   HG11  VAL  40          HG11      VAL  40 -10.957  14.037  14.673
  323   HG12  VAL  40          HG12      VAL  40  -9.678  15.211  14.982
  324   HG13  VAL  40          HG13      VAL  40 -10.521  14.449  16.331
  325   HG21  VAL  40          HG21      VAL  40  -8.390  11.878  16.876
  326   HG22  VAL  40          HG22      VAL  40  -9.956  11.414  16.211
  327   HG23  VAL  40          HG23      VAL  40  -9.839  12.785  17.314
  328    H    CYS  41           HN       CYS  41  -6.681  12.938  14.143
  329    HA   CYS  41           HA       CYS  41  -4.710  11.799  14.104
  330    HB2  CYS  41           HB2      CYS  41  -6.421   9.524  15.136
  331    HB3  CYS  41           HB1      CYS  41  -4.661   9.559  15.148
  332    HG   CYS  41           HG       CYS  41  -5.295  10.318  17.476
  333    H    PHE  42           HN       PHE  42  -3.616   9.769  13.124
  334    HA   PHE  42           HA       PHE  42  -4.861   8.157  11.244
  335    HB2  PHE  42           HB2      PHE  42  -4.477  10.883  10.328
  336    HB3  PHE  42           HB1      PHE  42  -3.597   9.743   9.316
  337    HD1  PHE  42           HD2      PHE  42  -5.277   7.418   9.210
  338    HD2  PHE  42           HD1      PHE  42  -6.379  11.528   9.218
  339    HE1  PHE  42           HE2      PHE  42  -7.362   6.857   8.030
  340    HE2  PHE  42           HE1      PHE  42  -8.467  10.975   8.038
  341    HZ   PHE  42           HZ       PHE  42  -8.959   8.636   7.443
  342    H    LYS  43           HN       LYS  43  -1.964  10.220  10.960
  343    HA   LYS  43           HA       LYS  43  -0.255   8.245  10.029
  344    HB2  LYS  43           HB2      LYS  43   1.586   9.723  10.833
  345    HB3  LYS  43           HB1      LYS  43   0.367  10.553   9.875
  346    HG2  LYS  43           HG2      LYS  43  -0.675  11.348  11.977
  347    HG3  LYS  43           HG1      LYS  43   0.658  10.612  12.870
  348    HD2  LYS  43           HD2      LYS  43   2.211  12.019  11.454
  349    HD3  LYS  43           HD1      LYS  43   0.777  12.880  10.893
  350    HE2  LYS  43           HE2      LYS  43   0.360  13.804  12.972
  351    HE3  LYS  43           HE1      LYS  43   1.267  12.554  13.823
  352    HZ1  LYS  43           HZ1      LYS  43   2.205  14.996  13.378
  353    HZ2  LYS  43           HZ2      LYS  43   2.795  14.220  11.997
  354    HZ3  LYS  43           HZ3      LYS  43   3.202  13.638  13.532
  355    H    VAL  44           HN       VAL  44   0.259   6.374  10.953
  356    HA   VAL  44           HA       VAL  44  -0.084   5.634  13.594
  357    HB   VAL  44           HB       VAL  44   2.198   4.495  12.015
  358   HG11  VAL  44          HG11      VAL  44   2.086   3.264  13.910
  359   HG12  VAL  44          HG12      VAL  44   0.852   2.401  12.993
  360   HG13  VAL  44          HG13      VAL  44   0.379   3.621  14.174
  361   HG21  VAL  44          HG21      VAL  44   0.845   4.215  10.250
  362   HG22  VAL  44          HG22      VAL  44  -0.599   4.618  11.175
  363   HG23  VAL  44          HG23      VAL  44   0.055   2.980  11.228
  364    H    LYS  45           HN       LYS  45   2.720   7.120  12.060
  365    HA   LYS  45           HA       LYS  45   4.559   8.149  12.902
  366    HB2  LYS  45           HB2      LYS  45   2.987   9.430  14.243
  367    HB3  LYS  45           HB1      LYS  45   2.929   8.155  15.449
  368    HG2  LYS  45           HG2      LYS  45   5.371   8.527  15.839
  369    HG3  LYS  45           HG1      LYS  45   5.258   9.935  14.780
  370    HD2  LYS  45           HD2      LYS  45   3.182  10.366  16.493
  371    HD3  LYS  45           HD1      LYS  45   4.355   9.576  17.548
  372    HE2  LYS  45           HE2      LYS  45   5.527  11.620  15.822
  373    HE3  LYS  45           HE1      LYS  45   4.303  12.249  16.924
  374    HZ1  LYS  45           HZ1      LYS  45   6.894  11.022  17.528
  375    HZ2  LYS  45           HZ2      LYS  45   5.634  10.810  18.636
  376    HZ3  LYS  45           HZ3      LYS  45   6.149  12.368  18.230
  377    H    THR  46           HN       THR  46   3.683   6.433  15.884
  378    HA   THR  46           HA       THR  46   6.293   5.121  15.819
  379    HB   THR  46           HB       THR  46   5.357   4.384  18.199
  380    HG1  THR  46           HG1      THR  46   3.854   5.713  18.992
  381   HG21  THR  46          HG21      THR  46   5.966   7.022  18.761
  382   HG22  THR  46          HG22      THR  46   6.867   6.666  17.286
  383   HG23  THR  46          HG23      THR  46   7.087   5.661  18.719
  384    H    THR  47           HN       THR  47   5.270   3.830  13.959
  385    HA   THR  47           HA       THR  47   3.336   1.842  14.551
  386    HB   THR  47           HB       THR  47   5.237   1.204  12.401
  387    HG1  THR  47           HG1      THR  47   3.934   3.707  12.502
  388   HG21  THR  47          HG21      THR  47   2.785   1.741  11.281
  389   HG22  THR  47          HG22      THR  47   2.383   1.113  12.878
  390   HG23  THR  47          HG23      THR  47   3.383   0.160  11.783
  391    H    ALA  48           HN       ALA  48   3.533  -0.068  15.521
  392    HA   ALA  48           HA       ALA  48   6.231  -0.988  16.228
  393    HB1  ALA  48           HB1      ALA  48   4.727  -2.508  17.791
  394    HB2  ALA  48           HB2      ALA  48   3.573  -1.198  17.534
  395    HB3  ALA  48           HB3      ALA  48   5.156  -0.854  18.233
  396    HA   PRO  49           HA       PRO  49   5.080  -3.994  12.940
  397    HB2  PRO  49           HB2      PRO  49   7.667  -4.629  12.343
  398    HB3  PRO  49           HB1      PRO  49   6.808  -3.262  11.627
  399    HG2  PRO  49           HG2      PRO  49   8.745  -3.298  13.907
  400    HG3  PRO  49           HG1      PRO  49   8.622  -2.150  12.560
  401    HD2  PRO  49           HD2      PRO  49   7.661  -1.585  15.014
  402    HD3  PRO  49           HD1      PRO  49   6.870  -1.000  13.535
  403    H    ARG  50           HN       ARG  50   4.247  -5.621  14.191
  404    HA   ARG  50           HA       ARG  50   6.112  -7.228  15.786
  405    HB2  ARG  50           HB2      ARG  50   3.169  -6.760  15.863
  406    HB3  ARG  50           HB1      ARG  50   3.770  -8.315  16.422
  407    HG2  ARG  50           HG2      ARG  50   5.189  -5.977  17.491
  408    HG3  ARG  50           HG1      ARG  50   3.500  -6.127  17.982
  409    HD2  ARG  50           HD2      ARG  50   4.665  -7.307  19.623
  410    HD3  ARG  50           HD1      ARG  50   4.082  -8.564  18.533
  411    HE   ARG  50           HE       ARG  50   6.545  -8.013  17.567
  412   HH11  ARG  50          HH11      ARG  50   5.363  -8.801  20.755
  413   HH12  ARG  50          HH12      ARG  50   6.832  -9.576  21.244
  414   HH21  ARG  50          HH21      ARG  50   8.478  -9.032  18.208
  415   HH22  ARG  50          HH22      ARG  50   8.601  -9.708  19.799
  416    H    ARG  51           HN       ARG  51   3.955  -7.357  13.036
  417    HA   ARG  51           HA       ARG  51   4.981 -10.047  12.441
  418    HB2  ARG  51           HB2      ARG  51   2.140  -9.090  12.420
  419    HB3  ARG  51           HB1      ARG  51   2.644 -10.369  11.323
  420    HG2  ARG  51           HG2      ARG  51   3.492 -11.619  13.326
  421    HG3  ARG  51           HG1      ARG  51   2.707 -10.397  14.327
  422    HD2  ARG  51           HD2      ARG  51   1.382 -12.502  13.918
  423    HD3  ARG  51           HD1      ARG  51   0.560 -10.993  13.536
  424    HE   ARG  51           HE       ARG  51   1.486 -13.012  11.651
  425   HH11  ARG  51          HH11      ARG  51   0.092  -9.845  12.143
  426   HH12  ARG  51          HH12      ARG  51  -0.543  -9.742  10.537
  427   HH21  ARG  51          HH21      ARG  51   0.652 -12.871   9.541
  428   HH22  ARG  51          HH22      ARG  51  -0.226 -11.456   9.060
  429    H    TYR  52           HN       TYR  52   5.587  -7.220  11.523
  430    HA   TYR  52           HA       TYR  52   6.147  -6.145   9.600
  431    HB2  TYR  52           HB2      TYR  52   6.338  -9.023   8.951
  432    HB3  TYR  52           HB1      TYR  52   6.261  -7.937   7.568
  433    HD1  TYR  52           HD1      TYR  52   7.863  -5.785   7.861
  434    HD2  TYR  52           HD2      TYR  52   8.441  -9.573   9.707
  435    HE1  TYR  52           HE1      TYR  52  10.261  -5.293   8.107
  436    HE2  TYR  52           HE2      TYR  52  10.839  -9.092   9.960
  437    HH   TYR  52           HH       TYR  52  12.153  -5.967   9.420
  438    H    CYS  53           HN       CYS  53   4.578  -4.787   9.036
  439    HA   CYS  53           HA       CYS  53   2.978  -3.932   7.581
  440    HB2  CYS  53           HB2      CYS  53   3.482  -5.672   5.899
  441    HB3  CYS  53           HB1      CYS  53   2.410  -6.790   6.727
  442    HG   CYS  53           HG       CYS  53   1.070  -5.760   4.724
  443    H    VAL  54           HN       VAL  54   1.734  -3.139   9.134
  444    HA   VAL  54           HA       VAL  54  -0.577  -4.747   9.968
  445    HB   VAL  54           HB       VAL  54  -0.434  -3.774  12.251
  446   HG11  VAL  54          HG11      VAL  54   2.090  -5.282  11.647
  447   HG12  VAL  54          HG12      VAL  54   0.501  -6.043  11.556
  448   HG13  VAL  54          HG13      VAL  54   1.070  -5.368  13.084
  449   HG21  VAL  54          HG21      VAL  54   2.129  -2.673  11.153
  450   HG22  VAL  54          HG22      VAL  54   1.931  -2.972  12.880
  451   HG23  VAL  54          HG23      VAL  54   0.857  -1.844  12.050
  452    H    ARG  55           HN       ARG  55  -2.346  -3.348  10.887
  453    HA   ARG  55           HA       ARG  55  -2.222  -0.578   9.958
  454    HB2  ARG  55           HB2      ARG  55  -3.901  -2.720   8.822
  455    HB3  ARG  55           HB1      ARG  55  -4.736  -1.209   9.159
  456    HG2  ARG  55           HG2      ARG  55  -3.313   0.007   7.711
  457    HG3  ARG  55           HG1      ARG  55  -2.192  -1.348   7.565
  458    HD2  ARG  55           HD2      ARG  55  -4.942  -1.985   6.793
  459    HD3  ARG  55           HD1      ARG  55  -4.189  -0.740   5.796
  460    HE   ARG  55           HE       ARG  55  -2.311  -2.707   5.936
  461   HH11  ARG  55          HH11      ARG  55  -5.662  -2.597   4.967
  462   HH12  ARG  55          HH12      ARG  55  -5.502  -3.880   3.815
  463   HH21  ARG  55          HH21      ARG  55  -2.098  -4.395   4.421
  464   HH22  ARG  55          HH22      ARG  55  -3.477  -4.902   3.506
  465    H    SER  56           HN       SER  56  -2.445  -2.100  12.603
  466    HA   SER  56           HA       SER  56  -4.283  -0.260  13.799
  467    HB2  SER  56           HB2      SER  56  -5.646  -2.203  14.857
  468    HB3  SER  56           HB1      SER  56  -6.037  -1.681  13.218
  469    HG   SER  56           HG       SER  56  -4.272  -3.820  13.802
  470    H    ASN  57           HN       ASN  57  -1.559  -0.684  14.267
  471    HA   ASN  57           HA       ASN  57  -1.314  -2.304  16.654
  472    HB2  ASN  57           HB2      ASN  57   0.476  -1.251  14.690
  473    HB3  ASN  57           HB1      ASN  57   0.997  -0.691  16.277
  474   HD21  ASN  57          1HE2      ASN  57   1.440  -2.264  17.900
  475   HD22  ASN  57          2HE2      ASN  57   1.917  -3.864  17.458
  476    H    SER  58           HN       SER  58  -1.512   1.117  15.811
  477    HA   SER  58           HA       SER  58  -0.973   1.948  18.536
  478    HB2  SER  58           HB2      SER  58  -1.496   4.245  17.624
  479    HB3  SER  58           HB1      SER  58  -0.163   3.409  16.827
  480    HG   SER  58           HG       SER  58  -1.353   3.152  15.059
  481    H    GLY  59           HN       GLY  59  -3.830   1.601  16.473
  482    HA2  GLY  59           HA2      GLY  59  -5.666   1.101  18.402
  483    HA3  GLY  59           HA1      GLY  59  -5.591   2.857  18.361
  484    H    ILE  60           HN       ILE  60  -5.261   0.616  15.652
  485    HA   ILE  60           HA       ILE  60  -6.346   0.353  13.716
  486    HB   ILE  60           HB       ILE  60  -8.680   0.136  13.679
  487   HG12  ILE  60          HG12      ILE  60  -9.165   1.416  16.327
  488   HG13  ILE  60          HG11      ILE  60  -8.953   2.474  14.940
  489   HG21  ILE  60          HG21      ILE  60  -7.568  -0.523  16.389
  490   HG22  ILE  60          HG22      ILE  60  -7.692  -1.569  14.974
  491   HG23  ILE  60          HG23      ILE  60  -9.149  -1.072  15.834
  492   HD11  ILE  60          HD11      ILE  60 -10.848   0.214  14.687
  493   HD12  ILE  60          HD12      ILE  60 -10.895   1.823  13.965
  494   HD13  ILE  60          HD13      ILE  60 -11.319   1.606  15.662
  495    H    ILE  61           HN       ILE  61  -7.285   3.424  15.259
  496    HA   ILE  61           HA       ILE  61  -7.833   4.634  12.698
  497    HB   ILE  61           HB       ILE  61  -8.238   5.293  15.524
  498   HG12  ILE  61          HG12      ILE  61  -9.698   6.017  12.979
  499   HG13  ILE  61          HG11      ILE  61 -10.048   4.643  14.020
  500   HG21  ILE  61          HG21      ILE  61  -7.615   7.504  13.577
  501   HG22  ILE  61          HG22      ILE  61  -6.757   7.119  15.071
  502   HG23  ILE  61          HG23      ILE  61  -8.410   7.733  15.136
  503   HD11  ILE  61          HD11      ILE  61 -10.187   7.470  15.008
  504   HD12  ILE  61          HD12      ILE  61 -10.869   6.015  15.735
  505   HD13  ILE  61          HD13      ILE  61 -11.554   6.660  14.242
  506    H    ASP  62           HN       ASP  62  -5.265   4.697  15.093
  507    HA   ASP  62           HA       ASP  62  -3.842   6.801  13.717
  508    HB2  ASP  62           HB2      ASP  62  -3.345   5.189  16.203
  509    HB3  ASP  62           HB1      ASP  62  -2.044   6.130  15.479
  510    H    ALA  63           HN       ALA  63  -3.820   3.331  14.018
  511    HA   ALA  63           HA       ALA  63  -1.297   3.045  12.636
  512    HB1  ALA  63           HB1      ALA  63  -2.421   0.554  12.668
  513    HB2  ALA  63           HB2      ALA  63  -3.116   1.317  14.097
  514    HB3  ALA  63           HB3      ALA  63  -1.365   1.229  13.906
  515    H    GLY  64           HN       GLY  64  -4.542   3.441  11.662
  516    HA2  GLY  64           HA2      GLY  64  -4.458   1.845   9.288
  517    HA3  GLY  64           HA1      GLY  64  -5.657   3.064   9.677
  518    H    ALA  65           HN       ALA  65  -2.701   4.555   9.912
  519    HA   ALA  65           HA       ALA  65  -3.119   5.972   7.455
  520    HB1  ALA  65           HB1      ALA  65  -0.757   6.921   8.238
  521    HB2  ALA  65           HB2      ALA  65  -1.292   6.216   9.763
  522    HB3  ALA  65           HB3      ALA  65  -2.282   7.436   8.959
  523    H    SER  66           HN       SER  66  -1.728   3.021   7.986
  524    HA   SER  66           HA       SER  66   0.508   3.344   6.167
  525    HB2  SER  66           HB2      SER  66   0.409   0.685   6.538
  526    HB3  SER  66           HB1      SER  66   1.159   1.781   7.697
  527    HG   SER  66           HG       SER  66  -1.564   1.015   7.830
  528    H    ILE  67           HN       ILE  67  -2.616   3.351   5.534
  529    HA   ILE  67           HA       ILE  67  -2.797   1.255   3.563
  530    HB   ILE  67           HB       ILE  67  -4.659   3.599   3.929
  531   HG12  ILE  67          HG12      ILE  67  -5.127   0.869   5.085
  532   HG13  ILE  67          HG11      ILE  67  -4.168   2.049   5.972
  533   HG21  ILE  67          HG21      ILE  67  -6.089   1.372   3.116
  534   HG22  ILE  67          HG22      ILE  67  -4.607   1.303   2.162
  535   HG23  ILE  67          HG23      ILE  67  -5.621   2.744   2.112
  536   HD11  ILE  67          HD11      ILE  67  -7.064   1.969   5.438
  537   HD12  ILE  67          HD12      ILE  67  -6.297   3.558   5.402
  538   HD13  ILE  67          HD13      ILE  67  -6.178   2.554   6.847
  539    H    ASN  68           HN       ASN  68  -1.532   4.419   3.579
  540    HA   ASN  68           HA       ASN  68  -0.412   5.537   1.915
  541    HB2  ASN  68           HB2      ASN  68  -0.429   3.155   0.758
  542    HB3  ASN  68           HB1      ASN  68  -1.626   3.914  -0.285
  543   HD21  ASN  68          1HE2      ASN  68  -0.241   3.778  -2.084
  544   HD22  ASN  68          2HE2      ASN  68   1.125   4.823  -2.257
  545    H    VAL  69           HN       VAL  69  -3.748   5.051   2.136
  546    HA   VAL  69           HA       VAL  69  -4.479   6.968   0.098
  547    HB   VAL  69           HB       VAL  69  -6.252   5.766   2.224
  548   HG11  VAL  69          HG11      VAL  69  -7.271   7.672   1.210
  549   HG12  VAL  69          HG12      VAL  69  -8.021   6.234   0.517
  550   HG13  VAL  69          HG13      VAL  69  -6.813   7.129  -0.404
  551   HG21  VAL  69          HG21      VAL  69  -5.928   4.757  -0.591
  552   HG22  VAL  69          HG22      VAL  69  -6.783   3.998   0.753
  553   HG23  VAL  69          HG23      VAL  69  -5.023   4.094   0.769
  554    H    SER  70           HN       SER  70  -4.072   6.905   3.591
  555    HA   SER  70           HA       SER  70  -5.237   9.526   3.942
  556    HB2  SER  70           HB2      SER  70  -3.553   8.384   6.096
  557    HB3  SER  70           HB1      SER  70  -5.165   9.094   6.179
  558    HG   SER  70           HG       SER  70  -5.837   7.077   5.063
  559    H    VAL  71           HN       VAL  71  -1.994   8.101   4.080
  560    HA   VAL  71           HA       VAL  71  -0.791  10.750   4.289
  561    HB   VAL  71           HB       VAL  71   1.350   9.554   4.495
  562   HG11  VAL  71          HG11      VAL  71   0.986   9.353   6.682
  563   HG12  VAL  71          HG12      VAL  71  -0.119   7.999   6.448
  564   HG13  VAL  71          HG13      VAL  71  -0.718   9.654   6.343
  565   HG21  VAL  71          HG21      VAL  71  -0.260   7.336   3.512
  566   HG22  VAL  71          HG22      VAL  71   0.683   6.915   4.941
  567   HG23  VAL  71          HG23      VAL  71   1.490   7.554   3.508
  568    H    MET  72           HN       MET  72   1.414  10.794   2.897
  569    HA   MET  72           HA       MET  72   1.409   9.644   0.337
  570    HB2  MET  72           HB2      MET  72  -0.608  11.370   0.391
  571    HB3  MET  72           HB1      MET  72   0.679  12.519   0.062
  572    HG2  MET  72           HG2      MET  72   0.668  11.970  -2.075
  573    HG3  MET  72           HG1      MET  72   0.998  10.287  -1.671
  574    HE1  MET  72           HE1      MET  72  -2.119  12.890  -2.343
  575    HE2  MET  72           HE2      MET  72  -1.891  12.495  -0.639
  576    HE3  MET  72           HE3      MET  72  -3.297  11.878  -1.508
  577    H    LEU  73           HN       LEU  73   2.016  12.986   1.431
  578    HA   LEU  73           HA       LEU  73   4.560  13.100   0.191
  579    HB2  LEU  73           HB2      LEU  73   4.812  15.164   1.720
  580    HB3  LEU  73           HB1      LEU  73   3.599  15.182   0.454
  581    HG   LEU  73           HG       LEU  73   2.603  14.205   3.036
  582   HD11  LEU  73          HD11      LEU  73   2.531  16.975   3.380
  583   HD12  LEU  73          HD12      LEU  73   4.204  16.595   2.976
  584   HD13  LEU  73          HD13      LEU  73   3.426  15.799   4.343
  585   HD21  LEU  73          HD21      LEU  73   1.000  16.227   2.311
  586   HD22  LEU  73          HD22      LEU  73   0.865  14.600   1.645
  587   HD23  LEU  73          HD23      LEU  73   1.725  15.852   0.748
  588    H    GLN  74           HN       GLN  74   3.551  12.538   3.545
  589    HA   GLN  74           HA       GLN  74   6.147  11.317   4.061
  590    HB2  GLN  74           HB2      GLN  74   6.209  12.595   6.294
  591    HB3  GLN  74           HB1      GLN  74   6.708  13.446   4.840
  592    HG2  GLN  74           HG2      GLN  74   5.097  14.960   5.050
  593    HG3  GLN  74           HG1      GLN  74   3.871  13.732   5.361
  594   HE21  GLN  74          1HE2      GLN  74   4.587  12.595   7.646
  595   HE22  GLN  74          2HE2      GLN  74   4.648  13.743   8.935
  596    HA   PRO  75           HA       PRO  75   2.765   8.857   5.937
  597    HB2  PRO  75           HB2      PRO  75   4.511   6.585   5.382
  598    HB3  PRO  75           HB1      PRO  75   2.886   6.911   4.783
  599    HG2  PRO  75           HG2      PRO  75   5.083   7.005   3.195
  600    HG3  PRO  75           HG1      PRO  75   3.648   8.008   2.918
  601    HD2  PRO  75           HD2      PRO  75   6.260   8.743   4.183
  602    HD3  PRO  75           HD1      PRO  75   5.251   9.676   3.056
  603    H    PHE  76           HN       PHE  76   6.255   8.237   6.318
  604    HA   PHE  76           HA       PHE  76   6.018   8.467   9.189
  605    HB2  PHE  76           HB2      PHE  76   7.121   5.897   8.048
  606    HB3  PHE  76           HB1      PHE  76   6.840   6.287   9.742
  607    HD1  PHE  76           HD1      PHE  76   4.448   6.616  10.509
  608    HD2  PHE  76           HD2      PHE  76   5.468   4.873   6.763
  609    HE1  PHE  76           HE1      PHE  76   2.206   5.618  10.368
  610    HE2  PHE  76           HE2      PHE  76   3.225   3.871   6.615
  611    HZ   PHE  76           HZ       PHE  76   1.591   4.243   8.418
  612    H    ASP  77           HN       ASP  77   7.326  10.298   8.138
  613    HA   ASP  77           HA       ASP  77  10.119   9.521   7.708
  614    HB2  ASP  77           HB2      ASP  77  10.431  11.763   6.792
  615    HB3  ASP  77           HB1      ASP  77   9.076  10.962   6.002
  616    H    TYR  78           HN       TYR  78   8.042  11.023  10.006
  617    HA   TYR  78           HA       TYR  78  10.226  12.329  11.411
  618    HB2  TYR  78           HB2      TYR  78   7.501  12.839  11.182
  619    HB3  TYR  78           HB1      TYR  78   7.686  12.245  12.829
  620    HD1  TYR  78           HD2      TYR  78  10.400  13.307  13.461
  621    HD2  TYR  78           HD1      TYR  78   7.094  15.121  11.491
  622    HE1  TYR  78           HE2      TYR  78  11.200  15.521  14.171
  623    HE2  TYR  78           HE1      TYR  78   7.885  17.341  12.195
  624    HH   TYR  78           HH       TYR  78  10.142  18.368  12.850
  625    H    ASP  79           HN       ASP  79   9.608   9.245  11.158
  626    HA   ASP  79           HA       ASP  79   9.313   8.497  13.933
  627    HB2  ASP  79           HB2      ASP  79   8.372   7.117  12.111
  628    HB3  ASP  79           HB1      ASP  79  10.004   6.785  11.538
  629    HA   PRO  80           HA       PRO  80  13.671   8.937  14.936
  630    HB2  PRO  80           HB2      PRO  80  12.921   7.007  17.073
  631    HB3  PRO  80           HB1      PRO  80  13.739   8.567  17.205
  632    HG2  PRO  80           HG2      PRO  80  11.192   8.306  17.932
  633    HG3  PRO  80           HG1      PRO  80  11.757   9.766  17.099
  634    HD2  PRO  80           HD2      PRO  80  10.191   7.455  16.028
  635    HD3  PRO  80           HD1      PRO  80  10.046   9.185  15.656
  636    H    ASN  81           HN       ASN  81  12.127   5.768  15.251
  637    HA   ASN  81           HA       ASN  81  14.409   4.183  14.851
  638    HB2  ASN  81           HB2      ASN  81  11.514   3.508  14.261
  639    HB3  ASN  81           HB1      ASN  81  12.830   2.349  14.429
  640   HD21  ASN  81          1HE2      ASN  81  10.476   2.306  15.946
  641   HD22  ASN  81          2HE2      ASN  81  10.888   2.602  17.597
  642    H    GLU  82           HN       GLU  82  15.232   5.582  13.133
  643    HA   GLU  82           HA       GLU  82  14.134   5.812  10.603
  644    HB2  GLU  82           HB2      GLU  82  16.803   6.200  11.791
  645    HB3  GLU  82           HB1      GLU  82  16.777   5.953  10.051
  646    HG2  GLU  82           HG2      GLU  82  16.210   8.061   9.749
  647    HG3  GLU  82           HG1      GLU  82  14.739   7.812  10.689
  648    H    LYS  83           HN       LYS  83  15.957   3.132  11.976
  649    HA   LYS  83           HA       LYS  83  16.656   1.927   9.520
  650    HB2  LYS  83           HB2      LYS  83  17.545   1.217  11.746
  651    HB3  LYS  83           HB1      LYS  83  15.968   0.534  12.121
  652    HG2  LYS  83           HG2      LYS  83  16.363  -0.781   9.883
  653    HG3  LYS  83           HG1      LYS  83  18.056  -0.429  10.238
  654    HD2  LYS  83           HD2      LYS  83  17.943  -2.327  11.446
  655    HD3  LYS  83           HD1      LYS  83  17.198  -1.285  12.660
  656    HE2  LYS  83           HE2      LYS  83  15.436  -2.477  10.589
  657    HE3  LYS  83           HE1      LYS  83  16.066  -3.546  11.842
  658    HZ1  LYS  83           HZ1      LYS  83  14.251  -2.827  12.933
  659    HZ2  LYS  83           HZ2      LYS  83  14.127  -1.394  12.044
  660    HZ3  LYS  83           HZ3      LYS  83  15.232  -1.503  13.319
  661    H    SER  84           HN       SER  84  13.874   1.469  11.684
  662    HA   SER  84           HA       SER  84  12.465  -0.156   9.760
  663    HB2  SER  84           HB2      SER  84  11.895   0.904  12.486
  664    HB3  SER  84           HB1      SER  84  10.524   0.427  11.485
  665    HG   SER  84           HG       SER  84  11.784  -1.599  11.178
  666    H    LYS  85           HN       LYS  85  12.767   3.208  10.344
  667    HA   LYS  85           HA       LYS  85  10.345   4.265   9.624
  668    HB2  LYS  85           HB2      LYS  85  12.178   5.607  10.449
  669    HB3  LYS  85           HB1      LYS  85  13.078   5.352   8.962
  670    HG2  LYS  85           HG2      LYS  85  10.980   6.439   7.846
  671    HG3  LYS  85           HG1      LYS  85  10.694   7.067   9.470
  672    HD2  LYS  85           HD2      LYS  85  12.172   8.682   9.087
  673    HD3  LYS  85           HD1      LYS  85  13.434   7.464   8.889
  674    HE2  LYS  85           HE2      LYS  85  12.550   7.234   6.487
  675    HE3  LYS  85           HE1      LYS  85  11.723   8.762   6.791
  676    HZ1  LYS  85           HZ1      LYS  85  14.204   9.329   7.614
  677    HZ2  LYS  85           HZ2      LYS  85  13.637   9.632   6.050
  678    HZ3  LYS  85           HZ3      LYS  85  14.538   8.236   6.365
  679    H    HIS  86           HN       HIS  86  12.625   5.106   7.147
  680    HA   HIS  86           HA       HIS  86  12.655   4.823   4.861
  681    HB2  HIS  86           HB2      HIS  86  11.326   2.450   5.720
  682    HB3  HIS  86           HB1      HIS  86  10.481   3.069   4.305
  683    HD1  HIS  86           HD1      HIS  86  13.209   0.954   5.192
  684    HD2  HIS  86           HD2      HIS  86  12.483   3.659   2.123
  685    HE1  HIS  86           HE1      HIS  86  14.849   0.369   3.379
  686    HE2  HIS  86           HE2      HIS  86  14.327   1.959   1.496
  687    H    LYS  87           HN       LYS  87  11.168   5.212   2.866
  688    HA   LYS  87           HA       LYS  87   8.698   6.651   3.532
  689    HB2  LYS  87           HB2      LYS  87  10.827   7.955   1.843
  690    HB3  LYS  87           HB1      LYS  87   9.314   8.660   2.384
  691    HG2  LYS  87           HG2      LYS  87  10.543   7.938   4.738
  692    HG3  LYS  87           HG1      LYS  87  11.881   8.493   3.731
  693    HD2  LYS  87           HD2      LYS  87   9.336  10.052   4.156
  694    HD3  LYS  87           HD1      LYS  87  10.797  10.276   5.121
  695    HE2  LYS  87           HE2      LYS  87  12.042  10.849   3.092
  696    HE3  LYS  87           HE1      LYS  87  10.581  10.622   2.131
  697    HZ1  LYS  87           HZ1      LYS  87  10.648  12.893   2.476
  698    HZ2  LYS  87           HZ2      LYS  87  11.202  12.756   4.068
  699    HZ3  LYS  87           HZ3      LYS  87   9.595  12.380   3.698
  700    H    PHE  88           HN       PHE  88   7.522   7.423   1.473
  701    HA   PHE  88           HA       PHE  88   7.209   5.165  -0.245
  702    HB2  PHE  88           HB2      PHE  88   5.384   6.684   0.610
  703    HB3  PHE  88           HB1      PHE  88   5.902   7.849  -0.604
  704    HD1  PHE  88           HD2      PHE  88   4.460   4.500  -0.087
  705    HD2  PHE  88           HD1      PHE  88   5.339   7.579  -2.890
  706    HE1  PHE  88           HE2      PHE  88   3.048   3.375  -1.760
  707    HE2  PHE  88           HE1      PHE  88   3.929   6.461  -4.567
  708    HZ   PHE  88           HZ       PHE  88   2.782   4.356  -4.004
  709    H    MET  89           HN       MET  89   8.198   8.571  -1.090
  710    HA   MET  89           HA       MET  89   8.675   7.768  -3.824
  711    HB2  MET  89           HB2      MET  89   8.745  10.318  -2.352
  712    HB3  MET  89           HB1      MET  89  10.097  10.175  -3.456
  713    HG2  MET  89           HG2      MET  89   8.382   9.709  -5.302
  714    HG3  MET  89           HG1      MET  89   7.142  10.183  -4.144
  715    HE1  MET  89           HE1      MET  89   6.306  11.911  -6.082
  716    HE2  MET  89           HE2      MET  89   7.587  12.521  -7.132
  717    HE3  MET  89           HE3      MET  89   6.842  13.587  -5.946
  718    H    VAL  90           HN       VAL  90  10.481   8.090  -0.882
  719    HA   VAL  90           HA       VAL  90  13.117   7.589  -1.932
  720    HB   VAL  90           HB       VAL  90  12.315   7.328   0.947
  721   HG11  VAL  90          HG11      VAL  90  14.841   8.576   0.461
  722   HG12  VAL  90          HG12      VAL  90  14.746   7.068  -0.447
  723   HG13  VAL  90          HG13      VAL  90  14.488   7.065   1.297
  724   HG21  VAL  90          HG21      VAL  90  11.805   9.489   1.062
  725   HG22  VAL  90          HG22      VAL  90  12.060   9.654  -0.675
  726   HG23  VAL  90          HG23      VAL  90  13.403   9.900   0.441
  727    H    GLN  91           HN       GLN  91  10.528   5.530  -1.208
  728    HA   GLN  91           HA       GLN  91  11.753   3.347  -0.033
  729    HB2  GLN  91           HB2      GLN  91   9.249   3.871  -0.854
  730    HB3  GLN  91           HB1      GLN  91   9.736   2.751  -2.117
  731    HG2  GLN  91           HG2      GLN  91  10.356   1.114  -0.379
  732    HG3  GLN  91           HG1      GLN  91   9.753   2.230   0.846
  733   HE21  GLN  91          1HE2      GLN  91   7.453   3.034   0.315
  734   HE22  GLN  91          2HE2      GLN  91   6.325   1.804  -0.129
  735    H    SER  92           HN       SER  92  12.330   4.545  -3.175
  736    HA   SER  92           HA       SER  92  12.877   2.204  -4.594
  737    HB2  SER  92           HB2      SER  92  14.505   3.779  -5.871
  738    HB3  SER  92           HB1      SER  92  12.776   4.127  -5.903
  739    HG   SER  92           HG       SER  92  14.802   5.621  -4.927
  740    H    MET  93           HN       MET  93  14.634   3.522  -1.934
  741    HA   MET  93           HA       MET  93  17.200   2.500  -2.666
  742    HB2  MET  93           HB2      MET  93  16.296   3.142   0.140
  743    HB3  MET  93           HB1      MET  93  17.926   3.194  -0.516
  744    HG2  MET  93           HG2      MET  93  16.227   4.976  -1.982
  745    HG3  MET  93           HG1      MET  93  16.100   5.303  -0.255
  746    HE1  MET  93           HE1      MET  93  19.249   5.975   1.085
  747    HE2  MET  93           HE2      MET  93  17.489   6.093   1.134
  748    HE3  MET  93           HE3      MET  93  18.450   7.459   0.566
  749    H    PHE  94           HN       PHE  94  14.461   1.537  -0.719
  750    HA   PHE  94           HA       PHE  94  15.530  -0.820   0.398
  751    HB2  PHE  94           HB2      PHE  94  13.463   0.027   1.258
  752    HB3  PHE  94           HB1      PHE  94  12.703  -0.029  -0.327
  753    HD1  PHE  94           HD1      PHE  94  12.289  -2.294  -1.372
  754    HD2  PHE  94           HD2      PHE  94  13.325  -1.785   2.723
  755    HE1  PHE  94           HE1      PHE  94  11.406  -4.531  -0.876
  756    HE2  PHE  94           HE2      PHE  94  12.442  -4.025   3.229
  757    HZ   PHE  94           HZ       PHE  94  11.480  -5.402   1.427
  758    H    ALA  95           HN       ALA  95  14.571  -0.026  -2.784
  759    HA   ALA  95           HA       ALA  95  15.586  -2.379  -3.936
  760    HB1  ALA  95           HB1      ALA  95  13.633  -3.497  -3.184
  761    HB2  ALA  95           HB2      ALA  95  13.408  -3.195  -4.908
  762    HB3  ALA  95           HB3      ALA  95  12.591  -2.179  -3.719
  763    HA   PRO  96           HA       PRO  96  15.750   1.063  -6.869
  764    HB2  PRO  96           HB2      PRO  96  17.171  -0.346  -8.770
  765    HB3  PRO  96           HB1      PRO  96  17.893   0.534  -7.420
  766    HG2  PRO  96           HG2      PRO  96  17.298  -2.383  -7.682
  767    HG3  PRO  96           HG1      PRO  96  18.714  -1.586  -6.972
  768    HD2  PRO  96           HD2      PRO  96  16.772  -2.617  -5.439
  769    HD3  PRO  96           HD1      PRO  96  17.611  -1.118  -4.986
  770    H    THR  97           HN       THR  97  14.498  -2.131  -7.384
  771    HA   THR  97           HA       THR  97  13.530  -1.754 -10.025
  772    HB   THR  97           HB       THR  97  11.894  -3.664  -9.113
  773    HG1  THR  97           HG1      THR  97  12.510  -3.503  -6.965
  774   HG21  THR  97          HG21      THR  97  13.168  -4.774 -10.536
  775   HG22  THR  97          HG22      THR  97  14.302  -5.051  -9.213
  776   HG23  THR  97          HG23      THR  97  14.516  -3.665 -10.284
  777    H    ASP  98           HN       ASP  98  12.379  -0.773  -6.918
  778    HA   ASP  98           HA       ASP  98   9.644  -0.597  -7.380
  779    HB2  ASP  98           HB2      ASP  98  11.544   0.508  -5.461
  780    HB3  ASP  98           HB1      ASP  98  10.191   1.591  -5.773
  781    H    THR  99           HN       THR  99  12.156   1.844  -8.001
  782    HA   THR  99           HA       THR  99  10.465   3.875  -8.895
  783    HB   THR  99           HB       THR  99  12.582   4.469 -10.340
  784    HG1  THR  99           HG1      THR  99  14.354   3.349  -9.888
  785   HG21  THR  99          HG21      THR  99  12.942   5.890  -8.692
  786   HG22  THR  99          HG22      THR  99  13.646   4.602  -7.715
  787   HG23  THR  99          HG23      THR  99  11.913   4.923  -7.635
  788    H    SER 100           HN       SER 100  12.030   1.253 -10.679
  789    HA   SER 100           HA       SER 100  10.977   1.998 -13.219
  790    HB2  SER 100           HB2      SER 100  11.558  -0.599 -13.588
  791    HB3  SER 100           HB1      SER 100  12.793   0.658 -13.564
  792    HG   SER 100           HG       SER 100  13.197  -1.205 -12.182
  793    H    ASP 101           HN       ASP 101   9.746   0.236 -10.530
  794    HA   ASP 101           HA       ASP 101   7.900  -1.454 -11.733
  795    HB2  ASP 101           HB2      ASP 101   8.608  -1.174  -9.238
  796    HB3  ASP 101           HB1      ASP 101   7.252  -0.052  -9.165
  797    H    MET 102           HN       MET 102   7.662   2.000 -11.069
  798    HA   MET 102           HA       MET 102   4.863   2.195 -11.502
  799    HB2  MET 102           HB2      MET 102   7.077   4.240 -11.618
  800    HB3  MET 102           HB1      MET 102   5.382   4.651 -11.839
  801    HG2  MET 102           HG2      MET 102   6.040   3.095  -9.425
  802    HG3  MET 102           HG1      MET 102   6.641   4.752  -9.480
  803    HE1  MET 102           HE1      MET 102   3.897   6.784  -8.351
  804    HE2  MET 102           HE2      MET 102   5.596   6.544  -8.760
  805    HE3  MET 102           HE3      MET 102   4.903   5.728  -7.358
  806    H    GLU 103           HN       GLU 103   7.605   3.079 -13.604
  807    HA   GLU 103           HA       GLU 103   5.945   3.579 -15.861
  808    HB2  GLU 103           HB2      GLU 103   8.708   3.866 -15.176
  809    HB3  GLU 103           HB1      GLU 103   8.594   3.026 -16.718
  810    HG2  GLU 103           HG2      GLU 103   7.589   4.808 -17.769
  811    HG3  GLU 103           HG1      GLU 103   6.984   5.493 -16.262
  812    H    ALA 104           HN       ALA 104   7.999   0.885 -14.885
  813    HA   ALA 104           HA       ALA 104   7.675  -0.633 -17.233
  814    HB1  ALA 104           HB1      ALA 104   8.817  -2.374 -16.095
  815    HB2  ALA 104           HB2      ALA 104   8.420  -1.683 -14.520
  816    HB3  ALA 104           HB3      ALA 104   9.534  -0.841 -15.599
  817    H    VAL 105           HN       VAL 105   5.605  -0.434 -14.394
  818    HA   VAL 105           HA       VAL 105   4.477  -2.969 -14.527
  819    HB   VAL 105           HB       VAL 105   2.302  -1.762 -13.682
  820   HG11  VAL 105          HG11      VAL 105   3.846  -1.418 -11.451
  821   HG12  VAL 105          HG12      VAL 105   4.807  -2.541 -12.414
  822   HG13  VAL 105          HG13      VAL 105   3.143  -2.943 -11.992
  823   HG21  VAL 105          HG21      VAL 105   3.259   0.301 -12.329
  824   HG22  VAL 105          HG22      VAL 105   2.559   0.490 -13.934
  825   HG23  VAL 105          HG23      VAL 105   4.309   0.424 -13.735
  826    H    TRP 106           HN       TRP 106   3.599  -0.104 -16.439
  827    HA   TRP 106           HA       TRP 106   1.451  -1.559 -17.728
  828    HB2  TRP 106           HB2      TRP 106   2.519   1.236 -17.896
  829    HB3  TRP 106           HB1      TRP 106   1.519   0.619 -19.208
  830    HD1  TRP 106           HD1      TRP 106   1.335   1.357 -15.428
  831    HE1  TRP 106           HE1      TRP 106  -1.132   1.719 -14.795
  832    HE3  TRP 106           HE3      TRP 106  -0.835   0.187 -19.909
  833    HZ2  TRP 106           HZ2      TRP 106  -3.664   1.533 -16.029
  834    HZ3  TRP 106           HZ3      TRP 106  -3.285   0.306 -20.098
  835    HH2  TRP 106           HH2      TRP 106  -4.669   0.964 -18.196
  836    H    LYS 107           HN       LYS 107   4.630  -0.269 -18.600
  837    HA   LYS 107           HA       LYS 107   4.579  -1.157 -21.287
  838    HB2  LYS 107           HB2      LYS 107   6.315   0.331 -19.622
  839    HB3  LYS 107           HB1      LYS 107   7.263  -0.993 -20.285
  840    HG2  LYS 107           HG2      LYS 107   5.592   0.331 -22.272
  841    HG3  LYS 107           HG1      LYS 107   6.770   1.403 -21.514
  842    HD2  LYS 107           HD2      LYS 107   8.233  -0.876 -22.008
  843    HD3  LYS 107           HD1      LYS 107   7.169  -0.774 -23.412
  844    HE2  LYS 107           HE2      LYS 107   8.682   0.647 -24.243
  845    HE3  LYS 107           HE1      LYS 107   8.006   1.818 -23.112
  846    HZ1  LYS 107           HZ1      LYS 107   9.722   0.666 -21.508
  847    HZ2  LYS 107           HZ2      LYS 107  10.186   1.928 -22.535
  848    HZ3  LYS 107           HZ3      LYS 107  10.516   0.325 -22.964
  849    H    GLU 108           HN       GLU 108   6.289  -2.457 -18.435
  850    HA   GLU 108           HA       GLU 108   7.268  -4.738 -19.776
  851    HB2  GLU 108           HB2      GLU 108   8.254  -5.293 -17.800
  852    HB3  GLU 108           HB1      GLU 108   7.901  -3.608 -17.460
  853    HG2  GLU 108           HG2      GLU 108   5.680  -4.581 -16.480
  854    HG3  GLU 108           HG1      GLU 108   6.617  -6.064 -16.390
  855    H    ALA 109           HN       ALA 109   4.164  -4.026 -18.497
  856    HA   ALA 109           HA       ALA 109   2.213  -5.193 -18.519
  857    HB1  ALA 109           HB1      ALA 109   3.720  -7.361 -19.972
  858    HB2  ALA 109           HB2      ALA 109   3.020  -5.942 -20.748
  859    HB3  ALA 109           HB3      ALA 109   1.975  -7.108 -19.937
  860    H    LYS 110           HN       LYS 110   1.247  -7.398 -17.840
  861    HA   LYS 110           HA       LYS 110   1.873  -7.843 -15.205
  862    HB2  LYS 110           HB2      LYS 110   0.278  -9.563 -15.190
  863    HB3  LYS 110           HB1      LYS 110  -0.260  -8.410 -16.397
  864    HG2  LYS 110           HG2      LYS 110   1.344 -10.787 -17.229
  865    HG3  LYS 110           HG1      LYS 110  -0.374 -10.957 -16.877
  866    HD2  LYS 110           HD2      LYS 110   0.539  -8.782 -18.704
  867    HD3  LYS 110           HD1      LYS 110   0.430 -10.435 -19.309
  868    HE2  LYS 110           HE2      LYS 110  -1.637  -9.330 -19.791
  869    HE3  LYS 110           HE1      LYS 110  -1.925 -10.508 -18.512
  870    HZ1  LYS 110           HZ1      LYS 110  -1.355  -7.679 -17.884
  871    HZ2  LYS 110           HZ2      LYS 110  -2.112  -8.844 -16.920
  872    HZ3  LYS 110           HZ3      LYS 110  -2.924  -8.193 -18.254
  873    HA   PRO 111           HA       PRO 111   4.289 -11.895 -16.366
  874    HB2  PRO 111           HB2      PRO 111   5.959 -11.636 -18.519
  875    HB3  PRO 111           HB1      PRO 111   4.369 -12.404 -18.588
  876    HG2  PRO 111           HG2      PRO 111   5.174  -9.636 -19.367
  877    HG3  PRO 111           HG1      PRO 111   4.066 -10.754 -20.183
  878    HD2  PRO 111           HD2      PRO 111   3.194  -8.716 -18.679
  879    HD3  PRO 111           HD1      PRO 111   2.318 -10.248 -18.772
  880    H    GLU 112           HN       GLU 112   5.896  -8.960 -17.604
  881    HA   GLU 112           HA       GLU 112   8.290  -9.486 -16.131
  882    HB2  GLU 112           HB2      GLU 112   7.300  -7.222 -17.822
  883    HB3  GLU 112           HB1      GLU 112   8.710  -6.985 -16.800
  884    HG2  GLU 112           HG2      GLU 112   9.412  -9.276 -17.992
  885    HG3  GLU 112           HG1      GLU 112   8.387  -8.591 -19.252
  886    H    ASP 113           HN       ASP 113   5.375  -7.618 -15.620
  887    HA   ASP 113           HA       ASP 113   6.292  -6.020 -13.485
  888    HB2  ASP 113           HB2      ASP 113   4.184  -5.638 -14.773
  889    HB3  ASP 113           HB1      ASP 113   3.475  -7.018 -13.943
  890    H    LEU 114           HN       LEU 114   5.054  -9.292 -13.635
  891    HA   LEU 114           HA       LEU 114   4.532  -9.700 -10.914
  892    HB2  LEU 114           HB2      LEU 114   3.869 -11.243 -12.737
  893    HB3  LEU 114           HB1      LEU 114   5.548 -11.709 -12.926
  894    HG   LEU 114           HG       LEU 114   5.328 -12.330 -10.369
  895   HD11  LEU 114          HD11      LEU 114   3.030 -13.321 -10.014
  896   HD12  LEU 114          HD12      LEU 114   2.496 -12.335 -11.374
  897   HD13  LEU 114          HD13      LEU 114   3.141 -11.564  -9.926
  898   HD21  LEU 114          HD21      LEU 114   5.102 -14.557 -11.002
  899   HD22  LEU 114          HD22      LEU 114   5.726 -13.781 -12.459
  900   HD23  LEU 114          HD23      LEU 114   4.010 -14.170 -12.332
  901    H    MET 115           HN       MET 115   7.507  -9.756 -12.754
  902    HA   MET 115           HA       MET 115   9.176 -11.042 -10.920
  903    HB2  MET 115           HB2      MET 115   9.473  -9.528 -13.346
  904    HB3  MET 115           HB1      MET 115  10.703  -9.033 -12.192
  905    HG2  MET 115           HG2      MET 115  10.861 -11.713 -11.949
  906    HG3  MET 115           HG1      MET 115  10.369 -11.570 -13.635
  907    HE1  MET 115           HE1      MET 115  12.685 -12.822 -12.281
  908    HE2  MET 115           HE2      MET 115  14.124 -11.854 -11.955
  909    HE3  MET 115           HE3      MET 115  13.899 -12.594 -13.539
  910    H    ASP 116           HN       ASP 116   8.226  -7.636 -11.171
  911    HA   ASP 116           HA       ASP 116   9.961  -6.756  -9.084
  912    HB2  ASP 116           HB2      ASP 116   7.451  -5.399 -10.088
  913    HB3  ASP 116           HB1      ASP 116   8.803  -4.647  -9.247
  914    H    SER 117           HN       SER 117   6.714  -7.999  -9.279
  915    HA   SER 117           HA       SER 117   5.863  -7.237  -6.680
  916    HB2  SER 117           HB2      SER 117   4.922  -9.542  -8.383
  917    HB3  SER 117           HB1      SER 117   4.042  -8.815  -7.038
  918    HG   SER 117           HG       SER 117   4.832  -7.355  -9.333
  919    H    LYS 118           HN       LYS 118   7.106 -10.320  -8.000
  920    HA   LYS 118           HA       LYS 118   7.092 -11.669  -5.512
  921    HB2  LYS 118           HB2      LYS 118   8.599 -13.288  -6.624
  922    HB3  LYS 118           HB1      LYS 118   7.181 -12.918  -7.594
  923    HG2  LYS 118           HG2      LYS 118   8.389 -11.989  -9.244
  924    HG3  LYS 118           HG1      LYS 118   9.535 -11.243  -8.129
  925    HD2  LYS 118           HD2      LYS 118  10.159 -13.839  -7.779
  926    HD3  LYS 118           HD1      LYS 118   9.615 -13.879  -9.457
  927    HE2  LYS 118           HE2      LYS 118  11.986 -13.490  -9.417
  928    HE3  LYS 118           HE1      LYS 118  11.176 -12.021  -9.959
  929    HZ1  LYS 118           HZ1      LYS 118  12.744 -12.491  -7.578
  930    HZ2  LYS 118           HZ2      LYS 118  11.313 -11.632  -7.307
  931    HZ3  LYS 118           HZ3      LYS 118  12.450 -11.050  -8.415
  932    H    LEU 119           HN       LEU 119   9.276  -9.525  -7.112
  933    HA   LEU 119           HA       LEU 119  11.555 -10.040  -5.464
  934    HB2  LEU 119           HB2      LEU 119  11.540  -8.996  -7.768
  935    HB3  LEU 119           HB1      LEU 119  10.969  -7.523  -7.008
  936    HG   LEU 119           HG       LEU 119  13.096  -7.756  -5.529
  937   HD11  LEU 119          HD11      LEU 119  14.281  -9.075  -7.908
  938   HD12  LEU 119          HD12      LEU 119  13.442 -10.090  -6.736
  939   HD13  LEU 119          HD13      LEU 119  14.802  -9.094  -6.224
  940   HD21  LEU 119          HD21      LEU 119  14.012  -6.141  -6.816
  941   HD22  LEU 119          HD22      LEU 119  12.449  -6.231  -7.630
  942   HD23  LEU 119          HD23      LEU 119  13.843  -7.076  -8.302
  943    H    ARG 120           HN       ARG 120   9.139  -7.431  -5.539
  944    HA   ARG 120           HA       ARG 120  10.122  -6.150  -3.190
  945    HB2  ARG 120           HB2      ARG 120   8.628  -5.226  -5.142
  946    HB3  ARG 120           HB1      ARG 120   7.304  -5.826  -4.156
  947    HG2  ARG 120           HG2      ARG 120   7.442  -3.650  -3.454
  948    HG3  ARG 120           HG1      ARG 120   8.462  -4.459  -2.263
  949    HD2  ARG 120           HD2      ARG 120   9.379  -2.959  -4.713
  950    HD3  ARG 120           HD1      ARG 120   9.557  -2.453  -3.036
  951    HE   ARG 120           HE       ARG 120  11.262  -4.015  -2.756
  952   HH11  ARG 120          HH11      ARG 120   9.949  -4.150  -5.993
  953   HH12  ARG 120          HH12      ARG 120  11.231  -5.138  -6.599
  954   HH21  ARG 120          HH21      ARG 120  12.937  -5.316  -3.555
  955   HH22  ARG 120          HH22      ARG 120  12.929  -5.799  -5.216
  956    H    CYS 121           HN       CYS 121   7.714  -8.582  -3.858
  957    HA   CYS 121           HA       CYS 121   6.453  -8.517  -1.311
  958    HB2  CYS 121           HB2      CYS 121   6.530 -10.559  -3.522
  959    HB3  CYS 121           HB1      CYS 121   5.680 -10.864  -2.010
  960    HG   CYS 121           HG       CYS 121   4.863  -8.655  -4.040
  961    H    VAL 122           HN       VAL 122   9.137 -10.370  -2.649
  962    HA   VAL 122           HA       VAL 122   9.426 -12.042  -0.337
  963    HB   VAL 122           HB       VAL 122  11.305 -11.519  -2.645
  964   HG11  VAL 122          HG11      VAL 122  12.847 -12.323  -1.191
  965   HG12  VAL 122          HG12      VAL 122  12.147 -13.870  -1.671
  966   HG13  VAL 122          HG13      VAL 122  11.638 -13.099  -0.168
  967   HG21  VAL 122          HG21      VAL 122   8.969 -12.804  -2.765
  968   HG22  VAL 122          HG22      VAL 122   9.986 -14.133  -2.207
  969   HG23  VAL 122          HG23      VAL 122  10.375 -13.295  -3.709
  970    H    PHE 123           HN       PHE 123  11.066  -9.151  -1.562
  971    HA   PHE 123           HA       PHE 123  13.088  -8.997   0.360
  972    HB2  PHE 123           HB2      PHE 123  12.041  -7.338  -1.731
  973    HB3  PHE 123           HB1      PHE 123  12.307  -6.351  -0.298
  974    HD1  PHE 123           HD1      PHE 123  14.592  -6.413   0.790
  975    HD2  PHE 123           HD2      PHE 123  13.822  -7.991  -3.087
  976    HE1  PHE 123           HE1      PHE 123  16.996  -6.312   0.275
  977    HE2  PHE 123           HE2      PHE 123  16.224  -7.893  -3.608
  978    HZ   PHE 123           HZ       PHE 123  17.815  -7.053  -1.926
  979    H    GLU 124           HN       GLU 124   9.786  -7.719   0.383
  980    HA   GLU 124           HA       GLU 124  10.024  -6.343   2.851
  981    HB2  GLU 124           HB2      GLU 124   8.260  -5.927   1.118
  982    HB3  GLU 124           HB1      GLU 124   7.503  -7.440   1.599
  983    HG2  GLU 124           HG2      GLU 124   7.532  -6.373   3.976
  984    HG3  GLU 124           HG1      GLU 124   7.694  -4.863   3.081
  985    H    LEU 125           HN       LEU 125   8.522  -9.471   2.029
  986    HA   LEU 125           HA       LEU 125   8.992 -10.317   4.807
  987    HB2  LEU 125           HB2      LEU 125   6.506 -10.638   3.149
  988    HB3  LEU 125           HB1      LEU 125   6.849 -11.700   4.501
  989    HG   LEU 125           HG       LEU 125   6.997  -8.814   5.098
  990   HD11  LEU 125          HD11      LEU 125   5.084  -8.388   3.972
  991   HD12  LEU 125          HD12      LEU 125   4.357  -9.093   5.415
  992   HD13  LEU 125          HD13      LEU 125   4.578 -10.077   3.968
  993   HD21  LEU 125          HD21      LEU 125   7.195 -10.035   7.008
  994   HD22  LEU 125          HD22      LEU 125   6.182 -11.348   6.408
  995   HD23  LEU 125          HD23      LEU 125   5.441  -9.852   6.977
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1 -12.102  14.479   0.918
    2    H2   MET   1           HT2      MET   1 -13.765  14.077   1.062
    3    H3   MET   1           HT3      MET   1 -13.238  15.125  -0.191
    4    HA   MET   1           HA       MET   1 -12.355  12.337   0.093
    5    HB2  MET   1           HB2      MET   1 -14.854  12.669  -0.211
    6    HB3  MET   1           HB1      MET   1 -14.483  13.414  -1.760
    7    HG2  MET   1           HG2      MET   1 -13.971  11.449  -2.742
    8    HG3  MET   1           HG1      MET   1 -13.301  10.757  -1.266
    9    HE1  MET   1           HE1      MET   1 -15.369   8.247  -0.451
   10    HE2  MET   1           HE2      MET   1 -13.947   8.740  -1.369
   11    HE3  MET   1           HE3      MET   1 -15.388   8.174  -2.213
   12    H    ALA   2           HN       ALA   2 -11.652  11.545  -2.093
   13    HA   ALA   2           HA       ALA   2 -10.324  13.708  -3.595
   14    HB1  ALA   2           HB1      ALA   2  -9.223  10.937  -3.158
   15    HB2  ALA   2           HB2      ALA   2  -8.772  12.348  -2.203
   16    HB3  ALA   2           HB3      ALA   2  -8.412  12.300  -3.929
   17    H    LYS   3           HN       LYS   3  -9.490  12.740  -5.798
   18    HA   LYS   3           HA       LYS   3 -11.755  12.170  -7.357
   19    HB2  LYS   3           HB2      LYS   3  -8.920  11.580  -8.188
   20    HB3  LYS   3           HB1      LYS   3 -10.278  12.028  -9.211
   21    HG2  LYS   3           HG2      LYS   3  -9.379  14.069  -9.151
   22    HG3  LYS   3           HG1      LYS   3 -10.127  14.177  -7.556
   23    HD2  LYS   3           HD2      LYS   3  -8.149  14.055  -6.481
   24    HD3  LYS   3           HD1      LYS   3  -7.495  12.868  -7.611
   25    HE2  LYS   3           HE2      LYS   3  -7.799  15.307  -9.017
   26    HE3  LYS   3           HE1      LYS   3  -7.015  15.677  -7.481
   27    HZ1  LYS   3           HZ1      LYS   3  -5.995  13.360  -8.908
   28    HZ2  LYS   3           HZ2      LYS   3  -5.162  14.562  -8.060
   29    HZ3  LYS   3           HZ3      LYS   3  -5.700  14.858  -9.635
   30    H    VAL   4           HN       VAL   4 -12.827  10.348  -6.623
   31    HA   VAL   4           HA       VAL   4 -11.522   7.853  -6.209
   32    HB   VAL   4           HB       VAL   4 -13.789   6.889  -6.087
   33   HG11  VAL   4          HG11      VAL   4 -14.583   8.703  -4.282
   34   HG12  VAL   4          HG12      VAL   4 -12.909   9.217  -4.497
   35   HG13  VAL   4          HG13      VAL   4 -13.268   7.565  -3.994
   36   HG21  VAL   4          HG21      VAL   4 -15.736   8.433  -6.196
   37   HG22  VAL   4          HG22      VAL   4 -14.948   8.176  -7.751
   38   HG23  VAL   4          HG23      VAL   4 -14.668   9.670  -6.856
   39    H    GLU   5           HN       GLU   5 -12.714   9.465  -9.010
   40    HA   GLU   5           HA       GLU   5 -13.309   7.236 -10.626
   41    HB2  GLU   5           HB2      GLU   5 -12.493  10.065 -11.246
   42    HB3  GLU   5           HB1      GLU   5 -12.784   8.890 -12.521
   43    HG2  GLU   5           HG2      GLU   5 -15.052   8.681 -11.961
   44    HG3  GLU   5           HG1      GLU   5 -14.826   9.480 -10.406
   45    H    GLN   6           HN       GLN   6 -10.312   9.095 -10.185
   46    HA   GLN   6           HA       GLN   6  -8.788   7.663 -12.091
   47    HB2  GLN   6           HB2      GLN   6  -7.919   9.244  -9.659
   48    HB3  GLN   6           HB1      GLN   6  -6.814   8.623 -10.873
   49    HG2  GLN   6           HG2      GLN   6  -8.436  10.001 -12.477
   50    HG3  GLN   6           HG1      GLN   6  -8.679  10.921 -10.993
   51   HE21  GLN   6          1HE2      GLN   6  -7.598  12.785 -11.645
   52   HE22  GLN   6          2HE2      GLN   6  -5.894  12.830 -11.944
   53    H    VAL   7           HN       VAL   7  -9.101   7.347  -8.585
   54    HA   VAL   7           HA       VAL   7  -7.362   5.060  -8.441
   55    HB   VAL   7           HB       VAL   7  -7.861   5.075  -6.040
   56   HG11  VAL   7          HG11      VAL   7  -6.323   6.802  -7.424
   57   HG12  VAL   7          HG12      VAL   7  -6.409   6.758  -5.663
   58   HG13  VAL   7          HG13      VAL   7  -7.369   7.931  -6.564
   59   HG21  VAL   7          HG21      VAL   7  -9.627   7.440  -6.654
   60   HG22  VAL   7          HG22      VAL   7  -9.280   6.764  -5.063
   61   HG23  VAL   7          HG23      VAL   7 -10.211   5.831  -6.235
   62    H    LEU   8           HN       LEU   8 -10.742   5.403  -8.963
   63    HA   LEU   8           HA       LEU   8 -11.822   3.336  -7.505
   64    HB2  LEU   8           HB2      LEU   8 -12.585   4.896  -9.797
   65    HB3  LEU   8           HB1      LEU   8 -13.152   3.247  -9.969
   66    HG   LEU   8           HG       LEU   8 -13.772   5.138  -7.703
   67   HD11  LEU   8          HD11      LEU   8 -16.135   4.291  -8.687
   68   HD12  LEU   8          HD12      LEU   8 -15.155   4.285 -10.154
   69   HD13  LEU   8          HD13      LEU   8 -15.319   5.765  -9.209
   70   HD21  LEU   8          HD21      LEU   8 -15.400   3.013  -7.325
   71   HD22  LEU   8          HD22      LEU   8 -13.871   3.254  -6.481
   72   HD23  LEU   8          HD23      LEU   8 -13.939   2.210  -7.900
   73    H    SER   9           HN       SER   9 -10.494   2.984 -10.839
   74    HA   SER   9           HA       SER   9 -10.291   0.991 -12.074
   75    HB2  SER   9           HB2      SER   9  -8.466  -0.403 -10.767
   76    HB3  SER   9           HB1      SER   9  -8.083   1.191 -11.415
   77    HG   SER   9           HG       SER   9  -9.073   0.891  -8.780
   78    H    LEU  10           HN       LEU  10 -12.689   0.633 -10.880
   79    HA   LEU  10           HA       LEU  10 -12.752  -1.716  -9.210
   80    HB2  LEU  10           HB2      LEU  10 -15.218  -1.415  -9.437
   81    HB3  LEU  10           HB1      LEU  10 -14.343  -0.034  -8.791
   82    HG   LEU  10           HG       LEU  10 -14.349   0.398 -11.528
   83   HD11  LEU  10          HD11      LEU  10 -16.094  -1.440 -11.597
   84   HD12  LEU  10          HD12      LEU  10 -16.553   0.100 -12.325
   85   HD13  LEU  10          HD13      LEU  10 -17.159  -0.337 -10.727
   86   HD21  LEU  10          HD21      LEU  10 -15.398   1.613  -9.123
   87   HD22  LEU  10          HD22      LEU  10 -16.479   1.881 -10.490
   88   HD23  LEU  10          HD23      LEU  10 -14.789   2.372 -10.594
   89    H    GLU  11           HN       GLU  11 -14.048  -1.063 -12.529
   90    HA   GLU  11           HA       GLU  11 -14.642  -3.896 -12.817
   91    HB2  GLU  11           HB2      GLU  11 -15.778  -1.607 -13.865
   92    HB3  GLU  11           HB1      GLU  11 -14.871  -2.245 -15.230
   93    HG2  GLU  11           HG2      GLU  11 -16.696  -4.003 -13.640
   94    HG3  GLU  11           HG1      GLU  11 -17.317  -2.961 -14.919
   95    HA   PRO  12           HA       PRO  12 -10.974  -3.574 -15.769
   96    HB2  PRO  12           HB2      PRO  12 -10.003  -1.198 -16.520
   97    HB3  PRO  12           HB1      PRO  12 -11.523  -1.785 -17.204
   98    HG2  PRO  12           HG2      PRO  12 -11.056   0.351 -15.213
   99    HG3  PRO  12           HG1      PRO  12 -12.402   0.141 -16.344
  100    HD2  PRO  12           HD2      PRO  12 -12.299  -0.567 -13.560
  101    HD3  PRO  12           HD1      PRO  12 -13.646  -0.781 -14.694
  102    H    GLN  13           HN       GLN  13 -10.260  -4.311 -13.558
  103    HA   GLN  13           HA       GLN  13  -9.088  -2.532 -11.755
  104    HB2  GLN  13           HB2      GLN  13  -9.055  -5.472 -12.161
  105    HB3  GLN  13           HB1      GLN  13  -7.744  -4.820 -11.189
  106    HG2  GLN  13           HG2      GLN  13  -9.078  -4.692  -9.438
  107    HG3  GLN  13           HG1      GLN  13 -10.166  -3.623 -10.321
  108   HE21  GLN  13          1HE2      GLN  13  -9.523  -6.884  -9.331
  109   HE22  GLN  13          2HE2      GLN  13 -11.071  -7.533  -9.740
  110    H    HIS  14           HN       HIS  14  -7.877  -3.816 -14.717
  111    HA   HIS  14           HA       HIS  14  -5.607  -4.124 -15.406
  112    HB2  HIS  14           HB2      HIS  14  -6.506  -1.270 -15.468
  113    HB3  HIS  14           HB1      HIS  14  -5.005  -1.774 -16.226
  114    HD1  HIS  14           HD1      HIS  14  -8.692  -2.707 -16.375
  115    HD2  HIS  14           HD2      HIS  14  -5.316  -2.568 -18.792
  116    HE1  HIS  14           HE1      HIS  14  -9.487  -3.340 -18.676
  117    HE2  HIS  14           HE2      HIS  14  -7.445  -3.153 -20.139
  118    H    GLU  15           HN       GLU  15  -4.586  -4.775 -13.391
  119    HA   GLU  15           HA       GLU  15  -2.249  -3.382 -12.863
  120    HB2  GLU  15           HB2      GLU  15  -4.501  -2.348 -11.394
  121    HB3  GLU  15           HB1      GLU  15  -3.326  -3.031 -10.280
  122    HG2  GLU  15           HG2      GLU  15  -1.579  -1.654 -11.452
  123    HG3  GLU  15           HG1      GLU  15  -2.900  -0.849 -12.299
  124    H    LEU  16           HN       LEU  16  -1.052  -5.150 -12.591
  125    HA   LEU  16           HA       LEU  16  -2.043  -7.494 -11.274
  126    HB2  LEU  16           HB2      LEU  16  -0.482  -7.719 -13.111
  127    HB3  LEU  16           HB1      LEU  16   0.718  -6.770 -12.253
  128    HG   LEU  16           HG       LEU  16   0.330  -8.757 -10.461
  129   HD11  LEU  16          HD11      LEU  16  -1.043  -9.686 -12.693
  130   HD12  LEU  16          HD12      LEU  16  -0.527 -10.627 -11.294
  131   HD13  LEU  16          HD13      LEU  16   0.500 -10.540 -12.724
  132   HD21  LEU  16          HD21      LEU  16   2.446  -7.876 -11.536
  133   HD22  LEU  16          HD22      LEU  16   2.193  -9.081 -12.798
  134   HD23  LEU  16          HD23      LEU  16   2.432  -9.592 -11.128
  135    H    LYS  17           HN       LYS  17   0.945  -5.685 -10.585
  136    HA   LYS  17           HA       LYS  17   1.826  -4.913  -8.620
  137    HB2  LYS  17           HB2      LYS  17  -0.745  -4.559  -8.092
  138    HB3  LYS  17           HB1      LYS  17  -0.467  -5.892  -6.981
  139    HG2  LYS  17           HG2      LYS  17   0.690  -4.621  -5.548
  140    HG3  LYS  17           HG1      LYS  17   1.543  -3.768  -6.837
  141    HD2  LYS  17           HD2      LYS  17  -0.748  -2.619  -7.246
  142    HD3  LYS  17           HD1      LYS  17  -1.127  -3.176  -5.615
  143    HE2  LYS  17           HE2      LYS  17   1.328  -2.091  -5.234
  144    HE3  LYS  17           HE1      LYS  17   0.704  -1.058  -6.519
  145    HZ1  LYS  17           HZ1      LYS  17  -0.896  -1.639  -4.103
  146    HZ2  LYS  17           HZ2      LYS  17  -1.064  -0.361  -5.199
  147    HZ3  LYS  17           HZ3      LYS  17   0.241  -0.385  -4.122
  148    H    PHE  18           HN       PHE  18   0.071  -7.997  -8.243
  149    HA   PHE  18           HA       PHE  18   2.371  -9.523  -7.822
  150    HB2  PHE  18           HB2      PHE  18   2.195 -10.004  -5.416
  151    HB3  PHE  18           HB1      PHE  18   2.553  -8.306  -5.705
  152    HD1  PHE  18           HD1      PHE  18   0.747  -6.613  -5.459
  153    HD2  PHE  18           HD2      PHE  18   0.233 -10.673  -4.291
  154    HE1  PHE  18           HE1      PHE  18  -1.190  -5.967  -4.085
  155    HE2  PHE  18           HE2      PHE  18  -1.706 -10.035  -2.916
  156    HZ   PHE  18           HZ       PHE  18  -2.419  -7.680  -2.811
  157    H    ARG  19           HN       ARG  19   1.570 -11.620  -6.364
  158    HA   ARG  19           HA       ARG  19  -0.221 -12.976  -7.999
  159    HB2  ARG  19           HB2      ARG  19   1.446 -13.926  -6.309
  160    HB3  ARG  19           HB1      ARG  19   0.206 -13.652  -5.094
  161    HG2  ARG  19           HG2      ARG  19  -0.783 -15.089  -7.425
  162    HG3  ARG  19           HG1      ARG  19   0.525 -15.928  -6.590
  163    HD2  ARG  19           HD2      ARG  19  -0.747 -16.376  -4.795
  164    HD3  ARG  19           HD1      ARG  19  -1.504 -14.784  -4.812
  165    HE   ARG  19           HE       ARG  19  -3.287 -15.746  -5.836
  166   HH11  ARG  19          HH11      ARG  19  -0.468 -17.670  -6.565
  167   HH12  ARG  19          HH12      ARG  19  -1.357 -18.860  -7.457
  168   HH21  ARG  19          HH21      ARG  19  -4.457 -17.309  -7.007
  169   HH22  ARG  19          HH22      ARG  19  -3.621 -18.655  -7.707
  170    H    GLY  20           HN       GLY  20  -2.388 -13.188  -8.083
  171    HA2  GLY  20           HA2      GLY  20  -4.609 -12.969  -7.506
  172    HA3  GLY  20           HA1      GLY  20  -4.101 -12.667  -5.853
  173    HA   PRO  21           HA       PRO  21  -3.743  -8.250  -7.646
  174    HB2  PRO  21           HB2      PRO  21  -4.577  -8.549 -10.471
  175    HB3  PRO  21           HB1      PRO  21  -3.262  -7.603  -9.779
  176    HG2  PRO  21           HG2      PRO  21  -2.819  -9.871 -11.161
  177    HG3  PRO  21           HG1      PRO  21  -1.789  -9.365  -9.810
  178    HD2  PRO  21           HD2      PRO  21  -3.890 -11.478  -9.909
  179    HD3  PRO  21           HD1      PRO  21  -2.368 -11.434  -9.000
  180    H    PHE  22           HN       PHE  22  -6.119 -10.240  -9.401
  181    HA   PHE  22           HA       PHE  22  -8.245  -8.382  -9.073
  182    HB2  PHE  22           HB2      PHE  22  -7.887 -10.450 -10.725
  183    HB3  PHE  22           HB1      PHE  22  -8.831 -11.268  -9.485
  184    HD1  PHE  22           HD1      PHE  22  -8.856  -8.680 -12.068
  185    HD2  PHE  22           HD2      PHE  22 -11.147 -10.714  -9.115
  186    HE1  PHE  22           HE1      PHE  22 -10.921  -7.777 -13.054
  187    HE2  PHE  22           HE2      PHE  22 -13.216  -9.815 -10.094
  188    HZ   PHE  22           HZ       PHE  22 -13.105  -8.345 -12.067
  189    H    THR  23           HN       THR  23  -7.425 -11.432  -7.451
  190    HA   THR  23           HA       THR  23  -9.644 -11.383  -5.693
  191    HB   THR  23           HB       THR  23  -8.238 -13.118  -4.425
  192    HG1  THR  23           HG1      THR  23  -6.207 -12.804  -5.056
  193   HG21  THR  23          HG21      THR  23  -8.615 -13.785  -7.321
  194   HG22  THR  23          HG22      THR  23  -9.971 -13.611  -6.207
  195   HG23  THR  23          HG23      THR  23  -8.744 -14.844  -5.918
  196    H    ASP  24           HN       ASP  24  -6.194 -10.676  -5.084
  197    HA   ASP  24           HA       ASP  24  -6.642  -9.962  -2.378
  198    HB2  ASP  24           HB2      ASP  24  -4.423 -10.564  -3.780
  199    HB3  ASP  24           HB1      ASP  24  -4.284  -8.807  -3.742
  200    H    VAL  25           HN       VAL  25  -6.059  -7.967  -5.276
  201    HA   VAL  25           HA       VAL  25  -6.249  -5.507  -3.919
  202    HB   VAL  25           HB       VAL  25  -5.528  -6.109  -6.423
  203   HG11  VAL  25          HG11      VAL  25  -7.053  -5.375  -8.072
  204   HG12  VAL  25          HG12      VAL  25  -8.166  -4.731  -6.865
  205   HG13  VAL  25          HG13      VAL  25  -7.965  -6.474  -7.037
  206   HG21  VAL  25          HG21      VAL  25  -6.385  -3.547  -5.161
  207   HG22  VAL  25          HG22      VAL  25  -5.858  -3.557  -6.844
  208   HG23  VAL  25          HG23      VAL  25  -4.767  -4.114  -5.575
  209    H    VAL  26           HN       VAL  26  -8.780  -7.430  -5.517
  210    HA   VAL  26           HA       VAL  26 -10.831  -5.546  -5.349
  211    HB   VAL  26           HB       VAL  26 -10.863  -8.547  -5.426
  212   HG11  VAL  26          HG11      VAL  26 -13.102  -6.749  -4.713
  213   HG12  VAL  26          HG12      VAL  26 -12.828  -8.441  -4.296
  214   HG13  VAL  26          HG13      VAL  26 -13.442  -8.015  -5.893
  215   HG21  VAL  26          HG21      VAL  26 -11.618  -8.273  -7.629
  216   HG22  VAL  26          HG22      VAL  26 -10.380  -7.033  -7.426
  217   HG23  VAL  26          HG23      VAL  26 -12.087  -6.596  -7.352
  218    H    THR  27           HN       THR  27  -9.677  -7.873  -2.953
  219    HA   THR  27           HA       THR  27 -11.707  -7.546  -1.060
  220    HB   THR  27           HB       THR  27  -8.771  -8.001  -0.481
  221    HG1  THR  27           HG1      THR  27 -10.813  -9.840  -1.173
  222   HG21  THR  27          HG21      THR  27 -11.144  -8.051   1.179
  223   HG22  THR  27          HG22      THR  27  -9.440  -8.079   1.632
  224   HG23  THR  27          HG23      THR  27 -10.265  -9.578   1.205
  225    H    THR  28           HN       THR  28  -8.655  -5.801  -1.493
  226    HA   THR  28           HA       THR  28  -9.110  -3.962   0.636
  227    HB   THR  28           HB       THR  28  -7.345  -2.666  -0.991
  228    HG1  THR  28           HG1      THR  28  -6.741  -5.389  -1.397
  229   HG21  THR  28          HG21      THR  28  -5.720  -4.524   0.249
  230   HG22  THR  28          HG22      THR  28  -7.139  -4.422   1.292
  231   HG23  THR  28          HG23      THR  28  -6.228  -2.964   0.896
  232    H    ASN  29           HN       ASN  29  -9.617  -3.896  -2.855
  233    HA   ASN  29           HA       ASN  29 -10.367  -1.222  -3.129
  234    HB2  ASN  29           HB2      ASN  29 -10.654  -3.686  -4.716
  235    HB3  ASN  29           HB1      ASN  29 -11.864  -2.449  -5.048
  236   HD21  ASN  29          1HE2      ASN  29 -10.761  -0.155  -5.083
  237   HD22  ASN  29          2HE2      ASN  29  -9.389  -0.054  -6.127
  238    H    LEU  30           HN       LEU  30 -12.238  -4.054  -2.187
  239    HA   LEU  30           HA       LEU  30 -14.806  -2.962  -2.358
  240    HB2  LEU  30           HB2      LEU  30 -14.523  -5.317  -1.983
  241    HB3  LEU  30           HB1      LEU  30 -13.655  -5.031  -0.488
  242    HG   LEU  30           HG       LEU  30 -16.065  -5.846  -0.305
  243   HD11  LEU  30          HD11      LEU  30 -14.572  -4.542   1.426
  244   HD12  LEU  30          HD12      LEU  30 -16.271  -4.878   1.754
  245   HD13  LEU  30          HD13      LEU  30 -15.782  -3.283   1.180
  246   HD21  LEU  30          HD21      LEU  30 -17.102  -4.456  -1.967
  247   HD22  LEU  30          HD22      LEU  30 -16.571  -2.993  -1.137
  248   HD23  LEU  30          HD23      LEU  30 -17.770  -4.045  -0.387
  249    H    LYS  31           HN       LYS  31 -12.552  -3.058   0.377
  250    HA   LYS  31           HA       LYS  31 -14.232  -1.201   1.866
  251    HB2  LYS  31           HB2      LYS  31 -11.823  -2.865   2.542
  252    HB3  LYS  31           HB1      LYS  31 -12.311  -1.539   3.588
  253    HG2  LYS  31           HG2      LYS  31 -13.793  -2.851   4.569
  254    HG3  LYS  31           HG1      LYS  31 -14.618  -3.086   3.027
  255    HD2  LYS  31           HD2      LYS  31 -14.042  -5.244   3.858
  256    HD3  LYS  31           HD1      LYS  31 -12.950  -4.892   2.518
  257    HE2  LYS  31           HE2      LYS  31 -11.296  -5.436   3.913
  258    HE3  LYS  31           HE1      LYS  31 -11.605  -3.890   4.703
  259    HZ1  LYS  31           HZ1      LYS  31 -13.324  -5.202   6.045
  260    HZ2  LYS  31           HZ2      LYS  31 -11.689  -5.426   6.421
  261    HZ3  LYS  31           HZ3      LYS  31 -12.512  -6.583   5.502
  262    H    LEU  32           HN       LEU  32 -13.501   0.173  -0.233
  263    HA   LEU  32           HA       LEU  32 -10.945   1.457   0.109
  264    HB2  LEU  32           HB2      LEU  32 -12.826   1.210  -1.974
  265    HB3  LEU  32           HB1      LEU  32 -12.744   2.921  -1.605
  266    HG   LEU  32           HG       LEU  32 -11.186   2.052  -3.421
  267   HD11  LEU  32          HD11      LEU  32  -9.828   3.810  -3.047
  268   HD12  LEU  32          HD12      LEU  32  -9.471   3.320  -1.390
  269   HD13  LEU  32          HD13      LEU  32 -10.983   4.152  -1.758
  270   HD21  LEU  32          HD21      LEU  32  -9.217   1.298  -1.376
  271   HD22  LEU  32          HD22      LEU  32  -9.505   0.628  -2.982
  272   HD23  LEU  32          HD23      LEU  32 -10.524   0.140  -1.629
  273    H    GLY  33           HN       GLY  33 -11.798   1.787   2.427
  274    HA2  GLY  33           HA2      GLY  33 -12.084   4.571   2.836
  275    HA3  GLY  33           HA1      GLY  33 -13.640   3.789   3.071
  276    H    ASN  34           HN       ASN  34 -13.918   2.337   4.819
  277    HA   ASN  34           HA       ASN  34 -11.884   2.661   6.921
  278    HB2  ASN  34           HB2      ASN  34 -13.744   2.101   8.494
  279    HB3  ASN  34           HB1      ASN  34 -14.022   3.572   7.568
  280   HD21  ASN  34          1HE2      ASN  34 -15.262   0.596   8.483
  281   HD22  ASN  34          2HE2      ASN  34 -16.613   0.539   7.407
  282    HA   PRO  35           HA       PRO  35 -11.729  -1.837   5.728
  283    HB2  PRO  35           HB2      PRO  35  -9.044  -2.042   5.611
  284    HB3  PRO  35           HB1      PRO  35 -10.002  -1.443   4.251
  285    HG2  PRO  35           HG2      PRO  35  -8.474   0.105   6.313
  286    HG3  PRO  35           HG1      PRO  35  -8.530   0.340   4.556
  287    HD2  PRO  35           HD2      PRO  35  -9.994   1.840   6.274
  288    HD3  PRO  35           HD1      PRO  35 -10.553   1.436   4.639
  289    H    THR  36           HN       THR  36 -12.417  -2.615   7.694
  290    HA   THR  36           HA       THR  36 -12.345  -3.348   9.856
  291    HB   THR  36           HB       THR  36  -9.452  -3.948   9.671
  292    HG1  THR  36           HG1      THR  36  -9.862  -5.558   8.088
  293   HG21  THR  36          HG21      THR  36  -9.979  -5.926  10.652
  294   HG22  THR  36          HG22      THR  36 -11.567  -6.012   9.891
  295   HG23  THR  36          HG23      THR  36 -11.303  -4.930  11.257
  296    H    ASP  37           HN       ASP  37 -11.964  -0.573   9.690
  297    HA   ASP  37           HA       ASP  37  -9.750   0.411  11.087
  298    HB2  ASP  37           HB2      ASP  37 -12.459   1.408  10.423
  299    HB3  ASP  37           HB1      ASP  37 -11.655   2.199  11.776
  300    H    ARG  38           HN       ARG  38 -12.917  -0.671  12.258
  301    HA   ARG  38           HA       ARG  38 -13.653  -1.295  14.316
  302    HB2  ARG  38           HB2      ARG  38 -10.736  -1.574  15.043
  303    HB3  ARG  38           HB1      ARG  38 -12.102  -2.369  15.812
  304    HG2  ARG  38           HG2      ARG  38 -11.348  -2.811  12.937
  305    HG3  ARG  38           HG1      ARG  38 -10.737  -3.796  14.268
  306    HD2  ARG  38           HD2      ARG  38 -13.657  -3.386  13.643
  307    HD3  ARG  38           HD1      ARG  38 -12.709  -4.773  13.109
  308    HE   ARG  38           HE       ARG  38 -12.639  -4.335  15.952
  309   HH11  ARG  38          HH11      ARG  38 -14.366  -5.854  13.327
  310   HH12  ARG  38          HH12      ARG  38 -15.097  -7.055  14.338
  311   HH21  ARG  38          HH21      ARG  38 -13.597  -5.914  17.282
  312   HH22  ARG  38          HH22      ARG  38 -14.661  -7.089  16.583
  313    H    ASN  39           HN       ASN  39 -13.718   1.358  13.985
  314    HA   ASN  39           HA       ASN  39 -13.768   2.374  16.586
  315    HB2  ASN  39           HB2      ASN  39 -11.179   2.301  15.769
  316    HB3  ASN  39           HB1      ASN  39 -11.647   3.906  15.215
  317   HD21  ASN  39          1HE2      ASN  39  -9.889   4.314  16.877
  318   HD22  ASN  39          2HE2      ASN  39 -10.420   4.603  18.494
  319    H    VAL  40           HN       VAL  40 -14.520   4.561  16.691
  320    HA   VAL  40           HA       VAL  40 -16.121   5.282  14.429
  321    HB   VAL  40           HB       VAL  40 -16.951   5.610  16.709
  322   HG11  VAL  40          HG11      VAL  40 -15.908   6.785  18.323
  323   HG12  VAL  40          HG12      VAL  40 -15.321   8.012  17.199
  324   HG13  VAL  40          HG13      VAL  40 -14.476   6.470  17.343
  325   HG21  VAL  40          HG21      VAL  40 -17.762   7.939  16.451
  326   HG22  VAL  40          HG22      VAL  40 -17.917   6.980  14.979
  327   HG23  VAL  40          HG23      VAL  40 -16.614   8.158  15.130
  328    H    CYS  41           HN       CYS  41 -14.164   5.498  13.007
  329    HA   CYS  41           HA       CYS  41 -13.471   8.314  12.820
  330    HB2  CYS  41           HB2      CYS  41 -11.687   6.859  14.146
  331    HB3  CYS  41           HB1      CYS  41 -11.184   6.421  12.516
  332    HG   CYS  41           HG       CYS  41  -9.826   8.504  13.279
  333    H    PHE  42           HN       PHE  42 -12.514   8.869  10.735
  334    HA   PHE  42           HA       PHE  42 -13.532   7.102   8.637
  335    HB2  PHE  42           HB2      PHE  42 -13.548   9.919   9.025
  336    HB3  PHE  42           HB1      PHE  42 -12.581   9.592   7.592
  337    HD1  PHE  42           HD2      PHE  42 -15.902   9.197   9.125
  338    HD2  PHE  42           HD1      PHE  42 -13.579   8.824   5.579
  339    HE1  PHE  42           HE2      PHE  42 -17.962   8.918   7.808
  340    HE2  PHE  42           HE1      PHE  42 -15.635   8.546   4.256
  341    HZ   PHE  42           HZ       PHE  42 -17.830   8.592   5.371
  342    H    LYS  43           HN       LYS  43 -11.243   6.153   9.772
  343    HA   LYS  43           HA       LYS  43  -9.200   5.328   9.256
  344    HB2  LYS  43           HB2      LYS  43  -8.956   4.677   7.109
  345    HB3  LYS  43           HB1      LYS  43 -10.557   5.363   6.906
  346    HG2  LYS  43           HG2      LYS  43  -9.131   7.556   6.420
  347    HG3  LYS  43           HG1      LYS  43  -7.938   6.348   5.947
  348    HD2  LYS  43           HD2      LYS  43 -10.612   5.783   4.928
  349    HD3  LYS  43           HD1      LYS  43  -9.968   7.327   4.365
  350    HE2  LYS  43           HE2      LYS  43  -7.807   5.847   3.958
  351    HE3  LYS  43           HE1      LYS  43  -9.010   4.561   3.855
  352    HZ1  LYS  43           HZ1      LYS  43 -10.113   6.434   2.304
  353    HZ2  LYS  43           HZ2      LYS  43  -9.107   5.205   1.722
  354    HZ3  LYS  43           HZ3      LYS  43  -8.472   6.742   2.026
  355    H    VAL  44           HN       VAL  44  -7.073   6.242   7.736
  356    HA   VAL  44           HA       VAL  44  -5.380   7.764   7.700
  357    HB   VAL  44           HB       VAL  44  -7.373   9.872   8.528
  358   HG11  VAL  44          HG11      VAL  44  -5.770  11.370   8.101
  359   HG12  VAL  44          HG12      VAL  44  -5.278  10.553   6.619
  360   HG13  VAL  44          HG13      VAL  44  -4.652  10.009   8.175
  361   HG21  VAL  44          HG21      VAL  44  -8.488   9.414   6.650
  362   HG22  VAL  44          HG22      VAL  44  -7.218   8.346   6.055
  363   HG23  VAL  44          HG23      VAL  44  -7.100  10.086   5.797
  364    H    LYS  45           HN       LYS  45  -6.085   6.287  10.094
  365    HA   LYS  45           HA       LYS  45  -4.279   7.302  11.915
  366    HB2  LYS  45           HB2      LYS  45  -6.688   8.795  11.985
  367    HB3  LYS  45           HB1      LYS  45  -6.659   7.812  13.441
  368    HG2  LYS  45           HG2      LYS  45  -4.759   8.835  14.257
  369    HG3  LYS  45           HG1      LYS  45  -4.242   9.380  12.661
  370    HD2  LYS  45           HD2      LYS  45  -6.589  10.690  12.877
  371    HD3  LYS  45           HD1      LYS  45  -6.118  10.614  14.576
  372    HE2  LYS  45           HE2      LYS  45  -3.810  11.430  13.680
  373    HE3  LYS  45           HE1      LYS  45  -4.748  11.955  12.283
  374    HZ1  LYS  45           HZ1      LYS  45  -4.364  13.480  14.401
  375    HZ2  LYS  45           HZ2      LYS  45  -5.776  12.697  14.906
  376    HZ3  LYS  45           HZ3      LYS  45  -5.767  13.573  13.459
  377    H    THR  46           HN       THR  46  -7.606   6.146  12.457
  378    HA   THR  46           HA       THR  46  -6.979   4.225  14.361
  379    HB   THR  46           HB       THR  46  -9.155   3.197  13.801
  380    HG1  THR  46           HG1      THR  46  -9.246   5.072  11.679
  381   HG21  THR  46          HG21      THR  46  -9.232   5.166  15.196
  382   HG22  THR  46          HG22      THR  46 -10.603   5.149  14.086
  383   HG23  THR  46          HG23      THR  46  -9.226   6.203  13.770
  384    H    THR  47           HN       THR  47  -7.753   3.562  10.940
  385    HA   THR  47           HA       THR  47  -7.189   1.838   9.564
  386    HB   THR  47           HB       THR  47  -4.598   1.156  10.529
  387    HG1  THR  47           HG1      THR  47  -4.362   2.924  11.730
  388   HG21  THR  47          HG21      THR  47  -5.786   2.108   8.149
  389   HG22  THR  47          HG22      THR  47  -4.185   1.406   8.380
  390   HG23  THR  47          HG23      THR  47  -4.414   3.148   8.528
  391    H    ALA  48           HN       ALA  48  -6.074  -0.478   9.586
  392    HA   ALA  48           HA       ALA  48  -7.310  -1.903  11.838
  393    HB1  ALA  48           HB1      ALA  48  -6.526  -2.976   9.130
  394    HB2  ALA  48           HB2      ALA  48  -8.143  -2.438   9.582
  395    HB3  ALA  48           HB3      ALA  48  -7.423  -3.834  10.383
  396    HA   PRO  49           HA       PRO  49  -3.598  -3.484  13.582
  397    HB2  PRO  49           HB2      PRO  49  -4.595  -6.238  13.044
  398    HB3  PRO  49           HB1      PRO  49  -4.045  -5.517  14.560
  399    HG2  PRO  49           HG2      PRO  49  -6.639  -5.907  14.108
  400    HG3  PRO  49           HG1      PRO  49  -6.069  -4.448  14.939
  401    HD2  PRO  49           HD2      PRO  49  -7.014  -4.783  12.126
  402    HD3  PRO  49           HD1      PRO  49  -7.245  -3.421  13.240
  403    H    ARG  50           HN       ARG  50  -1.607  -4.474  13.076
  404    HA   ARG  50           HA       ARG  50  -1.223  -5.956  10.659
  405    HB2  ARG  50           HB2      ARG  50  -1.366  -3.277  10.229
  406    HB3  ARG  50           HB1      ARG  50   0.354  -3.462  10.540
  407    HG2  ARG  50           HG2      ARG  50   0.469  -3.882   8.346
  408    HG3  ARG  50           HG1      ARG  50  -0.073  -5.498   8.805
  409    HD2  ARG  50           HD2      ARG  50  -2.346  -3.787   8.556
  410    HD3  ARG  50           HD1      ARG  50  -1.353  -3.634   7.107
  411    HE   ARG  50           HE       ARG  50  -1.532  -6.325   7.536
  412   HH11  ARG  50          HH11      ARG  50  -3.841  -3.742   7.118
  413   HH12  ARG  50          HH12      ARG  50  -5.042  -4.764   6.399
  414   HH21  ARG  50          HH21      ARG  50  -3.107  -7.669   6.589
  415   HH22  ARG  50          HH22      ARG  50  -4.625  -6.993   6.099
  416    H    ARG  51           HN       ARG  51   0.260  -7.386  11.241
  417    HA   ARG  51           HA       ARG  51   2.167  -6.734  13.340
  418    HB2  ARG  51           HB2      ARG  51   0.868  -9.120  12.401
  419    HB3  ARG  51           HB1      ARG  51   2.610  -9.360  12.395
  420    HG2  ARG  51           HG2      ARG  51   1.916 -10.074  14.505
  421    HG3  ARG  51           HG1      ARG  51   2.578  -8.460  14.778
  422    HD2  ARG  51           HD2      ARG  51   0.438  -7.505  14.986
  423    HD3  ARG  51           HD1      ARG  51  -0.350  -8.921  14.292
  424    HE   ARG  51           HE       ARG  51  -0.334  -9.903  16.359
  425   HH11  ARG  51          HH11      ARG  51   1.840  -7.174  16.388
  426   HH12  ARG  51          HH12      ARG  51   2.098  -7.239  18.099
  427   HH21  ARG  51          HH21      ARG  51   0.003  -9.990  18.610
  428   HH22  ARG  51          HH22      ARG  51   1.056  -8.838  19.361
  429    H    TYR  52           HN       TYR  52   2.501  -8.535  10.278
  430    HA   TYR  52           HA       TYR  52   5.149  -7.289   9.956
  431    HB2  TYR  52           HB2      TYR  52   4.090  -9.907   8.872
  432    HB3  TYR  52           HB1      TYR  52   5.681  -9.244   8.514
  433    HD1  TYR  52           HD1      TYR  52   7.390  -9.097  10.299
  434    HD2  TYR  52           HD2      TYR  52   3.639 -10.995  10.954
  435    HE1  TYR  52           HE1      TYR  52   8.300 -10.193  12.303
  436    HE2  TYR  52           HE2      TYR  52   4.539 -12.095  12.960
  437    HH   TYR  52           HH       TYR  52   6.478 -11.553  14.645
  438    H    CYS  53           HN       CYS  53   4.455  -5.427   8.903
  439    HA   CYS  53           HA       CYS  53   4.423  -5.463   6.121
  440    HB2  CYS  53           HB2      CYS  53   1.981  -6.404   6.913
  441    HB3  CYS  53           HB1      CYS  53   1.643  -4.688   6.757
  442    HG   CYS  53           HG       CYS  53   1.162  -5.600   4.416
  443    H    VAL  54           HN       VAL  54   5.388  -3.975   8.389
  444    HA   VAL  54           HA       VAL  54   5.633  -1.855   9.218
  445    HB   VAL  54           HB       VAL  54   6.936  -1.642   7.266
  446   HG11  VAL  54          HG11      VAL  54   5.477  -2.523   5.592
  447   HG12  VAL  54          HG12      VAL  54   5.963  -0.903   5.092
  448   HG13  VAL  54          HG13      VAL  54   4.362  -1.170   5.780
  449   HG21  VAL  54          HG21      VAL  54   6.995   0.654   7.014
  450   HG22  VAL  54          HG22      VAL  54   6.119   0.468   8.533
  451   HG23  VAL  54          HG23      VAL  54   5.238   0.804   7.042
  452    H    ARG  55           HN       ARG  55   3.587  -1.884  10.281
  453    HA   ARG  55           HA       ARG  55   2.102   0.455   9.901
  454    HB2  ARG  55           HB2      ARG  55   1.275  -0.979   7.944
  455    HB3  ARG  55           HB1      ARG  55   0.481  -1.973   9.158
  456    HG2  ARG  55           HG2      ARG  55  -1.052  -0.358   9.683
  457    HG3  ARG  55           HG1      ARG  55   0.004   0.963   9.181
  458    HD2  ARG  55           HD2      ARG  55  -1.101   1.034   7.255
  459    HD3  ARG  55           HD1      ARG  55  -0.450  -0.562   6.877
  460    HE   ARG  55           HE       ARG  55  -2.806  -0.628   8.525
  461   HH11  ARG  55          HH11      ARG  55  -1.604  -0.512   5.250
  462   HH12  ARG  55          HH12      ARG  55  -3.038  -1.201   4.567
  463   HH21  ARG  55          HH21      ARG  55  -4.693  -1.535   7.628
  464   HH22  ARG  55          HH22      ARG  55  -4.792  -1.780   5.916
  465    H    SER  56           HN       SER  56   0.486   0.769  11.498
  466    HA   SER  56           HA       SER  56  -0.151   0.687  13.690
  467    HB2  SER  56           HB2      SER  56  -1.190  -1.621  14.265
  468    HB3  SER  56           HB1      SER  56  -1.891  -0.685  12.944
  469    HG   SER  56           HG       SER  56  -0.187  -2.934  12.801
  470    H    ASN  57           HN       ASN  57   2.707   0.101  13.245
  471    HA   ASN  57           HA       ASN  57   3.415  -1.991  15.078
  472    HB2  ASN  57           HB2      ASN  57   4.976   0.117  13.603
  473    HB3  ASN  57           HB1      ASN  57   5.743  -0.904  14.816
  474   HD21  ASN  57          1HE2      ASN  57   6.557  -0.895  12.186
  475   HD22  ASN  57          2HE2      ASN  57   6.178  -2.420  11.467
  476    H    SER  58           HN       SER  58   3.085   1.512  15.246
  477    HA   SER  58           HA       SER  58   4.228   1.664  17.893
  478    HB2  SER  58           HB2      SER  58   4.237   3.514  16.106
  479    HB3  SER  58           HB1      SER  58   2.570   3.817  16.594
  480    HG   SER  58           HG       SER  58   3.266   4.733  18.354
  481    H    GLY  59           HN       GLY  59   0.977   1.531  16.527
  482    HA2  GLY  59           HA2      GLY  59  -0.307   0.340  18.577
  483    HA3  GLY  59           HA1      GLY  59  -0.310   2.031  19.049
  484    H    ILE  60           HN       ILE  60  -0.592   0.825  15.721
  485    HA   ILE  60           HA       ILE  60  -2.252   0.918  14.201
  486    HB   ILE  60           HB       ILE  60  -3.557   0.155  16.527
  487   HG12  ILE  60          HG12      ILE  60  -4.677   0.378  13.726
  488   HG13  ILE  60          HG11      ILE  60  -3.654  -0.926  14.319
  489   HG21  ILE  60          HG21      ILE  60  -5.151   2.366  15.234
  490   HG22  ILE  60          HG22      ILE  60  -4.454   2.402  16.854
  491   HG23  ILE  60          HG23      ILE  60  -5.735   1.254  16.472
  492   HD11  ILE  60          HD11      ILE  60  -5.413  -2.007  15.102
  493   HD12  ILE  60          HD12      ILE  60  -6.442  -0.775  14.372
  494   HD13  ILE  60          HD13      ILE  60  -5.912  -0.604  16.046
  495    H    ILE  61           HN       ILE  61  -2.711   3.355  16.762
  496    HA   ILE  61           HA       ILE  61  -3.760   5.255  14.873
  497    HB   ILE  61           HB       ILE  61  -3.577   5.002  17.778
  498   HG12  ILE  61          HG12      ILE  61  -5.659   4.821  16.447
  499   HG13  ILE  61          HG11      ILE  61  -5.757   6.065  17.690
  500   HG21  ILE  61          HG21      ILE  61  -3.773   7.450  18.197
  501   HG22  ILE  61          HG22      ILE  61  -3.266   7.727  16.530
  502   HG23  ILE  61          HG23      ILE  61  -2.174   6.932  17.666
  503   HD11  ILE  61          HD11      ILE  61  -4.896   6.899  14.984
  504   HD12  ILE  61          HD12      ILE  61  -5.867   7.754  16.182
  505   HD13  ILE  61          HD13      ILE  61  -6.590   6.468  15.217
  506    H    ASP  62           HN       ASP  62  -0.713   4.733  16.563
  507    HA   ASP  62           HA       ASP  62   0.328   7.280  15.658
  508    HB2  ASP  62           HB2      ASP  62   1.257   5.099  17.438
  509    HB3  ASP  62           HB1      ASP  62   2.514   6.003  16.598
  510    H    ALA  63           HN       ALA  63   0.516   3.901  14.791
  511    HA   ALA  63           HA       ALA  63   2.556   4.399  12.779
  512    HB1  ALA  63           HB1      ALA  63   1.861   1.875  12.284
  513    HB2  ALA  63           HB2      ALA  63   1.297   1.998  13.950
  514    HB3  ALA  63           HB3      ALA  63   2.985   2.328  13.560
  515    H    GLY  64           HN       GLY  64  -0.898   3.864  12.977
  516    HA2  GLY  64           HA2      GLY  64  -1.188   3.648  10.098
  517    HA3  GLY  64           HA1      GLY  64  -2.484   3.618  11.285
  518    H    ALA  65           HN       ALA  65   0.042   6.012  10.540
  519    HA   ALA  65           HA       ALA  65  -1.873   8.152  10.744
  520    HB1  ALA  65           HB1      ALA  65   0.167   8.799  11.598
  521    HB2  ALA  65           HB2      ALA  65   0.228   9.492   9.978
  522    HB3  ALA  65           HB3      ALA  65   1.079   7.986  10.325
  523    H    SER  66           HN       SER  66   0.179   6.807   8.156
  524    HA   SER  66           HA       SER  66  -1.792   7.211   6.160
  525    HB2  SER  66           HB2      SER  66   0.298   8.973   5.255
  526    HB3  SER  66           HB1      SER  66  -1.427   9.285   5.419
  527    HG   SER  66           HG       SER  66  -1.110  10.123   7.373
  528    H    ILE  67           HN       ILE  67  -0.920   4.909   6.028
  529    HA   ILE  67           HA       ILE  67   1.742   4.517   5.068
  530    HB   ILE  67           HB       ILE  67   0.459   2.816   6.362
  531   HG12  ILE  67          HG12      ILE  67   2.468   2.325   4.881
  532   HG13  ILE  67          HG11      ILE  67   1.444   0.952   5.278
  533   HG21  ILE  67          HG21      ILE  67  -1.692   3.134   5.188
  534   HG22  ILE  67          HG22      ILE  67  -1.199   1.445   5.288
  535   HG23  ILE  67          HG23      ILE  67  -1.007   2.330   3.776
  536   HD11  ILE  67          HD11      ILE  67   0.408   1.951   2.897
  537   HD12  ILE  67          HD12      ILE  67   1.386   0.501   3.113
  538   HD13  ILE  67          HD13      ILE  67   2.160   2.034   2.712
  539    H    ASN  68           HN       ASN  68  -1.414   4.867   3.562
  540    HA   ASN  68           HA       ASN  68  -0.487   5.733   1.109
  541    HB2  ASN  68           HB2      ASN  68   0.119   3.058   1.272
  542    HB3  ASN  68           HB1      ASN  68  -1.435   3.027   0.447
  543   HD21  ASN  68          1HE2      ASN  68  -0.840   2.547  -1.602
  544   HD22  ASN  68          2HE2      ASN  68   0.238   3.502  -2.556
  545    H    VAL  69           HN       VAL  69  -2.964   3.980   2.857
  546    HA   VAL  69           HA       VAL  69  -5.041   4.633   0.966
  547    HB   VAL  69           HB       VAL  69  -5.138   2.552   2.275
  548   HG11  VAL  69          HG11      VAL  69  -4.174   3.222   4.353
  549   HG12  VAL  69          HG12      VAL  69  -5.829   2.703   4.673
  550   HG13  VAL  69          HG13      VAL  69  -5.439   4.423   4.617
  551   HG21  VAL  69          HG21      VAL  69  -7.543   3.284   3.348
  552   HG22  VAL  69          HG22      VAL  69  -7.273   2.847   1.660
  553   HG23  VAL  69          HG23      VAL  69  -7.277   4.543   2.143
  554    H    SER  70           HN       SER  70  -3.845   5.916   4.007
  555    HA   SER  70           HA       SER  70  -6.020   7.562   4.662
  556    HB2  SER  70           HB2      SER  70  -3.131   8.237   5.220
  557    HB3  SER  70           HB1      SER  70  -4.550   8.677   6.168
  558    HG   SER  70           HG       SER  70  -3.565   6.951   7.171
  559    H    VAL  71           HN       VAL  71  -3.355   7.996   2.446
  560    HA   VAL  71           HA       VAL  71  -2.723   9.720   1.081
  561    HB   VAL  71           HB       VAL  71  -4.594  10.615  -0.323
  562   HG11  VAL  71          HG11      VAL  71  -3.663   8.767  -1.295
  563   HG12  VAL  71          HG12      VAL  71  -5.308   8.183  -1.047
  564   HG13  VAL  71          HG13      VAL  71  -4.030   7.722   0.077
  565   HG21  VAL  71          HG21      VAL  71  -6.824   9.771  -0.042
  566   HG22  VAL  71          HG22      VAL  71  -6.319  10.532   1.466
  567   HG23  VAL  71          HG23      VAL  71  -6.324   8.774   1.323
  568    H    MET  72           HN       MET  72  -2.279  10.833   3.302
  569    HA   MET  72           HA       MET  72  -3.806  13.348   3.413
  570    HB2  MET  72           HB2      MET  72  -3.081  11.529   5.458
  571    HB3  MET  72           HB1      MET  72  -2.131  12.985   5.715
  572    HG2  MET  72           HG2      MET  72  -4.245  13.014   6.944
  573    HG3  MET  72           HG1      MET  72  -4.130  14.330   5.777
  574    HE1  MET  72           HE1      MET  72  -5.268  14.743   3.982
  575    HE2  MET  72           HE2      MET  72  -6.923  14.753   4.592
  576    HE3  MET  72           HE3      MET  72  -6.518  13.810   3.159
  577    H    LEU  73           HN       LEU  73  -1.990  14.825   4.931
  578    HA   LEU  73           HA       LEU  73  -0.171  15.657   2.880
  579    HB2  LEU  73           HB2      LEU  73  -1.448  17.035   4.726
  580    HB3  LEU  73           HB1      LEU  73  -0.013  16.693   5.672
  581    HG   LEU  73           HG       LEU  73   1.099  17.615   3.363
  582   HD11  LEU  73          HD11      LEU  73  -1.578  18.922   3.707
  583   HD12  LEU  73          HD12      LEU  73  -0.836  18.281   2.240
  584   HD13  LEU  73          HD13      LEU  73  -0.222  19.769   2.961
  585   HD21  LEU  73          HD21      LEU  73   1.486  18.247   5.791
  586   HD22  LEU  73          HD22      LEU  73   0.217  19.452   5.572
  587   HD23  LEU  73          HD23      LEU  73   1.685  19.532   4.600
  588    H    GLN  74           HN       GLN  74   0.037  13.232   5.144
  589    HA   GLN  74           HA       GLN  74   2.972  13.310   5.033
  590    HB2  GLN  74           HB2      GLN  74   1.214  13.062   7.421
  591    HB3  GLN  74           HB1      GLN  74   2.673  12.082   7.384
  592    HG2  GLN  74           HG2      GLN  74   4.018  14.095   7.060
  593    HG3  GLN  74           HG1      GLN  74   2.554  15.077   7.105
  594   HE21  GLN  74          1HE2      GLN  74   1.622  15.556   9.036
  595   HE22  GLN  74          2HE2      GLN  74   2.310  15.137  10.564
  596    HA   PRO  75           HA       PRO  75   1.253   9.226   3.587
  597    HB2  PRO  75           HB2      PRO  75   2.937   9.602   1.240
  598    HB3  PRO  75           HB1      PRO  75   1.188   9.387   1.330
  599    HG2  PRO  75           HG2      PRO  75   2.351  11.728   0.603
  600    HG3  PRO  75           HG1      PRO  75   0.785  11.643   1.429
  601    HD2  PRO  75           HD2      PRO  75   3.493  12.252   2.560
  602    HD3  PRO  75           HD1      PRO  75   1.929  13.023   2.903
  603    H    PHE  76           HN       PHE  76   3.078   9.240   5.541
  604    HA   PHE  76           HA       PHE  76   4.721   7.050   4.957
  605    HB2  PHE  76           HB2      PHE  76   6.962   8.198   5.248
  606    HB3  PHE  76           HB1      PHE  76   6.161   8.455   3.703
  607    HD1  PHE  76           HD2      PHE  76   5.103  10.631   3.207
  608    HD2  PHE  76           HD1      PHE  76   7.392   9.996   6.739
  609    HE1  PHE  76           HE2      PHE  76   5.298  13.063   3.512
  610    HE2  PHE  76           HE1      PHE  76   7.592  12.429   7.050
  611    HZ   PHE  76           HZ       PHE  76   6.544  13.965   5.435
  612    H    ASP  77           HN       ASP  77   4.831   9.997   6.980
  613    HA   ASP  77           HA       ASP  77   5.224  10.261   9.220
  614    HB2  ASP  77           HB2      ASP  77   3.420   7.866   9.535
  615    HB3  ASP  77           HB1      ASP  77   3.571   9.261  10.599
  616    H    TYR  78           HN       TYR  78   7.475   9.355   8.673
  617    HA   TYR  78           HA       TYR  78   7.928   6.846  10.146
  618    HB2  TYR  78           HB2      TYR  78  10.180   6.910   8.919
  619    HB3  TYR  78           HB1      TYR  78   8.748   6.532   7.969
  620    HD1  TYR  78           HD2      TYR  78  10.542   9.635   9.063
  621    HD2  TYR  78           HD1      TYR  78   8.713   7.486   5.880
  622    HE1  TYR  78           HE2      TYR  78  11.086  11.470   7.521
  623    HE2  TYR  78           HE1      TYR  78   9.253   9.315   4.327
  624    HH   TYR  78           HH       TYR  78  11.385  11.861   5.157
  625    H    ASP  79           HN       ASP  79   7.836   9.883  10.977
  626    HA   ASP  79           HA       ASP  79  10.323  10.719  11.821
  627    HB2  ASP  79           HB2      ASP  79   7.553  11.273  12.622
  628    HB3  ASP  79           HB1      ASP  79   8.738  11.563  13.891
  629    HA   PRO  80           HA       PRO  80  10.188   8.422  15.959
  630    HB2  PRO  80           HB2      PRO  80   7.972   7.194  16.847
  631    HB3  PRO  80           HB1      PRO  80   8.191   8.940  17.022
  632    HG2  PRO  80           HG2      PRO  80   6.605   7.426  14.981
  633    HG3  PRO  80           HG1      PRO  80   6.162   8.889  15.882
  634    HD2  PRO  80           HD2      PRO  80   7.096   8.924  13.318
  635    HD3  PRO  80           HD1      PRO  80   7.317  10.264  14.459
  636    H    ASN  81           HN       ASN  81  11.370   7.153  14.236
  637    HA   ASN  81           HA       ASN  81  11.274   4.434  14.673
  638    HB2  ASN  81           HB2      ASN  81   9.241   5.292  12.758
  639    HB3  ASN  81           HB1      ASN  81  10.305   4.051  12.108
  640   HD21  ASN  81          1HE2      ASN  81   7.883   3.227  12.261
  641   HD22  ASN  81          2HE2      ASN  81   7.583   2.219  13.631
  642    H    GLU  82           HN       GLU  82  13.291   6.000  14.465
  643    HA   GLU  82           HA       GLU  82  14.453   6.222  11.869
  644    HB2  GLU  82           HB2      GLU  82  15.329   6.807  14.655
  645    HB3  GLU  82           HB1      GLU  82  16.577   6.616  13.431
  646    HG2  GLU  82           HG2      GLU  82  15.639   8.395  12.121
  647    HG3  GLU  82           HG1      GLU  82  14.263   8.526  13.215
  648    H    LYS  83           HN       LYS  83  14.689   3.857  14.481
  649    HA   LYS  83           HA       LYS  83  16.981   2.506  13.543
  650    HB2  LYS  83           HB2      LYS  83  14.827   1.983  15.451
  651    HB3  LYS  83           HB1      LYS  83  15.359   0.524  14.630
  652    HG2  LYS  83           HG2      LYS  83  17.738   1.648  15.290
  653    HG3  LYS  83           HG1      LYS  83  16.721   2.164  16.637
  654    HD2  LYS  83           HD2      LYS  83  17.060   0.154  17.539
  655    HD3  LYS  83           HD1      LYS  83  16.067  -0.515  16.243
  656    HE2  LYS  83           HE2      LYS  83  18.438  -0.283  14.973
  657    HE3  LYS  83           HE1      LYS  83  18.991  -0.572  16.622
  658    HZ1  LYS  83           HZ1      LYS  83  17.645  -2.361  14.781
  659    HZ2  LYS  83           HZ2      LYS  83  17.103  -2.439  16.381
  660    HZ3  LYS  83           HZ3      LYS  83  18.735  -2.709  16.028
  661    H    SER  84           HN       SER  84  13.540   2.031  12.984
  662    HA   SER  84           HA       SER  84  13.736  -0.055  11.101
  663    HB2  SER  84           HB2      SER  84  11.604   2.063  11.397
  664    HB3  SER  84           HB1      SER  84  11.443   0.599  10.426
  665    HG   SER  84           HG       SER  84  10.540   0.435  12.564
  666    H    LYS  85           HN       LYS  85  14.381   3.300  10.829
  667    HA   LYS  85           HA       LYS  85  14.719   4.703   9.025
  668    HB2  LYS  85           HB2      LYS  85  16.841   3.693   9.292
  669    HB3  LYS  85           HB1      LYS  85  16.355   2.252   8.413
  670    HG2  LYS  85           HG2      LYS  85  17.053   3.145   6.511
  671    HG3  LYS  85           HG1      LYS  85  15.990   4.535   6.736
  672    HD2  LYS  85           HD2      LYS  85  17.659   5.734   7.916
  673    HD3  LYS  85           HD1      LYS  85  18.667   4.297   8.091
  674    HE2  LYS  85           HE2      LYS  85  18.051   4.945   5.314
  675    HE3  LYS  85           HE1      LYS  85  18.927   6.228   6.148
  676    HZ1  LYS  85           HZ1      LYS  85  19.809   3.564   5.398
  677    HZ2  LYS  85           HZ2      LYS  85  20.319   4.098   6.919
  678    HZ3  LYS  85           HZ3      LYS  85  20.693   5.000   5.539
  679    H    HIS  86           HN       HIS  86  12.730   4.922   7.960
  680    HA   HIS  86           HA       HIS  86  12.449   3.281   5.503
  681    HB2  HIS  86           HB2      HIS  86  10.690   3.288   7.673
  682    HB3  HIS  86           HB1      HIS  86   9.880   4.231   6.426
  683    HD1  HIS  86           HD1      HIS  86  10.791   0.787   7.366
  684    HD2  HIS  86           HD2      HIS  86   9.377   2.774   4.002
  685    HE1  HIS  86           HE1      HIS  86   9.945  -1.013   5.828
  686    HE2  HIS  86           HE2      HIS  86   9.169   0.207   3.765
  687    H    LYS  87           HN       LYS  87  10.875   4.244   3.854
  688    HA   LYS  87           HA       LYS  87  10.161   6.926   3.702
  689    HB2  LYS  87           HB2      LYS  87  12.979   6.388   2.989
  690    HB3  LYS  87           HB1      LYS  87  12.086   7.396   1.859
  691    HG2  LYS  87           HG2      LYS  87  11.589   8.265   4.545
  692    HG3  LYS  87           HG1      LYS  87  13.324   8.172   4.246
  693    HD2  LYS  87           HD2      LYS  87  11.933   9.359   2.004
  694    HD3  LYS  87           HD1      LYS  87  11.597  10.230   3.501
  695    HE2  LYS  87           HE2      LYS  87  14.413   9.477   3.026
  696    HE3  LYS  87           HE1      LYS  87  13.742  10.705   1.952
  697    HZ1  LYS  87           HZ1      LYS  87  14.693  11.813   3.799
  698    HZ2  LYS  87           HZ2      LYS  87  13.916  10.802   4.911
  699    HZ3  LYS  87           HZ3      LYS  87  13.014  11.904   3.998
  700    H    PHE  88           HN       PHE  88   8.802   7.218   1.866
  701    HA   PHE  88           HA       PHE  88   8.277   4.946   0.244
  702    HB2  PHE  88           HB2      PHE  88   6.859   7.151   1.073
  703    HB3  PHE  88           HB1      PHE  88   7.022   7.411  -0.661
  704    HD1  PHE  88           HD1      PHE  88   6.253   5.600  -2.229
  705    HD2  PHE  88           HD2      PHE  88   5.344   5.586   1.928
  706    HE1  PHE  88           HE1      PHE  88   4.418   4.013  -2.641
  707    HE2  PHE  88           HE2      PHE  88   3.507   4.000   1.524
  708    HZ   PHE  88           HZ       PHE  88   3.042   3.210  -0.763
  709    H    MET  89           HN       MET  89   9.492   8.241  -0.825
  710    HA   MET  89           HA       MET  89   9.707   7.309  -3.538
  711    HB2  MET  89           HB2      MET  89  10.210   9.853  -2.166
  712    HB3  MET  89           HB1      MET  89  11.490   9.499  -3.308
  713    HG2  MET  89           HG2      MET  89   9.674   9.236  -5.089
  714    HG3  MET  89           HG1      MET  89   8.536   9.873  -3.908
  715    HE1  MET  89           HE1      MET  89   9.207  12.109  -6.960
  716    HE2  MET  89           HE2      MET  89   8.588  13.250  -5.775
  717    HE3  MET  89           HE3      MET  89   7.877  11.644  -5.895
  718    H    VAL  90           HN       VAL  90  11.676   7.272  -0.722
  719    HA   VAL  90           HA       VAL  90  14.189   6.478  -1.881
  720    HB   VAL  90           HB       VAL  90  13.392   6.202   0.998
  721   HG11  VAL  90          HG11      VAL  90  15.431   5.233   0.943
  722   HG12  VAL  90          HG12      VAL  90  15.982   6.908   0.995
  723   HG13  VAL  90          HG13      VAL  90  15.901   6.053  -0.546
  724   HG21  VAL  90          HG21      VAL  90  12.874   8.468   0.375
  725   HG22  VAL  90          HG22      VAL  90  14.426   8.639  -0.446
  726   HG23  VAL  90          HG23      VAL  90  14.370   8.465   1.309
  727    H    GLN  91           HN       GLN  91  11.371   4.738  -1.211
  728    HA   GLN  91           HA       GLN  91  12.303   2.375  -0.155
  729    HB2  GLN  91           HB2      GLN  91   9.930   3.264  -1.539
  730    HB3  GLN  91           HB1      GLN  91  10.314   1.600  -1.957
  731    HG2  GLN  91           HG2      GLN  91  10.432   1.085   0.472
  732    HG3  GLN  91           HG1      GLN  91   9.869   2.723   0.797
  733   HE21  GLN  91          1HE2      GLN  91   7.952   2.172   1.724
  734   HE22  GLN  91          2HE2      GLN  91   6.657   1.414   0.868
  735    H    SER  92           HN       SER  92  13.048   3.594  -3.258
  736    HA   SER  92           HA       SER  92  13.283   1.240  -4.748
  737    HB2  SER  92           HB2      SER  92  14.994   2.576  -6.076
  738    HB3  SER  92           HB1      SER  92  13.392   3.295  -5.914
  739    HG   SER  92           HG       SER  92  15.733   3.952  -4.454
  740    H    MET  93           HN       MET  93  15.246   2.256  -2.081
  741    HA   MET  93           HA       MET  93  17.641   0.931  -2.885
  742    HB2  MET  93           HB2      MET  93  17.442   2.849  -1.200
  743    HB3  MET  93           HB1      MET  93  16.852   1.646  -0.063
  744    HG2  MET  93           HG2      MET  93  19.003   1.463   0.503
  745    HG3  MET  93           HG1      MET  93  19.111   0.447  -0.933
  746    HE1  MET  93           HE1      MET  93  19.778   1.741  -3.487
  747    HE2  MET  93           HE2      MET  93  20.013   3.488  -3.483
  748    HE3  MET  93           HE3      MET  93  18.463   2.807  -2.992
  749    H    PHE  94           HN       PHE  94  14.919   0.275  -0.765
  750    HA   PHE  94           HA       PHE  94  15.881  -2.380  -0.090
  751    HB2  PHE  94           HB2      PHE  94  13.018  -1.700   0.349
  752    HB3  PHE  94           HB1      PHE  94  14.154  -2.521   1.412
  753    HD1  PHE  94           HD1      PHE  94  13.202   0.775   0.074
  754    HD2  PHE  94           HD2      PHE  94  15.254  -1.349   3.127
  755    HE1  PHE  94           HE1      PHE  94  13.497   2.865   1.311
  756    HE2  PHE  94           HE2      PHE  94  15.553   0.745   4.389
  757    HZ   PHE  94           HZ       PHE  94  14.673   2.861   3.481
  758    H    ALA  95           HN       ALA  95  14.633  -1.156  -2.840
  759    HA   ALA  95           HA       ALA  95  14.245  -3.604  -4.119
  760    HB1  ALA  95           HB1      ALA  95  12.211  -3.785  -2.801
  761    HB2  ALA  95           HB2      ALA  95  11.816  -3.557  -4.505
  762    HB3  ALA  95           HB3      ALA  95  11.674  -2.207  -3.378
  763    HA   PRO  96           HA       PRO  96  15.148   0.189  -6.677
  764    HB2  PRO  96           HB2      PRO  96  16.450  -1.996  -8.228
  765    HB3  PRO  96           HB1      PRO  96  17.052  -0.383  -7.828
  766    HG2  PRO  96           HG2      PRO  96  17.969  -2.525  -6.546
  767    HG3  PRO  96           HG1      PRO  96  17.677  -1.004  -5.682
  768    HD2  PRO  96           HD2      PRO  96  16.054  -3.512  -5.713
  769    HD3  PRO  96           HD1      PRO  96  16.367  -2.385  -4.377
  770    H    THR  97           HN       THR  97  14.135  -3.050  -7.746
  771    HA   THR  97           HA       THR  97  13.097  -2.211 -10.232
  772    HB   THR  97           HB       THR  97  13.636  -4.536  -9.859
  773    HG1  THR  97           HG1      THR  97  11.838  -3.965 -11.264
  774   HG21  THR  97          HG21      THR  97  13.036  -4.675  -7.466
  775   HG22  THR  97          HG22      THR  97  12.395  -5.998  -8.436
  776   HG23  THR  97          HG23      THR  97  11.334  -4.684  -7.930
  777    H    ASP  98           HN       ASP  98  11.849  -2.020  -7.023
  778    HA   ASP  98           HA       ASP  98   9.102  -2.006  -7.532
  779    HB2  ASP  98           HB2      ASP  98  10.305  -2.043  -5.273
  780    HB3  ASP  98           HB1      ASP  98  10.424  -0.294  -5.434
  781    H    THR  99           HN       THR  99  11.440   0.663  -7.531
  782    HA   THR  99           HA       THR  99   9.636   2.749  -7.974
  783    HB   THR  99           HB       THR  99  11.946   3.446  -9.388
  784    HG1  THR  99           HG1      THR  99  13.045   1.634  -8.762
  785   HG21  THR  99          HG21      THR  99  10.934   4.911  -7.788
  786   HG22  THR  99          HG22      THR  99  12.613   4.626  -7.327
  787   HG23  THR  99          HG23      THR  99  11.311   3.800  -6.471
  788    H    SER 100           HN       SER 100  11.357   0.682 -10.266
  789    HA   SER 100           HA       SER 100  10.310   1.925 -12.601
  790    HB2  SER 100           HB2      SER 100  11.019  -0.452 -13.562
  791    HB3  SER 100           HB1      SER 100  12.224   0.756 -13.117
  792    HG   SER 100           HG       SER 100  12.904  -0.989 -12.052
  793    H    ASP 101           HN       ASP 101   9.105  -0.427 -10.395
  794    HA   ASP 101           HA       ASP 101   7.353  -1.878 -11.985
  795    HB2  ASP 101           HB2      ASP 101   7.954  -2.312  -9.572
  796    HB3  ASP 101           HB1      ASP 101   6.808  -1.048  -9.134
  797    H    MET 102           HN       MET 102   7.096   1.418 -10.889
  798    HA   MET 102           HA       MET 102   4.271   1.650 -11.116
  799    HB2  MET 102           HB2      MET 102   6.564   3.556 -10.955
  800    HB3  MET 102           HB1      MET 102   5.014   4.174 -11.508
  801    HG2  MET 102           HG2      MET 102   4.180   4.202  -9.450
  802    HG3  MET 102           HG1      MET 102   4.752   2.571  -9.108
  803    HE1  MET 102           HE1      MET 102   6.103   6.331  -7.309
  804    HE2  MET 102           HE2      MET 102   4.745   6.016  -8.388
  805    HE3  MET 102           HE3      MET 102   6.301   6.518  -9.051
  806    H    GLU 103           HN       GLU 103   6.883   2.743 -13.274
  807    HA   GLU 103           HA       GLU 103   5.123   3.394 -15.414
  808    HB2  GLU 103           HB2      GLU 103   8.090   3.230 -15.081
  809    HB3  GLU 103           HB1      GLU 103   7.408   3.378 -16.694
  810    HG2  GLU 103           HG2      GLU 103   7.044   5.293 -14.404
  811    HG3  GLU 103           HG1      GLU 103   8.002   5.550 -15.862
  812    H    ALA 104           HN       ALA 104   7.520   0.816 -15.019
  813    HA   ALA 104           HA       ALA 104   7.133  -0.485 -17.419
  814    HB1  ALA 104           HB1      ALA 104   9.036  -0.879 -15.984
  815    HB2  ALA 104           HB2      ALA 104   8.235  -2.398 -16.387
  816    HB3  ALA 104           HB3      ALA 104   7.999  -1.671 -14.797
  817    H    VAL 105           HN       VAL 105   5.279  -0.964 -14.418
  818    HA   VAL 105           HA       VAL 105   4.147  -3.401 -15.109
  819    HB   VAL 105           HB       VAL 105   3.910  -2.497 -12.868
  820   HG11  VAL 105          HG11      VAL 105   1.853  -0.586 -13.955
  821   HG12  VAL 105          HG12      VAL 105   3.505  -0.135 -13.526
  822   HG13  VAL 105          HG13      VAL 105   2.407  -0.738 -12.289
  823   HG21  VAL 105          HG21      VAL 105   1.872  -3.775 -14.370
  824   HG22  VAL 105          HG22      VAL 105   1.098  -2.683 -13.222
  825   HG23  VAL 105          HG23      VAL 105   2.223  -3.914 -12.647
  826    H    TRP 106           HN       TRP 106   3.312  -0.214 -16.308
  827    HA   TRP 106           HA       TRP 106   0.845  -1.180 -17.480
  828    HB2  TRP 106           HB2      TRP 106   2.027   1.404 -16.928
  829    HB3  TRP 106           HB1      TRP 106   1.435   1.330 -18.583
  830    HD1  TRP 106           HD1      TRP 106   0.261   1.617 -15.019
  831    HE1  TRP 106           HE1      TRP 106  -2.303   1.840 -14.974
  832    HE3  TRP 106           HE3      TRP 106  -0.738   0.501 -19.907
  833    HZ2  TRP 106           HZ2      TRP 106  -4.463   1.578 -16.773
  834    HZ3  TRP 106           HZ3      TRP 106  -3.078   0.508 -20.665
  835    HH2  TRP 106           HH2      TRP 106  -4.901   1.036 -19.129
  836    H    LYS 107           HN       LYS 107   3.967   0.026 -18.691
  837    HA   LYS 107           HA       LYS 107   3.282  -0.664 -21.408
  838    HB2  LYS 107           HB2      LYS 107   4.602   1.343 -20.911
  839    HB3  LYS 107           HB1      LYS 107   5.879   0.341 -20.237
  840    HG2  LYS 107           HG2      LYS 107   5.580  -0.742 -22.720
  841    HG3  LYS 107           HG1      LYS 107   5.245   0.963 -23.021
  842    HD2  LYS 107           HD2      LYS 107   7.512   0.747 -21.292
  843    HD3  LYS 107           HD1      LYS 107   7.754  -0.297 -22.693
  844    HE2  LYS 107           HE2      LYS 107   8.491   1.577 -23.685
  845    HE3  LYS 107           HE1      LYS 107   6.777   1.946 -23.868
  846    HZ1  LYS 107           HZ1      LYS 107   6.831   3.474 -22.191
  847    HZ2  LYS 107           HZ2      LYS 107   8.404   3.655 -22.787
  848    HZ3  LYS 107           HZ3      LYS 107   8.130   2.741 -21.391
  849    H    GLU 108           HN       GLU 108   5.594  -1.850 -18.980
  850    HA   GLU 108           HA       GLU 108   6.722  -3.814 -20.688
  851    HB2  GLU 108           HB2      GLU 108   7.196  -2.836 -18.082
  852    HB3  GLU 108           HB1      GLU 108   6.960  -4.571 -17.932
  853    HG2  GLU 108           HG2      GLU 108   9.141  -4.672 -18.401
  854    HG3  GLU 108           HG1      GLU 108   8.615  -4.459 -20.069
  855    H    ALA 109           HN       ALA 109   3.677  -3.676 -19.329
  856    HA   ALA 109           HA       ALA 109   1.957  -5.169 -19.408
  857    HB1  ALA 109           HB1      ALA 109   2.121  -7.192 -20.548
  858    HB2  ALA 109           HB2      ALA 109   3.828  -7.389 -20.152
  859    HB3  ALA 109           HB3      ALA 109   3.330  -6.174 -21.331
  860    H    LYS 110           HN       LYS 110   1.094  -7.000 -18.174
  861    HA   LYS 110           HA       LYS 110   1.805  -6.934 -15.512
  862    HB2  LYS 110           HB2      LYS 110  -0.365  -7.662 -16.163
  863    HB3  LYS 110           HB1      LYS 110   0.287  -9.020 -17.065
  864    HG2  LYS 110           HG2      LYS 110   0.792  -8.817 -14.134
  865    HG3  LYS 110           HG1      LYS 110  -0.771  -9.386 -14.719
  866    HD2  LYS 110           HD2      LYS 110   1.220 -10.735 -16.207
  867    HD3  LYS 110           HD1      LYS 110   1.701 -10.808 -14.511
  868    HE2  LYS 110           HE2      LYS 110   0.279 -12.508 -14.293
  869    HE3  LYS 110           HE1      LYS 110  -1.024 -11.334 -14.473
  870    HZ1  LYS 110           HZ1      LYS 110  -0.454 -11.768 -17.014
  871    HZ2  LYS 110           HZ2      LYS 110  -1.570 -12.710 -16.160
  872    HZ3  LYS 110           HZ3      LYS 110   0.010 -13.271 -16.388
  873    HA   PRO 111           HA       PRO 111   4.005 -11.326 -16.281
  874    HB2  PRO 111           HB2      PRO 111   5.281 -10.455 -18.836
  875    HB3  PRO 111           HB1      PRO 111   4.780 -12.069 -18.318
  876    HG2  PRO 111           HG2      PRO 111   3.313 -10.697 -20.058
  877    HG3  PRO 111           HG1      PRO 111   2.543 -11.671 -18.792
  878    HD2  PRO 111           HD2      PRO 111   2.866  -8.715 -18.980
  879    HD3  PRO 111           HD1      PRO 111   1.534  -9.666 -18.293
  880    H    GLU 112           HN       GLU 112   5.397  -8.263 -17.466
  881    HA   GLU 112           HA       GLU 112   7.989  -8.841 -16.422
  882    HB2  GLU 112           HB2      GLU 112   6.900  -6.945 -18.167
  883    HB3  GLU 112           HB1      GLU 112   7.549  -6.020 -16.819
  884    HG2  GLU 112           HG2      GLU 112   9.630  -6.333 -17.507
  885    HG3  GLU 112           HG1      GLU 112   9.394  -8.074 -17.623
  886    H    ASP 113           HN       ASP 113   5.328  -6.737 -15.301
  887    HA   ASP 113           HA       ASP 113   6.752  -5.720 -13.083
  888    HB2  ASP 113           HB2      ASP 113   4.342  -5.325 -12.163
  889    HB3  ASP 113           HB1      ASP 113   4.894  -4.431 -13.573
  890    H    LEU 114           HN       LEU 114   4.865  -8.631 -13.537
  891    HA   LEU 114           HA       LEU 114   4.431  -9.393 -10.906
  892    HB2  LEU 114           HB2      LEU 114   3.483 -10.607 -12.778
  893    HB3  LEU 114           HB1      LEU 114   5.080 -11.104 -13.305
  894    HG   LEU 114           HG       LEU 114   4.661 -11.947 -10.587
  895   HD11  LEU 114          HD11      LEU 114   2.262 -11.823 -11.328
  896   HD12  LEU 114          HD12      LEU 114   2.814 -13.415 -10.806
  897   HD13  LEU 114          HD13      LEU 114   2.648 -13.059 -12.524
  898   HD21  LEU 114          HD21      LEU 114   5.285 -13.198 -13.226
  899   HD22  LEU 114          HD22      LEU 114   4.909 -14.217 -11.836
  900   HD23  LEU 114          HD23      LEU 114   6.272 -13.099 -11.767
  901    H    MET 115           HN       MET 115   7.348  -9.536 -12.836
  902    HA   MET 115           HA       MET 115   8.828 -11.181 -11.032
  903    HB2  MET 115           HB2      MET 115   9.223 -10.575 -13.578
  904    HB3  MET 115           HB1      MET 115  10.186  -9.275 -12.887
  905    HG2  MET 115           HG2      MET 115  10.791 -11.804 -11.636
  906    HG3  MET 115           HG1      MET 115  10.991 -11.885 -13.386
  907    HE1  MET 115           HE1      MET 115  14.095 -10.779 -10.633
  908    HE2  MET 115           HE2      MET 115  12.695 -11.845 -10.523
  909    HE3  MET 115           HE3      MET 115  12.562 -10.160 -10.019
  910    H    ASP 116           HN       ASP 116   8.364  -7.722 -11.431
  911    HA   ASP 116           HA       ASP 116  10.426  -6.942  -9.616
  912    HB2  ASP 116           HB2      ASP 116   7.993  -5.316 -10.366
  913    HB3  ASP 116           HB1      ASP 116   9.567  -4.724  -9.841
  914    H    SER 117           HN       SER 117   7.062  -7.784  -9.363
  915    HA   SER 117           HA       SER 117   6.563  -6.778  -6.762
  916    HB2  SER 117           HB2      SER 117   5.264  -9.203  -7.954
  917    HB3  SER 117           HB1      SER 117   4.553  -8.017  -6.859
  918    HG   SER 117           HG       SER 117   4.164  -6.721  -8.501
  919    H    LYS 118           HN       LYS 118   7.508  -9.947  -8.007
  920    HA   LYS 118           HA       LYS 118   7.516 -11.367  -5.608
  921    HB2  LYS 118           HB2      LYS 118   8.118 -11.943  -8.226
  922    HB3  LYS 118           HB1      LYS 118   9.693 -12.067  -7.454
  923    HG2  LYS 118           HG2      LYS 118   9.012 -13.810  -6.066
  924    HG3  LYS 118           HG1      LYS 118   7.300 -13.461  -6.315
  925    HD2  LYS 118           HD2      LYS 118   7.214 -14.610  -8.265
  926    HD3  LYS 118           HD1      LYS 118   8.850 -14.143  -8.733
  927    HE2  LYS 118           HE2      LYS 118   8.458 -16.028  -6.453
  928    HE3  LYS 118           HE1      LYS 118   8.300 -16.624  -8.105
  929    HZ1  LYS 118           HZ1      LYS 118  10.609 -16.519  -6.795
  930    HZ2  LYS 118           HZ2      LYS 118  10.652 -15.010  -7.557
  931    HZ3  LYS 118           HZ3      LYS 118  10.495 -16.419  -8.480
  932    H    LEU 119           HN       LEU 119   9.721  -9.072  -6.936
  933    HA   LEU 119           HA       LEU 119  11.949  -9.683  -5.253
  934    HB2  LEU 119           HB2      LEU 119  12.249  -8.492  -7.350
  935    HB3  LEU 119           HB1      LEU 119  11.261  -7.166  -6.768
  936    HG   LEU 119           HG       LEU 119  13.633  -7.845  -5.133
  937   HD11  LEU 119          HD11      LEU 119  13.826  -7.276  -7.972
  938   HD12  LEU 119          HD12      LEU 119  15.070  -7.786  -6.832
  939   HD13  LEU 119          HD13      LEU 119  14.664  -6.076  -6.988
  940   HD21  LEU 119          HD21      LEU 119  13.663  -5.188  -5.489
  941   HD22  LEU 119          HD22      LEU 119  12.677  -5.991  -4.266
  942   HD23  LEU 119          HD23      LEU 119  11.957  -5.509  -5.802
  943    H    ARG 120           HN       ARG 120   9.466  -7.130  -5.138
  944    HA   ARG 120           HA       ARG 120  10.393  -6.042  -2.682
  945    HB2  ARG 120           HB2      ARG 120   8.297  -4.770  -2.675
  946    HB3  ARG 120           HB1      ARG 120   9.081  -4.705  -4.247
  947    HG2  ARG 120           HG2      ARG 120   7.413  -5.817  -5.278
  948    HG3  ARG 120           HG1      ARG 120   7.079  -6.839  -3.880
  949    HD2  ARG 120           HD2      ARG 120   5.253  -5.576  -3.610
  950    HD3  ARG 120           HD1      ARG 120   6.357  -4.356  -2.976
  951    HE   ARG 120           HE       ARG 120   6.398  -3.889  -5.636
  952   HH11  ARG 120          HH11      ARG 120   3.803  -4.233  -3.325
  953   HH12  ARG 120          HH12      ARG 120   2.736  -3.169  -4.177
  954   HH21  ARG 120          HH21      ARG 120   4.993  -2.489  -6.758
  955   HH22  ARG 120          HH22      ARG 120   3.411  -2.179  -6.126
  956    H    CYS 121           HN       CYS 121   8.084  -8.528  -3.526
  957    HA   CYS 121           HA       CYS 121   6.831  -8.724  -0.991
  958    HB2  CYS 121           HB2      CYS 121   7.088 -10.767  -3.205
  959    HB3  CYS 121           HB1      CYS 121   6.021 -10.919  -1.814
  960    HG   CYS 121           HG       CYS 121   5.629  -8.703  -3.965
  961    H    VAL 122           HN       VAL 122   9.647 -10.302  -2.420
  962    HA   VAL 122           HA       VAL 122   9.985 -12.150  -0.261
  963    HB   VAL 122           HB       VAL 122  10.860 -12.638  -2.505
  964   HG11  VAL 122          HG11      VAL 122  12.701 -10.325  -1.936
  965   HG12  VAL 122          HG12      VAL 122  11.572 -10.508  -3.277
  966   HG13  VAL 122          HG13      VAL 122  13.007 -11.528  -3.188
  967   HG21  VAL 122          HG21      VAL 122  11.980 -13.281  -0.135
  968   HG22  VAL 122          HG22      VAL 122  13.357 -12.536  -0.947
  969   HG23  VAL 122          HG23      VAL 122  12.533 -13.907  -1.688
  970    H    PHE 123           HN       PHE 123  11.287  -8.978  -1.055
  971    HA   PHE 123           HA       PHE 123  13.273  -8.936   0.971
  972    HB2  PHE 123           HB2      PHE 123  12.074  -6.993  -0.906
  973    HB3  PHE 123           HB1      PHE 123  12.747  -6.304   0.568
  974    HD1  PHE 123           HD1      PHE 123  13.592  -8.565  -2.259
  975    HD2  PHE 123           HD2      PHE 123  15.019  -5.891   0.729
  976    HE1  PHE 123           HE1      PHE 123  15.846  -8.680  -3.239
  977    HE2  PHE 123           HE2      PHE 123  17.275  -6.001  -0.245
  978    HZ   PHE 123           HZ       PHE 123  17.691  -7.396  -2.232
  979    H    GLU 124           HN       GLU 124   9.878  -8.091   0.875
  980    HA   GLU 124           HA       GLU 124   9.732  -6.624   3.266
  981    HB2  GLU 124           HB2      GLU 124   7.958  -7.352   1.299
  982    HB3  GLU 124           HB1      GLU 124   7.385  -8.282   2.676
  983    HG2  GLU 124           HG2      GLU 124   6.188  -6.307   2.816
  984    HG3  GLU 124           HG1      GLU 124   7.502  -6.072   3.967
  985    H    LEU 125           HN       LEU 125   9.148 -10.078   2.643
  986    HA   LEU 125           HA       LEU 125   9.182 -11.900   4.003
  987    HB2  LEU 125           HB2      LEU 125  11.038 -10.024   5.406
  988    HB3  LEU 125           HB1      LEU 125  10.576 -11.519   6.198
  989    HG   LEU 125           HG       LEU 125  11.346 -12.249   3.594
  990   HD11  LEU 125          HD11      LEU 125  13.178 -11.101   2.988
  991   HD12  LEU 125          HD12      LEU 125  13.717 -10.879   4.652
  992   HD13  LEU 125          HD13      LEU 125  12.477  -9.821   3.978
  993   HD21  LEU 125          HD21      LEU 125  12.296 -12.627   6.366
  994   HD22  LEU 125          HD22      LEU 125  13.443 -12.999   5.078
  995   HD23  LEU 125          HD23      LEU 125  11.882 -13.819   5.133
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1 -10.140  11.562   1.836
    2    H2   MET   1           HT2      MET   1 -10.721  10.363   0.753
    3    H3   MET   1           HT3      MET   1 -11.705  10.896   2.054
    4    HA   MET   1           HA       MET   1 -12.564  11.953   0.241
    5    HB2  MET   1           HB2      MET   1 -11.890  13.346   2.286
    6    HB3  MET   1           HB1      MET   1 -10.561  13.943   1.301
    7    HG2  MET   1           HG2      MET   1 -12.613  14.382  -0.374
    8    HG3  MET   1           HG1      MET   1 -13.437  14.547   1.175
    9    HE1  MET   1           HE1      MET   1 -11.191  15.603  -1.351
   10    HE2  MET   1           HE2      MET   1  -9.935  16.564  -0.571
   11    HE3  MET   1           HE3      MET   1 -11.371  17.352  -1.223
   12    H    ALA   2           HN       ALA   2 -12.004  11.181  -1.768
   13    HA   ALA   2           HA       ALA   2 -10.176  12.810  -3.285
   14    HB1  ALA   2           HB1      ALA   2  -8.538  11.298  -2.486
   15    HB2  ALA   2           HB2      ALA   2  -8.900  10.810  -4.142
   16    HB3  ALA   2           HB3      ALA   2  -9.575   9.904  -2.787
   17    H    LYS   3           HN       LYS   3 -10.119  12.052  -5.627
   18    HA   LYS   3           HA       LYS   3 -12.754  11.852  -6.591
   19    HB2  LYS   3           HB2      LYS   3 -10.828  12.875  -7.808
   20    HB3  LYS   3           HB1      LYS   3 -10.211  11.257  -8.106
   21    HG2  LYS   3           HG2      LYS   3 -11.456  11.123  -9.927
   22    HG3  LYS   3           HG1      LYS   3 -12.912  11.302  -8.946
   23    HD2  LYS   3           HD2      LYS   3 -11.415  13.783  -9.514
   24    HD3  LYS   3           HD1      LYS   3 -12.202  13.020 -10.898
   25    HE2  LYS   3           HE2      LYS   3 -14.276  12.906  -9.370
   26    HE3  LYS   3           HE1      LYS   3 -13.431  14.099  -8.385
   27    HZ1  LYS   3           HZ1      LYS   3 -14.482  15.524  -9.750
   28    HZ2  LYS   3           HZ2      LYS   3 -14.672  14.392 -10.992
   29    HZ3  LYS   3           HZ3      LYS   3 -13.195  15.192 -10.797
   30    H    VAL   4           HN       VAL   4 -14.003  10.135  -6.416
   31    HA   VAL   4           HA       VAL   4 -13.146   7.517  -5.924
   32    HB   VAL   4           HB       VAL   4 -15.784   8.320  -7.149
   33   HG11  VAL   4          HG11      VAL   4 -15.061   5.862  -7.041
   34   HG12  VAL   4          HG12      VAL   4 -16.639   6.286  -6.379
   35   HG13  VAL   4          HG13      VAL   4 -15.272   6.016  -5.296
   36   HG21  VAL   4          HG21      VAL   4 -16.483   9.161  -5.196
   37   HG22  VAL   4          HG22      VAL   4 -14.773   9.277  -4.783
   38   HG23  VAL   4          HG23      VAL   4 -15.713   7.877  -4.265
   39    H    GLU   5           HN       GLU   5 -14.147   9.096  -8.936
   40    HA   GLU   5           HA       GLU   5 -14.111   6.853 -10.597
   41    HB2  GLU   5           HB2      GLU   5 -13.888   9.791 -11.015
   42    HB3  GLU   5           HB1      GLU   5 -13.444   8.741 -12.353
   43    HG2  GLU   5           HG2      GLU   5 -15.633   7.717 -12.321
   44    HG3  GLU   5           HG1      GLU   5 -16.084   8.675 -10.912
   45    H    GLN   6           HN       GLN   6 -11.503   9.157  -9.855
   46    HA   GLN   6           HA       GLN   6  -9.590   7.942 -11.555
   47    HB2  GLN   6           HB2      GLN   6  -9.581  10.022  -9.459
   48    HB3  GLN   6           HB1      GLN   6  -8.053   9.190  -9.694
   49    HG2  GLN   6           HG2      GLN   6  -8.878   9.778 -12.264
   50    HG3  GLN   6           HG1      GLN   6  -9.349  11.197 -11.331
   51   HE21  GLN   6          1HE2      GLN   6  -7.858  12.690 -11.784
   52   HE22  GLN   6          2HE2      GLN   6  -6.148  12.468 -11.655
   53    H    VAL   7           HN       VAL   7 -10.399   7.509  -8.150
   54    HA   VAL   7           HA       VAL   7  -8.218   5.675  -7.703
   55    HB   VAL   7           HB       VAL   7  -8.994   7.171  -5.910
   56   HG11  VAL   7          HG11      VAL   7 -11.077   6.999  -4.877
   57   HG12  VAL   7          HG12      VAL   7 -11.409   5.425  -5.598
   58   HG13  VAL   7          HG13      VAL   7 -11.448   6.877  -6.597
   59   HG21  VAL   7          HG21      VAL   7  -9.617   4.530  -4.770
   60   HG22  VAL   7          HG22      VAL   7  -8.381   5.703  -4.314
   61   HG23  VAL   7          HG23      VAL   7  -8.111   4.627  -5.684
   62    H    LEU   8           HN       LEU   8 -11.456   5.380  -8.835
   63    HA   LEU   8           HA       LEU   8 -12.196   2.888  -7.837
   64    HB2  LEU   8           HB2      LEU   8 -13.328   4.666  -9.529
   65    HB3  LEU   8           HB1      LEU   8 -12.857   3.421 -10.671
   66    HG   LEU   8           HG       LEU   8 -14.169   1.766  -9.453
   67   HD11  LEU   8          HD11      LEU   8 -15.789   2.900  -7.699
   68   HD12  LEU   8          HD12      LEU   8 -14.414   3.986  -7.498
   69   HD13  LEU   8          HD13      LEU   8 -14.216   2.254  -7.229
   70   HD21  LEU   8          HD21      LEU   8 -15.435   4.282 -10.416
   71   HD22  LEU   8          HD22      LEU   8 -16.452   3.050  -9.668
   72   HD23  LEU   8          HD23      LEU   8 -15.493   2.655 -11.095
   73    H    SER   9           HN       SER   9 -10.428   3.630 -10.834
   74    HA   SER   9           HA       SER   9  -9.254   2.292 -12.274
   75    HB2  SER   9           HB2      SER   9  -7.864   0.633 -10.468
   76    HB3  SER   9           HB1      SER   9  -7.326   2.167 -11.150
   77    HG   SER   9           HG       SER   9  -8.717   1.738  -8.711
   78    H    LEU  10           HN       LEU  10 -11.908   1.091 -11.302
   79    HA   LEU  10           HA       LEU  10 -11.355  -1.746 -11.332
   80    HB2  LEU  10           HB2      LEU  10 -13.740  -0.075 -10.874
   81    HB3  LEU  10           HB1      LEU  10 -14.019  -1.656 -11.578
   82    HG   LEU  10           HG       LEU  10 -12.535  -2.508  -9.606
   83   HD11  LEU  10          HD11      LEU  10 -12.993   0.301  -8.924
   84   HD12  LEU  10          HD12      LEU  10 -11.778  -0.830  -8.330
   85   HD13  LEU  10          HD13      LEU  10 -13.402  -0.837  -7.641
   86   HD21  LEU  10          HD21      LEU  10 -14.672  -2.423  -8.139
   87   HD22  LEU  10          HD22      LEU  10 -14.710  -3.290  -9.674
   88   HD23  LEU  10          HD23      LEU  10 -15.405  -1.672  -9.558
   89    H    GLU  11           HN       GLU  11 -12.001   0.651 -13.716
   90    HA   GLU  11           HA       GLU  11 -13.381  -0.943 -15.595
   91    HB2  GLU  11           HB2      GLU  11 -12.575   1.678 -15.497
   92    HB3  GLU  11           HB1      GLU  11 -11.506   1.021 -16.729
   93    HG2  GLU  11           HG2      GLU  11 -13.601   0.077 -17.816
   94    HG3  GLU  11           HG1      GLU  11 -14.502   1.133 -16.726
   95    HA   PRO  12           HA       PRO  12  -9.145  -2.346 -17.171
   96    HB2  PRO  12           HB2      PRO  12  -6.885  -1.241 -16.281
   97    HB3  PRO  12           HB1      PRO  12  -7.917  -0.368 -17.420
   98    HG2  PRO  12           HG2      PRO  12  -7.520   0.069 -14.515
   99    HG3  PRO  12           HG1      PRO  12  -7.942   1.232 -15.779
  100    HD2  PRO  12           HD2      PRO  12  -9.707  -0.070 -13.952
  101    HD3  PRO  12           HD1      PRO  12 -10.141   1.016 -15.285
  102    H    GLN  13           HN       GLN  13  -9.082  -4.404 -16.296
  103    HA   GLN  13           HA       GLN  13  -8.992  -4.899 -13.535
  104    HB2  GLN  13           HB2      GLN  13  -9.463  -6.423 -15.754
  105    HB3  GLN  13           HB1      GLN  13  -7.880  -7.017 -15.272
  106    HG2  GLN  13           HG2      GLN  13  -8.946  -8.362 -13.873
  107    HG3  GLN  13           HG1      GLN  13  -9.292  -6.932 -12.902
  108   HE21  GLN  13          1HE2      GLN  13 -10.573  -9.407 -14.853
  109   HE22  GLN  13          2HE2      GLN  13 -12.227  -8.910 -14.810
  110    H    HIS  14           HN       HIS  14  -6.435  -4.942 -16.011
  111    HA   HIS  14           HA       HIS  14  -4.167  -4.898 -15.875
  112    HB2  HIS  14           HB2      HIS  14  -5.036  -2.837 -14.431
  113    HB3  HIS  14           HB1      HIS  14  -4.251  -3.734 -13.137
  114    HD1  HIS  14           HD1      HIS  14  -2.396  -4.319 -16.162
  115    HD2  HIS  14           HD2      HIS  14  -2.585  -1.269 -13.347
  116    HE1  HIS  14           HE1      HIS  14  -0.280  -2.995 -16.463
  117    HE2  HIS  14           HE2      HIS  14  -0.465  -1.096 -14.817
  118    H    GLU  15           HN       GLU  15  -2.384  -6.017 -15.126
  119    HA   GLU  15           HA       GLU  15  -2.833  -8.452 -13.818
  120    HB2  GLU  15           HB2      GLU  15  -0.330  -8.586 -13.717
  121    HB3  GLU  15           HB1      GLU  15  -0.986  -8.262 -15.316
  122    HG2  GLU  15           HG2      GLU  15   0.639  -6.701 -15.330
  123    HG3  GLU  15           HG1      GLU  15  -0.593  -5.750 -14.505
  124    H    LEU  16           HN       LEU  16  -1.263  -5.488 -12.640
  125    HA   LEU  16           HA       LEU  16  -0.902  -4.686 -10.546
  126    HB2  LEU  16           HB2      LEU  16  -3.253  -6.474 -10.145
  127    HB3  LEU  16           HB1      LEU  16  -2.432  -5.848  -8.728
  128    HG   LEU  16           HG       LEU  16  -3.120  -3.836 -10.774
  129   HD11  LEU  16          HD11      LEU  16  -5.062  -5.637 -10.425
  130   HD12  LEU  16          HD12      LEU  16  -5.377  -3.916 -10.649
  131   HD13  LEU  16          HD13      LEU  16  -5.375  -4.608  -9.028
  132   HD21  LEU  16          HD21      LEU  16  -2.131  -3.131  -8.715
  133   HD22  LEU  16          HD22      LEU  16  -3.326  -4.023  -7.775
  134   HD23  LEU  16          HD23      LEU  16  -3.818  -2.615  -8.714
  135    H    LYS  17           HN       LYS  17   1.218  -5.642 -10.670
  136    HA   LYS  17           HA       LYS  17   2.972  -6.760  -9.760
  137    HB2  LYS  17           HB2      LYS  17   0.901  -6.888  -7.664
  138    HB3  LYS  17           HB1      LYS  17   2.169  -8.100  -7.532
  139    HG2  LYS  17           HG2      LYS  17   3.290  -6.529  -6.418
  140    HG3  LYS  17           HG1      LYS  17   3.609  -5.833  -8.008
  141    HD2  LYS  17           HD2      LYS  17   2.247  -4.081  -7.646
  142    HD3  LYS  17           HD1      LYS  17   1.026  -5.072  -6.848
  143    HE2  LYS  17           HE2      LYS  17   1.770  -3.679  -5.144
  144    HE3  LYS  17           HE1      LYS  17   2.696  -5.157  -4.886
  145    HZ1  LYS  17           HZ1      LYS  17   4.622  -4.164  -5.483
  146    HZ2  LYS  17           HZ2      LYS  17   3.816  -2.774  -4.958
  147    HZ3  LYS  17           HZ3      LYS  17   3.894  -3.132  -6.609
  148    H    PHE  18           HN       PHE  18   0.607  -9.097  -8.553
  149    HA   PHE  18           HA       PHE  18   1.078 -10.930 -10.734
  150    HB2  PHE  18           HB2      PHE  18   2.084 -12.688  -9.362
  151    HB3  PHE  18           HB1      PHE  18   3.090 -11.246  -9.340
  152    HD1  PHE  18           HD1      PHE  18   3.159  -9.812  -7.341
  153    HD2  PHE  18           HD2      PHE  18   1.073 -13.521  -7.376
  154    HE1  PHE  18           HE1      PHE  18   3.118  -9.808  -4.880
  155    HE2  PHE  18           HE2      PHE  18   1.028 -13.524  -4.917
  156    HZ   PHE  18           HZ       PHE  18   2.051 -11.665  -3.666
  157    H    ARG  19           HN       ARG  19   0.334 -13.286  -9.211
  158    HA   ARG  19           HA       ARG  19  -2.485 -12.999  -9.287
  159    HB2  ARG  19           HB2      ARG  19  -0.556 -15.159  -8.693
  160    HB3  ARG  19           HB1      ARG  19  -2.141 -15.333  -7.953
  161    HG2  ARG  19           HG2      ARG  19  -1.774 -14.808 -10.886
  162    HG3  ARG  19           HG1      ARG  19  -1.816 -16.433 -10.200
  163    HD2  ARG  19           HD2      ARG  19  -3.994 -14.355 -10.011
  164    HD3  ARG  19           HD1      ARG  19  -4.010 -15.792 -11.032
  165    HE   ARG  19           HE       ARG  19  -3.665 -16.800  -8.543
  166   HH11  ARG  19          HH11      ARG  19  -5.990 -14.595  -9.927
  167   HH12  ARG  19          HH12      ARG  19  -7.264 -15.066  -8.852
  168   HH21  ARG  19          HH21      ARG  19  -5.338 -17.420  -7.128
  169   HH22  ARG  19          HH22      ARG  19  -6.894 -16.670  -7.263
  170    H    GLY  20           HN       GLY  20  -3.998 -13.333  -7.538
  171    HA2  GLY  20           HA2      GLY  20  -4.355 -13.526  -5.117
  172    HA3  GLY  20           HA1      GLY  20  -2.910 -12.563  -4.885
  173    HA   PRO  21           HA       PRO  21  -4.767  -8.559  -5.005
  174    HB2  PRO  21           HB2      PRO  21  -4.584  -8.396  -7.991
  175    HB3  PRO  21           HB1      PRO  21  -4.194  -7.172  -6.776
  176    HG2  PRO  21           HG2      PRO  21  -2.262  -8.575  -7.946
  177    HG3  PRO  21           HG1      PRO  21  -2.176  -8.175  -6.221
  178    HD2  PRO  21           HD2      PRO  21  -2.765 -10.768  -7.536
  179    HD3  PRO  21           HD1      PRO  21  -2.003 -10.449  -5.967
  180    H    PHE  22           HN       PHE  22  -5.865 -10.809  -7.470
  181    HA   PHE  22           HA       PHE  22  -8.391  -9.612  -7.887
  182    HB2  PHE  22           HB2      PHE  22  -7.202 -12.304  -8.416
  183    HB3  PHE  22           HB1      PHE  22  -8.951 -12.127  -8.508
  184    HD1  PHE  22           HD1      PHE  22  -9.824 -10.199 -10.005
  185    HD2  PHE  22           HD2      PHE  22  -5.902 -11.828 -10.258
  186    HE1  PHE  22           HE1      PHE  22  -9.616  -9.331 -12.298
  187    HE2  PHE  22           HE2      PHE  22  -5.685 -10.961 -12.550
  188    HZ   PHE  22           HZ       PHE  22  -7.543  -9.712 -13.573
  189    H    THR  23           HN       THR  23  -7.461 -12.470  -5.957
  190    HA   THR  23           HA       THR  23 -10.003 -12.587  -4.660
  191    HB   THR  23           HB       THR  23  -9.115 -14.421  -3.415
  192    HG1  THR  23           HG1      THR  23  -7.167 -13.998  -2.700
  193   HG21  THR  23          HG21      THR  23  -8.976 -15.807  -5.135
  194   HG22  THR  23          HG22      THR  23  -7.485 -15.062  -5.711
  195   HG23  THR  23          HG23      THR  23  -9.046 -14.384  -6.174
  196    H    ASP  24           HN       ASP  24  -6.744 -11.796  -3.406
  197    HA   ASP  24           HA       ASP  24  -7.768 -11.038  -0.870
  198    HB2  ASP  24           HB2      ASP  24  -5.649 -11.076  -0.173
  199    HB3  ASP  24           HB1      ASP  24  -5.335 -11.829  -1.725
  200    H    VAL  25           HN       VAL  25  -6.373  -9.037  -3.484
  201    HA   VAL  25           HA       VAL  25  -6.705  -6.623  -2.085
  202    HB   VAL  25           HB       VAL  25  -6.335  -7.174  -5.006
  203   HG11  VAL  25          HG11      VAL  25  -5.877  -4.577  -4.991
  204   HG12  VAL  25          HG12      VAL  25  -7.090  -4.612  -3.710
  205   HG13  VAL  25          HG13      VAL  25  -7.486  -5.225  -5.316
  206   HG21  VAL  25          HG21      VAL  25  -4.535  -7.319  -3.129
  207   HG22  VAL  25          HG22      VAL  25  -4.551  -5.559  -3.251
  208   HG23  VAL  25          HG23      VAL  25  -4.151  -6.536  -4.663
  209    H    VAL  26           HN       VAL  26  -9.031  -8.358  -4.091
  210    HA   VAL  26           HA       VAL  26 -10.800  -6.254  -4.579
  211    HB   VAL  26           HB       VAL  26 -12.630  -7.997  -4.593
  212   HG11  VAL  26          HG11      VAL  26 -10.160  -8.195  -6.277
  213   HG12  VAL  26          HG12      VAL  26 -11.718  -7.465  -6.665
  214   HG13  VAL  26          HG13      VAL  26 -11.563  -9.219  -6.578
  215   HG21  VAL  26          HG21      VAL  26 -10.296  -9.751  -3.881
  216   HG22  VAL  26          HG22      VAL  26 -11.761 -10.371  -4.641
  217   HG23  VAL  26          HG23      VAL  26 -11.846  -9.605  -3.053
  218    H    THR  27           HN       THR  27 -10.352  -8.169  -1.670
  219    HA   THR  27           HA       THR  27 -12.708  -7.492  -0.329
  220    HB   THR  27           HB       THR  27 -11.474  -7.968   1.742
  221    HG1  THR  27           HG1      THR  27  -9.245  -8.360   1.633
  222   HG21  THR  27          HG21      THR  27 -10.250 -10.146   0.860
  223   HG22  THR  27          HG22      THR  27 -11.193  -9.771  -0.584
  224   HG23  THR  27          HG23      THR  27 -12.006 -10.022   0.961
  225    H    THR  28           HN       THR  28  -9.549  -5.880  -0.344
  226    HA   THR  28           HA       THR  28 -10.393  -3.672   1.247
  227    HB   THR  28           HB       THR  28  -8.262  -2.629   0.495
  228    HG1  THR  28           HG1      THR  28  -6.899  -3.923  -0.828
  229   HG21  THR  28          HG21      THR  28  -7.307  -5.334   1.041
  230   HG22  THR  28          HG22      THR  28  -8.511  -4.741   2.184
  231   HG23  THR  28          HG23      THR  28  -7.028  -3.826   1.913
  232    H    ASN  29           HN       ASN  29 -10.142  -4.294  -2.207
  233    HA   ASN  29           HA       ASN  29 -10.607  -1.698  -3.147
  234    HB2  ASN  29           HB2      ASN  29 -10.399  -4.330  -4.254
  235    HB3  ASN  29           HB1      ASN  29 -11.804  -3.533  -4.956
  236   HD21  ASN  29          1HE2      ASN  29 -11.519  -1.970  -6.436
  237   HD22  ASN  29          2HE2      ASN  29  -9.979  -1.404  -6.976
  238    H    LEU  30           HN       LEU  30 -12.894  -4.332  -2.443
  239    HA   LEU  30           HA       LEU  30 -15.226  -3.053  -3.287
  240    HB2  LEU  30           HB2      LEU  30 -15.264  -5.392  -2.767
  241    HB3  LEU  30           HB1      LEU  30 -14.761  -5.093  -1.116
  242    HG   LEU  30           HG       LEU  30 -17.208  -5.701  -1.507
  243   HD11  LEU  30          HD11      LEU  30 -16.074  -4.452   0.504
  244   HD12  LEU  30          HD12      LEU  30 -17.827  -4.601   0.401
  245   HD13  LEU  30          HD13      LEU  30 -17.042  -3.095  -0.075
  246   HD21  LEU  30          HD21      LEU  30 -18.658  -3.735  -2.036
  247   HD22  LEU  30          HD22      LEU  30 -17.722  -4.346  -3.401
  248   HD23  LEU  30          HD23      LEU  30 -17.207  -2.882  -2.564
  249    H    LYS  31           HN       LYS  31 -13.746  -3.153  -0.058
  250    HA   LYS  31           HA       LYS  31 -15.581  -1.082   0.856
  251    HB2  LYS  31           HB2      LYS  31 -14.007  -3.179   2.111
  252    HB3  LYS  31           HB1      LYS  31 -13.786  -1.634   2.920
  253    HG2  LYS  31           HG2      LYS  31 -15.767  -1.782   3.898
  254    HG3  LYS  31           HG1      LYS  31 -16.569  -2.087   2.357
  255    HD2  LYS  31           HD2      LYS  31 -16.062  -4.448   2.518
  256    HD3  LYS  31           HD1      LYS  31 -15.136  -4.177   3.996
  257    HE2  LYS  31           HE2      LYS  31 -17.484  -3.071   4.705
  258    HE3  LYS  31           HE1      LYS  31 -18.056  -4.297   3.573
  259    HZ1  LYS  31           HZ1      LYS  31 -17.812  -4.926   6.025
  260    HZ2  LYS  31           HZ2      LYS  31 -16.151  -4.992   5.716
  261    HZ3  LYS  31           HZ3      LYS  31 -17.208  -6.003   4.868
  262    H    LEU  32           HN       LEU  32 -14.407   0.274  -0.878
  263    HA   LEU  32           HA       LEU  32 -11.814   1.274  -0.115
  264    HB2  LEU  32           HB2      LEU  32 -13.266   1.209  -2.471
  265    HB3  LEU  32           HB1      LEU  32 -13.305   2.902  -2.023
  266    HG   LEU  32           HG       LEU  32 -11.433   2.274  -3.551
  267   HD11  LEU  32          HD11      LEU  32  -9.648   3.278  -1.847
  268   HD12  LEU  32          HD12      LEU  32 -11.119   3.629  -0.942
  269   HD13  LEU  32          HD13      LEU  32 -10.920   4.254  -2.579
  270   HD21  LEU  32          HD21      LEU  32  -9.939   1.107  -1.279
  271   HD22  LEU  32          HD22      LEU  32  -9.806   0.790  -3.009
  272   HD23  LEU  32          HD23      LEU  32 -11.124   0.075  -2.079
  273    H    GLY  33           HN       GLY  33 -13.016   1.631   2.072
  274    HA2  GLY  33           HA2      GLY  33 -13.058   4.424   2.529
  275    HA3  GLY  33           HA1      GLY  33 -14.706   3.815   2.486
  276    H    ASN  34           HN       ASN  34 -15.515   2.720   4.230
  277    HA   ASN  34           HA       ASN  34 -13.740   2.577   6.567
  278    HB2  ASN  34           HB2      ASN  34 -16.764   2.558   6.463
  279    HB3  ASN  34           HB1      ASN  34 -15.777   2.614   7.919
  280   HD21  ASN  34          1HE2      ASN  34 -16.861   4.377   5.121
  281   HD22  ASN  34          2HE2      ASN  34 -16.427   5.948   5.695
  282    HA   PRO  35           HA       PRO  35 -14.219  -1.875   5.505
  283    HB2  PRO  35           HB2      PRO  35 -11.830  -2.622   6.560
  284    HB3  PRO  35           HB1      PRO  35 -11.998  -1.980   4.922
  285    HG2  PRO  35           HG2      PRO  35 -11.146  -0.578   7.427
  286    HG3  PRO  35           HG1      PRO  35 -10.456  -0.473   5.796
  287    HD2  PRO  35           HD2      PRO  35 -12.126   1.410   6.783
  288    HD3  PRO  35           HD1      PRO  35 -12.089   0.980   5.061
  289    H    THR  36           HN       THR  36 -12.804  -0.598   8.518
  290    HA   THR  36           HA       THR  36 -14.632  -2.337  10.020
  291    HB   THR  36           HB       THR  36 -12.203  -2.023  11.507
  292    HG1  THR  36           HG1      THR  36 -11.071  -1.849   9.614
  293   HG21  THR  36          HG21      THR  36 -12.378  -4.253  11.890
  294   HG22  THR  36          HG22      THR  36 -12.905  -4.611  10.246
  295   HG23  THR  36          HG23      THR  36 -14.037  -3.909  11.401
  296    H    ASP  37           HN       ASP  37 -12.065  -0.111  11.051
  297    HA   ASP  37           HA       ASP  37 -12.095   1.676  12.461
  298    HB2  ASP  37           HB2      ASP  37 -13.095   2.733  10.490
  299    HB3  ASP  37           HB1      ASP  37 -14.696   2.217  11.011
  300    H    ARG  38           HN       ARG  38 -12.269   0.811  14.481
  301    HA   ARG  38           HA       ARG  38 -14.967   0.321  15.535
  302    HB2  ARG  38           HB2      ARG  38 -12.742  -1.248  15.686
  303    HB3  ARG  38           HB1      ARG  38 -12.655  -0.386  17.215
  304    HG2  ARG  38           HG2      ARG  38 -13.904  -2.164  17.861
  305    HG3  ARG  38           HG1      ARG  38 -15.199  -1.082  17.345
  306    HD2  ARG  38           HD2      ARG  38 -15.654  -2.296  15.467
  307    HD3  ARG  38           HD1      ARG  38 -13.995  -2.870  15.305
  308    HE   ARG  38           HE       ARG  38 -14.851  -4.114  17.543
  309   HH11  ARG  38          HH11      ARG  38 -16.170  -3.849  14.323
  310   HH12  ARG  38          HH12      ARG  38 -16.952  -5.392  14.381
  311   HH21  ARG  38          HH21      ARG  38 -15.878  -6.146  17.621
  312   HH22  ARG  38          HH22      ARG  38 -16.786  -6.697  16.254
  313    H    ASN  39           HN       ASN  39 -13.858   2.982  15.162
  314    HA   ASN  39           HA       ASN  39 -14.352   3.989  17.824
  315    HB2  ASN  39           HB2      ASN  39 -11.653   3.980  16.612
  316    HB3  ASN  39           HB1      ASN  39 -12.162   5.503  17.334
  317   HD21  ASN  39          1HE2      ASN  39 -10.446   2.873  17.953
  318   HD22  ASN  39          2HE2      ASN  39 -10.689   2.715  19.656
  319    H    VAL  40           HN       VAL  40 -13.811   6.579  17.616
  320    HA   VAL  40           HA       VAL  40 -15.815   7.591  15.950
  321    HB   VAL  40           HB       VAL  40 -14.870   9.828  16.444
  322   HG11  VAL  40          HG11      VAL  40 -15.172   9.718  18.884
  323   HG12  VAL  40          HG12      VAL  40 -15.073   7.959  18.802
  324   HG13  VAL  40          HG13      VAL  40 -16.406   8.805  18.015
  325   HG21  VAL  40          HG21      VAL  40 -12.934   9.963  17.987
  326   HG22  VAL  40          HG22      VAL  40 -12.514   9.329  16.396
  327   HG23  VAL  40          HG23      VAL  40 -12.680   8.233  17.766
  328    H    CYS  41           HN       CYS  41 -15.233   9.557  14.428
  329    HA   CYS  41           HA       CYS  41 -14.456  10.227  12.398
  330    HB2  CYS  41           HB2      CYS  41 -12.063   9.022  13.679
  331    HB3  CYS  41           HB1      CYS  41 -11.982   9.291  11.940
  332    HG   CYS  41           HG       CYS  41 -12.789  11.868  12.872
  333    H    PHE  42           HN       PHE  42 -13.840   9.453  10.224
  334    HA   PHE  42           HA       PHE  42 -14.678   6.653   9.848
  335    HB2  PHE  42           HB2      PHE  42 -15.200   7.577   7.451
  336    HB3  PHE  42           HB1      PHE  42 -16.329   7.860   8.771
  337    HD1  PHE  42           HD2      PHE  42 -16.609  10.067   9.720
  338    HD2  PHE  42           HD1      PHE  42 -13.890   9.378   6.519
  339    HE1  PHE  42           HE2      PHE  42 -16.478  12.489   9.315
  340    HE2  PHE  42           HE1      PHE  42 -13.754  11.800   6.108
  341    HZ   PHE  42           HZ       PHE  42 -15.050  13.359   7.507
  342    H    LYS  43           HN       LYS  43 -12.475   5.908  10.063
  343    HA   LYS  43           HA       LYS  43 -10.526   5.143   9.221
  344    HB2  LYS  43           HB2      LYS  43 -10.537   4.567   7.049
  345    HB3  LYS  43           HB1      LYS  43 -12.169   5.207   7.060
  346    HG2  LYS  43           HG2      LYS  43 -11.483   7.230   6.040
  347    HG3  LYS  43           HG1      LYS  43  -9.781   6.871   6.308
  348    HD2  LYS  43           HD2      LYS  43 -11.549   5.146   4.603
  349    HD3  LYS  43           HD1      LYS  43 -10.647   6.517   3.959
  350    HE2  LYS  43           HE2      LYS  43  -9.358   4.274   5.497
  351    HE3  LYS  43           HE1      LYS  43  -9.531   4.262   3.743
  352    HZ1  LYS  43           HZ1      LYS  43  -8.063   6.010   3.502
  353    HZ2  LYS  43           HZ2      LYS  43  -7.366   5.145   4.777
  354    HZ3  LYS  43           HZ3      LYS  43  -8.255   6.549   5.095
  355    H    VAL  44           HN       VAL  44  -8.568   6.083   7.650
  356    HA   VAL  44           HA       VAL  44  -6.925   7.652   7.446
  357    HB   VAL  44           HB       VAL  44  -8.880   9.723   8.441
  358   HG11  VAL  44          HG11      VAL  44  -6.933  10.872   8.347
  359   HG12  VAL  44          HG12      VAL  44  -7.350  10.977   6.637
  360   HG13  VAL  44          HG13      VAL  44  -6.204   9.757   7.191
  361   HG21  VAL  44          HG21      VAL  44  -8.620   8.446   5.749
  362   HG22  VAL  44          HG22      VAL  44  -9.126  10.130   5.887
  363   HG23  VAL  44          HG23      VAL  44 -10.074   8.859   6.658
  364    H    LYS  45           HN       LYS  45  -7.707   6.263  10.030
  365    HA   LYS  45           HA       LYS  45  -5.650   7.224  11.644
  366    HB2  LYS  45           HB2      LYS  45  -7.750   8.971  11.781
  367    HB3  LYS  45           HB1      LYS  45  -8.094   7.904  13.135
  368    HG2  LYS  45           HG2      LYS  45  -6.304   8.608  14.329
  369    HG3  LYS  45           HG1      LYS  45  -5.321   8.897  12.892
  370    HD2  LYS  45           HD2      LYS  45  -5.944  11.046  12.766
  371    HD3  LYS  45           HD1      LYS  45  -7.638  10.662  13.075
  372    HE2  LYS  45           HE2      LYS  45  -6.532  10.202  15.514
  373    HE3  LYS  45           HE1      LYS  45  -5.522  11.521  14.922
  374    HZ1  LYS  45           HZ1      LYS  45  -7.797  11.934  16.176
  375    HZ2  LYS  45           HZ2      LYS  45  -8.407  11.811  14.604
  376    HZ3  LYS  45           HZ3      LYS  45  -7.236  12.976  14.967
  377    H    THR  46           HN       THR  46  -8.969   6.230  12.483
  378    HA   THR  46           HA       THR  46  -7.904   4.044  14.072
  379    HB   THR  46           HB       THR  46 -10.274   3.702  14.734
  380    HG1  THR  46           HG1      THR  46 -10.802   6.013  13.185
  381   HG21  THR  46          HG21      THR  46 -10.587   5.713  15.999
  382   HG22  THR  46          HG22      THR  46  -9.469   6.590  14.954
  383   HG23  THR  46          HG23      THR  46  -8.874   5.295  15.992
  384    H    THR  47           HN       THR  47  -7.168   2.478  12.701
  385    HA   THR  47           HA       THR  47  -9.126   1.327  10.825
  386    HB   THR  47           HB       THR  47  -7.106   2.239   9.736
  387    HG1  THR  47           HG1      THR  47  -8.129   0.377   8.861
  388   HG21  THR  47          HG21      THR  47  -5.631   0.203  11.384
  389   HG22  THR  47          HG22      THR  47  -5.437   1.954  11.433
  390   HG23  THR  47          HG23      THR  47  -4.963   1.054   9.992
  391    H    ALA  48           HN       ALA  48  -7.797  -1.089  10.350
  392    HA   ALA  48           HA       ALA  48  -8.157  -2.422  12.949
  393    HB1  ALA  48           HB1      ALA  48  -8.224  -4.059  10.502
  394    HB2  ALA  48           HB2      ALA  48  -9.532  -2.890  10.679
  395    HB3  ALA  48           HB3      ALA  48  -9.259  -4.102  11.929
  396    HA   PRO  49           HA       PRO  49  -3.968  -3.777  13.138
  397    HB2  PRO  49           HB2      PRO  49  -4.994  -6.488  13.772
  398    HB3  PRO  49           HB1      PRO  49  -3.906  -5.450  14.700
  399    HG2  PRO  49           HG2      PRO  49  -6.437  -5.806  15.461
  400    HG3  PRO  49           HG1      PRO  49  -5.645  -4.227  15.622
  401    HD2  PRO  49           HD2      PRO  49  -7.623  -5.158  13.580
  402    HD3  PRO  49           HD1      PRO  49  -7.485  -3.579  14.380
  403    H    ARG  50           HN       ARG  50  -2.588  -5.804  12.475
  404    HA   ARG  50           HA       ARG  50  -3.366  -7.463  10.367
  405    HB2  ARG  50           HB2      ARG  50  -3.338  -4.967   9.396
  406    HB3  ARG  50           HB1      ARG  50  -1.634  -5.351   9.193
  407    HG2  ARG  50           HG2      ARG  50  -2.685  -5.897   7.159
  408    HG3  ARG  50           HG1      ARG  50  -2.367  -7.431   7.974
  409    HD2  ARG  50           HD2      ARG  50  -4.692  -7.459   8.779
  410    HD3  ARG  50           HD1      ARG  50  -4.997  -5.954   7.916
  411    HE   ARG  50           HE       ARG  50  -5.138  -7.138   5.959
  412   HH11  ARG  50          HH11      ARG  50  -3.731  -9.171   8.421
  413   HH12  ARG  50          HH12      ARG  50  -3.801 -10.605   7.454
  414   HH21  ARG  50          HH21      ARG  50  -5.234  -9.022   4.686
  415   HH22  ARG  50          HH22      ARG  50  -4.655 -10.521   5.333
  416    H    ARG  51           HN       ARG  51  -1.844  -8.994  10.051
  417    HA   ARG  51           HA       ARG  51   0.515  -8.927  11.671
  418    HB2  ARG  51           HB2      ARG  51  -1.047 -10.931  10.750
  419    HB3  ARG  51           HB1      ARG  51   0.264 -11.008   9.581
  420    HG2  ARG  51           HG2      ARG  51   1.074 -10.828  12.408
  421    HG3  ARG  51           HG1      ARG  51   0.264 -12.319  11.924
  422    HD2  ARG  51           HD2      ARG  51   2.165 -11.635   9.919
  423    HD3  ARG  51           HD1      ARG  51   2.960 -11.549  11.491
  424    HE   ARG  51           HE       ARG  51   2.119 -13.902  10.127
  425   HH11  ARG  51          HH11      ARG  51   2.536 -12.520  13.304
  426   HH12  ARG  51          HH12      ARG  51   2.760 -14.052  14.078
  427   HH21  ARG  51          HH21      ARG  51   2.412 -15.919  11.144
  428   HH22  ARG  51          HH22      ARG  51   2.690 -15.983  12.853
  429    H    TYR  52           HN       TYR  52   2.323  -7.913  11.127
  430    HA   TYR  52           HA       TYR  52   3.980  -6.941   9.903
  431    HB2  TYR  52           HB2      TYR  52   3.681  -9.647   9.017
  432    HB3  TYR  52           HB1      TYR  52   4.134  -8.649   7.640
  433    HD1  TYR  52           HD2      TYR  52   5.125  -8.212  11.197
  434    HD2  TYR  52           HD1      TYR  52   6.363  -9.272   7.268
  435    HE1  TYR  52           HE2      TYR  52   7.466  -8.245  11.949
  436    HE2  TYR  52           HE1      TYR  52   8.707  -9.309   8.009
  437    HH   TYR  52           HH       TYR  52   9.589  -9.176  11.324
  438    H    CYS  53           HN       CYS  53   2.672  -5.114   9.415
  439    HA   CYS  53           HA       CYS  53   2.734  -4.183   6.844
  440    HB2  CYS  53           HB2      CYS  53   0.747  -6.164   6.865
  441    HB3  CYS  53           HB1      CYS  53  -0.146  -4.658   6.939
  442    HG   CYS  53           HG       CYS  53   0.159  -5.227   4.404
  443    H    VAL  54           HN       VAL  54   2.537  -2.074   7.074
  444    HA   VAL  54           HA       VAL  54   1.879  -0.789   9.417
  445    HB   VAL  54           HB       VAL  54   1.687   1.289   8.122
  446   HG11  VAL  54          HG11      VAL  54   3.904   1.007   8.436
  447   HG12  VAL  54          HG12      VAL  54   3.906   0.756   6.691
  448   HG13  VAL  54          HG13      VAL  54   3.898  -0.630   7.781
  449   HG21  VAL  54          HG21      VAL  54   0.430   0.629   6.227
  450   HG22  VAL  54          HG22      VAL  54   1.621  -0.592   5.775
  451   HG23  VAL  54          HG23      VAL  54   2.013   1.122   5.625
  452    H    ARG  55           HN       ARG  55   0.034  -0.461  10.479
  453    HA   ARG  55           HA       ARG  55  -2.386   0.268   9.157
  454    HB2  ARG  55           HB2      ARG  55  -2.010  -2.411   9.142
  455    HB3  ARG  55           HB1      ARG  55  -2.836  -2.222  10.682
  456    HG2  ARG  55           HG2      ARG  55  -4.509  -2.656   9.086
  457    HG3  ARG  55           HG1      ARG  55  -4.609  -0.930   9.438
  458    HD2  ARG  55           HD2      ARG  55  -4.706  -0.886   7.151
  459    HD3  ARG  55           HD1      ARG  55  -2.965  -0.752   7.394
  460    HE   ARG  55           HE       ARG  55  -2.702  -2.830   6.462
  461   HH11  ARG  55          HH11      ARG  55  -6.076  -2.330   7.204
  462   HH12  ARG  55          HH12      ARG  55  -6.600  -3.752   6.367
  463   HH21  ARG  55          HH21      ARG  55  -3.391  -4.703   5.361
  464   HH22  ARG  55          HH22      ARG  55  -5.076  -5.101   5.324
  465    H    SER  56           HN       SER  56  -1.333  -1.343  12.178
  466    HA   SER  56           HA       SER  56  -1.919   0.954  13.763
  467    HB2  SER  56           HB2      SER  56  -3.770  -0.172  15.090
  468    HB3  SER  56           HB1      SER  56  -4.212   0.400  13.480
  469    HG   SER  56           HG       SER  56  -3.701  -1.843  12.809
  470    H    ASN  57           HN       ASN  57   0.390  -0.439  13.673
  471    HA   ASN  57           HA       ASN  57   0.444  -2.424  15.774
  472    HB2  ASN  57           HB2      ASN  57   2.332  -1.414  13.737
  473    HB3  ASN  57           HB1      ASN  57   3.058  -1.970  15.242
  474   HD21  ASN  57          1HE2      ASN  57   1.784  -2.871  12.263
  475   HD22  ASN  57          2HE2      ASN  57   1.753  -4.580  12.509
  476    H    SER  58           HN       SER  58   1.342   0.969  15.380
  477    HA   SER  58           HA       SER  58   2.706   1.083  17.915
  478    HB2  SER  58           HB2      SER  58   3.419   2.577  16.151
  479    HB3  SER  58           HB1      SER  58   1.801   3.268  16.030
  480    HG   SER  58           HG       SER  58   2.063   4.086  18.135
  481    H    GLY  59           HN       GLY  59  -0.534   1.902  16.765
  482    HA2  GLY  59           HA2      GLY  59  -1.887   1.520  19.084
  483    HA3  GLY  59           HA1      GLY  59  -1.299   3.169  19.225
  484    H    ILE  60           HN       ILE  60  -2.340   1.575  16.242
  485    HA   ILE  60           HA       ILE  60  -4.019   1.969  14.797
  486    HB   ILE  60           HB       ILE  60  -5.263   1.991  17.260
  487   HG12  ILE  60          HG12      ILE  60  -6.494   2.178  14.505
  488   HG13  ILE  60          HG11      ILE  60  -5.923   0.708  15.285
  489   HG21  ILE  60          HG21      ILE  60  -6.237   4.401  15.728
  490   HG22  ILE  60          HG22      ILE  60  -5.374   4.440  17.265
  491   HG23  ILE  60          HG23      ILE  60  -6.977   3.714  17.174
  492   HD11  ILE  60          HD11      ILE  60  -8.484   1.540  15.285
  493   HD12  ILE  60          HD12      ILE  60  -7.917   2.234  16.804
  494   HD13  ILE  60          HD13      ILE  60  -7.779   0.499  16.522
  495    H    ILE  61           HN       ILE  61  -3.465   4.816  16.872
  496    HA   ILE  61           HA       ILE  61  -4.129   6.604  14.717
  497    HB   ILE  61           HB       ILE  61  -3.695   6.781  17.597
  498   HG12  ILE  61          HG12      ILE  61  -5.167   8.937  16.288
  499   HG13  ILE  61          HG11      ILE  61  -5.705   7.341  15.771
  500   HG21  ILE  61          HG21      ILE  61  -3.078   9.176  17.599
  501   HG22  ILE  61          HG22      ILE  61  -2.763   9.068  15.867
  502   HG23  ILE  61          HG23      ILE  61  -1.791   8.128  17.002
  503   HD11  ILE  61          HD11      ILE  61  -5.594   6.977  18.437
  504   HD12  ILE  61          HD12      ILE  61  -7.034   7.506  17.566
  505   HD13  ILE  61          HD13      ILE  61  -5.997   8.692  18.359
  506    H    ASP  62           HN       ASP  62  -1.183   5.478  16.289
  507    HA   ASP  62           HA       ASP  62   0.431   7.383  14.821
  508    HB2  ASP  62           HB2      ASP  62   1.221   5.076  16.616
  509    HB3  ASP  62           HB1      ASP  62   2.343   6.241  15.920
  510    H    ALA  63           HN       ALA  63  -0.476   4.021  14.693
  511    HA   ALA  63           HA       ALA  63   1.354   3.458  12.502
  512    HB1  ALA  63           HB1      ALA  63  -0.250   1.890  14.346
  513    HB2  ALA  63           HB2      ALA  63   1.244   1.479  13.503
  514    HB3  ALA  63           HB3      ALA  63  -0.308   1.282  12.691
  515    H    GLY  64           HN       GLY  64  -1.875   4.565  12.859
  516    HA2  GLY  64           HA2      GLY  64  -2.796   3.552  10.312
  517    HA3  GLY  64           HA1      GLY  64  -3.673   4.627  11.388
  518    H    ALA  65           HN       ALA  65  -0.434   5.414  10.372
  519    HA   ALA  65           HA       ALA  65  -1.558   7.563   8.706
  520    HB1  ALA  65           HB1      ALA  65   0.900   8.473   9.160
  521    HB2  ALA  65           HB2      ALA  65   0.722   7.462  10.595
  522    HB3  ALA  65           HB3      ALA  65  -0.435   8.756  10.278
  523    H    SER  66           HN       SER  66  -0.603   4.658   8.095
  524    HA   SER  66           HA       SER  66   0.849   5.422   5.673
  525    HB2  SER  66           HB2      SER  66   2.025   4.032   7.897
  526    HB3  SER  66           HB1      SER  66   1.995   2.970   6.491
  527    HG   SER  66           HG       SER  66   3.808   4.093   6.186
  528    H    ILE  67           HN       ILE  67  -1.902   4.609   6.106
  529    HA   ILE  67           HA       ILE  67  -2.148   1.870   5.268
  530    HB   ILE  67           HB       ILE  67  -3.880   2.927   6.649
  531   HG12  ILE  67          HG12      ILE  67  -5.481   2.465   4.243
  532   HG13  ILE  67          HG11      ILE  67  -4.252   1.231   4.496
  533   HG21  ILE  67          HG21      ILE  67  -3.586   5.104   5.064
  534   HG22  ILE  67          HG22      ILE  67  -4.957   4.829   6.139
  535   HG23  ILE  67          HG23      ILE  67  -5.083   4.422   4.427
  536   HD11  ILE  67          HD11      ILE  67  -5.751   0.259   5.817
  537   HD12  ILE  67          HD12      ILE  67  -6.733   1.719   5.923
  538   HD13  ILE  67          HD13      ILE  67  -5.345   1.510   6.991
  539    H    ASN  68           HN       ASN  68  -1.555   4.810   3.679
  540    HA   ASN  68           HA       ASN  68  -1.080   5.200   1.470
  541    HB2  ASN  68           HB2      ASN  68  -0.886   2.580   1.360
  542    HB3  ASN  68           HB1      ASN  68  -2.439   2.701   0.536
  543   HD21  ASN  68          1HE2      ASN  68  -2.169   2.581  -1.592
  544   HD22  ASN  68          2HE2      ASN  68  -0.907   3.336  -2.493
  545    H    VAL  69           HN       VAL  69  -4.227   4.270   2.584
  546    HA   VAL  69           HA       VAL  69  -5.599   5.362   0.289
  547    HB   VAL  69           HB       VAL  69  -6.801   4.602   2.950
  548   HG11  VAL  69          HG11      VAL  69  -7.937   5.929   0.855
  549   HG12  VAL  69          HG12      VAL  69  -8.817   4.949   2.027
  550   HG13  VAL  69          HG13      VAL  69  -8.337   4.253   0.480
  551   HG21  VAL  69          HG21      VAL  69  -5.451   2.892   1.241
  552   HG22  VAL  69          HG22      VAL  69  -7.145   2.683   0.799
  553   HG23  VAL  69          HG23      VAL  69  -6.631   2.431   2.467
  554    H    SER  70           HN       SER  70  -4.722   6.402   3.524
  555    HA   SER  70           HA       SER  70  -6.368   8.734   3.525
  556    HB2  SER  70           HB2      SER  70  -4.974   9.401   5.490
  557    HB3  SER  70           HB1      SER  70  -5.660   7.782   5.638
  558    HG   SER  70           HG       SER  70  -3.696   7.107   5.868
  559    H    VAL  71           HN       VAL  71  -2.995   8.055   2.751
  560    HA   VAL  71           HA       VAL  71  -1.322   9.336   1.872
  561    HB   VAL  71           HB       VAL  71  -1.874  10.455  -0.211
  562   HG11  VAL  71          HG11      VAL  71  -2.299   8.544  -1.325
  563   HG12  VAL  71          HG12      VAL  71  -3.744   8.186  -0.378
  564   HG13  VAL  71          HG13      VAL  71  -2.147   7.821   0.277
  565   HG21  VAL  71          HG21      VAL  71  -3.954  11.560   0.649
  566   HG22  VAL  71          HG22      VAL  71  -4.783  10.018   0.440
  567   HG23  VAL  71          HG23      VAL  71  -4.105  10.852  -0.960
  568    H    MET  72           HN       MET  72  -1.054  11.817   0.863
  569    HA   MET  72           HA       MET  72  -0.734  13.995   1.420
  570    HB2  MET  72           HB2      MET  72  -3.439  13.512   1.841
  571    HB3  MET  72           HB1      MET  72  -2.916  14.297   3.324
  572    HG2  MET  72           HG2      MET  72  -2.771  16.280   2.341
  573    HG3  MET  72           HG1      MET  72  -1.874  15.625   0.972
  574    HE1  MET  72           HE1      MET  72  -6.187  15.320   1.825
  575    HE2  MET  72           HE2      MET  72  -5.940  17.032   1.482
  576    HE3  MET  72           HE3      MET  72  -4.981  16.237   2.730
  577    H    LEU  73           HN       LEU  73   0.812  14.707   2.717
  578    HA   LEU  73           HA       LEU  73   2.069  15.130   4.566
  579    HB2  LEU  73           HB2      LEU  73  -0.130  13.978   6.264
  580    HB3  LEU  73           HB1      LEU  73   1.080  15.164   6.715
  581    HG   LEU  73           HG       LEU  73  -1.067  15.718   4.674
  582   HD11  LEU  73          HD11      LEU  73  -2.348  15.355   6.569
  583   HD12  LEU  73          HD12      LEU  73  -2.024  17.086   6.646
  584   HD13  LEU  73          HD13      LEU  73  -1.103  15.971   7.654
  585   HD21  LEU  73          HD21      LEU  73   0.195  17.835   6.299
  586   HD22  LEU  73          HD22      LEU  73  -0.284  17.837   4.602
  587   HD23  LEU  73          HD23      LEU  73   1.220  17.059   5.091
  588    H    GLN  74           HN       GLN  74   0.246  12.179   5.422
  589    HA   GLN  74           HA       GLN  74   0.929  10.080   5.972
  590    HB2  GLN  74           HB2      GLN  74   2.986  10.992   4.042
  591    HB3  GLN  74           HB1      GLN  74   3.404   9.595   5.025
  592    HG2  GLN  74           HG2      GLN  74   0.739   9.494   3.808
  593    HG3  GLN  74           HG1      GLN  74   2.083   9.486   2.668
  594   HE21  GLN  74          1HE2      GLN  74   1.556   7.355   2.079
  595   HE22  GLN  74          2HE2      GLN  74   1.959   6.014   3.091
  596    HA   PRO  75           HA       PRO  75   3.160  12.015   9.603
  597    HB2  PRO  75           HB2      PRO  75   1.494   9.869  10.830
  598    HB3  PRO  75           HB1      PRO  75   1.795  11.518  11.389
  599    HG2  PRO  75           HG2      PRO  75  -0.523  10.876  10.251
  600    HG3  PRO  75           HG1      PRO  75   0.250  12.438   9.924
  601    HD2  PRO  75           HD2      PRO  75   0.080  10.010   8.202
  602    HD3  PRO  75           HD1      PRO  75   0.068  11.725   7.743
  603    H    PHE  76           HN       PHE  76   2.727   8.730   8.452
  604    HA   PHE  76           HA       PHE  76   4.839   7.679  10.125
  605    HB2  PHE  76           HB2      PHE  76   2.668   6.531   8.953
  606    HB3  PHE  76           HB1      PHE  76   3.934   6.073   7.821
  607    HD1  PHE  76           HD2      PHE  76   3.156   6.082  11.459
  608    HD2  PHE  76           HD1      PHE  76   5.220   4.203   8.247
  609    HE1  PHE  76           HE2      PHE  76   3.831   4.257  12.965
  610    HE2  PHE  76           HE1      PHE  76   5.898   2.374   9.747
  611    HZ   PHE  76           HZ       PHE  76   5.203   2.400  12.110
  612    H    ASP  77           HN       ASP  77   6.150   9.576   9.059
  613    HA   ASP  77           HA       ASP  77   7.741   8.350   6.915
  614    HB2  ASP  77           HB2      ASP  77   6.295  10.879   6.846
  615    HB3  ASP  77           HB1      ASP  77   8.010  11.085   6.502
  616    H    TYR  78           HN       TYR  78   7.946   8.760   9.947
  617    HA   TYR  78           HA       TYR  78  10.725   9.662   9.881
  618    HB2  TYR  78           HB2      TYR  78   8.809  10.649  11.996
  619    HB3  TYR  78           HB1      TYR  78  10.486  11.132  11.759
  620    HD1  TYR  78           HD2      TYR  78   7.138  11.226  10.135
  621    HD2  TYR  78           HD1      TYR  78  11.000  12.985  10.434
  622    HE1  TYR  78           HE2      TYR  78   6.393  13.090   8.713
  623    HE2  TYR  78           HE1      TYR  78  10.267  14.853   9.014
  624    HH   TYR  78           HH       TYR  78   7.450  15.798   8.527
  625    H    ASP  79           HN       ASP  79   9.583   7.031  10.078
  626    HA   ASP  79           HA       ASP  79   9.282   5.961  12.580
  627    HB2  ASP  79           HB2      ASP  79   9.905   4.975   9.976
  628    HB3  ASP  79           HB1      ASP  79  10.917   4.140  11.150
  629    HA   PRO  80           HA       PRO  80  13.222   6.925  14.518
  630    HB2  PRO  80           HB2      PRO  80  12.619   5.814  16.928
  631    HB3  PRO  80           HB1      PRO  80  12.042   7.411  16.441
  632    HG2  PRO  80           HG2      PRO  80  10.614   4.782  16.379
  633    HG3  PRO  80           HG1      PRO  80  10.015   6.370  16.895
  634    HD2  PRO  80           HD2      PRO  80   9.444   5.327  14.467
  635    HD3  PRO  80           HD1      PRO  80   9.638   7.073  14.729
  636    H    ASN  81           HN       ASN  81  13.739   5.182  12.821
  637    HA   ASN  81           HA       ASN  81  15.479   3.320  13.821
  638    HB2  ASN  81           HB2      ASN  81  13.343   2.218  14.650
  639    HB3  ASN  81           HB1      ASN  81  12.928   1.941  12.962
  640   HD21  ASN  81          1HE2      ASN  81  12.953  -0.289  14.044
  641   HD22  ASN  81          2HE2      ASN  81  14.433  -1.169  13.903
  642    H    GLU  82           HN       GLU  82  16.806   3.115  12.057
  643    HA   GLU  82           HA       GLU  82  16.115   4.017   9.521
  644    HB2  GLU  82           HB2      GLU  82  18.465   3.476  10.774
  645    HB3  GLU  82           HB1      GLU  82  18.376   2.134   9.642
  646    HG2  GLU  82           HG2      GLU  82  18.666   3.455   7.833
  647    HG3  GLU  82           HG1      GLU  82  17.810   4.818   8.553
  648    H    LYS  83           HN       LYS  83  16.519   0.677  10.689
  649    HA   LYS  83           HA       LYS  83  15.950  -0.523   8.207
  650    HB2  LYS  83           HB2      LYS  83  15.300  -2.529   9.595
  651    HB3  LYS  83           HB1      LYS  83  16.907  -1.895   9.916
  652    HG2  LYS  83           HG2      LYS  83  15.441  -0.539  11.749
  653    HG3  LYS  83           HG1      LYS  83  14.558  -2.063  11.660
  654    HD2  LYS  83           HD2      LYS  83  17.513  -1.750  12.185
  655    HD3  LYS  83           HD1      LYS  83  16.283  -2.137  13.389
  656    HE2  LYS  83           HE2      LYS  83  17.123  -4.225  12.888
  657    HE3  LYS  83           HE1      LYS  83  15.741  -4.124  11.799
  658    HZ1  LYS  83           HZ1      LYS  83  17.057  -4.054   9.993
  659    HZ2  LYS  83           HZ2      LYS  83  18.183  -4.802  11.008
  660    HZ3  LYS  83           HZ3      LYS  83  18.260  -3.133  10.747
  661    H    SER  84           HN       SER  84  13.915   0.342  10.968
  662    HA   SER  84           HA       SER  84  11.479  -0.437   9.641
  663    HB2  SER  84           HB2      SER  84  12.153  -0.014  12.252
  664    HB3  SER  84           HB1      SER  84  11.245   1.452  11.885
  665    HG   SER  84           HG       SER  84   9.612   0.174  12.307
  666    H    LYS  85           HN       LYS  85  13.441   2.356   9.544
  667    HA   LYS  85           HA       LYS  85  11.684   4.446   9.246
  668    HB2  LYS  85           HB2      LYS  85  14.081   4.766   9.320
  669    HB3  LYS  85           HB1      LYS  85  14.270   3.987   7.757
  670    HG2  LYS  85           HG2      LYS  85  13.681   5.835   6.619
  671    HG3  LYS  85           HG1      LYS  85  12.449   6.294   7.797
  672    HD2  LYS  85           HD2      LYS  85  13.872   7.597   8.962
  673    HD3  LYS  85           HD1      LYS  85  15.220   6.476   8.763
  674    HE2  LYS  85           HE2      LYS  85  16.052   8.013   7.366
  675    HE3  LYS  85           HE1      LYS  85  14.863   7.404   6.216
  676    HZ1  LYS  85           HZ1      LYS  85  13.525   9.203   6.503
  677    HZ2  LYS  85           HZ2      LYS  85  15.015   9.940   6.817
  678    HZ3  LYS  85           HZ3      LYS  85  14.014   9.476   8.099
  679    H    HIS  86           HN       HIS  86  13.202   3.982   6.191
  680    HA   HIS  86           HA       HIS  86  12.426   3.567   4.071
  681    HB2  HIS  86           HB2      HIS  86  10.863   1.972   3.799
  682    HB3  HIS  86           HB1      HIS  86  10.893   1.865   5.551
  683    HD1  HIS  86           HD1      HIS  86   8.710   2.207   6.699
  684    HD2  HIS  86           HD2      HIS  86   8.692   3.718   2.828
  685    HE1  HIS  86           HE1      HIS  86   6.342   2.935   6.272
  686    HE2  HIS  86           HE2      HIS  86   6.337   3.771   3.895
  687    H    LYS  87           HN       LYS  87  10.778   4.368   2.444
  688    HA   LYS  87           HA       LYS  87   9.068   6.575   3.190
  689    HB2  LYS  87           HB2      LYS  87  11.784   7.095   2.434
  690    HB3  LYS  87           HB1      LYS  87  10.716   7.721   1.186
  691    HG2  LYS  87           HG2      LYS  87   9.647   9.177   2.671
  692    HG3  LYS  87           HG1      LYS  87  10.264   8.325   4.088
  693    HD2  LYS  87           HD2      LYS  87  12.020   9.779   2.116
  694    HD3  LYS  87           HD1      LYS  87  11.384  10.518   3.588
  695    HE2  LYS  87           HE2      LYS  87  13.268   9.766   4.541
  696    HE3  LYS  87           HE1      LYS  87  12.456   8.201   4.546
  697    HZ1  LYS  87           HZ1      LYS  87  14.320   7.594   3.461
  698    HZ2  LYS  87           HZ2      LYS  87  14.647   9.151   2.886
  699    HZ3  LYS  87           HZ3      LYS  87  13.495   8.189   2.108
  700    H    PHE  88           HN       PHE  88   7.778   7.386   1.307
  701    HA   PHE  88           HA       PHE  88   7.110   5.221  -0.423
  702    HB2  PHE  88           HB2      PHE  88   5.496   6.966  -1.424
  703    HB3  PHE  88           HB1      PHE  88   5.262   6.439   0.238
  704    HD1  PHE  88           HD2      PHE  88   6.368   9.195  -1.915
  705    HD2  PHE  88           HD1      PHE  88   5.557   7.948   2.072
  706    HE1  PHE  88           HE2      PHE  88   6.432  11.540  -1.173
  707    HE2  PHE  88           HE1      PHE  88   5.616  10.291   2.820
  708    HZ   PHE  88           HZ       PHE  88   6.055  12.090   1.197
  709    H    MET  89           HN       MET  89   8.404   8.512  -1.306
  710    HA   MET  89           HA       MET  89   8.653   7.668  -4.063
  711    HB2  MET  89           HB2      MET  89   9.066  10.198  -2.593
  712    HB3  MET  89           HB1      MET  89  10.294   9.926  -3.814
  713    HG2  MET  89           HG2      MET  89   8.462   9.700  -5.527
  714    HG3  MET  89           HG1      MET  89   7.297  10.126  -4.276
  715    HE1  MET  89           HE1      MET  89   7.005  13.591  -5.956
  716    HE2  MET  89           HE2      MET  89   6.482  11.926  -6.193
  717    HE3  MET  89           HE3      MET  89   7.772  12.598  -7.193
  718    H    VAL  90           HN       VAL  90  10.626   7.925  -1.228
  719    HA   VAL  90           HA       VAL  90  13.164   7.179  -2.341
  720    HB   VAL  90           HB       VAL  90  12.502   7.060   0.572
  721   HG11  VAL  90          HG11      VAL  90  14.942   7.364  -1.103
  722   HG12  VAL  90          HG12      VAL  90  14.667   6.360   0.321
  723   HG13  VAL  90          HG13      VAL  90  14.912   8.098   0.500
  724   HG21  VAL  90          HG21      VAL  90  11.611   9.162   0.043
  725   HG22  VAL  90          HG22      VAL  90  12.871   9.493  -1.147
  726   HG23  VAL  90          HG23      VAL  90  13.258   9.506   0.574
  727    H    GLN  91           HN       GLN  91  10.496   5.266  -1.437
  728    HA   GLN  91           HA       GLN  91  11.604   3.138  -0.091
  729    HB2  GLN  91           HB2      GLN  91   9.180   3.705  -1.440
  730    HB3  GLN  91           HB1      GLN  91   9.699   2.112  -1.967
  731    HG2  GLN  91           HG2      GLN  91   9.503   1.203   0.132
  732    HG3  GLN  91           HG1      GLN  91   9.697   2.757   0.940
  733   HE21  GLN  91          1HE2      GLN  91   7.748   1.343   1.907
  734   HE22  GLN  91          2HE2      GLN  91   6.198   1.877   1.362
  735    H    SER  92           HN       SER  92  12.252   3.925  -3.383
  736    HA   SER  92           HA       SER  92  12.784   1.318  -4.356
  737    HB2  SER  92           HB2      SER  92  14.363   2.839  -5.921
  738    HB3  SER  92           HB1      SER  92  12.620   2.712  -6.133
  739    HG   SER  92           HG       SER  92  12.656   4.794  -5.865
  740    H    MET  93           HN       MET  93  14.564   3.254  -2.189
  741    HA   MET  93           HA       MET  93  17.170   2.370  -2.894
  742    HB2  MET  93           HB2      MET  93  16.052   4.322  -1.186
  743    HB3  MET  93           HB1      MET  93  17.038   3.273  -0.176
  744    HG2  MET  93           HG2      MET  93  18.079   4.437  -2.734
  745    HG3  MET  93           HG1      MET  93  18.146   5.319  -1.209
  746    HE1  MET  93           HE1      MET  93  19.691   3.210  -3.587
  747    HE2  MET  93           HE2      MET  93  19.419   1.670  -2.773
  748    HE3  MET  93           HE3      MET  93  21.035   2.374  -2.811
  749    H    PHE  94           HN       PHE  94  14.938   1.565  -0.244
  750    HA   PHE  94           HA       PHE  94  16.763  -0.423   0.745
  751    HB2  PHE  94           HB2      PHE  94  15.318  -0.760   2.533
  752    HB3  PHE  94           HB1      PHE  94  15.086   0.933   2.129
  753    HD1  PHE  94           HD1      PHE  94  13.607  -2.412   1.330
  754    HD2  PHE  94           HD2      PHE  94  12.954   1.731   2.045
  755    HE1  PHE  94           HE1      PHE  94  11.181  -2.780   1.212
  756    HE2  PHE  94           HE2      PHE  94  10.528   1.366   1.933
  757    HZ   PHE  94           HZ       PHE  94   9.635  -0.888   1.513
  758    H    ALA  95           HN       ALA  95  14.619  -0.481  -1.832
  759    HA   ALA  95           HA       ALA  95  15.139  -2.981  -2.699
  760    HB1  ALA  95           HB1      ALA  95  12.855  -4.118  -1.914
  761    HB2  ALA  95           HB2      ALA  95  13.172  -3.116  -0.498
  762    HB3  ALA  95           HB3      ALA  95  14.370  -4.296  -1.029
  763    HA   PRO  96           HA       PRO  96  10.296  -2.120  -4.085
  764    HB2  PRO  96           HB2      PRO  96  10.906   0.732  -3.375
  765    HB3  PRO  96           HB1      PRO  96   9.336  -0.060  -3.552
  766    HG2  PRO  96           HG2      PRO  96  10.570   0.253  -1.144
  767    HG3  PRO  96           HG1      PRO  96   9.466  -1.082  -1.505
  768    HD2  PRO  96           HD2      PRO  96  12.297  -1.201  -0.970
  769    HD3  PRO  96           HD1      PRO  96  11.181  -2.542  -1.273
  770    H    THR  97           HN       THR  97  11.844  -2.785  -5.826
  771    HA   THR  97           HA       THR  97  13.105  -0.862  -7.492
  772    HB   THR  97           HB       THR  97  12.202  -3.703  -8.006
  773    HG1  THR  97           HG1      THR  97  14.678  -2.499  -7.370
  774   HG21  THR  97          HG21      THR  97  14.225  -3.166  -9.793
  775   HG22  THR  97          HG22      THR  97  13.187  -1.745  -9.900
  776   HG23  THR  97          HG23      THR  97  12.513  -3.351 -10.175
  777    H    ASP  98           HN       ASP  98   9.900  -1.851  -7.013
  778    HA   ASP  98           HA       ASP  98   8.671  -1.577  -9.444
  779    HB2  ASP  98           HB2      ASP  98   6.632  -0.938  -8.098
  780    HB3  ASP  98           HB1      ASP  98   7.427  -2.435  -7.623
  781    H    THR  99           HN       THR  99  10.091   0.970  -7.564
  782    HA   THR  99           HA       THR  99   8.469   3.124  -8.288
  783    HB   THR  99           HB       THR  99  10.439   4.547  -7.939
  784    HG1  THR  99           HG1      THR  99  11.822   2.079  -7.976
  785   HG21  THR  99          HG21      THR  99  10.683   2.376  -5.903
  786   HG22  THR  99          HG22      THR  99   9.232   3.376  -5.995
  787   HG23  THR  99          HG23      THR  99  10.803   4.122  -5.697
  788    H    SER 100           HN       SER 100  11.355   1.862  -9.991
  789    HA   SER 100           HA       SER 100  10.992   3.578 -12.249
  790    HB2  SER 100           HB2      SER 100  12.426   0.958 -12.487
  791    HB3  SER 100           HB1      SER 100  12.855   2.532 -13.159
  792    HG   SER 100           HG       SER 100  13.263   3.152 -10.904
  793    H    ASP 101           HN       ASP 101   9.698   0.624 -11.151
  794    HA   ASP 101           HA       ASP 101   8.778  -0.485 -13.575
  795    HB2  ASP 101           HB2      ASP 101   9.061  -1.644 -11.313
  796    HB3  ASP 101           HB1      ASP 101   7.495  -0.954 -10.899
  797    H    MET 102           HN       MET 102   7.624   2.160 -11.688
  798    HA   MET 102           HA       MET 102   4.885   2.031 -12.027
  799    HB2  MET 102           HB2      MET 102   6.855   4.246 -11.766
  800    HB3  MET 102           HB1      MET 102   5.268   4.687 -12.372
  801    HG2  MET 102           HG2      MET 102   4.378   4.599 -10.344
  802    HG3  MET 102           HG1      MET 102   5.055   3.000 -10.039
  803    HE1  MET 102           HE1      MET 102   4.897   6.528  -9.396
  804    HE2  MET 102           HE2      MET 102   6.319   7.005  -8.470
  805    HE3  MET 102           HE3      MET 102   5.074   6.007  -7.720
  806    H    GLU 103           HN       GLU 103   7.214   3.595 -14.261
  807    HA   GLU 103           HA       GLU 103   5.248   3.973 -16.302
  808    HB2  GLU 103           HB2      GLU 103   7.228   4.495 -17.744
  809    HB3  GLU 103           HB1      GLU 103   7.137   5.453 -16.273
  810    HG2  GLU 103           HG2      GLU 103   9.231   4.875 -15.865
  811    HG3  GLU 103           HG1      GLU 103   8.658   3.234 -15.574
  812    H    ALA 104           HN       ALA 104   7.619   1.554 -15.507
  813    HA   ALA 104           HA       ALA 104   7.536   0.074 -17.911
  814    HB1  ALA 104           HB1      ALA 104   8.917  -0.026 -15.423
  815    HB2  ALA 104           HB2      ALA 104   9.339  -0.769 -16.964
  816    HB3  ALA 104           HB3      ALA 104   8.317  -1.637 -15.820
  817    H    VAL 105           HN       VAL 105   5.381   0.103 -15.187
  818    HA   VAL 105           HA       VAL 105   4.463  -2.515 -15.187
  819    HB   VAL 105           HB       VAL 105   2.903   0.015 -14.646
  820   HG11  VAL 105          HG11      VAL 105   1.355  -1.782 -15.163
  821   HG12  VAL 105          HG12      VAL 105   1.313  -1.422 -13.438
  822   HG13  VAL 105          HG13      VAL 105   2.175  -2.846 -14.020
  823   HG21  VAL 105          HG21      VAL 105   4.854  -1.515 -13.148
  824   HG22  VAL 105          HG22      VAL 105   3.328  -1.368 -12.279
  825   HG23  VAL 105          HG23      VAL 105   4.178   0.079 -12.819
  826    H    TRP 106           HN       TRP 106   3.063   0.222 -17.029
  827    HA   TRP 106           HA       TRP 106   1.355  -1.599 -18.486
  828    HB2  TRP 106           HB2      TRP 106   1.100   1.023 -17.796
  829    HB3  TRP 106           HB1      TRP 106   1.615   1.169 -19.473
  830    HD1  TRP 106           HD1      TRP 106  -1.123  -0.709 -17.457
  831    HE1  TRP 106           HE1      TRP 106  -3.231  -0.841 -18.927
  832    HE3  TRP 106           HE3      TRP 106   0.707   1.480 -21.701
  833    HZ2  TRP 106           HZ2      TRP 106  -4.015  -0.114 -21.541
  834    HZ3  TRP 106           HZ3      TRP 106  -0.788   1.724 -23.641
  835    HH2  TRP 106           HH2      TRP 106  -3.099   0.942 -23.560
  836    H    LYS 107           HN       LYS 107   4.503  -0.307 -18.888
  837    HA   LYS 107           HA       LYS 107   4.490  -0.649 -21.775
  838    HB2  LYS 107           HB2      LYS 107   6.313   0.565 -19.784
  839    HB3  LYS 107           HB1      LYS 107   7.073  -0.132 -21.208
  840    HG2  LYS 107           HG2      LYS 107   6.259   1.456 -22.590
  841    HG3  LYS 107           HG1      LYS 107   4.748   1.618 -21.694
  842    HD2  LYS 107           HD2      LYS 107   5.618   3.154 -20.235
  843    HD3  LYS 107           HD1      LYS 107   7.262   2.532 -20.393
  844    HE2  LYS 107           HE2      LYS 107   7.542   4.420 -21.605
  845    HE3  LYS 107           HE1      LYS 107   6.885   3.413 -22.894
  846    HZ1  LYS 107           HZ1      LYS 107   4.656   4.302 -22.276
  847    HZ2  LYS 107           HZ2      LYS 107   5.715   5.459 -22.908
  848    HZ3  LYS 107           HZ3      LYS 107   5.426   5.399 -21.243
  849    H    GLU 108           HN       GLU 108   6.374  -1.949 -19.036
  850    HA   GLU 108           HA       GLU 108   7.551  -4.007 -20.632
  851    HB2  GLU 108           HB2      GLU 108   7.438  -3.730 -17.625
  852    HB3  GLU 108           HB1      GLU 108   8.482  -4.824 -18.521
  853    HG2  GLU 108           HG2      GLU 108   9.463  -2.787 -19.633
  854    HG3  GLU 108           HG1      GLU 108   8.582  -1.826 -18.447
  855    H    ALA 109           HN       ALA 109   4.517  -3.725 -19.128
  856    HA   ALA 109           HA       ALA 109   2.744  -5.165 -19.103
  857    HB1  ALA 109           HB1      ALA 109   4.536  -7.363 -20.096
  858    HB2  ALA 109           HB2      ALA 109   3.843  -6.142 -21.162
  859    HB3  ALA 109           HB3      ALA 109   2.786  -7.221 -20.251
  860    H    LYS 110           HN       LYS 110   2.104  -7.381 -18.094
  861    HA   LYS 110           HA       LYS 110   2.667  -7.313 -15.402
  862    HB2  LYS 110           HB2      LYS 110   0.699  -8.397 -16.244
  863    HB3  LYS 110           HB1      LYS 110   1.657  -9.592 -17.099
  864    HG2  LYS 110           HG2      LYS 110   2.092  -9.445 -14.189
  865    HG3  LYS 110           HG1      LYS 110   0.510 -10.025 -14.715
  866    HD2  LYS 110           HD2      LYS 110   3.090 -11.120 -15.807
  867    HD3  LYS 110           HD1      LYS 110   2.299 -11.788 -14.378
  868    HE2  LYS 110           HE2      LYS 110   0.821 -11.437 -16.965
  869    HE3  LYS 110           HE1      LYS 110   1.809 -12.866 -16.662
  870    HZ1  LYS 110           HZ1      LYS 110   0.477 -13.205 -14.607
  871    HZ2  LYS 110           HZ2      LYS 110  -0.415 -13.359 -16.035
  872    HZ3  LYS 110           HZ3      LYS 110  -0.545 -11.953 -15.105
  873    HA   PRO 111           HA       PRO 111   5.600 -11.283 -16.225
  874    HB2  PRO 111           HB2      PRO 111   6.878  -9.958 -18.588
  875    HB3  PRO 111           HB1      PRO 111   6.706 -11.676 -18.215
  876    HG2  PRO 111           HG2      PRO 111   5.089 -10.513 -19.974
  877    HG3  PRO 111           HG1      PRO 111   4.473 -11.728 -18.838
  878    HD2  PRO 111           HD2      PRO 111   4.116  -8.778 -18.838
  879    HD3  PRO 111           HD1      PRO 111   3.023 -10.047 -18.255
  880    H    GLU 112           HN       GLU 112   6.588  -7.943 -17.045
  881    HA   GLU 112           HA       GLU 112   9.097  -8.208 -15.698
  882    HB2  GLU 112           HB2      GLU 112   7.753  -6.208 -17.304
  883    HB3  GLU 112           HB1      GLU 112   8.557  -5.481 -15.919
  884    HG2  GLU 112           HG2      GLU 112  10.152  -5.443 -17.618
  885    HG3  GLU 112           HG1      GLU 112  10.608  -6.817 -16.614
  886    H    ASP 113           HN       ASP 113   5.921  -7.004 -14.814
  887    HA   ASP 113           HA       ASP 113   6.671  -5.671 -12.447
  888    HB2  ASP 113           HB2      ASP 113   4.437  -5.566 -13.723
  889    HB3  ASP 113           HB1      ASP 113   4.006  -7.019 -12.823
  890    H    LEU 114           HN       LEU 114   5.947  -9.031 -13.134
  891    HA   LEU 114           HA       LEU 114   5.526  -9.999 -10.565
  892    HB2  LEU 114           HB2      LEU 114   7.056 -11.452 -12.717
  893    HB3  LEU 114           HB1      LEU 114   6.142 -12.163 -11.400
  894    HG   LEU 114           HG       LEU 114   4.840 -10.490 -13.529
  895   HD11  LEU 114          HD11      LEU 114   4.753 -13.467 -13.590
  896   HD12  LEU 114          HD12      LEU 114   6.138 -12.632 -14.294
  897   HD13  LEU 114          HD13      LEU 114   4.512 -12.304 -14.894
  898   HD21  LEU 114          HD21      LEU 114   3.459 -12.683 -12.113
  899   HD22  LEU 114          HD22      LEU 114   2.866 -11.098 -12.608
  900   HD23  LEU 114          HD23      LEU 114   3.860 -11.254 -11.160
  901    H    MET 115           HN       MET 115   8.518  -9.210 -12.218
  902    HA   MET 115           HA       MET 115  10.245 -10.367 -10.273
  903    HB2  MET 115           HB2      MET 115  10.579  -8.506 -12.584
  904    HB3  MET 115           HB1      MET 115  11.877  -8.617 -11.403
  905    HG2  MET 115           HG2      MET 115  11.254 -11.252 -11.943
  906    HG3  MET 115           HG1      MET 115  11.110 -10.454 -13.507
  907    HE1  MET 115           HE1      MET 115  12.977 -10.704 -10.362
  908    HE2  MET 115           HE2      MET 115  14.556  -9.989 -10.686
  909    HE3  MET 115           HE3      MET 115  14.299 -11.714 -10.947
  910    H    ASP 116           HN       ASP 116   8.786  -7.201 -10.723
  911    HA   ASP 116           HA       ASP 116  10.309  -5.911  -8.676
  912    HB2  ASP 116           HB2      ASP 116   7.819  -5.198 -10.207
  913    HB3  ASP 116           HB1      ASP 116   8.366  -4.206  -8.859
  914    H    SER 117           HN       SER 117   7.213  -7.541  -8.860
  915    HA   SER 117           HA       SER 117   6.297  -6.850  -6.264
  916    HB2  SER 117           HB2      SER 117   5.514  -9.350  -7.710
  917    HB3  SER 117           HB1      SER 117   4.519  -8.320  -6.680
  918    HG   SER 117           HG       SER 117   5.291  -7.968  -9.355
  919    H    LYS 118           HN       LYS 118   7.810  -9.774  -7.599
  920    HA   LYS 118           HA       LYS 118   7.853 -11.218  -5.181
  921    HB2  LYS 118           HB2      LYS 118   9.591 -11.429  -7.645
  922    HB3  LYS 118           HB1      LYS 118   9.630 -12.582  -6.318
  923    HG2  LYS 118           HG2      LYS 118   6.929 -12.293  -7.106
  924    HG3  LYS 118           HG1      LYS 118   7.894 -12.504  -8.569
  925    HD2  LYS 118           HD2      LYS 118   7.430 -14.691  -7.976
  926    HD3  LYS 118           HD1      LYS 118   9.010 -14.437  -7.232
  927    HE2  LYS 118           HE2      LYS 118   7.673 -15.504  -5.599
  928    HE3  LYS 118           HE1      LYS 118   7.781 -13.812  -5.120
  929    HZ1  LYS 118           HZ1      LYS 118   5.582 -13.704  -6.554
  930    HZ2  LYS 118           HZ2      LYS 118   5.561 -14.109  -4.912
  931    HZ3  LYS 118           HZ3      LYS 118   5.481 -15.326  -6.084
  932    H    LEU 119           HN       LEU 119   9.905  -8.795  -6.552
  933    HA   LEU 119           HA       LEU 119  12.150  -9.243  -4.833
  934    HB2  LEU 119           HB2      LEU 119  12.176  -8.033  -7.052
  935    HB3  LEU 119           HB1      LEU 119  11.446  -6.668  -6.227
  936    HG   LEU 119           HG       LEU 119  13.572  -7.071  -4.624
  937   HD11  LEU 119          HD11      LEU 119  15.454  -7.847  -5.700
  938   HD12  LEU 119          HD12      LEU 119  14.777  -7.581  -7.306
  939   HD13  LEU 119          HD13      LEU 119  14.215  -8.935  -6.325
  940   HD21  LEU 119          HD21      LEU 119  14.209  -5.552  -7.067
  941   HD22  LEU 119          HD22      LEU 119  14.238  -5.053  -5.376
  942   HD23  LEU 119          HD23      LEU 119  12.708  -5.109  -6.253
  943    H    ARG 120           HN       ARG 120   9.554  -6.806  -4.828
  944    HA   ARG 120           HA       ARG 120  10.381  -5.653  -2.355
  945    HB2  ARG 120           HB2      ARG 120   8.929  -4.644  -4.277
  946    HB3  ARG 120           HB1      ARG 120   7.591  -5.402  -3.423
  947    HG2  ARG 120           HG2      ARG 120   8.746  -4.138  -1.369
  948    HG3  ARG 120           HG1      ARG 120   9.241  -3.067  -2.683
  949    HD2  ARG 120           HD2      ARG 120   7.223  -2.144  -2.700
  950    HD3  ARG 120           HD1      ARG 120   6.500  -3.712  -3.059
  951    HE   ARG 120           HE       ARG 120   6.878  -3.827  -0.392
  952   HH11  ARG 120          HH11      ARG 120   5.374  -1.457  -2.467
  953   HH12  ARG 120          HH12      ARG 120   4.248  -0.932  -1.260
  954   HH21  ARG 120          HH21      ARG 120   5.397  -3.137   1.196
  955   HH22  ARG 120          HH22      ARG 120   4.260  -1.886   0.820
  956    H    CYS 121           HN       CYS 121   8.016  -8.081  -3.285
  957    HA   CYS 121           HA       CYS 121   6.703  -8.273  -0.795
  958    HB2  CYS 121           HB2      CYS 121   6.956 -10.164  -3.126
  959    HB3  CYS 121           HB1      CYS 121   6.026 -10.571  -1.688
  960    HG   CYS 121           HG       CYS 121   5.259  -8.040  -3.312
  961    H    VAL 122           HN       VAL 122   9.592  -9.840  -2.071
  962    HA   VAL 122           HA       VAL 122   9.762 -11.747   0.059
  963    HB   VAL 122           HB       VAL 122  10.804 -12.150  -2.151
  964   HG11  VAL 122          HG11      VAL 122  12.671  -9.954  -1.280
  965   HG12  VAL 122          HG12      VAL 122  11.664 -10.007  -2.724
  966   HG13  VAL 122          HG13      VAL 122  13.039 -11.096  -2.570
  967   HG21  VAL 122          HG21      VAL 122  12.536 -12.224   0.305
  968   HG22  VAL 122          HG22      VAL 122  13.024 -12.957  -1.223
  969   HG23  VAL 122          HG23      VAL 122  11.572 -13.523  -0.397
  970    H    PHE 123           HN       PHE 123  11.133  -8.564  -0.553
  971    HA   PHE 123           HA       PHE 123  12.946  -8.597   1.638
  972    HB2  PHE 123           HB2      PHE 123  12.035  -6.663  -0.369
  973    HB3  PHE 123           HB1      PHE 123  12.412  -5.931   1.188
  974    HD1  PHE 123           HD1      PHE 123  14.677  -6.067   2.107
  975    HD2  PHE 123           HD2      PHE 123  13.743  -7.587  -1.758
  976    HE1  PHE 123           HE1      PHE 123  17.074  -6.123   1.554
  977    HE2  PHE 123           HE2      PHE 123  16.139  -7.646  -2.317
  978    HZ   PHE 123           HZ       PHE 123  17.807  -6.914  -0.661
  979    H    GLU 124           HN       GLU 124   9.650  -7.396   1.203
  980    HA   GLU 124           HA       GLU 124   9.422  -6.209   3.767
  981    HB2  GLU 124           HB2      GLU 124   7.918  -6.145   1.510
  982    HB3  GLU 124           HB1      GLU 124   6.958  -7.235   2.501
  983    HG2  GLU 124           HG2      GLU 124   6.111  -5.072   2.874
  984    HG3  GLU 124           HG1      GLU 124   7.045  -5.492   4.309
  985    H    LEU 125           HN       LEU 125   8.309  -9.330   2.472
  986    HA   LEU 125           HA       LEU 125   7.802 -11.302   3.484
  987    HB2  LEU 125           HB2      LEU 125  10.029 -10.405   4.778
  988    HB3  LEU 125           HB1      LEU 125   8.912 -10.593   6.115
  989    HG   LEU 125           HG       LEU 125   9.755 -12.742   4.172
  990   HD11  LEU 125          HD11      LEU 125  10.363 -13.649   6.636
  991   HD12  LEU 125          HD12      LEU 125  10.619 -11.919   6.861
  992   HD13  LEU 125          HD13      LEU 125  11.496 -12.783   5.598
  993   HD21  LEU 125          HD21      LEU 125   7.474 -13.146   4.710
  994   HD22  LEU 125          HD22      LEU 125   7.745 -12.774   6.412
  995   HD23  LEU 125          HD23      LEU 125   8.444 -14.231   5.706
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1 -12.322  13.481   2.289
    2    H2   MET   1           HT2      MET   1 -12.705  11.817   2.461
    3    H3   MET   1           HT3      MET   1 -13.807  13.014   3.008
    4    HA   MET   1           HA       MET   1 -14.337  11.894   0.868
    5    HB2  MET   1           HB2      MET   1 -14.213  14.804   1.478
    6    HB3  MET   1           HB1      MET   1 -14.674  14.345  -0.156
    7    HG2  MET   1           HG2      MET   1 -16.267  12.708   1.269
    8    HG3  MET   1           HG1      MET   1 -16.141  14.073   2.375
    9    HE1  MET   1           HE1      MET   1 -18.077  12.528  -0.318
   10    HE2  MET   1           HE2      MET   1 -19.311  13.775  -0.500
   11    HE3  MET   1           HE3      MET   1 -18.945  13.122   1.098
   12    H    ALA   2           HN       ALA   2 -12.955  10.851  -0.474
   13    HA   ALA   2           HA       ALA   2 -10.914  12.445  -1.867
   14    HB1  ALA   2           HB1      ALA   2  -9.547  10.655  -1.867
   15    HB2  ALA   2           HB2      ALA   2 -10.861   9.518  -2.169
   16    HB3  ALA   2           HB3      ALA   2 -10.572  10.119  -0.536
   17    H    LYS   3           HN       LYS   3 -10.485  10.789  -4.046
   18    HA   LYS   3           HA       LYS   3 -12.916  11.302  -5.599
   19    HB2  LYS   3           HB2      LYS   3 -11.295  10.876  -7.560
   20    HB3  LYS   3           HB1      LYS   3 -11.124  12.368  -6.648
   21    HG2  LYS   3           HG2      LYS   3  -9.263  11.430  -5.409
   22    HG3  LYS   3           HG1      LYS   3  -9.459   9.891  -6.249
   23    HD2  LYS   3           HD2      LYS   3  -7.920  10.709  -7.666
   24    HD3  LYS   3           HD1      LYS   3  -9.263  11.638  -8.334
   25    HE2  LYS   3           HE2      LYS   3  -7.734  12.724  -6.011
   26    HE3  LYS   3           HE1      LYS   3  -7.039  12.826  -7.627
   27    HZ1  LYS   3           HZ1      LYS   3  -8.661  14.255  -8.337
   28    HZ2  LYS   3           HZ2      LYS   3  -8.531  14.731  -6.720
   29    HZ3  LYS   3           HZ3      LYS   3  -9.802  13.727  -7.205
   30    H    VAL   4           HN       VAL   4 -13.976   9.403  -4.758
   31    HA   VAL   4           HA       VAL   4 -13.072   6.804  -4.888
   32    HB   VAL   4           HB       VAL   4 -15.483   6.132  -5.110
   33   HG11  VAL   4          HG11      VAL   4 -14.129   6.929  -2.972
   34   HG12  VAL   4          HG12      VAL   4 -15.833   6.482  -2.891
   35   HG13  VAL   4          HG13      VAL   4 -15.370   8.182  -2.971
   36   HG21  VAL   4          HG21      VAL   4 -16.439   7.875  -6.387
   37   HG22  VAL   4          HG22      VAL   4 -15.830   9.116  -5.291
   38   HG23  VAL   4          HG23      VAL   4 -17.119   8.035  -4.768
   39    H    GLU   5           HN       GLU   5 -13.986   8.868  -7.515
   40    HA   GLU   5           HA       GLU   5 -14.554   6.780  -9.384
   41    HB2  GLU   5           HB2      GLU   5 -13.726   9.613 -10.015
   42    HB3  GLU   5           HB1      GLU   5 -14.631   8.509 -11.042
   43    HG2  GLU   5           HG2      GLU   5 -15.625   9.593  -8.418
   44    HG3  GLU   5           HG1      GLU   5 -16.010  10.276  -9.995
   45    H    GLN   6           HN       GLN   6 -11.751   8.912  -8.855
   46    HA   GLN   6           HA       GLN   6 -10.151   7.702 -10.869
   47    HB2  GLN   6           HB2      GLN   6  -9.851   9.795  -8.854
   48    HB3  GLN   6           HB1      GLN   6  -8.379   8.861  -9.075
   49    HG2  GLN   6           HG2      GLN   6  -9.138   9.344 -11.653
   50    HG3  GLN   6           HG1      GLN   6  -9.651  10.817 -10.832
   51   HE21  GLN   6          1HE2      GLN   6  -8.139  12.242 -11.509
   52   HE22  GLN   6          2HE2      GLN   6  -6.438  12.066 -11.248
   53    H    VAL   7           HN       VAL   7 -10.487   7.223  -7.395
   54    HA   VAL   7           HA       VAL   7  -8.343   5.299  -7.277
   55    HB   VAL   7           HB       VAL   7  -8.944   5.040  -4.919
   56   HG11  VAL   7          HG11      VAL   7  -8.560   7.421  -4.239
   57   HG12  VAL   7          HG12      VAL   7  -8.731   7.866  -5.937
   58   HG13  VAL   7          HG13      VAL   7  -7.421   6.799  -5.433
   59   HG21  VAL   7          HG21      VAL   7 -11.384   6.418  -5.819
   60   HG22  VAL   7          HG22      VAL   7 -10.734   6.949  -4.267
   61   HG23  VAL   7          HG23      VAL   7 -11.151   5.254  -4.516
   62    H    LEU   8           HN       LEU   8 -11.713   5.134  -7.956
   63    HA   LEU   8           HA       LEU   8 -12.411   2.667  -6.874
   64    HB2  LEU   8           HB2      LEU   8 -13.434   4.441  -8.918
   65    HB3  LEU   8           HB1      LEU   8 -13.659   2.765  -9.380
   66    HG   LEU   8           HG       LEU   8 -14.540   3.808  -6.698
   67   HD11  LEU   8          HD11      LEU   8 -16.488   4.595  -7.510
   68   HD12  LEU   8          HD12      LEU   8 -16.552   3.406  -8.812
   69   HD13  LEU   8          HD13      LEU   8 -15.535   4.838  -8.974
   70   HD21  LEU   8          HD21      LEU   8 -14.264   1.272  -7.535
   71   HD22  LEU   8          HD22      LEU   8 -15.903   1.599  -8.096
   72   HD23  LEU   8          HD23      LEU   8 -15.501   1.790  -6.390
   73    H    SER   9           HN       SER   9 -11.006   3.354 -10.069
   74    HA   SER   9           HA       SER   9 -10.116   1.957 -11.661
   75    HB2  SER   9           HB2      SER   9  -8.175   0.715 -10.806
   76    HB3  SER   9           HB1      SER   9  -8.268   2.324 -10.092
   77    HG   SER   9           HG       SER   9  -9.137   1.389  -8.216
   78    H    LEU  10           HN       LEU  10 -12.634   0.864 -10.413
   79    HA   LEU  10           HA       LEU  10 -12.157  -1.983 -10.328
   80    HB2  LEU  10           HB2      LEU  10 -14.349  -0.206  -9.623
   81    HB3  LEU  10           HB1      LEU  10 -14.880  -1.686 -10.402
   82    HG   LEU  10           HG       LEU  10 -12.892  -2.131  -8.299
   83   HD11  LEU  10          HD11      LEU  10 -13.788  -0.564  -6.922
   84   HD12  LEU  10          HD12      LEU  10 -14.943  -1.864  -6.626
   85   HD13  LEU  10          HD13      LEU  10 -15.346  -0.565  -7.748
   86   HD21  LEU  10          HD21      LEU  10 -14.511  -3.865  -7.664
   87   HD22  LEU  10          HD22      LEU  10 -14.101  -3.936  -9.377
   88   HD23  LEU  10          HD23      LEU  10 -15.639  -3.240  -8.868
   89    H    GLU  11           HN       GLU  11 -12.956   0.288 -12.794
   90    HA   GLU  11           HA       GLU  11 -14.506  -1.408 -14.449
   91    HB2  GLU  11           HB2      GLU  11 -13.162   1.169 -14.701
   92    HB3  GLU  11           HB1      GLU  11 -13.059   0.229 -16.183
   93    HG2  GLU  11           HG2      GLU  11 -15.040   1.144 -16.643
   94    HG3  GLU  11           HG1      GLU  11 -15.674  -0.086 -15.550
   95    HA   PRO  12           HA       PRO  12 -10.393  -2.982 -16.179
   96    HB2  PRO  12           HB2      PRO  12  -8.084  -1.771 -15.599
   97    HB3  PRO  12           HB1      PRO  12  -9.214  -1.037 -16.743
   98    HG2  PRO  12           HG2      PRO  12  -8.572  -0.250 -13.965
   99    HG3  PRO  12           HG1      PRO  12  -9.177   0.739 -15.303
  100    HD2  PRO  12           HD2      PRO  12 -10.675  -0.447 -13.156
  101    HD3  PRO  12           HD1      PRO  12 -11.282   0.543 -14.495
  102    H    GLN  13           HN       GLN  13 -10.177  -4.933 -15.102
  103    HA   GLN  13           HA       GLN  13  -9.922  -5.118 -12.315
  104    HB2  GLN  13           HB2      GLN  13 -10.480  -6.891 -14.291
  105    HB3  GLN  13           HB1      GLN  13  -8.831  -7.367 -13.910
  106    HG2  GLN  13           HG2      GLN  13  -9.717  -8.623 -12.310
  107    HG3  GLN  13           HG1      GLN  13  -9.984  -7.119 -11.430
  108   HE21  GLN  13          1HE2      GLN  13 -11.681  -8.631 -10.525
  109   HE22  GLN  13          2HE2      GLN  13 -13.230  -8.598 -11.289
  110    H    HIS  14           HN       HIS  14  -7.576  -4.499 -14.754
  111    HA   HIS  14           HA       HIS  14  -5.333  -4.157 -14.707
  112    HB2  HIS  14           HB2      HIS  14  -6.077  -3.771 -11.827
  113    HB3  HIS  14           HB1      HIS  14  -4.391  -3.694 -12.326
  114    HD1  HIS  14           HD1      HIS  14  -6.257  -2.373 -15.047
  115    HD2  HIS  14           HD2      HIS  14  -5.072  -0.909 -11.344
  116    HE1  HIS  14           HE1      HIS  14  -6.410   0.129 -15.234
  117    HE2  HIS  14           HE2      HIS  14  -5.605   0.997 -13.010
  118    H    GLU  15           HN       GLU  15  -3.548  -5.401 -14.815
  119    HA   GLU  15           HA       GLU  15  -3.403  -7.782 -13.109
  120    HB2  GLU  15           HB2      GLU  15  -2.601  -9.068 -15.117
  121    HB3  GLU  15           HB1      GLU  15  -4.303  -8.625 -15.149
  122    HG2  GLU  15           HG2      GLU  15  -3.758  -6.732 -16.622
  123    HG3  GLU  15           HG1      GLU  15  -2.072  -7.246 -16.625
  124    H    LEU  16           HN       LEU  16  -1.960  -5.575 -12.495
  125    HA   LEU  16           HA       LEU  16   0.565  -5.403 -13.748
  126    HB2  LEU  16           HB2      LEU  16  -0.432  -4.567 -11.033
  127    HB3  LEU  16           HB1      LEU  16   1.232  -4.316 -11.525
  128    HG   LEU  16           HG       LEU  16   0.309  -3.018 -13.510
  129   HD11  LEU  16          HD11      LEU  16  -1.950  -2.063 -13.161
  130   HD12  LEU  16          HD12      LEU  16  -2.192  -3.207 -11.841
  131   HD13  LEU  16          HD13      LEU  16  -1.962  -3.795 -13.488
  132   HD21  LEU  16          HD21      LEU  16   1.123  -2.205 -11.096
  133   HD22  LEU  16          HD22      LEU  16  -0.531  -1.592 -11.060
  134   HD23  LEU  16          HD23      LEU  16   0.566  -1.093 -12.347
  135    H    LYS  17           HN       LYS  17   0.943  -5.970 -10.365
  136    HA   LYS  17           HA       LYS  17   2.853  -8.003 -10.761
  137    HB2  LYS  17           HB2      LYS  17   2.714  -8.313  -8.297
  138    HB3  LYS  17           HB1      LYS  17   2.918  -6.632  -8.772
  139    HG2  LYS  17           HG2      LYS  17   0.968  -6.015  -7.877
  140    HG3  LYS  17           HG1      LYS  17   0.126  -7.442  -8.480
  141    HD2  LYS  17           HD2      LYS  17   0.364  -8.535  -6.538
  142    HD3  LYS  17           HD1      LYS  17   2.050  -8.043  -6.369
  143    HE2  LYS  17           HE2      LYS  17   0.263  -5.805  -5.993
  144    HE3  LYS  17           HE1      LYS  17  -0.129  -7.126  -4.894
  145    HZ1  LYS  17           HZ1      LYS  17   2.390  -5.608  -5.125
  146    HZ2  LYS  17           HZ2      LYS  17   2.370  -7.146  -4.423
  147    HZ3  LYS  17           HZ3      LYS  17   1.448  -5.898  -3.750
  148    H    PHE  18           HN       PHE  18   1.748  -9.507 -12.132
  149    HA   PHE  18           HA       PHE  18   0.751 -11.519 -12.519
  150    HB2  PHE  18           HB2      PHE  18   1.647 -11.822 -10.004
  151    HB3  PHE  18           HB1      PHE  18  -0.083 -11.927  -9.696
  152    HD1  PHE  18           HD1      PHE  18   1.924 -13.135 -12.587
  153    HD2  PHE  18           HD2      PHE  18  -0.523 -14.153  -9.258
  154    HE1  PHE  18           HE1      PHE  18   1.943 -15.490 -13.299
  155    HE2  PHE  18           HE2      PHE  18  -0.507 -16.511  -9.963
  156    HZ   PHE  18           HZ       PHE  18   0.728 -17.182 -11.986
  157    H    ARG  19           HN       ARG  19  -1.504 -12.714 -11.893
  158    HA   ARG  19           HA       ARG  19  -3.533 -11.166 -12.909
  159    HB2  ARG  19           HB2      ARG  19  -3.420 -13.727 -12.392
  160    HB3  ARG  19           HB1      ARG  19  -4.187 -13.276 -10.878
  161    HG2  ARG  19           HG2      ARG  19  -5.464 -12.124 -13.240
  162    HG3  ARG  19           HG1      ARG  19  -5.491 -13.888 -13.188
  163    HD2  ARG  19           HD2      ARG  19  -6.460 -13.795 -10.936
  164    HD3  ARG  19           HD1      ARG  19  -6.450 -12.034 -11.009
  165    HE   ARG  19           HE       ARG  19  -7.880 -12.724 -13.194
  166   HH11  ARG  19          HH11      ARG  19  -8.110 -13.608  -9.826
  167   HH12  ARG  19          HH12      ARG  19  -9.824 -13.846  -9.876
  168   HH21  ARG  19          HH21      ARG  19 -10.136 -13.034 -13.261
  169   HH22  ARG  19          HH22      ARG  19 -10.975 -13.518 -11.825
  170    H    GLY  20           HN       GLY  20  -3.834 -12.230  -9.528
  171    HA2  GLY  20           HA2      GLY  20  -3.745  -9.709  -8.324
  172    HA3  GLY  20           HA1      GLY  20  -5.414  -9.984  -8.794
  173    HA   PRO  21           HA       PRO  21  -3.886 -12.418  -4.817
  174    HB2  PRO  21           HB2      PRO  21  -4.811 -10.014  -3.367
  175    HB3  PRO  21           HB1      PRO  21  -3.444 -11.073  -3.017
  176    HG2  PRO  21           HG2      PRO  21  -3.077  -8.625  -4.040
  177    HG3  PRO  21           HG1      PRO  21  -2.050  -9.991  -4.512
  178    HD2  PRO  21           HD2      PRO  21  -4.268  -8.679  -6.011
  179    HD3  PRO  21           HD1      PRO  21  -2.761  -9.396  -6.618
  180    H    PHE  22           HN       PHE  22  -5.474 -13.379  -3.501
  181    HA   PHE  22           HA       PHE  22  -8.108 -13.279  -4.591
  182    HB2  PHE  22           HB2      PHE  22  -6.629 -15.019  -2.874
  183    HB3  PHE  22           HB1      PHE  22  -8.161 -14.640  -2.095
  184    HD1  PHE  22           HD1      PHE  22 -10.218 -14.686  -3.847
  185    HD2  PHE  22           HD2      PHE  22  -6.594 -16.893  -4.179
  186    HE1  PHE  22           HE1      PHE  22 -11.355 -16.330  -5.282
  187    HE2  PHE  22           HE2      PHE  22  -7.724 -18.540  -5.615
  188    HZ   PHE  22           HZ       PHE  22 -10.108 -18.259  -6.169
  189    H    THR  23           HN       THR  23  -6.935 -12.638  -1.305
  190    HA   THR  23           HA       THR  23  -9.354 -11.396  -0.468
  191    HB   THR  23           HB       THR  23  -6.726 -10.968   0.908
  192    HG1  THR  23           HG1      THR  23  -6.982 -13.035   1.841
  193   HG21  THR  23          HG21      THR  23  -9.314 -10.405   1.634
  194   HG22  THR  23          HG22      THR  23  -7.928 -10.525   2.718
  195   HG23  THR  23          HG23      THR  23  -8.975 -11.921   2.466
  196    H    ASP  24           HN       ASP  24  -6.177 -10.173  -1.378
  197    HA   ASP  24           HA       ASP  24  -6.585  -7.492  -0.801
  198    HB2  ASP  24           HB2      ASP  24  -4.837  -8.279  -3.090
  199    HB3  ASP  24           HB1      ASP  24  -4.574  -7.064  -1.847
  200    H    VAL  25           HN       VAL  25  -7.018  -9.077  -4.027
  201    HA   VAL  25           HA       VAL  25  -7.701  -6.734  -5.365
  202    HB   VAL  25           HB       VAL  25  -7.300  -8.906  -6.498
  203   HG11  VAL  25          HG11      VAL  25 -10.145  -9.619  -5.840
  204   HG12  VAL  25          HG12      VAL  25  -8.781 -10.200  -4.886
  205   HG13  VAL  25          HG13      VAL  25  -8.906 -10.623  -6.593
  206   HG21  VAL  25          HG21      VAL  25  -8.426  -8.230  -8.330
  207   HG22  VAL  25          HG22      VAL  25  -8.820  -6.838  -7.321
  208   HG23  VAL  25          HG23      VAL  25  -9.973  -8.162  -7.487
  209    H    VAL  26           HN       VAL  26  -9.852  -9.049  -3.719
  210    HA   VAL  26           HA       VAL  26 -12.201  -7.514  -4.183
  211    HB   VAL  26           HB       VAL  26 -11.831  -9.562  -2.011
  212   HG11  VAL  26          HG11      VAL  26 -13.888  -8.208  -1.950
  213   HG12  VAL  26          HG12      VAL  26 -14.211  -9.913  -2.258
  214   HG13  VAL  26          HG13      VAL  26 -14.272  -8.752  -3.583
  215   HG21  VAL  26          HG21      VAL  26 -12.701 -11.196  -3.707
  216   HG22  VAL  26          HG22      VAL  26 -11.058 -10.623  -3.999
  217   HG23  VAL  26          HG23      VAL  26 -12.400  -9.972  -4.940
  218    H    THR  27           HN       THR  27 -10.208  -8.028  -1.283
  219    HA   THR  27           HA       THR  27 -11.700  -6.312   0.372
  220    HB   THR  27           HB       THR  27 -10.025  -8.150   1.024
  221    HG1  THR  27           HG1      THR  27 -11.115  -6.628   2.456
  222   HG21  THR  27          HG21      THR  27  -7.989  -6.132   1.546
  223   HG22  THR  27          HG22      THR  27  -8.151  -6.562  -0.156
  224   HG23  THR  27          HG23      THR  27  -7.826  -7.814   1.042
  225    H    THR  28           HN       THR  28  -8.959  -5.662  -1.757
  226    HA   THR  28           HA       THR  28  -8.377  -3.106  -0.671
  227    HB   THR  28           HB       THR  28  -6.876  -4.452  -2.224
  228    HG1  THR  28           HG1      THR  28  -5.888  -2.628  -2.312
  229   HG21  THR  28          HG21      THR  28  -8.480  -3.134  -4.399
  230   HG22  THR  28          HG22      THR  28  -8.544  -4.852  -4.014
  231   HG23  THR  28          HG23      THR  28  -7.039  -4.133  -4.584
  232    H    ASN  29           HN       ASN  29 -10.310  -4.129  -3.462
  233    HA   ASN  29           HA       ASN  29 -11.269  -1.512  -4.043
  234    HB2  ASN  29           HB2      ASN  29 -12.223  -4.263  -4.853
  235    HB3  ASN  29           HB1      ASN  29 -12.985  -2.779  -5.416
  236   HD21  ASN  29          1HE2      ASN  29 -11.648  -1.271  -6.609
  237   HD22  ASN  29          2HE2      ASN  29 -10.358  -1.878  -7.584
  238    H    LEU  30           HN       LEU  30 -12.319  -4.168  -2.025
  239    HA   LEU  30           HA       LEU  30 -14.949  -3.184  -1.537
  240    HB2  LEU  30           HB2      LEU  30 -14.257  -5.548  -1.218
  241    HB3  LEU  30           HB1      LEU  30 -13.299  -5.053   0.163
  242    HG   LEU  30           HG       LEU  30 -15.542  -6.084   0.684
  243   HD11  LEU  30          HD11      LEU  30 -15.603  -3.351   1.812
  244   HD12  LEU  30          HD12      LEU  30 -14.125  -4.285   2.046
  245   HD13  LEU  30          HD13      LEU  30 -15.668  -4.917   2.620
  246   HD21  LEU  30          HD21      LEU  30 -16.540  -4.524  -1.241
  247   HD22  LEU  30          HD22      LEU  30 -16.838  -3.481   0.149
  248   HD23  LEU  30          HD23      LEU  30 -17.506  -5.113   0.113
  249    H    LYS  31           HN       LYS  31 -11.958  -3.103   0.364
  250    HA   LYS  31           HA       LYS  31 -13.143  -1.402   2.359
  251    HB2  LYS  31           HB2      LYS  31 -11.418  -3.141   2.866
  252    HB3  LYS  31           HB1      LYS  31 -10.238  -2.154   2.014
  253    HG2  LYS  31           HG2      LYS  31 -10.719  -0.314   3.622
  254    HG3  LYS  31           HG1      LYS  31 -11.733  -1.440   4.525
  255    HD2  LYS  31           HD2      LYS  31  -9.924  -2.149   5.606
  256    HD3  LYS  31           HD1      LYS  31  -9.276  -2.749   4.078
  257    HE2  LYS  31           HE2      LYS  31  -7.664  -1.280   5.095
  258    HE3  LYS  31           HE1      LYS  31  -8.319  -0.507   3.652
  259    HZ1  LYS  31           HZ1      LYS  31  -8.655   0.214   6.462
  260    HZ2  LYS  31           HZ2      LYS  31  -9.973   0.478   5.435
  261    HZ3  LYS  31           HZ3      LYS  31  -8.483   1.208   5.103
  262    H    LEU  32           HN       LEU  32 -13.628   0.096   0.329
  263    HA   LEU  32           HA       LEU  32 -11.378   1.886  -0.189
  264    HB2  LEU  32           HB2      LEU  32 -13.489   1.043  -1.750
  265    HB3  LEU  32           HB1      LEU  32 -14.005   2.642  -1.257
  266    HG   LEU  32           HG       LEU  32 -11.634   1.870  -2.936
  267   HD11  LEU  32          HD11      LEU  32 -12.704   4.029  -4.078
  268   HD12  LEU  32          HD12      LEU  32 -14.133   3.421  -3.240
  269   HD13  LEU  32          HD13      LEU  32 -13.281   2.392  -4.393
  270   HD21  LEU  32          HD21      LEU  32 -10.414   3.364  -1.772
  271   HD22  LEU  32          HD22      LEU  32 -11.833   4.108  -1.034
  272   HD23  LEU  32          HD23      LEU  32 -11.354   4.553  -2.672
  273    H    GLY  33           HN       GLY  33 -11.796   2.013   2.388
  274    HA2  GLY  33           HA2      GLY  33 -12.034   3.682   3.994
  275    HA3  GLY  33           HA1      GLY  33 -12.826   4.691   2.790
  276    H    ASN  34           HN       ASN  34 -13.287   2.940   5.588
  277    HA   ASN  34           HA       ASN  34 -16.142   3.308   5.468
  278    HB2  ASN  34           HB2      ASN  34 -15.003   0.761   4.832
  279    HB3  ASN  34           HB1      ASN  34 -15.836   0.625   6.377
  280   HD21  ASN  34          1HE2      ASN  34 -16.505  -0.536   3.799
  281   HD22  ASN  34          2HE2      ASN  34 -18.095   0.022   3.415
  282    HA   PRO  35           HA       PRO  35 -16.288   3.684   9.885
  283    HB2  PRO  35           HB2      PRO  35 -17.081   0.805  10.154
  284    HB3  PRO  35           HB1      PRO  35 -17.742   2.231  10.964
  285    HG2  PRO  35           HG2      PRO  35 -19.023   1.148   8.905
  286    HG3  PRO  35           HG1      PRO  35 -18.934   2.909   9.089
  287    HD2  PRO  35           HD2      PRO  35 -17.520   1.132   7.178
  288    HD3  PRO  35           HD1      PRO  35 -18.011   2.827   6.992
  289    H    THR  36           HN       THR  36 -14.704   0.806   8.635
  290    HA   THR  36           HA       THR  36 -12.716  -0.174   9.139
  291    HB   THR  36           HB       THR  36 -11.895   1.795  11.178
  292    HG1  THR  36           HG1      THR  36 -12.399   2.584   8.501
  293   HG21  THR  36          HG21      THR  36 -10.221   1.865   8.935
  294   HG22  THR  36          HG22      THR  36 -10.667   0.175   9.172
  295   HG23  THR  36          HG23      THR  36  -9.924   1.085  10.487
  296    H    ASP  37           HN       ASP  37 -11.276  -0.381  11.496
  297    HA   ASP  37           HA       ASP  37 -12.475  -2.418  12.853
  298    HB2  ASP  37           HB2      ASP  37 -10.069  -1.222  13.028
  299    HB3  ASP  37           HB1      ASP  37 -10.793  -0.640  14.524
  300    H    ARG  38           HN       ARG  38 -13.002   1.003  13.320
  301    HA   ARG  38           HA       ARG  38 -15.235   0.392  15.070
  302    HB2  ARG  38           HB2      ARG  38 -12.727   1.419  16.070
  303    HB3  ARG  38           HB1      ARG  38 -14.023   2.571  16.360
  304    HG2  ARG  38           HG2      ARG  38 -15.219   0.285  17.149
  305    HG3  ARG  38           HG1      ARG  38 -13.537  -0.072  17.546
  306    HD2  ARG  38           HD2      ARG  38 -14.964   2.445  18.385
  307    HD3  ARG  38           HD1      ARG  38 -14.855   0.999  19.388
  308    HE   ARG  38           HE       ARG  38 -12.308   1.973  18.473
  309   HH11  ARG  38          HH11      ARG  38 -14.753   2.237  20.948
  310   HH12  ARG  38          HH12      ARG  38 -13.658   2.850  22.141
  311   HH21  ARG  38          HH21      ARG  38 -10.865   2.780  20.039
  312   HH22  ARG  38          HH22      ARG  38 -11.450   3.159  21.626
  313    H    ASN  39           HN       ASN  39 -13.546   3.484  14.671
  314    HA   ASN  39           HA       ASN  39 -15.854   4.446  13.111
  315    HB2  ASN  39           HB2      ASN  39 -14.342   5.813  15.336
  316    HB3  ASN  39           HB1      ASN  39 -15.382   6.691  14.218
  317   HD21  ASN  39          1HE2      ASN  39 -17.616   6.280  14.235
  318   HD22  ASN  39          2HE2      ASN  39 -18.388   5.576  15.611
  319    H    VAL  40           HN       VAL  40 -15.126   6.831  12.279
  320    HA   VAL  40           HA       VAL  40 -12.446   6.629  11.105
  321    HB   VAL  40           HB       VAL  40 -14.867   7.332   9.449
  322   HG11  VAL  40          HG11      VAL  40 -12.220   7.892   9.029
  323   HG12  VAL  40          HG12      VAL  40 -13.454   7.785   7.774
  324   HG13  VAL  40          HG13      VAL  40 -12.438   6.389   8.131
  325   HG21  VAL  40          HG21      VAL  40 -14.857   5.160   8.515
  326   HG22  VAL  40          HG22      VAL  40 -14.821   4.938  10.264
  327   HG23  VAL  40          HG23      VAL  40 -13.345   4.741   9.320
  328    H    CYS  41           HN       CYS  41 -11.438   8.569  10.732
  329    HA   CYS  41           HA       CYS  41 -12.658  11.068  10.507
  330    HB2  CYS  41           HB2      CYS  41 -11.976  11.972  12.801
  331    HB3  CYS  41           HB1      CYS  41 -13.421  10.969  12.739
  332    HG   CYS  41           HG       CYS  41 -12.211   9.120  13.968
  333    H    PHE  42           HN       PHE  42 -10.549   9.757   9.271
  334    HA   PHE  42           HA       PHE  42  -8.431  10.102   8.508
  335    HB2  PHE  42           HB2      PHE  42  -9.406  12.506   8.558
  336    HB3  PHE  42           HB1      PHE  42  -8.381  12.729   9.972
  337    HD1  PHE  42           HD2      PHE  42  -8.250  11.649   6.415
  338    HD2  PHE  42           HD1      PHE  42  -6.177  13.377   9.706
  339    HE1  PHE  42           HE2      PHE  42  -6.343  12.154   4.944
  340    HE2  PHE  42           HE1      PHE  42  -4.268  13.886   8.241
  341    HZ   PHE  42           HZ       PHE  42  -4.349  13.274   5.857
  342    H    LYS  43           HN       LYS  43  -8.113   8.368  10.258
  343    HA   LYS  43           HA       LYS  43  -6.908   9.046  12.707
  344    HB2  LYS  43           HB2      LYS  43  -5.990   6.594  12.489
  345    HB3  LYS  43           HB1      LYS  43  -7.698   6.895  12.746
  346    HG2  LYS  43           HG2      LYS  43  -6.905   6.767   9.928
  347    HG3  LYS  43           HG1      LYS  43  -6.683   5.270  10.836
  348    HD2  LYS  43           HD2      LYS  43  -8.992   5.261  11.495
  349    HD3  LYS  43           HD1      LYS  43  -9.247   6.854  10.778
  350    HE2  LYS  43           HE2      LYS  43  -8.453   5.720   8.588
  351    HE3  LYS  43           HE1      LYS  43  -8.820   4.215   9.429
  352    HZ1  LYS  43           HZ1      LYS  43 -10.904   6.212   9.570
  353    HZ2  LYS  43           HZ2      LYS  43 -11.010   4.556   9.244
  354    HZ3  LYS  43           HZ3      LYS  43 -10.596   5.634   8.009
  355    H    VAL  44           HN       VAL  44  -5.076   7.241  10.201
  356    HA   VAL  44           HA       VAL  44  -2.779   7.254   9.899
  357    HB   VAL  44           HB       VAL  44  -2.068   9.416   8.805
  358   HG11  VAL  44          HG11      VAL  44  -2.746   8.245   7.041
  359   HG12  VAL  44          HG12      VAL  44  -4.310   9.046   7.184
  360   HG13  VAL  44          HG13      VAL  44  -4.042   7.490   7.968
  361   HG21  VAL  44          HG21      VAL  44  -3.860  11.037   8.297
  362   HG22  VAL  44          HG22      VAL  44  -3.482  10.962  10.017
  363   HG23  VAL  44          HG23      VAL  44  -4.929  10.168   9.398
  364    H    LYS  45           HN       LYS  45  -1.849   6.984  11.975
  365    HA   LYS  45           HA       LYS  45  -0.524   9.389  12.951
  366    HB2  LYS  45           HB2      LYS  45  -2.666   8.009  14.365
  367    HB3  LYS  45           HB1      LYS  45  -1.202   8.153  15.326
  368    HG2  LYS  45           HG2      LYS  45  -2.410  10.506  13.912
  369    HG3  LYS  45           HG1      LYS  45  -2.922  10.012  15.527
  370    HD2  LYS  45           HD2      LYS  45  -0.148  10.039  15.665
  371    HD3  LYS  45           HD1      LYS  45  -0.549  11.455  14.691
  372    HE2  LYS  45           HE2      LYS  45  -2.135  12.170  16.443
  373    HE3  LYS  45           HE1      LYS  45  -1.641  10.789  17.423
  374    HZ1  LYS  45           HZ1      LYS  45   0.718  11.915  16.893
  375    HZ2  LYS  45           HZ2      LYS  45  -0.200  12.271  18.269
  376    HZ3  LYS  45           HZ3      LYS  45  -0.266  13.291  16.921
  377    H    THR  46           HN       THR  46   1.525   9.034  13.348
  378    HA   THR  46           HA       THR  46   3.518   7.910  13.369
  379    HB   THR  46           HB       THR  46   3.616   6.331  15.416
  380    HG1  THR  46           HG1      THR  46   1.856   6.097  16.557
  381   HG21  THR  46          HG21      THR  46   4.495   8.293  16.061
  382   HG22  THR  46          HG22      THR  46   2.968   8.446  16.931
  383   HG23  THR  46          HG23      THR  46   3.177   9.237  15.368
  384    H    THR  47           HN       THR  47   2.181   4.995  14.703
  385    HA   THR  47           HA       THR  47   1.490   3.463  12.558
  386    HB   THR  47           HB       THR  47   3.966   2.287  12.473
  387    HG1  THR  47           HG1      THR  47   4.929   4.045  13.538
  388   HG21  THR  47          HG21      THR  47   3.658   2.535  10.304
  389   HG22  THR  47          HG22      THR  47   3.878   4.282  10.426
  390   HG23  THR  47          HG23      THR  47   2.279   3.575  10.657
  391    H    ALA  48           HN       ALA  48   3.976   3.207  15.102
  392    HA   ALA  48           HA       ALA  48   3.889   2.059  17.100
  393    HB1  ALA  48           HB1      ALA  48   1.986   1.134  17.884
  394    HB2  ALA  48           HB2      ALA  48   1.658   0.269  16.382
  395    HB3  ALA  48           HB3      ALA  48   1.264   1.983  16.519
  396    HA   PRO  49           HA       PRO  49   6.253  -1.584  16.470
  397    HB2  PRO  49           HB2      PRO  49   4.149  -3.172  17.884
  398    HB3  PRO  49           HB1      PRO  49   5.900  -3.158  18.127
  399    HG2  PRO  49           HG2      PRO  49   4.292  -1.870  19.809
  400    HG3  PRO  49           HG1      PRO  49   5.851  -1.175  19.329
  401    HD2  PRO  49           HD2      PRO  49   3.100  -0.410  18.498
  402    HD3  PRO  49           HD1      PRO  49   4.550   0.598  18.672
  403    H    ARG  50           HN       ARG  50   6.483  -2.868  14.751
  404    HA   ARG  50           HA       ARG  50   4.142  -4.222  13.629
  405    HB2  ARG  50           HB2      ARG  50   4.807  -3.542  11.342
  406    HB3  ARG  50           HB1      ARG  50   4.321  -2.178  12.340
  407    HG2  ARG  50           HG2      ARG  50   6.191  -1.309  11.384
  408    HG3  ARG  50           HG1      ARG  50   6.912  -2.045  12.817
  409    HD2  ARG  50           HD2      ARG  50   8.011  -3.600  11.619
  410    HD3  ARG  50           HD1      ARG  50   6.669  -3.832  10.500
  411    HE   ARG  50           HE       ARG  50   8.933  -2.112  10.149
  412   HH11  ARG  50          HH11      ARG  50   5.584  -2.596   9.299
  413   HH12  ARG  50          HH12      ARG  50   5.697  -1.694   7.826
  414   HH21  ARG  50          HH21      ARG  50   9.084  -0.924   8.212
  415   HH22  ARG  50          HH22      ARG  50   7.684  -0.743   7.209
  416    H    ARG  51           HN       ARG  51   4.565  -6.195  12.737
  417    HA   ARG  51           HA       ARG  51   7.236  -7.255  13.201
  418    HB2  ARG  51           HB2      ARG  51   4.692  -8.301  13.529
  419    HB3  ARG  51           HB1      ARG  51   5.278  -9.109  12.082
  420    HG2  ARG  51           HG2      ARG  51   6.980  -8.979  14.534
  421    HG3  ARG  51           HG1      ARG  51   5.699 -10.182  14.390
  422    HD2  ARG  51           HD2      ARG  51   6.693 -11.035  12.350
  423    HD3  ARG  51           HD1      ARG  51   7.930  -9.781  12.401
  424    HE   ARG  51           HE       ARG  51   8.173 -11.102  14.784
  425   HH11  ARG  51          HH11      ARG  51   8.280 -12.026  11.420
  426   HH12  ARG  51          HH12      ARG  51   9.375 -13.340  11.687
  427   HH21  ARG  51          HH21      ARG  51   9.615 -12.830  15.136
  428   HH22  ARG  51          HH22      ARG  51  10.134 -13.797  13.795
  429    H    TYR  52           HN       TYR  52   4.913  -6.934  10.539
  430    HA   TYR  52           HA       TYR  52   6.927  -6.537   8.599
  431    HB2  TYR  52           HB2      TYR  52   6.446  -8.667   7.290
  432    HB3  TYR  52           HB1      TYR  52   7.442  -8.848   8.730
  433    HD1  TYR  52           HD2      TYR  52   4.023  -9.323   7.389
  434    HD2  TYR  52           HD1      TYR  52   6.757 -10.243  10.516
  435    HE1  TYR  52           HE2      TYR  52   2.467 -11.028   8.239
  436    HE2  TYR  52           HE1      TYR  52   5.210 -11.950  11.375
  437    HH   TYR  52           HH       TYR  52   2.533 -12.269  11.189
  438    H    CYS  53           HN       CYS  53   4.480  -5.357   9.449
  439    HA   CYS  53           HA       CYS  53   3.127  -4.045   7.866
  440    HB2  CYS  53           HB2      CYS  53   3.583  -5.455   5.887
  441    HB3  CYS  53           HB1      CYS  53   2.542  -6.713   6.530
  442    HG   CYS  53           HG       CYS  53   1.194  -5.294   4.719
  443    H    VAL  54           HN       VAL  54   1.987  -3.591   9.642
  444    HA   VAL  54           HA       VAL  54  -0.214  -5.431  10.329
  445    HB   VAL  54           HB       VAL  54  -0.150  -4.447  12.620
  446   HG11  VAL  54          HG11      VAL  54   1.405  -5.954  13.391
  447   HG12  VAL  54          HG12      VAL  54   2.551  -5.599  12.097
  448   HG13  VAL  54          HG13      VAL  54   1.116  -6.568  11.764
  449   HG21  VAL  54          HG21      VAL  54   1.828  -3.219  13.336
  450   HG22  VAL  54          HG22      VAL  54   0.991  -2.355  12.046
  451   HG23  VAL  54          HG23      VAL  54   2.463  -3.259  11.691
  452    H    ARG  55           HN       ARG  55  -2.128  -4.329  11.284
  453    HA   ARG  55           HA       ARG  55  -2.442  -1.532  10.537
  454    HB2  ARG  55           HB2      ARG  55  -4.541  -2.009   9.303
  455    HB3  ARG  55           HB1      ARG  55  -3.113  -2.666   8.513
  456    HG2  ARG  55           HG2      ARG  55  -3.849  -4.788   9.996
  457    HG3  ARG  55           HG1      ARG  55  -5.423  -4.043   9.709
  458    HD2  ARG  55           HD2      ARG  55  -4.276  -3.912   7.235
  459    HD3  ARG  55           HD1      ARG  55  -3.619  -5.425   7.857
  460    HE   ARG  55           HE       ARG  55  -6.343  -4.893   7.108
  461   HH11  ARG  55          HH11      ARG  55  -4.249  -6.901   9.048
  462   HH12  ARG  55          HH12      ARG  55  -5.368  -8.221   9.114
  463   HH21  ARG  55          HH21      ARG  55  -7.816  -6.628   7.192
  464   HH22  ARG  55          HH22      ARG  55  -7.392  -8.067   8.059
  465    H    SER  56           HN       SER  56  -3.327  -0.541  12.209
  466    HA   SER  56           HA       SER  56  -4.775  -0.033  13.903
  467    HB2  SER  56           HB2      SER  56  -6.201  -2.654  13.649
  468    HB3  SER  56           HB1      SER  56  -6.849  -1.064  14.056
  469    HG   SER  56           HG       SER  56  -5.809  -0.910  11.628
  470    H    ASN  57           HN       ASN  57  -2.408  -0.868  14.600
  471    HA   ASN  57           HA       ASN  57  -2.580  -3.102  16.438
  472    HB2  ASN  57           HB2      ASN  57  -0.424  -1.410  15.334
  473    HB3  ASN  57           HB1      ASN  57  -0.163  -1.993  16.975
  474   HD21  ASN  57          1HE2      ASN  57   1.645  -3.067  15.812
  475   HD22  ASN  57          2HE2      ASN  57   1.342  -4.626  15.131
  476    H    SER  58           HN       SER  58  -2.492   0.427  16.602
  477    HA   SER  58           HA       SER  58  -2.348   0.373  19.501
  478    HB2  SER  58           HB2      SER  58  -2.970   2.840  17.912
  479    HB3  SER  58           HB1      SER  58  -2.112   2.693  19.443
  480    HG   SER  58           HG       SER  58  -1.153   1.758  16.940
  481    H    GLY  59           HN       GLY  59  -4.866   0.941  17.038
  482    HA2  GLY  59           HA2      GLY  59  -6.977   0.081  18.540
  483    HA3  GLY  59           HA1      GLY  59  -6.805   1.769  18.990
  484    H    ILE  60           HN       ILE  60  -6.566   3.255  17.000
  485    HA   ILE  60           HA       ILE  60  -7.953   2.424  14.622
  486    HB   ILE  60           HB       ILE  60  -9.751   4.160  14.847
  487   HG12  ILE  60          HG12      ILE  60  -8.845   4.120  17.734
  488   HG13  ILE  60          HG11      ILE  60  -8.803   5.497  16.638
  489   HG21  ILE  60          HG21      ILE  60  -9.936   1.998  16.933
  490   HG22  ILE  60          HG22      ILE  60 -10.081   1.702  15.200
  491   HG23  ILE  60          HG23      ILE  60 -11.252   2.736  16.021
  492   HD11  ILE  60          HD11      ILE  60 -10.654   5.852  18.022
  493   HD12  ILE  60          HD12      ILE  60 -11.189   4.178  17.879
  494   HD13  ILE  60          HD13      ILE  60 -11.324   5.267  16.499
  495    H    ILE  61           HN       ILE  61  -6.860   5.151  16.612
  496    HA   ILE  61           HA       ILE  61  -6.526   6.995  14.498
  497    HB   ILE  61           HB       ILE  61  -5.773   6.761  17.335
  498   HG12  ILE  61          HG12      ILE  61  -7.701   8.066  16.520
  499   HG13  ILE  61          HG11      ILE  61  -6.555   9.074  17.399
  500   HG21  ILE  61          HG21      ILE  61  -4.141   8.627  17.245
  501   HG22  ILE  61          HG22      ILE  61  -4.104   8.459  15.490
  502   HG23  ILE  61          HG23      ILE  61  -3.552   7.132  16.516
  503   HD11  ILE  61          HD11      ILE  61  -7.517   9.316  14.705
  504   HD12  ILE  61          HD12      ILE  61  -5.757   9.214  14.734
  505   HD13  ILE  61          HD13      ILE  61  -6.585  10.456  15.673
  506    H    ASP  62           HN       ASP  62  -4.489   4.543  15.930
  507    HA   ASP  62           HA       ASP  62  -2.242   5.230  14.213
  508    HB2  ASP  62           HB2      ASP  62  -2.550   2.907  16.120
  509    HB3  ASP  62           HB1      ASP  62  -1.060   3.415  15.335
  510    H    ALA  63           HN       ALA  63  -5.040   3.316  14.116
  511    HA   ALA  63           HA       ALA  63  -4.185   1.126  12.577
  512    HB1  ALA  63           HB1      ALA  63  -6.317   1.151  13.733
  513    HB2  ALA  63           HB2      ALA  63  -6.554   0.838  12.014
  514    HB3  ALA  63           HB3      ALA  63  -6.895   2.436  12.674
  515    H    GLY  64           HN       GLY  64  -5.107   4.387  11.588
  516    HA2  GLY  64           HA2      GLY  64  -5.051   3.596   8.774
  517    HA3  GLY  64           HA1      GLY  64  -5.500   5.175   9.394
  518    H    ALA  65           HN       ALA  65  -2.713   4.295  10.932
  519    HA   ALA  65           HA       ALA  65  -1.157   6.251   9.627
  520    HB1  ALA  65           HB1      ALA  65   0.296   5.969  11.315
  521    HB2  ALA  65           HB2      ALA  65   0.274   4.210  11.186
  522    HB3  ALA  65           HB3      ALA  65  -1.031   5.049  12.022
  523    H    SER  66           HN       SER  66  -1.968   3.403   8.226
  524    HA   SER  66           HA       SER  66   0.409   3.471   6.558
  525    HB2  SER  66           HB2      SER  66  -0.285   1.177   8.339
  526    HB3  SER  66           HB1      SER  66   0.418   0.838   6.759
  527    HG   SER  66           HG       SER  66   1.560   2.657   8.605
  528    H    ILE  67           HN       ILE  67  -2.280   4.180   5.984
  529    HA   ILE  67           HA       ILE  67  -3.435   1.993   4.467
  530    HB   ILE  67           HB       ILE  67  -4.345   4.862   4.528
  531   HG12  ILE  67          HG12      ILE  67  -4.229   3.903   6.808
  532   HG13  ILE  67          HG11      ILE  67  -5.884   4.220   6.301
  533   HG21  ILE  67          HG21      ILE  67  -6.570   3.662   4.058
  534   HG22  ILE  67          HG22      ILE  67  -5.563   2.289   3.602
  535   HG23  ILE  67          HG23      ILE  67  -5.409   3.819   2.740
  536   HD11  ILE  67          HD11      ILE  67  -4.799   1.506   5.824
  537   HD12  ILE  67          HD12      ILE  67  -6.432   2.020   6.247
  538   HD13  ILE  67          HD13      ILE  67  -5.176   1.969   7.484
  539    H    ASN  68           HN       ASN  68  -1.185   4.478   3.871
  540    HA   ASN  68           HA       ASN  68   0.021   4.960   1.988
  541    HB2  ASN  68           HB2      ASN  68  -0.650   2.558   1.252
  542    HB3  ASN  68           HB1      ASN  68  -1.855   3.365   0.251
  543   HD21  ASN  68          1HE2      ASN  68  -0.608   2.337  -1.539
  544   HD22  ASN  68          2HE2      ASN  68   0.785   3.165  -2.139
  545    H    VAL  69           HN       VAL  69  -3.429   4.700   1.071
  546    HA   VAL  69           HA       VAL  69  -3.262   7.211  -0.353
  547    HB   VAL  69           HB       VAL  69  -5.596   6.816  -0.977
  548   HG11  VAL  69          HG11      VAL  69  -3.844   5.841  -2.339
  549   HG12  VAL  69          HG12      VAL  69  -5.237   4.761  -2.282
  550   HG13  VAL  69          HG13      VAL  69  -3.809   4.410  -1.310
  551   HG21  VAL  69          HG21      VAL  69  -5.372   4.354   0.755
  552   HG22  VAL  69          HG22      VAL  69  -6.710   4.723  -0.331
  553   HG23  VAL  69          HG23      VAL  69  -6.395   5.758   1.060
  554    H    SER  70           HN       SER  70  -4.199   6.185   2.805
  555    HA   SER  70           HA       SER  70  -6.122   8.168   3.379
  556    HB2  SER  70           HB2      SER  70  -5.819   6.186   4.798
  557    HB3  SER  70           HB1      SER  70  -4.223   6.765   5.273
  558    HG   SER  70           HG       SER  70  -5.844   7.291   6.812
  559    H    VAL  71           HN       VAL  71  -2.615   8.077   3.883
  560    HA   VAL  71           HA       VAL  71  -2.393  10.595   5.118
  561    HB   VAL  71           HB       VAL  71  -0.592   8.954   5.216
  562   HG11  VAL  71          HG11      VAL  71   0.558   8.121   3.427
  563   HG12  VAL  71          HG12      VAL  71   0.274   9.552   2.436
  564   HG13  VAL  71          HG13      VAL  71  -1.018   8.378   2.678
  565   HG21  VAL  71          HG21      VAL  71   0.871  11.028   3.779
  566   HG22  VAL  71          HG22      VAL  71   0.946  10.554   5.476
  567   HG23  VAL  71          HG23      VAL  71  -0.305  11.668   4.926
  568    H    MET  72           HN       MET  72  -3.694  12.046   3.945
  569    HA   MET  72           HA       MET  72  -3.055  12.598   1.171
  570    HB2  MET  72           HB2      MET  72  -5.397  12.665   2.313
  571    HB3  MET  72           HB1      MET  72  -4.903  14.266   2.844
  572    HG2  MET  72           HG2      MET  72  -4.317  14.483   0.249
  573    HG3  MET  72           HG1      MET  72  -5.613  13.291   0.151
  574    HE1  MET  72           HE1      MET  72  -7.427  16.556  -0.897
  575    HE2  MET  72           HE2      MET  72  -7.591  14.808  -1.063
  576    HE3  MET  72           HE3      MET  72  -6.051  15.587  -1.429
  577    H    LEU  73           HN       LEU  73  -2.767  14.203   4.315
  578    HA   LEU  73           HA       LEU  73  -1.725  16.638   3.349
  579    HB2  LEU  73           HB2      LEU  73  -2.533  15.735   5.776
  580    HB3  LEU  73           HB1      LEU  73  -0.793  15.721   5.994
  581    HG   LEU  73           HG       LEU  73  -1.874  17.814   6.771
  582   HD11  LEU  73          HD11      LEU  73  -0.070  19.050   6.214
  583   HD12  LEU  73          HD12      LEU  73  -0.228  18.707   4.491
  584   HD13  LEU  73          HD13      LEU  73   0.502  17.513   5.565
  585   HD21  LEU  73          HD21      LEU  73  -3.146  19.145   5.463
  586   HD22  LEU  73          HD22      LEU  73  -3.435  17.640   4.590
  587   HD23  LEU  73          HD23      LEU  73  -2.222  18.779   4.006
  588    H    GLN  74           HN       GLN  74   0.092  14.172   5.173
  589    HA   GLN  74           HA       GLN  74   2.179  13.999   3.242
  590    HB2  GLN  74           HB2      GLN  74   2.366  16.055   5.298
  591    HB3  GLN  74           HB1      GLN  74   3.720  14.935   5.358
  592    HG2  GLN  74           HG2      GLN  74   4.243  15.383   3.046
  593    HG3  GLN  74           HG1      GLN  74   2.826  16.422   2.900
  594   HE21  GLN  74          1HE2      GLN  74   3.938  18.257   2.374
  595   HE22  GLN  74          2HE2      GLN  74   4.974  19.089   3.478
  596    HA   PRO  75           HA       PRO  75   2.896  10.204   5.358
  597    HB2  PRO  75           HB2      PRO  75   5.625   9.959   5.101
  598    HB3  PRO  75           HB1      PRO  75   4.468   9.579   3.823
  599    HG2  PRO  75           HG2      PRO  75   6.094  12.055   4.232
  600    HG3  PRO  75           HG1      PRO  75   5.736  11.184   2.728
  601    HD2  PRO  75           HD2      PRO  75   4.436  13.437   3.394
  602    HD3  PRO  75           HD1      PRO  75   3.616  12.105   2.553
  603    H    PHE  76           HN       PHE  76   4.028   9.241   7.224
  604    HA   PHE  76           HA       PHE  76   5.285  11.193   9.009
  605    HB2  PHE  76           HB2      PHE  76   2.659  10.638   9.331
  606    HB3  PHE  76           HB1      PHE  76   3.362   9.358  10.310
  607    HD1  PHE  76           HD1      PHE  76   3.327  13.031   9.828
  608    HD2  PHE  76           HD2      PHE  76   4.146   9.791  12.463
  609    HE1  PHE  76           HE1      PHE  76   3.626  14.620  11.684
  610    HE2  PHE  76           HE2      PHE  76   4.447  11.373  14.322
  611    HZ   PHE  76           HZ       PHE  76   4.186  13.791  13.934
  612    H    ASP  77           HN       ASP  77   4.101   7.855   9.407
  613    HA   ASP  77           HA       ASP  77   5.143   5.982  10.183
  614    HB2  ASP  77           HB2      ASP  77   6.241   6.606   7.815
  615    HB3  ASP  77           HB1      ASP  77   7.683   6.700   8.822
  616    H    TYR  78           HN       TYR  78   5.492   8.508  11.715
  617    HA   TYR  78           HA       TYR  78   6.461   9.088  13.691
  618    HB2  TYR  78           HB2      TYR  78   6.934   6.339  13.551
  619    HB3  TYR  78           HB1      TYR  78   8.505   7.042  13.914
  620    HD1  TYR  78           HD1      TYR  78   7.940   9.257  15.655
  621    HD2  TYR  78           HD2      TYR  78   6.058   5.446  15.493
  622    HE1  TYR  78           HE1      TYR  78   7.306   9.477  18.020
  623    HE2  TYR  78           HE2      TYR  78   5.416   5.656  17.857
  624    HH   TYR  78           HH       TYR  78   6.602   7.233  19.953
  625    H    ASP  79           HN       ASP  79   9.000   7.602  11.677
  626    HA   ASP  79           HA       ASP  79  10.625   8.773  10.456
  627    HB2  ASP  79           HB2      ASP  79   9.524  10.988  11.424
  628    HB3  ASP  79           HB1      ASP  79  10.930  10.938  12.482
  629    HA   PRO  80           HA       PRO  80  13.783   8.533  14.131
  630    HB2  PRO  80           HB2      PRO  80  12.105   7.806  16.443
  631    HB3  PRO  80           HB1      PRO  80  13.396   9.005  16.326
  632    HG2  PRO  80           HG2      PRO  80  10.813   9.713  16.533
  633    HG3  PRO  80           HG1      PRO  80  11.975  10.657  15.582
  634    HD2  PRO  80           HD2      PRO  80   9.894   8.718  14.653
  635    HD3  PRO  80           HD1      PRO  80  10.394  10.266  13.949
  636    H    ASN  81           HN       ASN  81  13.810   6.670  12.642
  637    HA   ASN  81           HA       ASN  81  13.798   4.195  14.123
  638    HB2  ASN  81           HB2      ASN  81  12.174   4.069  11.613
  639    HB3  ASN  81           HB1      ASN  81  12.161   2.997  13.006
  640   HD21  ASN  81          1HE2      ASN  81  10.790   5.734  11.518
  641   HD22  ASN  81          2HE2      ASN  81   9.624   6.098  12.737
  642    H    GLU  82           HN       GLU  82  16.052   4.302  13.561
  643    HA   GLU  82           HA       GLU  82  16.867   4.399  10.823
  644    HB2  GLU  82           HB2      GLU  82  18.322   5.211  12.642
  645    HB3  GLU  82           HB1      GLU  82  18.438   3.576  13.278
  646    HG2  GLU  82           HG2      GLU  82  20.244   3.310  12.030
  647    HG3  GLU  82           HG1      GLU  82  19.193   3.347  10.615
  648    H    LYS  83           HN       LYS  83  16.651   1.806  13.261
  649    HA   LYS  83           HA       LYS  83  17.583  -0.262  11.581
  650    HB2  LYS  83           HB2      LYS  83  17.412  -0.613  13.980
  651    HB3  LYS  83           HB1      LYS  83  15.678  -0.330  13.937
  652    HG2  LYS  83           HG2      LYS  83  16.475  -2.476  12.157
  653    HG3  LYS  83           HG1      LYS  83  16.953  -2.776  13.829
  654    HD2  LYS  83           HD2      LYS  83  14.539  -2.076  14.411
  655    HD3  LYS  83           HD1      LYS  83  14.208  -2.346  12.700
  656    HE2  LYS  83           HE2      LYS  83  14.981  -4.640  12.888
  657    HE3  LYS  83           HE1      LYS  83  15.405  -4.378  14.580
  658    HZ1  LYS  83           HZ1      LYS  83  12.852  -3.661  14.609
  659    HZ2  LYS  83           HZ2      LYS  83  13.367  -5.245  14.899
  660    HZ3  LYS  83           HZ3      LYS  83  12.800  -4.808  13.366
  661    H    SER  84           HN       SER  84  14.398   1.017  12.312
  662    HA   SER  84           HA       SER  84  12.884  -0.678  10.639
  663    HB2  SER  84           HB2      SER  84  12.150   1.091  12.451
  664    HB3  SER  84           HB1      SER  84  12.048   2.156  11.050
  665    HG   SER  84           HG       SER  84  10.294   0.343  11.856
  666    H    LYS  85           HN       LYS  85  14.988   1.911   9.898
  667    HA   LYS  85           HA       LYS  85  15.384   3.138   7.992
  668    HB2  LYS  85           HB2      LYS  85  16.567   1.164   7.515
  669    HB3  LYS  85           HB1      LYS  85  15.114   0.300   7.042
  670    HG2  LYS  85           HG2      LYS  85  15.142   1.138   4.953
  671    HG3  LYS  85           HG1      LYS  85  15.724   2.718   5.480
  672    HD2  LYS  85           HD2      LYS  85  17.589   0.414   5.681
  673    HD3  LYS  85           HD1      LYS  85  17.241   1.055   4.074
  674    HE2  LYS  85           HE2      LYS  85  18.145   2.744   6.399
  675    HE3  LYS  85           HE1      LYS  85  19.242   2.059   5.199
  676    HZ1  LYS  85           HZ1      LYS  85  18.679   4.328   4.645
  677    HZ2  LYS  85           HZ2      LYS  85  17.028   3.963   4.652
  678    HZ3  LYS  85           HZ3      LYS  85  18.039   3.281   3.480
  679    H    HIS  86           HN       HIS  86  13.564   4.497   7.795
  680    HA   HIS  86           HA       HIS  86  11.286   3.587   6.182
  681    HB2  HIS  86           HB2      HIS  86  10.819   4.896   8.191
  682    HB3  HIS  86           HB1      HIS  86  11.785   6.229   7.567
  683    HD1  HIS  86           HD1      HIS  86  10.324   8.040   6.771
  684    HD2  HIS  86           HD2      HIS  86   8.670   4.303   6.026
  685    HE1  HIS  86           HE1      HIS  86   8.143   8.493   5.607
  686    HE2  HIS  86           HE2      HIS  86   7.103   6.220   5.276
  687    H    LYS  87           HN       LYS  87  10.500   4.805   4.278
  688    HA   LYS  87           HA       LYS  87  11.677   6.897   2.952
  689    HB2  LYS  87           HB2      LYS  87  13.097   5.554   1.236
  690    HB3  LYS  87           HB1      LYS  87  13.806   5.979   2.788
  691    HG2  LYS  87           HG2      LYS  87  12.707   3.538   3.319
  692    HG3  LYS  87           HG1      LYS  87  13.189   3.365   1.634
  693    HD2  LYS  87           HD2      LYS  87  15.181   4.643   3.380
  694    HD3  LYS  87           HD1      LYS  87  14.836   2.952   3.742
  695    HE2  LYS  87           HE2      LYS  87  15.312   3.756   0.912
  696    HE3  LYS  87           HE1      LYS  87  16.692   3.617   2.001
  697    HZ1  LYS  87           HZ1      LYS  87  15.393   1.340   2.509
  698    HZ2  LYS  87           HZ2      LYS  87  16.626   1.481   1.360
  699    HZ3  LYS  87           HZ3      LYS  87  15.008   1.548   0.874
  700    H    PHE  88           HN       PHE  88   9.456   7.078   2.131
  701    HA   PHE  88           HA       PHE  88   8.284   4.934   0.640
  702    HB2  PHE  88           HB2      PHE  88   7.339   7.192   1.893
  703    HB3  PHE  88           HB1      PHE  88   7.097   7.558   0.189
  704    HD1  PHE  88           HD2      PHE  88   6.813   4.416   2.180
  705    HD2  PHE  88           HD1      PHE  88   4.900   7.234  -0.371
  706    HE1  PHE  88           HE2      PHE  88   4.780   3.028   2.178
  707    HE2  PHE  88           HE1      PHE  88   2.864   5.853  -0.376
  708    HZ   PHE  88           HZ       PHE  88   2.803   3.746   0.899
  709    H    MET  89           HN       MET  89   9.434   8.199  -0.537
  710    HA   MET  89           HA       MET  89   9.078   7.346  -3.288
  711    HB2  MET  89           HB2      MET  89   9.648   9.889  -1.965
  712    HB3  MET  89           HB1      MET  89  10.759   9.641  -3.296
  713    HG2  MET  89           HG2      MET  89   8.626   9.215  -4.728
  714    HG3  MET  89           HG1      MET  89   7.753   9.951  -3.387
  715    HE1  MET  89           HE1      MET  89   7.817  12.236  -6.543
  716    HE2  MET  89           HE2      MET  89   7.355  13.186  -5.137
  717    HE3  MET  89           HE3      MET  89   6.758  11.539  -5.315
  718    H    VAL  90           HN       VAL  90  11.614   7.652  -0.963
  719    HA   VAL  90           HA       VAL  90  13.846   6.933  -2.618
  720    HB   VAL  90           HB       VAL  90  14.600   8.268  -0.967
  721   HG11  VAL  90          HG11      VAL  90  12.394   7.175   0.626
  722   HG12  VAL  90          HG12      VAL  90  12.989   8.828   0.482
  723   HG13  VAL  90          HG13      VAL  90  13.817   7.681   1.534
  724   HG21  VAL  90          HG21      VAL  90  15.901   6.162  -0.903
  725   HG22  VAL  90          HG22      VAL  90  14.910   5.636   0.457
  726   HG23  VAL  90          HG23      VAL  90  15.938   7.060   0.613
  727    H    GLN  91           HN       GLN  91  11.501   5.020  -1.150
  728    HA   GLN  91           HA       GLN  91  12.934   2.839  -0.217
  729    HB2  GLN  91           HB2      GLN  91  10.246   3.406  -0.694
  730    HB3  GLN  91           HB1      GLN  91  10.566   1.975  -1.657
  731    HG2  GLN  91           HG2      GLN  91  11.704   1.136   0.557
  732    HG3  GLN  91           HG1      GLN  91  10.632   2.325   1.291
  733   HE21  GLN  91          1HE2      GLN  91   9.931   0.170   2.246
  734   HE22  GLN  91          2HE2      GLN  91   8.639  -0.638   1.432
  735    H    SER  92           HN       SER  92  12.753   3.918  -3.444
  736    HA   SER  92           HA       SER  92  12.908   1.531  -4.876
  737    HB2  SER  92           HB2      SER  92  14.503   3.775  -5.930
  738    HB3  SER  92           HB1      SER  92  13.199   2.858  -6.685
  739    HG   SER  92           HG       SER  92  13.102   5.178  -5.176
  740    H    MET  93           HN       MET  93  15.284   2.863  -2.764
  741    HA   MET  93           HA       MET  93  17.581   1.805  -4.082
  742    HB2  MET  93           HB2      MET  93  17.445   3.727  -2.323
  743    HB3  MET  93           HB1      MET  93  17.442   2.425  -1.142
  744    HG2  MET  93           HG2      MET  93  19.585   1.685  -1.813
  745    HG3  MET  93           HG1      MET  93  19.563   2.708  -3.248
  746    HE1  MET  93           HE1      MET  93  22.373   3.499  -0.903
  747    HE2  MET  93           HE2      MET  93  22.141   4.633  -2.234
  748    HE3  MET  93           HE3      MET  93  21.841   2.913  -2.480
  749    H    PHE  94           HN       PHE  94  15.421   0.901  -1.474
  750    HA   PHE  94           HA       PHE  94  16.743  -1.464  -0.677
  751    HB2  PHE  94           HB2      PHE  94  15.076  -1.516   0.824
  752    HB3  PHE  94           HB1      PHE  94  14.379  -0.115   0.026
  753    HD1  PHE  94           HD1      PHE  94  14.451  -3.835  -0.240
  754    HD2  PHE  94           HD2      PHE  94  12.223  -0.247  -0.759
  755    HE1  PHE  94           HE1      PHE  94  12.457  -5.158  -0.810
  756    HE2  PHE  94           HE2      PHE  94  10.225  -1.566  -1.328
  757    HZ   PHE  94           HZ       PHE  94  10.342  -4.024  -1.353
  758    H    ALA  95           HN       ALA  95  14.976  -0.681  -3.482
  759    HA   ALA  95           HA       ALA  95  15.547  -3.186  -4.721
  760    HB1  ALA  95           HB1      ALA  95  12.844  -2.662  -3.662
  761    HB2  ALA  95           HB2      ALA  95  13.652  -4.192  -4.006
  762    HB3  ALA  95           HB3      ALA  95  12.920  -3.267  -5.318
  763    HA   PRO  96           HA       PRO  96  15.893   0.529  -7.459
  764    HB2  PRO  96           HB2      PRO  96  17.022  -1.230  -9.399
  765    HB3  PRO  96           HB1      PRO  96  17.859  -0.041  -8.401
  766    HG2  PRO  96           HG2      PRO  96  17.563  -2.959  -8.012
  767    HG3  PRO  96           HG1      PRO  96  18.853  -1.873  -7.466
  768    HD2  PRO  96           HD2      PRO  96  17.049  -2.894  -5.761
  769    HD3  PRO  96           HD1      PRO  96  17.687  -1.248  -5.562
  770    H    THR  97           HN       THR  97  14.521  -2.645  -8.037
  771    HA   THR  97           HA       THR  97  13.310  -2.036 -10.528
  772    HB   THR  97           HB       THR  97  11.933  -4.065 -10.081
  773    HG1  THR  97           HG1      THR  97  13.393  -4.229  -7.662
  774   HG21  THR  97          HG21      THR  97  13.661  -5.115 -10.970
  775   HG22  THR  97          HG22      THR  97  14.258  -5.393  -9.334
  776   HG23  THR  97          HG23      THR  97  14.799  -3.981 -10.241
  777    H    ASP  98           HN       ASP  98  12.457  -1.347  -7.255
  778    HA   ASP  98           HA       ASP  98   9.692  -1.127  -7.450
  779    HB2  ASP  98           HB2      ASP  98  11.763   0.093  -5.686
  780    HB3  ASP  98           HB1      ASP  98  10.138   0.770  -5.646
  781    H    THR  99           HN       THR  99  12.154   1.388  -7.986
  782    HA   THR  99           HA       THR  99  10.384   3.460  -8.610
  783    HB   THR  99           HB       THR  99  12.577   3.959 -10.215
  784    HG1  THR  99           HG1      THR  99  14.331   3.103  -9.271
  785   HG21  THR  99          HG21      THR  99  13.464   4.837  -7.794
  786   HG22  THR  99          HG22      THR  99  11.722   4.725  -7.536
  787   HG23  THR  99          HG23      THR  99  12.357   5.707  -8.856
  788    H    SER 100           HN       SER 100  11.931   1.047 -10.662
  789    HA   SER 100           HA       SER 100  10.764   1.962 -13.094
  790    HB2  SER 100           HB2      SER 100  11.444  -0.434 -13.848
  791    HB3  SER 100           HB1      SER 100  12.712   0.714 -13.418
  792    HG   SER 100           HG       SER 100  13.111  -0.370 -11.606
  793    H    ASP 101           HN       ASP 101   9.677  -0.033 -10.508
  794    HA   ASP 101           HA       ASP 101   7.851  -1.688 -11.775
  795    HB2  ASP 101           HB2      ASP 101   8.615  -1.456  -9.249
  796    HB3  ASP 101           HB1      ASP 101   7.125  -0.524  -9.127
  797    H    MET 102           HN       MET 102   7.349   1.629 -10.559
  798    HA   MET 102           HA       MET 102   4.604   1.775 -11.031
  799    HB2  MET 102           HB2      MET 102   6.807   3.768 -10.811
  800    HB3  MET 102           HB1      MET 102   5.273   4.320 -11.467
  801    HG2  MET 102           HG2      MET 102   4.274   4.294  -9.473
  802    HG3  MET 102           HG1      MET 102   4.998   2.751  -9.023
  803    HE1  MET 102           HE1      MET 102   4.897   5.849  -6.906
  804    HE2  MET 102           HE2      MET 102   4.612   6.211  -8.609
  805    HE3  MET 102           HE3      MET 102   6.016   6.891  -7.785
  806    H    GLU 103           HN       GLU 103   7.238   2.898 -13.153
  807    HA   GLU 103           HA       GLU 103   5.508   3.445 -15.345
  808    HB2  GLU 103           HB2      GLU 103   8.440   3.459 -14.874
  809    HB3  GLU 103           HB1      GLU 103   7.891   3.361 -16.541
  810    HG2  GLU 103           HG2      GLU 103   6.916   5.467 -14.638
  811    HG3  GLU 103           HG1      GLU 103   8.360   5.668 -15.630
  812    H    ALA 104           HN       ALA 104   7.952   0.934 -14.832
  813    HA   ALA 104           HA       ALA 104   7.657  -0.435 -17.205
  814    HB1  ALA 104           HB1      ALA 104   9.477  -0.671 -15.510
  815    HB2  ALA 104           HB2      ALA 104   8.913  -2.177 -16.232
  816    HB3  ALA 104           HB3      ALA 104   8.398  -1.732 -14.605
  817    H    VAL 105           HN       VAL 105   5.573  -0.704 -14.375
  818    HA   VAL 105           HA       VAL 105   4.586  -3.258 -14.844
  819    HB   VAL 105           HB       VAL 105   2.378  -2.331 -13.810
  820   HG11  VAL 105          HG11      VAL 105   3.183  -3.332 -12.007
  821   HG12  VAL 105          HG12      VAL 105   4.336  -2.030 -11.725
  822   HG13  VAL 105          HG13      VAL 105   4.761  -3.366 -12.793
  823   HG21  VAL 105          HG21      VAL 105   2.401  -0.066 -13.777
  824   HG22  VAL 105          HG22      VAL 105   4.160   0.028 -13.714
  825   HG23  VAL 105          HG23      VAL 105   3.249  -0.341 -12.257
  826    H    TRP 106           HN       TRP 106   3.576  -0.223 -16.381
  827    HA   TRP 106           HA       TRP 106   1.425  -1.556 -17.777
  828    HB2  TRP 106           HB2      TRP 106   2.504   1.261 -17.916
  829    HB3  TRP 106           HB1      TRP 106   1.164   0.683 -18.903
  830    HD1  TRP 106           HD1      TRP 106  -0.650  -0.788 -16.926
  831    HE1  TRP 106           HE1      TRP 106  -1.783   0.422 -14.958
  832    HE3  TRP 106           HE3      TRP 106   2.467   3.245 -16.552
  833    HZ2  TRP 106           HZ2      TRP 106  -1.405   2.776 -13.447
  834    HZ3  TRP 106           HZ3      TRP 106   2.012   4.931 -14.820
  835    HH2  TRP 106           HH2      TRP 106   0.115   4.701 -13.300
  836    H    LYS 107           HN       LYS 107   4.494  -0.006 -18.689
  837    HA   LYS 107           HA       LYS 107   4.247  -0.776 -21.433
  838    HB2  LYS 107           HB2      LYS 107   6.523   0.139 -21.661
  839    HB3  LYS 107           HB1      LYS 107   5.430   1.251 -20.849
  840    HG2  LYS 107           HG2      LYS 107   6.380   0.660 -18.700
  841    HG3  LYS 107           HG1      LYS 107   7.434  -0.526 -19.473
  842    HD2  LYS 107           HD2      LYS 107   7.469   2.395 -20.193
  843    HD3  LYS 107           HD1      LYS 107   8.479   1.717 -18.913
  844    HE2  LYS 107           HE2      LYS 107   8.470   0.776 -21.778
  845    HE3  LYS 107           HE1      LYS 107   9.638   1.909 -21.098
  846    HZ1  LYS 107           HZ1      LYS 107   9.255  -0.944 -20.401
  847    HZ2  LYS 107           HZ2      LYS 107  10.159   0.113 -19.437
  848    HZ3  LYS 107           HZ3      LYS 107  10.640  -0.201 -21.029
  849    H    GLU 108           HN       GLU 108   6.225  -1.934 -18.712
  850    HA   GLU 108           HA       GLU 108   7.495  -3.931 -20.344
  851    HB2  GLU 108           HB2      GLU 108   7.944  -2.777 -17.796
  852    HB3  GLU 108           HB1      GLU 108   7.791  -4.512 -17.564
  853    HG2  GLU 108           HG2      GLU 108   9.734  -3.052 -19.329
  854    HG3  GLU 108           HG1      GLU 108  10.087  -4.029 -17.904
  855    H    ALA 109           HN       ALA 109   4.436  -3.770 -19.158
  856    HA   ALA 109           HA       ALA 109   2.759  -5.288 -18.972
  857    HB1  ALA 109           HB1      ALA 109   4.773  -7.279 -20.003
  858    HB2  ALA 109           HB2      ALA 109   3.742  -6.255 -21.003
  859    HB3  ALA 109           HB3      ALA 109   3.022  -7.483 -19.961
  860    H    LYS 110           HN       LYS 110   2.113  -7.353 -17.828
  861    HA   LYS 110           HA       LYS 110   2.848  -7.208 -15.167
  862    HB2  LYS 110           HB2      LYS 110   1.173  -8.653 -14.818
  863    HB3  LYS 110           HB1      LYS 110   0.836  -8.377 -16.517
  864    HG2  LYS 110           HG2      LYS 110   1.127 -10.515 -16.943
  865    HG3  LYS 110           HG1      LYS 110   2.744 -10.484 -16.290
  866    HD2  LYS 110           HD2      LYS 110   2.120 -11.304 -14.283
  867    HD3  LYS 110           HD1      LYS 110   0.533 -10.533 -14.338
  868    HE2  LYS 110           HE2      LYS 110   0.130 -12.854 -14.511
  869    HE3  LYS 110           HE1      LYS 110  -0.072 -12.205 -16.136
  870    HZ1  LYS 110           HZ1      LYS 110   1.884 -14.073 -15.127
  871    HZ2  LYS 110           HZ2      LYS 110   2.535 -12.859 -16.109
  872    HZ3  LYS 110           HZ3      LYS 110   1.305 -13.856 -16.702
  873    HA   PRO 111           HA       PRO 111   5.449 -11.395 -16.101
  874    HB2  PRO 111           HB2      PRO 111   6.892  -9.988 -18.319
  875    HB3  PRO 111           HB1      PRO 111   6.614 -11.718 -18.083
  876    HG2  PRO 111           HG2      PRO 111   5.144 -10.347 -19.822
  877    HG3  PRO 111           HG1      PRO 111   4.409 -11.598 -18.802
  878    HD2  PRO 111           HD2      PRO 111   4.213  -8.641 -18.608
  879    HD3  PRO 111           HD1      PRO 111   3.027  -9.881 -18.161
  880    H    GLU 112           HN       GLU 112   6.382  -8.069 -16.656
  881    HA   GLU 112           HA       GLU 112   8.877  -8.264 -15.263
  882    HB2  GLU 112           HB2      GLU 112   7.749  -6.449 -17.029
  883    HB3  GLU 112           HB1      GLU 112   7.781  -5.574 -15.503
  884    HG2  GLU 112           HG2      GLU 112  10.267  -6.962 -15.960
  885    HG3  GLU 112           HG1      GLU 112   9.871  -5.898 -17.305
  886    H    ASP 113           HN       ASP 113   5.574  -7.396 -14.473
  887    HA   ASP 113           HA       ASP 113   6.088  -6.075 -12.033
  888    HB2  ASP 113           HB2      ASP 113   3.625  -7.643 -12.821
  889    HB3  ASP 113           HB1      ASP 113   3.725  -6.429 -11.547
  890    H    LEU 114           HN       LEU 114   5.187  -9.470 -12.661
  891    HA   LEU 114           HA       LEU 114   5.139 -10.345 -10.028
  892    HB2  LEU 114           HB2      LEU 114   5.693 -12.603 -10.975
  893    HB3  LEU 114           HB1      LEU 114   4.315 -11.800 -11.699
  894    HG   LEU 114           HG       LEU 114   5.967 -11.035 -13.523
  895   HD11  LEU 114          HD11      LEU 114   7.649 -13.212 -13.559
  896   HD12  LEU 114          HD12      LEU 114   7.664 -12.718 -11.865
  897   HD13  LEU 114          HD13      LEU 114   8.097 -11.562 -13.125
  898   HD21  LEU 114          HD21      LEU 114   5.869 -13.559 -14.415
  899   HD22  LEU 114          HD22      LEU 114   4.468 -12.490 -14.386
  900   HD23  LEU 114          HD23      LEU 114   4.703 -13.670 -13.096
  901    H    MET 115           HN       MET 115   7.863  -9.793 -12.157
  902    HA   MET 115           HA       MET 115   9.800 -11.117 -10.547
  903    HB2  MET 115           HB2      MET 115  10.016 -10.564 -13.002
  904    HB3  MET 115           HB1      MET 115  10.311  -8.899 -12.526
  905    HG2  MET 115           HG2      MET 115  12.384  -9.351 -11.699
  906    HG3  MET 115           HG1      MET 115  11.978 -11.015 -11.286
  907    HE1  MET 115           HE1      MET 115  13.935 -11.842 -11.831
  908    HE2  MET 115           HE2      MET 115  14.847 -11.725 -13.337
  909    HE3  MET 115           HE3      MET 115  13.602 -12.960 -13.155
  910    H    ASP 116           HN       ASP 116   8.828  -7.711 -10.880
  911    HA   ASP 116           HA       ASP 116  10.729  -6.755  -8.978
  912    HB2  ASP 116           HB2      ASP 116   8.189  -5.446  -9.979
  913    HB3  ASP 116           HB1      ASP 116   9.496  -4.638  -9.116
  914    H    SER 117           HN       SER 117   7.361  -7.723  -8.863
  915    HA   SER 117           HA       SER 117   6.776  -6.859  -6.244
  916    HB2  SER 117           HB2      SER 117   5.620  -9.197  -7.756
  917    HB3  SER 117           HB1      SER 117   4.874  -8.382  -6.382
  918    HG   SER 117           HG       SER 117   5.549  -7.003  -8.758
  919    H    LYS 118           HN       LYS 118   7.801 -10.017  -7.516
  920    HA   LYS 118           HA       LYS 118   7.879 -11.373  -5.063
  921    HB2  LYS 118           HB2      LYS 118   8.929 -11.807  -7.786
  922    HB3  LYS 118           HB1      LYS 118   9.839 -12.604  -6.510
  923    HG2  LYS 118           HG2      LYS 118   8.178 -14.062  -6.043
  924    HG3  LYS 118           HG1      LYS 118   6.903 -12.898  -6.411
  925    HD2  LYS 118           HD2      LYS 118   7.937 -13.221  -8.866
  926    HD3  LYS 118           HD1      LYS 118   8.311 -14.804  -8.181
  927    HE2  LYS 118           HE2      LYS 118   5.588 -13.820  -7.664
  928    HE3  LYS 118           HE1      LYS 118   5.955 -14.159  -9.355
  929    HZ1  LYS 118           HZ1      LYS 118   6.451 -16.385  -8.862
  930    HZ2  LYS 118           HZ2      LYS 118   5.032 -16.056  -8.003
  931    HZ3  LYS 118           HZ3      LYS 118   6.516 -16.104  -7.195
  932    H    LEU 119           HN       LEU 119  10.038  -9.169  -6.616
  933    HA   LEU 119           HA       LEU 119  12.349  -9.749  -5.038
  934    HB2  LEU 119           HB2      LEU 119  12.217  -8.530  -7.295
  935    HB3  LEU 119           HB1      LEU 119  11.786  -7.111  -6.362
  936    HG   LEU 119           HG       LEU 119  14.037  -7.894  -5.061
  937   HD11  LEU 119          HD11      LEU 119  15.668  -8.717  -6.498
  938   HD12  LEU 119          HD12      LEU 119  14.722  -8.349  -7.940
  939   HD13  LEU 119          HD13      LEU 119  14.247  -9.685  -6.892
  940   HD21  LEU 119          HD21      LEU 119  14.929  -5.945  -5.840
  941   HD22  LEU 119          HD22      LEU 119  13.241  -5.689  -6.284
  942   HD23  LEU 119          HD23      LEU 119  14.399  -6.234  -7.497
  943    H    ARG 120           HN       ARG 120   9.928  -7.143  -4.904
  944    HA   ARG 120           HA       ARG 120  10.995  -5.971  -2.543
  945    HB2  ARG 120           HB2      ARG 120   8.886  -4.681  -2.501
  946    HB3  ARG 120           HB1      ARG 120   9.662  -4.649  -4.078
  947    HG2  ARG 120           HG2      ARG 120   8.105  -6.438  -4.817
  948    HG3  ARG 120           HG1      ARG 120   7.276  -6.292  -3.266
  949    HD2  ARG 120           HD2      ARG 120   7.641  -4.056  -5.256
  950    HD3  ARG 120           HD1      ARG 120   6.174  -5.017  -5.073
  951    HE   ARG 120           HE       ARG 120   7.020  -3.779  -2.630
  952   HH11  ARG 120          HH11      ARG 120   5.247  -3.289  -5.595
  953   HH12  ARG 120          HH12      ARG 120   4.253  -2.032  -4.940
  954   HH21  ARG 120          HH21      ARG 120   5.713  -2.127  -1.766
  955   HH22  ARG 120          HH22      ARG 120   4.519  -1.370  -2.766
  956    H    CYS 121           HN       CYS 121   8.572  -8.413  -3.179
  957    HA   CYS 121           HA       CYS 121   7.374  -8.475  -0.632
  958    HB2  CYS 121           HB2      CYS 121   7.566 -10.434  -2.896
  959    HB3  CYS 121           HB1      CYS 121   6.840 -10.916  -1.367
  960    HG   CYS 121           HG       CYS 121   5.676  -8.565  -3.044
  961    H    VAL 122           HN       VAL 122  10.275  -9.984  -1.904
  962    HA   VAL 122           HA       VAL 122  10.677 -11.909   0.095
  963    HB   VAL 122           HB       VAL 122  12.742 -10.416  -1.532
  964   HG11  VAL 122          HG11      VAL 122  13.920 -12.760  -0.990
  965   HG12  VAL 122          HG12      VAL 122  12.971 -12.568   0.485
  966   HG13  VAL 122          HG13      VAL 122  14.130 -11.324   0.011
  967   HG21  VAL 122          HG21      VAL 122  12.208 -11.731  -3.244
  968   HG22  VAL 122          HG22      VAL 122  10.801 -12.262  -2.324
  969   HG23  VAL 122          HG23      VAL 122  12.306 -13.176  -2.239
  970    H    PHE 123           HN       PHE 123  11.540  -8.486  -0.025
  971    HA   PHE 123           HA       PHE 123  13.226  -8.396   2.201
  972    HB2  PHE 123           HB2      PHE 123  12.626  -6.570   0.442
  973    HB3  PHE 123           HB1      PHE 123  11.345  -6.144   1.572
  974    HD1  PHE 123           HD2      PHE 123  15.003  -6.451   1.179
  975    HD2  PHE 123           HD1      PHE 123  11.805  -4.923   3.535
  976    HE1  PHE 123           HE2      PHE 123  16.605  -5.104   2.474
  977    HE2  PHE 123           HE1      PHE 123  13.400  -3.573   4.832
  978    HZ   PHE 123           HZ       PHE 123  15.804  -3.663   4.303
  979    H    GLU 124           HN       GLU 124   9.712  -7.928   1.995
  980    HA   GLU 124           HA       GLU 124   9.312  -7.445   4.747
  981    HB2  GLU 124           HB2      GLU 124   7.480  -8.392   2.551
  982    HB3  GLU 124           HB1      GLU 124   6.916  -8.162   4.200
  983    HG2  GLU 124           HG2      GLU 124   6.508  -6.054   3.667
  984    HG3  GLU 124           HG1      GLU 124   8.253  -5.809   3.598
  985    H    LEU 125           HN       LEU 125   8.822 -10.400   2.816
  986    HA   LEU 125           HA       LEU 125   8.753 -11.948   5.309
  987    HB2  LEU 125           HB2      LEU 125   6.974 -12.064   3.374
  988    HB3  LEU 125           HB1      LEU 125   8.153 -13.129   2.632
  989    HG   LEU 125           HG       LEU 125   6.876 -13.553   5.335
  990   HD11  LEU 125          HD11      LEU 125   5.156 -14.150   3.990
  991   HD12  LEU 125          HD12      LEU 125   6.087 -15.643   3.874
  992   HD13  LEU 125          HD13      LEU 125   6.198 -14.433   2.595
  993   HD21  LEU 125          HD21      LEU 125   9.132 -14.453   5.244
  994   HD22  LEU 125          HD22      LEU 125   8.754 -15.290   3.738
  995   HD23  LEU 125          HD23      LEU 125   7.944 -15.758   5.233
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1 -14.110  13.961  -2.747
    2    H2   MET   1           HT2      MET   1 -14.821  14.090  -1.190
    3    H3   MET   1           HT3      MET   1 -14.321  12.560  -1.785
    4    HA   MET   1           HA       MET   1 -12.665  14.839  -0.963
    5    HB2  MET   1           HB2      MET   1 -13.492  13.310   0.778
    6    HB3  MET   1           HB1      MET   1 -12.833  11.941  -0.107
    7    HG2  MET   1           HG2      MET   1 -10.728  12.333   0.581
    8    HG3  MET   1           HG1      MET   1 -10.924  14.084   0.540
    9    HE1  MET   1           HE1      MET   1 -10.095  11.818   3.928
   10    HE2  MET   1           HE2      MET   1 -10.170  11.289   2.248
   11    HE3  MET   1           HE3      MET   1 -11.488  10.902   3.355
   12    H    ALA   2           HN       ALA   2 -12.233  11.439  -1.952
   13    HA   ALA   2           HA       ALA   2  -9.795  12.230  -3.372
   14    HB1  ALA   2           HB1      ALA   2 -10.529   9.373  -3.095
   15    HB2  ALA   2           HB2      ALA   2 -10.099  10.247  -1.624
   16    HB3  ALA   2           HB3      ALA   2  -8.956  10.160  -2.965
   17    H    LYS   3           HN       LYS   3  -9.418  11.700  -5.522
   18    HA   LYS   3           HA       LYS   3 -11.537  11.902  -7.304
   19    HB2  LYS   3           HB2      LYS   3  -9.825  10.935  -8.981
   20    HB3  LYS   3           HB1      LYS   3  -9.460  12.464  -8.192
   21    HG2  LYS   3           HG2      LYS   3  -8.438  10.349  -6.583
   22    HG3  LYS   3           HG1      LYS   3  -7.917  10.098  -8.249
   23    HD2  LYS   3           HD2      LYS   3  -7.255  12.571  -8.220
   24    HD3  LYS   3           HD1      LYS   3  -7.424  12.465  -6.466
   25    HE2  LYS   3           HE2      LYS   3  -5.796  10.394  -7.841
   26    HE3  LYS   3           HE1      LYS   3  -5.114  12.013  -7.690
   27    HZ1  LYS   3           HZ1      LYS   3  -4.886  10.138  -5.819
   28    HZ2  LYS   3           HZ2      LYS   3  -6.290  10.910  -5.276
   29    HZ3  LYS   3           HZ3      LYS   3  -4.864  11.795  -5.480
   30    H    VAL   4           HN       VAL   4 -13.191  10.485  -7.126
   31    HA   VAL   4           HA       VAL   4 -12.887   7.703  -6.687
   32    HB   VAL   4           HB       VAL   4 -15.299   9.081  -7.863
   33   HG11  VAL   4          HG11      VAL   4 -16.546   7.234  -7.144
   34   HG12  VAL   4          HG12      VAL   4 -15.249   6.652  -6.101
   35   HG13  VAL   4          HG13      VAL   4 -15.091   6.533  -7.853
   36   HG21  VAL   4          HG21      VAL   4 -15.208  10.290  -5.954
   37   HG22  VAL   4          HG22      VAL   4 -14.169   9.122  -5.138
   38   HG23  VAL   4          HG23      VAL   4 -15.904   8.828  -5.255
   39    H    GLU   5           HN       GLU   5 -13.516   9.627  -9.608
   40    HA   GLU   5           HA       GLU   5 -13.951   7.540 -11.393
   41    HB2  GLU   5           HB2      GLU   5 -13.523  10.354 -11.533
   42    HB3  GLU   5           HB1      GLU   5 -12.501   9.591 -12.742
   43    HG2  GLU   5           HG2      GLU   5 -14.962   8.312 -12.975
   44    HG3  GLU   5           HG1      GLU   5 -15.350  10.015 -12.738
   45    H    GLN   6           HN       GLN   6 -10.868   9.146 -10.583
   46    HA   GLN   6           HA       GLN   6  -9.263   7.604 -12.309
   47    HB2  GLN   6           HB2      GLN   6  -8.480   8.963  -9.718
   48    HB3  GLN   6           HB1      GLN   6  -7.364   8.400 -10.951
   49    HG2  GLN   6           HG2      GLN   6  -8.811  10.025 -12.473
   50    HG3  GLN   6           HG1      GLN   6  -9.112  10.800 -10.918
   51   HE21  GLN   6          1HE2      GLN   6  -7.922  12.677 -11.433
   52   HE22  GLN   6          2HE2      GLN   6  -6.198  12.663 -11.567
   53    H    VAL   7           HN       VAL   7 -10.120   7.199  -8.912
   54    HA   VAL   7           HA       VAL   7  -8.561   4.800  -8.589
   55    HB   VAL   7           HB       VAL   7  -9.386   4.766  -6.305
   56   HG11  VAL   7          HG11      VAL   7  -7.661   6.543  -7.360
   57   HG12  VAL   7          HG12      VAL   7  -8.017   6.429  -5.636
   58   HG13  VAL   7          HG13      VAL   7  -8.829   7.642  -6.627
   59   HG21  VAL   7          HG21      VAL   7 -10.773   6.967  -5.750
   60   HG22  VAL   7          HG22      VAL   7 -11.553   5.445  -6.181
   61   HG23  VAL   7          HG23      VAL   7 -11.341   6.704  -7.398
   62    H    LEU   8           HN       LEU   8 -11.767   5.381  -9.661
   63    HA   LEU   8           HA       LEU   8 -13.217   3.351  -8.510
   64    HB2  LEU   8           HB2      LEU   8 -13.750   5.199 -10.372
   65    HB3  LEU   8           HB1      LEU   8 -13.681   3.779 -11.399
   66    HG   LEU   8           HG       LEU   8 -15.430   2.706 -10.073
   67   HD11  LEU   8          HD11      LEU   8 -14.697   4.602  -8.128
   68   HD12  LEU   8          HD12      LEU   8 -15.929   3.346  -8.012
   69   HD13  LEU   8          HD13      LEU   8 -16.365   4.957  -8.578
   70   HD21  LEU   8          HD21      LEU   8 -15.766   4.672 -11.897
   71   HD22  LEU   8          HD22      LEU   8 -16.671   5.332 -10.534
   72   HD23  LEU   8          HD23      LEU   8 -17.087   3.747 -11.185
   73    H    SER   9           HN       SER   9 -11.315   2.996 -11.558
   74    HA   SER   9           HA       SER   9 -10.784   1.075 -12.733
   75    HB2  SER   9           HB2      SER   9 -10.017  -0.739 -10.841
   76    HB3  SER   9           HB1      SER   9  -9.017   0.607 -11.384
   77    HG   SER   9           HG       SER   9 -10.713   0.539  -9.097
   78    H    LEU  10           HN       LEU  10 -13.402   1.097 -12.797
   79    HA   LEU  10           HA       LEU  10 -14.643  -1.179 -11.530
   80    HB2  LEU  10           HB2      LEU  10 -16.608  -0.433 -12.912
   81    HB3  LEU  10           HB1      LEU  10 -15.967   0.743 -11.772
   82    HG   LEU  10           HG       LEU  10 -14.554   1.155 -14.153
   83   HD11  LEU  10          HD11      LEU  10 -17.490   1.228 -14.787
   84   HD12  LEU  10          HD12      LEU  10 -16.508  -0.195 -15.133
   85   HD13  LEU  10          HD13      LEU  10 -16.113   1.352 -15.883
   86   HD21  LEU  10          HD21      LEU  10 -15.109   2.892 -12.578
   87   HD22  LEU  10          HD22      LEU  10 -16.832   2.684 -12.890
   88   HD23  LEU  10          HD23      LEU  10 -15.777   3.316 -14.154
   89    H    GLU  11           HN       GLU  11 -14.068  -0.325 -14.998
   90    HA   GLU  11           HA       GLU  11 -14.888  -3.001 -15.778
   91    HB2  GLU  11           HB2      GLU  11 -14.973  -0.553 -17.050
   92    HB3  GLU  11           HB1      GLU  11 -13.616  -1.342 -17.839
   93    HG2  GLU  11           HG2      GLU  11 -16.157  -2.850 -17.514
   94    HG3  GLU  11           HG1      GLU  11 -16.055  -1.599 -18.751
   95    HA   PRO  12           HA       PRO  12 -10.233  -3.356 -16.497
   96    HB2  PRO  12           HB2      PRO  12  -8.657  -1.197 -16.457
   97    HB3  PRO  12           HB1      PRO  12  -9.697  -1.501 -17.854
   98    HG2  PRO  12           HG2      PRO  12  -9.968   0.519 -15.711
   99    HG3  PRO  12           HG1      PRO  12 -10.572   0.555 -17.375
  100    HD2  PRO  12           HD2      PRO  12 -12.003  -0.153 -14.986
  101    HD3  PRO  12           HD1      PRO  12 -12.605  -0.126 -16.654
  102    H    GLN  13           HN       GLN  13 -10.708  -4.274 -14.339
  103    HA   GLN  13           HA       GLN  13 -10.482  -2.755 -12.012
  104    HB2  GLN  13           HB2      GLN  13 -10.195  -5.706 -12.562
  105    HB3  GLN  13           HB1      GLN  13  -9.970  -5.066 -10.939
  106    HG2  GLN  13           HG2      GLN  13 -12.396  -4.066 -12.153
  107    HG3  GLN  13           HG1      GLN  13 -12.357  -5.828 -12.115
  108   HE21  GLN  13          1HE2      GLN  13 -14.221  -5.344 -10.652
  109   HE22  GLN  13          2HE2      GLN  13 -13.876  -5.149  -8.971
  110    H    HIS  14           HN       HIS  14  -8.005  -3.851 -14.126
  111    HA   HIS  14           HA       HIS  14  -5.745  -3.661 -14.090
  112    HB2  HIS  14           HB2      HIS  14  -6.223  -1.976 -11.623
  113    HB3  HIS  14           HB1      HIS  14  -4.721  -2.055 -12.538
  114    HD1  HIS  14           HD1      HIS  14  -6.089   0.636 -12.182
  115    HD2  HIS  14           HD2      HIS  14  -6.801  -1.883 -15.408
  116    HE1  HIS  14           HE1      HIS  14  -6.954   2.122 -14.016
  117    HE2  HIS  14           HE2      HIS  14  -7.293   0.589 -15.987
  118    H    GLU  15           HN       GLU  15  -4.783  -5.541 -13.700
  119    HA   GLU  15           HA       GLU  15  -4.266  -6.294 -10.922
  120    HB2  GLU  15           HB2      GLU  15  -5.404  -8.149 -13.021
  121    HB3  GLU  15           HB1      GLU  15  -4.776  -8.675 -11.465
  122    HG2  GLU  15           HG2      GLU  15  -6.683  -8.205 -10.445
  123    HG3  GLU  15           HG1      GLU  15  -6.727  -6.583 -11.133
  124    H    LEU  16           HN       LEU  16  -2.103  -5.812 -11.090
  125    HA   LEU  16           HA       LEU  16  -0.565  -7.555 -12.887
  126    HB2  LEU  16           HB2      LEU  16   0.426  -4.798 -12.303
  127    HB3  LEU  16           HB1      LEU  16   0.813  -5.856 -13.643
  128    HG   LEU  16           HG       LEU  16  -0.438  -4.051 -14.529
  129   HD11  LEU  16          HD11      LEU  16  -1.604  -5.394 -15.845
  130   HD12  LEU  16          HD12      LEU  16  -2.777  -5.707 -14.566
  131   HD13  LEU  16          HD13      LEU  16  -1.328  -6.703 -14.696
  132   HD21  LEU  16          HD21      LEU  16  -2.958  -4.331 -13.182
  133   HD22  LEU  16          HD22      LEU  16  -1.940  -2.904 -13.369
  134   HD23  LEU  16          HD23      LEU  16  -1.675  -4.003 -12.016
  135    H    LYS  17           HN       LYS  17   0.062  -5.143 -10.327
  136    HA   LYS  17           HA       LYS  17   2.369  -6.084  -9.280
  137    HB2  LYS  17           HB2      LYS  17   0.004  -5.016  -7.735
  138    HB3  LYS  17           HB1      LYS  17   1.635  -5.161  -7.091
  139    HG2  LYS  17           HG2      LYS  17   2.299  -3.706  -9.130
  140    HG3  LYS  17           HG1      LYS  17   0.583  -3.295  -9.170
  141    HD2  LYS  17           HD2      LYS  17   0.677  -2.450  -6.922
  142    HD3  LYS  17           HD1      LYS  17   2.337  -3.015  -6.732
  143    HE2  LYS  17           HE2      LYS  17   2.501  -0.704  -7.153
  144    HE3  LYS  17           HE1      LYS  17   2.925  -1.493  -8.672
  145    HZ1  LYS  17           HZ1      LYS  17   0.572  -1.139  -9.364
  146    HZ2  LYS  17           HZ2      LYS  17   1.461   0.287  -9.168
  147    HZ3  LYS  17           HZ3      LYS  17   0.353  -0.188  -7.982
  148    H    PHE  18           HN       PHE  18   2.973  -8.064  -8.764
  149    HA   PHE  18           HA       PHE  18   2.953 -10.218  -8.017
  150    HB2  PHE  18           HB2      PHE  18   2.729  -8.583  -5.913
  151    HB3  PHE  18           HB1      PHE  18   1.219  -9.465  -5.722
  152    HD1  PHE  18           HD1      PHE  18   4.483 -10.745  -6.957
  153    HD2  PHE  18           HD2      PHE  18   1.595 -10.761  -3.831
  154    HE1  PHE  18           HE1      PHE  18   5.690 -12.583  -5.857
  155    HE2  PHE  18           HE2      PHE  18   2.798 -12.600  -2.725
  156    HZ   PHE  18           HZ       PHE  18   4.848 -13.512  -3.737
  157    H    ARG  19           HN       ARG  19   1.375 -11.917  -6.812
  158    HA   ARG  19           HA       ARG  19  -0.808 -12.269  -8.682
  159    HB2  ARG  19           HB2      ARG  19   0.483 -14.013  -6.603
  160    HB3  ARG  19           HB1      ARG  19  -1.047 -14.470  -7.338
  161    HG2  ARG  19           HG2      ARG  19   0.973 -13.704  -9.290
  162    HG3  ARG  19           HG1      ARG  19   1.448 -15.081  -8.295
  163    HD2  ARG  19           HD2      ARG  19   0.333 -15.985 -10.169
  164    HD3  ARG  19           HD1      ARG  19  -0.809 -16.083  -8.829
  165    HE   ARG  19           HE       ARG  19  -1.447 -13.734  -9.990
  166   HH11  ARG  19          HH11      ARG  19  -1.022 -16.960 -11.256
  167   HH12  ARG  19          HH12      ARG  19  -2.165 -16.741 -12.538
  168   HH21  ARG  19          HH21      ARG  19  -2.953 -13.449 -11.674
  169   HH22  ARG  19          HH22      ARG  19  -3.262 -14.750 -12.776
  170    H    GLY  20           HN       GLY  20  -2.969 -12.527  -8.122
  171    HA2  GLY  20           HA2      GLY  20  -4.862 -12.402  -6.787
  172    HA3  GLY  20           HA1      GLY  20  -3.838 -12.136  -5.390
  173    HA   PRO  21           HA       PRO  21  -3.851  -7.652  -6.788
  174    HB2  PRO  21           HB2      PRO  21  -4.762  -7.631  -9.596
  175    HB3  PRO  21           HB1      PRO  21  -3.410  -6.784  -8.847
  176    HG2  PRO  21           HG2      PRO  21  -3.073  -8.897 -10.500
  177    HG3  PRO  21           HG1      PRO  21  -1.959  -8.518  -9.177
  178    HD2  PRO  21           HD2      PRO  21  -4.028 -10.647  -9.364
  179    HD3  PRO  21           HD1      PRO  21  -2.473 -10.642  -8.514
  180    H    PHE  22           HN       PHE  22  -6.245  -9.471  -8.710
  181    HA   PHE  22           HA       PHE  22  -8.385  -7.706  -8.070
  182    HB2  PHE  22           HB2      PHE  22  -8.400  -9.098 -10.098
  183    HB3  PHE  22           HB1      PHE  22  -8.460 -10.549  -9.104
  184    HD1  PHE  22           HD2      PHE  22 -10.318  -7.309  -9.070
  185    HD2  PHE  22           HD1      PHE  22 -10.510 -11.558  -9.247
  186    HE1  PHE  22           HE2      PHE  22 -12.775  -7.195  -9.063
  187    HE2  PHE  22           HE1      PHE  22 -12.968 -11.451  -9.241
  188    HZ   PHE  22           HZ       PHE  22 -14.104  -9.267  -9.148
  189    H    THR  23           HN       THR  23  -7.672 -11.042  -7.056
  190    HA   THR  23           HA       THR  23  -9.715 -11.279  -5.175
  191    HB   THR  23           HB       THR  23  -7.069 -12.691  -4.947
  192    HG1  THR  23           HG1      THR  23  -7.513 -13.040  -7.026
  193   HG21  THR  23          HG21      THR  23  -8.928 -14.583  -4.627
  194   HG22  THR  23          HG22      THR  23  -9.811 -13.193  -3.997
  195   HG23  THR  23          HG23      THR  23  -8.259 -13.644  -3.292
  196    H    ASP  24           HN       ASP  24  -6.290 -10.454  -4.589
  197    HA   ASP  24           HA       ASP  24  -6.639 -10.150  -1.791
  198    HB2  ASP  24           HB2      ASP  24  -4.472 -10.397  -3.374
  199    HB3  ASP  24           HB1      ASP  24  -4.447  -8.656  -3.116
  200    H    VAL  25           HN       VAL  25  -6.331  -7.765  -4.404
  201    HA   VAL  25           HA       VAL  25  -6.688  -5.530  -2.688
  202    HB   VAL  25           HB       VAL  25  -7.137  -5.563  -5.664
  203   HG11  VAL  25          HG11      VAL  25  -6.597  -3.203  -5.545
  204   HG12  VAL  25          HG12      VAL  25  -6.358  -3.325  -3.802
  205   HG13  VAL  25          HG13      VAL  25  -7.963  -3.568  -4.490
  206   HG21  VAL  25          HG21      VAL  25  -4.861  -6.412  -4.581
  207   HG22  VAL  25          HG22      VAL  25  -4.568  -4.677  -4.467
  208   HG23  VAL  25          HG23      VAL  25  -4.890  -5.416  -6.036
  209    H    VAL  26           HN       VAL  26  -9.057  -7.444  -4.509
  210    HA   VAL  26           HA       VAL  26 -11.126  -5.596  -4.552
  211    HB   VAL  26           HB       VAL  26 -12.711  -7.567  -4.483
  212   HG11  VAL  26          HG11      VAL  26 -10.664  -6.942  -6.490
  213   HG12  VAL  26          HG12      VAL  26 -12.419  -7.029  -6.639
  214   HG13  VAL  26          HG13      VAL  26 -11.456  -8.505  -6.687
  215   HG21  VAL  26          HG21      VAL  26 -11.880  -9.411  -3.541
  216   HG22  VAL  26          HG22      VAL  26 -10.213  -8.888  -3.776
  217   HG23  VAL  26          HG23      VAL  26 -11.081  -9.678  -5.091
  218    H    THR  27           HN       THR  27 -10.105  -7.605  -1.829
  219    HA   THR  27           HA       THR  27 -12.418  -7.319  -0.287
  220    HB   THR  27           HB       THR  27 -10.631  -8.830   0.383
  221    HG1  THR  27           HG1      THR  27 -11.561  -8.483   2.227
  222   HG21  THR  27          HG21      THR  27  -8.508  -8.288   0.914
  223   HG22  THR  27          HG22      THR  27  -8.945  -6.685   1.508
  224   HG23  THR  27          HG23      THR  27  -8.825  -6.981  -0.226
  225    H    THR  28           HN       THR  28  -9.516  -5.269  -0.396
  226    HA   THR  28           HA       THR  28 -10.607  -3.276   1.339
  227    HB   THR  28           HB       THR  28  -8.212  -3.519   1.208
  228    HG1  THR  28           HG1      THR  28  -8.115  -1.464   1.509
  229   HG21  THR  28          HG21      THR  28  -8.417  -2.724  -1.687
  230   HG22  THR  28          HG22      THR  28  -7.948  -4.308  -1.072
  231   HG23  THR  28          HG23      THR  28  -6.926  -2.907  -0.764
  232    H    ASN  29           HN       ASN  29 -10.136  -3.529  -2.146
  233    HA   ASN  29           HA       ASN  29 -11.146  -0.995  -2.829
  234    HB2  ASN  29           HB2      ASN  29  -9.904  -3.081  -4.160
  235    HB3  ASN  29           HB1      ASN  29 -11.499  -3.006  -4.903
  236   HD21  ASN  29          1HE2      ASN  29  -9.198  -2.436  -6.308
  237   HD22  ASN  29          2HE2      ASN  29  -9.180  -0.757  -6.713
  238    H    LEU  30           HN       LEU  30 -12.759  -4.079  -2.349
  239    HA   LEU  30           HA       LEU  30 -15.124  -3.597  -3.728
  240    HB2  LEU  30           HB2      LEU  30 -14.620  -5.770  -2.810
  241    HB3  LEU  30           HB1      LEU  30 -14.677  -5.140  -1.175
  242    HG   LEU  30           HG       LEU  30 -16.676  -6.508  -2.005
  243   HD11  LEU  30          HD11      LEU  30 -17.935  -5.540  -0.408
  244   HD12  LEU  30          HD12      LEU  30 -17.718  -3.917  -1.063
  245   HD13  LEU  30          HD13      LEU  30 -16.447  -4.649  -0.083
  246   HD21  LEU  30          HD21      LEU  30 -16.851  -5.357  -4.192
  247   HD22  LEU  30          HD22      LEU  30 -17.357  -3.895  -3.346
  248   HD23  LEU  30          HD23      LEU  30 -18.358  -5.346  -3.275
  249    H    LYS  31           HN       LYS  31 -14.426  -2.874  -0.303
  250    HA   LYS  31           HA       LYS  31 -16.883  -1.296  -0.176
  251    HB2  LYS  31           HB2      LYS  31 -15.066  -2.537   1.811
  252    HB3  LYS  31           HB1      LYS  31 -15.837  -1.032   2.291
  253    HG2  LYS  31           HG2      LYS  31 -17.914  -2.480   1.214
  254    HG3  LYS  31           HG1      LYS  31 -16.950  -3.703   2.045
  255    HD2  LYS  31           HD2      LYS  31 -18.459  -2.933   3.668
  256    HD3  LYS  31           HD1      LYS  31 -16.950  -2.095   4.033
  257    HE2  LYS  31           HE2      LYS  31 -17.746  -0.104   2.909
  258    HE3  LYS  31           HE1      LYS  31 -19.221  -0.937   2.421
  259    HZ1  LYS  31           HZ1      LYS  31 -18.494   0.193   4.997
  260    HZ2  LYS  31           HZ2      LYS  31 -19.314  -1.285   5.052
  261    HZ3  LYS  31           HZ3      LYS  31 -20.015   0.041   4.271
  262    H    LEU  32           HN       LEU  32 -14.053  -0.676  -1.427
  263    HA   LEU  32           HA       LEU  32 -12.508   1.044  -1.431
  264    HB2  LEU  32           HB2      LEU  32 -15.079   1.725  -2.384
  265    HB3  LEU  32           HB1      LEU  32 -14.454   3.143  -1.566
  266    HG   LEU  32           HG       LEU  32 -13.139   1.673  -3.863
  267   HD11  LEU  32          HD11      LEU  32 -14.655   2.956  -4.946
  268   HD12  LEU  32          HD12      LEU  32 -13.425   4.194  -4.694
  269   HD13  LEU  32          HD13      LEU  32 -14.814   4.097  -3.611
  270   HD21  LEU  32          HD21      LEU  32 -11.798   2.933  -1.864
  271   HD22  LEU  32          HD22      LEU  32 -12.072   4.264  -2.985
  272   HD23  LEU  32          HD23      LEU  32 -11.232   2.813  -3.529
  273    H    GLY  33           HN       GLY  33 -12.988   0.331   1.247
  274    HA2  GLY  33           HA2      GLY  33 -11.787   2.268   2.715
  275    HA3  GLY  33           HA1      GLY  33 -13.483   2.719   2.792
  276    H    ASN  34           HN       ASN  34 -14.959   1.352   3.856
  277    HA   ASN  34           HA       ASN  34 -15.667   0.043   5.553
  278    HB2  ASN  34           HB2      ASN  34 -15.102  -2.216   5.480
  279    HB3  ASN  34           HB1      ASN  34 -14.775  -1.667   3.841
  280   HD21  ASN  34          1HE2      ASN  34 -13.247  -2.298   6.957
  281   HD22  ASN  34          2HE2      ASN  34 -11.710  -2.753   6.314
  282    HA   PRO  35           HA       PRO  35 -13.052   1.079   8.996
  283    HB2  PRO  35           HB2      PRO  35 -14.817   0.680  10.949
  284    HB3  PRO  35           HB1      PRO  35 -15.050   1.981   9.776
  285    HG2  PRO  35           HG2      PRO  35 -16.375  -0.689   9.933
  286    HG3  PRO  35           HG1      PRO  35 -17.063   0.880   9.485
  287    HD2  PRO  35           HD2      PRO  35 -16.216  -1.098   7.704
  288    HD3  PRO  35           HD1      PRO  35 -16.503   0.604   7.299
  289    H    THR  36           HN       THR  36 -11.446  -0.264   9.553
  290    HA   THR  36           HA       THR  36 -11.698  -3.061   9.813
  291    HB   THR  36           HB       THR  36  -9.473  -1.582  11.164
  292    HG1  THR  36           HG1      THR  36  -8.509  -1.415   9.039
  293   HG21  THR  36          HG21      THR  36  -9.303  -3.968  11.183
  294   HG22  THR  36          HG22      THR  36  -8.104  -3.317  10.065
  295   HG23  THR  36          HG23      THR  36  -9.586  -4.045   9.444
  296    H    ASP  37           HN       ASP  37 -10.696  -0.845  12.422
  297    HA   ASP  37           HA       ASP  37 -12.670  -1.812  14.242
  298    HB2  ASP  37           HB2      ASP  37 -10.565  -3.531  13.968
  299    HB3  ASP  37           HB1      ASP  37 -10.011  -2.521  15.302
  300    H    ARG  38           HN       ARG  38 -11.123  -1.365  16.628
  301    HA   ARG  38           HA       ARG  38 -10.414   0.295  18.011
  302    HB2  ARG  38           HB2      ARG  38  -8.635   0.629  16.297
  303    HB3  ARG  38           HB1      ARG  38  -9.673   1.799  15.494
  304    HG2  ARG  38           HG2      ARG  38  -8.704   3.348  16.748
  305    HG3  ARG  38           HG1      ARG  38  -9.598   2.677  18.113
  306    HD2  ARG  38           HD2      ARG  38  -6.918   1.622  17.248
  307    HD3  ARG  38           HD1      ARG  38  -7.091   2.937  18.410
  308    HE   ARG  38           HE       ARG  38  -7.579   0.142  18.866
  309   HH11  ARG  38          HH11      ARG  38  -8.323   3.385  19.918
  310   HH12  ARG  38          HH12      ARG  38  -8.757   2.900  21.523
  311   HH21  ARG  38          HH21      ARG  38  -8.151  -0.498  20.976
  312   HH22  ARG  38          HH22      ARG  38  -8.659   0.695  22.123
  313    H    ASN  39           HN       ASN  39 -11.632   2.102  15.188
  314    HA   ASN  39           HA       ASN  39 -13.779   3.155  16.896
  315    HB2  ASN  39           HB2      ASN  39 -11.587   4.628  15.848
  316    HB3  ASN  39           HB1      ASN  39 -13.026   5.135  14.967
  317   HD21  ASN  39          1HE2      ASN  39 -14.912   4.773  17.009
  318   HD22  ASN  39          2HE2      ASN  39 -14.621   5.961  18.230
  319    H    VAL  40           HN       VAL  40 -15.050   4.745  15.041
  320    HA   VAL  40           HA       VAL  40 -15.878   2.777  13.008
  321    HB   VAL  40           HB       VAL  40 -18.100   3.894  13.051
  322   HG11  VAL  40          HG11      VAL  40 -16.928   2.382  15.299
  323   HG12  VAL  40          HG12      VAL  40 -18.302   1.997  14.262
  324   HG13  VAL  40          HG13      VAL  40 -18.496   3.134  15.596
  325   HG21  VAL  40          HG21      VAL  40 -18.640   5.333  14.987
  326   HG22  VAL  40          HG22      VAL  40 -17.456   6.063  13.903
  327   HG23  VAL  40          HG23      VAL  40 -16.931   5.344  15.425
  328    H    CYS  41           HN       CYS  41 -15.180   6.159  13.661
  329    HA   CYS  41           HA       CYS  41 -15.528   6.798  10.821
  330    HB2  CYS  41           HB2      CYS  41 -16.514   8.212  12.757
  331    HB3  CYS  41           HB1      CYS  41 -14.868   8.801  12.964
  332    HG   CYS  41           HG       CYS  41 -16.726   9.985  11.093
  333    H    PHE  42           HN       PHE  42 -13.889   8.056   9.724
  334    HA   PHE  42           HA       PHE  42 -11.769   8.433   9.001
  335    HB2  PHE  42           HB2      PHE  42 -11.088   8.264  11.945
  336    HB3  PHE  42           HB1      PHE  42 -10.035   8.903  10.686
  337    HD1  PHE  42           HD2      PHE  42 -10.846  10.930   9.378
  338    HD2  PHE  42           HD1      PHE  42 -12.624   9.639  13.022
  339    HE1  PHE  42           HE2      PHE  42 -11.837  13.162   9.681
  340    HE2  PHE  42           HE1      PHE  42 -13.620  11.868  13.331
  341    HZ   PHE  42           HZ       PHE  42 -13.226  13.633  11.658
  342    H    LYS  43           HN       LYS  43 -12.542   5.925   8.587
  343    HA   LYS  43           HA       LYS  43 -11.312   3.754   9.652
  344    HB2  LYS  43           HB2      LYS  43 -11.099   3.032   7.099
  345    HB3  LYS  43           HB1      LYS  43 -12.643   3.082   7.938
  346    HG2  LYS  43           HG2      LYS  43 -13.417   4.749   6.658
  347    HG3  LYS  43           HG1      LYS  43 -11.878   5.612   6.678
  348    HD2  LYS  43           HD2      LYS  43 -11.051   3.787   5.081
  349    HD3  LYS  43           HD1      LYS  43 -12.755   3.378   4.873
  350    HE2  LYS  43           HE2      LYS  43 -13.253   5.445   3.906
  351    HE3  LYS  43           HE1      LYS  43 -11.781   6.192   4.525
  352    HZ1  LYS  43           HZ1      LYS  43 -12.123   4.398   2.220
  353    HZ2  LYS  43           HZ2      LYS  43 -10.632   4.448   3.018
  354    HZ3  LYS  43           HZ3      LYS  43 -11.268   5.854   2.327
  355    H    VAL  44           HN       VAL  44  -9.907   5.488   6.861
  356    HA   VAL  44           HA       VAL  44  -7.414   4.195   7.006
  357    HB   VAL  44           HB       VAL  44  -6.600   5.928   5.478
  358   HG11  VAL  44          HG11      VAL  44  -9.403   5.209   4.667
  359   HG12  VAL  44          HG12      VAL  44  -8.114   4.010   4.760
  360   HG13  VAL  44          HG13      VAL  44  -7.971   5.374   3.650
  361   HG21  VAL  44          HG21      VAL  44  -9.212   7.276   6.141
  362   HG22  VAL  44          HG22      VAL  44  -8.228   7.695   4.740
  363   HG23  VAL  44          HG23      VAL  44  -7.582   7.907   6.367
  364    H    LYS  45           HN       LYS  45  -8.543   5.888   9.426
  365    HA   LYS  45           HA       LYS  45  -5.916   7.011  10.110
  366    HB2  LYS  45           HB2      LYS  45  -8.085   8.594   9.563
  367    HB3  LYS  45           HB1      LYS  45  -8.201   8.419  11.308
  368    HG2  LYS  45           HG2      LYS  45  -6.771  10.111  11.431
  369    HG3  LYS  45           HG1      LYS  45  -5.534   8.961  10.921
  370    HD2  LYS  45           HD2      LYS  45  -5.704   9.632   8.662
  371    HD3  LYS  45           HD1      LYS  45  -7.209  10.504   8.956
  372    HE2  LYS  45           HE2      LYS  45  -5.557  11.769  10.681
  373    HE3  LYS  45           HE1      LYS  45  -4.417  11.327   9.410
  374    HZ1  LYS  45           HZ1      LYS  45  -5.348  12.753   7.961
  375    HZ2  LYS  45           HZ2      LYS  45  -5.895  13.534   9.357
  376    HZ3  LYS  45           HZ3      LYS  45  -6.925  12.489   8.516
  377    H    THR  46           HN       THR  46  -9.035   6.776  11.815
  378    HA   THR  46           HA       THR  46  -7.686   5.647  14.121
  379    HB   THR  46           HB       THR  46 -10.648   5.923  14.045
  380    HG1  THR  46           HG1      THR  46  -8.945   8.179  14.220
  381   HG21  THR  46          HG21      THR  46  -8.851   7.106  16.101
  382   HG22  THR  46          HG22      THR  46  -9.130   5.365  16.079
  383   HG23  THR  46          HG23      THR  46 -10.489   6.473  16.262
  384    H    THR  47           HN       THR  47  -7.150   3.718  12.702
  385    HA   THR  47           HA       THR  47  -9.276   1.707  13.017
  386    HB   THR  47           HB       THR  47  -9.160   2.236  10.663
  387    HG1  THR  47           HG1      THR  47  -9.024   0.216  10.013
  388   HG21  THR  47          HG21      THR  47  -7.237   2.150   9.326
  389   HG22  THR  47          HG22      THR  47  -6.272   1.437  10.619
  390   HG23  THR  47          HG23      THR  47  -6.792   3.119  10.731
  391    H    ALA  48           HN       ALA  48  -8.398  -0.550  12.978
  392    HA   ALA  48           HA       ALA  48  -5.774  -0.638  14.318
  393    HB1  ALA  48           HB1      ALA  48  -7.790  -1.172  15.729
  394    HB2  ALA  48           HB2      ALA  48  -6.542  -2.416  15.686
  395    HB3  ALA  48           HB3      ALA  48  -8.011  -2.609  14.729
  396    HA   PRO  49           HA       PRO  49  -4.708  -3.050  10.673
  397    HB2  PRO  49           HB2      PRO  49  -2.168  -3.660  11.479
  398    HB3  PRO  49           HB1      PRO  49  -2.616  -2.121  10.736
  399    HG2  PRO  49           HG2      PRO  49  -2.246  -2.793  13.629
  400    HG3  PRO  49           HG1      PRO  49  -1.718  -1.354  12.737
  401    HD2  PRO  49           HD2      PRO  49  -3.908  -1.334  14.303
  402    HD3  PRO  49           HD1      PRO  49  -3.819  -0.387  12.802
  403    H    ARG  50           HN       ARG  50  -4.308  -4.086  14.010
  404    HA   ARG  50           HA       ARG  50  -4.475  -6.115  15.024
  405    HB2  ARG  50           HB2      ARG  50  -6.551  -5.999  13.298
  406    HB3  ARG  50           HB1      ARG  50  -5.730  -7.428  12.687
  407    HG2  ARG  50           HG2      ARG  50  -5.942  -8.546  14.771
  408    HG3  ARG  50           HG1      ARG  50  -6.489  -7.072  15.574
  409    HD2  ARG  50           HD2      ARG  50  -8.458  -8.263  15.228
  410    HD3  ARG  50           HD1      ARG  50  -8.427  -7.119  13.887
  411    HE   ARG  50           HE       ARG  50  -7.247  -9.669  13.271
  412   HH11  ARG  50          HH11      ARG  50 -10.216  -7.838  13.381
  413   HH12  ARG  50          HH12      ARG  50 -11.014  -8.823  12.202
  414   HH21  ARG  50          HH21      ARG  50  -8.295 -10.966  11.720
  415   HH22  ARG  50          HH22      ARG  50  -9.924 -10.599  11.260
  416    H    ARG  51           HN       ARG  51  -2.262  -5.500  13.016
  417    HA   ARG  51           HA       ARG  51  -0.727  -7.781  13.363
  418    HB2  ARG  51           HB2      ARG  51  -2.621  -8.329  11.459
  419    HB3  ARG  51           HB1      ARG  51  -1.273  -7.787  10.472
  420    HG2  ARG  51           HG2      ARG  51  -1.241 -10.195  10.737
  421    HG3  ARG  51           HG1      ARG  51   0.168  -9.465  11.507
  422    HD2  ARG  51           HD2      ARG  51  -1.644  -9.505  13.551
  423    HD3  ARG  51           HD1      ARG  51  -2.050 -10.978  12.675
  424    HE   ARG  51           HE       ARG  51   0.292 -10.495  14.246
  425   HH11  ARG  51          HH11      ARG  51  -0.970 -12.297  11.537
  426   HH12  ARG  51          HH12      ARG  51   0.191 -13.572  11.684
  427   HH21  ARG  51          HH21      ARG  51   1.819 -12.172  14.441
  428   HH22  ARG  51          HH22      ARG  51   1.774 -13.502  13.333
  429    H    TYR  52           HN       TYR  52   1.172  -7.799  11.645
  430    HA   TYR  52           HA       TYR  52   2.124  -5.052  11.551
  431    HB2  TYR  52           HB2      TYR  52   3.383  -7.746  11.444
  432    HB3  TYR  52           HB1      TYR  52   4.225  -6.427  10.639
  433    HD1  TYR  52           HD2      TYR  52   5.132  -4.559  11.925
  434    HD2  TYR  52           HD1      TYR  52   3.168  -7.804  13.852
  435    HE1  TYR  52           HE2      TYR  52   6.066  -3.837  14.081
  436    HE2  TYR  52           HE1      TYR  52   4.096  -7.089  16.015
  437    HH   TYR  52           HH       TYR  52   5.913  -5.788  16.899
  438    H    CYS  53           HN       CYS  53   2.937  -4.039   9.720
  439    HA   CYS  53           HA       CYS  53   3.363  -4.782   7.181
  440    HB2  CYS  53           HB2      CYS  53   1.210  -5.982   7.031
  441    HB3  CYS  53           HB1      CYS  53   0.343  -4.498   7.401
  442    HG   CYS  53           HG       CYS  53   0.487  -5.152   4.719
  443    H    VAL  54           HN       VAL  54   1.628  -2.553   9.207
  444    HA   VAL  54           HA       VAL  54   2.359  -0.343   7.399
  445    HB   VAL  54           HB       VAL  54   0.679   0.999   8.678
  446   HG11  VAL  54          HG11      VAL  54   0.324  -0.630   6.548
  447   HG12  VAL  54          HG12      VAL  54  -0.913   0.456   7.183
  448   HG13  VAL  54          HG13      VAL  54  -0.912  -1.247   7.644
  449   HG21  VAL  54          HG21      VAL  54   0.737  -1.201  10.413
  450   HG22  VAL  54          HG22      VAL  54  -0.856  -1.228   9.657
  451   HG23  VAL  54          HG23      VAL  54  -0.309   0.215  10.509
  452    H    ARG  55           HN       ARG  55   4.075  -1.710   9.390
  453    HA   ARG  55           HA       ARG  55   5.739  -1.145  10.812
  454    HB2  ARG  55           HB2      ARG  55   4.820   1.702  10.360
  455    HB3  ARG  55           HB1      ARG  55   6.318   1.223  11.141
  456    HG2  ARG  55           HG2      ARG  55   5.542   0.754   8.273
  457    HG3  ARG  55           HG1      ARG  55   6.771   1.865   8.878
  458    HD2  ARG  55           HD2      ARG  55   8.258   0.231   8.646
  459    HD3  ARG  55           HD1      ARG  55   7.438  -0.629   9.947
  460    HE   ARG  55           HE       ARG  55   6.748  -2.133   8.390
  461   HH11  ARG  55          HH11      ARG  55   7.322   0.903   6.767
  462   HH12  ARG  55          HH12      ARG  55   6.960   0.274   5.195
  463   HH21  ARG  55          HH21      ARG  55   6.272  -2.963   6.323
  464   HH22  ARG  55          HH22      ARG  55   6.363  -1.920   4.942
  465    H    SER  56           HN       SER  56   2.969   1.012  11.600
  466    HA   SER  56           HA       SER  56   2.093   1.587  13.637
  467    HB2  SER  56           HB2      SER  56   2.022  -1.358  13.378
  468    HB3  SER  56           HB1      SER  56   1.645  -0.701  14.971
  469    HG   SER  56           HG       SER  56   0.391   0.762  13.146
  470    H    ASN  57           HN       ASN  57   4.602   2.214  13.823
  471    HA   ASN  57           HA       ASN  57   5.892   0.887  16.051
  472    HB2  ASN  57           HB2      ASN  57   6.854   2.240  13.876
  473    HB3  ASN  57           HB1      ASN  57   7.037   3.438  15.154
  474   HD21  ASN  57          1HE2      ASN  57   7.489  -0.064  14.770
  475   HD22  ASN  57          2HE2      ASN  57   9.046  -0.115  15.516
  476    H    SER  58           HN       SER  58   4.142   3.901  15.491
  477    HA   SER  58           HA       SER  58   4.834   4.963  18.080
  478    HB2  SER  58           HB2      SER  58   2.871   5.862  15.972
  479    HB3  SER  58           HB1      SER  58   3.129   6.725  17.488
  480    HG   SER  58           HG       SER  58   5.132   6.147  15.561
  481    H    GLY  59           HN       GLY  59   2.062   3.236  16.735
  482    HA2  GLY  59           HA2      GLY  59   1.136   1.931  18.838
  483    HA3  GLY  59           HA1      GLY  59   0.578   3.550  19.223
  484    H    ILE  60           HN       ILE  60   0.723   2.095  16.003
  485    HA   ILE  60           HA       ILE  60  -0.820   1.610  14.459
  486    HB   ILE  60           HB       ILE  60  -2.616   0.331  15.009
  487   HG12  ILE  60          HG12      ILE  60  -3.479   0.872  17.627
  488   HG13  ILE  60          HG11      ILE  60  -3.272   2.447  16.881
  489   HG21  ILE  60          HG21      ILE  60  -1.185   0.279  17.652
  490   HG22  ILE  60          HG22      ILE  60  -0.562  -0.453  16.174
  491   HG23  ILE  60          HG23      ILE  60  -2.071  -1.034  16.878
  492   HD11  ILE  60          HD11      ILE  60  -4.591   0.819  15.000
  493   HD12  ILE  60          HD12      ILE  60  -5.229   2.203  15.889
  494   HD13  ILE  60          HD13      ILE  60  -5.384   0.577  16.556
  495    H    ILE  61           HN       ILE  61  -1.952   3.980  16.855
  496    HA   ILE  61           HA       ILE  61  -3.826   5.095  14.966
  497    HB   ILE  61           HB       ILE  61  -3.305   5.307  17.814
  498   HG12  ILE  61          HG12      ILE  61  -5.358   4.405  16.753
  499   HG13  ILE  61          HG11      ILE  61  -5.697   5.692  17.906
  500   HG21  ILE  61          HG21      ILE  61  -2.535   7.550  17.279
  501   HG22  ILE  61          HG22      ILE  61  -4.081   7.609  18.124
  502   HG23  ILE  61          HG23      ILE  61  -4.020   7.862  16.380
  503   HD11  ILE  61          HD11      ILE  61  -5.869   5.739  14.926
  504   HD12  ILE  61          HD12      ILE  61  -5.693   7.233  15.847
  505   HD13  ILE  61          HD13      ILE  61  -7.082   6.183  16.125
  506    H    ASP  62           HN       ASP  62  -0.656   5.927  16.256
  507    HA   ASP  62           HA       ASP  62  -0.642   8.453  14.830
  508    HB2  ASP  62           HB2      ASP  62   0.442   8.467  16.971
  509    HB3  ASP  62           HB1      ASP  62   1.404   7.055  16.557
  510    H    ALA  63           HN       ALA  63   0.625   5.223  14.579
  511    HA   ALA  63           HA       ALA  63   2.279   5.850  12.274
  512    HB1  ALA  63           HB1      ALA  63   3.375   4.206  13.351
  513    HB2  ALA  63           HB2      ALA  63   2.338   3.166  12.375
  514    HB3  ALA  63           HB3      ALA  63   1.901   3.529  14.045
  515    H    GLY  64           HN       GLY  64  -0.969   4.993  12.813
  516    HA2  GLY  64           HA2      GLY  64  -1.516   3.379  10.579
  517    HA3  GLY  64           HA1      GLY  64  -2.685   4.378  11.424
  518    H    ALA  65           HN       ALA  65  -0.412   6.532  10.489
  519    HA   ALA  65           HA       ALA  65  -2.017   7.398   8.253
  520    HB1  ALA  65           HB1      ALA  65   0.469   8.642   9.418
  521    HB2  ALA  65           HB2      ALA  65  -1.185   9.003   9.914
  522    HB3  ALA  65           HB3      ALA  65  -0.648   9.397   8.281
  523    H    SER  66           HN       SER  66  -0.013   4.984   8.214
  524    HA   SER  66           HA       SER  66   1.433   5.827   5.792
  525    HB2  SER  66           HB2      SER  66   2.743   3.598   6.400
  526    HB3  SER  66           HB1      SER  66   3.144   5.136   7.162
  527    HG   SER  66           HG       SER  66   1.332   3.249   8.256
  528    H    ILE  67           HN       ILE  67  -1.380   4.557   6.308
  529    HA   ILE  67           HA       ILE  67  -1.266   2.007   5.039
  530    HB   ILE  67           HB       ILE  67  -3.093   2.722   6.575
  531   HG12  ILE  67          HG12      ILE  67  -4.932   1.699   5.224
  532   HG13  ILE  67          HG11      ILE  67  -3.887   1.788   3.810
  533   HG21  ILE  67          HG21      ILE  67  -4.949   4.057   5.615
  534   HG22  ILE  67          HG22      ILE  67  -3.925   4.408   4.222
  535   HG23  ILE  67          HG23      ILE  67  -3.456   4.973   5.826
  536   HD11  ILE  67          HD11      ILE  67  -3.321   0.225   6.317
  537   HD12  ILE  67          HD12      ILE  67  -2.292   0.300   4.886
  538   HD13  ILE  67          HD13      ILE  67  -3.892  -0.438   4.786
  539    H    ASN  68           HN       ASN  68  -1.109   5.181   3.842
  540    HA   ASN  68           HA       ASN  68  -0.707   5.878   1.684
  541    HB2  ASN  68           HB2      ASN  68  -0.221   3.389   1.170
  542    HB3  ASN  68           HB1      ASN  68  -1.869   3.344   0.548
  543   HD21  ASN  68          1HE2      ASN  68  -1.475   3.128  -1.608
  544   HD22  ASN  68          2HE2      ASN  68  -0.613   4.289  -2.553
  545    H    VAL  69           HN       VAL  69  -3.722   4.101   2.259
  546    HA   VAL  69           HA       VAL  69  -5.254   5.584   0.386
  547    HB   VAL  69           HB       VAL  69  -7.228   4.657   1.624
  548   HG11  VAL  69          HG11      VAL  69  -6.659   2.256   1.061
  549   HG12  VAL  69          HG12      VAL  69  -5.046   2.834   0.646
  550   HG13  VAL  69          HG13      VAL  69  -6.452   3.430  -0.237
  551   HG21  VAL  69          HG21      VAL  69  -6.931   3.107   3.405
  552   HG22  VAL  69          HG22      VAL  69  -6.037   4.565   3.836
  553   HG23  VAL  69          HG23      VAL  69  -5.178   3.149   3.232
  554    H    SER  70           HN       SER  70  -4.059   6.371   3.477
  555    HA   SER  70           HA       SER  70  -6.186   8.145   4.234
  556    HB2  SER  70           HB2      SER  70  -4.130   8.957   5.781
  557    HB3  SER  70           HB1      SER  70  -5.111   7.539   6.151
  558    HG   SER  70           HG       SER  70  -3.010   6.880   6.234
  559    H    VAL  71           HN       VAL  71  -2.914   8.539   2.915
  560    HA   VAL  71           HA       VAL  71  -3.505  10.691   1.266
  561    HB   VAL  71           HB       VAL  71  -3.951  11.937   3.350
  562   HG11  VAL  71          HG11      VAL  71  -2.209  10.597   4.657
  563   HG12  VAL  71          HG12      VAL  71  -2.351  12.319   5.012
  564   HG13  VAL  71          HG13      VAL  71  -1.030  11.733   4.001
  565   HG21  VAL  71          HG21      VAL  71  -1.610  12.754   1.659
  566   HG22  VAL  71          HG22      VAL  71  -2.265  13.805   2.912
  567   HG23  VAL  71          HG23      VAL  71  -3.284  13.299   1.565
  568    H    MET  72           HN       MET  72  -1.725  11.348   0.057
  569    HA   MET  72           HA       MET  72   0.467   9.574  -0.019
  570    HB2  MET  72           HB2      MET  72   0.232  12.301  -1.308
  571    HB3  MET  72           HB1      MET  72   1.340  11.019  -1.776
  572    HG2  MET  72           HG2      MET  72  -1.561  10.413  -1.774
  573    HG3  MET  72           HG1      MET  72  -0.927  11.450  -3.052
  574    HE1  MET  72           HE1      MET  72  -1.865   7.692  -3.649
  575    HE2  MET  72           HE2      MET  72  -1.469   8.646  -5.079
  576    HE3  MET  72           HE3      MET  72  -2.408   9.367  -3.771
  577    H    LEU  73           HN       LEU  73   2.392  11.974  -0.547
  578    HA   LEU  73           HA       LEU  73   4.004  13.106   0.585
  579    HB2  LEU  73           HB2      LEU  73   2.209  12.980   3.004
  580    HB3  LEU  73           HB1      LEU  73   3.491  14.132   2.685
  581    HG   LEU  73           HG       LEU  73   1.659  14.359   0.545
  582   HD11  LEU  73          HD11      LEU  73  -0.437  14.443   1.394
  583   HD12  LEU  73          HD12      LEU  73   0.112  14.906   3.005
  584   HD13  LEU  73          HD13      LEU  73   0.222  13.224   2.484
  585   HD21  LEU  73          HD21      LEU  73   1.559  16.341   2.721
  586   HD22  LEU  73          HD22      LEU  73   1.869  16.556   0.999
  587   HD23  LEU  73          HD23      LEU  73   3.160  16.001   2.065
  588    H    GLN  74           HN       GLN  74   4.832  12.884   3.292
  589    HA   GLN  74           HA       GLN  74   5.417  10.014   3.547
  590    HB2  GLN  74           HB2      GLN  74   7.493  12.113   4.118
  591    HB3  GLN  74           HB1      GLN  74   7.718  10.386   3.877
  592    HG2  GLN  74           HG2      GLN  74   6.788  12.243   1.706
  593    HG3  GLN  74           HG1      GLN  74   8.485  11.868   2.003
  594   HE21  GLN  74          1HE2      GLN  74   7.281  11.338  -0.417
  595   HE22  GLN  74          2HE2      GLN  74   7.170   9.629  -0.639
  596    HA   PRO  75           HA       PRO  75   3.938  11.891   7.570
  597    HB2  PRO  75           HB2      PRO  75   2.192   9.539   7.653
  598    HB3  PRO  75           HB1      PRO  75   1.771  11.248   7.777
  599    HG2  PRO  75           HG2      PRO  75   1.141   9.762   5.615
  600    HG3  PRO  75           HG1      PRO  75   1.523  11.489   5.502
  601    HD2  PRO  75           HD2      PRO  75   3.252   9.119   4.891
  602    HD3  PRO  75           HD1      PRO  75   3.082  10.650   4.005
  603    H    PHE  76           HN       PHE  76   4.937   8.713   6.528
  604    HA   PHE  76           HA       PHE  76   5.594   7.918   9.264
  605    HB2  PHE  76           HB2      PHE  76   6.236   5.735   8.118
  606    HB3  PHE  76           HB1      PHE  76   4.531   6.171   8.077
  607    HD1  PHE  76           HD2      PHE  76   7.595   5.818   6.107
  608    HD2  PHE  76           HD1      PHE  76   3.451   6.778   6.014
  609    HE1  PHE  76           HE2      PHE  76   7.607   5.613   3.656
  610    HE2  PHE  76           HE1      PHE  76   3.454   6.574   3.562
  611    HZ   PHE  76           HZ       PHE  76   5.535   5.992   2.380
  612    H    ASP  77           HN       ASP  77   7.054  10.034   7.754
  613    HA   ASP  77           HA       ASP  77   9.661   8.838   7.283
  614    HB2  ASP  77           HB2      ASP  77   8.437  10.881   6.046
  615    HB3  ASP  77           HB1      ASP  77   9.323  11.789   7.269
  616    H    TYR  78           HN       TYR  78   7.994   9.902   9.951
  617    HA   TYR  78           HA       TYR  78  10.353  10.977  11.303
  618    HB2  TYR  78           HB2      TYR  78   7.510  10.777  12.311
  619    HB3  TYR  78           HB1      TYR  78   8.830  11.658  13.071
  620    HD1  TYR  78           HD1      TYR  78   6.822  11.523   9.938
  621    HD2  TYR  78           HD2      TYR  78   9.173  13.907  12.561
  622    HE1  TYR  78           HE1      TYR  78   6.211  13.529   8.652
  623    HE2  TYR  78           HE2      TYR  78   8.569  15.920  11.284
  624    HH   TYR  78           HH       TYR  78   6.083  15.931   8.939
  625    H    ASP  79           HN       ASP  79   9.214   7.985  10.707
  626    HA   ASP  79           HA       ASP  79   8.868   6.575  12.992
  627    HB2  ASP  79           HB2      ASP  79   9.930   5.999  10.357
  628    HB3  ASP  79           HB1      ASP  79  10.659   4.975  11.591
  629    HA   PRO  80           HA       PRO  80  12.627   7.614  15.285
  630    HB2  PRO  80           HB2      PRO  80  11.800   6.507  17.627
  631    HB3  PRO  80           HB1      PRO  80  11.288   8.113  17.095
  632    HG2  PRO  80           HG2      PRO  80   9.837   5.502  16.905
  633    HG3  PRO  80           HG1      PRO  80   9.215   7.096  17.367
  634    HD2  PRO  80           HD2      PRO  80   8.851   6.057  14.896
  635    HD3  PRO  80           HD1      PRO  80   9.032   7.800  15.179
  636    H    ASN  81           HN       ASN  81  13.275   5.863  13.632
  637    HA   ASN  81           HA       ASN  81  14.902   3.985  14.786
  638    HB2  ASN  81           HB2      ASN  81  12.843   2.829  15.519
  639    HB3  ASN  81           HB1      ASN  81  12.306   2.732  13.845
  640   HD21  ASN  81          1HE2      ASN  81  13.284   0.827  16.108
  641   HD22  ASN  81          2HE2      ASN  81  14.306  -0.272  15.252
  642    H    GLU  82           HN       GLU  82  16.384   3.842  13.136
  643    HA   GLU  82           HA       GLU  82  15.826   4.632  10.516
  644    HB2  GLU  82           HB2      GLU  82  18.134   3.776  10.012
  645    HB3  GLU  82           HB1      GLU  82  18.043   4.933  11.333
  646    HG2  GLU  82           HG2      GLU  82  19.242   3.478  12.501
  647    HG3  GLU  82           HG1      GLU  82  17.769   2.519  12.612
  648    H    LYS  83           HN       LYS  83  16.307   1.390  11.891
  649    HA   LYS  83           HA       LYS  83  16.118   0.024   9.436
  650    HB2  LYS  83           HB2      LYS  83  16.690  -0.793  11.913
  651    HB3  LYS  83           HB1      LYS  83  14.984  -1.220  11.902
  652    HG2  LYS  83           HG2      LYS  83  15.666  -2.326   9.590
  653    HG3  LYS  83           HG1      LYS  83  17.244  -2.378  10.379
  654    HD2  LYS  83           HD2      LYS  83  15.117  -3.241  12.153
  655    HD3  LYS  83           HD1      LYS  83  15.175  -4.207  10.677
  656    HE2  LYS  83           HE2      LYS  83  17.383  -4.887  11.078
  657    HE3  LYS  83           HE1      LYS  83  17.651  -3.613  12.267
  658    HZ1  LYS  83           HZ1      LYS  83  15.670  -4.920  13.433
  659    HZ2  LYS  83           HZ2      LYS  83  17.294  -5.321  13.678
  660    HZ3  LYS  83           HZ3      LYS  83  16.363  -6.206  12.578
  661    H    SER  84           HN       SER  84  13.725   0.878  11.891
  662    HA   SER  84           HA       SER  84  11.504  -0.081  10.324
  663    HB2  SER  84           HB2      SER  84  11.917   0.933  12.997
  664    HB3  SER  84           HB1      SER  84  10.507   1.692  12.259
  665    HG   SER  84           HG       SER  84   9.918  -0.561  11.672
  666    H    LYS  85           HN       LYS  85  13.322   2.809  10.340
  667    HA   LYS  85           HA       LYS  85  11.547   4.813   9.800
  668    HB2  LYS  85           HB2      LYS  85  13.916   5.213  10.048
  669    HB3  LYS  85           HB1      LYS  85  14.253   4.379   8.541
  670    HG2  LYS  85           HG2      LYS  85  14.018   6.269   7.418
  671    HG3  LYS  85           HG1      LYS  85  12.369   6.444   8.018
  672    HD2  LYS  85           HD2      LYS  85  12.966   8.078   9.415
  673    HD3  LYS  85           HD1      LYS  85  14.316   7.133  10.048
  674    HE2  LYS  85           HE2      LYS  85  14.380   8.649   7.443
  675    HE3  LYS  85           HE1      LYS  85  14.974   9.290   8.975
  676    HZ1  LYS  85           HZ1      LYS  85  16.525   8.019   7.262
  677    HZ2  LYS  85           HZ2      LYS  85  15.996   6.687   8.159
  678    HZ3  LYS  85           HZ3      LYS  85  16.786   7.965   8.933
  679    H    HIS  86           HN       HIS  86  13.316   4.285   6.890
  680    HA   HIS  86           HA       HIS  86  12.705   3.728   4.732
  681    HB2  HIS  86           HB2      HIS  86  11.296   1.931   5.846
  682    HB3  HIS  86           HB1      HIS  86   9.941   3.047   5.730
  683    HD1  HIS  86           HD1      HIS  86  12.561   2.257   3.093
  684    HD2  HIS  86           HD2      HIS  86   8.465   1.975   3.729
  685    HE1  HIS  86           HE1      HIS  86  11.596   1.454   0.914
  686    HE2  HIS  86           HE2      HIS  86   9.108   1.373   1.297
  687    H    LYS  87           HN       LYS  87  11.217   4.494   2.943
  688    HA   LYS  87           HA       LYS  87   9.543   6.802   3.510
  689    HB2  LYS  87           HB2      LYS  87  12.216   7.277   3.023
  690    HB3  LYS  87           HB1      LYS  87  11.495   7.470   1.431
  691    HG2  LYS  87           HG2      LYS  87   9.855   8.831   3.304
  692    HG3  LYS  87           HG1      LYS  87  11.532   9.301   3.591
  693    HD2  LYS  87           HD2      LYS  87  11.596   9.545   0.986
  694    HD3  LYS  87           HD1      LYS  87   9.842   9.670   1.154
  695    HE2  LYS  87           HE2      LYS  87  10.692  11.883   1.202
  696    HE3  LYS  87           HE1      LYS  87  10.246  11.475   2.858
  697    HZ1  LYS  87           HZ1      LYS  87  12.902  11.871   1.690
  698    HZ2  LYS  87           HZ2      LYS  87  12.751  10.750   2.948
  699    HZ3  LYS  87           HZ3      LYS  87  12.299  12.361   3.194
  700    H    PHE  88           HN       PHE  88   8.209   7.441   1.655
  701    HA   PHE  88           HA       PHE  88   7.533   5.229  -0.006
  702    HB2  PHE  88           HB2      PHE  88   6.174   7.361   0.986
  703    HB3  PHE  88           HB1      PHE  88   6.337   7.813  -0.709
  704    HD1  PHE  88           HD1      PHE  88   5.832   4.506   0.930
  705    HD2  PHE  88           HD2      PHE  88   4.307   7.454  -1.732
  706    HE1  PHE  88           HE1      PHE  88   3.960   3.015   0.359
  707    HE2  PHE  88           HE2      PHE  88   2.431   5.970  -2.307
  708    HZ   PHE  88           HZ       PHE  88   2.256   3.747  -1.261
  709    H    MET  89           HN       MET  89   8.791   8.510  -0.985
  710    HA   MET  89           HA       MET  89   8.895   7.680  -3.747
  711    HB2  MET  89           HB2      MET  89   9.357  10.171  -2.291
  712    HB3  MET  89           HB1      MET  89  10.639   9.898  -3.452
  713    HG2  MET  89           HG2      MET  89   8.811   9.643  -5.222
  714    HG3  MET  89           HG1      MET  89   7.680  10.233  -4.008
  715    HE1  MET  89           HE1      MET  89   7.559  13.606  -5.635
  716    HE2  MET  89           HE2      MET  89   6.996  11.963  -5.926
  717    HE3  MET  89           HE3      MET  89   8.263  12.655  -6.939
  718    H    VAL  90           HN       VAL  90  11.101   7.914  -1.066
  719    HA   VAL  90           HA       VAL  90  13.491   7.133  -2.431
  720    HB   VAL  90           HB       VAL  90  12.906   8.346  -0.000
  721   HG11  VAL  90          HG11      VAL  90  13.932   7.084   1.724
  722   HG12  VAL  90          HG12      VAL  90  14.469   5.843   0.592
  723   HG13  VAL  90          HG13      VAL  90  12.753   6.019   0.958
  724   HG21  VAL  90          HG21      VAL  90  15.357   7.520  -1.466
  725   HG22  VAL  90          HG22      VAL  90  15.529   8.147   0.174
  726   HG23  VAL  90          HG23      VAL  90  14.761   9.133  -1.071
  727    H    GLN  91           HN       GLN  91  10.900   5.288  -1.253
  728    HA   GLN  91           HA       GLN  91  12.036   3.125  -0.007
  729    HB2  GLN  91           HB2      GLN  91  10.027   1.944  -0.405
  730    HB3  GLN  91           HB1      GLN  91   9.591   3.637  -0.283
  731    HG2  GLN  91           HG2      GLN  91   9.501   3.782  -2.728
  732    HG3  GLN  91           HG1      GLN  91   9.894   2.067  -2.827
  733   HE21  GLN  91          1HE2      GLN  91   8.188   0.897  -3.282
  734   HE22  GLN  91          2HE2      GLN  91   6.581   1.157  -2.702
  735    H    SER  92           HN       SER  92  12.471   3.763  -3.374
  736    HA   SER  92           HA       SER  92  12.535   1.151  -4.371
  737    HB2  SER  92           HB2      SER  92  14.567   2.824  -5.599
  738    HB3  SER  92           HB1      SER  92  13.082   2.170  -6.288
  739    HG   SER  92           HG       SER  92  11.969   3.920  -5.277
  740    H    MET  93           HN       MET  93  15.010   2.857  -2.547
  741    HA   MET  93           HA       MET  93  17.111   1.029  -3.159
  742    HB2  MET  93           HB2      MET  93  16.785   3.461  -1.536
  743    HB3  MET  93           HB1      MET  93  17.963   2.313  -0.914
  744    HG2  MET  93           HG2      MET  93  19.333   2.513  -2.757
  745    HG3  MET  93           HG1      MET  93  18.033   3.101  -3.790
  746    HE1  MET  93           HE1      MET  93  20.512   4.069  -4.113
  747    HE2  MET  93           HE2      MET  93  21.280   5.165  -2.964
  748    HE3  MET  93           HE3      MET  93  20.247   5.809  -4.240
  749    H    PHE  94           HN       PHE  94  15.098   1.620  -0.301
  750    HA   PHE  94           HA       PHE  94  16.114  -0.081   1.533
  751    HB2  PHE  94           HB2      PHE  94  14.174   1.282   2.005
  752    HB3  PHE  94           HB1      PHE  94  13.195   0.346   0.881
  753    HD1  PHE  94           HD1      PHE  94  12.684  -2.042   1.414
  754    HD2  PHE  94           HD2      PHE  94  14.445   0.606   4.239
  755    HE1  PHE  94           HE1      PHE  94  12.023  -3.554   3.235
  756    HE2  PHE  94           HE2      PHE  94  13.786  -0.902   6.070
  757    HZ   PHE  94           HZ       PHE  94  12.573  -2.986   5.569
  758    H    ALA  95           HN       ALA  95  14.464  -0.996  -1.388
  759    HA   ALA  95           HA       ALA  95  15.461  -3.467  -1.731
  760    HB1  ALA  95           HB1      ALA  95  13.530  -3.542   0.453
  761    HB2  ALA  95           HB2      ALA  95  14.754  -4.718  -0.021
  762    HB3  ALA  95           HB3      ALA  95  13.186  -4.707  -0.826
  763    HA   PRO  96           HA       PRO  96  10.963  -3.656  -3.814
  764    HB2  PRO  96           HB2      PRO  96  10.279  -0.839  -3.071
  765    HB3  PRO  96           HB1      PRO  96   9.209  -2.215  -3.373
  766    HG2  PRO  96           HG2      PRO  96   9.747  -1.461  -0.889
  767    HG3  PRO  96           HG1      PRO  96   9.651  -3.180  -1.308
  768    HD2  PRO  96           HD2      PRO  96  12.026  -1.504  -0.717
  769    HD3  PRO  96           HD1      PRO  96  11.764  -3.234  -0.435
  770    H    THR  97           HN       THR  97  12.762  -3.596  -5.380
  771    HA   THR  97           HA       THR  97  13.675  -1.228  -6.606
  772    HB   THR  97           HB       THR  97  13.420  -3.999  -7.799
  773    HG1  THR  97           HG1      THR  97  15.574  -4.216  -7.119
  774   HG21  THR  97          HG21      THR  97  15.668  -2.368  -8.645
  775   HG22  THR  97          HG22      THR  97  14.108  -1.708  -9.137
  776   HG23  THR  97          HG23      THR  97  14.554  -3.352  -9.594
  777    H    ASP  98           HN       ASP  98  10.749  -2.952  -6.765
  778    HA   ASP  98           HA       ASP  98   9.750  -2.417  -9.277
  779    HB2  ASP  98           HB2      ASP  98   7.573  -2.831  -8.357
  780    HB3  ASP  98           HB1      ASP  98   8.716  -3.905  -7.557
  781    H    THR  99           HN       THR  99  10.333  -0.180  -6.718
  782    HA   THR  99           HA       THR  99   8.317   1.689  -7.136
  783    HB   THR  99           HB       THR  99  11.178   2.437  -6.536
  784    HG1  THR  99           HG1      THR  99  10.734   0.845  -5.094
  785   HG21  THR  99          HG21      THR  99   9.924   4.399  -6.689
  786   HG22  THR  99          HG22      THR  99   9.986   4.035  -4.964
  787   HG23  THR  99          HG23      THR  99   8.529   3.674  -5.889
  788    H    SER 100           HN       SER 100  11.480   1.474  -8.776
  789    HA   SER 100           HA       SER 100  10.924   3.657 -10.542
  790    HB2  SER 100           HB2      SER 100  12.895   1.384 -10.928
  791    HB3  SER 100           HB1      SER 100  12.912   2.940 -11.757
  792    HG   SER 100           HG       SER 100  13.355   2.447  -9.000
  793    H    ASP 101           HN       ASP 101  10.350   0.259 -10.486
  794    HA   ASP 101           HA       ASP 101   9.667  -0.129 -13.203
  795    HB2  ASP 101           HB2      ASP 101   8.864  -1.755 -10.787
  796    HB3  ASP 101           HB1      ASP 101   8.781  -2.279 -12.465
  797    H    MET 102           HN       MET 102   7.929   1.257 -10.554
  798    HA   MET 102           HA       MET 102   5.331   0.530 -11.137
  799    HB2  MET 102           HB2      MET 102   4.601   2.335  -9.824
  800    HB3  MET 102           HB1      MET 102   6.179   1.931  -9.175
  801    HG2  MET 102           HG2      MET 102   6.921   3.992  -9.521
  802    HG3  MET 102           HG1      MET 102   6.425   3.957 -11.210
  803    HE1  MET 102           HE1      MET 102   5.277   7.207  -9.115
  804    HE2  MET 102           HE2      MET 102   6.679   6.150  -8.962
  805    HE3  MET 102           HE3      MET 102   5.376   6.064  -7.775
  806    H    GLU 103           HN       GLU 103   7.350   2.857 -12.807
  807    HA   GLU 103           HA       GLU 103   5.209   3.964 -14.353
  808    HB2  GLU 103           HB2      GLU 103   7.487   5.039 -13.867
  809    HB3  GLU 103           HB1      GLU 103   8.118   3.992 -15.130
  810    HG2  GLU 103           HG2      GLU 103   6.412   4.984 -16.673
  811    HG3  GLU 103           HG1      GLU 103   6.046   6.151 -15.402
  812    H    ALA 104           HN       ALA 104   7.878   1.765 -15.131
  813    HA   ALA 104           HA       ALA 104   6.935   1.132 -17.721
  814    HB1  ALA 104           HB1      ALA 104   8.806  -0.656 -16.249
  815    HB2  ALA 104           HB2      ALA 104   9.313   0.976 -16.687
  816    HB3  ALA 104           HB3      ALA 104   8.814  -0.159 -17.941
  817    H    VAL 105           HN       VAL 105   6.254  -0.312 -14.600
  818    HA   VAL 105           HA       VAL 105   5.614  -2.884 -15.415
  819    HB   VAL 105           HB       VAL 105   4.047  -2.968 -13.457
  820   HG11  VAL 105          HG11      VAL 105   6.924  -2.335 -13.406
  821   HG12  VAL 105          HG12      VAL 105   6.058  -3.743 -12.795
  822   HG13  VAL 105          HG13      VAL 105   6.083  -2.249 -11.859
  823   HG21  VAL 105          HG21      VAL 105   4.847  -0.086 -13.286
  824   HG22  VAL 105          HG22      VAL 105   4.337  -0.993 -11.866
  825   HG23  VAL 105          HG23      VAL 105   3.231  -0.786 -13.223
  826    H    TRP 106           HN       TRP 106   3.790   0.041 -15.941
  827    HA   TRP 106           HA       TRP 106   1.358  -1.427 -16.539
  828    HB2  TRP 106           HB2      TRP 106   1.195   0.819 -15.562
  829    HB3  TRP 106           HB1      TRP 106   2.047   1.498 -16.945
  830    HD1  TRP 106           HD1      TRP 106   0.339   2.824 -18.307
  831    HE1  TRP 106           HE1      TRP 106  -2.053   2.419 -19.169
  832    HE3  TRP 106           HE3      TRP 106  -0.562  -1.704 -16.109
  833    HZ2  TRP 106           HZ2      TRP 106  -4.056   0.443 -18.945
  834    HZ3  TRP 106           HZ3      TRP 106  -2.741  -2.784 -16.484
  835    HH2  TRP 106           HH2      TRP 106  -4.451  -1.731 -17.872
  836    H    LYS 107           HN       LYS 107   4.072  -0.068 -18.263
  837    HA   LYS 107           HA       LYS 107   2.811  -0.556 -20.844
  838    HB2  LYS 107           HB2      LYS 107   5.388   0.741 -19.993
  839    HB3  LYS 107           HB1      LYS 107   5.094   0.314 -21.673
  840    HG2  LYS 107           HG2      LYS 107   3.116   1.739 -21.700
  841    HG3  LYS 107           HG1      LYS 107   3.389   2.153 -20.005
  842    HD2  LYS 107           HD2      LYS 107   5.812   2.731 -21.120
  843    HD3  LYS 107           HD1      LYS 107   4.705   3.149 -22.429
  844    HE2  LYS 107           HE2      LYS 107   5.068   5.097 -21.070
  845    HE3  LYS 107           HE1      LYS 107   3.414   4.535 -20.829
  846    HZ1  LYS 107           HZ1      LYS 107   4.631   3.238 -18.872
  847    HZ2  LYS 107           HZ2      LYS 107   3.995   4.794 -18.678
  848    HZ3  LYS 107           HZ3      LYS 107   5.649   4.586 -18.964
  849    H    GLU 108           HN       GLU 108   5.330  -1.845 -18.773
  850    HA   GLU 108           HA       GLU 108   6.354  -3.656 -20.753
  851    HB2  GLU 108           HB2      GLU 108   6.864  -3.137 -17.871
  852    HB3  GLU 108           HB1      GLU 108   7.308  -4.714 -18.501
  853    HG2  GLU 108           HG2      GLU 108   9.125  -2.985 -18.497
  854    HG3  GLU 108           HG1      GLU 108   8.833  -3.793 -20.037
  855    H    ALA 109           HN       ALA 109   3.508  -3.658 -19.048
  856    HA   ALA 109           HA       ALA 109   1.827  -5.213 -19.046
  857    HB1  ALA 109           HB1      ALA 109   2.022  -7.318 -20.058
  858    HB2  ALA 109           HB2      ALA 109   3.766  -7.373 -19.808
  859    HB3  ALA 109           HB3      ALA 109   3.080  -6.265 -20.995
  860    H    LYS 110           HN       LYS 110   1.154  -7.177 -17.808
  861    HA   LYS 110           HA       LYS 110   1.799  -6.913 -15.140
  862    HB2  LYS 110           HB2      LYS 110  -0.251  -7.970 -15.927
  863    HB3  LYS 110           HB1      LYS 110   0.668  -9.340 -16.531
  864    HG2  LYS 110           HG2      LYS 110   1.026  -8.695 -13.677
  865    HG3  LYS 110           HG1      LYS 110  -0.558  -9.309 -14.153
  866    HD2  LYS 110           HD2      LYS 110   2.014 -10.662 -14.936
  867    HD3  LYS 110           HD1      LYS 110   1.159 -11.037 -13.438
  868    HE2  LYS 110           HE2      LYS 110  -0.142 -12.441 -14.562
  869    HE3  LYS 110           HE1      LYS 110  -0.753 -11.089 -15.514
  870    HZ1  LYS 110           HZ1      LYS 110   0.530 -11.629 -17.266
  871    HZ2  LYS 110           HZ2      LYS 110   0.507 -13.171 -16.571
  872    HZ3  LYS 110           HZ3      LYS 110   1.831 -12.149 -16.316
  873    HA   PRO 111           HA       PRO 111   4.554 -11.041 -15.705
  874    HB2  PRO 111           HB2      PRO 111   5.776 -10.006 -18.233
  875    HB3  PRO 111           HB1      PRO 111   5.531 -11.675 -17.702
  876    HG2  PRO 111           HG2      PRO 111   3.909 -10.600 -19.503
  877    HG3  PRO 111           HG1      PRO 111   3.266 -11.648 -18.224
  878    HD2  PRO 111           HD2      PRO 111   3.128  -8.686 -18.498
  879    HD3  PRO 111           HD1      PRO 111   1.946  -9.812 -17.802
  880    H    GLU 112           HN       GLU 112   5.350  -7.737 -16.632
  881    HA   GLU 112           HA       GLU 112   8.054  -7.861 -15.723
  882    HB2  GLU 112           HB2      GLU 112   6.969  -6.228 -17.414
  883    HB3  GLU 112           HB1      GLU 112   6.500  -5.309 -15.990
  884    HG2  GLU 112           HG2      GLU 112   9.315  -6.093 -16.021
  885    HG3  GLU 112           HG1      GLU 112   8.847  -5.034 -17.350
  886    H    ASP 113           HN       ASP 113   5.091  -6.419 -14.364
  887    HA   ASP 113           HA       ASP 113   6.322  -5.479 -12.003
  888    HB2  ASP 113           HB2      ASP 113   3.828  -5.697 -11.129
  889    HB3  ASP 113           HB1      ASP 113   4.297  -4.444 -12.267
  890    H    LEU 114           HN       LEU 114   4.916  -8.589 -12.833
  891    HA   LEU 114           HA       LEU 114   4.600  -9.691 -10.308
  892    HB2  LEU 114           HB2      LEU 114   3.944 -10.741 -12.479
  893    HB3  LEU 114           HB1      LEU 114   5.632 -11.135 -12.749
  894    HG   LEU 114           HG       LEU 114   5.279 -12.267 -10.324
  895   HD11  LEU 114          HD11      LEU 114   3.182 -12.977  -9.877
  896   HD12  LEU 114          HD12      LEU 114   2.741 -13.099 -11.581
  897   HD13  LEU 114          HD13      LEU 114   2.749 -11.526 -10.783
  898   HD21  LEU 114          HD21      LEU 114   6.208 -13.692 -11.816
  899   HD22  LEU 114          HD22      LEU 114   5.113 -13.221 -13.115
  900   HD23  LEU 114          HD23      LEU 114   4.568 -14.339 -11.865
  901    H    MET 115           HN       MET 115   7.504  -9.282 -12.240
  902    HA   MET 115           HA       MET 115   9.197 -10.799 -10.513
  903    HB2  MET 115           HB2      MET 115   9.423  -9.833 -13.063
  904    HB3  MET 115           HB1      MET 115  10.477  -8.742 -12.175
  905    HG2  MET 115           HG2      MET 115  11.809 -10.554 -11.386
  906    HG3  MET 115           HG1      MET 115  10.669 -11.738 -12.021
  907    HE1  MET 115           HE1      MET 115  13.363  -8.998 -12.964
  908    HE2  MET 115           HE2      MET 115  11.866  -8.425 -13.698
  909    HE3  MET 115           HE3      MET 115  13.194  -8.974 -14.720
  910    H    ASP 116           HN       ASP 116   8.360  -7.377 -10.805
  911    HA   ASP 116           HA       ASP 116  10.336  -6.484  -8.946
  912    HB2  ASP 116           HB2      ASP 116   7.844  -4.915  -9.481
  913    HB3  ASP 116           HB1      ASP 116   9.501  -4.354  -9.288
  914    H    SER 117           HN       SER 117   7.068  -7.628  -8.789
  915    HA   SER 117           HA       SER 117   6.442  -6.736  -6.168
  916    HB2  SER 117           HB2      SER 117   5.356  -9.145  -7.596
  917    HB3  SER 117           HB1      SER 117   4.552  -8.201  -6.341
  918    HG   SER 117           HG       SER 117   4.392  -6.485  -7.791
  919    H    LYS 118           HN       LYS 118   7.641  -9.780  -7.514
  920    HA   LYS 118           HA       LYS 118   7.689 -11.246  -5.121
  921    HB2  LYS 118           HB2      LYS 118   8.296 -11.769  -7.755
  922    HB3  LYS 118           HB1      LYS 118   9.876 -11.847  -6.988
  923    HG2  LYS 118           HG2      LYS 118   9.366 -13.714  -5.805
  924    HG3  LYS 118           HG1      LYS 118   7.658 -13.295  -5.666
  925    HD2  LYS 118           HD2      LYS 118   7.140 -14.535  -7.442
  926    HD3  LYS 118           HD1      LYS 118   8.379 -13.749  -8.421
  927    HE2  LYS 118           HE2      LYS 118   8.843 -16.102  -8.340
  928    HE3  LYS 118           HE1      LYS 118  10.067 -15.253  -7.398
  929    HZ1  LYS 118           HZ1      LYS 118   8.055 -17.143  -6.536
  930    HZ2  LYS 118           HZ2      LYS 118   8.230 -15.796  -5.529
  931    HZ3  LYS 118           HZ3      LYS 118   9.563 -16.782  -5.860
  932    H    LEU 119           HN       LEU 119   9.795  -8.869  -6.480
  933    HA   LEU 119           HA       LEU 119  12.043  -9.386  -4.784
  934    HB2  LEU 119           HB2      LEU 119  12.019  -8.146  -7.014
  935    HB3  LEU 119           HB1      LEU 119  11.415  -6.765  -6.117
  936    HG   LEU 119           HG       LEU 119  13.585  -7.337  -4.632
  937   HD11  LEU 119          HD11      LEU 119  14.649  -9.027  -5.718
  938   HD12  LEU 119          HD12      LEU 119  15.355  -7.658  -6.577
  939   HD13  LEU 119          HD13      LEU 119  14.021  -8.559  -7.298
  940   HD21  LEU 119          HD21      LEU 119  14.340  -5.797  -6.983
  941   HD22  LEU 119          HD22      LEU 119  14.200  -5.298  -5.298
  942   HD23  LEU 119          HD23      LEU 119  12.771  -5.328  -6.330
  943    H    ARG 120           HN       ARG 120   9.522  -6.872  -4.758
  944    HA   ARG 120           HA       ARG 120  10.389  -5.773  -2.272
  945    HB2  ARG 120           HB2      ARG 120   8.485  -4.331  -2.416
  946    HB3  ARG 120           HB1      ARG 120   9.168  -4.489  -4.026
  947    HG2  ARG 120           HG2      ARG 120   7.171  -5.053  -4.784
  948    HG3  ARG 120           HG1      ARG 120   7.224  -6.506  -3.787
  949    HD2  ARG 120           HD2      ARG 120   5.969  -5.565  -2.105
  950    HD3  ARG 120           HD1      ARG 120   6.451  -3.921  -2.526
  951    HE   ARG 120           HE       ARG 120   4.814  -5.246  -4.502
  952   HH11  ARG 120          HH11      ARG 120   4.845  -3.220  -1.657
  953   HH12  ARG 120          HH12      ARG 120   3.286  -2.537  -1.977
  954   HH21  ARG 120          HH21      ARG 120   2.764  -4.348  -4.920
  955   HH22  ARG 120          HH22      ARG 120   2.105  -3.177  -3.827
  956    H    CYS 121           HN       CYS 121   8.021  -8.169  -3.212
  957    HA   CYS 121           HA       CYS 121   6.610  -8.275  -0.767
  958    HB2  CYS 121           HB2      CYS 121   6.911 -10.204  -3.057
  959    HB3  CYS 121           HB1      CYS 121   5.950 -10.598  -1.636
  960    HG   CYS 121           HG       CYS 121   5.192  -8.545  -3.802
  961    H    VAL 122           HN       VAL 122   9.480  -9.961  -1.936
  962    HA   VAL 122           HA       VAL 122   9.569 -11.786   0.269
  963    HB   VAL 122           HB       VAL 122  10.613 -12.351  -1.877
  964   HG11  VAL 122          HG11      VAL 122  11.422 -10.142  -2.503
  965   HG12  VAL 122          HG12      VAL 122  12.728 -11.324  -2.544
  966   HG13  VAL 122          HG13      VAL 122  12.606 -10.192  -1.199
  967   HG21  VAL 122          HG21      VAL 122  12.932 -12.246  -0.031
  968   HG22  VAL 122          HG22      VAL 122  12.264 -13.603  -0.938
  969   HG23  VAL 122          HG23      VAL 122  11.472 -13.054   0.539
  970    H    PHE 123           HN       PHE 123  11.231  -8.759  -0.524
  971    HA   PHE 123           HA       PHE 123  12.893  -8.766   1.783
  972    HB2  PHE 123           HB2      PHE 123  12.356  -6.985  -0.467
  973    HB3  PHE 123           HB1      PHE 123  12.644  -6.109   1.034
  974    HD1  PHE 123           HD1      PHE 123  14.787  -6.304   2.194
  975    HD2  PHE 123           HD2      PHE 123  14.103  -8.207  -1.551
  976    HE1  PHE 123           HE1      PHE 123  17.211  -6.612   1.912
  977    HE2  PHE 123           HE2      PHE 123  16.526  -8.519  -1.839
  978    HZ   PHE 123           HZ       PHE 123  18.084  -7.722  -0.106
  979    H    GLU 124           HN       GLU 124   9.684  -7.549   1.086
  980    HA   GLU 124           HA       GLU 124   9.423  -5.911   3.384
  981    HB2  GLU 124           HB2      GLU 124   7.990  -5.816   1.311
  982    HB3  GLU 124           HB1      GLU 124   7.188  -7.272   1.880
  983    HG2  GLU 124           HG2      GLU 124   6.744  -5.920   4.027
  984    HG3  GLU 124           HG1      GLU 124   7.129  -4.516   3.033
  985    H    LEU 125           HN       LEU 125   8.574  -9.276   2.707
  986    HA   LEU 125           HA       LEU 125   8.173 -11.043   4.085
  987    HB2  LEU 125           HB2      LEU 125   9.793  -9.258   5.667
  988    HB3  LEU 125           HB1      LEU 125   8.631 -10.080   6.689
  989    HG   LEU 125           HG       LEU 125  10.670 -11.342   6.675
  990   HD11  LEU 125          HD11      LEU 125   9.639 -13.365   5.135
  991   HD12  LEU 125          HD12      LEU 125   8.210 -12.413   5.536
  992   HD13  LEU 125          HD13      LEU 125   9.236 -13.045   6.821
  993   HD21  LEU 125          HD21      LEU 125  11.120 -10.367   4.213
  994   HD22  LEU 125          HD22      LEU 125  10.573 -11.992   3.799
  995   HD23  LEU 125          HD23      LEU 125  11.956 -11.775   4.871
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1 -12.680  12.682   0.842
    2    H2   MET   1           HT2      MET   1 -11.872  11.227   0.424
    3    H3   MET   1           HT3      MET   1 -13.393  11.599  -0.279
    4    HA   MET   1           HA       MET   1 -12.540  13.281  -1.559
    5    HB2  MET   1           HB2      MET   1 -10.558  13.316   0.589
    6    HB3  MET   1           HB1      MET   1  -9.834  13.506  -1.002
    7    HG2  MET   1           HG2      MET   1 -12.219  15.147  -0.464
    8    HG3  MET   1           HG1      MET   1 -10.777  15.540   0.469
    9    HE1  MET   1           HE1      MET   1 -11.968  14.540  -3.020
   10    HE2  MET   1           HE2      MET   1 -10.287  14.068  -3.263
   11    HE3  MET   1           HE3      MET   1 -10.944  15.458  -4.126
   12    H    ALA   2           HN       ALA   2 -12.670  10.396  -1.694
   13    HA   ALA   2           HA       ALA   2 -10.310   9.781  -3.342
   14    HB1  ALA   2           HB1      ALA   2 -12.129   8.102  -1.686
   15    HB2  ALA   2           HB2      ALA   2 -10.370   8.083  -1.804
   16    HB3  ALA   2           HB3      ALA   2 -11.347   7.380  -3.093
   17    H    LYS   3           HN       LYS   3 -10.670  10.193  -5.427
   18    HA   LYS   3           HA       LYS   3 -13.163  10.447  -6.653
   19    HB2  LYS   3           HB2      LYS   3 -10.974  11.296  -7.530
   20    HB3  LYS   3           HB1      LYS   3 -10.605   9.655  -8.037
   21    HG2  LYS   3           HG2      LYS   3 -12.636   9.686  -9.452
   22    HG3  LYS   3           HG1      LYS   3 -12.879  11.375  -9.003
   23    HD2  LYS   3           HD2      LYS   3 -10.195  11.092  -9.875
   24    HD3  LYS   3           HD1      LYS   3 -11.230  10.291 -11.058
   25    HE2  LYS   3           HE2      LYS   3 -11.319  12.406 -11.889
   26    HE3  LYS   3           HE1      LYS   3 -12.656  12.505 -10.743
   27    HZ1  LYS   3           HZ1      LYS   3 -11.455  13.794  -9.310
   28    HZ2  LYS   3           HZ2      LYS   3 -10.801  14.316 -10.780
   29    HZ3  LYS   3           HZ3      LYS   3  -9.956  13.201  -9.829
   30    H    VAL   4           HN       VAL   4 -14.632   8.919  -6.717
   31    HA   VAL   4           HA       VAL   4 -14.286   6.194  -6.490
   32    HB   VAL   4           HB       VAL   4 -16.516   7.486  -8.056
   33   HG11  VAL   4          HG11      VAL   4 -17.826   5.579  -7.194
   34   HG12  VAL   4          HG12      VAL   4 -16.355   4.925  -6.475
   35   HG13  VAL   4          HG13      VAL   4 -16.487   5.077  -8.226
   36   HG21  VAL   4          HG21      VAL   4 -16.050   7.296  -5.098
   37   HG22  VAL   4          HG22      VAL   4 -17.676   7.418  -5.769
   38   HG23  VAL   4          HG23      VAL   4 -16.503   8.703  -6.060
   39    H    GLU   5           HN       GLU   5 -14.474   8.125  -9.470
   40    HA   GLU   5           HA       GLU   5 -14.437   5.932 -11.244
   41    HB2  GLU   5           HB2      GLU   5 -14.833   8.582 -11.547
   42    HB3  GLU   5           HB1      GLU   5 -13.182   8.460 -12.138
   43    HG2  GLU   5           HG2      GLU   5 -14.154   6.483 -13.547
   44    HG3  GLU   5           HG1      GLU   5 -15.687   7.303 -13.252
   45    H    GLN   6           HN       GLN   6 -11.799   8.059 -10.128
   46    HA   GLN   6           HA       GLN   6  -9.776   6.624 -11.532
   47    HB2  GLN   6           HB2      GLN   6  -9.876   8.842  -9.580
   48    HB3  GLN   6           HB1      GLN   6  -8.393   7.902  -9.575
   49    HG2  GLN   6           HG2      GLN   6  -8.371   8.288 -12.109
   50    HG3  GLN   6           HG1      GLN   6  -9.572   9.537 -11.792
   51   HE21  GLN   6          1HE2      GLN   6  -8.472  11.387 -12.128
   52   HE22  GLN   6          2HE2      GLN   6  -7.002  11.823 -11.329
   53    H    VAL   7           HN       VAL   7 -11.147   6.441  -8.322
   54    HA   VAL   7           HA       VAL   7  -9.192   4.559  -7.351
   55    HB   VAL   7           HB       VAL   7 -11.775   5.463  -6.080
   56   HG11  VAL   7          HG11      VAL   7  -9.437   3.886  -5.028
   57   HG12  VAL   7          HG12      VAL   7 -11.138   3.422  -5.064
   58   HG13  VAL   7          HG13      VAL   7 -10.596   4.702  -3.979
   59   HG21  VAL   7          HG21      VAL   7  -9.063   6.387  -5.241
   60   HG22  VAL   7          HG22      VAL   7 -10.631   7.168  -5.034
   61   HG23  VAL   7          HG23      VAL   7  -9.856   7.152  -6.619
   62    H    LEU   8           HN       LEU   8 -12.172   4.285  -9.069
   63    HA   LEU   8           HA       LEU   8 -13.217   1.925  -8.032
   64    HB2  LEU   8           HB2      LEU   8 -14.346   3.316  -9.722
   65    HB3  LEU   8           HB1      LEU   8 -13.184   2.791 -10.924
   66    HG   LEU   8           HG       LEU   8 -14.074   0.395 -10.209
   67   HD11  LEU   8          HD11      LEU   8 -16.528   0.526  -9.833
   68   HD12  LEU   8          HD12      LEU   8 -16.348   2.259  -9.559
   69   HD13  LEU   8          HD13      LEU   8 -15.564   1.107  -8.476
   70   HD21  LEU   8          HD21      LEU   8 -15.426   0.403 -12.143
   71   HD22  LEU   8          HD22      LEU   8 -14.134   1.565 -12.452
   72   HD23  LEU   8          HD23      LEU   8 -15.743   2.133 -12.006
   73    H    SER   9           HN       SER   9 -10.855   2.300 -10.668
   74    HA   SER   9           HA       SER   9  -9.385   0.846 -11.621
   75    HB2  SER   9           HB2      SER   9  -8.812  -0.882  -9.432
   76    HB3  SER   9           HB1      SER   9  -7.877   0.494 -10.014
   77    HG   SER   9           HG       SER   9  -9.841   0.414  -7.980
   78    H    LEU  10           HN       LEU  10 -12.382  -0.234 -11.006
   79    HA   LEU  10           HA       LEU  10 -11.881  -3.065 -11.241
   80    HB2  LEU  10           HB2      LEU  10 -14.295  -1.401 -10.857
   81    HB3  LEU  10           HB1      LEU  10 -14.499  -2.969 -11.618
   82    HG   LEU  10           HG       LEU  10 -12.999  -3.706  -9.518
   83   HD11  LEU  10          HD11      LEU  10 -13.791  -1.038  -8.902
   84   HD12  LEU  10          HD12      LEU  10 -12.859  -2.172  -7.925
   85   HD13  LEU  10          HD13      LEU  10 -14.618  -2.144  -7.806
   86   HD21  LEU  10          HD21      LEU  10 -15.877  -3.362  -8.919
   87   HD22  LEU  10          HD22      LEU  10 -14.860  -4.801  -8.827
   88   HD23  LEU  10          HD23      LEU  10 -15.462  -4.244 -10.389
   89    H    GLU  11           HN       GLU  11 -12.289  -0.488 -13.478
   90    HA   GLU  11           HA       GLU  11 -13.579  -1.901 -15.556
   91    HB2  GLU  11           HB2      GLU  11 -12.627   0.674 -15.226
   92    HB3  GLU  11           HB1      GLU  11 -11.566   0.024 -16.468
   93    HG2  GLU  11           HG2      GLU  11 -13.235   0.879 -17.759
   94    HG3  GLU  11           HG1      GLU  11 -13.822  -0.767 -17.539
   95    HA   PRO  12           HA       PRO  12  -9.292  -3.417 -16.858
   96    HB2  PRO  12           HB2      PRO  12  -7.068  -2.427 -15.766
   97    HB3  PRO  12           HB1      PRO  12  -7.988  -1.471 -16.935
   98    HG2  PRO  12           HG2      PRO  12  -7.777  -1.161 -13.994
   99    HG3  PRO  12           HG1      PRO  12  -8.091   0.062 -15.235
  100    HD2  PRO  12           HD2      PRO  12  -9.997  -1.292 -13.580
  101    HD3  PRO  12           HD1      PRO  12 -10.318  -0.110 -14.862
  102    H    GLN  13           HN       GLN  13  -9.094  -5.523 -16.114
  103    HA   GLN  13           HA       GLN  13  -9.423  -6.176 -13.401
  104    HB2  GLN  13           HB2      GLN  13  -9.523  -7.613 -15.664
  105    HB3  GLN  13           HB1      GLN  13  -7.903  -8.057 -15.147
  106    HG2  GLN  13           HG2      GLN  13  -9.353  -8.355 -12.847
  107    HG3  GLN  13           HG1      GLN  13 -10.496  -8.860 -14.091
  108   HE21  GLN  13          1HE2      GLN  13 -10.483 -10.962 -14.363
  109   HE22  GLN  13          2HE2      GLN  13  -9.101 -11.996 -14.297
  110    H    HIS  14           HN       HIS  14  -6.657  -5.142 -15.184
  111    HA   HIS  14           HA       HIS  14  -4.495  -4.754 -14.612
  112    HB2  HIS  14           HB2      HIS  14  -5.905  -4.715 -11.981
  113    HB3  HIS  14           HB1      HIS  14  -4.146  -4.656 -11.998
  114    HD1  HIS  14           HD1      HIS  14  -5.334  -2.949 -14.922
  115    HD2  HIS  14           HD2      HIS  14  -4.893  -1.975 -10.906
  116    HE1  HIS  14           HE1      HIS  14  -5.370  -0.437 -14.832
  117    HE2  HIS  14           HE2      HIS  14  -5.009   0.131 -12.404
  118    H    GLU  15           HN       GLU  15  -2.738  -5.965 -14.659
  119    HA   GLU  15           HA       GLU  15  -2.425  -8.278 -12.956
  120    HB2  GLU  15           HB2      GLU  15  -2.596  -8.528 -15.962
  121    HB3  GLU  15           HB1      GLU  15  -1.899  -9.764 -14.924
  122    HG2  GLU  15           HG2      GLU  15  -4.186  -9.638 -13.694
  123    HG3  GLU  15           HG1      GLU  15  -4.741  -8.902 -15.196
  124    H    LEU  16           HN       LEU  16  -0.729  -6.835 -12.209
  125    HA   LEU  16           HA       LEU  16   1.664  -7.025 -13.904
  126    HB2  LEU  16           HB2      LEU  16   1.131  -4.618 -12.189
  127    HB3  LEU  16           HB1      LEU  16   2.329  -4.810 -13.452
  128    HG   LEU  16           HG       LEU  16  -0.476  -5.067 -14.331
  129   HD11  LEU  16          HD11      LEU  16   0.512  -2.694 -12.894
  130   HD12  LEU  16          HD12      LEU  16  -1.137  -3.256 -13.166
  131   HD13  LEU  16          HD13      LEU  16  -0.281  -2.385 -14.438
  132   HD21  LEU  16          HD21      LEU  16   1.161  -5.138 -16.012
  133   HD22  LEU  16          HD22      LEU  16   2.043  -3.771 -15.330
  134   HD23  LEU  16          HD23      LEU  16   0.481  -3.513 -16.107
  135    H    LYS  17           HN       LYS  17   1.027  -5.686 -10.649
  136    HA   LYS  17           HA       LYS  17   2.768  -7.766  -9.529
  137    HB2  LYS  17           HB2      LYS  17   3.908  -6.075  -8.145
  138    HB3  LYS  17           HB1      LYS  17   4.175  -5.810  -9.863
  139    HG2  LYS  17           HG2      LYS  17   2.715  -3.963  -9.909
  140    HG3  LYS  17           HG1      LYS  17   2.051  -4.351  -8.323
  141    HD2  LYS  17           HD2      LYS  17   4.965  -3.747  -8.642
  142    HD3  LYS  17           HD1      LYS  17   3.787  -2.438  -8.535
  143    HE2  LYS  17           HE2      LYS  17   2.948  -3.559  -6.421
  144    HE3  LYS  17           HE1      LYS  17   4.393  -4.567  -6.498
  145    HZ1  LYS  17           HZ1      LYS  17   4.288  -2.245  -5.211
  146    HZ2  LYS  17           HZ2      LYS  17   4.828  -1.704  -6.720
  147    HZ3  LYS  17           HZ3      LYS  17   5.713  -2.872  -5.876
  148    H    PHE  18           HN       PHE  18   0.179  -8.130  -9.269
  149    HA   PHE  18           HA       PHE  18  -0.261  -7.732  -6.444
  150    HB2  PHE  18           HB2      PHE  18  -1.562  -6.047  -8.419
  151    HB3  PHE  18           HB1      PHE  18  -2.736  -6.931  -7.452
  152    HD1  PHE  18           HD1      PHE  18  -0.097  -4.406  -7.413
  153    HD2  PHE  18           HD2      PHE  18  -2.956  -6.528  -5.084
  154    HE1  PHE  18           HE1      PHE  18   0.191  -2.782  -5.587
  155    HE2  PHE  18           HE2      PHE  18  -2.676  -4.907  -3.254
  156    HZ   PHE  18           HZ       PHE  18  -1.101  -3.031  -3.504
  157    H    ARG  19           HN       ARG  19   0.148 -10.146  -7.226
  158    HA   ARG  19           HA       ARG  19  -1.735 -11.675  -8.520
  159    HB2  ARG  19           HB2      ARG  19   0.436 -12.501  -7.586
  160    HB3  ARG  19           HB1      ARG  19  -0.297 -12.495  -5.988
  161    HG2  ARG  19           HG2      ARG  19  -1.781 -14.230  -6.544
  162    HG3  ARG  19           HG1      ARG  19  -1.454 -14.062  -8.270
  163    HD2  ARG  19           HD2      ARG  19   1.026 -14.547  -7.039
  164    HD3  ARG  19           HD1      ARG  19  -0.116 -15.677  -6.311
  165    HE   ARG  19           HE       ARG  19  -0.244 -15.551  -9.187
  166   HH11  ARG  19          HH11      ARG  19   1.276 -17.073  -6.437
  167   HH12  ARG  19          HH12      ARG  19   1.720 -18.498  -7.314
  168   HH21  ARG  19          HH21      ARG  19   0.339 -17.425 -10.341
  169   HH22  ARG  19          HH22      ARG  19   1.190 -18.698  -9.530
  170    H    GLY  20           HN       GLY  20  -3.435 -13.168  -7.560
  171    HA2  GLY  20           HA2      GLY  20  -5.454 -13.332  -6.441
  172    HA3  GLY  20           HA1      GLY  20  -4.575 -12.736  -5.039
  173    HA   PRO  21           HA       PRO  21  -5.799  -8.487  -6.989
  174    HB2  PRO  21           HB2      PRO  21  -7.509  -8.944  -9.211
  175    HB3  PRO  21           HB1      PRO  21  -5.897  -8.228  -9.237
  176    HG2  PRO  21           HG2      PRO  21  -6.742 -11.003  -9.839
  177    HG3  PRO  21           HG1      PRO  21  -5.364 -10.082 -10.466
  178    HD2  PRO  21           HD2      PRO  21  -5.054 -12.060  -8.668
  179    HD3  PRO  21           HD1      PRO  21  -4.025 -10.611  -8.654
  180    H    PHE  22           HN       PHE  22  -7.972 -11.208  -7.567
  181    HA   PHE  22           HA       PHE  22 -10.308  -9.880  -6.663
  182    HB2  PHE  22           HB2      PHE  22  -9.729 -12.835  -6.939
  183    HB3  PHE  22           HB1      PHE  22 -11.322 -12.131  -6.681
  184    HD1  PHE  22           HD2      PHE  22 -12.227 -10.550  -8.448
  185    HD2  PHE  22           HD1      PHE  22  -8.857 -13.069  -9.087
  186    HE1  PHE  22           HE2      PHE  22 -12.517 -10.316 -10.880
  187    HE2  PHE  22           HE1      PHE  22  -9.140 -12.838 -11.519
  188    HZ   PHE  22           HZ       PHE  22 -10.973 -11.461 -12.419
  189    H    THR  23           HN       THR  23  -8.127 -12.238  -5.101
  190    HA   THR  23           HA       THR  23  -9.637 -12.317  -2.693
  191    HB   THR  23           HB       THR  23  -7.431 -13.352  -1.805
  192    HG1  THR  23           HG1      THR  23  -5.839 -13.335  -3.144
  193   HG21  THR  23          HG21      THR  23  -8.975 -14.974  -2.178
  194   HG22  THR  23          HG22      THR  23  -7.805 -15.384  -3.431
  195   HG23  THR  23          HG23      THR  23  -9.260 -14.479  -3.847
  196    H    ASP  24           HN       ASP  24  -6.494 -10.838  -3.428
  197    HA   ASP  24           HA       ASP  24  -6.251  -9.612  -0.886
  198    HB2  ASP  24           HB2      ASP  24  -4.766  -9.455  -3.469
  199    HB3  ASP  24           HB1      ASP  24  -4.465  -8.230  -2.238
  200    H    VAL  25           HN       VAL  25  -7.009  -8.271  -4.085
  201    HA   VAL  25           HA       VAL  25  -7.293  -5.618  -3.120
  202    HB   VAL  25           HB       VAL  25  -8.574  -6.583  -5.655
  203   HG11  VAL  25          HG11      VAL  25  -8.668  -4.411  -6.269
  204   HG12  VAL  25          HG12      VAL  25  -7.181  -3.992  -5.416
  205   HG13  VAL  25          HG13      VAL  25  -8.691  -4.167  -4.522
  206   HG21  VAL  25          HG21      VAL  25  -6.513  -6.338  -6.808
  207   HG22  VAL  25          HG22      VAL  25  -6.185  -7.376  -5.423
  208   HG23  VAL  25          HG23      VAL  25  -5.715  -5.679  -5.382
  209    H    VAL  26           HN       VAL  26  -9.844  -8.041  -3.841
  210    HA   VAL  26           HA       VAL  26 -11.985  -6.295  -3.599
  211    HB   VAL  26           HB       VAL  26 -13.451  -8.134  -3.228
  212   HG11  VAL  26          HG11      VAL  26 -11.222  -8.520  -5.161
  213   HG12  VAL  26          HG12      VAL  26 -12.917  -8.132  -5.452
  214   HG13  VAL  26          HG13      VAL  26 -12.453  -9.773  -5.001
  215   HG21  VAL  26          HG21      VAL  26 -10.992  -9.513  -2.261
  216   HG22  VAL  26          HG22      VAL  26 -12.290 -10.468  -2.980
  217   HG23  VAL  26          HG23      VAL  26 -12.611  -9.470  -1.562
  218    H    THR  27           HN       THR  27 -10.202  -7.848  -0.964
  219    HA   THR  27           HA       THR  27 -12.097  -7.424   1.044
  220    HB   THR  27           HB       THR  27  -9.084  -7.222   1.258
  221    HG1  THR  27           HG1      THR  27  -9.139  -9.375   1.670
  222   HG21  THR  27          HG21      THR  27 -10.202  -8.316   3.591
  223   HG22  THR  27          HG22      THR  27 -11.086  -6.829   3.246
  224   HG23  THR  27          HG23      THR  27  -9.330  -6.794   3.408
  225    H    THR  28           HN       THR  28  -9.474  -5.333  -0.055
  226    HA   THR  28           HA       THR  28 -10.264  -3.092   1.533
  227    HB   THR  28           HB       THR  28  -8.432  -3.210  -0.870
  228    HG1  THR  28           HG1      THR  28  -7.832  -3.309   1.899
  229   HG21  THR  28          HG21      THR  28  -7.848  -1.230   1.167
  230   HG22  THR  28          HG22      THR  28  -9.389  -0.947   0.357
  231   HG23  THR  28          HG23      THR  28  -7.905  -1.073  -0.589
  232    H    ASN  29           HN       ASN  29 -10.460  -3.838  -1.918
  233    HA   ASN  29           HA       ASN  29 -11.793  -1.474  -2.672
  234    HB2  ASN  29           HB2      ASN  29 -11.040  -4.013  -3.973
  235    HB3  ASN  29           HB1      ASN  29 -12.364  -3.125  -4.718
  236   HD21  ASN  29          1HE2      ASN  29 -11.897  -1.479  -6.008
  237   HD22  ASN  29          2HE2      ASN  29 -10.334  -0.765  -6.194
  238    H    LEU  30           HN       LEU  30 -13.092  -4.620  -1.676
  239    HA   LEU  30           HA       LEU  30 -15.638  -4.342  -2.783
  240    HB2  LEU  30           HB2      LEU  30 -16.417  -6.010  -1.325
  241    HB3  LEU  30           HB1      LEU  30 -14.742  -6.397  -1.643
  242    HG   LEU  30           HG       LEU  30 -14.399  -5.039   0.634
  243   HD11  LEU  30          HD11      LEU  30 -16.161  -5.018   2.077
  244   HD12  LEU  30          HD12      LEU  30 -16.926  -6.423   1.336
  245   HD13  LEU  30          HD13      LEU  30 -17.049  -4.843   0.563
  246   HD21  LEU  30          HD21      LEU  30 -13.957  -7.061   1.603
  247   HD22  LEU  30          HD22      LEU  30 -14.006  -7.541  -0.093
  248   HD23  LEU  30          HD23      LEU  30 -15.405  -7.819   0.944
  249    H    LYS  31           HN       LYS  31 -14.545  -3.280   0.438
  250    HA   LYS  31           HA       LYS  31 -17.056  -1.818   0.755
  251    HB2  LYS  31           HB2      LYS  31 -15.271  -3.114   2.552
  252    HB3  LYS  31           HB1      LYS  31 -15.275  -1.401   2.954
  253    HG2  LYS  31           HG2      LYS  31 -17.843  -1.616   2.869
  254    HG3  LYS  31           HG1      LYS  31 -17.542  -3.351   2.991
  255    HD2  LYS  31           HD2      LYS  31 -16.149  -2.862   5.027
  256    HD3  LYS  31           HD1      LYS  31 -16.741  -1.201   4.943
  257    HE2  LYS  31           HE2      LYS  31 -18.516  -3.629   5.139
  258    HE3  LYS  31           HE1      LYS  31 -18.005  -2.660   6.521
  259    HZ1  LYS  31           HZ1      LYS  31 -18.984  -0.742   5.040
  260    HZ2  LYS  31           HZ2      LYS  31 -19.979  -1.669   6.046
  261    HZ3  LYS  31           HZ3      LYS  31 -19.901  -2.009   4.390
  262    H    LEU  32           HN       LEU  32 -14.348  -1.231  -0.838
  263    HA   LEU  32           HA       LEU  32 -12.934   0.547  -1.206
  264    HB2  LEU  32           HB2      LEU  32 -15.523   0.989  -2.044
  265    HB3  LEU  32           HB1      LEU  32 -15.131   2.470  -1.191
  266    HG   LEU  32           HG       LEU  32 -13.412   1.321  -3.401
  267   HD11  LEU  32          HD11      LEU  32 -15.017   3.745  -3.881
  268   HD12  LEU  32          HD12      LEU  32 -15.915   2.229  -3.815
  269   HD13  LEU  32          HD13      LEU  32 -14.594   2.424  -4.968
  270   HD21  LEU  32          HD21      LEU  32 -12.158   3.240  -3.265
  271   HD22  LEU  32          HD22      LEU  32 -12.569   2.995  -1.568
  272   HD23  LEU  32          HD23      LEU  32 -13.460   4.174  -2.530
  273    H    GLY  33           HN       GLY  33 -13.149   0.021   1.571
  274    HA2  GLY  33           HA2      GLY  33 -12.733   0.956   3.621
  275    HA3  GLY  33           HA1      GLY  33 -11.873   2.176   2.699
  276    H    ASN  34           HN       ASN  34 -15.028   1.324   4.085
  277    HA   ASN  34           HA       ASN  34 -15.970   4.053   3.702
  278    HB2  ASN  34           HB2      ASN  34 -17.209   1.471   4.169
  279    HB3  ASN  34           HB1      ASN  34 -17.821   2.677   5.297
  280   HD21  ASN  34          1HE2      ASN  34 -18.417   1.283   2.445
  281   HD22  ASN  34          2HE2      ASN  34 -19.265   2.557   1.642
  282    HA   PRO  35           HA       PRO  35 -15.548   3.997   8.424
  283    HB2  PRO  35           HB2      PRO  35 -15.238   1.752   9.790
  284    HB3  PRO  35           HB1      PRO  35 -16.785   2.103   9.011
  285    HG2  PRO  35           HG2      PRO  35 -14.618   0.238   8.161
  286    HG3  PRO  35           HG1      PRO  35 -16.375   0.047   8.037
  287    HD2  PRO  35           HD2      PRO  35 -14.637   0.925   5.999
  288    HD3  PRO  35           HD1      PRO  35 -16.409   1.018   5.988
  289    H    THR  36           HN       THR  36 -13.415   4.636   7.077
  290    HA   THR  36           HA       THR  36 -11.073   3.194   8.040
  291    HB   THR  36           HB       THR  36 -10.743   5.665   6.440
  292    HG1  THR  36           HG1      THR  36 -11.984   3.336   5.408
  293   HG21  THR  36          HG21      THR  36  -8.763   4.675   6.275
  294   HG22  THR  36          HG22      THR  36  -9.540   3.609   5.105
  295   HG23  THR  36          HG23      THR  36  -9.396   3.113   6.793
  296    H    ASP  37           HN       ASP  37  -9.329   5.522   7.990
  297    HA   ASP  37           HA       ASP  37  -9.364   6.219  10.689
  298    HB2  ASP  37           HB2      ASP  37  -7.417   6.360   9.055
  299    HB3  ASP  37           HB1      ASP  37  -8.106   7.886   8.511
  300    H    ARG  38           HN       ARG  38 -10.373   7.739  11.838
  301    HA   ARG  38           HA       ARG  38 -11.669   9.520  12.404
  302    HB2  ARG  38           HB2      ARG  38 -10.155  10.395  10.172
  303    HB3  ARG  38           HB1      ARG  38 -11.782  11.025   9.980
  304    HG2  ARG  38           HG2      ARG  38 -10.917  12.704  11.220
  305    HG3  ARG  38           HG1      ARG  38 -11.418  11.646  12.539
  306    HD2  ARG  38           HD2      ARG  38  -9.056  10.637  12.332
  307    HD3  ARG  38           HD1      ARG  38  -8.674  12.096  11.420
  308    HE   ARG  38           HE       ARG  38  -8.569  13.211  13.399
  309   HH11  ARG  38          HH11      ARG  38 -10.583  10.396  13.853
  310   HH12  ARG  38          HH12      ARG  38 -10.805  10.675  15.548
  311   HH21  ARG  38          HH21      ARG  38  -8.860  13.578  15.627
  312   HH22  ARG  38          HH22      ARG  38  -9.827  12.481  16.555
  313    H    ASN  39           HN       ASN  39 -12.993   7.298  11.681
  314    HA   ASN  39           HA       ASN  39 -15.379   8.391  10.362
  315    HB2  ASN  39           HB2      ASN  39 -13.807   6.043   9.582
  316    HB3  ASN  39           HB1      ASN  39 -15.525   5.711   9.760
  317   HD21  ASN  39          1HE2      ASN  39 -13.140   7.643   8.085
  318   HD22  ASN  39          2HE2      ASN  39 -14.144   8.067   6.745
  319    H    VAL  40           HN       VAL  40 -17.070   8.323  11.666
  320    HA   VAL  40           HA       VAL  40 -17.000   6.995  14.173
  321    HB   VAL  40           HB       VAL  40 -19.339   7.745  14.418
  322   HG11  VAL  40          HG11      VAL  40 -18.718   9.865  14.883
  323   HG12  VAL  40          HG12      VAL  40 -18.042  10.135  13.277
  324   HG13  VAL  40          HG13      VAL  40 -17.114   9.249  14.486
  325   HG21  VAL  40          HG21      VAL  40 -19.058   8.136  11.509
  326   HG22  VAL  40          HG22      VAL  40 -19.912   9.411  12.378
  327   HG23  VAL  40          HG23      VAL  40 -20.484   7.745  12.471
  328    H    CYS  41           HN       CYS  41 -16.495   4.855  12.965
  329    HA   CYS  41           HA       CYS  41 -18.975   3.336  12.961
  330    HB2  CYS  41           HB2      CYS  41 -18.572   3.934  10.593
  331    HB3  CYS  41           HB1      CYS  41 -17.009   3.132  10.673
  332    HG   CYS  41           HG       CYS  41 -19.261   1.707   9.773
  333    H    PHE  42           HN       PHE  42 -15.816   2.248  11.744
  334    HA   PHE  42           HA       PHE  42 -14.678   1.264  14.051
  335    HB2  PHE  42           HB2      PHE  42 -17.064  -0.090  13.667
  336    HB3  PHE  42           HB1      PHE  42 -15.879  -1.179  12.961
  337    HD1  PHE  42           HD1      PHE  42 -16.329   0.906  16.024
  338    HD2  PHE  42           HD2      PHE  42 -14.908  -2.731  14.331
  339    HE1  PHE  42           HE1      PHE  42 -15.732   0.098  18.270
  340    HE2  PHE  42           HE2      PHE  42 -14.311  -3.547  16.575
  341    HZ   PHE  42           HZ       PHE  42 -14.722  -2.132  18.548
  342    H    LYS  43           HN       LYS  43 -13.939  -1.384  13.094
  343    HA   LYS  43           HA       LYS  43 -12.497  -2.420  11.675
  344    HB2  LYS  43           HB2      LYS  43 -14.060  -0.721   9.976
  345    HB3  LYS  43           HB1      LYS  43 -12.406  -0.730   9.392
  346    HG2  LYS  43           HG2      LYS  43 -13.299  -3.393  10.071
  347    HG3  LYS  43           HG1      LYS  43 -14.371  -2.626   8.899
  348    HD2  LYS  43           HD2      LYS  43 -12.788  -2.591   7.273
  349    HD3  LYS  43           HD1      LYS  43 -11.466  -2.345   8.414
  350    HE2  LYS  43           HE2      LYS  43 -10.965  -4.488   7.986
  351    HE3  LYS  43           HE1      LYS  43 -12.304  -4.853   9.074
  352    HZ1  LYS  43           HZ1      LYS  43 -12.561  -6.085   7.051
  353    HZ2  LYS  43           HZ2      LYS  43 -12.428  -4.683   6.112
  354    HZ3  LYS  43           HZ3      LYS  43 -13.772  -4.904   7.115
  355    H    VAL  44           HN       VAL  44 -10.727  -1.136   9.744
  356    HA   VAL  44           HA       VAL  44  -8.469  -0.717  11.123
  357    HB   VAL  44           HB       VAL  44  -7.748   0.871   9.246
  358   HG11  VAL  44          HG11      VAL  44  -8.537  -1.970   9.082
  359   HG12  VAL  44          HG12      VAL  44  -6.962  -1.211   8.848
  360   HG13  VAL  44          HG13      VAL  44  -8.163  -1.167   7.557
  361   HG21  VAL  44          HG21      VAL  44 -10.581   0.306   8.468
  362   HG22  VAL  44          HG22      VAL  44  -9.352   0.528   7.225
  363   HG23  VAL  44          HG23      VAL  44  -9.674   1.817   8.385
  364    H    LYS  45           HN       LYS  45 -11.077   1.604  10.943
  365    HA   LYS  45           HA       LYS  45  -9.796   3.978  11.504
  366    HB2  LYS  45           HB2      LYS  45 -11.848   4.810  12.272
  367    HB3  LYS  45           HB1      LYS  45 -12.302   3.531  11.157
  368    HG2  LYS  45           HG2      LYS  45 -13.597   2.727  12.765
  369    HG3  LYS  45           HG1      LYS  45 -12.125   2.261  13.620
  370    HD2  LYS  45           HD2      LYS  45 -12.116   4.588  14.610
  371    HD3  LYS  45           HD1      LYS  45 -13.737   4.785  13.941
  372    HE2  LYS  45           HE2      LYS  45 -13.421   2.302  15.428
  373    HE3  LYS  45           HE1      LYS  45 -13.108   3.731  16.412
  374    HZ1  LYS  45           HZ1      LYS  45 -15.472   3.834  14.723
  375    HZ2  LYS  45           HZ2      LYS  45 -15.248   4.381  16.307
  376    HZ3  LYS  45           HZ3      LYS  45 -15.534   2.740  16.012
  377    H    THR  46           HN       THR  46  -9.121   5.043  13.377
  378    HA   THR  46           HA       THR  46  -7.863   5.080  15.296
  379    HB   THR  46           HB       THR  46 -10.221   5.379  16.067
  380    HG1  THR  46           HG1      THR  46  -8.345   4.124  17.765
  381   HG21  THR  46          HG21      THR  46 -10.040   2.467  16.805
  382   HG22  THR  46          HG22      THR  46 -11.124   3.173  15.607
  383   HG23  THR  46          HG23      THR  46 -11.303   3.589  17.311
  384    H    THR  47           HN       THR  47  -7.255   2.841  13.650
  385    HA   THR  47           HA       THR  47  -7.189   0.346  14.711
  386    HB   THR  47           HB       THR  47  -4.576   0.735  13.725
  387    HG1  THR  47           HG1      THR  47  -6.405   2.086  12.055
  388   HG21  THR  47          HG21      THR  47  -5.219  -0.964  12.479
  389   HG22  THR  47          HG22      THR  47  -6.334   0.075  11.593
  390   HG23  THR  47          HG23      THR  47  -6.872  -0.752  13.054
  391    H    ALA  48           HN       ALA  48  -5.398  -0.863  15.743
  392    HA   ALA  48           HA       ALA  48  -4.023   0.725  17.807
  393    HB1  ALA  48           HB1      ALA  48  -4.543  -1.751  18.972
  394    HB2  ALA  48           HB2      ALA  48  -6.045  -1.305  18.163
  395    HB3  ALA  48           HB3      ALA  48  -5.325  -0.215  19.347
  396    HA   PRO  49           HA       PRO  49  -0.372  -1.592  16.952
  397    HB2  PRO  49           HB2      PRO  49   0.602  -2.321  19.375
  398    HB3  PRO  49           HB1      PRO  49   0.623  -0.650  18.799
  399    HG2  PRO  49           HG2      PRO  49  -1.292  -1.985  20.672
  400    HG3  PRO  49           HG1      PRO  49  -0.550  -0.378  20.786
  401    HD2  PRO  49           HD2      PRO  49  -3.084  -0.764  19.910
  402    HD3  PRO  49           HD1      PRO  49  -2.060   0.561  19.324
  403    H    ARG  50           HN       ARG  50  -0.747  -3.463  15.880
  404    HA   ARG  50           HA       ARG  50  -0.358  -5.931  17.087
  405    HB2  ARG  50           HB2      ARG  50  -2.735  -6.859  16.684
  406    HB3  ARG  50           HB1      ARG  50  -2.432  -5.943  18.152
  407    HG2  ARG  50           HG2      ARG  50  -3.422  -3.961  17.126
  408    HG3  ARG  50           HG1      ARG  50  -3.720  -4.877  15.648
  409    HD2  ARG  50           HD2      ARG  50  -5.583  -5.773  16.481
  410    HD3  ARG  50           HD1      ARG  50  -4.767  -6.246  17.970
  411    HE   ARG  50           HE       ARG  50  -5.418  -3.444  17.825
  412   HH11  ARG  50          HH11      ARG  50  -6.555  -6.617  18.736
  413   HH12  ARG  50          HH12      ARG  50  -7.721  -6.012  19.864
  414   HH21  ARG  50          HH21      ARG  50  -6.954  -2.649  19.310
  415   HH22  ARG  50          HH22      ARG  50  -7.947  -3.760  20.189
  416    H    ARG  51           HN       ARG  51  -0.643  -7.753  15.600
  417    HA   ARG  51           HA       ARG  51  -0.437  -8.743  13.564
  418    HB2  ARG  51           HB2      ARG  51  -2.499  -6.733  13.213
  419    HB3  ARG  51           HB1      ARG  51  -1.610  -7.005  11.720
  420    HG2  ARG  51           HG2      ARG  51  -2.037  -9.549  12.488
  421    HG3  ARG  51           HG1      ARG  51  -3.463  -8.768  13.172
  422    HD2  ARG  51           HD2      ARG  51  -4.192  -8.011  11.076
  423    HD3  ARG  51           HD1      ARG  51  -2.618  -8.292  10.333
  424    HE   ARG  51           HE       ARG  51  -3.895 -10.676  11.319
  425   HH11  ARG  51          HH11      ARG  51  -3.562  -8.507   8.603
  426   HH12  ARG  51          HH12      ARG  51  -4.044  -9.694   7.437
  427   HH21  ARG  51          HH21      ARG  51  -4.529 -12.236   9.786
  428   HH22  ARG  51          HH22      ARG  51  -4.595 -11.809   8.109
  429    H    TYR  52           HN       TYR  52   0.051  -7.863  11.034
  430    HA   TYR  52           HA       TYR  52   2.311  -6.001  11.290
  431    HB2  TYR  52           HB2      TYR  52   2.339  -8.819  10.380
  432    HB3  TYR  52           HB1      TYR  52   3.286  -7.685   9.423
  433    HD1  TYR  52           HD1      TYR  52   5.099  -6.362  10.539
  434    HD2  TYR  52           HD2      TYR  52   3.092  -9.560  12.498
  435    HE1  TYR  52           HE1      TYR  52   6.927  -6.495  12.179
  436    HE2  TYR  52           HE2      TYR  52   4.914  -9.704  14.144
  437    HH   TYR  52           HH       TYR  52   7.007  -7.432  14.774
  438    H    CYS  53           HN       CYS  53   2.701  -4.670   9.587
  439    HA   CYS  53           HA       CYS  53   2.343  -3.533   7.618
  440    HB2  CYS  53           HB2      CYS  53   2.575  -5.678   6.434
  441    HB3  CYS  53           HB1      CYS  53   0.876  -6.033   6.722
  442    HG   CYS  53           HG       CYS  53   0.702  -5.061   4.408
  443    H    VAL  54           HN       VAL  54   0.869  -2.065   6.868
  444    HA   VAL  54           HA       VAL  54  -0.941  -0.699   7.047
  445    HB   VAL  54           HB       VAL  54  -1.733  -2.463   5.480
  446   HG11  VAL  54          HG11      VAL  54  -1.957  -4.409   6.753
  447   HG12  VAL  54          HG12      VAL  54  -3.615  -3.917   6.411
  448   HG13  VAL  54          HG13      VAL  54  -2.909  -3.595   7.994
  449   HG21  VAL  54          HG21      VAL  54  -4.145  -1.565   6.946
  450   HG22  VAL  54          HG22      VAL  54  -3.746  -1.435   5.234
  451   HG23  VAL  54          HG23      VAL  54  -3.015  -0.328   6.395
  452    H    ARG  55           HN       ARG  55   0.097  -1.929   9.547
  453    HA   ARG  55           HA       ARG  55  -2.300  -1.531  11.211
  454    HB2  ARG  55           HB2      ARG  55   0.096  -3.302  11.721
  455    HB3  ARG  55           HB1      ARG  55  -1.132  -2.940  12.927
  456    HG2  ARG  55           HG2      ARG  55  -1.951  -4.073  10.295
  457    HG3  ARG  55           HG1      ARG  55  -1.265  -5.129  11.529
  458    HD2  ARG  55           HD2      ARG  55  -3.382  -5.294  12.252
  459    HD3  ARG  55           HD1      ARG  55  -3.077  -3.719  12.982
  460    HE   ARG  55           HE       ARG  55  -3.943  -3.015  10.560
  461   HH11  ARG  55          HH11      ARG  55  -5.216  -5.324  12.852
  462   HH12  ARG  55          HH12      ARG  55  -6.854  -5.125  12.330
  463   HH21  ARG  55          HH21      ARG  55  -6.098  -2.753   9.877
  464   HH22  ARG  55          HH22      ARG  55  -7.356  -3.666  10.642
  465    H    SER  56           HN       SER  56  -2.062  -0.290  13.088
  466    HA   SER  56           HA       SER  56   0.306   1.447  13.040
  467    HB2  SER  56           HB2      SER  56  -2.329   2.059  14.364
  468    HB3  SER  56           HB1      SER  56  -1.032   3.178  13.945
  469    HG   SER  56           HG       SER  56  -1.472   2.403  11.709
  470    H    ASN  57           HN       ASN  57   1.737   1.208  14.550
  471    HA   ASN  57           HA       ASN  57   1.144  -0.327  16.933
  472    HB2  ASN  57           HB2      ASN  57   3.698   0.871  15.858
  473    HB3  ASN  57           HB1      ASN  57   3.607  -0.005  17.384
  474   HD21  ASN  57          1HE2      ASN  57   2.957  -2.226  17.325
  475   HD22  ASN  57          2HE2      ASN  57   3.266  -3.179  15.917
  476    H    SER  58           HN       SER  58   1.834   3.020  16.086
  477    HA   SER  58           HA       SER  58   2.125   3.816  18.842
  478    HB2  SER  58           HB2      SER  58   3.337   4.895  16.923
  479    HB3  SER  58           HB1      SER  58   1.801   5.619  16.447
  480    HG   SER  58           HG       SER  58   1.744   6.542  18.597
  481    H    GLY  59           HN       GLY  59  -0.495   3.978  16.433
  482    HA2  GLY  59           HA2      GLY  59  -2.663   3.871  17.909
  483    HA3  GLY  59           HA1      GLY  59  -2.119   5.479  18.360
  484    H    ILE  60           HN       ILE  60  -2.091   3.812  15.267
  485    HA   ILE  60           HA       ILE  60  -2.861   4.289  13.215
  486    HB   ILE  60           HB       ILE  60  -5.047   3.982  14.336
  487   HG12  ILE  60          HG12      ILE  60  -4.951   5.982  12.069
  488   HG13  ILE  60          HG11      ILE  60  -4.876   4.229  11.913
  489   HG21  ILE  60          HG21      ILE  60  -4.787   6.923  14.744
  490   HG22  ILE  60          HG22      ILE  60  -5.410   5.683  15.830
  491   HG23  ILE  60          HG23      ILE  60  -6.382   6.228  14.466
  492   HD11  ILE  60          HD11      ILE  60  -7.219   5.219  13.353
  493   HD12  ILE  60          HD12      ILE  60  -7.093   4.004  12.082
  494   HD13  ILE  60          HD13      ILE  60  -7.123   5.717  11.665
  495    H    ILE  61           HN       ILE  61  -2.878   7.176  15.277
  496    HA   ILE  61           HA       ILE  61  -2.666   8.896  12.982
  497    HB   ILE  61           HB       ILE  61  -3.197   9.174  15.828
  498   HG12  ILE  61          HG12      ILE  61  -4.475  11.156  15.004
  499   HG13  ILE  61          HG11      ILE  61  -3.816  10.866  13.397
  500   HG21  ILE  61          HG21      ILE  61  -1.446  11.254  14.528
  501   HG22  ILE  61          HG22      ILE  61  -1.071  10.276  15.948
  502   HG23  ILE  61          HG23      ILE  61  -2.343  11.496  16.028
  503   HD11  ILE  61          HD11      ILE  61  -4.934   8.741  13.276
  504   HD12  ILE  61          HD12      ILE  61  -6.099   9.999  13.687
  505   HD13  ILE  61          HD13      ILE  61  -5.501   8.908  14.937
  506    H    ASP  62           HN       ASP  62  -0.512   7.629  15.458
  507    HA   ASP  62           HA       ASP  62   1.679   9.292  14.538
  508    HB2  ASP  62           HB2      ASP  62   1.186   7.483  16.815
  509    HB3  ASP  62           HB1      ASP  62   2.837   7.458  16.199
  510    H    ALA  63           HN       ALA  63   0.492   6.039  14.237
  511    HA   ALA  63           HA       ALA  63   2.847   5.109  12.826
  512    HB1  ALA  63           HB1      ALA  63   0.929   3.850  14.320
  513    HB2  ALA  63           HB2      ALA  63   2.102   3.052  13.271
  514    HB3  ALA  63           HB3      ALA  63   0.483   3.409  12.671
  515    H    GLY  64           HN       GLY  64  -0.407   6.213  11.997
  516    HA2  GLY  64           HA2      GLY  64  -1.209   6.916   9.924
  517    HA3  GLY  64           HA1      GLY  64   0.388   6.621   9.264
  518    H    ALA  65           HN       ALA  65  -0.515   3.869  10.824
  519    HA   ALA  65           HA       ALA  65  -0.835   1.762   9.942
  520    HB1  ALA  65           HB1      ALA  65  -3.055   1.376   9.910
  521    HB2  ALA  65           HB2      ALA  65  -3.370   2.650   8.730
  522    HB3  ALA  65           HB3      ALA  65  -3.135   3.059  10.429
  523    H    SER  66           HN       SER  66   0.609   3.523   8.071
  524    HA   SER  66           HA       SER  66   1.045   3.806   5.820
  525    HB2  SER  66           HB2      SER  66   1.204   1.351   4.789
  526    HB3  SER  66           HB1      SER  66   2.369   1.936   5.975
  527    HG   SER  66           HG       SER  66   1.382   0.769   7.537
  528    H    ILE  67           HN       ILE  67  -1.584   4.421   6.144
  529    HA   ILE  67           HA       ILE  67  -3.373   2.855   4.618
  530    HB   ILE  67           HB       ILE  67  -3.590   5.829   5.050
  531   HG12  ILE  67          HG12      ILE  67  -4.908   3.830   6.841
  532   HG13  ILE  67          HG11      ILE  67  -3.208   4.197   7.108
  533   HG21  ILE  67          HG21      ILE  67  -5.235   5.172   3.519
  534   HG22  ILE  67          HG22      ILE  67  -6.065   5.168   5.074
  535   HG23  ILE  67          HG23      ILE  67  -5.532   3.649   4.355
  536   HD11  ILE  67          HD11      ILE  67  -4.707   5.537   8.511
  537   HD12  ILE  67          HD12      ILE  67  -5.426   6.229   7.057
  538   HD13  ILE  67          HD13      ILE  67  -3.729   6.531   7.431
  539    H    ASN  68           HN       ASN  68  -0.813   4.833   3.592
  540    HA   ASN  68           HA       ASN  68  -0.046   5.423   1.535
  541    HB2  ASN  68           HB2      ASN  68  -0.575   3.153   0.825
  542    HB3  ASN  68           HB1      ASN  68  -2.255   3.600   0.547
  543   HD21  ASN  68          1HE2      ASN  68  -1.600   2.616  -1.615
  544   HD22  ASN  68          2HE2      ASN  68  -0.976   3.707  -2.797
  545    H    VAL  69           HN       VAL  69  -3.516   5.148   0.789
  546    HA   VAL  69           HA       VAL  69  -3.540   7.640  -0.584
  547    HB   VAL  69           HB       VAL  69  -5.935   6.063   0.352
  548   HG11  VAL  69          HG11      VAL  69  -6.642   7.140  -2.002
  549   HG12  VAL  69          HG12      VAL  69  -5.517   8.373  -1.437
  550   HG13  VAL  69          HG13      VAL  69  -6.912   7.935  -0.452
  551   HG21  VAL  69          HG21      VAL  69  -3.926   5.123  -1.293
  552   HG22  VAL  69          HG22      VAL  69  -5.145   5.710  -2.424
  553   HG23  VAL  69          HG23      VAL  69  -5.576   4.508  -1.208
  554    H    SER  70           HN       SER  70  -4.452   6.666   2.673
  555    HA   SER  70           HA       SER  70  -5.749   9.190   3.221
  556    HB2  SER  70           HB2      SER  70  -6.364   6.920   4.250
  557    HB3  SER  70           HB1      SER  70  -4.961   7.150   5.293
  558    HG   SER  70           HG       SER  70  -6.206   8.346   6.469
  559    H    VAL  71           HN       VAL  71  -2.743   7.578   4.225
  560    HA   VAL  71           HA       VAL  71  -1.870   9.890   5.713
  561    HB   VAL  71           HB       VAL  71   0.287   8.605   5.918
  562   HG11  VAL  71          HG11      VAL  71  -1.878   6.781   6.804
  563   HG12  VAL  71          HG12      VAL  71  -1.926   8.449   7.374
  564   HG13  VAL  71          HG13      VAL  71  -0.515   7.445   7.704
  565   HG21  VAL  71          HG21      VAL  71   0.676   6.712   4.794
  566   HG22  VAL  71          HG22      VAL  71  -0.665   7.197   3.758
  567   HG23  VAL  71          HG23      VAL  71  -0.944   6.092   5.103
  568    H    MET  72           HN       MET  72  -1.407  11.648   4.532
  569    HA   MET  72           HA       MET  72   0.279  11.322   2.144
  570    HB2  MET  72           HB2      MET  72  -1.964  13.076   2.807
  571    HB3  MET  72           HB1      MET  72  -0.588  13.946   2.143
  572    HG2  MET  72           HG2      MET  72  -0.645  12.069   0.332
  573    HG3  MET  72           HG1      MET  72  -2.310  11.872   0.878
  574    HE1  MET  72           HE1      MET  72  -4.216  14.670   0.189
  575    HE2  MET  72           HE2      MET  72  -4.032  12.932   0.419
  576    HE3  MET  72           HE3      MET  72  -4.117  13.601  -1.211
  577    H    LEU  73           HN       LEU  73   0.101  12.726   5.307
  578    HA   LEU  73           HA       LEU  73   2.581  14.225   4.857
  579    HB2  LEU  73           HB2      LEU  73   0.454  15.200   5.983
  580    HB3  LEU  73           HB1      LEU  73   0.975  14.290   7.389
  581    HG   LEU  73           HG       LEU  73   3.235  15.541   7.054
  582   HD11  LEU  73          HD11      LEU  73   1.414  16.931   5.192
  583   HD12  LEU  73          HD12      LEU  73   3.169  16.760   5.153
  584   HD13  LEU  73          HD13      LEU  73   2.421  17.952   6.218
  585   HD21  LEU  73          HD21      LEU  73   0.931  17.223   7.984
  586   HD22  LEU  73          HD22      LEU  73   2.571  17.134   8.629
  587   HD23  LEU  73          HD23      LEU  73   1.452  15.793   8.877
  588    H    GLN  74           HN       GLN  74   1.251  11.499   6.568
  589    HA   GLN  74           HA       GLN  74   3.869  11.044   7.840
  590    HB2  GLN  74           HB2      GLN  74   1.161   9.989   8.674
  591    HB3  GLN  74           HB1      GLN  74   2.684   9.666   9.492
  592    HG2  GLN  74           HG2      GLN  74   1.316  12.333   9.219
  593    HG3  GLN  74           HG1      GLN  74   1.452  11.357  10.681
  594   HE21  GLN  74          1HE2      GLN  74   3.486  11.155  11.686
  595   HE22  GLN  74          2HE2      GLN  74   4.739  12.313  11.413
  596    HA   PRO  75           HA       PRO  75   3.506   7.716   4.677
  597    HB2  PRO  75           HB2      PRO  75   6.102   7.716   3.960
  598    HB3  PRO  75           HB1      PRO  75   4.948   8.890   3.314
  599    HG2  PRO  75           HG2      PRO  75   6.947   9.217   5.518
  600    HG3  PRO  75           HG1      PRO  75   6.550  10.329   4.195
  601    HD2  PRO  75           HD2      PRO  75   5.571  10.607   6.722
  602    HD3  PRO  75           HD1      PRO  75   4.696  11.150   5.277
  603    H    PHE  76           HN       PHE  76   3.128   6.094   6.290
  604    HA   PHE  76           HA       PHE  76   3.660   4.187   7.402
  605    HB2  PHE  76           HB2      PHE  76   6.140   4.764   5.962
  606    HB3  PHE  76           HB1      PHE  76   6.407   3.897   7.470
  607    HD1  PHE  76           HD2      PHE  76   4.852   3.769   4.157
  608    HD2  PHE  76           HD1      PHE  76   5.640   1.640   7.756
  609    HE1  PHE  76           HE2      PHE  76   4.208   1.668   3.050
  610    HE2  PHE  76           HE1      PHE  76   4.998  -0.466   6.655
  611    HZ   PHE  76           HZ       PHE  76   4.281  -0.452   4.300
  612    H    ASP  77           HN       ASP  77   6.131   6.686   8.051
  613    HA   ASP  77           HA       ASP  77   6.772   7.697   9.977
  614    HB2  ASP  77           HB2      ASP  77   4.045   6.857  10.524
  615    HB3  ASP  77           HB1      ASP  77   5.027   6.858  11.984
  616    H    TYR  78           HN       TYR  78   7.705   5.037   9.237
  617    HA   TYR  78           HA       TYR  78   8.082   3.649  11.761
  618    HB2  TYR  78           HB2      TYR  78   8.084   2.872   9.063
  619    HB3  TYR  78           HB1      TYR  78   9.745   2.666   9.606
  620    HD1  TYR  78           HD1      TYR  78  10.048   1.380  11.861
  621    HD2  TYR  78           HD2      TYR  78   6.539   1.189   9.464
  622    HE1  TYR  78           HE1      TYR  78   9.436  -0.746  12.936
  623    HE2  TYR  78           HE2      TYR  78   5.917  -0.936  10.531
  624    HH   TYR  78           HH       TYR  78   7.094  -2.006  13.323
  625    H    ASP  79           HN       ASP  79   9.357   6.346  10.572
  626    HA   ASP  79           HA       ASP  79  11.961   6.496  10.308
  627    HB2  ASP  79           HB2      ASP  79  10.051   8.229  11.316
  628    HB3  ASP  79           HB1      ASP  79  11.289   8.205  12.566
  629    HA   PRO  80           HA       PRO  80  13.049   5.815  15.076
  630    HB2  PRO  80           HB2      PRO  80  10.771   4.008  15.717
  631    HB3  PRO  80           HB1      PRO  80  11.570   5.214  16.732
  632    HG2  PRO  80           HG2      PRO  80   9.173   5.702  15.693
  633    HG3  PRO  80           HG1      PRO  80  10.399   6.980  15.783
  634    HD2  PRO  80           HD2      PRO  80   9.511   5.368  13.430
  635    HD3  PRO  80           HD1      PRO  80   9.958   7.082  13.516
  636    H    ASN  81           HN       ASN  81  14.431   4.706  13.486
  637    HA   ASN  81           HA       ASN  81  15.620   2.510  13.989
  638    HB2  ASN  81           HB2      ASN  81  12.909   1.648  13.110
  639    HB3  ASN  81           HB1      ASN  81  14.271   0.715  12.517
  640   HD21  ASN  81          1HE2      ASN  81  14.377   2.286  15.627
  641   HD22  ASN  81          2HE2      ASN  81  14.281   0.847  16.574
  642    H    GLU  82           HN       GLU  82  17.212   2.487  12.415
  643    HA   GLU  82           HA       GLU  82  16.826   3.894   9.987
  644    HB2  GLU  82           HB2      GLU  82  19.012   3.415  11.420
  645    HB3  GLU  82           HB1      GLU  82  19.153   2.061  10.308
  646    HG2  GLU  82           HG2      GLU  82  18.783   3.891   8.487
  647    HG3  GLU  82           HG1      GLU  82  19.314   4.984   9.764
  648    H    LYS  83           HN       LYS  83  17.270   0.442  10.682
  649    HA   LYS  83           HA       LYS  83  17.021  -0.329   7.965
  650    HB2  LYS  83           HB2      LYS  83  16.674  -1.816  10.568
  651    HB3  LYS  83           HB1      LYS  83  16.410  -2.593   9.014
  652    HG2  LYS  83           HG2      LYS  83  18.706  -2.130   8.369
  653    HG3  LYS  83           HG1      LYS  83  18.979  -1.296   9.900
  654    HD2  LYS  83           HD2      LYS  83  19.164  -3.223  11.064
  655    HD3  LYS  83           HD1      LYS  83  17.912  -4.032  10.121
  656    HE2  LYS  83           HE2      LYS  83  19.568  -5.183   9.167
  657    HE3  LYS  83           HE1      LYS  83  19.960  -3.696   8.305
  658    HZ1  LYS  83           HZ1      LYS  83  21.730  -4.968   9.757
  659    HZ2  LYS  83           HZ2      LYS  83  21.058  -4.031  10.993
  660    HZ3  LYS  83           HZ3      LYS  83  21.734  -3.281   9.636
  661    H    SER  84           HN       SER  84  14.793  -0.078  10.688
  662    HA   SER  84           HA       SER  84  12.512  -0.945   9.169
  663    HB2  SER  84           HB2      SER  84  12.149   0.595  11.685
  664    HB3  SER  84           HB1      SER  84  11.341  -0.869  11.132
  665    HG   SER  84           HG       SER  84  12.980  -2.072  11.848
  666    H    LYS  85           HN       LYS  85  13.823   2.265   9.859
  667    HA   LYS  85           HA       LYS  85  11.610   3.836   9.560
  668    HB2  LYS  85           HB2      LYS  85  13.109   5.611   8.589
  669    HB3  LYS  85           HB1      LYS  85  13.603   4.926  10.126
  670    HG2  LYS  85           HG2      LYS  85  15.507   4.144   9.296
  671    HG3  LYS  85           HG1      LYS  85  14.749   3.551   7.825
  672    HD2  LYS  85           HD2      LYS  85  16.005   5.200   6.898
  673    HD3  LYS  85           HD1      LYS  85  14.611   6.181   7.354
  674    HE2  LYS  85           HE2      LYS  85  15.901   7.426   8.663
  675    HE3  LYS  85           HE1      LYS  85  16.343   6.000   9.601
  676    HZ1  LYS  85           HZ1      LYS  85  17.772   7.275   7.373
  677    HZ2  LYS  85           HZ2      LYS  85  17.971   5.614   7.630
  678    HZ3  LYS  85           HZ3      LYS  85  18.371   6.712   8.853
  679    H    HIS  86           HN       HIS  86  13.638   4.233   6.735
  680    HA   HIS  86           HA       HIS  86  13.188   4.248   4.501
  681    HB2  HIS  86           HB2      HIS  86  12.025   2.506   3.579
  682    HB3  HIS  86           HB1      HIS  86  12.252   1.876   5.203
  683    HD1  HIS  86           HD1      HIS  86   9.574   3.894   3.376
  684    HD2  HIS  86           HD2      HIS  86   9.959   0.882   6.211
  685    HE1  HIS  86           HE1      HIS  86   7.227   3.199   3.941
  686    HE2  HIS  86           HE2      HIS  86   7.491   1.291   5.564
  687    H    LYS  87           HN       LYS  87  11.660   5.106   2.845
  688    HA   LYS  87           HA       LYS  87   9.503   6.777   3.975
  689    HB2  LYS  87           HB2      LYS  87  11.967   7.741   3.005
  690    HB3  LYS  87           HB1      LYS  87  10.775   8.128   1.771
  691    HG2  LYS  87           HG2      LYS  87   9.491   8.862   4.075
  692    HG3  LYS  87           HG1      LYS  87  11.170   9.271   4.424
  693    HD2  LYS  87           HD2      LYS  87  11.299  10.605   2.404
  694    HD3  LYS  87           HD1      LYS  87   9.660  10.130   1.957
  695    HE2  LYS  87           HE2      LYS  87   8.872  11.867   3.094
  696    HE3  LYS  87           HE1      LYS  87   9.525  11.169   4.576
  697    HZ1  LYS  87           HZ1      LYS  87  11.317  12.533   4.539
  698    HZ2  LYS  87           HZ2      LYS  87  10.244  13.540   3.704
  699    HZ3  LYS  87           HZ3      LYS  87  11.379  12.622   2.850
  700    H    PHE  88           HN       PHE  88   8.045   7.728   2.144
  701    HA   PHE  88           HA       PHE  88   7.160   5.509   0.565
  702    HB2  PHE  88           HB2      PHE  88   5.603   7.073   1.625
  703    HB3  PHE  88           HB1      PHE  88   6.179   8.361   0.574
  704    HD1  PHE  88           HD2      PHE  88   4.576   5.010   0.500
  705    HD2  PHE  88           HD1      PHE  88   5.171   8.729  -1.483
  706    HE1  PHE  88           HE2      PHE  88   2.896   4.378  -1.184
  707    HE2  PHE  88           HE1      PHE  88   3.492   8.105  -3.169
  708    HZ   PHE  88           HZ       PHE  88   2.353   5.925  -3.021
  709    H    MET  89           HN       MET  89   8.316   8.788  -0.510
  710    HA   MET  89           HA       MET  89   8.341   7.886  -3.262
  711    HB2  MET  89           HB2      MET  89   8.753  10.461  -1.892
  712    HB3  MET  89           HB1      MET  89   9.909  10.214  -3.185
  713    HG2  MET  89           HG2      MET  89   8.032   9.910  -4.789
  714    HG3  MET  89           HG1      MET  89   6.885  10.189  -3.482
  715    HE1  MET  89           HE1      MET  89   7.062  12.725  -6.379
  716    HE2  MET  89           HE2      MET  89   6.205  13.617  -5.127
  717    HE3  MET  89           HE3      MET  89   5.859  11.909  -5.376
  718    H    VAL  90           HN       VAL  90  10.535   8.287  -0.622
  719    HA   VAL  90           HA       VAL  90  12.993   7.646  -1.943
  720    HB   VAL  90           HB       VAL  90  12.533   7.549   1.020
  721   HG11  VAL  90          HG11      VAL  90  14.952   8.654   0.658
  722   HG12  VAL  90          HG12      VAL  90  14.856   7.660  -0.795
  723   HG13  VAL  90          HG13      VAL  90  14.689   6.915   0.795
  724   HG21  VAL  90          HG21      VAL  90  13.238   9.982   0.966
  725   HG22  VAL  90          HG22      VAL  90  11.596   9.636   0.420
  726   HG23  VAL  90          HG23      VAL  90  12.870   9.952  -0.758
  727    H    GLN  91           HN       GLN  91  10.483   5.657  -0.813
  728    HA   GLN  91           HA       GLN  91  11.762   3.566   0.432
  729    HB2  GLN  91           HB2      GLN  91   9.202   4.068  -0.457
  730    HB3  GLN  91           HB1      GLN  91   9.661   2.637  -1.365
  731    HG2  GLN  91           HG2      GLN  91  10.278   1.533   0.757
  732    HG3  GLN  91           HG1      GLN  91   9.687   2.946   1.628
  733   HE21  GLN  91          1HE2      GLN  91   7.540   3.186   1.963
  734   HE22  GLN  91          2HE2      GLN  91   6.345   2.045   1.457
  735    H    SER  92           HN       SER  92  12.145   4.364  -2.894
  736    HA   SER  92           HA       SER  92  12.529   1.812  -3.985
  737    HB2  SER  92           HB2      SER  92  13.521   2.883  -5.831
  738    HB3  SER  92           HB1      SER  92  12.407   4.087  -5.182
  739    HG   SER  92           HG       SER  92  14.695   4.718  -5.699
  740    H    MET  93           HN       MET  93  14.513   3.562  -1.787
  741    HA   MET  93           HA       MET  93  16.988   2.288  -2.435
  742    HB2  MET  93           HB2      MET  93  16.849   4.539  -1.374
  743    HB3  MET  93           HB1      MET  93  16.217   3.777   0.081
  744    HG2  MET  93           HG2      MET  93  18.429   2.344  -0.161
  745    HG3  MET  93           HG1      MET  93  18.966   3.784  -1.024
  746    HE1  MET  93           HE1      MET  93  17.075   2.510   1.912
  747    HE2  MET  93           HE2      MET  93  17.375   3.634   3.237
  748    HE3  MET  93           HE3      MET  93  18.578   2.411   2.829
  749    H    PHE  94           HN       PHE  94  14.591   2.035   0.139
  750    HA   PHE  94           HA       PHE  94  15.784   0.015   1.637
  751    HB2  PHE  94           HB2      PHE  94  13.922   1.188   2.558
  752    HB3  PHE  94           HB1      PHE  94  12.882   0.732   1.213
  753    HD1  PHE  94           HD1      PHE  94  12.230  -1.687   0.965
  754    HD2  PHE  94           HD2      PHE  94  14.072  -0.148   4.477
  755    HE1  PHE  94           HE1      PHE  94  11.435  -3.636   2.227
  756    HE2  PHE  94           HE2      PHE  94  13.279  -2.097   5.752
  757    HZ   PHE  94           HZ       PHE  94  11.958  -3.847   4.627
  758    H    ALA  95           HN       ALA  95  14.302  -0.147  -1.454
  759    HA   ALA  95           HA       ALA  95  15.162  -2.532  -2.300
  760    HB1  ALA  95           HB1      ALA  95  12.803  -3.830  -1.820
  761    HB2  ALA  95           HB2      ALA  95  13.071  -2.978  -0.300
  762    HB3  ALA  95           HB3      ALA  95  14.302  -4.078  -0.922
  763    HA   PRO  96           HA       PRO  96  10.456  -1.987  -4.250
  764    HB2  PRO  96           HB2      PRO  96  10.711   0.876  -3.413
  765    HB3  PRO  96           HB1      PRO  96   9.256  -0.081  -3.711
  766    HG2  PRO  96           HG2      PRO  96  10.372   0.349  -1.218
  767    HG3  PRO  96           HG1      PRO  96   9.282  -0.985  -1.624
  768    HD2  PRO  96           HD2      PRO  96  12.017  -1.159  -0.866
  769    HD3  PRO  96           HD1      PRO  96  10.968  -2.477  -1.407
  770    H    THR  97           HN       THR  97  12.169  -2.433  -5.880
  771    HA   THR  97           HA       THR  97  13.491  -0.322  -7.256
  772    HB   THR  97           HB       THR  97  13.888  -1.997  -9.016
  773    HG1  THR  97           HG1      THR  97  12.199  -3.280  -9.184
  774   HG21  THR  97          HG21      THR  97  14.288  -2.977  -6.210
  775   HG22  THR  97          HG22      THR  97  15.451  -2.175  -7.265
  776   HG23  THR  97          HG23      THR  97  14.921  -3.817  -7.625
  777    H    ASP  98           HN       ASP  98  10.337  -1.529  -7.161
  778    HA   ASP  98           HA       ASP  98   9.294  -1.115  -9.655
  779    HB2  ASP  98           HB2      ASP  98   7.115  -0.699  -8.404
  780    HB3  ASP  98           HB1      ASP  98   7.946  -2.217  -8.076
  781    H    THR  99           HN       THR  99  10.394   1.323  -7.466
  782    HA   THR  99           HA       THR  99   8.677   3.425  -8.055
  783    HB   THR  99           HB       THR  99  10.848   4.852  -7.740
  784    HG1  THR  99           HG1      THR  99  12.512   3.556  -7.885
  785   HG21  THR  99          HG21      THR  99   9.033   3.885  -5.970
  786   HG22  THR  99          HG22      THR  99  10.353   4.984  -5.570
  787   HG23  THR  99          HG23      THR  99  10.543   3.249  -5.318
  788    H    SER 100           HN       SER 100  11.715   2.575  -9.761
  789    HA   SER 100           HA       SER 100  11.261   4.482 -11.852
  790    HB2  SER 100           HB2      SER 100  13.528   3.601 -11.321
  791    HB3  SER 100           HB1      SER 100  13.017   2.005 -11.873
  792    HG   SER 100           HG       SER 100  12.840   2.779 -13.935
  793    H    ASP 101           HN       ASP 101  10.324   1.275 -11.125
  794    HA   ASP 101           HA       ASP 101   9.488   0.395 -13.676
  795    HB2  ASP 101           HB2      ASP 101   9.956  -0.896 -11.407
  796    HB3  ASP 101           HB1      ASP 101   8.214  -0.697 -11.223
  797    H    MET 102           HN       MET 102   8.063   2.576 -11.427
  798    HA   MET 102           HA       MET 102   5.361   2.108 -11.659
  799    HB2  MET 102           HB2      MET 102   7.050   4.422 -11.068
  800    HB3  MET 102           HB1      MET 102   5.536   4.884 -11.823
  801    HG2  MET 102           HG2      MET 102   4.423   4.588  -9.932
  802    HG3  MET 102           HG1      MET 102   5.065   2.959  -9.740
  803    HE1  MET 102           HE1      MET 102   4.775   5.756  -7.172
  804    HE2  MET 102           HE2      MET 102   4.915   6.460  -8.783
  805    HE3  MET 102           HE3      MET 102   6.172   6.751  -7.584
  806    H    GLU 103           HN       GLU 103   7.358   4.095 -13.880
  807    HA   GLU 103           HA       GLU 103   5.203   4.502 -15.717
  808    HB2  GLU 103           HB2      GLU 103   8.013   5.256 -15.513
  809    HB3  GLU 103           HB1      GLU 103   7.561   4.832 -17.158
  810    HG2  GLU 103           HG2      GLU 103   5.565   6.414 -16.784
  811    HG3  GLU 103           HG1      GLU 103   6.504   7.022 -15.421
  812    H    ALA 104           HN       ALA 104   7.838   2.241 -15.383
  813    HA   ALA 104           HA       ALA 104   7.573   0.931 -17.874
  814    HB1  ALA 104           HB1      ALA 104   9.323   0.845 -15.678
  815    HB2  ALA 104           HB2      ALA 104   9.504   0.065 -17.249
  816    HB3  ALA 104           HB3      ALA 104   8.728  -0.796 -15.920
  817    H    VAL 105           HN       VAL 105   5.796   0.584 -14.915
  818    HA   VAL 105           HA       VAL 105   5.097  -2.097 -15.004
  819    HB   VAL 105           HB       VAL 105   3.397   0.225 -14.084
  820   HG11  VAL 105          HG11      VAL 105   2.421  -1.699 -12.614
  821   HG12  VAL 105          HG12      VAL 105   3.003  -2.730 -13.920
  822   HG13  VAL 105          HG13      VAL 105   1.831  -1.458 -14.258
  823   HG21  VAL 105          HG21      VAL 105   4.319  -1.208 -11.893
  824   HG22  VAL 105          HG22      VAL 105   4.906   0.358 -12.453
  825   HG23  VAL 105          HG23      VAL 105   5.708  -1.121 -12.977
  826    H    TRP 106           HN       TRP 106   3.242   0.619 -16.434
  827    HA   TRP 106           HA       TRP 106   1.512  -1.259 -17.793
  828    HB2  TRP 106           HB2      TRP 106   1.326   1.444 -16.994
  829    HB3  TRP 106           HB1      TRP 106   1.212   1.441 -18.751
  830    HD1  TRP 106           HD1      TRP 106  -0.492  -1.089 -19.308
  831    HE1  TRP 106           HE1      TRP 106  -2.945  -1.232 -18.543
  832    HE3  TRP 106           HE3      TRP 106  -0.398   2.441 -15.611
  833    HZ2  TRP 106           HZ2      TRP 106  -4.619  -0.010 -16.625
  834    HZ3  TRP 106           HZ3      TRP 106  -2.468   2.894 -14.359
  835    HH2  TRP 106           HH2      TRP 106  -4.533   1.693 -14.858
  836    H    LYS 107           HN       LYS 107   4.357   0.582 -18.538
  837    HA   LYS 107           HA       LYS 107   4.027   0.372 -21.395
  838    HB2  LYS 107           HB2      LYS 107   6.138   1.455 -19.575
  839    HB3  LYS 107           HB1      LYS 107   6.534   1.137 -21.258
  840    HG2  LYS 107           HG2      LYS 107   4.083   2.560 -21.202
  841    HG3  LYS 107           HG1      LYS 107   5.219   3.385 -20.133
  842    HD2  LYS 107           HD2      LYS 107   6.035   2.512 -22.885
  843    HD3  LYS 107           HD1      LYS 107   5.179   4.034 -22.629
  844    HE2  LYS 107           HE2      LYS 107   6.973   5.034 -21.708
  845    HE3  LYS 107           HE1      LYS 107   7.455   3.583 -20.831
  846    HZ1  LYS 107           HZ1      LYS 107   8.804   4.565 -22.895
  847    HZ2  LYS 107           HZ2      LYS 107   7.786   3.492 -23.715
  848    HZ3  LYS 107           HZ3      LYS 107   8.803   2.923 -22.489
  849    H    GLU 108           HN       GLU 108   5.743  -1.352 -18.866
  850    HA   GLU 108           HA       GLU 108   7.064  -3.050 -20.845
  851    HB2  GLU 108           HB2      GLU 108   7.309  -3.220 -17.846
  852    HB3  GLU 108           HB1      GLU 108   8.388  -3.904 -19.055
  853    HG2  GLU 108           HG2      GLU 108   7.946  -0.949 -18.805
  854    HG3  GLU 108           HG1      GLU 108   9.160  -1.808 -17.856
  855    H    ALA 109           HN       ALA 109   4.229  -3.069 -18.969
  856    HA   ALA 109           HA       ALA 109   2.535  -4.597 -18.872
  857    HB1  ALA 109           HB1      ALA 109   3.344  -5.321 -21.129
  858    HB2  ALA 109           HB2      ALA 109   2.547  -6.577 -20.181
  859    HB3  ALA 109           HB3      ALA 109   4.304  -6.556 -20.317
  860    H    LYS 110           HN       LYS 110   2.215  -7.061 -18.134
  861    HA   LYS 110           HA       LYS 110   2.961  -7.194 -15.485
  862    HB2  LYS 110           HB2      LYS 110   1.136  -8.475 -16.737
  863    HB3  LYS 110           HB1      LYS 110   2.384  -9.654 -17.111
  864    HG2  LYS 110           HG2      LYS 110   2.236  -8.931 -14.282
  865    HG3  LYS 110           HG1      LYS 110   0.784  -9.710 -14.914
  866    HD2  LYS 110           HD2      LYS 110   3.384 -10.917 -15.657
  867    HD3  LYS 110           HD1      LYS 110   2.880 -11.082 -13.973
  868    HE2  LYS 110           HE2      LYS 110   1.793 -12.899 -14.741
  869    HE3  LYS 110           HE1      LYS 110   0.581 -11.718 -15.237
  870    HZ1  LYS 110           HZ1      LYS 110   1.912 -11.615 -17.397
  871    HZ2  LYS 110           HZ2      LYS 110   0.952 -12.982 -17.131
  872    HZ3  LYS 110           HZ3      LYS 110   2.624 -13.064 -16.889
  873    HA   PRO 111           HA       PRO 111   6.326 -10.600 -16.902
  874    HB2  PRO 111           HB2      PRO 111   7.252  -8.899 -19.185
  875    HB3  PRO 111           HB1      PRO 111   7.312 -10.654 -18.990
  876    HG2  PRO 111           HG2      PRO 111   5.450  -9.531 -20.520
  877    HG3  PRO 111           HG1      PRO 111   5.065 -10.923 -19.493
  878    HD2  PRO 111           HD2      PRO 111   4.362  -8.057 -19.142
  879    HD3  PRO 111           HD1      PRO 111   3.464  -9.507 -18.657
  880    H    GLU 112           HN       GLU 112   6.751  -7.099 -17.433
  881    HA   GLU 112           HA       GLU 112   9.367  -7.073 -16.268
  882    HB2  GLU 112           HB2      GLU 112   7.852  -5.318 -17.810
  883    HB3  GLU 112           HB1      GLU 112   8.028  -4.498 -16.265
  884    HG2  GLU 112           HG2      GLU 112   9.844  -3.770 -17.525
  885    HG3  GLU 112           HG1      GLU 112  10.514  -5.009 -16.463
  886    H    ASP 113           HN       ASP 113   6.125  -6.202 -15.153
  887    HA   ASP 113           HA       ASP 113   6.897  -5.167 -12.650
  888    HB2  ASP 113           HB2      ASP 113   4.429  -5.802 -14.025
  889    HB3  ASP 113           HB1      ASP 113   4.333  -6.243 -12.322
  890    H    LEU 114           HN       LEU 114   6.212  -8.427 -13.746
  891    HA   LEU 114           HA       LEU 114   5.857  -9.737 -11.337
  892    HB2  LEU 114           HB2      LEU 114   5.584 -10.786 -13.537
  893    HB3  LEU 114           HB1      LEU 114   7.319 -10.740 -13.779
  894    HG   LEU 114           HG       LEU 114   7.410 -12.167 -11.602
  895   HD11  LEU 114          HD11      LEU 114   4.832 -11.762 -11.389
  896   HD12  LEU 114          HD12      LEU 114   5.538 -13.317 -10.945
  897   HD13  LEU 114          HD13      LEU 114   4.737 -13.124 -12.505
  898   HD21  LEU 114          HD21      LEU 114   7.809 -13.940 -12.937
  899   HD22  LEU 114          HD22      LEU 114   7.633 -12.745 -14.221
  900   HD23  LEU 114          HD23      LEU 114   6.273 -13.781 -13.789
  901    H    MET 115           HN       MET 115   8.819  -8.602 -12.826
  902    HA   MET 115           HA       MET 115  10.649 -10.021 -11.236
  903    HB2  MET 115           HB2      MET 115  10.740  -7.970 -13.219
  904    HB3  MET 115           HB1      MET 115  11.741  -7.468 -11.863
  905    HG2  MET 115           HG2      MET 115  13.196  -9.236 -12.105
  906    HG3  MET 115           HG1      MET 115  12.017 -10.224 -12.967
  907    HE1  MET 115           HE1      MET 115  11.031  -9.546 -15.195
  908    HE2  MET 115           HE2      MET 115  11.951  -8.791 -16.495
  909    HE3  MET 115           HE3      MET 115  11.097  -7.789 -15.323
  910    H    ASP 116           HN       ASP 116   9.298  -6.750 -10.837
  911    HA   ASP 116           HA       ASP 116  10.617  -6.299  -8.351
  912    HB2  ASP 116           HB2      ASP 116   8.215  -4.855  -9.492
  913    HB3  ASP 116           HB1      ASP 116   9.299  -4.265  -8.236
  914    H    SER 117           HN       SER 117   7.544  -7.604  -9.348
  915    HA   SER 117           HA       SER 117   6.159  -7.417  -6.914
  916    HB2  SER 117           HB2      SER 117   5.873  -9.645  -8.908
  917    HB3  SER 117           HB1      SER 117   4.628  -8.981  -7.850
  918    HG   SER 117           HG       SER 117   4.930  -8.314 -10.269
  919    H    LYS 118           HN       LYS 118   8.040 -10.120  -8.299
  920    HA   LYS 118           HA       LYS 118   7.694 -11.806  -6.054
  921    HB2  LYS 118           HB2      LYS 118   9.105 -11.882  -8.582
  922    HB3  LYS 118           HB1      LYS 118  10.102 -12.535  -7.291
  923    HG2  LYS 118           HG2      LYS 118   8.513 -14.201  -6.773
  924    HG3  LYS 118           HG1      LYS 118   7.273 -13.425  -7.761
  925    HD2  LYS 118           HD2      LYS 118   8.658 -13.870  -9.767
  926    HD3  LYS 118           HD1      LYS 118   9.805 -14.739  -8.744
  927    HE2  LYS 118           HE2      LYS 118   7.113 -15.684  -8.312
  928    HE3  LYS 118           HE1      LYS 118   7.544 -15.776 -10.019
  929    HZ1  LYS 118           HZ1      LYS 118   9.082 -17.357  -9.636
  930    HZ2  LYS 118           HZ2      LYS 118   8.152 -17.663  -8.257
  931    HZ3  LYS 118           HZ3      LYS 118   9.551 -16.720  -8.140
  932    H    LEU 119           HN       LEU 119  10.066  -9.441  -7.004
  933    HA   LEU 119           HA       LEU 119  11.901 -10.050  -4.901
  934    HB2  LEU 119           HB2      LEU 119  12.051  -8.598  -7.208
  935    HB3  LEU 119           HB1      LEU 119  12.080  -7.344  -5.977
  936    HG   LEU 119           HG       LEU 119  13.827  -9.213  -4.981
  937   HD11  LEU 119          HD11      LEU 119  15.212 -10.040  -6.651
  938   HD12  LEU 119          HD12      LEU 119  14.596  -8.913  -7.860
  939   HD13  LEU 119          HD13      LEU 119  13.600 -10.268  -7.327
  940   HD21  LEU 119          HD21      LEU 119  14.605  -6.896  -6.736
  941   HD22  LEU 119          HD22      LEU 119  15.514  -7.588  -5.394
  942   HD23  LEU 119          HD23      LEU 119  14.013  -6.720  -5.085
  943    H    ARG 120           HN       ARG 120   9.630  -7.327  -5.320
  944    HA   ARG 120           HA       ARG 120  10.223  -6.120  -2.848
  945    HB2  ARG 120           HB2      ARG 120   8.029  -5.899  -4.839
  946    HB3  ARG 120           HB1      ARG 120   7.690  -5.307  -3.220
  947    HG2  ARG 120           HG2      ARG 120   8.493  -3.544  -4.725
  948    HG3  ARG 120           HG1      ARG 120   9.557  -3.785  -3.337
  949    HD2  ARG 120           HD2      ARG 120  10.274  -5.433  -5.632
  950    HD3  ARG 120           HD1      ARG 120  10.330  -3.705  -5.977
  951    HE   ARG 120           HE       ARG 120  11.638  -4.079  -3.565
  952   HH11  ARG 120          HH11      ARG 120  12.023  -5.086  -6.881
  953   HH12  ARG 120          HH12      ARG 120  13.749  -5.182  -6.783
  954   HH21  ARG 120          HH21      ARG 120  13.914  -4.219  -3.434
  955   HH22  ARG 120          HH22      ARG 120  14.821  -4.695  -4.828
  956    H    CYS 121           HN       CYS 121   8.074  -8.685  -3.778
  957    HA   CYS 121           HA       CYS 121   6.577  -8.777  -1.358
  958    HB2  CYS 121           HB2      CYS 121   6.935 -10.603  -3.700
  959    HB3  CYS 121           HB1      CYS 121   6.172 -11.225  -2.241
  960    HG   CYS 121           HG       CYS 121   4.979  -8.951  -3.995
  961    H    VAL 122           HN       VAL 122   9.405 -10.524  -2.558
  962    HA   VAL 122           HA       VAL 122   9.627 -12.171  -0.224
  963    HB   VAL 122           HB       VAL 122  10.479 -12.925  -2.402
  964   HG11  VAL 122          HG11      VAL 122  12.655 -10.871  -2.032
  965   HG12  VAL 122          HG12      VAL 122  11.321 -10.738  -3.176
  966   HG13  VAL 122          HG13      VAL 122  12.505 -12.031  -3.351
  967   HG21  VAL 122          HG21      VAL 122  12.387 -12.725  -0.095
  968   HG22  VAL 122          HG22      VAL 122  12.792 -13.625  -1.555
  969   HG23  VAL 122          HG23      VAL 122  11.390 -14.092  -0.592
  970    H    PHE 123           HN       PHE 123  11.409  -9.336  -1.424
  971    HA   PHE 123           HA       PHE 123  13.277  -9.179   0.650
  972    HB2  PHE 123           HB2      PHE 123  12.833  -7.774  -1.639
  973    HB3  PHE 123           HB1      PHE 123  12.327  -6.601  -0.429
  974    HD1  PHE 123           HD1      PHE 123  15.141  -8.588  -1.698
  975    HD2  PHE 123           HD2      PHE 123  13.908  -5.557   1.025
  976    HE1  PHE 123           HE1      PHE 123  17.495  -7.989  -1.305
  977    HE2  PHE 123           HE2      PHE 123  16.261  -4.953   1.421
  978    HZ   PHE 123           HZ       PHE 123  18.057  -6.168   0.255
  979    H    GLU 124           HN       GLU 124  10.053  -7.752   0.347
  980    HA   GLU 124           HA       GLU 124  10.147  -6.303   2.782
  981    HB2  GLU 124           HB2      GLU 124   8.548  -5.990   0.796
  982    HB3  GLU 124           HB1      GLU 124   7.621  -7.313   1.490
  983    HG2  GLU 124           HG2      GLU 124   7.393  -6.022   3.574
  984    HG3  GLU 124           HG1      GLU 124   8.255  -4.685   2.813
  985    H    LEU 125           HN       LEU 125   8.923  -9.508   1.916
  986    HA   LEU 125           HA       LEU 125   7.995 -10.042   4.593
  987    HB2  LEU 125           HB2      LEU 125   7.257 -11.010   2.201
  988    HB3  LEU 125           HB1      LEU 125   8.393 -12.261   2.668
  989    HG   LEU 125           HG       LEU 125   6.199 -12.963   3.316
  990   HD11  LEU 125          HD11      LEU 125   8.292 -12.999   4.972
  991   HD12  LEU 125          HD12      LEU 125   6.720 -13.674   5.400
  992   HD13  LEU 125          HD13      LEU 125   7.170 -12.062   5.959
  993   HD21  LEU 125          HD21      LEU 125   4.844 -11.109   3.433
  994   HD22  LEU 125          HD22      LEU 125   5.998 -10.193   4.402
  995   HD23  LEU 125          HD23      LEU 125   5.055 -11.486   5.143
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1 -11.491   9.574  -1.549
    2    H2   MET   1           HT2      MET   1 -12.069   8.637  -0.232
    3    H3   MET   1           HT3      MET   1 -11.657  10.287   0.000
    4    HA   MET   1           HA       MET   1 -13.940   9.121  -1.409
    5    HB2  MET   1           HB2      MET   1 -13.389  10.653   1.034
    6    HB3  MET   1           HB1      MET   1 -14.729  11.287   0.090
    7    HG2  MET   1           HG2      MET   1 -15.808   9.821   1.470
    8    HG3  MET   1           HG1      MET   1 -15.519   8.809   0.057
    9    HE1  MET   1           HE1      MET   1 -15.797   8.600   3.579
   10    HE2  MET   1           HE2      MET   1 -14.393   9.657   3.735
   11    HE3  MET   1           HE3      MET   1 -14.299   7.979   4.273
   12    H    ALA   2           HN       ALA   2 -11.681  11.776  -1.369
   13    HA   ALA   2           HA       ALA   2 -13.137  13.721  -2.737
   14    HB1  ALA   2           HB1      ALA   2 -11.138  14.488  -1.866
   15    HB2  ALA   2           HB2      ALA   2 -10.773  14.391  -3.588
   16    HB3  ALA   2           HB3      ALA   2 -10.217  13.122  -2.497
   17    H    LYS   3           HN       LYS   3 -10.488  11.986  -4.337
   18    HA   LYS   3           HA       LYS   3 -12.001  12.073  -6.834
   19    HB2  LYS   3           HB2      LYS   3  -9.131  11.268  -6.336
   20    HB3  LYS   3           HB1      LYS   3  -9.885  11.473  -7.910
   21    HG2  LYS   3           HG2      LYS   3  -8.938  13.507  -7.788
   22    HG3  LYS   3           HG1      LYS   3 -10.384  13.889  -6.850
   23    HD2  LYS   3           HD2      LYS   3  -8.814  14.652  -5.390
   24    HD3  LYS   3           HD1      LYS   3  -8.860  12.966  -4.873
   25    HE2  LYS   3           HE2      LYS   3  -6.948  12.479  -6.334
   26    HE3  LYS   3           HE1      LYS   3  -6.893  14.175  -6.813
   27    HZ1  LYS   3           HZ1      LYS   3  -5.355  14.156  -5.150
   28    HZ2  LYS   3           HZ2      LYS   3  -6.127  12.935  -4.272
   29    HZ3  LYS   3           HZ3      LYS   3  -6.733  14.514  -4.236
   30    H    VAL   4           HN       VAL   4 -13.437  10.426  -6.825
   31    HA   VAL   4           HA       VAL   4 -12.564   7.761  -6.035
   32    HB   VAL   4           HB       VAL   4 -15.239   7.682  -7.024
   33   HG11  VAL   4          HG11      VAL   4 -14.192   6.245  -5.301
   34   HG12  VAL   4          HG12      VAL   4 -15.744   6.918  -4.803
   35   HG13  VAL   4          HG13      VAL   4 -14.243   7.605  -4.181
   36   HG21  VAL   4          HG21      VAL   4 -15.542  10.006  -6.731
   37   HG22  VAL   4          HG22      VAL   4 -14.659  10.008  -5.204
   38   HG23  VAL   4          HG23      VAL   4 -16.248   9.249  -5.303
   39    H    GLU   5           HN       GLU   5 -13.861   9.407  -8.919
   40    HA   GLU   5           HA       GLU   5 -14.032   7.201 -10.597
   41    HB2  GLU   5           HB2      GLU   5 -13.410  10.087 -11.210
   42    HB3  GLU   5           HB1      GLU   5 -13.689   8.879 -12.457
   43    HG2  GLU   5           HG2      GLU   5 -15.916   8.444 -11.306
   44    HG3  GLU   5           HG1      GLU   5 -15.616   9.937 -10.419
   45    H    GLN   6           HN       GLN   6 -11.249   9.399 -10.144
   46    HA   GLN   6           HA       GLN   6  -9.531   8.209 -11.994
   47    HB2  GLN   6           HB2      GLN   6  -9.119   9.844  -9.517
   48    HB3  GLN   6           HB1      GLN   6  -7.724   9.090 -10.272
   49    HG2  GLN   6           HG2      GLN   6  -8.892  10.281 -12.415
   50    HG3  GLN   6           HG1      GLN   6  -9.321  11.402 -11.124
   51   HE21  GLN   6          1HE2      GLN   6  -7.965  13.097 -11.603
   52   HE22  GLN   6          2HE2      GLN   6  -6.240  12.975 -11.627
   53    H    VAL   7           HN       VAL   7  -9.874   7.576  -8.526
   54    HA   VAL   7           HA       VAL   7  -8.017   5.373  -8.568
   55    HB   VAL   7           HB       VAL   7  -9.789   6.215  -6.286
   56   HG11  VAL   7          HG11      VAL   7  -7.547   4.329  -6.634
   57   HG12  VAL   7          HG12      VAL   7  -8.899   4.290  -5.504
   58   HG13  VAL   7          HG13      VAL   7  -7.509   5.324  -5.178
   59   HG21  VAL   7          HG21      VAL   7  -8.459   8.112  -7.178
   60   HG22  VAL   7          HG22      VAL   7  -6.994   7.170  -6.897
   61   HG23  VAL   7          HG23      VAL   7  -8.008   7.651  -5.536
   62    H    LEU   8           HN       LEU   8 -11.409   5.618  -9.050
   63    HA   LEU   8           HA       LEU   8 -12.392   3.371  -7.798
   64    HB2  LEU   8           HB2      LEU   8 -13.355   5.224  -9.629
   65    HB3  LEU   8           HB1      LEU   8 -13.568   3.681 -10.429
   66    HG   LEU   8           HG       LEU   8 -14.946   2.856  -8.650
   67   HD11  LEU   8          HD11      LEU   8 -14.005   3.643  -6.673
   68   HD12  LEU   8          HD12      LEU   8 -15.542   4.501  -6.771
   69   HD13  LEU   8          HD13      LEU   8 -14.044   5.322  -7.209
   70   HD21  LEU   8          HD21      LEU   8 -15.623   5.006 -10.282
   71   HD22  LEU   8          HD22      LEU   8 -16.251   5.432  -8.690
   72   HD23  LEU   8          HD23      LEU   8 -16.729   3.914  -9.449
   73    H    SER   9           HN       SER   9 -11.070   3.433 -11.149
   74    HA   SER   9           HA       SER   9 -10.535   1.678 -12.548
   75    HB2  SER   9           HB2      SER   9  -9.339  -0.207 -10.965
   76    HB3  SER   9           HB1      SER   9  -8.544   1.258 -11.540
   77    HG   SER   9           HG       SER   9  -9.820   0.858  -9.031
   78    H    LEU  10           HN       LEU  10 -13.141   1.517 -12.077
   79    HA   LEU  10           HA       LEU  10 -13.960  -1.010 -10.950
   80    HB2  LEU  10           HB2      LEU  10 -16.209  -0.259 -11.790
   81    HB3  LEU  10           HB1      LEU  10 -15.417   0.820 -10.649
   82    HG   LEU  10           HG       LEU  10 -14.542   1.621 -13.177
   83   HD11  LEU  10          HD11      LEU  10 -17.534   1.632 -13.262
   84   HD12  LEU  10          HD12      LEU  10 -16.643   0.232 -13.859
   85   HD13  LEU  10          HD13      LEU  10 -16.371   1.821 -14.575
   86   HD21  LEU  10          HD21      LEU  10 -16.511   3.429 -12.420
   87   HD22  LEU  10          HD22      LEU  10 -14.809   3.475 -11.963
   88   HD23  LEU  10          HD23      LEU  10 -15.985   2.703 -10.901
   89    H    GLU  11           HN       GLU  11 -14.107   0.373 -14.292
   90    HA   GLU  11           HA       GLU  11 -15.079  -2.091 -15.386
   91    HB2  GLU  11           HB2      GLU  11 -14.587   0.583 -16.340
   92    HB3  GLU  11           HB1      GLU  11 -13.860  -0.573 -17.447
   93    HG2  GLU  11           HG2      GLU  11 -16.044  -1.749 -17.560
   94    HG3  GLU  11           HG1      GLU  11 -16.738  -0.456 -16.582
   95    HA   PRO  12           HA       PRO  12 -10.508  -2.816 -16.339
   96    HB2  PRO  12           HB2      PRO  12  -8.752  -0.808 -16.242
   97    HB3  PRO  12           HB1      PRO  12  -9.911  -0.887 -17.573
   98    HG2  PRO  12           HG2      PRO  12  -9.831   0.949 -15.262
   99    HG3  PRO  12           HG1      PRO  12 -10.585   1.171 -16.848
  100    HD2  PRO  12           HD2      PRO  12 -11.817   0.318 -14.372
  101    HD3  PRO  12           HD1      PRO  12 -12.589   0.628 -15.940
  102    H    GLN  13           HN       GLN  13 -10.767  -3.945 -14.267
  103    HA   GLN  13           HA       GLN  13 -10.407  -2.643 -11.831
  104    HB2  GLN  13           HB2      GLN  13 -10.061  -5.543 -12.616
  105    HB3  GLN  13           HB1      GLN  13  -9.886  -4.996 -10.953
  106    HG2  GLN  13           HG2      GLN  13 -12.340  -4.123 -12.310
  107    HG3  GLN  13           HG1      GLN  13 -12.196  -5.860 -12.046
  108   HE21  GLN  13          1HE2      GLN  13 -10.913  -3.286 -10.016
  109   HE22  GLN  13          2HE2      GLN  13 -11.882  -3.644  -8.632
  110    H    HIS  14           HN       HIS  14  -8.070  -3.508 -14.182
  111    HA   HIS  14           HA       HIS  14  -5.816  -3.287 -14.279
  112    HB2  HIS  14           HB2      HIS  14  -6.212  -1.773 -11.694
  113    HB3  HIS  14           HB1      HIS  14  -4.716  -1.809 -12.618
  114    HD1  HIS  14           HD1      HIS  14  -6.193  -1.505 -15.439
  115    HD2  HIS  14           HD2      HIS  14  -6.671   0.928 -12.106
  116    HE1  HIS  14           HE1      HIS  14  -7.016   0.699 -16.329
  117    HE2  HIS  14           HE2      HIS  14  -7.221   2.180 -14.301
  118    H    GLU  15           HN       GLU  15  -4.930  -5.240 -14.109
  119    HA   GLU  15           HA       GLU  15  -4.460  -6.320 -11.411
  120    HB2  GLU  15           HB2      GLU  15  -4.353  -8.016 -13.883
  121    HB3  GLU  15           HB1      GLU  15  -4.666  -8.501 -12.223
  122    HG2  GLU  15           HG2      GLU  15  -6.866  -7.476 -12.317
  123    HG3  GLU  15           HG1      GLU  15  -6.552  -6.928 -13.963
  124    H    LEU  16           HN       LEU  16  -2.591  -4.814 -11.474
  125    HA   LEU  16           HA       LEU  16  -0.229  -6.211 -12.349
  126    HB2  LEU  16           HB2      LEU  16  -0.161  -3.392 -13.165
  127    HB3  LEU  16           HB1      LEU  16   0.524  -4.798 -13.948
  128    HG   LEU  16           HG       LEU  16  -1.866  -5.334 -14.702
  129   HD11  LEU  16          HD11      LEU  16  -2.584  -3.350 -13.018
  130   HD12  LEU  16          HD12      LEU  16  -3.547  -3.868 -14.401
  131   HD13  LEU  16          HD13      LEU  16  -2.489  -2.464 -14.540
  132   HD21  LEU  16          HD21      LEU  16  -0.545  -2.843 -15.764
  133   HD22  LEU  16          HD22      LEU  16  -1.672  -3.886 -16.629
  134   HD23  LEU  16          HD23      LEU  16  -0.081  -4.495 -16.172
  135    H    LYS  17           HN       LYS  17   0.603  -6.296 -10.362
  136    HA   LYS  17           HA       LYS  17   1.923  -4.118  -9.231
  137    HB2  LYS  17           HB2      LYS  17  -0.863  -4.416  -8.412
  138    HB3  LYS  17           HB1      LYS  17   0.246  -4.452  -7.049
  139    HG2  LYS  17           HG2      LYS  17   0.751  -2.275  -7.235
  140    HG3  LYS  17           HG1      LYS  17   0.758  -2.320  -8.999
  141    HD2  LYS  17           HD2      LYS  17  -1.417  -1.731  -9.154
  142    HD3  LYS  17           HD1      LYS  17  -1.878  -2.664  -7.728
  143    HE2  LYS  17           HE2      LYS  17  -0.461  -0.776  -6.511
  144    HE3  LYS  17           HE1      LYS  17  -0.921   0.140  -7.946
  145    HZ1  LYS  17           HZ1      LYS  17  -3.056  -1.334  -6.636
  146    HZ2  LYS  17           HZ2      LYS  17  -3.068   0.213  -7.318
  147    HZ3  LYS  17           HZ3      LYS  17  -2.430  -0.023  -5.770
  148    H    PHE  18           HN       PHE  18   0.470  -7.265  -8.824
  149    HA   PHE  18           HA       PHE  18   2.746  -8.583  -8.015
  150    HB2  PHE  18           HB2      PHE  18   2.070  -8.944  -5.525
  151    HB3  PHE  18           HB1      PHE  18   2.967  -7.496  -5.968
  152    HD1  PHE  18           HD1      PHE  18  -0.628  -8.518  -5.959
  153    HD2  PHE  18           HD2      PHE  18   2.290  -5.627  -4.845
  154    HE1  PHE  18           HE1      PHE  18  -2.394  -7.125  -4.962
  155    HE2  PHE  18           HE2      PHE  18   0.530  -4.230  -3.845
  156    HZ   PHE  18           HZ       PHE  18  -1.817  -4.979  -3.902
  157    H    ARG  19           HN       ARG  19   2.114 -10.704  -6.680
  158    HA   ARG  19           HA       ARG  19   0.403 -12.213  -8.233
  159    HB2  ARG  19           HB2      ARG  19   2.111 -12.891  -6.361
  160    HB3  ARG  19           HB1      ARG  19   0.695 -12.852  -5.320
  161    HG2  ARG  19           HG2      ARG  19   0.520 -14.382  -7.857
  162    HG3  ARG  19           HG1      ARG  19   1.470 -15.058  -6.532
  163    HD2  ARG  19           HD2      ARG  19  -0.352 -15.426  -5.233
  164    HD3  ARG  19           HD1      ARG  19  -1.203 -14.005  -5.839
  165    HE   ARG  19           HE       ARG  19  -2.188 -15.318  -7.435
  166   HH11  ARG  19          HH11      ARG  19   0.513 -17.050  -6.062
  167   HH12  ARG  19          HH12      ARG  19   0.132 -18.533  -6.870
  168   HH21  ARG  19          HH21      ARG  19  -2.690 -17.269  -8.497
  169   HH22  ARG  19          HH22      ARG  19  -1.685 -18.659  -8.250
  170    H    GLY  20           HN       GLY  20  -1.756 -12.970  -7.998
  171    HA2  GLY  20           HA2      GLY  20  -4.004 -12.623  -7.597
  172    HA3  GLY  20           HA1      GLY  20  -3.524 -12.347  -5.925
  173    HA   PRO  21           HA       PRO  21  -3.137  -7.937  -7.653
  174    HB2  PRO  21           HB2      PRO  21  -3.972  -7.712 -10.338
  175    HB3  PRO  21           HB1      PRO  21  -2.338  -7.529  -9.716
  176    HG2  PRO  21           HG2      PRO  21  -3.534  -9.785 -11.154
  177    HG3  PRO  21           HG1      PRO  21  -1.833  -9.366 -10.926
  178    HD2  PRO  21           HD2      PRO  21  -3.154 -11.447  -9.660
  179    HD3  PRO  21           HD1      PRO  21  -1.635 -10.718  -9.118
  180    H    PHE  22           HN       PHE  22  -5.617  -9.512  -9.712
  181    HA   PHE  22           HA       PHE  22  -7.643  -7.700  -8.878
  182    HB2  PHE  22           HB2      PHE  22  -7.778  -8.701 -11.064
  183    HB3  PHE  22           HB1      PHE  22  -7.768 -10.320 -10.374
  184    HD1  PHE  22           HD1      PHE  22  -9.760  -7.218 -10.666
  185    HD2  PHE  22           HD2      PHE  22  -9.755 -11.358  -9.684
  186    HE1  PHE  22           HE1      PHE  22 -12.220  -7.201 -10.597
  187    HE2  PHE  22           HE2      PHE  22 -12.214 -11.348  -9.614
  188    HZ   PHE  22           HZ       PHE  22 -13.449  -9.268 -10.070
  189    H    THR  23           HN       THR  23  -6.688 -10.944  -7.884
  190    HA   THR  23           HA       THR  23  -9.022 -11.503  -6.384
  191    HB   THR  23           HB       THR  23  -7.342 -13.199  -5.257
  192    HG1  THR  23           HG1      THR  23  -5.984 -12.743  -7.679
  193   HG21  THR  23          HG21      THR  23  -8.752 -14.379  -6.531
  194   HG22  THR  23          HG22      THR  23  -7.398 -14.412  -7.661
  195   HG23  THR  23          HG23      THR  23  -8.686 -13.225  -7.862
  196    H    ASP  24           HN       ASP  24  -5.762 -10.528  -5.216
  197    HA   ASP  24           HA       ASP  24  -6.647 -10.408  -2.515
  198    HB2  ASP  24           HB2      ASP  24  -4.204 -10.565  -3.528
  199    HB3  ASP  24           HB1      ASP  24  -4.282  -8.811  -3.381
  200    H    VAL  25           HN       VAL  25  -6.224  -8.006  -5.049
  201    HA   VAL  25           HA       VAL  25  -6.659  -5.732  -3.482
  202    HB   VAL  25           HB       VAL  25  -7.210  -4.477  -5.455
  203   HG11  VAL  25          HG11      VAL  25  -5.221  -5.380  -6.923
  204   HG12  VAL  25          HG12      VAL  25  -4.940  -6.385  -5.500
  205   HG13  VAL  25          HG13      VAL  25  -4.948  -4.627  -5.353
  206   HG21  VAL  25          HG21      VAL  25  -7.548  -7.155  -6.779
  207   HG22  VAL  25          HG22      VAL  25  -7.251  -5.677  -7.687
  208   HG23  VAL  25          HG23      VAL  25  -8.695  -5.818  -6.690
  209    H    VAL  26           HN       VAL  26  -9.067  -7.977  -4.742
  210    HA   VAL  26           HA       VAL  26 -11.295  -6.320  -4.630
  211    HB   VAL  26           HB       VAL  26 -12.669  -8.317  -4.346
  212   HG11  VAL  26          HG11      VAL  26 -10.947  -9.597  -6.203
  213   HG12  VAL  26          HG12      VAL  26 -10.794  -7.854  -6.424
  214   HG13  VAL  26          HG13      VAL  26 -12.380  -8.620  -6.520
  215   HG21  VAL  26          HG21      VAL  26 -11.899  -9.970  -3.070
  216   HG22  VAL  26          HG22      VAL  26 -10.243  -9.373  -3.180
  217   HG23  VAL  26          HG23      VAL  26 -10.880 -10.443  -4.429
  218    H    THR  27           HN       THR  27  -9.596  -7.946  -2.027
  219    HA   THR  27           HA       THR  27 -11.565  -7.594  -0.037
  220    HB   THR  27           HB       THR  27  -8.740  -7.374   0.811
  221    HG1  THR  27           HG1      THR  27  -8.091  -8.847  -0.525
  222   HG21  THR  27          HG21      THR  27  -9.449  -8.467   2.603
  223   HG22  THR  27          HG22      THR  27 -10.203  -9.731   1.630
  224   HG23  THR  27          HG23      THR  27 -11.082  -8.240   1.975
  225    H    THR  28           HN       THR  28  -8.785  -5.636  -1.017
  226    HA   THR  28           HA       THR  28  -9.308  -3.504   0.799
  227    HB   THR  28           HB       THR  28  -7.769  -3.156  -1.753
  228    HG1  THR  28           HG1      THR  28  -6.991  -4.650   0.517
  229   HG21  THR  28          HG21      THR  28  -7.513  -1.206  -0.631
  230   HG22  THR  28          HG22      THR  28  -6.200  -2.125   0.105
  231   HG23  THR  28          HG23      THR  28  -7.738  -1.954   0.951
  232    H    ASN  29           HN       ASN  29 -10.036  -4.090  -2.604
  233    HA   ASN  29           HA       ASN  29 -11.064  -1.594  -3.281
  234    HB2  ASN  29           HB2      ASN  29 -11.415  -4.364  -4.327
  235    HB3  ASN  29           HB1      ASN  29 -12.533  -3.123  -4.884
  236   HD21  ASN  29          1HE2      ASN  29 -11.067  -0.933  -5.166
  237   HD22  ASN  29          2HE2      ASN  29  -9.790  -1.168  -6.305
  238    H    LEU  30           HN       LEU  30 -12.648  -4.374  -1.770
  239    HA   LEU  30           HA       LEU  30 -15.286  -3.457  -1.882
  240    HB2  LEU  30           HB2      LEU  30 -14.830  -5.716  -1.215
  241    HB3  LEU  30           HB1      LEU  30 -13.869  -5.180   0.150
  242    HG   LEU  30           HG       LEU  30 -16.205  -6.087   0.637
  243   HD11  LEU  30          HD11      LEU  30 -14.663  -4.505   2.060
  244   HD12  LEU  30          HD12      LEU  30 -16.313  -4.864   2.564
  245   HD13  LEU  30          HD13      LEU  30 -15.952  -3.341   1.753
  246   HD21  LEU  30          HD21      LEU  30 -18.007  -4.373   0.484
  247   HD22  LEU  30          HD22      LEU  30 -17.470  -4.997  -1.074
  248   HD23  LEU  30          HD23      LEU  30 -16.935  -3.408  -0.529
  249    H    LYS  31           HN       LYS  31 -12.841  -3.046   0.656
  250    HA   LYS  31           HA       LYS  31 -14.522  -1.053   1.966
  251    HB2  LYS  31           HB2      LYS  31 -12.972  -3.004   3.022
  252    HB3  LYS  31           HB1      LYS  31 -11.834  -1.664   3.046
  253    HG2  LYS  31           HG2      LYS  31 -12.898  -1.663   5.144
  254    HG3  LYS  31           HG1      LYS  31 -13.614  -0.330   4.236
  255    HD2  LYS  31           HD2      LYS  31 -15.036  -2.840   3.848
  256    HD3  LYS  31           HD1      LYS  31 -14.987  -2.342   5.541
  257    HE2  LYS  31           HE2      LYS  31 -16.140  -0.378   5.130
  258    HE3  LYS  31           HE1      LYS  31 -15.701  -0.357   3.423
  259    HZ1  LYS  31           HZ1      LYS  31 -17.128  -2.593   3.531
  260    HZ2  LYS  31           HZ2      LYS  31 -17.804  -1.081   3.192
  261    HZ3  LYS  31           HZ3      LYS  31 -17.894  -1.714   4.757
  262    H    LEU  32           HN       LEU  32 -13.907  -0.004  -0.348
  263    HA   LEU  32           HA       LEU  32 -11.390   1.335  -0.457
  264    HB2  LEU  32           HB2      LEU  32 -13.296   0.799  -2.291
  265    HB3  LEU  32           HB1      LEU  32 -13.709   2.459  -1.924
  266    HG   LEU  32           HG       LEU  32 -11.393   1.368  -3.413
  267   HD11  LEU  32          HD11      LEU  32 -11.707   3.806  -4.345
  268   HD12  LEU  32          HD12      LEU  32 -13.272   3.668  -3.544
  269   HD13  LEU  32          HD13      LEU  32 -12.813   2.506  -4.788
  270   HD21  LEU  32          HD21      LEU  32 -11.135   3.575  -1.402
  271   HD22  LEU  32          HD22      LEU  32 -10.186   3.596  -2.887
  272   HD23  LEU  32          HD23      LEU  32 -10.025   2.252  -1.757
  273    H    GLY  33           HN       GLY  33 -12.004   1.907   2.000
  274    HA2  GLY  33           HA2      GLY  33 -12.232   4.747   2.058
  275    HA3  GLY  33           HA1      GLY  33 -13.707   3.990   2.641
  276    H    ASN  34           HN       ASN  34 -13.702   2.889   4.607
  277    HA   ASN  34           HA       ASN  34 -11.621   3.721   6.430
  278    HB2  ASN  34           HB2      ASN  34 -14.375   2.999   6.632
  279    HB3  ASN  34           HB1      ASN  34 -13.453   1.935   7.690
  280   HD21  ASN  34          1HE2      ASN  34 -14.949   4.883   7.425
  281   HD22  ASN  34          2HE2      ASN  34 -14.233   5.677   8.783
  282    HA   PRO  35           HA       PRO  35  -9.721  -0.338   5.924
  283    HB2  PRO  35           HB2      PRO  35  -7.191   0.446   6.301
  284    HB3  PRO  35           HB1      PRO  35  -8.058   0.821   4.809
  285    HG2  PRO  35           HG2      PRO  35  -7.315   2.597   7.050
  286    HG3  PRO  35           HG1      PRO  35  -7.607   2.993   5.350
  287    HD2  PRO  35           HD2      PRO  35  -9.411   3.264   7.564
  288    HD3  PRO  35           HD1      PRO  35  -9.712   3.641   5.857
  289    H    THR  36           HN       THR  36 -10.832   0.826   8.513
  290    HA   THR  36           HA       THR  36  -8.932  -0.404  10.394
  291    HB   THR  36           HB       THR  36 -10.388   0.852  12.117
  292    HG1  THR  36           HG1      THR  36 -11.053   2.336   9.796
  293   HG21  THR  36          HG21      THR  36  -8.827   2.583  10.223
  294   HG22  THR  36          HG22      THR  36  -8.095   1.548  11.449
  295   HG23  THR  36          HG23      THR  36  -9.155   2.873  11.931
  296    H    ASP  37           HN       ASP  37 -12.358  -0.213   9.523
  297    HA   ASP  37           HA       ASP  37 -14.099  -1.638   9.847
  298    HB2  ASP  37           HB2      ASP  37 -12.181  -3.198   8.914
  299    HB3  ASP  37           HB1      ASP  37 -12.243  -3.878  10.537
  300    H    ARG  38           HN       ARG  38 -13.129  -0.126  12.077
  301    HA   ARG  38           HA       ARG  38 -14.420  -1.610  14.189
  302    HB2  ARG  38           HB2      ARG  38 -11.912  -2.205  14.202
  303    HB3  ARG  38           HB1      ARG  38 -11.662  -0.565  14.784
  304    HG2  ARG  38           HG2      ARG  38 -11.848  -1.520  16.802
  305    HG3  ARG  38           HG1      ARG  38 -13.580  -1.396  16.489
  306    HD2  ARG  38           HD2      ARG  38 -12.514  -3.782  15.288
  307    HD3  ARG  38           HD1      ARG  38 -12.091  -3.717  16.997
  308    HE   ARG  38           HE       ARG  38 -14.736  -3.098  16.959
  309   HH11  ARG  38          HH11      ARG  38 -12.850  -5.750  15.697
  310   HH12  ARG  38          HH12      ARG  38 -14.135  -6.900  15.851
  311   HH21  ARG  38          HH21      ARG  38 -16.427  -4.610  17.162
  312   HH22  ARG  38          HH22      ARG  38 -16.166  -6.254  16.682
  313    H    ASN  39           HN       ASN  39 -12.180   1.177  14.099
  314    HA   ASN  39           HA       ASN  39 -14.419   2.864  15.000
  315    HB2  ASN  39           HB2      ASN  39 -12.333   2.178  16.606
  316    HB3  ASN  39           HB1      ASN  39 -11.724   3.669  15.893
  317   HD21  ASN  39          1HE2      ASN  39 -11.847   4.395  18.139
  318   HD22  ASN  39          2HE2      ASN  39 -13.343   5.032  18.723
  319    H    VAL  40           HN       VAL  40 -13.220   5.301  15.011
  320    HA   VAL  40           HA       VAL  40 -13.209   5.983  12.260
  321    HB   VAL  40           HB       VAL  40 -12.593   8.261  13.041
  322   HG11  VAL  40          HG11      VAL  40 -14.770   7.131  14.777
  323   HG12  VAL  40          HG12      VAL  40 -14.949   7.309  13.031
  324   HG13  VAL  40          HG13      VAL  40 -14.672   8.729  14.038
  325   HG21  VAL  40          HG21      VAL  40 -12.244   8.762  15.324
  326   HG22  VAL  40          HG22      VAL  40 -11.191   7.396  14.960
  327   HG23  VAL  40          HG23      VAL  40 -12.704   7.136  15.828
  328    H    CYS  41           HN       CYS  41 -11.322   7.709  11.659
  329    HA   CYS  41           HA       CYS  41  -8.684   7.108  12.428
  330    HB2  CYS  41           HB2      CYS  41  -9.803   5.146  10.763
  331    HB3  CYS  41           HB1      CYS  41  -8.760   6.100   9.716
  332    HG   CYS  41           HG       CYS  41  -6.847   5.561  11.589
  333    H    PHE  42           HN       PHE  42  -7.090   8.269  11.174
  334    HA   PHE  42           HA       PHE  42  -8.096  10.021   9.079
  335    HB2  PHE  42           HB2      PHE  42  -6.707  11.890  10.440
  336    HB3  PHE  42           HB1      PHE  42  -8.445  11.671  10.593
  337    HD1  PHE  42           HD1      PHE  42  -9.238  10.071  12.469
  338    HD2  PHE  42           HD2      PHE  42  -5.367  11.834  12.316
  339    HE1  PHE  42           HE1      PHE  42  -8.979   9.707  14.889
  340    HE2  PHE  42           HE2      PHE  42  -5.102  11.472  14.735
  341    HZ   PHE  42           HZ       PHE  42  -6.910  10.408  16.024
  342    H    LYS  43           HN       LYS  43  -5.189   9.725  11.152
  343    HA   LYS  43           HA       LYS  43  -3.605   8.950   8.859
  344    HB2  LYS  43           HB2      LYS  43  -2.035  10.795   8.994
  345    HB3  LYS  43           HB1      LYS  43  -3.653  11.403   8.671
  346    HG2  LYS  43           HG2      LYS  43  -3.651  11.578  11.341
  347    HG3  LYS  43           HG1      LYS  43  -1.924  11.768  11.033
  348    HD2  LYS  43           HD2      LYS  43  -2.208  13.736   9.879
  349    HD3  LYS  43           HD1      LYS  43  -3.860  13.341   9.400
  350    HE2  LYS  43           HE2      LYS  43  -4.495  13.594  11.828
  351    HE3  LYS  43           HE1      LYS  43  -2.884  14.260  12.097
  352    HZ1  LYS  43           HZ1      LYS  43  -4.070  15.567   9.905
  353    HZ2  LYS  43           HZ2      LYS  43  -3.598  16.217  11.392
  354    HZ3  LYS  43           HZ3      LYS  43  -5.158  15.593  11.202
  355    H    VAL  44           HN       VAL  44  -2.709   7.182   9.737
  356    HA   VAL  44           HA       VAL  44  -2.236   6.288  12.144
  357    HB   VAL  44           HB       VAL  44  -0.526   6.165   9.721
  358   HG11  VAL  44          HG11      VAL  44   1.018   4.572  10.995
  359   HG12  VAL  44          HG12      VAL  44   0.441   5.383  12.450
  360   HG13  VAL  44          HG13      VAL  44   1.278   6.304  11.201
  361   HG21  VAL  44          HG21      VAL  44  -2.483   4.576  11.015
  362   HG22  VAL  44          HG22      VAL  44  -0.980   3.656  10.959
  363   HG23  VAL  44          HG23      VAL  44  -1.680   4.293   9.475
  364    H    LYS  45           HN       LYS  45   0.272   8.382  10.682
  365    HA   LYS  45           HA       LYS  45   1.725   9.871  11.587
  366    HB2  LYS  45           HB2      LYS  45  -0.630  10.320  12.928
  367    HB3  LYS  45           HB1      LYS  45   0.503  10.052  14.244
  368    HG2  LYS  45           HG2      LYS  45   1.144  11.957  12.027
  369    HG3  LYS  45           HG1      LYS  45   0.143  12.446  13.394
  370    HD2  LYS  45           HD2      LYS  45   1.894  12.523  14.802
  371    HD3  LYS  45           HD1      LYS  45   2.611  11.051  14.143
  372    HE2  LYS  45           HE2      LYS  45   3.160  12.567  12.097
  373    HE3  LYS  45           HE1      LYS  45   2.927  13.886  13.242
  374    HZ1  LYS  45           HZ1      LYS  45   5.112  13.521  13.590
  375    HZ2  LYS  45           HZ2      LYS  45   5.054  11.903  13.104
  376    HZ3  LYS  45           HZ3      LYS  45   4.537  12.338  14.655
  377    H    THR  46           HN       THR  46   0.747   8.127  14.545
  378    HA   THR  46           HA       THR  46   3.568   7.340  14.858
  379    HB   THR  46           HB       THR  46   1.553   7.595  17.086
  380    HG1  THR  46           HG1      THR  46   3.320   9.528  16.017
  381   HG21  THR  46          HG21      THR  46   4.207   6.644  17.011
  382   HG22  THR  46          HG22      THR  46   3.169   6.903  18.415
  383   HG23  THR  46          HG23      THR  46   4.219   8.200  17.842
  384    H    THR  47           HN       THR  47   3.944   5.280  14.519
  385    HA   THR  47           HA       THR  47   2.158   3.261  15.619
  386    HB   THR  47           HB       THR  47   2.604   1.992  13.342
  387    HG1  THR  47           HG1      THR  47   2.645   4.718  12.565
  388   HG21  THR  47          HG21      THR  47   0.376   2.224  13.817
  389   HG22  THR  47          HG22      THR  47   0.531   3.205  12.361
  390   HG23  THR  47          HG23      THR  47   0.473   3.980  13.945
  391    H    ALA  48           HN       ALA  48   4.874   3.200  13.338
  392    HA   ALA  48           HA       ALA  48   6.852   2.080  13.355
  393    HB1  ALA  48           HB1      ALA  48   8.012   2.246  15.697
  394    HB2  ALA  48           HB2      ALA  48   6.656   3.314  16.059
  395    HB3  ALA  48           HB3      ALA  48   7.743   3.690  14.722
  396    HA   PRO  49           HA       PRO  49   5.122  -1.771  15.329
  397    HB2  PRO  49           HB2      PRO  49   4.720  -3.212  13.106
  398    HB3  PRO  49           HB1      PRO  49   3.540  -2.011  13.645
  399    HG2  PRO  49           HG2      PRO  49   5.642  -1.779  11.523
  400    HG3  PRO  49           HG1      PRO  49   3.948  -1.255  11.479
  401    HD2  PRO  49           HD2      PRO  49   6.038   0.430  11.998
  402    HD3  PRO  49           HD1      PRO  49   4.391   0.687  12.608
  403    H    ARG  50           HN       ARG  50   5.894  -4.172  14.371
  404    HA   ARG  50           HA       ARG  50   8.712  -4.165  14.847
  405    HB2  ARG  50           HB2      ARG  50   6.578  -6.161  14.591
  406    HB3  ARG  50           HB1      ARG  50   8.124  -6.702  13.951
  407    HG2  ARG  50           HG2      ARG  50   9.157  -6.629  16.002
  408    HG3  ARG  50           HG1      ARG  50   8.022  -5.443  16.650
  409    HD2  ARG  50           HD2      ARG  50   6.392  -7.036  17.061
  410    HD3  ARG  50           HD1      ARG  50   7.069  -8.174  15.896
  411    HE   ARG  50           HE       ARG  50   7.780  -7.899  18.660
  412   HH11  ARG  50          HH11      ARG  50   8.913  -8.915  15.520
  413   HH12  ARG  50          HH12      ARG  50  10.099 -10.002  16.160
  414   HH21  ARG  50          HH21      ARG  50   9.339  -9.330  19.505
  415   HH22  ARG  50          HH22      ARG  50  10.340 -10.238  18.424
  416    H    ARG  51           HN       ARG  51   7.079  -5.859  12.191
  417    HA   ARG  51           HA       ARG  51   8.094  -4.464  10.032
  418    HB2  ARG  51           HB2      ARG  51  10.212  -5.652  11.337
  419    HB3  ARG  51           HB1      ARG  51   9.833  -6.828  10.088
  420    HG2  ARG  51           HG2      ARG  51   9.939  -4.935   8.431
  421    HG3  ARG  51           HG1      ARG  51  10.597  -3.945   9.734
  422    HD2  ARG  51           HD2      ARG  51  11.856  -6.586   9.221
  423    HD3  ARG  51           HD1      ARG  51  12.153  -5.293   8.059
  424    HE   ARG  51           HE       ARG  51  12.639  -4.156  10.495
  425   HH11  ARG  51          HH11      ARG  51  13.858  -6.947   8.790
  426   HH12  ARG  51          HH12      ARG  51  15.423  -6.870   9.528
  427   HH21  ARG  51          HH21      ARG  51  14.696  -4.053  11.466
  428   HH22  ARG  51          HH22      ARG  51  15.899  -5.227  11.048
  429    H    TYR  52           HN       TYR  52   6.000  -5.111   9.360
  430    HA   TYR  52           HA       TYR  52   5.977  -7.508   7.820
  431    HB2  TYR  52           HB2      TYR  52   5.138  -7.771  10.497
  432    HB3  TYR  52           HB1      TYR  52   3.674  -7.800   9.522
  433    HD1  TYR  52           HD1      TYR  52   3.994  -9.312   7.283
  434    HD2  TYR  52           HD2      TYR  52   6.077  -9.817  10.958
  435    HE1  TYR  52           HE1      TYR  52   4.415 -11.666   6.713
  436    HE2  TYR  52           HE2      TYR  52   6.507 -12.172  10.398
  437    HH   TYR  52           HH       TYR  52   6.661 -13.505   8.032
  438    H    CYS  53           HN       CYS  53   3.702  -5.281   9.459
  439    HA   CYS  53           HA       CYS  53   2.876  -3.789   7.313
  440    HB2  CYS  53           HB2      CYS  53   2.008  -6.472   6.871
  441    HB3  CYS  53           HB1      CYS  53   0.579  -5.531   7.263
  442    HG   CYS  53           HG       CYS  53   0.866  -5.389   4.683
  443    H    VAL  54           HN       VAL  54   1.311  -2.320   7.917
  444    HA   VAL  54           HA       VAL  54   0.594  -2.269  10.682
  445    HB   VAL  54           HB       VAL  54  -0.716  -0.218  10.039
  446   HG11  VAL  54          HG11      VAL  54   1.361   1.078   9.354
  447   HG12  VAL  54          HG12      VAL  54   2.200  -0.474   9.356
  448   HG13  VAL  54          HG13      VAL  54   1.467   0.135  10.840
  449   HG21  VAL  54          HG21      VAL  54   0.580  -0.118   7.401
  450   HG22  VAL  54          HG22      VAL  54  -1.016   0.434   7.904
  451   HG23  VAL  54          HG23      VAL  54  -0.747  -1.271   7.544
  452    H    ARG  55           HN       ARG  55  -1.269  -2.852  11.664
  453    HA   ARG  55           HA       ARG  55  -3.746  -3.125  10.237
  454    HB2  ARG  55           HB2      ARG  55  -2.020  -5.437  10.678
  455    HB3  ARG  55           HB1      ARG  55  -3.658  -5.672  11.256
  456    HG2  ARG  55           HG2      ARG  55  -4.572  -5.331   9.108
  457    HG3  ARG  55           HG1      ARG  55  -3.047  -4.706   8.479
  458    HD2  ARG  55           HD2      ARG  55  -2.158  -7.072   9.206
  459    HD3  ARG  55           HD1      ARG  55  -3.858  -7.513   9.062
  460    HE   ARG  55           HE       ARG  55  -2.864  -6.105   6.771
  461   HH11  ARG  55          HH11      ARG  55  -3.115  -9.238   8.288
  462   HH12  ARG  55          HH12      ARG  55  -2.979 -10.109   6.798
  463   HH21  ARG  55          HH21      ARG  55  -2.685  -7.248   4.810
  464   HH22  ARG  55          HH22      ARG  55  -2.732  -8.980   4.823
  465    H    SER  56           HN       SER  56  -3.689  -1.500  12.138
  466    HA   SER  56           HA       SER  56  -4.768  -0.907  14.074
  467    HB2  SER  56           HB2      SER  56  -5.400  -3.692  14.879
  468    HB3  SER  56           HB1      SER  56  -6.416  -2.251  14.909
  469    HG   SER  56           HG       SER  56  -6.033  -2.624  12.408
  470    H    ASN  57           HN       ASN  57  -1.965  -1.552  13.936
  471    HA   ASN  57           HA       ASN  57  -1.343  -2.959  16.393
  472    HB2  ASN  57           HB2      ASN  57   0.288  -1.747  14.196
  473    HB3  ASN  57           HB1      ASN  57   1.053  -2.197  15.717
  474   HD21  ASN  57          1HE2      ASN  57   0.468  -4.459  16.471
  475   HD22  ASN  57          2HE2      ASN  57   0.487  -5.693  15.262
  476    H    SER  58           HN       SER  58  -1.323   0.445  15.357
  477    HA   SER  58           HA       SER  58  -0.015   1.262  17.803
  478    HB2  SER  58           HB2      SER  58   0.481   2.470  15.770
  479    HB3  SER  58           HB1      SER  58  -1.217   2.892  15.566
  480    HG   SER  58           HG       SER  58   0.201   3.611  17.897
  481    H    GLY  59           HN       GLY  59  -3.357   1.386  16.573
  482    HA2  GLY  59           HA2      GLY  59  -4.650   1.230  18.940
  483    HA3  GLY  59           HA1      GLY  59  -4.253   2.937  18.823
  484    H    ILE  60           HN       ILE  60  -5.139   0.812  16.127
  485    HA   ILE  60           HA       ILE  60  -6.930   0.781  14.736
  486    HB   ILE  60           HB       ILE  60  -8.404   2.446  16.771
  487   HG12  ILE  60          HG12      ILE  60  -7.441   0.423  17.819
  488   HG13  ILE  60          HG11      ILE  60  -9.199   0.352  17.738
  489   HG21  ILE  60          HG21      ILE  60  -9.461   2.303  14.580
  490   HG22  ILE  60          HG22      ILE  60 -10.389   1.412  15.786
  491   HG23  ILE  60          HG23      ILE  60  -9.369   0.544  14.639
  492   HD11  ILE  60          HD11      ILE  60  -8.918  -1.677  16.886
  493   HD12  ILE  60          HD12      ILE  60  -7.205  -1.399  16.568
  494   HD13  ILE  60          HD13      ILE  60  -8.417  -0.865  15.403
  495    H    ILE  61           HN       ILE  61  -6.798   4.003  16.304
  496    HA   ILE  61           HA       ILE  61  -7.535   5.334  13.867
  497    HB   ILE  61           HB       ILE  61  -7.078   5.996  16.675
  498   HG12  ILE  61          HG12      ILE  61  -8.835   7.832  15.730
  499   HG13  ILE  61          HG11      ILE  61  -9.003   6.581  14.504
  500   HG21  ILE  61          HG21      ILE  61  -6.740   8.436  16.220
  501   HG22  ILE  61          HG22      ILE  61  -6.339   8.004  14.557
  502   HG23  ILE  61          HG23      ILE  61  -5.342   7.412  15.886
  503   HD11  ILE  61          HD11      ILE  61  -9.035   5.420  17.129
  504   HD12  ILE  61          HD12      ILE  61 -10.250   5.352  15.853
  505   HD13  ILE  61          HD13      ILE  61 -10.243   6.697  16.995
  506    H    ASP  62           HN       ASP  62  -4.586   4.852  15.709
  507    HA   ASP  62           HA       ASP  62  -2.990   6.406  13.875
  508    HB2  ASP  62           HB2      ASP  62  -2.427   4.975  16.461
  509    HB3  ASP  62           HB1      ASP  62  -1.115   5.544  15.435
  510    H    ALA  63           HN       ALA  63  -3.975   3.175  14.426
  511    HA   ALA  63           HA       ALA  63  -1.744   1.954  13.059
  512    HB1  ALA  63           HB1      ALA  63  -4.318   0.799  14.067
  513    HB2  ALA  63           HB2      ALA  63  -2.790   0.860  14.932
  514    HB3  ALA  63           HB3      ALA  63  -2.938  -0.122  13.479
  515    H    GLY  64           HN       GLY  64  -5.114   2.710  12.197
  516    HA2  GLY  64           HA2      GLY  64  -4.546   1.516   9.549
  517    HA3  GLY  64           HA1      GLY  64  -6.131   1.498  10.296
  518    H    ALA  65           HN       ALA  65  -3.742   4.074   9.736
  519    HA   ALA  65           HA       ALA  65  -5.747   5.417   8.072
  520    HB1  ALA  65           HB1      ALA  65  -4.840   7.585   9.183
  521    HB2  ALA  65           HB2      ALA  65  -4.412   6.500  10.503
  522    HB3  ALA  65           HB3      ALA  65  -6.088   6.636   9.980
  523    H    SER  66           HN       SER  66  -2.824   4.074   8.007
  524    HA   SER  66           HA       SER  66  -1.821   6.039   6.061
  525    HB2  SER  66           HB2      SER  66  -0.383   4.788   8.338
  526    HB3  SER  66           HB1      SER  66   0.499   4.908   6.819
  527    HG   SER  66           HG       SER  66  -0.862   7.106   7.969
  528    H    ILE  67           HN       ILE  67  -3.440   3.561   5.793
  529    HA   ILE  67           HA       ILE  67  -1.846   1.477   4.747
  530    HB   ILE  67           HB       ILE  67  -4.174   1.120   5.423
  531   HG12  ILE  67          HG12      ILE  67  -3.801   0.595   2.465
  532   HG13  ILE  67          HG11      ILE  67  -3.087  -0.377   3.749
  533   HG21  ILE  67          HG21      ILE  67  -5.340   2.240   2.980
  534   HG22  ILE  67          HG22      ILE  67  -4.726   3.437   4.120
  535   HG23  ILE  67          HG23      ILE  67  -5.935   2.263   4.637
  536   HD11  ILE  67          HD11      ILE  67  -5.091  -1.409   2.825
  537   HD12  ILE  67          HD12      ILE  67  -6.034   0.009   3.282
  538   HD13  ILE  67          HD13      ILE  67  -5.299  -1.000   4.528
  539    H    ASN  68           HN       ASN  68  -2.582   4.552   3.584
  540    HA   ASN  68           HA       ASN  68  -1.453   5.501   1.724
  541    HB2  ASN  68           HB2      ASN  68  -0.509   3.190   1.142
  542    HB3  ASN  68           HB1      ASN  68  -1.963   2.956   0.180
  543   HD21  ASN  68          1HE2      ASN  68  -0.159   2.700  -1.463
  544   HD22  ASN  68          2HE2      ASN  68   0.330   4.130  -2.301
  545    H    VAL  69           HN       VAL  69  -4.468   4.107   2.199
  546    HA   VAL  69           HA       VAL  69  -5.682   5.107  -0.232
  547    HB   VAL  69           HB       VAL  69  -7.054   3.940   2.188
  548   HG11  VAL  69          HG11      VAL  69  -8.987   4.042   1.049
  549   HG12  VAL  69          HG12      VAL  69  -8.222   3.628  -0.486
  550   HG13  VAL  69          HG13      VAL  69  -8.169   5.288   0.107
  551   HG21  VAL  69          HG21      VAL  69  -6.892   1.809   1.243
  552   HG22  VAL  69          HG22      VAL  69  -5.283   2.494   1.019
  553   HG23  VAL  69          HG23      VAL  69  -6.414   2.442  -0.332
  554    H    SER  70           HN       SER  70  -5.467   6.057   3.157
  555    HA   SER  70           HA       SER  70  -7.542   7.892   3.279
  556    HB2  SER  70           HB2      SER  70  -4.987   7.510   4.736
  557    HB3  SER  70           HB1      SER  70  -5.748   9.093   4.889
  558    HG   SER  70           HG       SER  70  -7.689   7.934   5.488
  559    H    VAL  71           HN       VAL  71  -4.190   8.426   2.274
  560    HA   VAL  71           HA       VAL  71  -4.467  10.066   0.176
  561    HB   VAL  71           HB       VAL  71  -5.878  11.593   1.497
  562   HG11  VAL  71          HG11      VAL  71  -5.343  12.437   3.509
  563   HG12  VAL  71          HG12      VAL  71  -3.645  12.653   3.083
  564   HG13  VAL  71          HG13      VAL  71  -4.235  11.066   3.580
  565   HG21  VAL  71          HG21      VAL  71  -5.065  13.464   0.513
  566   HG22  VAL  71          HG22      VAL  71  -4.018  12.289  -0.282
  567   HG23  VAL  71          HG23      VAL  71  -3.425  13.200   1.106
  568    H    MET  72           HN       MET  72  -2.582   8.320   1.410
  569    HA   MET  72           HA       MET  72  -0.328   8.031   1.519
  570    HB2  MET  72           HB2      MET  72  -0.629   9.959  -0.376
  571    HB3  MET  72           HB1      MET  72   0.382  10.801   0.790
  572    HG2  MET  72           HG2      MET  72   2.188   9.602   0.271
  573    HG3  MET  72           HG1      MET  72   1.285   8.090   0.210
  574    HE1  MET  72           HE1      MET  72   3.434  10.245  -2.413
  575    HE2  MET  72           HE2      MET  72   3.419   8.586  -3.010
  576    HE3  MET  72           HE3      MET  72   3.662   8.903  -1.292
  577    H    LEU  73           HN       LEU  73  -0.754  11.467   2.379
  578    HA   LEU  73           HA       LEU  73  -0.236  12.649   4.247
  579    HB2  LEU  73           HB2      LEU  73  -0.818   9.941   5.354
  580    HB3  LEU  73           HB1      LEU  73  -0.123  11.152   6.413
  581    HG   LEU  73           HG       LEU  73  -2.525  11.922   4.837
  582   HD11  LEU  73          HD11      LEU  73  -2.529   9.995   7.143
  583   HD12  LEU  73          HD12      LEU  73  -3.307   9.825   5.568
  584   HD13  LEU  73          HD13      LEU  73  -3.925  10.993   6.737
  585   HD21  LEU  73          HD21      LEU  73  -2.961  12.893   7.237
  586   HD22  LEU  73          HD22      LEU  73  -1.823  13.673   6.138
  587   HD23  LEU  73          HD23      LEU  73  -1.228  12.624   7.425
  588    H    GLN  74           HN       GLN  74   1.421  12.836   6.066
  589    HA   GLN  74           HA       GLN  74   3.986  12.657   5.022
  590    HB2  GLN  74           HB2      GLN  74   2.826  13.225   7.684
  591    HB3  GLN  74           HB1      GLN  74   4.516  12.737   7.672
  592    HG2  GLN  74           HG2      GLN  74   4.819  14.541   5.878
  593    HG3  GLN  74           HG1      GLN  74   3.244  15.132   6.404
  594   HE21  GLN  74          1HE2      GLN  74   4.922  16.972   6.737
  595   HE22  GLN  74          2HE2      GLN  74   5.552  17.098   8.342
  596    HA   PRO  75           HA       PRO  75   5.567   8.584   5.451
  597    HB2  PRO  75           HB2      PRO  75   7.738   9.756   7.131
  598    HB3  PRO  75           HB1      PRO  75   7.855   8.703   5.716
  599    HG2  PRO  75           HG2      PRO  75   8.370  11.305   5.511
  600    HG3  PRO  75           HG1      PRO  75   7.503  10.446   4.225
  601    HD2  PRO  75           HD2      PRO  75   6.456  12.321   6.294
  602    HD3  PRO  75           HD1      PRO  75   5.928  12.078   4.616
  603    H    PHE  76           HN       PHE  76   6.069   6.896   7.040
  604    HA   PHE  76           HA       PHE  76   4.885   7.494   9.671
  605    HB2  PHE  76           HB2      PHE  76   4.727   4.769   9.465
  606    HB3  PHE  76           HB1      PHE  76   3.424   5.884   9.071
  607    HD1  PHE  76           HD2      PHE  76   3.337   6.730   6.628
  608    HD2  PHE  76           HD1      PHE  76   5.489   3.277   7.875
  609    HE1  PHE  76           HE2      PHE  76   3.307   5.883   4.318
  610    HE2  PHE  76           HE1      PHE  76   5.464   2.423   5.568
  611    HZ   PHE  76           HZ       PHE  76   4.371   3.727   3.786
  612    H    ASP  77           HN       ASP  77   7.089   5.089   8.208
  613    HA   ASP  77           HA       ASP  77   8.554   4.944  10.724
  614    HB2  ASP  77           HB2      ASP  77   8.622   3.305   8.193
  615    HB3  ASP  77           HB1      ASP  77   9.813   3.104   9.473
  616    H    TYR  78           HN       TYR  78   8.802   7.394   9.401
  617    HA   TYR  78           HA       TYR  78  11.435   7.323   8.129
  618    HB2  TYR  78           HB2      TYR  78   9.389   8.634   7.220
  619    HB3  TYR  78           HB1      TYR  78   9.762   9.797   8.485
  620    HD1  TYR  78           HD1      TYR  78  12.799   9.591   8.345
  621    HD2  TYR  78           HD2      TYR  78   9.831   9.940   5.314
  622    HE1  TYR  78           HE1      TYR  78  14.441  10.665   6.870
  623    HE2  TYR  78           HE2      TYR  78  11.470  11.014   3.830
  624    HH   TYR  78           HH       TYR  78  14.827  11.081   4.537
  625    H    ASP  79           HN       ASP  79   9.894   9.638  10.364
  626    HA   ASP  79           HA       ASP  79  12.341  10.448  11.492
  627    HB2  ASP  79           HB2      ASP  79   9.479  10.907  12.106
  628    HB3  ASP  79           HB1      ASP  79  10.620  11.194  13.417
  629    HA   PRO  80           HA       PRO  80  11.792   7.753  15.309
  630    HB2  PRO  80           HB2      PRO  80   9.447   6.703  16.051
  631    HB3  PRO  80           HB1      PRO  80   9.806   8.413  16.325
  632    HG2  PRO  80           HG2      PRO  80   8.185   7.146  14.147
  633    HG3  PRO  80           HG1      PRO  80   7.824   8.589  15.113
  634    HD2  PRO  80           HD2      PRO  80   8.875   8.676  12.589
  635    HD3  PRO  80           HD1      PRO  80   9.129   9.939  13.809
  636    H    ASN  81           HN       ASN  81  12.879   6.526  13.461
  637    HA   ASN  81           HA       ASN  81  12.645   3.818  13.710
  638    HB2  ASN  81           HB2      ASN  81  10.488   4.848  12.067
  639    HB3  ASN  81           HB1      ASN  81  11.461   3.681  11.183
  640   HD21  ASN  81          1HE2      ASN  81  10.010   2.044  11.150
  641   HD22  ASN  81          2HE2      ASN  81   9.467   1.209  12.561
  642    H    GLU  82           HN       GLU  82  14.724   5.234  13.445
  643    HA   GLU  82           HA       GLU  82  15.703   5.590  10.790
  644    HB2  GLU  82           HB2      GLU  82  16.514   6.355  13.398
  645    HB3  GLU  82           HB1      GLU  82  17.850   5.460  12.688
  646    HG2  GLU  82           HG2      GLU  82  18.428   7.411  11.788
  647    HG3  GLU  82           HG1      GLU  82  17.129   7.101  10.637
  648    H    LYS  83           HN       LYS  83  16.116   3.084  13.266
  649    HA   LYS  83           HA       LYS  83  18.135   1.632  11.931
  650    HB2  LYS  83           HB2      LYS  83  16.372   1.224  14.193
  651    HB3  LYS  83           HB1      LYS  83  16.473  -0.243  13.230
  652    HG2  LYS  83           HG2      LYS  83  19.092   0.497  13.389
  653    HG3  LYS  83           HG1      LYS  83  18.466   1.020  14.954
  654    HD2  LYS  83           HD2      LYS  83  17.994  -1.111  15.632
  655    HD3  LYS  83           HD1      LYS  83  17.711  -1.687  13.988
  656    HE2  LYS  83           HE2      LYS  83  20.370  -1.012  13.941
  657    HE3  LYS  83           HE1      LYS  83  20.165  -1.652  15.571
  658    HZ1  LYS  83           HZ1      LYS  83  19.516  -3.711  14.768
  659    HZ2  LYS  83           HZ2      LYS  83  20.745  -3.268  13.693
  660    HZ3  LYS  83           HZ3      LYS  83  19.124  -3.118  13.232
  661    H    SER  84           HN       SER  84  14.627   1.422  11.928
  662    HA   SER  84           HA       SER  84  14.357  -0.597   9.978
  663    HB2  SER  84           HB2      SER  84  12.463   1.648  10.685
  664    HB3  SER  84           HB1      SER  84  12.038   0.234   9.720
  665    HG   SER  84           HG       SER  84  13.051   0.088  12.364
  666    H    LYS  85           HN       LYS  85  15.172   2.725   9.711
  667    HA   LYS  85           HA       LYS  85  15.319   4.177   7.922
  668    HB2  LYS  85           HB2      LYS  85  17.364   2.949   7.818
  669    HB3  LYS  85           HB1      LYS  85  16.615   1.661   6.889
  670    HG2  LYS  85           HG2      LYS  85  16.122   3.634   5.209
  671    HG3  LYS  85           HG1      LYS  85  17.496   4.368   6.035
  672    HD2  LYS  85           HD2      LYS  85  17.580   1.585   4.897
  673    HD3  LYS  85           HD1      LYS  85  18.018   3.012   3.956
  674    HE2  LYS  85           HE2      LYS  85  19.875   3.468   5.278
  675    HE3  LYS  85           HE1      LYS  85  19.268   2.513   6.630
  676    HZ1  LYS  85           HZ1      LYS  85  19.736   0.510   5.458
  677    HZ2  LYS  85           HZ2      LYS  85  21.129   1.467   5.395
  678    HZ3  LYS  85           HZ3      LYS  85  20.125   1.345   4.040
  679    H    HIS  86           HN       HIS  86  13.194   4.566   7.235
  680    HA   HIS  86           HA       HIS  86  12.367   3.036   4.831
  681    HB2  HIS  86           HB2      HIS  86  10.932   3.442   7.304
  682    HB3  HIS  86           HB1      HIS  86  10.003   4.037   5.932
  683    HD1  HIS  86           HD1      HIS  86  10.979   1.840   3.893
  684    HD2  HIS  86           HD2      HIS  86   9.499   1.126   7.710
  685    HE1  HIS  86           HE1      HIS  86  10.122  -0.524   3.850
  686    HE2  HIS  86           HE2      HIS  86   9.313  -0.963   6.196
  687    H    LYS  87           HN       LYS  87  10.603   4.178   3.518
  688    HA   LYS  87           HA       LYS  87  10.055   6.871   3.470
  689    HB2  LYS  87           HB2      LYS  87  12.772   6.299   2.562
  690    HB3  LYS  87           HB1      LYS  87  11.828   7.188   1.377
  691    HG2  LYS  87           HG2      LYS  87  11.572   9.023   2.755
  692    HG3  LYS  87           HG1      LYS  87  11.899   8.096   4.220
  693    HD2  LYS  87           HD2      LYS  87  14.061   8.272   2.193
  694    HD3  LYS  87           HD1      LYS  87  13.701   9.722   3.131
  695    HE2  LYS  87           HE2      LYS  87  14.015   8.470   5.202
  696    HE3  LYS  87           HE1      LYS  87  14.345   7.007   4.275
  697    HZ1  LYS  87           HZ1      LYS  87  16.366   7.833   3.541
  698    HZ2  LYS  87           HZ2      LYS  87  16.313   8.367   5.145
  699    HZ3  LYS  87           HZ3      LYS  87  15.967   9.441   3.884
  700    H    PHE  88           HN       PHE  88   8.542   7.288   1.778
  701    HA   PHE  88           HA       PHE  88   7.742   5.060   0.193
  702    HB2  PHE  88           HB2      PHE  88   5.944   6.523  -0.596
  703    HB3  PHE  88           HB1      PHE  88   6.110   6.566   1.156
  704    HD1  PHE  88           HD1      PHE  88   6.957   8.551   2.277
  705    HD2  PHE  88           HD2      PHE  88   6.437   8.449  -1.945
  706    HE1  PHE  88           HE1      PHE  88   7.131  11.004   2.200
  707    HE2  PHE  88           HE2      PHE  88   6.611  10.902  -2.030
  708    HZ   PHE  88           HZ       PHE  88   6.958  12.182   0.044
  709    H    MET  89           HN       MET  89   8.975   8.321  -0.916
  710    HA   MET  89           HA       MET  89   8.961   7.389  -3.653
  711    HB2  MET  89           HB2      MET  89   9.467   9.957  -2.330
  712    HB3  MET  89           HB1      MET  89  10.664   9.645  -3.569
  713    HG2  MET  89           HG2      MET  89   8.793   9.355  -5.229
  714    HG3  MET  89           HG1      MET  89   7.655   9.810  -3.965
  715    HE1  MET  89           HE1      MET  89   6.798  11.512  -5.958
  716    HE2  MET  89           HE2      MET  89   8.048  12.247  -6.963
  717    HE3  MET  89           HE3      MET  89   7.252  13.199  -5.717
  718    H    VAL  90           HN       VAL  90  11.233   7.675  -1.043
  719    HA   VAL  90           HA       VAL  90  13.601   6.836  -2.447
  720    HB   VAL  90           HB       VAL  90  13.417   6.699   0.519
  721   HG11  VAL  90          HG11      VAL  90  15.556   6.222  -0.007
  722   HG12  VAL  90          HG12      VAL  90  15.701   7.979  -0.064
  723   HG13  VAL  90          HG13      VAL  90  15.478   7.063  -1.556
  724   HG21  VAL  90          HG21      VAL  90  13.263   9.191  -1.138
  725   HG22  VAL  90          HG22      VAL  90  14.053   9.206   0.438
  726   HG23  VAL  90          HG23      VAL  90  12.351   8.760   0.308
  727    H    GLN  91           HN       GLN  91  10.985   5.107  -1.202
  728    HA   GLN  91           HA       GLN  91  12.133   2.892  -0.031
  729    HB2  GLN  91           HB2      GLN  91   9.584   3.649  -0.750
  730    HB3  GLN  91           HB1      GLN  91   9.847   2.204  -1.713
  731    HG2  GLN  91           HG2      GLN  91   9.885   0.838   0.085
  732    HG3  GLN  91           HG1      GLN  91  10.614   2.053   1.134
  733   HE21  GLN  91          1HE2      GLN  91   7.634   1.952  -0.792
  734   HE22  GLN  91          2HE2      GLN  91   6.573   2.337   0.516
  735    H    SER  92           HN       SER  92  12.428   3.760  -3.330
  736    HA   SER  92           HA       SER  92  12.497   1.252  -4.558
  737    HB2  SER  92           HB2      SER  92  14.193   3.644  -5.292
  738    HB3  SER  92           HB1      SER  92  13.713   2.320  -6.352
  739    HG   SER  92           HG       SER  92  12.193   4.450  -5.353
  740    H    MET  93           HN       MET  93  14.734   2.569  -2.289
  741    HA   MET  93           HA       MET  93  17.030   1.091  -3.153
  742    HB2  MET  93           HB2      MET  93  17.105   3.215  -1.762
  743    HB3  MET  93           HB1      MET  93  16.507   2.261  -0.412
  744    HG2  MET  93           HG2      MET  93  18.681   2.029   0.058
  745    HG3  MET  93           HG1      MET  93  18.611   0.758  -1.162
  746    HE1  MET  93           HE1      MET  93  21.763   1.817  -1.095
  747    HE2  MET  93           HE2      MET  93  21.645   1.581  -2.839
  748    HE3  MET  93           HE3      MET  93  20.726   0.547  -1.745
  749    H    PHE  94           HN       PHE  94  14.523   0.858  -0.722
  750    HA   PHE  94           HA       PHE  94  15.360  -1.605   0.426
  751    HB2  PHE  94           HB2      PHE  94  13.909  -0.366   1.773
  752    HB3  PHE  94           HB1      PHE  94  12.835   0.018   0.436
  753    HD1  PHE  94           HD1      PHE  94  11.390  -1.859  -0.497
  754    HD2  PHE  94           HD2      PHE  94  13.433  -2.115   3.227
  755    HE1  PHE  94           HE1      PHE  94   9.865  -3.654   0.209
  756    HE2  PHE  94           HE2      PHE  94  11.912  -3.914   3.941
  757    HZ   PHE  94           HZ       PHE  94  10.125  -4.685   2.432
  758    H    ALA  95           HN       ALA  95  14.135  -0.879  -2.593
  759    HA   ALA  95           HA       ALA  95  13.983  -3.553  -3.454
  760    HB1  ALA  95           HB1      ALA  95  11.453  -2.234  -2.656
  761    HB2  ALA  95           HB2      ALA  95  11.892  -3.941  -2.653
  762    HB3  ALA  95           HB3      ALA  95  11.444  -3.149  -4.164
  763    HA   PRO  96           HA       PRO  96  15.151  -0.360  -6.605
  764    HB2  PRO  96           HB2      PRO  96  16.239  -2.412  -8.195
  765    HB3  PRO  96           HB1      PRO  96  17.124  -1.327  -7.122
  766    HG2  PRO  96           HG2      PRO  96  16.178  -4.107  -6.646
  767    HG3  PRO  96           HG1      PRO  96  17.645  -3.300  -6.061
  768    HD2  PRO  96           HD2      PRO  96  15.563  -3.736  -4.444
  769    HD3  PRO  96           HD1      PRO  96  16.514  -2.240  -4.328
  770    H    THR  97           HN       THR  97  13.293  -3.297  -6.811
  771    HA   THR  97           HA       THR  97  12.490  -3.033  -9.518
  772    HB   THR  97           HB       THR  97  10.468  -4.460  -8.415
  773    HG1  THR  97           HG1      THR  97  10.934  -5.107  -6.489
  774   HG21  THR  97          HG21      THR  97  11.745  -5.470 -10.095
  775   HG22  THR  97          HG22      THR  97  11.952  -6.495  -8.675
  776   HG23  THR  97          HG23      THR  97  13.227  -5.371  -9.147
  777    H    ASP  98           HN       ASP  98  11.476  -1.517  -6.590
  778    HA   ASP  98           HA       ASP  98   8.847  -0.857  -7.202
  779    HB2  ASP  98           HB2      ASP  98  10.481  -0.385  -5.090
  780    HB3  ASP  98           HB1      ASP  98  10.395   1.226  -5.798
  781    H    THR  99           HN       THR  99  11.801   1.013  -7.878
  782    HA   THR  99           HA       THR  99  10.550   3.190  -9.102
  783    HB   THR  99           HB       THR  99  13.269   1.988  -9.674
  784    HG1  THR  99           HG1      THR  99  12.516   4.143  -7.992
  785   HG21  THR  99          HG21      THR  99  11.954   4.391 -10.731
  786   HG22  THR  99          HG22      THR  99  13.291   3.442 -11.380
  787   HG23  THR  99          HG23      THR  99  13.585   4.625 -10.105
  788    H    SER 100           HN       SER 100  11.751   0.163 -10.469
  789    HA   SER 100           HA       SER 100  11.018   0.769 -13.156
  790    HB2  SER 100           HB2      SER 100  11.229  -2.067 -12.274
  791    HB3  SER 100           HB1      SER 100  11.912  -1.274 -13.693
  792    HG   SER 100           HG       SER 100  13.383  -0.220 -12.202
  793    H    ASP 101           HN       ASP 101   9.375  -0.565 -10.422
  794    HA   ASP 101           HA       ASP 101   7.295  -1.899 -11.776
  795    HB2  ASP 101           HB2      ASP 101   8.023  -1.310  -9.057
  796    HB3  ASP 101           HB1      ASP 101   6.300  -1.024  -9.288
  797    H    MET 102           HN       MET 102   7.544   1.440 -10.555
  798    HA   MET 102           HA       MET 102   4.876   2.159 -10.896
  799    HB2  MET 102           HB2      MET 102   7.353   3.493 -10.378
  800    HB3  MET 102           HB1      MET 102   6.495   4.396 -11.616
  801    HG2  MET 102           HG2      MET 102   4.960   5.150 -10.174
  802    HG3  MET 102           HG1      MET 102   4.815   3.594  -9.359
  803    HE1  MET 102           HE1      MET 102   5.647   7.167  -8.812
  804    HE2  MET 102           HE2      MET 102   6.109   6.993  -7.119
  805    HE3  MET 102           HE3      MET 102   4.595   6.299  -7.693
  806    H    GLU 103           HN       GLU 103   7.551   2.683 -13.218
  807    HA   GLU 103           HA       GLU 103   5.793   3.524 -15.296
  808    HB2  GLU 103           HB2      GLU 103   8.302   4.073 -14.914
  809    HB3  GLU 103           HB1      GLU 103   8.590   2.574 -15.786
  810    HG2  GLU 103           HG2      GLU 103   7.595   3.399 -17.746
  811    HG3  GLU 103           HG1      GLU 103   6.863   4.760 -16.897
  812    H    ALA 104           HN       ALA 104   7.813   0.634 -14.944
  813    HA   ALA 104           HA       ALA 104   7.009  -0.635 -17.284
  814    HB1  ALA 104           HB1      ALA 104   8.993  -1.094 -15.715
  815    HB2  ALA 104           HB2      ALA 104   8.266  -2.438 -16.596
  816    HB3  ALA 104           HB3      ALA 104   7.883  -2.190 -14.893
  817    H    VAL 105           HN       VAL 105   5.490  -0.797 -14.084
  818    HA   VAL 105           HA       VAL 105   4.036  -3.125 -14.494
  819    HB   VAL 105           HB       VAL 105   3.493  -0.720 -12.788
  820   HG11  VAL 105          HG11      VAL 105   1.645  -2.019 -11.728
  821   HG12  VAL 105          HG12      VAL 105   1.724  -3.134 -13.090
  822   HG13  VAL 105          HG13      VAL 105   1.289  -1.448 -13.358
  823   HG21  VAL 105          HG21      VAL 105   4.396  -1.927 -11.103
  824   HG22  VAL 105          HG22      VAL 105   5.178  -2.782 -12.433
  825   HG23  VAL 105          HG23      VAL 105   3.725  -3.449 -11.689
  826    H    TRP 106           HN       TRP 106   2.863   0.207 -15.067
  827    HA   TRP 106           HA       TRP 106   0.569  -0.905 -16.442
  828    HB2  TRP 106           HB2      TRP 106   1.417   1.867 -15.658
  829    HB3  TRP 106           HB1      TRP 106   0.172   1.658 -16.884
  830    HD1  TRP 106           HD1      TRP 106  -0.304  -1.107 -14.572
  831    HE1  TRP 106           HE1      TRP 106  -2.133  -0.580 -12.839
  832    HE3  TRP 106           HE3      TRP 106  -0.670   3.944 -15.284
  833    HZ2  TRP 106           HZ2      TRP 106  -3.545   1.675 -11.899
  834    HZ3  TRP 106           HZ3      TRP 106  -2.285   5.211 -13.928
  835    HH2  TRP 106           HH2      TRP 106  -3.693   4.100 -12.272
  836    H    LYS 107           HN       LYS 107   3.646   0.499 -17.260
  837    HA   LYS 107           HA       LYS 107   3.333   1.399 -19.807
  838    HB2  LYS 107           HB2      LYS 107   5.521   0.166 -18.312
  839    HB3  LYS 107           HB1      LYS 107   5.643  -0.101 -20.044
  840    HG2  LYS 107           HG2      LYS 107   5.176   2.474 -20.164
  841    HG3  LYS 107           HG1      LYS 107   5.776   2.443 -18.506
  842    HD2  LYS 107           HD2      LYS 107   7.895   1.988 -19.143
  843    HD3  LYS 107           HD1      LYS 107   7.382   0.949 -20.473
  844    HE2  LYS 107           HE2      LYS 107   8.502   2.944 -21.311
  845    HE3  LYS 107           HE1      LYS 107   6.807   2.921 -21.796
  846    HZ1  LYS 107           HZ1      LYS 107   6.654   4.282 -19.514
  847    HZ2  LYS 107           HZ2      LYS 107   6.866   5.017 -21.023
  848    HZ3  LYS 107           HZ3      LYS 107   8.201   4.745 -20.021
  849    H    GLU 108           HN       GLU 108   3.693  -1.969 -18.802
  850    HA   GLU 108           HA       GLU 108   1.944  -3.294 -20.275
  851    HB2  GLU 108           HB2      GLU 108   3.942  -2.185 -22.144
  852    HB3  GLU 108           HB1      GLU 108   3.605  -3.895 -22.360
  853    HG2  GLU 108           HG2      GLU 108   1.113  -2.642 -22.064
  854    HG3  GLU 108           HG1      GLU 108   2.055  -1.627 -23.155
  855    H    ALA 109           HN       ALA 109   2.912  -4.181 -18.152
  856    HA   ALA 109           HA       ALA 109   4.372  -6.562 -18.865
  857    HB1  ALA 109           HB1      ALA 109   6.395  -6.119 -18.021
  858    HB2  ALA 109           HB2      ALA 109   5.738  -5.234 -16.643
  859    HB3  ALA 109           HB3      ALA 109   5.922  -4.429 -18.202
  860    H    LYS 110           HN       LYS 110   1.828  -6.532 -17.934
  861    HA   LYS 110           HA       LYS 110   1.383  -6.500 -15.218
  862    HB2  LYS 110           HB2      LYS 110  -0.424  -6.743 -16.767
  863    HB3  LYS 110           HB1      LYS 110   0.190  -8.287 -17.336
  864    HG2  LYS 110           HG2      LYS 110  -0.420  -8.093 -14.452
  865    HG3  LYS 110           HG1      LYS 110  -1.793  -8.053 -15.560
  866    HD2  LYS 110           HD2      LYS 110   0.071 -10.108 -16.334
  867    HD3  LYS 110           HD1      LYS 110  -0.400 -10.307 -14.645
  868    HE2  LYS 110           HE2      LYS 110  -2.306  -9.996 -16.964
  869    HE3  LYS 110           HE1      LYS 110  -1.879 -11.526 -16.198
  870    HZ1  LYS 110           HZ1      LYS 110  -3.710 -11.079 -14.993
  871    HZ2  LYS 110           HZ2      LYS 110  -3.637  -9.411 -15.262
  872    HZ3  LYS 110           HZ3      LYS 110  -2.655 -10.121 -14.081
  873    HA   PRO 111           HA       PRO 111   2.683 -11.101 -14.765
  874    HB2  PRO 111           HB2      PRO 111   4.241 -12.228 -16.680
  875    HB3  PRO 111           HB1      PRO 111   2.477 -12.314 -16.695
  876    HG2  PRO 111           HG2      PRO 111   4.304 -10.545 -18.249
  877    HG3  PRO 111           HG1      PRO 111   2.801 -11.333 -18.757
  878    HD2  PRO 111           HD2      PRO 111   2.990  -8.704 -18.064
  879    HD3  PRO 111           HD1      PRO 111   1.498  -9.648 -17.924
  880    H    GLU 112           HN       GLU 112   4.802  -8.766 -16.221
  881    HA   GLU 112           HA       GLU 112   7.227  -9.758 -15.083
  882    HB2  GLU 112           HB2      GLU 112   6.633  -6.987 -16.129
  883    HB3  GLU 112           HB1      GLU 112   8.222  -7.694 -15.875
  884    HG2  GLU 112           HG2      GLU 112   7.231  -9.515 -17.545
  885    HG3  GLU 112           HG1      GLU 112   6.276  -8.124 -18.058
  886    H    ASP 113           HN       ASP 113   4.730  -7.504 -14.117
  887    HA   ASP 113           HA       ASP 113   6.131  -6.176 -12.072
  888    HB2  ASP 113           HB2      ASP 113   3.166  -6.731 -12.069
  889    HB3  ASP 113           HB1      ASP 113   4.014  -5.363 -11.348
  890    H    LEU 114           HN       LEU 114   3.941  -8.993 -11.881
  891    HA   LEU 114           HA       LEU 114   4.093  -9.383  -9.136
  892    HB2  LEU 114           HB2      LEU 114   4.019 -11.963 -10.013
  893    HB3  LEU 114           HB1      LEU 114   2.621 -10.928  -9.826
  894    HG   LEU 114           HG       LEU 114   3.977 -10.769 -12.443
  895   HD11  LEU 114          HD11      LEU 114   3.791 -13.272 -11.515
  896   HD12  LEU 114          HD12      LEU 114   3.559 -12.851 -13.212
  897   HD13  LEU 114          HD13      LEU 114   2.162 -13.077 -12.160
  898   HD21  LEU 114          HD21      LEU 114   1.991  -9.506 -12.129
  899   HD22  LEU 114          HD22      LEU 114   1.137 -10.895 -11.459
  900   HD23  LEU 114          HD23      LEU 114   1.570 -10.867 -13.167
  901    H    MET 115           HN       MET 115   6.369 -10.127 -11.657
  902    HA   MET 115           HA       MET 115   8.088 -11.758 -10.054
  903    HB2  MET 115           HB2      MET 115   7.938 -10.915 -12.785
  904    HB3  MET 115           HB1      MET 115   9.555 -10.581 -12.182
  905    HG2  MET 115           HG2      MET 115   8.816 -13.168 -11.296
  906    HG3  MET 115           HG1      MET 115   8.437 -13.051 -13.013
  907    HE1  MET 115           HE1      MET 115  11.589 -12.516 -14.820
  908    HE2  MET 115           HE2      MET 115  11.222 -10.998 -14.001
  909    HE3  MET 115           HE3      MET 115   9.915 -11.992 -14.644
  910    H    ASP 116           HN       ASP 116   8.053  -8.336 -11.001
  911    HA   ASP 116           HA       ASP 116  10.517  -7.708  -9.696
  912    HB2  ASP 116           HB2      ASP 116   8.260  -6.038 -10.797
  913    HB3  ASP 116           HB1      ASP 116   9.629  -5.311  -9.961
  914    H    SER 117           HN       SER 117   7.104  -7.266  -8.915
  915    HA   SER 117           HA       SER 117   7.335  -5.974  -6.456
  916    HB2  SER 117           HB2      SER 117   5.287  -8.080  -6.987
  917    HB3  SER 117           HB1      SER 117   5.086  -6.563  -6.110
  918    HG   SER 117           HG       SER 117   4.600  -7.042  -8.672
  919    H    LYS 118           HN       LYS 118   7.435  -9.382  -7.313
  920    HA   LYS 118           HA       LYS 118   7.335 -10.518  -4.770
  921    HB2  LYS 118           HB2      LYS 118   8.030 -11.367  -7.439
  922    HB3  LYS 118           HB1      LYS 118   9.171 -12.043  -6.286
  923    HG2  LYS 118           HG2      LYS 118   7.629 -13.390  -5.335
  924    HG3  LYS 118           HG1      LYS 118   6.314 -12.237  -5.571
  925    HD2  LYS 118           HD2      LYS 118   6.814 -12.855  -8.129
  926    HD3  LYS 118           HD1      LYS 118   7.332 -14.359  -7.367
  927    HE2  LYS 118           HE2      LYS 118   5.013 -13.995  -6.081
  928    HE3  LYS 118           HE1      LYS 118   4.632 -13.167  -7.589
  929    HZ1  LYS 118           HZ1      LYS 118   4.060 -15.574  -7.543
  930    HZ2  LYS 118           HZ2      LYS 118   5.713 -15.927  -7.468
  931    HZ3  LYS 118           HZ3      LYS 118   5.080 -15.130  -8.819
  932    H    LEU 119           HN       LEU 119   9.802  -8.827  -6.465
  933    HA   LEU 119           HA       LEU 119  12.036  -9.631  -4.898
  934    HB2  LEU 119           HB2      LEU 119  12.047  -8.452  -7.163
  935    HB3  LEU 119           HB1      LEU 119  11.739  -6.970  -6.277
  936    HG   LEU 119           HG       LEU 119  13.894  -7.819  -4.927
  937   HD11  LEU 119          HD11      LEU 119  14.371  -8.797  -7.736
  938   HD12  LEU 119          HD12      LEU 119  14.083  -9.843  -6.345
  939   HD13  LEU 119          HD13      LEU 119  15.515  -8.814  -6.393
  940   HD21  LEU 119          HD21      LEU 119  13.946  -6.336  -7.552
  941   HD22  LEU 119          HD22      LEU 119  15.213  -6.306  -6.325
  942   HD23  LEU 119          HD23      LEU 119  13.621  -5.634  -5.967
  943    H    ARG 120           HN       ARG 120   9.895  -6.802  -4.760
  944    HA   ARG 120           HA       ARG 120  11.101  -5.711  -2.418
  945    HB2  ARG 120           HB2      ARG 120   9.880  -4.296  -3.991
  946    HB3  ARG 120           HB1      ARG 120   8.401  -5.191  -3.678
  947    HG2  ARG 120           HG2      ARG 120   8.705  -4.456  -1.240
  948    HG3  ARG 120           HG1      ARG 120   9.853  -3.282  -1.888
  949    HD2  ARG 120           HD2      ARG 120   8.118  -2.387  -3.354
  950    HD3  ARG 120           HD1      ARG 120   6.972  -3.571  -2.730
  951    HE   ARG 120           HE       ARG 120   7.784  -1.123  -1.478
  952   HH11  ARG 120          HH11      ARG 120   6.555  -4.338  -0.901
  953   HH12  ARG 120          HH12      ARG 120   5.827  -3.922   0.614
  954   HH21  ARG 120          HH21      ARG 120   6.825  -0.574   0.514
  955   HH22  ARG 120          HH22      ARG 120   5.979  -1.786   1.417
  956    H    CYS 121           HN       CYS 121   8.396  -7.846  -3.058
  957    HA   CYS 121           HA       CYS 121   7.200  -7.814  -0.526
  958    HB2  CYS 121           HB2      CYS 121   7.256  -9.808  -2.768
  959    HB3  CYS 121           HB1      CYS 121   6.471 -10.208  -1.245
  960    HG   CYS 121           HG       CYS 121   5.488  -8.031  -3.222
  961    H    VAL 122           HN       VAL 122   9.972  -9.565  -1.763
  962    HA   VAL 122           HA       VAL 122  10.213 -11.478   0.283
  963    HB   VAL 122           HB       VAL 122  12.425 -10.216  -1.347
  964   HG11  VAL 122          HG11      VAL 122  12.883 -12.946  -0.576
  965   HG12  VAL 122          HG12      VAL 122  12.592 -11.953   0.851
  966   HG13  VAL 122          HG13      VAL 122  13.874 -11.518  -0.278
  967   HG21  VAL 122          HG21      VAL 122  11.677 -11.366  -3.093
  968   HG22  VAL 122          HG22      VAL 122  10.284 -11.884  -2.143
  969   HG23  VAL 122          HG23      VAL 122  11.750 -12.864  -2.167
  970    H    PHE 123           HN       PHE 123  11.580  -8.216  -0.029
  971    HA   PHE 123           HA       PHE 123  13.146  -8.235   2.283
  972    HB2  PHE 123           HB2      PHE 123  11.915  -6.108   0.595
  973    HB3  PHE 123           HB1      PHE 123  12.554  -5.649   2.169
  974    HD1  PHE 123           HD1      PHE 123  13.389  -6.931  -1.158
  975    HD2  PHE 123           HD2      PHE 123  14.911  -5.669   2.610
  976    HE1  PHE 123           HE1      PHE 123  15.655  -6.823  -2.114
  977    HE2  PHE 123           HE2      PHE 123  17.179  -5.558   1.663
  978    HZ   PHE 123           HZ       PHE 123  17.553  -6.136  -0.703
  979    H    GLU 124           HN       GLU 124   9.716  -7.666   1.838
  980    HA   GLU 124           HA       GLU 124   9.124  -6.514   4.319
  981    HB2  GLU 124           HB2      GLU 124   7.597  -7.951   2.225
  982    HB3  GLU 124           HB1      GLU 124   6.859  -7.888   3.819
  983    HG2  GLU 124           HG2      GLU 124   6.842  -5.513   3.808
  984    HG3  GLU 124           HG1      GLU 124   7.842  -5.454   2.356
  985    H    LEU 125           HN       LEU 125   9.013  -9.935   3.329
  986    HA   LEU 125           HA       LEU 125   8.477 -10.824   6.010
  987    HB2  LEU 125           HB2      LEU 125   8.766 -12.062   3.346
  988    HB3  LEU 125           HB1      LEU 125   9.228 -13.075   4.699
  989    HG   LEU 125           HG       LEU 125   6.858 -12.232   5.616
  990   HD11  LEU 125          HD11      LEU 125   6.272 -10.844   3.770
  991   HD12  LEU 125          HD12      LEU 125   5.259 -12.287   3.696
  992   HD13  LEU 125          HD13      LEU 125   6.644 -12.124   2.616
  993   HD21  LEU 125          HD21      LEU 125   5.991 -14.326   4.191
  994   HD22  LEU 125          HD22      LEU 125   7.024 -14.489   5.610
  995   HD23  LEU 125          HD23      LEU 125   7.730 -14.545   3.995
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1 -13.729   8.934  -2.275
    2    H2   MET   1           HT2      MET   1 -14.207   8.196  -0.801
    3    H3   MET   1           HT3      MET   1 -12.559   8.598  -1.067
    4    HA   MET   1           HA       MET   1 -14.844  10.356  -0.556
    5    HB2  MET   1           HB2      MET   1 -13.511   9.416   1.312
    6    HB3  MET   1           HB1      MET   1 -12.063  10.129   0.615
    7    HG2  MET   1           HG2      MET   1 -13.883  12.229   0.827
    8    HG3  MET   1           HG1      MET   1 -14.055  11.310   2.320
    9    HE1  MET   1           HE1      MET   1 -11.798  11.029   4.146
   10    HE2  MET   1           HE2      MET   1 -13.144  12.168   4.150
   11    HE3  MET   1           HE3      MET   1 -11.501  12.743   4.432
   12    H    ALA   2           HN       ALA   2 -11.664  10.137  -2.051
   13    HA   ALA   2           HA       ALA   2 -11.710  12.977  -2.717
   14    HB1  ALA   2           HB1      ALA   2  -9.436  12.435  -3.718
   15    HB2  ALA   2           HB2      ALA   2  -9.612  10.842  -2.979
   16    HB3  ALA   2           HB3      ALA   2  -9.591  12.287  -1.968
   17    H    LYS   3           HN       LYS   3 -10.497  10.352  -4.758
   18    HA   LYS   3           HA       LYS   3 -12.361  11.237  -6.864
   19    HB2  LYS   3           HB2      LYS   3 -10.587  10.701  -8.504
   20    HB3  LYS   3           HB1      LYS   3 -10.128  11.993  -7.403
   21    HG2  LYS   3           HG2      LYS   3  -9.136   9.865  -6.080
   22    HG3  LYS   3           HG1      LYS   3  -8.989   9.304  -7.746
   23    HD2  LYS   3           HD2      LYS   3  -7.703  11.256  -8.340
   24    HD3  LYS   3           HD1      LYS   3  -7.959  11.955  -6.739
   25    HE2  LYS   3           HE2      LYS   3  -5.819  11.064  -6.587
   26    HE3  LYS   3           HE1      LYS   3  -6.827   9.810  -5.867
   27    HZ1  LYS   3           HZ1      LYS   3  -5.568   9.835  -8.541
   28    HZ2  LYS   3           HZ2      LYS   3  -6.847   8.791  -8.175
   29    HZ3  LYS   3           HZ3      LYS   3  -5.398   8.688  -7.309
   30    H    VAL   4           HN       VAL   4 -13.713   9.489  -5.930
   31    HA   VAL   4           HA       VAL   4 -13.038   6.811  -5.862
   32    HB   VAL   4           HB       VAL   4 -15.504   6.363  -6.300
   33   HG11  VAL   4          HG11      VAL   4 -16.003   6.770  -4.099
   34   HG12  VAL   4          HG12      VAL   4 -15.206   8.343  -4.093
   35   HG13  VAL   4          HG13      VAL   4 -14.243   6.865  -4.065
   36   HG21  VAL   4          HG21      VAL   4 -16.915   8.470  -5.943
   37   HG22  VAL   4          HG22      VAL   4 -16.254   8.194  -7.552
   38   HG23  VAL   4          HG23      VAL   4 -15.492   9.363  -6.473
   39    H    GLU   5           HN       GLU   5 -13.703   8.802  -8.650
   40    HA   GLU   5           HA       GLU   5 -14.190   6.624 -10.443
   41    HB2  GLU   5           HB2      GLU   5 -14.721   9.223 -10.641
   42    HB3  GLU   5           HB1      GLU   5 -13.149   9.240 -11.431
   43    HG2  GLU   5           HG2      GLU   5 -13.927   7.607 -13.052
   44    HG3  GLU   5           HG1      GLU   5 -15.491   7.530 -12.243
   45    H    GLN   6           HN       GLN   6 -11.412   8.752  -9.810
   46    HA   GLN   6           HA       GLN   6  -9.646   7.374 -11.573
   47    HB2  GLN   6           HB2      GLN   6  -9.458   9.565  -9.602
   48    HB3  GLN   6           HB1      GLN   6  -7.984   8.632  -9.807
   49    HG2  GLN   6           HG2      GLN   6  -8.597   9.061 -12.380
   50    HG3  GLN   6           HG1      GLN   6  -9.333  10.491 -11.658
   51   HE21  GLN   6          1HE2      GLN   6  -8.011  12.170 -11.878
   52   HE22  GLN   6          2HE2      GLN   6  -6.299  12.151 -11.637
   53    H    VAL   7           HN       VAL   7 -10.522   7.091  -8.210
   54    HA   VAL   7           HA       VAL   7  -8.409   5.240  -7.560
   55    HB   VAL   7           HB       VAL   7 -10.837   5.944  -5.915
   56   HG11  VAL   7          HG11      VAL   7  -8.225   4.591  -5.301
   57   HG12  VAL   7          HG12      VAL   7  -9.864   4.002  -5.016
   58   HG13  VAL   7          HG13      VAL   7  -9.220   5.327  -4.045
   59   HG21  VAL   7          HG21      VAL   7  -8.413   7.201  -5.033
   60   HG22  VAL   7          HG22      VAL   7  -9.954   7.935  -5.474
   61   HG23  VAL   7          HG23      VAL   7  -8.736   7.632  -6.712
   62    H    LEU   8           HN       LEU   8 -11.578   4.965  -8.876
   63    HA   LEU   8           HA       LEU   8 -12.446   2.543  -7.820
   64    HB2  LEU   8           HB2      LEU   8 -13.060   4.188 -10.124
   65    HB3  LEU   8           HB1      LEU   8 -13.197   2.485 -10.513
   66    HG   LEU   8           HG       LEU   8 -14.515   3.442  -8.022
   67   HD11  LEU   8          HD11      LEU   8 -15.541   5.083  -9.177
   68   HD12  LEU   8          HD12      LEU   8 -16.531   3.752  -9.774
   69   HD13  LEU   8          HD13      LEU   8 -15.185   4.354 -10.742
   70   HD21  LEU   8          HD21      LEU   8 -14.954   1.233  -8.216
   71   HD22  LEU   8          HD22      LEU   8 -14.748   1.232  -9.967
   72   HD23  LEU   8          HD23      LEU   8 -16.252   1.818  -9.256
   73    H    SER   9           HN       SER   9 -10.439   3.102 -10.703
   74    HA   SER   9           HA       SER   9  -9.167   1.681 -11.968
   75    HB2  SER   9           HB2      SER   9  -8.042   0.024  -9.982
   76    HB3  SER   9           HB1      SER   9  -7.372   1.513 -10.645
   77    HG   SER   9           HG       SER   9  -9.014   1.210  -8.347
   78    H    LEU  10           HN       LEU  10 -11.954   0.621 -11.237
   79    HA   LEU  10           HA       LEU  10 -11.522  -2.234 -11.133
   80    HB2  LEU  10           HB2      LEU  10 -13.759  -0.451 -10.727
   81    HB3  LEU  10           HB1      LEU  10 -14.196  -1.822 -11.731
   82    HG   LEU  10           HG       LEU  10 -12.666  -2.495  -9.306
   83   HD11  LEU  10          HD11      LEU  10 -14.451  -0.592  -8.819
   84   HD12  LEU  10          HD12      LEU  10 -14.190  -1.942  -7.715
   85   HD13  LEU  10          HD13      LEU  10 -15.546  -1.974  -8.842
   86   HD21  LEU  10          HD21      LEU  10 -13.661  -4.107 -10.953
   87   HD22  LEU  10          HD22      LEU  10 -15.251  -3.601 -10.380
   88   HD23  LEU  10          HD23      LEU  10 -14.118  -4.374  -9.271
   89    H    GLU  11           HN       GLU  11 -11.834   0.107 -13.633
   90    HA   GLU  11           HA       GLU  11 -13.071  -1.505 -15.598
   91    HB2  GLU  11           HB2      GLU  11 -11.988   1.098 -15.466
   92    HB3  GLU  11           HB1      GLU  11 -11.138   0.284 -16.773
   93    HG2  GLU  11           HG2      GLU  11 -13.368  -0.357 -17.707
   94    HG3  GLU  11           HG1      GLU  11 -14.104   0.683 -16.488
   95    HA   PRO  12           HA       PRO  12  -8.730  -3.023 -16.731
   96    HB2  PRO  12           HB2      PRO  12  -6.547  -1.982 -15.605
   97    HB3  PRO  12           HB1      PRO  12  -7.424  -1.091 -16.854
   98    HG2  PRO  12           HG2      PRO  12  -7.342  -0.648 -13.921
   99    HG3  PRO  12           HG1      PRO  12  -7.564   0.523 -15.231
  100    HD2  PRO  12           HD2      PRO  12  -9.583  -0.671 -13.620
  101    HD3  PRO  12           HD1      PRO  12  -9.815   0.384 -15.024
  102    H    GLN  13           HN       GLN  13  -9.360  -4.962 -15.666
  103    HA   GLN  13           HA       GLN  13  -9.120  -5.383 -12.905
  104    HB2  GLN  13           HB2      GLN  13 -10.453  -6.763 -14.547
  105    HB3  GLN  13           HB1      GLN  13  -8.943  -7.517 -15.039
  106    HG2  GLN  13           HG2      GLN  13  -8.947  -8.886 -13.293
  107    HG3  GLN  13           HG1      GLN  13  -9.287  -7.572 -12.166
  108   HE21  GLN  13          1HE2      GLN  13 -10.606  -9.159 -11.073
  109   HE22  GLN  13          2HE2      GLN  13 -12.219  -9.450 -11.621
  110    H    HIS  14           HN       HIS  14  -6.724  -5.261 -15.365
  111    HA   HIS  14           HA       HIS  14  -4.750  -6.380 -13.487
  112    HB2  HIS  14           HB2      HIS  14  -5.424  -7.425 -15.988
  113    HB3  HIS  14           HB1      HIS  14  -3.916  -6.561 -16.265
  114    HD1  HIS  14           HD1      HIS  14  -5.234  -9.701 -15.004
  115    HD2  HIS  14           HD2      HIS  14  -1.772  -7.465 -14.471
  116    HE1  HIS  14           HE1      HIS  14  -3.561 -11.284 -13.996
  117    HE2  HIS  14           HE2      HIS  14  -1.502  -9.885 -13.600
  118    H    GLU  15           HN       GLU  15  -2.509  -5.754 -15.142
  119    HA   GLU  15           HA       GLU  15  -1.094  -4.067 -15.731
  120    HB2  GLU  15           HB2      GLU  15  -3.407  -2.140 -15.559
  121    HB3  GLU  15           HB1      GLU  15  -1.909  -1.948 -16.456
  122    HG2  GLU  15           HG2      GLU  15  -2.550  -3.512 -18.079
  123    HG3  GLU  15           HG1      GLU  15  -3.855  -4.143 -17.076
  124    H    LEU  16           HN       LEU  16  -0.136  -4.438 -13.665
  125    HA   LEU  16           HA       LEU  16   0.532  -2.245 -12.206
  126    HB2  LEU  16           HB2      LEU  16  -2.079  -3.288 -11.381
  127    HB3  LEU  16           HB1      LEU  16  -0.939  -3.131 -10.057
  128    HG   LEU  16           HG       LEU  16  -1.052  -0.770 -11.789
  129   HD11  LEU  16          HD11      LEU  16  -3.290  -0.788 -12.014
  130   HD12  LEU  16          HD12      LEU  16  -3.264  -0.227 -10.342
  131   HD13  LEU  16          HD13      LEU  16  -3.522  -1.936 -10.696
  132   HD21  LEU  16          HD21      LEU  16   0.122  -0.432  -9.841
  133   HD22  LEU  16          HD22      LEU  16  -0.974  -1.425  -8.880
  134   HD23  LEU  16          HD23      LEU  16  -1.467   0.190  -9.392
  135    H    LYS  17           HN       LYS  17  -0.655  -5.023 -10.423
  136    HA   LYS  17           HA       LYS  17   2.109  -5.994 -10.168
  137    HB2  LYS  17           HB2      LYS  17  -0.074  -5.996  -8.077
  138    HB3  LYS  17           HB1      LYS  17   1.504  -6.745  -7.884
  139    HG2  LYS  17           HG2      LYS  17   2.280  -4.831  -7.099
  140    HG3  LYS  17           HG1      LYS  17   1.981  -4.090  -8.672
  141    HD2  LYS  17           HD2      LYS  17   0.813  -2.736  -7.160
  142    HD3  LYS  17           HD1      LYS  17  -0.428  -3.779  -7.859
  143    HE2  LYS  17           HE2      LYS  17   0.881  -4.832  -5.445
  144    HE3  LYS  17           HE1      LYS  17  -0.081  -3.374  -5.199
  145    HZ1  LYS  17           HZ1      LYS  17  -1.755  -4.804  -6.676
  146    HZ2  LYS  17           HZ2      LYS  17  -1.724  -4.881  -4.987
  147    HZ3  LYS  17           HZ3      LYS  17  -0.933  -6.064  -5.901
  148    H    PHE  18           HN       PHE  18  -1.310  -6.855 -10.267
  149    HA   PHE  18           HA       PHE  18  -0.958  -9.161 -11.798
  150    HB2  PHE  18           HB2      PHE  18  -0.029  -9.716  -9.330
  151    HB3  PHE  18           HB1      PHE  18  -1.731 -10.093  -9.087
  152    HD1  PHE  18           HD1      PHE  18   0.934 -10.717 -11.629
  153    HD2  PHE  18           HD2      PHE  18  -2.365 -12.263  -9.428
  154    HE1  PHE  18           HE1      PHE  18   1.276 -12.920 -12.669
  155    HE2  PHE  18           HE2      PHE  18  -2.027 -14.469 -10.465
  156    HZ   PHE  18           HZ       PHE  18  -0.205 -14.800 -12.088
  157    H    ARG  19           HN       ARG  19  -3.051 -10.742 -11.165
  158    HA   ARG  19           HA       ARG  19  -5.284  -9.203 -11.925
  159    HB2  ARG  19           HB2      ARG  19  -6.568 -11.249 -11.673
  160    HB3  ARG  19           HB1      ARG  19  -5.028 -11.605 -12.439
  161    HG2  ARG  19           HG2      ARG  19  -4.150 -12.470 -10.362
  162    HG3  ARG  19           HG1      ARG  19  -5.636 -12.027  -9.521
  163    HD2  ARG  19           HD2      ARG  19  -5.750 -14.358  -9.993
  164    HD3  ARG  19           HD1      ARG  19  -6.870 -13.545 -11.084
  165    HE   ARG  19           HE       ARG  19  -4.418 -14.922 -11.796
  166   HH11  ARG  19          HH11      ARG  19  -6.981 -12.779 -12.824
  167   HH12  ARG  19          HH12      ARG  19  -6.691 -13.044 -14.509
  168   HH21  ARG  19          HH21      ARG  19  -4.045 -15.270 -14.013
  169   HH22  ARG  19          HH22      ARG  19  -5.029 -14.457 -15.185
  170    H    GLY  20           HN       GLY  20  -7.175 -10.663  -9.967
  171    HA2  GLY  20           HA2      GLY  20  -6.976  -8.557  -7.927
  172    HA3  GLY  20           HA1      GLY  20  -8.398  -9.526  -8.258
  173    HA   PRO  21           HA       PRO  21  -5.092 -11.560  -5.112
  174    HB2  PRO  21           HB2      PRO  21  -6.004  -9.475  -3.193
  175    HB3  PRO  21           HB1      PRO  21  -4.433 -10.269  -3.321
  176    HG2  PRO  21           HG2      PRO  21  -4.789  -7.758  -4.174
  177    HG3  PRO  21           HG1      PRO  21  -3.717  -8.884  -5.025
  178    HD2  PRO  21           HD2      PRO  21  -6.419  -7.903  -5.783
  179    HD3  PRO  21           HD1      PRO  21  -5.063  -8.396  -6.816
  180    H    PHE  22           HN       PHE  22  -5.964 -12.912  -3.418
  181    HA   PHE  22           HA       PHE  22  -8.749 -13.412  -3.763
  182    HB2  PHE  22           HB2      PHE  22  -6.575 -14.851  -2.798
  183    HB3  PHE  22           HB1      PHE  22  -7.608 -14.651  -1.387
  184    HD1  PHE  22           HD2      PHE  22  -9.854 -15.602  -1.347
  185    HD2  PHE  22           HD1      PHE  22  -7.248 -16.202  -4.657
  186    HE1  PHE  22           HE2      PHE  22 -11.284 -17.444  -2.132
  187    HE2  PHE  22           HE1      PHE  22  -8.673 -18.046  -5.449
  188    HZ   PHE  22           HZ       PHE  22 -10.693 -18.669  -4.185
  189    H    THR  23           HN       THR  23  -6.921 -12.493  -0.866
  190    HA   THR  23           HA       THR  23  -9.251 -11.819   0.633
  191    HB   THR  23           HB       THR  23  -7.634 -10.950   2.299
  192    HG1  THR  23           HG1      THR  23  -5.946 -10.172   1.223
  193   HG21  THR  23          HG21      THR  23  -6.771 -12.976   2.978
  194   HG22  THR  23          HG22      THR  23  -6.496 -13.531   1.327
  195   HG23  THR  23          HG23      THR  23  -8.136 -13.461   1.972
  196    H    ASP  24           HN       ASP  24  -6.661  -9.926  -0.813
  197    HA   ASP  24           HA       ASP  24  -7.527  -7.399  -0.063
  198    HB2  ASP  24           HB2      ASP  24  -6.093  -7.739  -2.654
  199    HB3  ASP  24           HB1      ASP  24  -5.843  -6.556  -1.377
  200    H    VAL  25           HN       VAL  25  -8.157  -9.071  -3.192
  201    HA   VAL  25           HA       VAL  25  -9.474  -6.932  -4.355
  202    HB   VAL  25           HB       VAL  25  -8.843  -9.193  -5.422
  203   HG11  VAL  25          HG11      VAL  25 -10.595 -10.840  -5.603
  204   HG12  VAL  25          HG12      VAL  25 -11.669  -9.859  -4.605
  205   HG13  VAL  25          HG13      VAL  25 -10.224 -10.579  -3.898
  206   HG21  VAL  25          HG21      VAL  25 -11.536  -8.270  -6.305
  207   HG22  VAL  25          HG22      VAL  25 -10.111  -8.669  -7.264
  208   HG23  VAL  25          HG23      VAL  25 -10.171  -7.154  -6.364
  209    H    VAL  26           HN       VAL  26 -10.853  -9.564  -2.381
  210    HA   VAL  26           HA       VAL  26 -13.440  -8.456  -2.518
  211    HB   VAL  26           HB       VAL  26 -12.450 -10.409  -0.483
  212   HG11  VAL  26          HG11      VAL  26 -14.570 -10.679   0.193
  213   HG12  VAL  26          HG12      VAL  26 -15.195 -10.651  -1.456
  214   HG13  VAL  26          HG13      VAL  26 -14.872  -9.138  -0.611
  215   HG21  VAL  26          HG21      VAL  26 -11.947 -11.591  -2.365
  216   HG22  VAL  26          HG22      VAL  26 -13.145 -10.749  -3.348
  217   HG23  VAL  26          HG23      VAL  26 -13.654 -12.008  -2.224
  218    H    THR  27           HN       THR  27 -11.152  -8.526   0.182
  219    HA   THR  27           HA       THR  27 -12.871  -6.938   1.784
  220    HB   THR  27           HB       THR  27 -10.891  -6.669   3.252
  221    HG1  THR  27           HG1      THR  27  -8.958  -7.093   2.555
  222   HG21  THR  27          HG21      THR  27 -11.310  -8.654   4.117
  223   HG22  THR  27          HG22      THR  27 -10.469  -9.456   2.789
  224   HG23  THR  27          HG23      THR  27 -12.185  -9.076   2.646
  225    H    THR  28           HN       THR  28  -9.950  -6.237  -0.037
  226    HA   THR  28           HA       THR  28 -10.046  -3.424   0.545
  227    HB   THR  28           HB       THR  28  -8.392  -4.461  -1.699
  228    HG1  THR  28           HG1      THR  28  -6.908  -5.279  -0.165
  229   HG21  THR  28          HG21      THR  28  -6.715  -3.136  -0.099
  230   HG22  THR  28          HG22      THR  28  -8.224  -2.328   0.323
  231   HG23  THR  28          HG23      THR  28  -7.679  -2.358  -1.353
  232    H    ASN  29           HN       ASN  29 -10.441  -5.243  -2.463
  233    HA   ASN  29           HA       ASN  29 -11.149  -2.957  -3.973
  234    HB2  ASN  29           HB2      ASN  29 -10.330  -5.498  -4.588
  235    HB3  ASN  29           HB1      ASN  29 -11.997  -5.482  -5.149
  236   HD21  ASN  29          1HE2      ASN  29 -12.548  -4.275  -6.898
  237   HD22  ASN  29          2HE2      ASN  29 -11.405  -3.422  -7.871
  238    H    LEU  30           HN       LEU  30 -13.129  -5.311  -2.248
  239    HA   LEU  30           HA       LEU  30 -15.474  -4.890  -3.726
  240    HB2  LEU  30           HB2      LEU  30 -16.665  -5.990  -2.128
  241    HB3  LEU  30           HB1      LEU  30 -15.049  -6.547  -1.778
  242    HG   LEU  30           HG       LEU  30 -15.025  -4.641  -0.003
  243   HD11  LEU  30          HD11      LEU  30 -16.900  -3.506   0.419
  244   HD12  LEU  30          HD12      LEU  30 -17.871  -4.976   0.421
  245   HD13  LEU  30          HD13      LEU  30 -17.530  -4.151  -1.098
  246   HD21  LEU  30          HD21      LEU  30 -16.732  -6.349   1.328
  247   HD22  LEU  30          HD22      LEU  30 -14.987  -6.541   1.165
  248   HD23  LEU  30          HD23      LEU  30 -16.072  -7.352   0.036
  249    H    LYS  31           HN       LYS  31 -14.507  -3.095  -0.781
  250    HA   LYS  31           HA       LYS  31 -16.581  -1.158  -1.433
  251    HB2  LYS  31           HB2      LYS  31 -15.611  -2.247   0.994
  252    HB3  LYS  31           HB1      LYS  31 -15.163  -0.556   1.005
  253    HG2  LYS  31           HG2      LYS  31 -17.927  -1.684   0.662
  254    HG3  LYS  31           HG1      LYS  31 -17.296  -0.819   2.064
  255    HD2  LYS  31           HD2      LYS  31 -17.224   0.519  -0.600
  256    HD3  LYS  31           HD1      LYS  31 -18.764   0.407   0.252
  257    HE2  LYS  31           HE2      LYS  31 -18.049   1.738   1.994
  258    HE3  LYS  31           HE1      LYS  31 -16.347   1.379   1.707
  259    HZ1  LYS  31           HZ1      LYS  31 -17.958   2.931  -0.226
  260    HZ2  LYS  31           HZ2      LYS  31 -16.275   2.842  -0.095
  261    HZ3  LYS  31           HZ3      LYS  31 -17.170   3.675   1.073
  262    H    LEU  32           HN       LEU  32 -14.561   0.499   0.349
  263    HA   LEU  32           HA       LEU  32 -12.310   1.121  -1.138
  264    HB2  LEU  32           HB2      LEU  32 -14.505   1.987  -2.514
  265    HB3  LEU  32           HB1      LEU  32 -14.120   3.409  -1.566
  266    HG   LEU  32           HG       LEU  32 -12.354   2.026  -3.593
  267   HD11  LEU  32          HD11      LEU  32 -13.731   4.688  -3.430
  268   HD12  LEU  32          HD12      LEU  32 -13.838   3.463  -4.693
  269   HD13  LEU  32          HD13      LEU  32 -12.360   4.407  -4.504
  270   HD21  LEU  32          HD21      LEU  32 -10.721   2.602  -2.115
  271   HD22  LEU  32          HD22      LEU  32 -11.681   3.884  -1.375
  272   HD23  LEU  32          HD23      LEU  32 -10.907   4.151  -2.937
  273    H    GLY  33           HN       GLY  33 -12.333   0.781   1.379
  274    HA2  GLY  33           HA2      GLY  33 -11.255   2.858   2.686
  275    HA3  GLY  33           HA1      GLY  33 -12.973   3.178   2.879
  276    H    ASN  34           HN       ASN  34 -14.203   0.982   3.514
  277    HA   ASN  34           HA       ASN  34 -14.572  -0.611   5.088
  278    HB2  ASN  34           HB2      ASN  34 -12.113  -1.260   4.140
  279    HB3  ASN  34           HB1      ASN  34 -11.736  -0.978   5.837
  280   HD21  ASN  34          1HE2      ASN  34 -13.096  -3.097   3.561
  281   HD22  ASN  34          2HE2      ASN  34 -13.629  -4.317   4.662
  282    HA   PRO  35           HA       PRO  35 -13.973   2.583   8.351
  283    HB2  PRO  35           HB2      PRO  35 -16.558   2.693   9.119
  284    HB3  PRO  35           HB1      PRO  35 -15.946   3.596   7.728
  285    HG2  PRO  35           HG2      PRO  35 -17.440   1.003   7.795
  286    HG3  PRO  35           HG1      PRO  35 -17.655   2.390   6.711
  287    HD2  PRO  35           HD2      PRO  35 -16.284   0.147   6.004
  288    HD3  PRO  35           HD1      PRO  35 -15.912   1.756   5.353
  289    H    THR  36           HN       THR  36 -13.057   0.100   8.867
  290    HA   THR  36           HA       THR  36 -14.534  -1.472  10.654
  291    HB   THR  36           HB       THR  36 -11.565  -1.222  10.950
  292    HG1  THR  36           HG1      THR  36 -11.352  -2.522   9.066
  293   HG21  THR  36          HG21      THR  36 -12.171  -3.010  12.197
  294   HG22  THR  36          HG22      THR  36 -11.984  -3.813  10.638
  295   HG23  THR  36          HG23      THR  36 -13.589  -3.362  11.210
  296    H    ASP  37           HN       ASP  37 -11.763   0.586  11.558
  297    HA   ASP  37           HA       ASP  37 -13.314   1.558  13.848
  298    HB2  ASP  37           HB2      ASP  37 -10.593   0.259  13.997
  299    HB3  ASP  37           HB1      ASP  37 -11.250   1.262  15.286
  300    H    ARG  38           HN       ARG  38 -11.806   2.435  11.175
  301    HA   ARG  38           HA       ARG  38 -10.020   4.466  12.095
  302    HB2  ARG  38           HB2      ARG  38 -10.279   3.211   9.744
  303    HB3  ARG  38           HB1      ARG  38 -11.223   4.651   9.385
  304    HG2  ARG  38           HG2      ARG  38  -9.088   5.840  10.420
  305    HG3  ARG  38           HG1      ARG  38  -8.316   4.353   9.866
  306    HD2  ARG  38           HD2      ARG  38  -9.859   6.356   8.231
  307    HD3  ARG  38           HD1      ARG  38  -8.149   5.946   8.103
  308    HE   ARG  38           HE       ARG  38  -9.864   3.700   7.648
  309   HH11  ARG  38          HH11      ARG  38  -8.437   6.515   6.157
  310   HH12  ARG  38          HH12      ARG  38  -8.517   5.860   4.555
  311   HH21  ARG  38          HH21      ARG  38  -9.969   2.839   5.542
  312   HH22  ARG  38          HH22      ARG  38  -9.386   3.774   4.207
  313    H    ASN  39           HN       ASN  39 -10.442   6.476  12.694
  314    HA   ASN  39           HA       ASN  39 -13.094   7.605  12.088
  315    HB2  ASN  39           HB2      ASN  39 -12.292   6.900  14.585
  316    HB3  ASN  39           HB1      ASN  39 -11.722   8.566  14.527
  317   HD21  ASN  39          1HE2      ASN  39 -13.970   7.107  15.944
  318   HD22  ASN  39          2HE2      ASN  39 -15.358   8.090  15.643
  319    H    VAL  40           HN       VAL  40 -12.602  10.152  13.181
  320    HA   VAL  40           HA       VAL  40 -10.865  11.234  11.108
  321    HB   VAL  40           HB       VAL  40 -11.778  13.440  11.832
  322   HG11  VAL  40          HG11      VAL  40 -14.205  11.842  11.362
  323   HG12  VAL  40          HG12      VAL  40 -12.888  11.581  10.219
  324   HG13  VAL  40          HG13      VAL  40 -13.544  13.202  10.453
  325   HG21  VAL  40          HG21      VAL  40 -13.944  12.156  13.364
  326   HG22  VAL  40          HG22      VAL  40 -13.152  13.714  13.602
  327   HG23  VAL  40          HG23      VAL  40 -12.376  12.234  14.168
  328    H    CYS  41           HN       CYS  41  -9.460  13.110  11.676
  329    HA   CYS  41           HA       CYS  41  -7.669  13.981  12.768
  330    HB2  CYS  41           HB2      CYS  41  -9.464  13.246  15.057
  331    HB3  CYS  41           HB1      CYS  41  -7.848  13.870  15.367
  332    HG   CYS  41           HG       CYS  41 -10.207  15.543  14.742
  333    H    PHE  42           HN       PHE  42  -5.939  13.402  14.525
  334    HA   PHE  42           HA       PHE  42  -4.262  12.026  15.167
  335    HB2  PHE  42           HB2      PHE  42  -6.616  10.165  15.243
  336    HB3  PHE  42           HB1      PHE  42  -4.997   9.556  15.575
  337    HD1  PHE  42           HD2      PHE  42  -3.768  11.707  17.073
  338    HD2  PHE  42           HD1      PHE  42  -7.742  10.196  17.254
  339    HE1  PHE  42           HE2      PHE  42  -3.949  12.475  19.403
  340    HE2  PHE  42           HE1      PHE  42  -7.932  10.963  19.585
  341    HZ   PHE  42           HZ       PHE  42  -6.033  12.103  20.662
  342    H    LYS  43           HN       LYS  43  -4.632   8.999  14.090
  343    HA   LYS  43           HA       LYS  43  -3.619   7.793  12.474
  344    HB2  LYS  43           HB2      LYS  43  -4.386   8.161  10.270
  345    HB3  LYS  43           HB1      LYS  43  -5.693   8.616  11.343
  346    HG2  LYS  43           HG2      LYS  43  -5.546  10.835  10.824
  347    HG3  LYS  43           HG1      LYS  43  -3.836  10.741  10.406
  348    HD2  LYS  43           HD2      LYS  43  -4.593   9.315   8.415
  349    HD3  LYS  43           HD1      LYS  43  -6.216   9.908   8.774
  350    HE2  LYS  43           HE2      LYS  43  -3.797  11.601   8.154
  351    HE3  LYS  43           HE1      LYS  43  -5.143  11.275   7.062
  352    HZ1  LYS  43           HZ1      LYS  43  -6.592  12.538   8.366
  353    HZ2  LYS  43           HZ2      LYS  43  -5.174  13.459   8.318
  354    HZ3  LYS  43           HZ3      LYS  43  -5.548  12.555   9.699
  355    H    VAL  44           HN       VAL  44  -1.970   7.790  10.639
  356    HA   VAL  44           HA       VAL  44   0.078   8.345   9.840
  357    HB   VAL  44           HB       VAL  44   0.643  10.525   9.280
  358   HG11  VAL  44          HG11      VAL  44  -1.609  11.709   8.798
  359   HG12  VAL  44          HG12      VAL  44  -2.319  10.221   9.419
  360   HG13  VAL  44          HG13      VAL  44  -1.246  10.168   8.022
  361   HG21  VAL  44          HG21      VAL  44  -1.151  12.100  10.952
  362   HG22  VAL  44          HG22      VAL  44   0.562  12.321  10.604
  363   HG23  VAL  44          HG23      VAL  44   0.060  11.218  11.880
  364    H    LYS  45           HN       LYS  45  -0.545   7.812  12.744
  365    HA   LYS  45           HA       LYS  45   1.385   9.236  14.283
  366    HB2  LYS  45           HB2      LYS  45  -0.579   7.185  14.730
  367    HB3  LYS  45           HB1      LYS  45   0.927   6.754  15.530
  368    HG2  LYS  45           HG2      LYS  45  -0.187   9.504  15.853
  369    HG3  LYS  45           HG1      LYS  45  -0.857   8.165  16.783
  370    HD2  LYS  45           HD2      LYS  45   2.049   8.972  16.731
  371    HD3  LYS  45           HD1      LYS  45   0.902   9.363  18.013
  372    HE2  LYS  45           HE2      LYS  45   0.526   6.784  18.079
  373    HE3  LYS  45           HE1      LYS  45   2.094   6.724  17.273
  374    HZ1  LYS  45           HZ1      LYS  45   1.622   8.170  19.819
  375    HZ2  LYS  45           HZ2      LYS  45   3.110   7.826  19.092
  376    HZ3  LYS  45           HZ3      LYS  45   2.178   6.574  19.742
  377    H    THR  46           HN       THR  46   2.892   7.563  15.674
  378    HA   THR  46           HA       THR  46   4.798   6.574  13.688
  379    HB   THR  46           HB       THR  46   6.199   6.394  15.936
  380    HG1  THR  46           HG1      THR  46   4.368   6.988  17.225
  381   HG21  THR  46          HG21      THR  46   5.643   9.147  14.894
  382   HG22  THR  46          HG22      THR  46   6.586   7.963  13.989
  383   HG23  THR  46          HG23      THR  46   7.138   8.505  15.574
  384    H    THR  47           HN       THR  47   2.407   5.060  14.363
  385    HA   THR  47           HA       THR  47   3.462   2.803  15.893
  386    HB   THR  47           HB       THR  47   1.290   3.392  16.601
  387    HG1  THR  47           HG1      THR  47   0.880   1.295  14.744
  388   HG21  THR  47          HG21      THR  47   0.622   3.616  13.698
  389   HG22  THR  47          HG22      THR  47   0.379   4.787  14.995
  390   HG23  THR  47          HG23      THR  47  -0.632   3.345  14.908
  391    H    ALA  48           HN       ALA  48   4.477   1.253  14.833
  392    HA   ALA  48           HA       ALA  48   3.351  -0.100  12.629
  393    HB1  ALA  48           HB1      ALA  48   4.105   1.948  11.455
  394    HB2  ALA  48           HB2      ALA  48   4.886   0.480  10.867
  395    HB3  ALA  48           HB3      ALA  48   5.760   1.576  11.937
  396    HA   PRO  49           HA       PRO  49   6.090  -3.063  14.501
  397    HB2  PRO  49           HB2      PRO  49   5.855  -5.030  12.620
  398    HB3  PRO  49           HB1      PRO  49   4.634  -4.712  13.856
  399    HG2  PRO  49           HG2      PRO  49   4.699  -3.852  10.991
  400    HG3  PRO  49           HG1      PRO  49   3.337  -4.471  11.944
  401    HD2  PRO  49           HD2      PRO  49   3.655  -1.842  11.443
  402    HD3  PRO  49           HD1      PRO  49   2.963  -2.433  12.968
  403    H    ARG  50           HN       ARG  50   8.026  -4.377  13.893
  404    HA   ARG  50           HA       ARG  50   9.989  -2.816  12.696
  405    HB2  ARG  50           HB2      ARG  50   9.780  -5.590  13.664
  406    HB3  ARG  50           HB1      ARG  50  11.019  -5.334  12.443
  407    HG2  ARG  50           HG2      ARG  50  12.338  -4.176  13.837
  408    HG3  ARG  50           HG1      ARG  50  10.980  -3.337  14.591
  409    HD2  ARG  50           HD2      ARG  50  11.542  -6.242  15.108
  410    HD3  ARG  50           HD1      ARG  50  12.323  -4.964  16.038
  411    HE   ARG  50           HE       ARG  50   9.608  -4.441  16.109
  412   HH11  ARG  50          HH11      ARG  50  11.751  -6.995  17.141
  413   HH12  ARG  50          HH12      ARG  50  10.750  -7.466  18.473
  414   HH21  ARG  50          HH21      ARG  50   8.290  -5.061  17.861
  415   HH22  ARG  50          HH22      ARG  50   8.786  -6.369  18.883
  416    H    ARG  51           HN       ARG  51   8.797  -5.907  11.370
  417    HA   ARG  51           HA       ARG  51   8.674  -4.733   8.710
  418    HB2  ARG  51           HB2      ARG  51  10.813  -6.501   9.609
  419    HB3  ARG  51           HB1      ARG  51   9.974  -7.127   8.197
  420    HG2  ARG  51           HG2      ARG  51  11.513  -5.878   7.122
  421    HG3  ARG  51           HG1      ARG  51  10.319  -4.607   7.392
  422    HD2  ARG  51           HD2      ARG  51  12.243  -3.591   8.143
  423    HD3  ARG  51           HD1      ARG  51  11.599  -4.270   9.635
  424    HE   ARG  51           HE       ARG  51  13.732  -5.561   8.058
  425   HH11  ARG  51          HH11      ARG  51  12.343  -4.633  11.133
  426   HH12  ARG  51          HH12      ARG  51  13.601  -5.375  12.058
  427   HH21  ARG  51          HH21      ARG  51  15.380  -6.531   9.287
  428   HH22  ARG  51          HH22      ARG  51  15.322  -6.446  11.015
  429    H    TYR  52           HN       TYR  52   6.419  -5.123   9.018
  430    HA   TYR  52           HA       TYR  52   5.670  -7.858   8.329
  431    HB2  TYR  52           HB2      TYR  52   5.324  -6.841  10.932
  432    HB3  TYR  52           HB1      TYR  52   3.728  -6.816  10.190
  433    HD1  TYR  52           HD1      TYR  52   6.579  -8.996  11.074
  434    HD2  TYR  52           HD2      TYR  52   2.522  -8.828   9.807
  435    HE1  TYR  52           HE1      TYR  52   6.351 -11.405  11.508
  436    HE2  TYR  52           HE2      TYR  52   2.281 -11.237  10.238
  437    HH   TYR  52           HH       TYR  52   3.632 -13.214  10.455
  438    H    CYS  53           HN       CYS  53   3.989  -4.876   9.313
  439    HA   CYS  53           HA       CYS  53   3.222  -3.576   7.137
  440    HB2  CYS  53           HB2      CYS  53   2.698  -5.667   5.864
  441    HB3  CYS  53           HB1      CYS  53   1.424  -6.038   7.013
  442    HG   CYS  53           HG       CYS  53   0.495  -4.865   4.705
  443    H    VAL  54           HN       VAL  54   2.227  -1.951   8.072
  444    HA   VAL  54           HA       VAL  54   1.186  -1.727  10.522
  445    HB   VAL  54           HB       VAL  54  -0.112  -0.352   8.172
  446   HG11  VAL  54          HG11      VAL  54  -1.078   1.049   9.639
  447   HG12  VAL  54          HG12      VAL  54   0.341   1.094  10.684
  448   HG13  VAL  54          HG13      VAL  54  -0.800  -0.246  10.803
  449   HG21  VAL  54          HG21      VAL  54   1.851   1.296   9.345
  450   HG22  VAL  54          HG22      VAL  54   1.842   0.603   7.724
  451   HG23  VAL  54          HG23      VAL  54   2.611  -0.268   9.050
  452    H    ARG  55           HN       ARG  55  -0.450  -2.449  11.678
  453    HA   ARG  55           HA       ARG  55  -2.930  -3.260  10.363
  454    HB2  ARG  55           HB2      ARG  55  -1.040  -5.132  11.141
  455    HB3  ARG  55           HB1      ARG  55  -2.175  -5.117  12.483
  456    HG2  ARG  55           HG2      ARG  55  -3.696  -5.147  10.104
  457    HG3  ARG  55           HG1      ARG  55  -2.426  -6.360   9.935
  458    HD2  ARG  55           HD2      ARG  55  -3.090  -7.404  12.008
  459    HD3  ARG  55           HD1      ARG  55  -4.274  -6.132  12.307
  460    HE   ARG  55           HE       ARG  55  -5.722  -7.218  10.918
  461   HH11  ARG  55          HH11      ARG  55  -2.496  -8.394  10.294
  462   HH12  ARG  55          HH12      ARG  55  -3.024  -9.636   9.210
  463   HH21  ARG  55          HH21      ARG  55  -6.418  -8.851   9.490
  464   HH22  ARG  55          HH22      ARG  55  -5.250  -9.895   8.751
  465    H    SER  56           HN       SER  56  -2.228  -0.982  11.970
  466    HA   SER  56           HA       SER  56  -3.140   0.285  13.617
  467    HB2  SER  56           HB2      SER  56  -5.088  -1.998  13.938
  468    HB3  SER  56           HB1      SER  56  -5.291  -0.362  14.569
  469    HG   SER  56           HG       SER  56  -4.784  -0.023  12.061
  470    H    ASN  57           HN       ASN  57  -1.083  -0.213  14.620
  471    HA   ASN  57           HA       ASN  57  -1.094  -2.144  16.781
  472    HB2  ASN  57           HB2      ASN  57   0.922  -0.572  15.352
  473    HB3  ASN  57           HB1      ASN  57   1.221  -0.683  17.085
  474   HD21  ASN  57          1HE2      ASN  57   0.652  -2.559  14.169
  475   HD22  ASN  57          2HE2      ASN  57   1.463  -3.987  14.706
  476    H    SER  58           HN       SER  58  -1.305   1.357  16.401
  477    HA   SER  58           HA       SER  58  -1.119   1.805  19.256
  478    HB2  SER  58           HB2      SER  58  -1.614   4.184  18.648
  479    HB3  SER  58           HB1      SER  58  -0.212   3.508  17.820
  480    HG   SER  58           HG       SER  58  -1.420   4.528  16.283
  481    H    GLY  59           HN       GLY  59  -3.723   1.645  16.854
  482    HA2  GLY  59           HA2      GLY  59  -5.667   0.986  18.730
  483    HA3  GLY  59           HA1      GLY  59  -5.772   2.712  18.434
  484    H    ILE  60           HN       ILE  60  -4.989   2.617  15.723
  485    HA   ILE  60           HA       ILE  60  -5.726   1.465  13.674
  486    HB   ILE  60           HB       ILE  60  -7.569   0.223  14.865
  487   HG12  ILE  60          HG12      ILE  60  -7.327   0.429  12.358
  488   HG13  ILE  60          HG11      ILE  60  -8.941   0.039  12.934
  489   HG21  ILE  60          HG21      ILE  60  -8.432   2.752  15.578
  490   HG22  ILE  60          HG22      ILE  60  -9.312   1.240  15.798
  491   HG23  ILE  60          HG23      ILE  60  -9.599   2.225  14.367
  492   HD11  ILE  60          HD11      ILE  60  -8.931   2.800  12.789
  493   HD12  ILE  60          HD12      ILE  60  -9.655   1.682  11.634
  494   HD13  ILE  60          HD13      ILE  60  -8.020   2.284  11.371
  495    H    ILE  61           HN       ILE  61  -6.904   4.031  15.664
  496    HA   ILE  61           HA       ILE  61  -7.750   5.691  13.462
  497    HB   ILE  61           HB       ILE  61  -8.003   5.661  16.338
  498   HG12  ILE  61          HG12      ILE  61  -9.451   7.523  14.475
  499   HG13  ILE  61          HG11      ILE  61  -9.747   5.789  14.419
  500   HG21  ILE  61          HG21      ILE  61  -7.125   8.273  15.127
  501   HG22  ILE  61          HG22      ILE  61  -6.408   7.407  16.488
  502   HG23  ILE  61          HG23      ILE  61  -7.998   8.151  16.654
  503   HD11  ILE  61          HD11      ILE  61  -9.873   6.672  17.128
  504   HD12  ILE  61          HD12      ILE  61 -11.133   5.945  16.132
  505   HD13  ILE  61          HD13      ILE  61 -10.904   7.694  16.126
  506    H    ASP  62           HN       ASP  62  -5.003   5.343  15.595
  507    HA   ASP  62           HA       ASP  62  -3.657   7.664  14.529
  508    HB2  ASP  62           HB2      ASP  62  -3.078   5.639  16.653
  509    HB3  ASP  62           HB1      ASP  62  -1.759   6.606  16.009
  510    H    ALA  63           HN       ALA  63  -3.620   4.178  14.230
  511    HA   ALA  63           HA       ALA  63  -1.251   4.206  12.526
  512    HB1  ALA  63           HB1      ALA  63  -2.679   2.237  14.045
  513    HB2  ALA  63           HB2      ALA  63  -1.043   2.184  13.390
  514    HB3  ALA  63           HB3      ALA  63  -2.406   1.669  12.398
  515    H    GLY  64           HN       GLY  64  -4.608   4.525  12.024
  516    HA2  GLY  64           HA2      GLY  64  -5.054   3.156   9.656
  517    HA3  GLY  64           HA1      GLY  64  -5.911   4.604  10.142
  518    H    ALA  65           HN       ALA  65  -3.152   6.073   9.946
  519    HA   ALA  65           HA       ALA  65  -3.537   6.669   7.130
  520    HB1  ALA  65           HB1      ALA  65  -2.633   8.693   7.503
  521    HB2  ALA  65           HB2      ALA  65  -1.416   8.071   8.613
  522    HB3  ALA  65           HB3      ALA  65  -3.069   8.315   9.165
  523    H    SER  66           HN       SER  66  -2.012   4.211   8.314
  524    HA   SER  66           HA       SER  66   0.522   4.603   6.902
  525    HB2  SER  66           HB2      SER  66  -0.037   2.029   8.265
  526    HB3  SER  66           HB1      SER  66   1.437   2.995   8.237
  527    HG   SER  66           HG       SER  66  -0.675   3.044  10.001
  528    H    ILE  67           HN       ILE  67  -2.487   3.736   6.027
  529    HA   ILE  67           HA       ILE  67  -2.101   1.271   4.692
  530    HB   ILE  67           HB       ILE  67  -4.128   1.811   3.417
  531   HG12  ILE  67          HG12      ILE  67  -4.385   4.388   4.921
  532   HG13  ILE  67          HG11      ILE  67  -3.468   4.355   3.419
  533   HG21  ILE  67          HG21      ILE  67  -5.649   1.927   5.307
  534   HG22  ILE  67          HG22      ILE  67  -4.343   2.506   6.342
  535   HG23  ILE  67          HG23      ILE  67  -4.282   0.875   5.674
  536   HD11  ILE  67          HD11      ILE  67  -6.276   4.510   3.793
  537   HD12  ILE  67          HD12      ILE  67  -5.901   3.009   2.944
  538   HD13  ILE  67          HD13      ILE  67  -5.352   4.553   2.291
  539    H    ASN  68           HN       ASN  68  -1.496   4.590   3.704
  540    HA   ASN  68           HA       ASN  68   0.485   4.391   1.990
  541    HB2  ASN  68           HB2      ASN  68  -0.549   2.615   0.675
  542    HB3  ASN  68           HB1      ASN  68  -1.963   3.619   0.369
  543   HD21  ASN  68          1HE2      ASN  68  -0.645   2.507  -1.751
  544   HD22  ASN  68          2HE2      ASN  68   0.210   3.728  -2.628
  545    H    VAL  69           HN       VAL  69  -2.629   5.418   0.641
  546    HA   VAL  69           HA       VAL  69  -1.621   8.109   0.348
  547    HB   VAL  69           HB       VAL  69  -3.748   8.546  -0.830
  548   HG11  VAL  69          HG11      VAL  69  -2.162   6.128  -1.673
  549   HG12  VAL  69          HG12      VAL  69  -1.917   7.806  -2.158
  550   HG13  VAL  69          HG13      VAL  69  -3.345   6.930  -2.708
  551   HG21  VAL  69          HG21      VAL  69  -5.336   6.787  -1.235
  552   HG22  VAL  69          HG22      VAL  69  -5.117   6.960   0.507
  553   HG23  VAL  69          HG23      VAL  69  -4.342   5.629  -0.351
  554    H    SER  70           HN       SER  70  -3.474   6.451   2.686
  555    HA   SER  70           HA       SER  70  -5.317   8.347   3.510
  556    HB2  SER  70           HB2      SER  70  -5.296   6.109   4.450
  557    HB3  SER  70           HB1      SER  70  -3.730   6.406   5.203
  558    HG   SER  70           HG       SER  70  -5.977   6.759   6.346
  559    H    VAL  71           HN       VAL  71  -1.868   8.151   4.196
  560    HA   VAL  71           HA       VAL  71  -1.827  10.223   6.141
  561    HB   VAL  71           HB       VAL  71  -0.008   8.590   5.969
  562   HG11  VAL  71          HG11      VAL  71   0.536   8.022   3.864
  563   HG12  VAL  71          HG12      VAL  71   1.668   9.368   3.989
  564   HG13  VAL  71          HG13      VAL  71   0.102   9.603   3.214
  565   HG21  VAL  71          HG21      VAL  71   1.801  10.076   6.365
  566   HG22  VAL  71          HG22      VAL  71   0.340  10.900   6.910
  567   HG23  VAL  71          HG23      VAL  71   1.074  11.335   5.366
  568    H    MET  72           HN       MET  72  -1.004  12.376   5.898
  569    HA   MET  72           HA       MET  72  -1.409  13.458   3.187
  570    HB2  MET  72           HB2      MET  72  -2.500  14.232   5.762
  571    HB3  MET  72           HB1      MET  72  -1.681  15.580   4.984
  572    HG2  MET  72           HG2      MET  72  -3.224  15.757   3.360
  573    HG3  MET  72           HG1      MET  72  -3.474  14.016   3.256
  574    HE1  MET  72           HE1      MET  72  -6.450  14.188   3.269
  575    HE2  MET  72           HE2      MET  72  -6.624  13.374   4.824
  576    HE3  MET  72           HE3      MET  72  -5.287  12.955   3.754
  577    H    LEU  73           HN       LEU  73  -0.057  14.991   6.082
  578    HA   LEU  73           HA       LEU  73   2.311  15.697   4.506
  579    HB2  LEU  73           HB2      LEU  73   0.966  16.873   6.902
  580    HB3  LEU  73           HB1      LEU  73   2.672  17.188   6.641
  581    HG   LEU  73           HG       LEU  73   0.880  17.675   4.332
  582   HD11  LEU  73          HD11      LEU  73  -0.092  18.572   6.662
  583   HD12  LEU  73          HD12      LEU  73  -0.256  19.451   5.142
  584   HD13  LEU  73          HD13      LEU  73   1.018  19.889   6.281
  585   HD21  LEU  73          HD21      LEU  73   2.528  19.070   3.681
  586   HD22  LEU  73          HD22      LEU  73   3.490  18.116   4.810
  587   HD23  LEU  73          HD23      LEU  73   2.818  19.667   5.315
  588    H    GLN  74           HN       GLN  74   4.368  15.918   5.898
  589    HA   GLN  74           HA       GLN  74   6.052  14.870   7.011
  590    HB2  GLN  74           HB2      GLN  74   3.777  13.850   8.721
  591    HB3  GLN  74           HB1      GLN  74   5.481  13.749   9.141
  592    HG2  GLN  74           HG2      GLN  74   5.185  15.680  10.194
  593    HG3  GLN  74           HG1      GLN  74   5.142  16.418   8.594
  594   HE21  GLN  74          1HE2      GLN  74   3.890  17.781  10.439
  595   HE22  GLN  74          2HE2      GLN  74   2.174  17.614  10.329
  596    HA   PRO  75           HA       PRO  75   6.837  10.868   5.376
  597    HB2  PRO  75           HB2      PRO  75   7.585   9.986   8.127
  598    HB3  PRO  75           HB1      PRO  75   8.487   9.837   6.614
  599    HG2  PRO  75           HG2      PRO  75   9.161  11.677   8.412
  600    HG3  PRO  75           HG1      PRO  75   9.212  12.041   6.676
  601    HD2  PRO  75           HD2      PRO  75   7.223  12.880   8.733
  602    HD3  PRO  75           HD1      PRO  75   7.821  13.761   7.313
  603    H    PHE  76           HN       PHE  76   6.440   8.427   5.920
  604    HA   PHE  76           HA       PHE  76   3.619   8.193   6.516
  605    HB2  PHE  76           HB2      PHE  76   5.687   6.225   5.534
  606    HB3  PHE  76           HB1      PHE  76   4.021   5.770   5.880
  607    HD1  PHE  76           HD2      PHE  76   5.768   8.515   4.041
  608    HD2  PHE  76           HD1      PHE  76   2.678   5.589   4.042
  609    HE1  PHE  76           HE2      PHE  76   5.114   9.210   1.773
  610    HE2  PHE  76           HE1      PHE  76   2.018   6.279   1.774
  611    HZ   PHE  76           HZ       PHE  76   3.237   8.092   0.638
  612    H    ASP  77           HN       ASP  77   6.671   6.958   7.830
  613    HA   ASP  77           HA       ASP  77   5.282   5.662  10.028
  614    HB2  ASP  77           HB2      ASP  77   7.869   5.421   8.766
  615    HB3  ASP  77           HB1      ASP  77   8.051   5.587  10.511
  616    H    TYR  78           HN       TYR  78   7.028   8.596   9.392
  617    HA   TYR  78           HA       TYR  78   7.424  10.450  10.650
  618    HB2  TYR  78           HB2      TYR  78   4.945   9.624  11.405
  619    HB3  TYR  78           HB1      TYR  78   5.783   9.598  12.951
  620    HD1  TYR  78           HD1      TYR  78   7.191  11.775  13.476
  621    HD2  TYR  78           HD2      TYR  78   3.955  11.598  10.720
  622    HE1  TYR  78           HE1      TYR  78   6.886  14.206  13.687
  623    HE2  TYR  78           HE2      TYR  78   3.642  14.027  10.922
  624    HH   TYR  78           HH       TYR  78   4.419  15.807  13.113
  625    H    ASP  79           HN       ASP  79   9.044   8.060  10.953
  626    HA   ASP  79           HA       ASP  79  10.388   8.796  13.425
  627    HB2  ASP  79           HB2      ASP  79   8.693   6.663  13.524
  628    HB3  ASP  79           HB1      ASP  79  10.201   5.877  13.070
  629    HA   PRO  80           HA       PRO  80  13.941   8.581  10.794
  630    HB2  PRO  80           HB2      PRO  80  15.242   7.568  13.285
  631    HB3  PRO  80           HB1      PRO  80  15.762   8.851  12.188
  632    HG2  PRO  80           HG2      PRO  80  14.652   9.443  14.533
  633    HG3  PRO  80           HG1      PRO  80  14.287  10.400  13.085
  634    HD2  PRO  80           HD2      PRO  80  12.614   8.378  14.491
  635    HD3  PRO  80           HD1      PRO  80  12.122   9.841  13.616
  636    H    ASN  81           HN       ASN  81  13.827   5.963  13.218
  637    HA   ASN  81           HA       ASN  81  14.517   3.755  13.030
  638    HB2  ASN  81           HB2      ASN  81  12.600   3.824  10.702
  639    HB3  ASN  81           HB1      ASN  81  12.945   2.467  11.769
  640   HD21  ASN  81          1HE2      ASN  81  10.379   3.255  11.328
  641   HD22  ASN  81          2HE2      ASN  81   9.727   3.967  12.760
  642    H    GLU  82           HN       GLU  82  16.701   4.321  12.280
  643    HA   GLU  82           HA       GLU  82  17.289   4.299   9.490
  644    HB2  GLU  82           HB2      GLU  82  19.223   3.894  11.778
  645    HB3  GLU  82           HB1      GLU  82  19.615   4.397  10.140
  646    HG2  GLU  82           HG2      GLU  82  18.282   6.457  10.516
  647    HG3  GLU  82           HG1      GLU  82  18.075   5.961  12.195
  648    H    LYS  83           HN       LYS  83  17.522   1.867  12.075
  649    HA   LYS  83           HA       LYS  83  18.822  -0.103  10.525
  650    HB2  LYS  83           HB2      LYS  83  18.408  -0.149  13.045
  651    HB3  LYS  83           HB1      LYS  83  16.763  -0.647  12.675
  652    HG2  LYS  83           HG2      LYS  83  18.779  -2.258  11.325
  653    HG3  LYS  83           HG1      LYS  83  18.896  -2.316  13.084
  654    HD2  LYS  83           HD2      LYS  83  16.313  -2.735  11.595
  655    HD3  LYS  83           HD1      LYS  83  17.405  -4.055  12.014
  656    HE2  LYS  83           HE2      LYS  83  17.244  -3.241  14.409
  657    HE3  LYS  83           HE1      LYS  83  15.917  -2.215  13.870
  658    HZ1  LYS  83           HZ1      LYS  83  14.533  -3.960  13.661
  659    HZ2  LYS  83           HZ2      LYS  83  15.577  -4.685  14.777
  660    HZ3  LYS  83           HZ3      LYS  83  15.740  -5.017  13.127
  661    H    SER  84           HN       SER  84  15.445   0.605  11.181
  662    HA   SER  84           HA       SER  84  14.299  -1.331   9.476
  663    HB2  SER  84           HB2      SER  84  13.226   0.254  11.297
  664    HB3  SER  84           HB1      SER  84  12.942   1.293   9.901
  665    HG   SER  84           HG       SER  84  11.762  -1.098  10.596
  666    H    LYS  85           HN       LYS  85  15.781   1.714   8.853
  667    HA   LYS  85           HA       LYS  85  15.931   3.039   6.971
  668    HB2  LYS  85           HB2      LYS  85  17.603   1.402   6.578
  669    HB3  LYS  85           HB1      LYS  85  16.435   0.255   5.942
  670    HG2  LYS  85           HG2      LYS  85  16.015   2.087   4.146
  671    HG3  LYS  85           HG1      LYS  85  17.584   2.702   4.670
  672    HD2  LYS  85           HD2      LYS  85  18.625   0.575   4.163
  673    HD3  LYS  85           HD1      LYS  85  17.059  -0.122   3.745
  674    HE2  LYS  85           HE2      LYS  85  17.431   0.509   1.644
  675    HE3  LYS  85           HE1      LYS  85  17.269   2.179   2.183
  676    HZ1  LYS  85           HZ1      LYS  85  19.706   0.621   1.671
  677    HZ2  LYS  85           HZ2      LYS  85  19.759   1.870   2.809
  678    HZ3  LYS  85           HZ3      LYS  85  19.326   2.204   1.209
  679    H    HIS  86           HN       HIS  86  13.843   3.890   6.650
  680    HA   HIS  86           HA       HIS  86  12.317   2.582   4.471
  681    HB2  HIS  86           HB2      HIS  86  10.210   3.335   5.571
  682    HB3  HIS  86           HB1      HIS  86  11.111   2.136   6.491
  683    HD1  HIS  86           HD1      HIS  86   9.265   5.055   7.053
  684    HD2  HIS  86           HD2      HIS  86  12.947   3.700   8.423
  685    HE1  HIS  86           HE1      HIS  86   9.722   6.360   9.154
  686    HE2  HIS  86           HE2      HIS  86  11.996   5.586   9.915
  687    H    LYS  87           HN       LYS  87  10.735   3.991   3.341
  688    HA   LYS  87           HA       LYS  87  10.458   6.701   3.381
  689    HB2  LYS  87           HB2      LYS  87  13.086   5.951   2.340
  690    HB3  LYS  87           HB1      LYS  87  12.173   6.975   1.242
  691    HG2  LYS  87           HG2      LYS  87  12.483   7.701   4.128
  692    HG3  LYS  87           HG1      LYS  87  13.731   8.090   2.944
  693    HD2  LYS  87           HD2      LYS  87  12.509   9.738   2.024
  694    HD3  LYS  87           HD1      LYS  87  11.012   8.807   2.114
  695    HE2  LYS  87           HE2      LYS  87  10.497   9.578   4.209
  696    HE3  LYS  87           HE1      LYS  87  12.185   9.837   4.646
  697    HZ1  LYS  87           HZ1      LYS  87  10.371  11.580   3.129
  698    HZ2  LYS  87           HZ2      LYS  87  12.033  11.668   2.829
  699    HZ3  LYS  87           HZ3      LYS  87  11.438  11.971   4.383
  700    H    PHE  88           HN       PHE  88   8.899   7.280   1.776
  701    HA   PHE  88           HA       PHE  88   7.910   5.150   0.158
  702    HB2  PHE  88           HB2      PHE  88   6.634   7.062   1.338
  703    HB3  PHE  88           HB1      PHE  88   6.982   7.979  -0.125
  704    HD1  PHE  88           HD1      PHE  88   5.866   4.494   0.625
  705    HD2  PHE  88           HD2      PHE  88   5.206   8.088  -1.556
  706    HE1  PHE  88           HE1      PHE  88   3.922   3.463  -0.477
  707    HE2  PHE  88           HE2      PHE  88   3.261   7.065  -2.662
  708    HZ   PHE  88           HZ       PHE  88   2.617   4.750  -2.122
  709    H    MET  89           HN       MET  89   9.239   8.380  -0.898
  710    HA   MET  89           HA       MET  89   9.132   7.502  -3.652
  711    HB2  MET  89           HB2      MET  89   9.745  10.046  -2.295
  712    HB3  MET  89           HB1      MET  89  10.829   9.736  -3.636
  713    HG2  MET  89           HG2      MET  89   8.710   9.406  -5.070
  714    HG3  MET  89           HG1      MET  89   7.821  10.099  -3.717
  715    HE1  MET  89           HE1      MET  89   7.771  12.023  -6.835
  716    HE2  MET  89           HE2      MET  89   7.710  13.456  -5.814
  717    HE3  MET  89           HE3      MET  89   6.784  12.026  -5.367
  718    H    VAL  90           HN       VAL  90  11.485   7.716  -1.098
  719    HA   VAL  90           HA       VAL  90  13.804   6.923  -2.606
  720    HB   VAL  90           HB       VAL  90  13.788   6.682   0.349
  721   HG11  VAL  90          HG11      VAL  90  15.686   7.272  -1.832
  722   HG12  VAL  90          HG12      VAL  90  15.904   6.333  -0.354
  723   HG13  VAL  90          HG13      VAL  90  15.965   8.096  -0.298
  724   HG21  VAL  90          HG21      VAL  90  14.267   9.200   0.402
  725   HG22  VAL  90          HG22      VAL  90  12.584   8.692   0.261
  726   HG23  VAL  90          HG23      VAL  90  13.457   9.256  -1.164
  727    H    GLN  91           HN       GLN  91  11.286   5.050  -1.258
  728    HA   GLN  91           HA       GLN  91  12.665   2.857  -0.264
  729    HB2  GLN  91           HB2      GLN  91   9.987   3.466  -0.905
  730    HB3  GLN  91           HB1      GLN  91  10.348   1.941  -1.697
  731    HG2  GLN  91           HG2      GLN  91  11.101   1.009   0.431
  732    HG3  GLN  91           HG1      GLN  91  10.729   2.535   1.230
  733   HE21  GLN  91          1HE2      GLN  91   8.347   3.227   0.201
  734   HE22  GLN  91          2HE2      GLN  91   7.145   2.049   0.589
  735    H    SER  92           HN       SER  92  12.535   3.916  -3.492
  736    HA   SER  92           HA       SER  92  12.756   1.519  -4.910
  737    HB2  SER  92           HB2      SER  92  13.726   2.899  -6.706
  738    HB3  SER  92           HB1      SER  92  12.296   3.650  -6.001
  739    HG   SER  92           HG       SER  92  13.890   4.814  -4.633
  740    H    MET  93           HN       MET  93  15.038   2.912  -2.763
  741    HA   MET  93           HA       MET  93  17.404   2.002  -4.059
  742    HB2  MET  93           HB2      MET  93  16.928   3.798  -2.074
  743    HB3  MET  93           HB1      MET  93  17.460   2.410  -1.133
  744    HG2  MET  93           HG2      MET  93  19.420   3.564  -1.513
  745    HG3  MET  93           HG1      MET  93  19.439   2.331  -2.773
  746    HE1  MET  93           HE1      MET  93  20.315   5.778  -2.073
  747    HE2  MET  93           HE2      MET  93  20.735   6.230  -3.725
  748    HE3  MET  93           HE3      MET  93  21.373   4.740  -3.030
  749    H    PHE  94           HN       PHE  94  15.323   0.909  -1.447
  750    HA   PHE  94           HA       PHE  94  16.822  -1.373  -0.728
  751    HB2  PHE  94           HB2      PHE  94  14.959  -0.560   0.648
  752    HB3  PHE  94           HB1      PHE  94  13.819  -0.987  -0.626
  753    HD1  PHE  94           HD1      PHE  94  13.686  -3.432  -1.316
  754    HD2  PHE  94           HD2      PHE  94  15.549  -2.116   2.276
  755    HE1  PHE  94           HE1      PHE  94  13.484  -5.696  -0.390
  756    HE2  PHE  94           HE2      PHE  94  15.347  -4.383   3.214
  757    HZ   PHE  94           HZ       PHE  94  14.314  -6.179   1.880
  758    H    ALA  95           HN       ALA  95  14.544  -0.747  -3.282
  759    HA   ALA  95           HA       ALA  95  15.329  -3.223  -4.617
  760    HB1  ALA  95           HB1      ALA  95  12.479  -2.381  -4.112
  761    HB2  ALA  95           HB2      ALA  95  13.271  -3.862  -3.576
  762    HB3  ALA  95           HB3      ALA  95  12.949  -3.606  -5.290
  763    HA   PRO  96           HA       PRO  96  15.973   0.496  -7.313
  764    HB2  PRO  96           HB2      PRO  96  17.152  -1.299  -9.189
  765    HB3  PRO  96           HB1      PRO  96  17.970  -0.146  -8.135
  766    HG2  PRO  96           HG2      PRO  96  17.535  -3.052  -7.777
  767    HG3  PRO  96           HG1      PRO  96  18.838  -2.022  -7.160
  768    HD2  PRO  96           HD2      PRO  96  16.912  -2.962  -5.552
  769    HD3  PRO  96           HD1      PRO  96  17.593  -1.337  -5.324
  770    H    THR  97           HN       THR  97  14.560  -2.640  -8.012
  771    HA   THR  97           HA       THR  97  13.501  -1.961 -10.554
  772    HB   THR  97           HB       THR  97  12.030  -3.982  -9.003
  773    HG1  THR  97           HG1      THR  97  13.889  -4.520  -8.058
  774   HG21  THR  97          HG21      THR  97  13.650  -4.531 -11.439
  775   HG22  THR  97          HG22      THR  97  12.153  -3.607 -11.569
  776   HG23  THR  97          HG23      THR  97  12.125  -5.244 -10.914
  777    H    ASP  98           HN       ASP  98  12.474  -1.311  -7.323
  778    HA   ASP  98           HA       ASP  98   9.728  -1.051  -7.667
  779    HB2  ASP  98           HB2      ASP  98  11.710   0.119  -5.774
  780    HB3  ASP  98           HB1      ASP  98  10.088   0.801  -5.806
  781    H    THR  99           HN       THR  99  12.244   1.452  -8.050
  782    HA   THR  99           HA       THR  99  10.523   3.554  -8.717
  783    HB   THR  99           HB       THR  99  12.773   4.051 -10.237
  784    HG1  THR  99           HG1      THR  99  14.498   3.300  -8.937
  785   HG21  THR  99          HG21      THR  99  13.596   4.883  -7.781
  786   HG22  THR  99          HG22      THR  99  11.848   4.786  -7.573
  787   HG23  THR  99          HG23      THR  99  12.529   5.780  -8.861
  788    H    SER 100           HN       SER 100  12.116   1.143 -10.730
  789    HA   SER 100           HA       SER 100  11.059   2.089 -13.198
  790    HB2  SER 100           HB2      SER 100  11.675  -0.450 -13.794
  791    HB3  SER 100           HB1      SER 100  12.905   0.802 -13.626
  792    HG   SER 100           HG       SER 100  12.099  -1.099 -11.681
  793    H    ASP 101           HN       ASP 101   9.846   0.114 -10.654
  794    HA   ASP 101           HA       ASP 101   8.038  -1.518 -11.972
  795    HB2  ASP 101           HB2      ASP 101   8.703  -1.467  -9.489
  796    HB3  ASP 101           HB1      ASP 101   7.428  -0.265  -9.307
  797    H    MET 102           HN       MET 102   7.575   1.845 -10.868
  798    HA   MET 102           HA       MET 102   4.833   2.019 -11.366
  799    HB2  MET 102           HB2      MET 102   7.060   3.921 -11.049
  800    HB3  MET 102           HB1      MET 102   5.718   4.535 -12.003
  801    HG2  MET 102           HG2      MET 102   4.424   4.799 -10.212
  802    HG3  MET 102           HG1      MET 102   4.846   3.215  -9.564
  803    HE1  MET 102           HE1      MET 102   4.349   6.331  -8.796
  804    HE2  MET 102           HE2      MET 102   5.758   7.188  -8.174
  805    HE3  MET 102           HE3      MET 102   4.889   6.055  -7.140
  806    H    GLU 103           HN       GLU 103   7.507   2.996 -13.516
  807    HA   GLU 103           HA       GLU 103   5.810   3.426 -15.765
  808    HB2  GLU 103           HB2      GLU 103   8.400   4.091 -15.107
  809    HB3  GLU 103           HB1      GLU 103   8.622   2.886 -16.368
  810    HG2  GLU 103           HG2      GLU 103   8.079   4.337 -17.944
  811    HG3  GLU 103           HG1      GLU 103   6.573   4.748 -17.123
  812    H    ALA 104           HN       ALA 104   8.055   0.855 -14.864
  813    HA   ALA 104           HA       ALA 104   7.890  -0.723 -17.129
  814    HB1  ALA 104           HB1      ALA 104   9.586  -1.065 -15.463
  815    HB2  ALA 104           HB2      ALA 104   8.687  -2.563 -15.701
  816    HB3  ALA 104           HB3      ALA 104   8.376  -1.564 -14.282
  817    H    VAL 105           HN       VAL 105   5.510  -0.357 -14.628
  818    HA   VAL 105           HA       VAL 105   4.250  -2.832 -14.726
  819    HB   VAL 105           HB       VAL 105   3.278  -0.067 -14.117
  820   HG11  VAL 105          HG11      VAL 105   1.069  -0.954 -13.507
  821   HG12  VAL 105          HG12      VAL 105   1.505  -2.507 -14.221
  822   HG13  VAL 105          HG13      VAL 105   1.373  -1.073 -15.239
  823   HG21  VAL 105          HG21      VAL 105   2.741  -2.091 -12.152
  824   HG22  VAL 105          HG22      VAL 105   3.763  -0.659 -12.035
  825   HG23  VAL 105          HG23      VAL 105   4.428  -2.166 -12.663
  826    H    TRP 106           HN       TRP 106   3.400   0.074 -16.634
  827    HA   TRP 106           HA       TRP 106   1.673  -1.514 -18.329
  828    HB2  TRP 106           HB2      TRP 106   1.490   1.040 -17.553
  829    HB3  TRP 106           HB1      TRP 106   2.375   1.286 -19.056
  830    HD1  TRP 106           HD1      TRP 106  -0.269  -1.468 -18.784
  831    HE1  TRP 106           HE1      TRP 106  -2.239  -0.870 -20.329
  832    HE3  TRP 106           HE3      TRP 106   1.163   3.250 -20.138
  833    HZ2  TRP 106           HZ2      TRP 106  -3.075   1.312 -21.910
  834    HZ3  TRP 106           HZ3      TRP 106  -0.279   4.526 -21.670
  835    HH2  TRP 106           HH2      TRP 106  -2.354   3.575 -22.538
  836    H    LYS 107           HN       LYS 107   4.848  -0.056 -18.469
  837    HA   LYS 107           HA       LYS 107   5.219  -0.358 -21.269
  838    HB2  LYS 107           HB2      LYS 107   6.691   0.686 -19.042
  839    HB3  LYS 107           HB1      LYS 107   7.742  -0.355 -19.993
  840    HG2  LYS 107           HG2      LYS 107   8.086   1.593 -21.092
  841    HG3  LYS 107           HG1      LYS 107   6.675   1.028 -21.988
  842    HD2  LYS 107           HD2      LYS 107   5.388   2.326 -20.077
  843    HD3  LYS 107           HD1      LYS 107   6.909   3.215 -19.984
  844    HE2  LYS 107           HE2      LYS 107   5.408   2.779 -22.556
  845    HE3  LYS 107           HE1      LYS 107   5.153   4.182 -21.520
  846    HZ1  LYS 107           HZ1      LYS 107   6.708   4.816 -23.154
  847    HZ2  LYS 107           HZ2      LYS 107   7.632   3.414 -22.951
  848    HZ3  LYS 107           HZ3      LYS 107   7.605   4.591 -21.737
  849    H    GLU 108           HN       GLU 108   6.361  -2.280 -18.481
  850    HA   GLU 108           HA       GLU 108   7.312  -4.314 -20.355
  851    HB2  GLU 108           HB2      GLU 108   7.789  -3.820 -17.435
  852    HB3  GLU 108           HB1      GLU 108   8.179  -5.371 -18.167
  853    HG2  GLU 108           HG2      GLU 108  10.166  -4.468 -18.586
  854    HG3  GLU 108           HG1      GLU 108   9.346  -3.634 -19.906
  855    H    ALA 109           HN       ALA 109   4.438  -3.684 -18.962
  856    HA   ALA 109           HA       ALA 109   2.555  -4.906 -18.612
  857    HB1  ALA 109           HB1      ALA 109   2.743  -7.380 -19.489
  858    HB2  ALA 109           HB2      ALA 109   4.220  -6.767 -20.230
  859    HB3  ALA 109           HB3      ALA 109   2.669  -6.018 -20.605
  860    H    LYS 110           HN       LYS 110   1.907  -7.322 -17.761
  861    HA   LYS 110           HA       LYS 110   2.443  -7.325 -15.059
  862    HB2  LYS 110           HB2      LYS 110   0.525  -8.446 -16.013
  863    HB3  LYS 110           HB1      LYS 110   1.564  -9.615 -16.816
  864    HG2  LYS 110           HG2      LYS 110   2.021  -9.525 -13.952
  865    HG3  LYS 110           HG1      LYS 110   0.347  -9.908 -14.358
  866    HD2  LYS 110           HD2      LYS 110   2.635 -11.303 -15.708
  867    HD3  LYS 110           HD1      LYS 110   2.027 -11.847 -14.145
  868    HE2  LYS 110           HE2      LYS 110   0.592 -13.077 -15.345
  869    HE3  LYS 110           HE1      LYS 110  -0.277 -11.562 -15.582
  870    HZ1  LYS 110           HZ1      LYS 110   0.411 -11.396 -17.716
  871    HZ2  LYS 110           HZ2      LYS 110   0.502 -13.079 -17.588
  872    HZ3  LYS 110           HZ3      LYS 110   1.902 -12.144 -17.432
  873    HA   PRO 111           HA       PRO 111   5.580 -11.117 -16.090
  874    HB2  PRO 111           HB2      PRO 111   6.902  -9.431 -18.186
  875    HB3  PRO 111           HB1      PRO 111   6.851 -11.192 -18.027
  876    HG2  PRO 111           HG2      PRO 111   5.245  -9.971 -19.746
  877    HG3  PRO 111           HG1      PRO 111   4.650 -11.327 -18.769
  878    HD2  PRO 111           HD2      PRO 111   4.112  -8.415 -18.500
  879    HD3  PRO 111           HD1      PRO 111   3.062  -9.796 -18.122
  880    H    GLU 112           HN       GLU 112   6.375  -7.652 -16.395
  881    HA   GLU 112           HA       GLU 112   8.837  -7.917 -14.962
  882    HB2  GLU 112           HB2      GLU 112   7.603  -5.930 -16.507
  883    HB3  GLU 112           HB1      GLU 112   7.764  -5.234 -14.902
  884    HG2  GLU 112           HG2      GLU 112  10.083  -6.591 -16.215
  885    HG3  GLU 112           HG1      GLU 112   9.672  -4.921 -16.603
  886    H    ASP 113           HN       ASP 113   5.556  -6.956 -14.126
  887    HA   ASP 113           HA       ASP 113   6.102  -6.033 -11.523
  888    HB2  ASP 113           HB2      ASP 113   3.504  -7.295 -12.381
  889    HB3  ASP 113           HB1      ASP 113   3.757  -6.030 -11.183
  890    H    LEU 114           HN       LEU 114   5.426  -9.238 -12.798
  891    HA   LEU 114           HA       LEU 114   4.856 -10.596 -10.445
  892    HB2  LEU 114           HB2      LEU 114   4.732 -11.505 -12.780
  893    HB3  LEU 114           HB1      LEU 114   6.477 -11.685 -12.744
  894    HG   LEU 114           HG       LEU 114   6.093 -13.148 -10.661
  895   HD11  LEU 114          HD11      LEU 114   3.806 -12.588 -10.203
  896   HD12  LEU 114          HD12      LEU 114   3.890 -14.289 -10.662
  897   HD13  LEU 114          HD13      LEU 114   3.313 -13.090 -11.820
  898   HD21  LEU 114          HD21      LEU 114   5.038 -14.233 -13.262
  899   HD22  LEU 114          HD22      LEU 114   5.908 -15.097 -11.995
  900   HD23  LEU 114          HD23      LEU 114   6.746 -13.897 -12.979
  901    H    MET 115           HN       MET 115   8.006  -9.870 -11.900
  902    HA   MET 115           HA       MET 115   9.496 -11.225  -9.872
  903    HB2  MET 115           HB2      MET 115  10.392 -10.889 -12.133
  904    HB3  MET 115           HB1      MET 115  10.386  -9.148 -11.881
  905    HG2  MET 115           HG2      MET 115  12.528  -9.470 -11.328
  906    HG3  MET 115           HG1      MET 115  11.857  -9.937  -9.767
  907    HE1  MET 115           HE1      MET 115  13.877 -11.373  -9.014
  908    HE2  MET 115           HE2      MET 115  14.735 -10.841 -10.459
  909    HE3  MET 115           HE3      MET 115  14.690 -12.554 -10.042
  910    H    ASP 116           HN       ASP 116   8.524  -7.884 -10.441
  911    HA   ASP 116           HA       ASP 116  10.065  -6.766  -8.330
  912    HB2  ASP 116           HB2      ASP 116   7.685  -5.761  -9.886
  913    HB3  ASP 116           HB1      ASP 116   8.457  -4.810  -8.619
  914    H    SER 117           HN       SER 117   6.790  -8.029  -8.562
  915    HA   SER 117           HA       SER 117   5.829  -7.107  -6.082
  916    HB2  SER 117           HB2      SER 117   5.071  -9.617  -7.576
  917    HB3  SER 117           HB1      SER 117   4.103  -8.821  -6.335
  918    HG   SER 117           HG       SER 117   4.197  -6.935  -7.806
  919    H    LYS 118           HN       LYS 118   7.256 -10.239  -7.003
  920    HA   LYS 118           HA       LYS 118   7.199 -11.341  -4.402
  921    HB2  LYS 118           HB2      LYS 118   8.156 -12.108  -7.017
  922    HB3  LYS 118           HB1      LYS 118   9.357 -12.503  -5.794
  923    HG2  LYS 118           HG2      LYS 118   8.212 -14.341  -5.350
  924    HG3  LYS 118           HG1      LYS 118   6.911 -13.326  -4.724
  925    HD2  LYS 118           HD2      LYS 118   5.636 -14.217  -6.329
  926    HD3  LYS 118           HD1      LYS 118   6.549 -13.215  -7.459
  927    HE2  LYS 118           HE2      LYS 118   8.235 -15.201  -7.424
  928    HE3  LYS 118           HE1      LYS 118   6.858 -16.118  -6.816
  929    HZ1  LYS 118           HZ1      LYS 118   5.784 -15.992  -8.789
  930    HZ2  LYS 118           HZ2      LYS 118   7.361 -15.864  -9.385
  931    HZ3  LYS 118           HZ3      LYS 118   6.418 -14.475  -9.187
  932    H    LEU 119           HN       LEU 119   9.349  -9.241  -6.103
  933    HA   LEU 119           HA       LEU 119  11.605  -9.531  -4.383
  934    HB2  LEU 119           HB2      LEU 119  11.787  -8.657  -6.665
  935    HB3  LEU 119           HB1      LEU 119  10.838  -7.254  -6.210
  936    HG   LEU 119           HG       LEU 119  12.805  -7.014  -4.409
  937   HD11  LEU 119          HD11      LEU 119  14.480  -7.852  -6.686
  938   HD12  LEU 119          HD12      LEU 119  13.761  -9.148  -5.730
  939   HD13  LEU 119          HD13      LEU 119  14.788  -7.942  -4.951
  940   HD21  LEU 119          HD21      LEU 119  12.098  -5.295  -5.976
  941   HD22  LEU 119          HD22      LEU 119  12.943  -6.120  -7.287
  942   HD23  LEU 119          HD23      LEU 119  13.857  -5.423  -5.949
  943    H    ARG 120           HN       ARG 120   8.882  -7.284  -4.489
  944    HA   ARG 120           HA       ARG 120   9.819  -5.633  -2.366
  945    HB2  ARG 120           HB2      ARG 120   7.733  -5.548  -4.230
  946    HB3  ARG 120           HB1      ARG 120   6.938  -5.608  -2.663
  947    HG2  ARG 120           HG2      ARG 120   8.987  -3.595  -3.563
  948    HG3  ARG 120           HG1      ARG 120   7.259  -3.320  -3.333
  949    HD2  ARG 120           HD2      ARG 120   7.426  -3.537  -1.000
  950    HD3  ARG 120           HD1      ARG 120   9.020  -4.283  -1.100
  951    HE   ARG 120           HE       ARG 120   8.423  -1.483  -1.068
  952   HH11  ARG 120          HH11      ARG 120  10.720  -3.878  -2.149
  953   HH12  ARG 120          HH12      ARG 120  12.043  -2.762  -2.210
  954   HH21  ARG 120          HH21      ARG 120  10.161  -0.014  -1.156
  955   HH22  ARG 120          HH22      ARG 120  11.725  -0.568  -1.650
  956    H    CYS 121           HN       CYS 121   7.812  -8.497  -2.553
  957    HA   CYS 121           HA       CYS 121   6.653  -8.441  -0.019
  958    HB2  CYS 121           HB2      CYS 121   7.484 -10.777  -1.744
  959    HB3  CYS 121           HB1      CYS 121   6.538 -10.946  -0.268
  960    HG   CYS 121           HG       CYS 121   5.042  -9.078  -1.987
  961    H    VAL 122           HN       VAL 122   9.865  -9.394  -1.038
  962    HA   VAL 122           HA       VAL 122  10.679 -10.778   1.260
  963    HB   VAL 122           HB       VAL 122  12.461  -9.070  -0.475
  964   HG11  VAL 122          HG11      VAL 122  12.891 -11.130   1.594
  965   HG12  VAL 122          HG12      VAL 122  13.902  -9.764   1.123
  966   HG13  VAL 122          HG13      VAL 122  13.910 -11.240   0.159
  967   HG21  VAL 122          HG21      VAL 122  11.340 -10.403  -2.033
  968   HG22  VAL 122          HG22      VAL 122  11.289 -11.791  -0.945
  969   HG23  VAL 122          HG23      VAL 122  12.815 -11.306  -1.683
  970    H    PHE 123           HN       PHE 123  10.622  -7.336   0.519
  971    HA   PHE 123           HA       PHE 123  12.186  -6.387   2.633
  972    HB2  PHE 123           HB2      PHE 123  11.582  -4.873   0.889
  973    HB3  PHE 123           HB1      PHE 123   9.866  -5.165   1.133
  974    HD1  PHE 123           HD1      PHE 123   8.781  -4.324   3.239
  975    HD2  PHE 123           HD2      PHE 123  12.702  -3.177   2.056
  976    HE1  PHE 123           HE1      PHE 123   8.661  -2.379   4.742
  977    HE2  PHE 123           HE2      PHE 123  12.592  -1.230   3.556
  978    HZ   PHE 123           HZ       PHE 123  10.569  -0.830   4.903
  979    H    GLU 124           HN       GLU 124   8.833  -7.363   2.500
  980    HA   GLU 124           HA       GLU 124   8.058  -6.340   5.026
  981    HB2  GLU 124           HB2      GLU 124   6.810  -8.719   3.660
  982    HB3  GLU 124           HB1      GLU 124   6.046  -7.570   4.751
  983    HG2  GLU 124           HG2      GLU 124   7.006  -6.028   2.641
  984    HG3  GLU 124           HG1      GLU 124   6.342  -7.477   1.887
  985    H    LEU 125           HN       LEU 125   9.016  -9.592   3.959
  986    HA   LEU 125           HA       LEU 125  10.152 -10.142   6.555
  987    HB2  LEU 125           HB2      LEU 125   7.562 -11.274   5.690
  988    HB3  LEU 125           HB1      LEU 125   8.701 -12.417   6.375
  989    HG   LEU 125           HG       LEU 125   8.295  -9.934   7.926
  990   HD11  LEU 125          HD11      LEU 125   6.139 -10.204   8.514
  991   HD12  LEU 125          HD12      LEU 125   6.211 -11.960   8.381
  992   HD13  LEU 125          HD13      LEU 125   6.019 -10.975   6.932
  993   HD21  LEU 125          HD21      LEU 125   9.596 -11.360   9.113
  994   HD22  LEU 125          HD22      LEU 125   8.893 -12.797   8.370
  995   HD23  LEU 125          HD23      LEU 125   8.024 -11.951   9.649