*HEADER    LIGASE                                  04-MAR-05   1Z1M              
*TITLE     NMR STRUCTURE OF UNLIAGNDED MDM2                                      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UBIQUITIN-PROTEIN LIGASE E3 MDM2;                          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: N-TERMINAL DOMAIN;                                         
*COMPND   5 SYNONYM: P53-BINDING PROTEIN MDM2, ONCOPROTEIN MDM2,                 
*COMPND   6 DOUBLE MINUTE 2 PROTEIN, HDM2;                                       
*COMPND   7 EC: 6.3.2.-;                                                         
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: ROSETTA (DE3) PLYSS                        
*KEYWDS    PEPTIDE-BINDING GROOVE, PSUDOSYMMETRY, ALPHA-BETA DOMAINS             
*EXPDTA    NMR, 24 STRUCTURES                                                    
*AUTHOR    S.UHRINOVA, D.UHRIN, H.POWERS, K.WATT, D.ZHELEVA, P.FISCHER,          
*AUTHOR   2 C.MCINNES, P.N.BARLOW                                                
*REVDAT   1   28-JUN-05 1Z1M    0                                                

###ha list included!!

assign (resid 19 and name HA  )(resid 20 and name HD* )   2.8 1.2 0.6  
assign (resid 19 and name HG2* )(resid 20 and name HD* )  2.8 1.2 0.6
assign (resid 19 and name HD1* )(resid 20 and name HD* )  3.8 1.2 0.8

assign (resid 19 and name HG2* )(resid 100 and name HE* )  2.8 1.2 0.6
assign (resid 19 and name HD1* )(resid 100 and name HE* )  3.5 1.2 0.8

assign (resid 19 and name HG2* )(resid 100 and name HD* )  3.5 1.2 0.8
assign (resid 19 and name HD1* )(resid 100 and name HD* )  3.3 1.2 0.6

assign (resid 19 and name HD1* )(resid 96 and name HA  )   4.2 1.2 0.6
assign (resid 19 and name HD1* )(resid 96 and name HB* )   3.0 1.2 0.6

assign (resid 19 and name HG2* )(resid 96 and name HB* )   3.6 1.2 0.6
assign (resid 19 and name HD1* )(resid 97 and name HA  )   2.7 1.2 0.6

assign (resid 19 and name HD1* )(resid 97 and name HG* )   4.0 1.2 0.6

assign (resid 19 and name HD1* )(resid 100 and name HB*  ) 4.3 1.2 0.6

assign (resid 26 and name HG2* )(resid 28 and name HB* )   4.2 1.2 0.6
assign (resid 28 and name HA   )(resid 29 and name HB*  )  4.2 1.2 0.6
assign (resid 28 and name HA   )(resid 109 and name HA  )  2.7 1.2 0.6

assign (resid 28 and name HG2* )(resid 109 and name HA  )  3.2 1.2 0.6

assign (resid 29 and name HB*  )(resid 47 and name HA  )  3.2 1.2 0.6
assign (resid 29 and name HB*  )(resid 47 and name HG2* )  3.2 1.2 0.6

assign (resid 97 and name HA   )(resid 100 and name HB*  ) 3.0 1.2 0.6
assign (resid 19 and name HD1* )(resid 100 and name HB*  ) 4.3 1.2 0.6

assign (resid 96 and name HA   )(resid 99 and name HB   ) 3.0 1.2 0.6

assign (resid 99 and name HB   )(resid 102 and name HE* ) 4.0 1.2 0.8
assign (resid 96 and name HB   )(resid 99 and name HB   ) 3.0 1.2 0.6
assign (resid 99 and name HB   )(resid 96 and name  HD2 or resid  96  and name  HD1 ) 3.6 2.4 0.9

assign (resid 98 and name HB*   )(resid 99 and name HD1*   ) 3.0 1.2 0.6

assign (resid 99 and name HG2*   )(resid 102 and name HE* ) 3.0 1.2 0.5
assign (resid 99 and name HD1*   )(resid 102 and name HE* ) 3.0 1.2 0.5


assign (resid 26 and name  HA )(resid  28  and name  HG1* ) 3.4 3.4 0.9
assign (resid 26 and name  HG2* )(resid  26  and name  HA ) 3.4 3.4 0.6
assign (resid 26 and name  HB )(resid  26  and name  HA ) 3.4 3.4 0.6
assign (resid 28 and name  HG2* )(resid  28  and name  HA ) 3.4 3.4 0.6
assign (resid 28 and name  HG1* )(resid  28  and name  HA ) 2.7 2.7 0.4
assign (resid 26 and name  HG2* )(resid  28  and name  HA ) 5.1 5.1 2.1
assign (resid 28 and name  HA )(resid  29  and name  HB* ) 4.2 4.2 1.8
assign (resid 28 and name  HB )(resid  28  and name  HA ) 3.4 3.4 0.6
assign (resid 26 and name  HB )(resid  28  and name  HG1* ) 3.4 3.4 0.6
assign (resid 26 and name  HG2* )(resid  26  and name  HA ) 2.7 2.7 0.4
assign (resid 26 and name  HB )(resid  50  and name  HG2 ) 3.4 3.4 0.6
assign (resid 26 and name  HB )(resid  50  and name  HG1 ) 3.4 3.4 0.6
assign (resid 26 and name  HB )(resid  26  and name  HA ) 3.4 3.4 0.6
assign (resid 26 and name  HB )(resid  28  and name  HG1* ) 4.2 4.2 1.8
assign (resid 21 and name  HA )(resid  19  and name  HG2* ) 5.1 5.1 2.1
assign (resid 21 and name  HA )(resid  21  and name  HG2* ) 2.7 2.7 0.4
assign (resid 21 and name  HA )(resid  22  and name  HA ) 5.1 5.1 2.1
assign (resid 19 and name  HD1* )(resid  19  and name  HA ) 3.4 3.4 0.6
assign (resid 19 and name  HG2* )(resid  19  and name  HA ) 3.4 3.4 0.6
assign (resid 19 and name  HG1* )(resid  19  and name  HA ) 3.4 3.4 0.6
assign (resid 19 and name  HA )(resid  20  and name  HD* ) 2.7 2.7 0.4
assign (resid 18 and name  HN )(resid  19  and name  HA ) 5.1 5.1 2.1
assign (resid 20 and name  HD2* )(resid  19  and name  HA ) 3.4 3.4 0.6
assign (resid 19 and name  HA )(resid  20  and name  HD1 ) 3.4 3.4 0.6
assign (resid 19 and name  HD1* )(resid  20  and name  HD1 ) 5.1 5.1 2.1
assign (resid 19 and name  HG2* )(resid  20  and name  HD1 ) 3.4 3.4 0.6
assign (resid 19 and name  HG2* )(resid  20  and name  HD2 ) 3.4 3.4 0.6
assign (resid 19 and name  HD1* )(resid  97  and name  HA ) 3.4 3.4 0.6
assign (resid 97 and name  HG* )(resid  97  and name  HA ) 2.7 2.7 0.4
assign (resid 97 and name  HA )(resid  100  and name  HD* ) 4.2 4.2 1.8
assign (resid 97 and name  HA )(resid  100  and name  HB2 ) 3.4 3.4 0.6
assign (resid 8 and name  HA )(resid  9  and name  HD1 ) 2.7 2.7 0.4
assign (resid 8 and name  HA )(resid  9  and name  HD2 ) 2.7 2.7 0.4
assign (resid 19 and name  HD1* )(resid  96  and name  HA ) 5.1 5.1 2.1
assign (resid 19 and name  HG2* )(resid  96  and name  HA ) 3.4 3.4 0.6
assign (resid 96 and name  HA )(resid  96  and name  HB* ) 2.7 2.7 0.4
assign (resid 96 and name  HA )(resid  96  and name  HD2 ) 3.4 3.4 0.6
assign (resid 96 and name  HA )(resid  99  and name  HB ) 2.7 2.7 0.4
assign (resid 89 and name  HD1 )(resid  88  and name  HA ) 3.4 3.4 0.6
assign (resid 89 and name  HD2 )(resid  88  and name  HA ) 4.2 4.2 1.8
assign (resid 62 and name  HA )(resid  65  and name  HA ) 5.1 5.1 2.1
assign (resid 64 and name  HA )(resid  65  and name  HA ) 5.1 5.1 2.1
assign (resid 91 and name  HE* )(resid  93  and name  HA ) 3.4 3.4 0.6
assign (resid 93 and name  HA )(resid  93  and name  HB ) 3.4 3.4 0.6
assign (resid 75 and name  HG2* )(resid  93  and name  HA ) 4.2 4.2 1.8
assign (resid 93 and name  HA )(resid  99  and name  HG2* ) 3.4 3.4 0.6
assign (resid 93 and name  HA )(resid  99  and name  HD1* ) 3.4 3.4 0.6
assign (resid 76 and name  HB1 )(resid  90  and name  HA ) 4.2 4.2 1.8
assign (resid 76 and name  HB2 )(resid  90  and name  HA ) 5.1 5.1 2.1
assign (resid 90 and name  HA )(resid  90  and name  HB2 ) 3.4 3.4 0.6
assign (resid 90 and name  HA )(resid  90  and name  HB1 ) 3.4 3.4 0.6
assign (resid 76 and name  HA )(resid  90  and name  HA ) 3.4 3.4 0.6
assign (resid 76 and name  HA )(resid  90  and name  HA ) 3.4 3.4 0.6
assign (resid 76 and name  HD1 )(resid  76  and name  HA ) 3.4 3.4 0.6
assign (resid 76 and name  HD* )(resid  90  and name  HA ) 4.2 4.2 1.8
assign (resid 74 and name  HG2* )(resid  90  and name  HA ) 3.4 3.4 0.6
assign (resid 90 and name  HB1 )(resid  90  and name  HA ) 3.4 3.4 0.6
assign (resid 90 and name  HB2 )(resid  90  and name  HA ) 3.4 3.4 0.6
assign (resid 76 and name  HA )(resid  90  and name  HB2 ) 3.4 3.4 0.6
assign (resid 76 and name  HA )(resid  90  and name  HB1 ) 3.4 3.4 0.6
assign (resid 90 and name  HB1 )(resid  90  and name  HB2 ) 3.4 3.4 0.6
assign (resid 74 and name  HG2* )(resid  90  and name  HB1 ) 3.4 3.4 0.6
assign (resid 74 and name  HG2* )(resid  90  and name  HB2 ) 3.4 3.4 0.6
assign (resid 76 and name  HD* )(resid  90  and name  HB1 ) 3.4 3.4 0.6
assign (resid 76 and name  HD* )(resid  90  and name  HB2 ) 3.4 3.4 0.6
assign (resid 91 and name  HB2 )(resid  91  and name  HA ) 3.4 3.4 0.6
assign (resid 91 and name  HB1 )(resid  91  and name  HA ) 3.4 3.4 0.6
assign (resid 91 and name  HA )(resid  91  and name  HD* ) 3.4 3.4 0.6
assign (resid 88 and name  HG2* )(resid  91  and name  HA ) 3.4 3.4 0.6
assign (resid 74 and name  HA )(resid  92  and name  HA ) 3.4 3.4 0.6
assign (resid 92 and name  HB* )(resid  92  and name  HA ) 3.4 3.4 0.6
assign (resid 74 and name  HB )(resid  92  and name  HA ) 5.1 5.1 2.1
assign (resid 92 and name  HA )(resid  93  and name  HG1* ) 5.1 5.1 2.1
assign (resid 74 and name  HD1* )(resid  92  and name  HA ) 3.4 3.4 0.6
assign (resid 74 and name  HG2* )(resid  92  and name  HA ) 4.2 4.2 1.8
assign (resid 74 and name  HA )(resid  92  and name  HA ) 3.4 3.4 0.6
assign (resid 74 and name  HG2* )(resid  74  and name  HA ) 3.4 3.4 0.6
assign (resid 92 and name  HA )(resid  93  and name  HG2* ) 5.1 5.1 2.1
assign (resid 75 and name  HG2* )(resid  92  and name  HA ) 4.2 4.2 1.8
assign (resid 92 and name  HB1 )(resid  92  and name  HA ) 3.4 3.4 0.6
assign (resid 92 and name  HB2 )(resid  92  and name  HA ) 3.4 3.4 0.6
assign (resid 74 and name  HD1* )(resid  92  and name  HB1 ) 3.4 3.4 0.6
assign (resid 74 and name  HD1* )(resid  92  and name  HB2 ) 4.2 4.2 1.8
assign (resid 92 and name  HB1 )(resid  95  and name  HG1 ) 3.4 3.4 0.6
assign (resid 92 and name  HB2 )(resid  95  and name  HG1 ) 3.4 3.4 0.6
assign (resid 92 and name  HB1 )(resid  95  and name  HG2 ) 4.2 4.2 1.8
assign (resid 92 and name  HB2 )(resid  95  and name  HG2 ) 3.4 3.4 0.6
assign (resid 73 and name  HD2 )(resid  92  and name  HB1 ) 5.1 5.1 2.1
assign (resid 73 and name  HD2 )(resid  92  and name  HA ) 5.1 5.1 2.1
assign (resid 91 and name  HD* )(resid  93  and name  HA ) 4.2 4.2 1.8
assign (resid 93 and name  HA )(resid  96  and name  HB ) 5.1 5.1 2.1
assign (resid 93 and name  HA )(resid  99  and name  HG1* ) 5.1 5.1 2.1
assign (resid 73 and name  HA )(resid  73  and name  HB2 ) 3.4 3.4 0.6
assign (resid 73 and name  HA )(resid  73  and name  HB1 ) 3.4 3.4 0.6
assign (resid 73 and name  HA )(resid  93  and name  HB ) 3.4 3.4 0.6
assign (resid 93 and name  HG1* )(resid  94  and name  HA ) 3.4 3.4 0.6
assign (resid 94 and name  HA )(resid  94  and name  HG* ) 2.7 2.7 0.4
assign (resid 94 and name  HA )(resid  94  and name  HB2 ) 3.4 3.4 0.6
assign (resid 94 and name  HA )(resid  94  and name  HB1 ) 3.4 3.4 0.6
assign (resid 94 and name  HA )(resid  95  and name  HA ) 5.1 5.1 2.1
assign (resid 100 and name  HA )(resid  103  and name  HD1* ) 3.4 3.4 0.6
assign (resid 99 and name  HD1* )(resid  100  and name  HA ) 3.4 3.4 0.6
assign (resid 100 and name  HA )(resid  103  and name  HB ) 3.4 3.4 0.6
assign (resid 100 and name  HA )(resid  100  and name  HB2 ) 3.4 3.4 0.6
assign (resid 100 and name  HA )(resid  100  and name  HB1 ) 3.4 3.4 0.6
assign (resid 100 and name  HA )(resid  103  and name  HG2* ) 3.4 3.4 0.6
assign (resid 101 and name  HA )(resid  101  and name  HB ) 3.4 3.4 0.6
assign (resid 101 and name  HA )(resid  104  and name  HB* ) 3.4 3.4 0.6
assign (resid 100 and name  HA )(resid  101  and name  HA ) 5.1 5.1 2.1
assign (resid 101 and name  HA )(resid  101  and name  HG2* ) 3.4 3.4 0.6
assign (resid 101 and name  HA )(resid  104  and name  HE* ) 5.1 5.1 2.1
assign (resid 101 and name  HA )(resid  104  and name  HD* ) 3.4 3.4 0.6
   
assign (resid 101 and name  HB )(resid  102  and name  HG1 ) 5.1 5.1 2.1
assign (resid 98 and name  HA )(resid  101  and name  HB ) 3.4 3.4 0.6
assign (resid 101 and name  HA )(resid  101  and name  HB ) 3.4 3.4 0.6
assign (resid 98 and name  HA )(resid  101  and name  HG2* ) 3.4 3.4 0.6
assign (resid 98 and name  HA )(resid  101  and name  HB ) 3.4 3.4 0.6
assign (resid 101 and name  HB )(resid  102  and name  HG2 ) 5.1 5.1 2.1
assign (resid 102 and name  HA )(resid  102  and name  HG2 ) 3.4 3.4 0.6
assign (resid 102 and name  HA )(resid  102  and name  HG1 ) 3.4 3.4 0.6
assign (resid  and name   )(resid    and name   )   
assign (resid 103 and name  HG2* )(resid  103  and name  HA ) 2.7 2.7 0.4
assign (resid 103 and name  HB )(resid  103  and name  HA ) 3.4 3.4 0.6
assign (resid 102 and name  HG1 )(resid  103  and name  HA ) 4.2 4.2 1.8
assign (resid  and name   )(resid    and name   )   
assign (resid 86 and name  HE* )(resid  103  and name  HA ) 3.4 3.4 0.6
assign (resid 104 and name  HA )(resid  104  and name  HD* ) 3.4 3.4 0.6
assign (resid 104 and name  HA )(resid  104  and name  HE* ) 4.2 4.2 1.8
assign (resid 104 and name  HA )(resid  104  and name  HB* ) 3.4 3.4 0.6
assign (resid 103 and name  HG2* )(resid  104  and name  HA ) 3.4 3.4 0.6
assign (resid 108 and name  HA )(resid  108  and name  HB ) 3.4 3.4 0.6
assign (resid 108 and name  HA )(resid  108  and name  HD1* ) 3.4 3.4 0.6
assign (resid 82H and name  D2* )(resid  85  and name  HA ) 3.4 3.4 0.6
assign (resid 85 and name  HD1* )(resid  85  and name  HA ) 2.7 2.7 0.4
assign (resid 85 and name  HB2 )(resid  85  and name  HA ) 2.7 2.7 0.4
assign (resid 85 and name  HB1 )(resid  85  and name  HA ) 2.7 2.7 0.4
assign (resid 28 and name  HA )(resid  109  and name  HA ) 3.4 3.4 0.6
assign (resid 109 and name  HA )(resid  109  and name  HB ) 3.4 3.4 0.6
assign (resid 29 and name  HB* )(resid  109  and name  HA ) 5.1 5.1 2.1
assign (resid 109 and name  HA )(resid  109  and name  HG1* ) 2.7 2.7 0.4
assign (resid 28 and name  HG2* )(resid  109  and name  HA ) 3.4 3.4 0.6
assign (resid 29 and name  HA )(resid  48  and name  HD* ) 5.1 5.1 2.1
assign (resid 29 and name  HA )(resid  48  and name  HE* ) 5.1 5.1 2.1
assign (resid 29 and name  HA )(resid  47  and name  HA ) 3.4 3.4 0.6
assign (resid 29 and name  HA )(resid  30  and name  HD* ) 3.4 3.4 0.6
assign (resid 29 and name  HA )(resid  29  and name  HD* ) 5.1 5.1 2.1
assign (resid 29 and name  HA )(resid  29  and name  HB1 ) 3.4 3.4 0.6
assign (resid 29 and name  HA )(resid  29  and name  HB2 ) 3.4 3.4 0.6
assign (resid 29 and name  HA )(resid  47  and name  HG2* ) 3.4 3.4 0.6
assign (resid 28 and name  HG1* )(resid  29  and name  HA ) 3.4 3.4 0.8
assign (resid 28 and name  HG2* )(resid  29  and name  HA ) 4.2 4.2 1.8
assign (resid 26 and name  HB )(resid  50  and name  HB* ) 3.4 3.4 0.6
assign (resid 27 and name  HA )(resid  49  and name  HA ) 3.4 3.4 0.6
assign (resid 27 and name  HA )(resid  49  and name  HA ) 2.7 2.7 0.4
assign (resid 27 and name  HD1* )(resid  49  and name  HA ) 3.4 3.4 0.6
assign (resid 49 and name  HG2* )(resid  49  and name  HA ) 3.4 3.4 0.6
assign (resid 27 and name  HB1 )(resid  49  and name  HA ) 4.2 4.2 1.8
assign (resid 49 and name  HA )(resid  50  and name  HB* ) 5.1 5.1 2.1
assign (resid 49 and name  HA )(resid  49  and name  HB ) 3.4 3.4 0.6
assign (resid 27 and name  HD1* )(resid  49  and name  HB ) 3.4 3.4 0.6
assign (resid 49 and name  HG2* )(resid  49  and name  HB ) 2.7 2.7 0.4
assign (resid 49 and name  HB )(resid  51  and name  HB1 ) 4.2 4.2 1.8
assign (resid 49 and name  HB )(resid  50  and name  HB* ) 3.4 3.4 0.6
assign (resid 27 and name  HB1 )(resid  49  and name  HB ) 5.1 5.1 2.1
assign (resid 38 and name  HD2* )(resid  53  and name  HA ) 4.2 4.2 1.8
assign (resid 38 and name  HD1* )(resid  53  and name  HA ) 3.4 3.4 0.6
assign (resid 53 and name  HA )(resid  53  and name  HG2* ) 2.7 2.7 0.4
assign (resid 53 and name  HA )(resid  53  and name  HB ) 3.4 3.4 0.6
assign (resid 53 and name  HA )(resid  56  and name  HB* ) 4.2 4.2 1.8
assign (resid 53 and name  HA )(resid  56  and name  HD* ) 4.2 4.2 1.8
assign (resid 53 and name  HA )(resid  53  and name  HN ) 4.2 4.2 1.8
assign (resid 52 and name  HA )(resid  53  and name  HN ) 5.1 5.1 2.1
assign (resid 96 and name  HA )(resid  96  and name  HD2 ) 3.4 3.4 0.6
assign (resid 52 and name  HA )(resid  55  and name  HD* ) 4.2 4.2 1.8
assign (resid 96 and name  JB )(resid  96  and name  HA ) 2.7 2.7 0.4
assign (resid 55 and name  HA )(resid  55  and name  HD* ) 3.4 3.4 0.6
assign (resid 76 and name  HA )(resid  90  and name  HA ) 3.4 3.4 0.6
assign (resid 76 and name  HB2 )(resid  76  and name  HA ) 3.4 3.4 0.6
assign (resid 76 and name  HB1 )(resid  76  and name  HA ) 3.4 3.4 0.6
assign (resid 75 and name  HG1* )(resid  76  and name  HA ) 5.1 5.1 2.1
assign (resid 76 and name  HB2 )(resid  76  and name  HA ) 3.4 3.4 0.6
assign (resid 76 and name  HB1 )(resid  76  and name  HA ) 3.4 3.4 0.6
assign (resid 76 and name  HA )(resid  90  and name  HB1 ) 3.4 3.4 0.6
assign (resid 76 and name  HA )(resid  90  and name  HB2 ) 3.4 3.4 0.6
assign (resid 88 and name  HG2* )(resid  88  and name  HA ) 3.4 3.4 0.6
assign (resid 88 and name  HG1* )(resid  88  and name  HA ) 3.4 3.4 0.6
assign (resid 88 and name  HA )(resid  88  and name  HB ) 3.4 3.4 0.6
assign (resid 88 and name  HA )(resid  89  and name  HD2 ) 3.4 3.4 0.6
assign (resid 88 and name  HA )(resid  89  and name  HD1 ) 3.4 3.4 0.6
assign (resid 88 and name  HG2* )(resid  90  and name  HA ) 5.1 5.1 2.1
assign (resid 88 and name  HG1* )(resid  90  and name  HA ) 5.1 5.1 2.1
assign (resid 89 and name  HA )(resid  88  and name  HG1* ) 3.4 3.4 0.6
assign (resid 14 and name  HA )(resid  14  and name  HB ) 3.4 3.4 0.6
assign (resid 14 and name  HA )(resid  14  and name  HG1* ) 2.7 2.7 0.4
assign (resid 15 and name  HB )(resid  14  and name  HG1* ) 3.4 3.4 0.6
assign (resid 13 and name  HA )(resid  13  and name  HG2* ) 2.7 2.7 0.4
assign (resid 13 and name  HA )(resid  14  and name  HG1* ) 5.1 5.1 2.1
assign (resid 91 and name  HD* )(  resid  93  and name  HG1* or resid 93 and name HG2* ) 4.2 4.2 1.8 !w nu.21
assign (resid 61 and name  HD1* or  resid  99  and name  HD1* )( resid 91 and name HD* ) 3.4 3.4 0.6 !m nu.22
assign (resid 29 and name  HA )(  resid  29  and name  HG* or resid 29 and name HB2 ) 3.4 3.4 0.6 !m nu.200
assign (resid 29 and name  HA )(  resid  30  and name  HD1 or resid 30 and name HD2 ) 3.4 3.4 0.6 !m nu.203
assign (resid 100 and name  HA )(  resid  100  and name  HD* or resid 104 and name HD* ) 4.2 4.2 1.8 !w nu.206
assign (resid 100 and name  HA )(  resid  101  and name  HN or resid 103 and name HN ) 4.2 4.2 1.8 !w nu.207
assign (resid 55 and name  HA or  resid  52  and name  HA )( resid 55 and name HD* ) 4.2 4.2 1.8 !w nu.272
assign (resid 75 and name  HG1* or  resid  75  and name  HG2* )( resid 91 and name HE* ) 3.4 3.4 0.6 !m nu.297
assign (resid 61 and name  HD1* )(  resid  99  and name  HD1* or resid 91 and name HE* ) 3.4 3.4 0.6 !m nu.299
assign (resid 61 and name  HG2* )(  resid  99  and name  HG2* or resid 91 and name HD* ) 3.4 3.4 0.6 !m nu.304
assign (resid 85 and name  HD1* )(  resid  103  and name  HD1* or resid 103 and name HG2* ) 2.7 2.7 0.3 !s nu.336
assign (resid 86 and name  HE* )(  resid  57  and name  HD1* or resid 99 and name HG2* ) 3.4 3.4 0.6 !m nu.337
assign (resid 103 and name  HG2* or  resid  103  and name  HD1* )( resid 104 and name HD* ) 4.2 4.2 1.8 !w nu.344
assign (resid 25 and name  HG* )(  resid  22  and name  HN or resid 18 and name HN ) 3.4 3.4 0.9 !m nu.4
assign (resid 27 and name  HD1* or  resid  27  and name  HD2* )( resid 49 and name HG2* ) 3.4 3.4 0.6 !m nu.82
assign (resid 27 and name  HD1* or  resid  27  and name  HD2* )( resid 47 and name HG2* ) 2.7 2.7 0.4 !s nu.83
assign (resid 48 and name  HB1 )(  resid  28  and name  HG2* or resid 53 and name HG* ) 3.4 3.4 0.6 !m nu.107
assign (resid 28 and name  HG2* or  resid  53  and name  HG* )( resid 48 and name HB2 ) 3.4 3.4 0.6 !m nu.118
assign (resid 37 and name  HB* )(  resid  85  and name  HD1* or resid 85 and name HD2* ) 3.4 3.4 1.0  !m nu.187
assign (resid 35 and name  HG or  resid  39  and name  HG1 )( resid 35 and name HD1* ) 2.7 2.7 0.4 !s nu.206
assign (resid 38 and name  HD2* )(  resid  53  and name  HG1* or resid 53 and name HG2* ) 2.7 2.7 0.4 !s nu.237
assign (resid 38 and name  HD2* )(  resid  35  and name  HD1* or resid 41 and name HG2* ) 3.4 3.4 0.6 !m nu.239
assign (resid 30 and name  HB* or  resid  37  and name  HB* )( resid 38 and name HD2* ) 3.4 3.4 0.6 !m nu.240
assign (resid 37 and name  HD1* )(  resid  60  and name  HD* or resid 60 and name HE* ) 3.4 3.4 0.6 !m nu.286
assign (resid 37 and name  HD2* )(  resid  60  and name  HD* or resid 60 and name HE* ) 3.4 3.4 0.6 !m nu.310
assign (resid 37 and name  HD2* )(  resid  57  and name  HD1* or resid 57 and name HD2* ) 2.7 2.7 0.4 !s nu.317
assign (resid 60 and name  HD* or  resid  60  and name  HE* )( resid 82 and name HB1 ) 4.2 4.2 1.8 !w nu.386
assign (resid 60 and name  HD* or  resid  60  and name  HE* )( resid 82 and name HB2 ) 5.1 5.1 2.1 !vw nu.387
assign (resid 37 and name  HD1* )(  resid  82  and name  HA or resid 38 and name HA )  3.4 3.4 0.6 !m nu.389
assign (resid 37 and name  HD1* or  resid  38  and name  HD2* )( resid 41 and name HG1* ) 4.2 4.2 1.8 !w nu.391
assign (resid 37 and name  HD1* )(resid  57  and name  HD1* or resid 57 and name HD2* ) 2.7 2.7 0.4 !s nu.392

assign (resid 85 and name HD2* )(resid 37 and name  HD2* or resid  82  and name  HD2* ) 3.4 3.4 0.6 !m nu.395
assign (resid 34 and name  HG or  resid  37  and name  HB* )( resid 38 and name HD1* ) 3.4 3.4 0.6 !m nu.401
assign (resid 38 and name  HD1* )(  resid  56  and name  HA or resid 57 and name HA ) 3.4 3.4 0.6 !m nu.409
assign (resid 34 and name  HN or  resid  37  and name  HN )( resid 38 and name HD1* ) 5.1 5.1 2.1 !vw nu.414
assign (resid 38 and name  HD1* )(  resid  39  and name  HN or resid 57 and name HN ) 4.2 4.2 1.8 !w nu.418
assign (resid 34 and name  HN or  resid  37  and name  HN )( resid 38 and name HD2* ) 5.1 5.1 2.1 !vw nu.423
assign (resid 38 and name  HD1* )(  resid  53  and name  HG1* or resid 53 and name HG2* ) 3.4 3.4 0.6 !m nu.433
assign (resid 38 and name  HD2* )(  resid  53  and name  HG1* or resid 53 and name HG2* ) 3.4 3.4 0.6 !m nu.434
assign (resid 38 and name  HD1* )(  resid  43  and name  HB*  or resid 38 and name HB1 ) 4.2 4.2 1.8 !w nu.458
assign (resid 38 and name  HD1* )(  resid  43  and name  HB*  or resid 38 and name HB2 ) 3.4 3.4 0.6 !m nu.464
assign (resid 37 and name  HD1* or  resid  38  and name  HD2* )( resid 41 and name HG2* ) 4.2 4.2 1.8 !w nu.494
assign (resid 43 and name HB* )(resid 38 and name  HB1 or  resid  38  and name  HG ) 3.4 3.4 0.6 !m nu.528
assign (resid 21 and name  HB* )(  resid  24  and name  HN or resid 19 and name HN ) 5.1 5.1 2.1 !vw nu.567
assign (resid 18 and name  HA or  resid  19  and name  HA )( resid 19 and name HG2* ) 3.4 3.4 0.6 !m nu.604
assign (resid 20 and name  HG1 )(  resid  20  and name  HA or resid 19 and name HA ) 4.2 4.2 1.8 !w nu.662
assign (resid 74 and name  HD1* )(  resid  91  and name  HD* or resid 91 and name HE* ) 5.1 5.1 2.1 !vw nu.712
assign (resid 103 and name  HB )(  resid  103  and name  HG2* or resid 99 and name HG2* ) 3.4 3.4 0.6 !m nu.721
assign (resid 85 and name  HB1 )(  resid  85  and name  HD1* or resid 85 and name HD2* ) 3.4 3.4 0.6 !m nu.775
assign (resid 85 and name  HG )(  resid  85  and name  HD1* or resid 85 and name HD2* ) 2.7 2.7 0.4 !s nu.789
assign (resid 34 and name  HA or  resid  85  and name  HA )( resid 85 and name HD1* ) 3.4 3.4 0.6 !m nu.803
assign (resid 93 and name  HG1* )(  resid  75  and name  HG1* or resid 75 and name HG2* ) 4.2 4.2 1.8 !w nu.865
assign (resid 93 and name  HG1* )(  resid  99  and name  HG2* or resid 99 and name HD1* ) 4.2 4.2 1.8 !w nu.866
assign (resid 75 and name  HG1* or  resid  75  and name  HG2* )( resid 93 and name HG1* ) 2.7 2.7 0.4 !s nu.881
assign (resid 73 and name  HB1 )(  resid  93  and name  HG1* or resid 93 and name HG2* ) 3.4 3.4 0.6 !m nu.886
assign (resid 73 and name  HB2 )(  resid  93  and name  HG1* or resid 93 and name HG2* ) 3.4 3.4 0.6 !m nu.887
assign (resid 75 and name  HB )(  resid  93  and name  HG1* or resid 93 and name HG2* ) 5.1 5.1 2.1 !vw nu.909
assign (resid 74 and name  HG2* )(  resid  68  and name  HN or resid 69 and name HN ) 5.1 5.1 2.1 !vw nu.927
assign (resid 61 and name  HD1* )(  resid  75  and name  HG1* or resid 75 and name HG2* ) 2.7 2.7 0.4 !s nu.945
assign (resid 66 and name  HD1* or  resid  66  and name  HD2* )( resid 66 and name HB1 ) 3.4 3.4 0.6 !m nu.958
assign (resid 91 and name  HB1 or  resid  99  and name  HA )( resid 10 and name 2HE* ) 3.4 3.4 0.6 !m nu.982
assign (resid 60 and name  HD* or  resid  60  and name  HE* )( resid 64 and name HD1 ) 4.2 4.2 1.8 !w nu.1003
assign (resid 60 and name  HD* or  resid  60  and name  HE* )( resid 64 and name HD2 ) 4.2 4.2 1.8 !w nu.1004
assign (resid 93 and name  HB )(  resid  93  and name  HG1* or resid 93 and name HG2* ) 2.7 2.7 0.4 !s nu.1085
assign (resid 66 and name  HB1 )(  resid  75  and name  HG2 or resid 75 and name HG1* ) 4.2 4.2 1.8 !w nu.1100
assign (resid 66 and name  HB2* )(  resid  75  and name  HG1* or resid 75 and name HG2* ) 4.2 4.2 1.8 !w nu.1101
assign (resid 64 and name  HB1 )(  resid  65  and name  HN or resid 66 and name HN ) 5.1 5.1 2.1 !vw nu.1146
assign (resid 64 and name  HB1 )(  resid  66  and name  HD1* or resid 66 and name HD2* ) 3.4 3.4 0.6 !m nu.1149
assign (resid 64 and name  HB2* )(  resid  66  and name  HD1* or resid 66 and name HD2* ) 3.4 3.4 0.6 !m nu.1151
assign (resid 64 and name  HB2 )(  resid  65  and name  HN or resid 66 and name HN ) 5.1 5.1 2.1 !vw nu.1157
assign (resid 66 and name  HD1* or  resid  66  and name  HD2* )( resid 80 and name HB* ) 4.2 4.2 1.8 !w nu.1200
assign (resid 85 and name  HB1 )(  resid  85  and name  HD1* or resid 85 and name HD2* ) 5.1 5.1 2.1 !vw nu.1231
assign (resid 34 and name  HA or  resid  85  and name  HA )( resid 85 and name HD2* ) 3.4 3.4 0.6 !m nu.1240
assign (resid 34 and name  HD1* )(  resid  34  and name  HN or resid 37 and name HN ) 4.2 4.2 1.8 !w nu.1242
assign (resid 33 and name  HB1 )(  resid  33  and name  HD1* or resid 33 and name HD2* ) 2.7 2.7 0.4 !s nu.1250
assign (resid 33 and name  HB1 )(  resid  85  and name  HD1* or resid 85 and name HD2* ) 3.4 3.4 0.6 !m nu.1251
assign (resid 35 and name  HB1 )(  resid  35  and name  HD1* or resid 35 and name HD2* ) 3.4 3.4 0.6 !m nu.1256
assign (resid 33 and name  HD1* )(  resid  85  and name  HD1* or resid 85 and name HD2* ) 3.4 3.4 0.6 !m nu.1351
assign (resid 37 and name  HD1* or  resid  38  and name  HD2* )( resid 56 and name HB1 ) 4.2 4.2 1.8 !w nu.1366
assign (resid 103 and name  HG1* )(  resid  103  and name  HG2* or resid 103 and name HD1* ) 3.4 3.4 0.6 !m nu.1001

assign ( resid 28 and name HB
         )
       ( resid 28 and name HG2*
         or resid 53 and name HG1*
         or resid 53 and name HG2*
         ) 5.0 5.0 0.0 volume=0.111 

assign ( resid 28 and name HG1*
         )
       ( resid 104 and name HD*
         or resid 104 and name HE*
         or resid 104 and name HH
         ) 5.0 5.0 0.0 volume=0.150 

assign ( resid 28 and name HG1*
         )
       ( resid 48 and name HN
         or resid 108 and name HN
         or resid 109 and name HN
         ) 5.0 5.0 0.0 volume=0.111 

assign ( resid 28 and name HG1*
         )
       ( resid 28 and name HG2*
         or resid 53 and name HG1*
         or resid 53 and name HG2*
         ) 5.0 5.0 0.0 volume=0.150 
!assign (resid 39 and name  HG2 )(resid  82  and name  HN )  5.1 2.1 2.6 !vw nu. 227 9.893 23.491 1.338 vol 4.980e+02
assign (resid 100 and name  HA )(resid  100  and name  HB )  4.2 2.0 1.2 !nu212 2.830 60.191 3.571 volume 1.893e+04
assign (resid 100 and name  HA )(resid  100  and name  HB1 ) 2.7 0.7 0.3 !nu211 3.214 60.191 3.579 volume 8.190e+02
assign (resid 100 and name  HA )(resid  100  and name  HE* ) 2.7 0.7 1.2 !s nu205 6.520 60.191 3.573 volume 2.454e+03
assign (resid 100 and name  HA )(resid  100  and name  HE* ) 3.4 2.5 0.6 !s nu56 3.595 115.729 6.504 volume 7.090e+02
assign (resid 100 and name  HA )(resid  100  and name  HN )  4.2 2.0 1.2 !w nu208 8.661 60.191 3.582 volume 3.396e+04
assign (resid 100 and name  HA )(resid  103  and name  HB )  4.2 2.0 1.2 !w nu213 1.666 60.191 3.567 volume 7.080e+04
assign (resid 100 and name  HA )(resid  103  and name  HD1* ) 4.2 2.0 1.2 !w nu. 729 3.600 11.473 0.577 vol 4.812e+04
assign (resid 100 and name  HB1 )(resid  103  and name  HD1* ) 5.1 2.5 1.5 !vw nu. 731 3.201 11.473 0.576 vol 3.680e+02
assign (resid 100 and name  HD* )(resid  100  and name  HN )   2.7 0.7 0.3 !s nu341 8.659 129.370 7.097 volume 3.454e+03
assign (resid 100 and name  HD* )(resid  102  and name  HE* )  3.6 2.5 1.2 !s nu342 1.245 129.370 7.105 volume 6.120e+02
assign (resid 100 and name  HD* )(resid  103  and name  HD1* ) 5.1 2.5 1.5 !vw nu. 725 7.045 11.473 0.574 vol 6.270e+02
assign (resid 100 and name  HE* )(resid  103  and name  HD1* ) 4.2 2.0 1.2 !w nu. 726 6.512 11.473 0.579 vol 2.235e+04
assign (resid 101 and name  HG2* )(resid  101  and name  HA ) 2.7 0.7 0.4 !s nu. 1026 3.951 18.618 1.250 vol 7.080e+05
assign (resid 101 and name  HG2* )(resid  101  and name  HB ) 2.7 0.7 0.4 !s nu. 1027 4.312 18.618 1.248 vol 1.652e+06
assign (resid 101 and name  HG2* )(resid  101  and name  HN ) 3.4 1.2 0.6 !m nu. 1030 8.219 18.618 1.247 vol 7.601e+04
assign (resid 101 and name  HG2* )(resid  102  and name  HN ) 4.2 2.0 1.2 !w nu. 1029 7.616 18.618 1.246 vol 2.549e+04
assign (resid 102 and name  HE* )(resid  102  and name  HG1* ) 5.1 2.5 1.5 !vw nu. 998 1.230 26.413 0.706 vol 4.810e+02
assign (resid 102 and name  HE* )(resid  103  and name  HN ) 5.1 2.5 1.5 !vw nu. 1031 8.265 12.772 1.245 vol 4.650e+02
assign (resid 103 and name  HA )(resid  103  and name  HB ) 5.1 2.5 1.5 !vw nu. 722 3.444 34.533 1.679 vol 4.800e+02
assign (resid 103 and name  HA )(resid  103  and name  HD1* ) 3.4 1.2 0.6 !m nu218 0.597 62.789 3.402 volume 5.792e+05
assign (resid 103 and name  HA )(resid  103  and name  HD1* ) 4.2 2.0 1.2 !w nu. 730 3.428 11.473 0.576 vol 3.132e+04
assign (resid 103 and name  HA )(resid  103  and name  HG1* ) 4.2 2.0 1.2 !w nu. 988 3.411 26.413 0.709 vol 1.515e+03
assign (resid 103 and name  HA )(resid  103  and name  HG2* ) 3.4 1.2 0.6 !m nu. 743 3.428 15.370 0.600 vol 1.340e+05
assign (resid 103 and name  HA )(resid  103  and name  HN )   4.2 2.0 1.2 !w nu224 8.267 62.789 3.406 volume 1.194e+04
assign (resid 103 and name  HA )(resid  103  and name HG2*)   5.1  3.0 1.5 !vw  nu219 0.769 62.789 3.404 volume 9.039e+05
assign (resid 103 and name  HB )(resid   104  and name  HD* ) 2.7 0.7 0.3 !s nu343 1.708 130.020 7.064 volume 1.564e+03
assign (resid 103 and name  HB )(resid  100  and name  HA )   5.1 2.5 1.5 !vw nu. 723 3.606 34.533 1.675 vol 7.300e+02
assign (resid 103 and name  HB )(resid  103  and name  HD1* ) 3.4 1.2 0.6 !m nu. 720 0.607 34.533 1.670 vol 4.964e+05
assign (resid 103 and name  HB )(resid  103  and name  HN )   3.4 1.2 0.6 !m nu. 759 8.241 34.533 1.668 vol 7.413e+04
assign (resid 103 and name  HB )(resid  104  and name  HD* )  2.7 0.7 0.3 !s nu292 1.702 130.344 7.067 volume 6.020e+02
assign (resid 103 and name  HB )(resid  104  and name  HD* )  5.1 2.5 1.5 !vw nu. 760 7.087 34.533 1.672 vol 7.390e+02
assign (resid 103 and name  HB )(resid  104  and name  HN )   4.2 2.0 1.2 !w nu. 758 8.911 34.533 1.670 vol 2.054e+04
assign (resid 103 and name  HD1* )(resid  104  and name  HA ) 5.1 2.5 1.5 !vw nu. 1017 4.140 11.473 0.567 vol 3.230e+02
assign (resid 103 and name  HD1* )(resid  104  and name  HN ) 5.1 2.5 1.5 !vw nu. 737 8.945 11.473 0.567 vol 3.890e+02
assign (resid 103 and name  HG1* )(resid  103  and name  HD1* ) 2.7 0.7 0.4 !s nu. 735 1.703 11.473 0.577 vol 7.663e+05
assign (resid 103 and name  HG1* )(resid  103  and name  HN ) 5.1 2.5 1.5 !vw nu. 994 8.251 26.413 0.724 vol 4.960e+02
assign (resid 103 and name  HG1* )(resid  86  and name  HE* ) 5.1 2.5 1.5 !vw nu. 989 6.491 26.413 0.702 vol 7.080e+02
assign (resid 103 and name  HG2* )(resid  103  and name  HD1* ) 2.7 0.7 0.4 !s nu. 733 0.738 11.473 0.577 vol 1.982e+06
assign (resid 103 and name  HG2* )(resid  103  and name  HN ) 4.2 2.0 1.2 !w nu. 755 8.266 15.370 0.596 vol 4.660e+04
assign (resid 103 and name  HG2* )(resid  104  and name  HA ) 3.4 1.2 0.6 !m nu. 745 4.072 15.370 0.592 vol 4.420e+05
assign (resid 103 and name  HG2* )(resid  104  and name  HD* ) 3.4 1.2 0.6 !m nu. 751 7.071 15.370 0.593 vol 1.924e+05
assign (resid 103 and name  HG2* )(resid  104  and name  HD* ) 4.2 2.0 1.2 !w nu291 0.606 130.344 7.070 volume 1.454e+04
assign (resid 103 and name  HN )(resid  103  and name  HD1* ) 4.2 2.0 1.2 !w nu. 724 8.257 11.473 0.574 vol 2.878e+04
assign (resid 104 and name  HA )(resid  104  and name  HD* )  3.4 1.2 0.6 !m nu285 4.122 130.344 7.066 volume 3.057e+05
assign (resid 104 and name  HB* )(resid  104  and name  HD* ) 3.4 1.2 0.6 !m nu284 3.089 130.344 7.066 volume 4.261e+05
assign (resid 110 and name  HA )(resid  110  and name  HG1* ) 2.7 0.7 0.4 !s nu. 1018 4.176 18.618 0.984 vol 1.360e+06
assign (resid 110 and name  HA )(resid  110  and name  HG1* ) 2.7 0.7 0.4 !s nu. 1019 8.811 18.618 0.983 vol 1.245e+06
assign (resid 110 and name  HN )(resid  110  and name  HG1* ) 2.7 0.7 0.4 !s nu. 1020 8.485 18.618 0.983 vol 6.062e+05
assign (resid  8 and name  HA  )(resid   9  and name  HD* ) 2.7 2.0 0.8
assign (resid  8 and name  HG1*  )(resid   9  and name  HD* ) 4.0 2.0 1.0
assign (resid  8 and name  HG2*  )(resid   9  and name  HD* ) 4.0 2.0 1.0
assign (resid 12 and name  HA* )(resid  13  and name  HB* )   5.1 2.5 1.5 !vw nu. 1304 3.881 16.345 1.374 vol 7.630e+02
assign (resid 12 and name  HN )(resid  13  and name  HB* )    5.1 2.5 1.5 !vw nu. 1307 8.346 16.345 1.373 vol 5.560e+02
assign (resid 13 and name  HA )(resid  13  and name  HB* )    2.7 0.7 0.4 !s nu. 1305 4.327 16.345 1.375 vol 7.157e+05
assign (resid 13 and name  HB* )(resid  13  and name  HN )    3.4 1.2 0.6 !m nu. 1306 8.149 16.345 1.374 vol 1.659e+05
assign (resid 14 and name  HA )(resid  14  and name  HG1* )   3.4 1.2 0.6 !m nu. 1312 4.224 17.319 0.949 vol 1.329e+05
assign (resid 14 and name  HB )(resid  14  and name  HG1* )   2.7 0.7 0.4 !s nu. 1313 2.080 17.319 0.946 vol 1.215e+06
assign (resid 14 and name  HG1* )(resid  14  and name  HN )   3.4 1.2 0.6 !m nu. 1314 8.199 17.319 0.949 vol 4.355e+05
assign (resid 14 and name  HG1* )(resid  15  and name  HN )   4.2 2.0 1.2 !w nu. 1315 8.364 17.319 0.950 vol 2.049e+04
assign (resid 14 and name  HG1* )(resid  15  and name  HB ) 4.5 4.2 1.8
assign (resid 14 and name  HG2* )(resid  15  and name  HB ) 4.5 4.2 1.8
assign (resid 15 and name  HA )(resid  15  and name  HG2* ) 2.7 0.7 0.4 !s nu. 1309 4.443 18.618 1.216 vol 9.013e+05
assign (resid 15 and name  HG2* )(resid  15  and name  HN ) 4.2 2.0 1.2 !w nu. 1308 8.342 18.618 1.225 vol 6.069e+04
assign (resid 18 and name  HB1 )(resid  19  and name  HA )  2.7 2.7 0.8 !s nu178 1.985 54.020 4.308 volume 1.108e+06
assign (resid 18 and name  HE21 )(resid  19  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 608 7.433 13.746 0.724 vol 7.440e+02
assign (resid 18 and name  HE22 )(resid  19  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 607 7.034 13.746 0.722 vol 6.550e+02
assign (resid 18 and name  HG* )(resid  19  and name  HA ) 2.7 0.7 0.3 !s nu180 2.361 54.020 4.310 volume 1.331e+06
assign (resid 18 and name  HN )(resid  18  and name  HB1 ) 3.4 1.2 0.6 !m nu. 634 8.525 26.413 2.142 vol 1.306e+05
assign (resid 18 and name  HN )(resid  18  and name  HB2 ) 3.4 1.2 0.6 !m nu. 635 8.525 26.413 2.011 vol 1.570e+05
assign (resid 18 and name  HN )(resid  19  and name  HA )    3.4 3.4 0.8 !m nu170 8.514 54.020 4.307 volume 5.992e+05
assign (resid 19 and name  HA )(resid  19  and name  HB ) 4.2 2.0 1.2 !w nu. 646 4.304 35.182 1.715 vol 2.002e+04

assign (resid 19 and name  HA )(resid  20  and name  HD1 )  3.2 2.2 0.6 !m nu. 580 4.349 48.174 3.897 vol 5.980e+05
assign (resid 19 and name  HA )(resid  20  and name  HD2 )  3.2 2.2 0.8 !vw nu. 645 3.744 35.182 1.710 vol 5.310e+02
assign (resid 19 and name  HD1* )(resid  18  and name  HG* ) 5.1 2.5 1.5 !vw nu. 586 2.388 48.174 0.269 vol 5.010e+02
assign (resid 19 and name  HG1* )(resid  19  and name  HG2* ) 3.4 1.2 0.6 !m nu. 1341 1.083 13.746 0.724 vol 9.677e+04
assign (resid 19 and name  HG11 )(resid  19  and name  HD1* ) 3.4 1.2 0.6 !m nu. 620 0.277 23.165 1.095 vol 8.352e+04
assign (resid 19 and name  HG2* )(resid  18  and name  HB1 ) 3.4 1.2 0.6 !m nu. 600 2.152 13.746 0.726 vol 4.248e+05
assign (resid 19 and name  HG2* )(resid  18  and name  HB2 ) 3.4 1.2 0.6 !m nu. 599 1.997 13.746 0.725 vol 3.232e+05
assign (resid 19 and name  HG2* )(resid  18  and name  HG* ) 3.4 1.2 0.6 !m nu. 601 2.409 13.746 0.727 vol 4.541e+05
assign (resid 19 and name  HG2* )(resid  20  and name  HD1 ) 3.4 1.2 0.6 !m nu. 603 3.901 13.746 0.726 vol 8.795e+04
assign (resid 19 and name  HG2* )(resid  20  and name  HD1 ) 4.2 2.0 1.2 !w nu. 579 0.744 48.174 3.897 vol 1.490e+04
assign (resid 19 and name  HG2* )(resid  20  and name  HD2 ) 4.2 2.0 1.2 !w nu. 578 0.724 48.174 3.728 vol 3.342e+04
assign (resid 19 and name  HG2* )(resid  20  and name  HD2* ) 3.4 1.2 0.6 !m nu. 602 3.721 13.746 0.729 vol 1.605e+05
assign (resid 19 and name  HG2* )(resid  24  and name  HN ) 4.2 2.0 1.2 !w nu. 609 7.954 13.746 0.723 vol 2.880e+03
assign (resid 19 and name  HN )(resid  19  and name  HA )   2.7 0.7 0.3 !s nu173 8.087 54.020 4.305 volume 9.716e+03
assign (resid 20 and name  HB* )(resid  21  and name  HB* ) 5.1 2.5 1.5 !vw nu. 1340 1.491 32.909 2.427 vol 5.780e+02
assign (resid 20 and name  HB1 )(resid  21  and name  HB* ) 4.2 2.0 1.2 !w nu. 563 2.403 15.695 1.474 vol 3.892e+04
assign (resid 20 and name  HB2 )(resid  21  and name  HB* ) 4.2 2.0 1.2 !w nu. 562 2.239 15.695 1.475 vol 1.571e+03
assign (resid 21 and name  HA )(resid  21  and name  HB* ) 2.7 0.7 0.4 !s nu. 564 4.051 15.695 1.475 vol 9.647e+05
assign (resid 21 and name  HA )(resid  22  and name  HA  ) 4.5 2.7 0.6
assign (resid 21 and name  HB* )(resid  20  and name  HA ) 4.2 2.0 1.2 !w nu. 566 4.429 15.695 1.476 vol 2.829e+04
assign (resid 21 and name  HB* )(resid  22  and name  HA ) 4.2 2.0 1.2 !w nu. 565 4.228 15.695 1.471 vol 6.766e+04
assign (resid 21 and name  HB* )(resid  22  and name  HN ) 4.2 2.0 1.2 !w nu. 568 8.622 15.695 1.472 vol 3.122e+04
assign (resid 25 and name  HB1 )(resid  25  and name  HN ) 5.1 2.5 1.5 !vw nu. 3 7.600 27.063 2.155 vol 6.740e+02
assign (resid 25 and name  HB1 )(resid  26  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 20 2.024 18.944 1.373 vol 7.450e+02
assign (resid 25 and name  HB2 )(resid  25  and name  HN ) 4.2 2.0 1.2 !w nu. 2 7.600 27.063 2.023 vol 1.265e+04
assign (resid 25 and name  HG* )(resid  28  and name  HG1* ) 3.4 3.4 0.9 !m nu. 43 0.933 31.285 2.377 vol 2.623e+05
assign (resid 25 and name  HG* )(resid  49  and name  HG2* ) 3.4 3.4 0.9 !m nu. 170 2.358 19.593 1.324 vol 1.427e+05

assign (resid 26 and name  HA )(resid  26  and name  HB )   3.4 1.2 0.6 !m nu184 4.158 62.139 3.991 volume 2.840e+05
assign (resid 26 and name  HA )(resid  26  and name  HG2* ) 3.4 1.2 0.6 !m nu. 17 4.001 18.944 1.373 vol 5.030e+05
assign (resid 26 and name  HA )(resid  26  and name  HN ) 4.2 2.0 1.2 !w nu33 7.587 62.139 3.995 volume 5.648e+04
assign (resid 26 and name  HA )(resid  26  and name HG2* )  5.1 2.5 1.5 !vw  nu183 1.350 62.139 3.985 volume 3.852e+05
assign (resid 26 and name  HA )(resid  27  and name  HB*  ) 4.2 2.0 1.2 !nu189 1.672 62.139 3.990 volume 3.960e+04
assign (resid 26 and name  HA )(resid  27  and name  HD1* ) 4.2 2.0 1.2 !w nu187 0.872 62.139 3.988 volume 3.974e+04
assign (resid 26 and name  HA )(resid  27  and name  HN ) 2.7 2.7 0.7 !s nu34 8.541 62.139 3.994 volume 1.124e+06
assign (resid 26 and name  HA )(resid  28  and name  HG1* ) 3.8 2.2 0.8
assign (resid 26 and name  HB )(resid  26  and name  HG2* ) 2.7 0.7 0.4 !s nu. 16 4.186 18.944 1.374 vol 7.438e+05
assign (resid 26 and name  HB )(resid  27  and name  HD1* ) 4.2 2.0 1.2 !w nu194 0.860 67.661 4.174 volume 5.900e+04
assign (resid 26 and name  HB )(resid  50  and name  HB*  ) 3.2 2.2 0.6
assign (resid 26 and name  HB )(resid  50  and name  HG*  ) 3.5 2.2 0.6
assign (resid 26 and name  HG2* )(resid  27  and name  HN ) 3.4 1.2 0.6 !m nu. 12 8.548 18.944 1.374 vol 3.166e+05
assign (resid 26 and name  HG2* )(resid  28  and name  HA ) 5.0 5.0 1.0 !vw nu. 25 5.105 18.944 1.373 vol 5.320e+02
assign (resid 26 and name  HG2* )(resid  28  and name  HG1* ) 3.4 1.2 0.6 !m nu. 22 0.963 18.944 1.374 vol 5.338e+05
assign (resid 26 and name  HG2* )(resid  28  and name  HG1* ) 3.4 1.2 0.6 !m nu. 34 1.370 19.268 0.938 vol 5.503e+05
assign (resid 26 and name  HG2* )(resid  28  and name  HG2* ) 4.2 2.0 1.2 !w nu. 21 0.711 18.944 1.372 vol 1.704e+03
assign (resid 26 and name  HG2* )(resid  29  and name  HN ) 5.1 2.5 1.5 !vw nu. 14 9.267 18.944 1.356 vol 4.940e+02
assign (resid 26 and name  HG2* )(resid  48  and name  HN ) 5.1 2.5 1.5 !vw nu. 13 8.770 18.944 1.368 vol 4.860e+02
assign (resid 26 and name  HG2* )(resid  50  and name  HG1 )  4.2 5.1 2.1
assign (resid 26 and name  HG2* )(resid  50  and name  HG2 )  5.0 2.1 2.1

assign (resid 26 and name  HG2* )(resid  104  and name  HE* ) 4.0 2.1 1.0
assign (resid 26 and name  HN )(resid  26  and name  HG2* ) 4.2 2.0 1.2 !w nu. 11 7.585 18.944 1.373 vol 1.562e+04
assign (resid 27 and name  HA )(resid  49  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 181 5.087 19.593 1.321 vol 5.670e+02
assign (resid 27 and name  HA )(resid  49  and name  HA  )  2.7 1.0 0.4
assign (resid 27 and name  HB1 )(resid  27  and name  HD* ) 2.7 0.7 0.4 !s nu. 44 0.870 40.055 1.703 vol 1.253e+06
assign (resid 27 and name  HB1 )(resid  27  and name  HN ) 3.4 1.2 0.6 !m nu. 52 8.539 40.055 1.705 vol 3.212e+05
assign (resid 27 and name  HB1 )(resid  28  and name  HN ) 4.2 2.0 1.2 !w nu. 53 9.877 40.055 1.704 vol 1.615e+03
assign (resid 27 and name  HB1 )(resid  49  and name  HA ) 4.2 2.0 1.2
assign (resid 27 and name  HB2 )(resid  27  and name  HD* ) 2.7 0.7 0.4 !s nu. 45 0.863 40.055 1.451 vol 8.413e+05
assign (resid 27 and name  HB2 )(resid  27  and name  HN ) 3.4 1.2 0.6 !m nu. 54 8.546 40.055 1.454 vol 1.027e+05
assign (resid 27 and name  HB2 )(resid  28  and name  HN ) 4.2 2.0 1.2 !w nu. 55 9.857 40.055 1.453 vol 5.253e+04
assign (resid 27 and name  HB2 )(resid  47  and name  HG2* ) 4.2 2.0 1.2 !w nu. 668 1.131 40.054 1.450 vol 1.302e+04
assign (resid 27 and name  HB2 )(resid  49  and name  HA  ) 4.2 2.0 1.2
assign (resid 27 and name  HD1* )(resid  47  and name  HB ) 3.8 3.4 0.6 !m nu2 0.867 68.960 3.915 volume 2.325e+05
assign (resid 27 and name  HD1* )(resid  28  and name  HN ) 3.4 1.2 0.6 !m nu. 77 9.830 21.867 0.891 vol 7.526e+04
assign (resid 27 and name  HD1* )(resid  47  and name  HB ) 2.7 0.7 0.4 !s nu. 67 3.956 21.867 0.888 vol 6.524e+05
assign (resid 27 and name  HD1* )(resid  48  and name  HN ) 4.2 2.0 1.2 !w nu. 76 8.738 21.867 0.889 vol 4.931e+04
assign (resid 27 and name  HD1* )(resid  49  and name  HA ) 3.0 1.2 1.0 !w nu. 63 5.384 21.867 0.886 vol 1.655e+03
assign (resid 27 and name  HD1* )(resid  49  and name  HG2* ) 2.7 0.7 0.4 !s nu. 86 1.325 21.867 0.888 vol 7.443e+05
assign (resid 27 and name  HD1* )(resid  49  and name  HB )   4.0 2.7 1.0
assign (resid 27 and name  HD2* )(resid  28  and name  HN )   3.4 1.2 0.6 !m nu. 78 9.848 21.867 0.834 vol 9.520e+04
assign (resid 27 and name  HD2* )(resid  47  and name  HG2* ) 4.2 2.0 1.2 !w nu. 84 1.135 21.867 0.832 vol 4.122e+04
assign (resid 27 and name  HD2* )(resid  49  and name  HA )   3.0 1.0 1.0 !w nu. 64 5.397 21.867 0.833 vol 3.663e+04
assign (resid 27 and name  HD2* )(resid  49  and name  HG2* ) 2.7 0.7 0.4 !s nu. 87 1.330 21.867 0.837 vol 8.563e+05
assign (resid 27 and name  HD2* )(resid  49  and name  HN )   5.1 2.5 1.5 !vw nu. 80 9.117 21.867 0.888 vol 4.430e+02
assign (resid 27 and name  HD2* )(resid  49  and name  HB )   4.0 2.7 1.2
assign (resid 28 and name  HA   )(resid  28  and name  HG1* ) 3.4 1.2 0.6 !m nu. 32 5.108 19.268 0.934 vol 4.413e+05
assign (resid 28 and name  HA   )(resid  29  and name  HB* )  4.5 2.0 1.0 !vw nu. 812 5.090 29.661 1.960 vol 7.910e+02
assign (resid 28 and name  HA   )(resid  109  and name  HA )  3.2 2.0 0.6

assign (resid 28 and name  HG1* )(resid  27  and name  HA ) 3.4 1.2 0.6 !m nu. 33 4.892 19.268 0.932 vol 1.136e+05
assign (resid 28 and name  HG1* )(resid  29  and name  HA ) 3.8 3.4 1.0
assign (resid 28 and name  HG1* )(resid  29  and name  HN ) 3.4 1.2 0.6 !m nu. 26 9.256 19.268 0.937 vol 1.566e+05
assign (resid 28 and name  HG1* )(resid  49  and name  HA ) 3.4 1.2 0.6 !m nu32 0.941 58.242 5.380 volume 1.071e+05
assign (resid 28 and name  HG1* )(resid  50  and name  HG1 )  3.2 1.4 0.6
assign (resid 28 and name  HG1* )(resid  50  and name  HG2 )  3.2 1.4 0.6
assign (resid 28 and name  HG1* )(resid  104  and name  HD* ) 3.4 1.4 0.8 


assign (resid 28 and name  HG2* )(resid  28  and name  HA ) 3.4 1.2 0.6 !m nu. 96 5.111 15.371 0.731 vol 1.146e+05
assign (resid 28 and name  HG2* )(resid  28  and name  HN ) 3.4 1.2 0.6 !m nu. 91 9.818 15.371 0.731 vol 3.345e+05
assign (resid 28 and name  HG2* )(resid  29  and name  HN ) 4.2 2.0 1.2 !w nu. 92 9.257 15.371 0.726 vol 1.614e+03
assign (resid 28 and name  HG2* )(resid  30  and name  HD1 ) 3.4 1.2 0.6 !m nu. 593 4.119 15.370 0.731 vol 1.342e+05
assign (resid 28 and name  HG2* )(resid  30  and name  HD2 ) 3.4 1.2 0.6 !m nu. 271 4.003 15.370 0.734 vol 1.402e+05
assign (resid 28 and name  HG2* )(resid  30  and name  HD2 ) 5.1 2.5 1.5 !vw nu. 268 0.758 48.174 3.993 vol 5.570e+02
assign (resid 28 and name  HG2* )(resid  48  and name  HB1 ) 4.2 2.0 1.2 !w nu. 125 3.582 15.371 0.730 vol 6.979e+04
assign (resid 28 and name  HG2* )(resid  48  and name  HN ) 3.4 1.2 0.6 !m nu. 93 8.749 15.371 0.729 vol 1.348e+05
assign (resid 28 and name  HG2* )(resid  49  and name  HA ) 4.2 2.0 1.2 !w nu. 95 5.372 15.371 0.727 vol 2.666e+03
assign (resid 28 and name  HG2* )(resid  49  and name  HA ) 4.2 2.0 1.2 !w nu31 0.720 58.242 5.382 volume 7.126e+04
assign (resid 28 and name  HN )(resid  28  and name  HG1* ) 3.4 1.2 0.6 !m nu. 27 9.839 19.268 0.931 vol 8.980e+04
assign (resid 28 and name  HN )(resid  49  and name  HA )  2.9 2.9 0.8 !s nu45 9.844 58.242 5.381 volume 3.724e+03
assign (resid 28 and name  HN )(resid  49  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 823 9.815 19.593 1.320 vol 4.660e+02


assign (resid 29 and name  HA )(resid  28  and name  HG2* ) 3.8 3.4 0.8
assign (resid 29 and name  HA )(resid  29  and name  HB* )  3.4 1.2 0.6 !nu201 1.968 49.798 5.325 volume 1.808e+05
assign (resid 29 and name  HA )(resid  29  and name  HN )   3.4 1.2 0.6 !m nu198 9.229 49.798 5.324 volume 1.898e+05
assign (resid 29 and name  HA )(resid  29  and name  HN )  4.2 2.0 1.2 !w nu4 9.261 49.148 5.331 volume 2.637e+04

assign (resid 29 and name  HA )(resid  30  and name  HD1 ) 2.9 3.4 0.7 !m nu11 4.050 49.148 5.322 volume 4.574e+05
assign (resid 29 and name  HA )(resid  30  and name  HD2 ) 2.9 3.4 0.7 !m nu. 101 5.336 48.174 4.006 vol 1.157e+05
assign (resid 29 and name  HA )(resid  47  and name  HA  ) 3.4 2.4 0.6
assign (resid 29 and name  HA )(resid  47  and name  HG2* ) 3.4 1.4 0.8 !m nu. 106 5.348 19.268 1.133 vol 1.014e+05
assign (resid 29 and name  HA )(resid  48  and name  HD* )  4.5 2.7 0.6 !s nu326 5.353 129.045 6.859 volume 3.660e+02
assign (resid 29 and name  HB1 )(resid  29  and name  HA ) 3.4 1.2 0.6 !m nu. 157 5.342 29.662 1.962 vol 9.004e+04
assign (resid 29 and name  HB1 )(resid  29  and name  HN ) 4.2 2.0 1.2 !w nu. 156 9.256 29.662 1.965 vol 3.022e+04
assign (resid 29 and name  HB1 )(resid  47  and name  HG2* ) 3.4 1.2 0.6 !m nu. 165 1.975 19.268 1.125 vol 8.469e+04
assign (resid 29 and name  HB2 )(resid  28  and name  HA ) 5.1 2.5 1.5 !vw nu. 164 5.106 29.662 1.619 vol 4.830e+02
assign (resid 29 and name  HB2 )(resid  29  and name  HA ) 4.2 2.0 1.2 !w nu. 154 5.350 29.662 1.624 vol 3.941e+04
assign (resid 29 and name  HB2 )(resid  29  and name  HN ) 4.2 2.0 1.2 !w nu. 155 9.251 29.662 1.624 vol 2.801e+04
assign (resid 29 and name  HB2 )(resid  47  and name  HB ) 4.2 2.0 1.2 !w nu43 1.652 69.285 3.916 volume 5.564e+04
assign (resid 29 and name  HB2 )(resid  47  and name  HB ) 5.1 2.5 1.5 !vw nu. 162 3.920 29.662 1.616 vol 4.650e+02
assign (resid 29 and name  HB2 )(resid  47  and name  HG2* ) 3.4 1.2 0.6 !m nu. 166 1.652 19.268 1.129 vol 5.129e+05
assign (resid 29 and name  HB2 )(resid  47  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 159 1.125 29.662 1.627 vol 6.240e+02
assign (resid 29 and name  HB* )(resid  109  and name  HA )  5.0 3.0 1.0
assign (resid 29 and name  HD1 )(resid  29  and name  HA ) 5.1 2.5 1.5 !vw nu. 686 5.344 40.379 3.250 vol 5.630e+02
assign (resid 29 and name  HD2 )(resid  29  and name  HA ) 5.1 2.5 1.5 !vw nu. 687 5.344 40.379 3.126 vol 5.300e+02

assign (resid 29 and name  HG* )(resid  27  and name  HN )  3.7 1.6 1.6 !m nu. 676 8.547 24.789 1.622 vol 7.947e+04
assign (resid 29 and name  HG* )(resid  28  and name  HN )  5.1 2.5 1.5 !vw nu. 677 9.839 24.789 1.619 vol 5.800e+02
assign (resid 29 and name  HG* )(resid  29  and name  HD* ) 2.7 0.7 0.4 !s nu. 168 3.217 24.790 1.640 vol 6.405e+05
assign (resid 29 and name  HG* )(resid  29  and name  HN )  5.1 2.5 1.5 !vw nu. 680 9.249 24.789 1.637 vol 7.150e+02
assign (resid 29 and name  HG* )(resid  30  and name  HD* ) 3.4 1.2 0.6 !m nu. 270 3.999 24.789 1.630 vol 2.572e+05
assign (resid 30 and name  HB1 )(resid  30  and name  HD1 ) 3.4 1.2 0.6 !m nu. 103 1.454 48.174 4.123 vol 9.236e+04
assign (resid 30 and name  HB2 )(resid  30  and name  HD1 ) 3.4 1.2 0.6 !m nu. 688 1.977 48.174 4.129 vol 1.075e+05
assign (resid 30 and name  HD1 )(resid  29  and name  HA )  3.4 1.2 0.6 !m nu. 100 5.336 48.174 4.119 vol 2.422e+05
assign (resid 30 and name  HD1 )(resid  35  and name  HD1* ) 3.4 1.2 0.6 !m nu. 210 4.109 20.568 1.131 vol 1.011e+05
assign (resid 30 and name  HD1 )(resid  48  and name  HD* ) 4.2 2.0 1.2 !w nu233 4.116 129.045 6.870 volume 3.976e+04
assign (resid 30 and name  HD1 )(resid  48  and name  HD* ) 5.1 2.5 1.5 !vw nu. 263 6.877 48.174 4.120 vol 6.590e+02
assign (resid 30 and name  HD1 )(resid  48  and name  HE* ) 4.2 2.0 1.2 !w nu58 4.092 115.729 6.500 volume 1.012e+04
assign (resid 30 and name  HD1 )(resid  48  and name  HE* ) 5.1 2.5 1.5 !vw nu. 266 6.533 48.174 4.122 vol 4.960e+02
assign (resid 30 and name  HD1* )(resid  35  and name  HD1* ) 4.2 2.0 1.2 !w nu. 269 1.116 48.174 4.123 vol 1.638e+04
assign (resid 30 and name  HD2 )(resid  48  and name  HD* ) 4.2 2.0 1.2 !w nu327 4.014 129.045 6.871 volume 1.069e+04
assign (resid 30 and name  HD2 )(resid  48  and name  HE* ) 4.2 2.0 1.2 !w nu57 4.013 115.729 6.501 volume 1.350e+04
assign (resid 30 and name  HD2 )(resid  48  and name  HE* ) 5.1 2.5 1.5 !vw nu. 265 6.521 48.174 4.010 vol 4.770e+02
assign (resid 30 and name  HD2* )(resid  48  and name  HD* ) 4.2 2.0 1.2 !w nu. 264 6.880 48.174 4.009 vol 9.749e+03
assign (resid 32 and name  HA )(resid  35  and name  HB1 )   4.2 2.0 1.2 !w nu. 274 4.089 38.755 1.900 vol 1.670e+04
assign (resid 32 and name  HA )(resid  35  and name  HB2 ) 4.2 2.0 1.2 !w nu. 277 4.095 38.755 1.364 vol 5.660e+04
assign (resid 33 and name  HA )(resid  35  and name  HD2* ) 3.4 1.2 0.6 !m nu. 250 4.108 22.191 1.028 vol 9.250e+04
assign (resid 33 and name  HA )(resid  84  and name  HB1 ) 3.2 3.2 0.6 !w nu. 1210 4.213 37.131 2.934 vol 3.071e+04
assign (resid 33 and name  HA )(resid  84  and name  HB2 ) 3.2 3.2 0.6 !w nu. 1214 4.251 37.131 2.688 vol 1.610e+04

assign (resid 33 and name  HB1 )(resid  33  and name  HA ) 3.4 1.2 0.6 !m nu. 1228 4.207 38.755 1.746 vol 2.251e+05
assign (resid 33 and name  HB1 )(resid  33  and name  HN ) 3.4 1.2 0.6 !m nu. 1227 8.954 38.755 1.752 vol 1.492e+05
assign (resid 33 and name  HB2 )(resid  33  and name  HN ) 4.2 2.0 1.2 !w nu. 1229 8.937 38.755 1.648 vol 6.549e+04
assign (resid 33 and name  HD1* )(resid  33  and name  HA ) 3.4 1.2 0.6 !m nu. 1350 4.196 21.541 0.939 vol 5.190e+05
assign (resid 33 and name  HD1* )(resid  33  and name  HN ) 4.2 2.0 1.2 !w nu. 1337 8.935 21.541 0.938 vol 3.432e+03
assign (resid 33 and name  HD1* )(resid  84  and name  HB* ) 3.4 1.2 0.6
assign (resid 33 and name  HD2* )(resid  84  and name  HB* ) 3.4 1.2 0.6
assign (resid 33 and name  HG )(resid  33  and name  HN )  4.2 2.0 1.2 !w nu. 1348 8.945 24.140 1.651 vol 2.960e+04
assign (resid 34 and name  HA )(resid  35  and name  HA )  4.2 2.0 1.2 !w nu77 4.041 54.994 3.806 volume 1.262e+04
assign (resid 34 and name  HA )(resid  38  and name  HD2* ) 5.1 2.5 1.5 !vw nu. 426 4.073 22.840 0.237 vol 7.730e+02
assign (resid 34 and name  HB* )(resid  33  and name  HN ) 4.2 2.0 1.2 !w nu. 184 8.947 38.756 1.502 vol 4.034e+04
assign (resid 34 and name  HB* )(resid  34  and name  HA ) 3.4 1.2 0.6 !m nu. 191 4.176 38.756 1.502 vol 3.781e+05
assign (resid 34 and name  HB* )(resid  34  and name  HN ) 3.4 1.2 0.6 !m nu. 182 7.359 38.756 1.501 vol 1.280e+05
assign (resid 34 and name  HB* )(resid  38  and name  HN ) 4.2 2.0 1.2 !w nu. 183 8.227 38.756 1.485 vol 2.578e+03
assign (resid 34 and name  HD* )(resid  37  and name  HB* ) 2.9 2.7 0.6 !s nu. 188 0.868 38.756 1.502 vol 1.285e+06
assign (resid 34 and name  HG* )(resid  34  and name  HB* ) 2.7 0.7 0.4 !s nu. 193 1.708 38.756 1.503 vol 1.924e+06
assign (resid 34 and name  HN )(resid  35  and name  HA )  3.7 2.5 0.8 !s nu66 7.376 54.994 3.815 volume 7.486e+03
assign (resid 34 and name  HN )(resid  35  and name  HD1* ) 4.2 2.0 1.2 !w nu. 215 7.396 20.568 1.126 vol 3.264e+03
assign (resid 35 and name  HA )(resid  35  and name  HB2 )  3.4 1.2 0.6 !m nu. 278 3.827 38.755 1.373 vol 1.020e+05
assign (resid 35 and name  HA )(resid  35  and name  HD1* ) 2.7 2.7 1.4 !s nu. 209 3.839 20.568 1.134 vol 6.155e+05
assign (resid 35 and name  HA )(resid  35  and name  HD2* ) 3.4 1.2 0.6 !m nu. 259 3.847 22.191 1.029 vol 1.015e+05
assign (resid 35 and name  HA )(resid  35  and name  HG )  4.2 2.0 1.2 !w nu. 1255 3.863 24.464 1.450 vol 1.392e+04
assign (resid 35 and name  HA )(resid  35  and name  HN )  4.2 2.0 1.2 !w nu68 8.640 54.994 3.816 volume 1.492e+04
assign (resid 35 and name  HA )(resid  38  and name  HB1 ) 3.4 1.2 0.6 !m nu83 1.697 54.994 3.812 volume 1.300e+05
assign (resid 35 and name  HA )(resid  38  and name  HB1 ) 5.1 2.5 1.5 !vw nu. 462 3.838 36.806 1.692 vol 6.550e+02
assign (resid 35 and name  HA )(resid  38  and name  HB2 ) 5.1 2.5 1.5 !vw nu. 469 3.854 36.806 0.972 vol 5.360e+02
assign (resid 35 and name  HA )(resid  38  and name  HD1* ) 3.7 1.5 0.8 !s nu70 0.589 54.994 3.813 volume 6.790e+02
assign (resid 35 and name  HA )(resid  38  and name  HD2* ) 3.4 1.2 0.6 !m nu. 425 3.846 22.840 0.237 vol 9.774e+04
assign (resid 35 and name  HA )(resid  38  and name  HD2* ) 4.2 2.0 1.2 !w nu69 0.222 54.994 3.813 volume 9.818e+04
assign (resid 35 and name  HA )(resid  38  and name  HN )  2.7 0.7 0.3 !s nu67 8.213 54.994 3.817 volume 3.185e+03
assign (resid 35 and name  HA )(resid  48  and name  HE* ) 2.7 0.7 0.7 !s nu65 6.495 54.994 3.817 volume 3.603e+03
assign (resid 35 and name  HB1 )(resid  35  and name  HD1* ) 2.7 0.7 0.4 !s nu. 207 1.918 20.568 1.133 vol 6.766e+05
assign (resid 35 and name  HB1 )(resid  35  and name  HD2* ) 2.7 0.7 0.4 !s nu. 257 1.904 22.191 1.029 vol 6.229e+05
assign (resid 35 and name  HB1 )(resid  36  and name  HN ) 4.2 2.0 1.2 !w nu. 201 7.957 38.756 1.910 vol 8.660e+03
assign (resid 35 and name  HB2 )(resid  35  and name  HB1 ) 3.4 1.2 0.6 !m nu. 1257 1.377 38.755 1.911 vol 5.477e+05
assign (resid 35 and name  HB2 )(resid  35  and name  HD1* ) 3.4 1.2 0.6 !m nu. 219 1.401 20.568 1.134 vol 2.687e+05
assign (resid 35 and name  HB2 )(resid  36  and name  HN ) 4.2 2.0 1.2 !w nu. 275 7.962 38.755 1.381 vol 2.642e+03
assign (resid 35 and name  HD1* )(resid  35  and name  HN ) 4.2 2.0 1.2 !w nu. 217 8.642 20.568 1.130 vol 1.471e+04
assign (resid 35 and name  HD1* )(resid  36  and name  HN ) 5.1 2.5 1.5 !vw nu. 216 7.956 20.568 1.135 vol 6.730e+02
assign (resid 35 and name  HD1* )(resid  38  and name  HD2* ) 3.4 1.2 0.6 !m nu. 203 0.232 20.568 1.135 vol 1.150e+05
assign (resid 35 and name  HD1* )(resid  39  and name  HD* ) 3.4 1.2 0.6 !s nu. 220 1.102 26.414 1.616 vol 6.321e+05
assign (resid 35 and name  HD1* )(resid  39  and name  HE* ) 3.4 1.2 0.6 !m nu. 1252 1.084 39.729 2.800 vol 4.495e+05
assign (resid 35 and name  HD1* )(resid  39  and name  HE* ) 3.4 1.2 0.6 !m nu. 208 2.797 20.568 1.133 vol 2.885e+05
assign (resid 35 and name  HD1* )(resid  39  and name  HG1 ) 3.4 1.2 0.6 !m nu. 205 1.347 20.568 1.132 vol 4.555e+05
assign (resid 35 and name  HD1* )(resid  39  and name  HG2 ) 4.2 2.0 1.2 !w nu. 234 1.139 23.491 1.322 vol 4.525e+03
assign (resid 35 and name  HD1* )(resid  39  and name  HN ) 5.1 2.5 1.5 !vw nu. 218 8.867 20.568 1.133 vol 7.000e+02
assign (resid 35 and name  HD1* )(resid  43  and name  HB* ) 4.2 4.2 1.0 !w nu. 204 0.581 20.568 1.133 vol 2.332e+04
assign (resid 35 and name  HD1* )(resid  48  and name  HD* ) 4.2 2.0 1.2 !w nu235 1.102 129.045 6.883 volume 2.022e+04
assign (resid 35 and name  HD1* )(resid  48  and name  HD* ) 5.1 2.5 1.5 !vw nu. 214 6.857 20.568 1.129 vol 6.690e+02
assign (resid 35 and name  HD1* )(resid  48  and name  HE* ) 3.4 1.2 0.6 !m nu. 213 6.516 20.568 1.133 vol 2.770e+05
assign (resid 35 and name  HD1* )(resid  48  and name  HE* ) 3.4 1.2 0.6 !m nu50 1.101 115.729 6.499 volume 4.030e+05
assign (resid 35 and name  HD1* )(resid  49  and name  HA ) 5.1 2.5 1.5 !vw nu. 212 5.305 20.568 1.138 vol 5.600e+02
assign (resid 35 and name  HD2* )(resid  35  and name  HB2 ) 2.7 0.7 0.4 !s nu. 256 1.599 22.191 1.028 vol 1.144e+06
assign (resid 35 and name  HD2* )(resid  37  and name  HD1* ) 5.1 2.5 1.5 !vw nu. 252 0.272 22.191 1.028 vol 4.770e+02
assign (resid 35 and name  HD2* )(resid  39  and name  HE* ) 3.4 1.2 0.6 !m nu. 1253 1.037 39.729 2.802 vol 3.024e+05
assign (resid 35 and name  HD2* )(resid  39  and name  HE* ) 3.4 1.2 0.6 !m nu. 258 2.795 22.191 1.031 vol 1.702e+05
assign (resid 35 and name  HD2* )(resid  40  and name  HN ) 5.1 2.5 1.5 !vw nu. 247 7.928 22.191 1.023 vol 5.560e+02
assign (resid 35 and name  HD2* )(resid  48  and name  HE* ) 3.4 1.2 0.6 !m nu227 1.032 115.729 6.498 volume 2.052e+05
assign (resid 35 and name  HD2* )(resid  48  and name  HE* ) 5.1 2.5 1.5 !vw nu. 248 6.503 22.191 1.025 vol 5.950e+02
assign (resid 35 and name  HG )(resid  35  and name  HB1 ) 2.7 0.7 0.4 !s nu. 1369 1.925 24.464 1.450 vol 2.370e+06
assign (resid 35 and name  HG* )(resid  48  and name  HD* ) 3.4 2.5 0.3 !s nu324 1.438 129.045 6.905 volume 3.234e+03
assign (resid 35 and name  HN )(resid  38  and name  HD2* ) 5.1 2.5 1.5 !vw nu. 428 8.646 22.840 0.228 vol 3.130e+02
assign (resid 36 and name  HA )(resid  36  and name  HG* ) 3.4 1.2 0.6 !m nu. 1336 3.908 23.815 1.605 vol 1.151e+05
assign (resid 36 and name  HB1 )(resid  36  and name  HN ) 3.4 1.2 0.6 !m nu. 1330 7.959 29.661 2.051 vol 4.430e+05
assign (resid 36 and name  HB1 )(resid  37  and name  HN ) 4.2 2.0 1.2 !w nu. 1332 7.373 29.661 2.057 vol 2.213e+04
assign (resid 36 and name  HB2 )(resid  36  and name  HN ) 2.7 2.7 0.8 !s nu. 1331 7.967 29.661 1.927 vol 9.126e+05
assign (resid 36 and name  HB2 )(resid  37  and name  HN ) 3.4 1.2 0.6 !m nu. 1333 7.385 29.661 1.928 vol 8.652e+04
assign (resid 36 and name  HG* )(resid  39  and name  HE* ) 4.2 2.0 1.2 !w nu. 280 2.809 23.815 1.593 vol 6.787e+04
assign (resid 36 and name  HN )(resid  39  and name  HG1 ) 5.1 2.5 1.5 !vw nu. 1368 7.951 23.490 1.612 vol 5.830e+02
assign (resid 37 and name  HA )(resid  37  and name  HB* ) 3.4 1.2 0.6 !m nu87 1.500 56.943 3.732 volume 5.798e+05
assign (resid 37 and name  HA )(resid  37  and name  HD1* ) 3.4 1.2 0.6 !m nu. 284 3.754 21.217 0.244 vol 1.074e+05
assign (resid 37 and name  HA )(resid  37  and name  HN ) 3.4 1.2 0.6 !m nu85 7.368 56.943 3.730 volume 2.076e+05
assign (resid 37 and name  HA )(resid  38  and name  HN ) 2.7 2.7 0.8 !s nu86 8.234 56.943 3.733 volume 1.743e+03
assign (resid 37 and name  HA )(resid  60  and name  HD* ) 2.7 2.7 1.3 !s nu84 6.770 56.943 3.724 volume 6.660e+02
assign (resid 37 and name  HA )(resid  60  and name  HE* )   4.2 2.0 1.2 !w nu263 3.737 115.079 6.769 volume 1.301e+04
assign (resid 37 and name  HB* )(resid  37  and name  HA ) 3.4 1.2 0.6 !m nu. 192 3.783 38.756 1.500 vol 1.737e+05
assign (resid 37 and name  HB* )(resid  37  and name  HD1* ) 2.7 0.7 0.4 !s nu. 292 1.515 21.217 0.244 vol 8.455e+05
assign (resid 37 and name  HB* )(resid  37  and name  HD1* ) 3.4 1.2 0.6 !m nu. 186 0.246 38.756 1.499 vol 1.369e+05
assign (resid 37 and name  HB* )(resid  37  and name  HD2* ) 3.4 1.2 0.6 !m nu. 185 0.081 38.756 1.498 vol 3.276e+05
assign (resid 37 and name  HB* )(resid  37  and name  HN ) 3.4 1.2 0.6 !m nu. 298 7.389 38.755 1.504 vol 1.103e+05
assign (resid 37 and name  HD1* )(resid  33  and name  HN )   5.1 2.5 1.5 !vw nu. 1354 8.937 21.217 0.242 vol 3.610e+02
assign (resid 37 and name  HD1* )(resid  37  and name  HD2* ) 3.4 1.2 0.6 !m nu. 294 0.062 21.217 0.247 vol 3.782e+05
assign (resid 37 and name  HD1* )(resid  38  and name  HB1 ) 3.4 1.2 0.6 !m nu. 291 1.713 21.217 0.246 vol 2.821e+05
assign (resid 37 and name  HD1* )(resid  38  and name  HD1* ) 3.4 1.2 0.6 !m nu. 295 0.512 21.217 0.250 vol 5.620e+05
assign (resid 37 and name  HD1* )(resid  38  and name  HN ) 4.2 2.0 1.2 !w nu. 288 8.223 21.217 0.245 vol 4.582e+04
assign (resid 37 and name  HD1* )(resid  40  and name  HN ) 5.1 2.5 1.5 !vw nu. 1355 7.924 21.217 0.247 vol 3.800e+02
assign (resid 37 and name  HD1* )(resid  41  and name  HG1* ) 3.4 1.2 0.6 !m nu. 390 1.290 21.217 0.245 vol 8.039e+04
assign (resid 37 and name  HD1* )(resid  57  and name  HA ) 3.4 1.2 0.6 !m nu. 285 3.979 21.217 0.249 vol 1.434e+05
assign (resid 37 and name  HD1* )(resid  57  and name  HA ) 3.4 1.2 0.6 !m nu106 0.264 55.319 3.962 volume 1.701e+05
assign (resid 37 and name  HD1* )(resid  57  and name  HD2* ) 3.4 1.2 0.6 !m nu. 394 0.249 22.516 0.852 vol 2.502e+05
assign (resid 37 and name  HD1* )(resid  60  and name  HB2 ) 3.7 2.1 0.6
assign (resid 37 and name  HD1* )(resid  60  and name  HB1 ) 3.4 1.2 0.6 
assign (resid 37 and name  HD1* )(resid  60  and name  HB2 ) 4.2 2.0 1.2 !w nu. 282 3.456 21.217 0.244 vol 2.480e+04
assign (resid 37 and name  HD1* )(resid  60  and name  HB2 ) 5.1 2.5 1.5 !vw nu. 347 0.247 35.507 2.922 vol 6.880e+02
assign (resid 37 and name  HD1* )(resid  60  and name  HB2 ) 5.1 2.5 1.5 !vw nu. 348 0.259 35.507 3.473 vol 5.380e+02
assign (resid 37 and name  HD1* )(resid  60  and name  HD* ) 2.7 0.7 0.3 !s nu257 0.238 129.370 6.786 volume 6.250e+02
assign (resid 37 and name  HD1* )(resid  60  and name  HE* ) 4.2 2.0 1.2 !w nu261 0.248 115.079 6.769 volume 8.716e+04
assign (resid 37 and name  HD1* )(resid  60  and name  HN ) 5.1 2.5 1.5 !vw nu. 289 8.780 21.217 0.251 vol 5.160e+02
assign (resid 37 and name  HD1* )(resid  82  and name  HA ) 3.4 1.2 0.6 !m nu97 0.251 55.319 3.589 volume 1.874e+05
assign (resid 37 and name  HD2* )(resid  38  and name  HN ) 5.1 2.5 1.5 !vw nu. 311 8.249 24.140 0.088 vol 3.350e+02
assign (resid 37 and name  HD2* )(resid  40  and name  HB1 ) 5.1 2.5 1.5 !vw nu. 308 4.266 24.140 0.078 vol 3.600e+02
assign (resid 37 and name  HD2* )(resid  57  and name  HD1* ) 2.7 0.7 0.4 !s nu. 324 0.075 22.516 0.793 vol 9.243e+05
assign (resid 37 and name  HD2* )(resid  57  and name  HD1* ) 2.7 0.7 0.4 !s nu. 325 0.259 22.516 0.794 vol 8.406e+05
assign (resid 37 and name  HD2* )(resid  57  and name  HD2* ) 3.4 1.2 0.6 !m nu. 393 0.079 22.516 0.855 vol 4.930e+05
assign (resid 37 and name  HD2* )(resid  60  and name  HB2 ) 5.1 2.5 1.5 !vw nu. 320 2.907 24.140 0.086 vol 3.530e+02
assign (resid 37 and name  HD2* )(resid  60  and name  HD* ) 2.7 0.7 0.3 !s nu258 0.083 129.370 6.789 volume 4.620e+02
assign (resid 37 and name  HD2* )(resid  60  and name  HE* ) 4.2 2.0 1.2 !w nu262 0.062 115.079 6.769 volume 7.251e+04
assign (resid 37 and name  HD2* )(resid  82  and name  HA ) 3.4 1.2 0.6 !m nu96 0.075 55.319 3.608 volume 3.200e+05
assign (resid 37 and name  HD2* )(resid  82  and name  HA ) 4.2 2.0 1.2 !w nu. 306 3.670 24.140 0.085 vol 6.306e+04
assign (resid 37 and name  HD2* )(resid  82  and name  HN ) 5.1 2.5 1.5 !vw nu. 321 9.888 24.140 0.088 vol 4.550e+02
assign (resid 37 and name  HD2* )(resid  85  and name  HD2* ) 3.4 1.2 0.6 !m nu. 316 0.600 24.140 0.085 vol 4.645e+05
assign (resid 37 and name  HG )(resid  37  and name  HD1* ) 2.7 0.7 0.4 !s nu. 293 0.980 21.217 0.246 vol 1.332e+06
assign (resid 37 and name  HG )(resid  60  and name  HD* ) 4.2 2.0 1.2 !w nu. 299 6.790 24.140 0.979 vol 5.396e+03
assign (resid 37 and name  HN )(resid  37  and name  HG ) 5.1 2.5 1.5 !vw nu. 296 7.358 24.140 0.987 vol 5.180e+02
assign (resid 38 and name  HA )(resid  38  and name  HB1 ) 4.2 2.0 1.2 !w nu. 461 3.617 36.806 1.690 vol 7.041e+03
assign (resid 38 and name  HA )(resid  38  and name  HB2 ) 4.2 2.0 1.2 !w nu. 468 3.616 36.806 0.970 vol 5.965e+04
assign (resid 38 and name  HA )(resid  38  and name  HN )  4.2 2.0 1.2 !w nu94 8.200 55.319 3.591 volume 3.915e+04
assign (resid 38 and name  HA )(resid  41  and name  HG1* ) 3.4 1.2 0.6 !m nu. 477 3.616 16.994 1.289 vol 1.524e+05
assign (resid 38 and name  HA )(resid  41  and name  HG1* ) 3.4 1.2 0.6 !m nu112 1.304 55.319 3.600 volume 3.749e+05
assign (resid 38 and name  HA )(resid  41  and name  HG2* ) 4.2 2.0 1.2 !w nu113 1.092 55.319 3.602 volume 9.349e+04
assign (resid 38 and name  HA )(resid  43  and name  HB* ) 4.2 2.0 1.2 !w nu. 535 3.612 16.020 0.593 vol 6.790e+04
assign (resid 38 and name  HB1 )(resid  35  and name  HD1* ) 4.2 2.0 1.2 !w nu. 460 1.116 36.806 1.691 vol 2.567e+04
assign (resid 38 and name  HB1 )(resid  38  and name  HB2 ) 3.4 1.2 0.6 !m nu. 467 1.709 36.806 0.975 vol 4.316e+05
assign (resid 38 and name  HB1 )(resid  38  and name  HN ) 5.1 2.5 1.5 !vw nu. 473 8.237 36.806 1.694 vol 7.620e+02
assign (resid 38 and name  HB1 )(resid  39  and name  HN ) 5.1 2.5 1.5 !vw nu. 472 8.863 36.806 1.670 vol 4.390e+02
assign (resid 38 and name  HB2 )(resid  35  and name  HD1* ) 5.1 2.5 1.5 !vw nu. 466 1.105 36.806 0.940 vol 2.260e+02
assign (resid 38 and name  HB2 )(resid  38  and name  HB1 ) 3.4 1.2 0.6 !m nu. 459 0.982 36.806 1.691 vol 3.305e+05
assign (resid 38 and name  HB2 )(resid  38  and name  HN ) 5.1 2.5 1.5 !vw nu. 470 8.237 36.806 0.981 vol 6.050e+02
assign (resid 38 and name  HB2 )(resid  39  and name  HN ) 5.1 2.5 1.5 !vw nu. 471 8.902 36.806 0.974 vol 1.960e+02
assign (resid 38 and name  HB2 )(resid  43  and name  HB* ) 4.2 2.0 1.2 !w nu. 465 0.576 36.806 0.972 vol 6.894e+04
assign (resid 38 and name  HB2* )(resid  43  and name  HB* ) 2.7 0.7 0.4 !s nu. 540 1.002 16.020 0.597 vol 7.089e+05
assign (resid 38 and name  HD1* )(resid  41  and name  HG1* ) 3.4 1.2 0.6 !m nu. 400 1.297 19.917 0.506 vol 2.700e+05
assign (resid 38 and name  HD1* )(resid  41  and name  HG1* ) 3.4 1.2 0.6 !m nu. 484 0.522 16.994 1.289 vol 1.128e+05
assign (resid 38 and name  HD1* )(resid  48  and name  HE* ) 5.1 2.5 1.5 !vw nu. 412 6.504 19.917 0.505 vol 6.630e+02
assign (resid 38 and name  HD1* )(resid  53  and name  HA ) 3.4 1.2 0.6 !m nu110 0.521 65.387 3.333 volume 1.056e+05
assign (resid 38 and name  HD1* )(resid  56  and name  HA )  4.5 2.4 0.6
assign (resid 38 and name  HD1* )(resid  56  and name  HB1 ) 3.4 1.2 0.6 !m nu. 1363 0.508 35.832 2.914 vol 7.496e+04
assign (resid 38 and name  HD1* )(resid  56  and name  HB1 ) 3.4 1.2 0.6 !m nu. 406 2.928 19.917 0.506 vol 3.412e+05
assign (resid 38 and name  HD1* )(resid  56  and name  HB2 ) 3.4 1.2 0.6 !m nu. 405 2.799 19.917 0.505 vol 2.855e+05
assign (resid 38 and name  HD1* )(resid  56  and name  HB2 ) 4.2 2.0 1.2 !w nu. 1364 0.498 35.832 2.786 vol 3.794e+04
assign (resid 38 and name  HD1* )(resid  56  and name  HD* )  3.4 1.2 0.6 !m nu347 0.524 130.344 7.125 volume 1.240e+05
assign (resid 38 and name  HD1* )(resid  56  and name  HD* ) 3.4 1.2 0.6 !m nu. 413 7.150 19.917 0.502 vol 9.934e+04
assign (resid 38 and name  HD1* )(resid  56  and name  HE* ) 4.2 2.0 1.2 !w nu. 415 7.028 19.917 0.505 vol 1.501e+03
assign (resid 38 and name  HD1* )(resid  56  and name  HN ) 4.2 2.0 1.2 !w nu. 417 8.603 19.917 0.507 vol 5.181e+03

assign (resid 38 and name  HD2* )(resid  38  and name  HB1 ) 4.2 2.0 1.2 !w nu. 457 0.231 36.806 1.690 vol 6.603e+04
assign (resid 38 and name  HD2* )(resid  38  and name  HB2 ) 3.4 1.2 0.6 !m nu. 463 0.243 36.806 0.972 vol 7.101e+04
assign (resid 38 and name  HD2* )(resid  38  and name  HD1* ) 2.7 0.7 0.4 !s nu. 396 0.245 19.917 0.506 vol 1.101e+06
assign (resid 38 and name  HD2* )(resid  43  and name  HB* ) 4.2 2.0 1.2 !w nu. 524 0.237 16.020 0.593 vol 5.440e+04
assign (resid 38 and name  HD2* )(resid  48  and name  HD* ) 2.7 0.7 0.3 !s nu237 0.259 129.045 6.877 volume 5.369e+03
assign (resid 38 and name  HD2* )(resid  48  and name  HD* ) 5.1 2.5 1.5 !vw nu. 421 6.895 22.840 0.240 vol 5.510e+02
assign (resid 38 and name  HD2* )(resid  48  and name  HE* ) 4.2 2.0 1.2 !w nu. 420 6.512 22.840 0.239 vol 1.608e+03
assign (resid 38 and name  HD2* )(resid  48  and name  HE* ) 4.2 2.0 1.2 !w nu46 0.232 115.729 6.496 volume 2.172e+04
assign (resid 38 and name  HD2* )(resid  53  and name  HA ) 2.7 0.7 0.3 !s nu109 0.272 65.387 3.335 volume 1.383e+03
assign (resid 38 and name  HD2* )(resid  53  and name  HA ) 4.2 2.0 1.2 !w nu. 244 3.364 22.841 0.234 vol 3.362e+03
assign (resid 38 and name  HD2* )(resid  53  and name  HB ) 5.1 2.5 1.5 !vw nu. 429 2.368 22.840 0.227 vol 5.000e+02
assign (resid 38 and name  HD2* )(resid  56  and name  HA )  3.8 3.4 0.9
assign (resid 38 and name  HD2* )(resid  56  and name  HB1 ) 5.1 2.5 1.5 !vw nu. 243 2.947 22.841 0.246 vol 5.910e+02
assign (resid 38 and name  HD2* )(resid  56  and name  HB2 ) 5.1 2.5 1.5 !vw nu. 1367 2.767 22.840 0.236 vol 4.630e+02
assign (resid 38 and name  HN )(resid  38  and name  HD1* ) 3.4 1.2 0.6 !m nu. 416 8.230 19.917 0.506 vol 1.160e+05
assign (resid 38 and name  HN )(resid  38  and name  HD2* ) 4.2 2.0 1.2 !w nu. 424 8.221 22.840 0.237 vol 6.202e+04
assign (resid 39 and name  HA )(resid  39  and name  HD* ) 3.4 1.2 0.6 !m nu. 223 4.289 26.414 1.623 vol 1.254e+05
assign (resid 39 and name  HA )(resid  39  and name  HG1 ) 3.4 1.2 0.6 !m nu. 232 4.293 23.491 1.621 vol 1.308e+05
assign (resid 39 and name  HA )(resid  39  and name  HG2 ) 3.4 1.2 0.6 !m nu. 229 4.276 23.491 1.322 vol 1.830e+05
assign (resid 39 and name  HA )(resid  43  and name  HB* ) 3.4 1.2 0.6 !m nu. 510 4.280 16.020 0.593 vol 1.506e+05
assign (resid 39 and name  HA )(resid  43  and name  HB* ) 3.4 1.2 0.6 !m nu150 0.572 56.618 4.262 volume 1.763e+05
assign (resid 39 and name  HA )(resid  43  and name  HN )  3.4 1.2 0.6 !m nu154 7.390 56.618 4.261 volume 7.061e+05
assign (resid 39 and name  HB* )(resid  40  and name  HN ) 3.4 1.2 0.6 !m nu. 514 7.950 29.661 1.862 vol 1.357e+05
assign (resid 39 and name  HB* )(resid  43  and name  HB* ) 5.1 2.5 1.5 !vw nu. 513 0.563 29.661 1.831 vol 4.530e+02
assign (resid 39 and name  HE* )(resid  39  and name  HG2 ) 3.4 1.2 0.6 !m nu. 233 2.802 23.491 1.330 vol 8.244e+04
assign (resid 39 and name  HE* )(resid  43  and name  HB* ) 4.2 2.0 1.2 !w nu. 532 2.794 16.020 0.594 vol 1.871e+04
assign (resid 39 and name  HN )(resid  39  and name  HG1 ) 4.2 2.0 1.2 !w nu. 230 8.896 23.491 1.626 vol 6.232e+04
assign (resid 39 and name  HN )(resid  39  and name  HG2 ) 4.2 2.0 1.2 !w nu. 228 8.874 23.491 1.328 vol 3.622e+03
assign (resid 39 and name  HN )(resid  43  and name  HB* ) 3.4 1.2 0.6 !m nu. 522 8.861 16.020 0.593 vol 1.128e+05
assign (resid 40 and name  HB* )(resid  41  and name  HG1* ) 5.1 2.5 1.5 !vw nu. 475 4.284 16.994 1.287 vol 5.560e+02
assign (resid 40 and name  HN )(resid  41  and name  HG1* ) 4.2 2.0 1.2 !w nu. 490 7.914 16.994 1.289 vol 5.178e+03
assign (resid 40 and name  HN )(resid  41  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 440 7.922 19.593 1.082 vol 6.590e+02

assign (resid 41 and name  HA )(resid  41  and name  HB ) 3.4 1.2 0.6 !m nu. 499 4.825 28.037 2.807 vol 3.059e+05
assign (resid 41 and name  HB )(resid  41  and name  HG1* ) 2.7 0.7 0.4 !s nu. 480 2.798 16.994 1.288 vol 8.113e+05
assign (resid 41 and name  HB )(resid  41  and name  HG2* ) 2.7 0.7 0.4 !s nu. 435 2.800 19.593 1.083 vol 8.115e+05
assign (resid 41 and name  HB )(resid  42  and name  HN ) 5.1 2.5 1.5 !vw nu. 504 7.560 28.037 2.803 vol 4.190e+02
assign (resid 41 and name  HB )(resid  56  and name  HD* ) 5.1 2.5 1.5 !vw nu. 500 7.137 28.037 2.812 vol 5.840e+02
assign (resid 41 and name  HB )(resid  59  and name  HB* ) 4.2 2.0 1.2 !w nu. 495 2.198 28.037 2.807 vol 6.325e+04
assign (resid 41 and name  HB )(resid  59  and name  HB1 ) 5.1 2.5 1.5 !vw nu. 1275 2.814 25.764 2.241 vol 6.380e+02
assign (resid 41 and name  HB )(resid  59  and name  HB2 ) 4.2 2.0 1.2 !w nu. 1274 2.802 25.764 2.184 vol 1.656e+03
assign (resid 41 and name  HB )(resid  60  and name  HA  )  5.1 5.1 1.0 !vw nu. 498 3.891 28.037 2.802 vol 5.480e+02
assign (resid 41 and name  HG1* )(resid  41  and name  HB ) 2.7 0.7 0.4 !s nu. 503 1.289 28.037 2.805 vol 6.533e+05
assign (resid 41 and name  HG1* )(resid  41  and name  HN ) 3.4 1.2 0.6 !m nu. 488 7.308 16.994 1.289 vol 4.983e+05
assign (resid 41 and name  HG1* )(resid  42  and name  HN ) 4.2 2.0 1.2 !w nu. 489 7.522 16.994 1.287 vol 2.725e+04
assign (resid 41 and name  HG1* )(resid  43  and name  HB* ) 3.4 1.2 0.6 !m nu. 527 1.318 16.020 0.593 vol 4.883e+05
assign (resid 41 and name  HG1* )(resid  43  and name  HB* ) 4.2 2.0 1.2 !w nu. 541 0.601 16.994 1.289 vol 4.768e+04
assign (resid 41 and name  HG1* )(resid  56  and name  HD* ) 3.4 1.2 0.6 !m nu. 487 7.144 16.994 1.289 vol 2.548e+05
assign (resid 41 and name  HG1* )(resid  56  and name  HD* ) 3.4 1.2 0.6 !m nu137 1.284 130.344 7.125 volume 2.185e+05
assign (resid 41 and name  HG1* )(resid  56  and name  HE* ) 3.4 1.2 0.6 !m nu. 549 7.083 16.994 1.288 vol 8.248e+04
assign (resid 41 and name  HG1* )(resid  56  and name  HE* ) 4.2 2.0 1.2 !w nu157 1.287 115.079 7.009 volume 2.302e+04
assign (resid 41 and name  HG1* )(resid  59  and name  HB* ) 3.4 1.2 0.6 !m nu. 481 2.219 16.994 1.288 vol 1.220e+05
assign (resid 41 and name  HG1* )(resid  59  and name  HB1 ) 4.2 2.0 1.2 !w nu. 1270 1.289 25.764 2.258 vol 2.013e+04

assign (resid 41 and name  HG1* )(resid  59  and name  HB2 ) 4.2 2.0 1.2 !w nu. 1271 1.283 25.764 2.188 vol 3.066e+04
assign (resid 41 and name  HG1* )(resid  60  and name  HA  ) 3.0 2.0 0.6 !m nu130 1.272 59.866 3.847 volume 4.197e+05
assign (resid 41 and name  HG1* )(resid  60  and name  HA ) 4.2 2.0 1.2 !w nu. 476 3.876 16.994 1.288 vol 4.564e+04


assign (resid 41 and name  HG1* )(resid  60  and name  HB1 ) 3.7 2.0 1.0 !w nu. 478 3.453 16.994 1.286 vol 7.536e+03
assign (resid 41 and name  HG1* )(resid  60  and name  HB2 ) 3.7 2.0 0.8 !m nu. 341 1.282 35.507 2.930 vol 7.446e+04
assign (resid 41 and name  HG1* )(resid  60  and name  HB2 ) 3.4 1.2 0.6 !m nu. 479 2.926 16.994 1.290 vol 2.692e+05
assign (resid 41 and name  HG1* )(resid  60  and name  HD* ) 2.7 0.7 0.3 !s nu120 1.287 129.370 6.797 volume 7.320e+02
assign (resid 41 and name  HG1* )(resid  60  and name  HD* ) 4.2 2.0 1.2 !w nu. 486 6.827 16.994 1.290 vol 3.278e+04
assign (resid 41 and name  HG1* )(resid  60  and name  HN ) 4.2 2.0 1.2 !w nu. 492 8.802 16.994 1.290 vol 2.414e+04

assign (resid 41 and name  HG2* )(resid  41  and name  HB ) 2.7 0.7 0.4 !s nu. 502 1.076 28.037 2.802 vol 6.150e+05
assign (resid 41 and name  HG2* )(resid  41  and name  HN ) 3.4 1.2 0.6 !m nu. 436 7.282 19.593 1.079 vol 2.906e+05
assign (resid 41 and name  HG2* )(resid  42  and name  HN ) 4.2 2.0 1.2 !w nu. 439 7.559 19.593 1.080 vol 1.553e+03
assign (resid 41 and name  HG2* )(resid  56  and name  HD* ) 2.7 0.7 0.3 !s nu138 1.060 130.344 7.126 volume 6.900e+02
assign (resid 41 and name  HG2* )(resid  56  and name  HD* ) 3.4 1.2 0.6 !m nu. 438 7.130 19.593 1.068 vol 1.845e+05
assign (resid 41 and name  HG2* )(resid  56  and name  HE* )  2.7 0.7 0.3 !s nu349 1.120 115.079 6.998 volume 7.320e+02
assign (resid 41 and name  HG2* )(resid  59  and name  HB* ) 3.4 1.2 0.6 !m nu. 450 2.218 19.593 1.079 vol 2.137e+05
assign (resid 41 and name  HG2* )(resid  59  and name  HB1 ) 5.1 2.5 1.5 !vw nu. 1272 1.083 25.764 2.248 vol 7.070e+02
assign (resid 41 and name  HG2* )(resid  59  and name  HB2 ) 5.1 2.5 1.5 !vw nu. 1273 1.077 25.764 2.185 vol 7.370e+02
assign (resid 41 and name  HG2* )(resid  60  and name  HA )  3.0 2.0 0.6 !m nu131 1.082 59.866 3.849 volume 9.959e+05
assign (resid 41 and name  HG2* )(resid  60  and name  HB1 ) 3.7 2.0 0.8 !w nu. 343 1.076 35.507 3.470 vol 5.008e+03
assign (resid 41 and name  HG2* )(resid  60  and name  HB2 ) 3.7 2.0 0.8 !m nu. 448 2.941 19.593 1.082 vol 2.365e+05
assign (resid 41 and name  HG2* )(resid  60  and name  HD* ) 3.4 1.2 0.6 !m nu119 1.056 129.370 6.795 volume 1.386e+05
assign (resid 41 and name  HG2* )(resid  60  and name  HN ) 3.4 1.2 0.6 !m nu. 443 8.772 19.593 1.084 vol 8.991e+04

assign (resid 41 and name  HG2* )(resid  63  and name  HA ) 4.5 3.4 0.8
assign (resid 41 and name  HG2* )(resid  63  and name  HB ) 3.8 3.4 0.8 
assign (resid 41 and name  HN )(resid  41  and name  HB ) 5.1 2.5 1.5 !vw nu. 501 7.311 28.037 2.810 vol 5.580e+02
assign (resid 42 and name  HA* )(resid  43  and name  HN ) 4.2 2.0 1.2 !w nu. 507 7.344 42.652 3.756 vol 1.032e+04
assign (resid 42 and name  HA1 )(resid  42  and name  HA2 ) 2.7 0.7 0.4 !s nu. 1264 3.761 42.652 4.453 vol 1.155e+06
assign (resid 42 and name  HA1 )(resid  42  and name  HA2 ) 2.7 0.7 0.4 !s nu. 505 4.452 42.652 3.762 vol 1.345e+06
assign (resid 42 and name  HA2 )(resid  42  and name  HN ) 3.4 1.2 0.6 !m nu. 508 7.546 42.652 3.758 vol 3.245e+05
assign (resid 42 and name  HN )(resid  43  and name  HB* ) 4.2 2.0 1.2 !w nu. 519 7.559 16.020 0.595 vol 5.434e+03
assign (resid 43 and name  HB* )(resid  43  and name  HN ) 3.4 1.2 0.6 !m nu. 509 7.397 16.020 0.592 vol 3.593e+05
assign (resid 43 and name  HB* )(resid  44  and name  HA ) 4.2 2.0 1.2 !w nu. 538 4.594 16.020 0.593 vol 1.533e+03
assign (resid 43 and name  HB* )(resid  44  and name  HB1 ) 4.2 2.0 1.2 !w nu. 531 2.373 16.020 0.592 vol 1.958e+04
assign (resid 43 and name  HB* )(resid  48  and name  HD* ) 4.2 2.0 1.2 !w nu. 517 6.903 16.020 0.589 vol 6.013e+03
assign (resid 43 and name  HB* )(resid  48  and name  HE* ) 3.4 1.2 0.6 !m nu. 516 6.511 16.020 0.593 vol 2.588e+05
assign (resid 43 and name  HB* )(resid  48  and name  HE* ) 3.4 1.2 0.6 !m nu47 0.582 115.729 6.501 volume 2.758e+05
assign (resid 43 and name  HB* )(resid  56  and name  HD* ) 3.4 1.2 0.6 !m nu. 542 7.132 16.020 0.594 vol 1.354e+05
assign (resid 43 and name  HB* )(resid  56  and name  HE* ) 3.4 1.2 0.6 !m nu. 518 7.049 16.020 0.594 vol 9.505e+04
assign (resid 43 and name  HB* )(resid  56  and name  HE* ) 4.2 2.0 1.2 !w nu156 0.574 115.079 7.007 volume 5.754e+04
assign (resid 43 and name  HN )(resid  43  and name  HB* ) 3.4 1.2 0.6 !m nu. 752 7.389 15.370 0.590 vol 4.793e+05
assign (resid 44 and name  HA )(resid  44  and name  HB2 ) 3.4 1.2 0.6 !m nu. 1372 4.584 28.037 1.836 vol 3.051e+05
assign (resid 44 and name  HA )(resid  44  and name  HG2 ) 3.4 1.2 0.6 !m nu. 1385 4.593 30.960 2.342 vol 3.599e+05
assign (resid 44 and name  HB1 )(resid  43  and name  HB* ) 4.2 2.0 1.2 !w nu. 1375 0.583 28.037 2.334 vol 6.734e+03
assign (resid 44 and name  HB1 )(resid  44  and name  HA ) 3.4 1.2 0.6 !m nu. 1373 4.569 28.037 2.338 vol 3.313e+05
assign (resid 44 and name  HB1 )(resid  44  and name  HB2 ) 2.7 0.7 0.4 !s nu. 1374 1.855 28.037 2.345 vol 2.257e+06
assign (resid 44 and name  HB1 )(resid  44  and name  HB2 ) 2.7 0.7 0.4 !s nu. 1386 1.857 30.960 2.440 vol 1.352e+06
assign (resid 44 and name  HB1 )(resid  44  and name  HN ) 4.2 2.0 1.2 !w nu. 1376 8.820 28.037 2.340 vol 4.359e+03
assign (resid 44 and name  HB2 )(resid  44  and name  HN ) 4.2 2.0 1.2 !w nu. 1370 8.821 28.037 1.839 vol 4.524e+04
assign (resid 44 and name  HB2 )(resid  45  and name  HN ) 5.1 2.5 1.5 !vw nu. 1371 7.419 28.037 1.836 vol 7.120e+02
assign (resid 44 and name  HG1 )(resid  44  and name  HN ) 4.2 2.0 1.2 !w nu. 1382 8.820 30.960 2.432 vol 3.390e+03
assign (resid 44 and name  HG2 )(resid  44  and name  HB2 ) 2.7 0.7 0.4 !s nu. 1387 1.857 30.960 2.332 vol 2.228e+06
assign (resid 45 and name  HA )(resid  45  and name  HG1 ) 4.2 2.0 1.2 !w nu. 1329 4.651 21.541 1.265 vol 2.140e+04
assign (resid 45 and name  HA )(resid  45  and name  HG2 ) 4.2 2.0 1.2 !w nu. 1326 4.665 21.541 1.111 vol 1.406e+04
assign (resid 45 and name  HB1 )(resid  45  and name  HB2 ) 2.7 0.7 0.4 !s nu. 1321 1.725 31.934 1.321 vol 6.435e+05
assign (resid 45 and name  HB1 )(resid  45  and name  HN ) 4.2 2.0 1.2 !w nu. 550 7.421 31.934 1.722 vol 1.657e+04
assign (resid 45 and name  HB1 )(resid  47  and name  HN ) 4.2 2.0 1.2 !w nu. 1316 7.023 31.934 1.724 vol 3.108e+04
assign (resid 45 and name  HB2 )(resid  45  and name  HD* ) 2.7 0.7 0.4 !s nu. 1392 1.305 26.738 1.652 vol 1.670e+06
assign (resid 45 and name  HB2 )(resid  45  and name  HE* ) 2.7 0.7 0.4 !s nu. 1393 1.300 39.080 2.897 vol 2.006e+06
assign (resid 45 and name  HB2 )(resid  45  and name  HE* ) 4.2 2.0 1.2 !w nu. 1389 2.892 31.934 1.322 vol 8.234e+03
assign (resid 45 and name  HB2 )(resid  45  and name  HN ) 5.1 2.5 1.5 !vw nu. 551 7.430 31.934 1.323 vol 7.090e+02
assign (resid 45 and name  HB2 )(resid  47  and name  HN ) 5.1 2.5 1.5 !vw nu. 1317 7.023 31.934 1.315 vol 7.360e+02
assign (resid 45 and name  HD* )(resid  45  and name  HN ) 5.1 2.5 1.5 !vw nu. 1390 7.412 26.738 1.646 vol 7.550e+02
assign (resid 45 and name  HE* )(resid  45  and name  HD* ) 2.7 0.7 0.4 !s nu. 1394 1.637 39.080 2.897 vol 1.710e+06
assign (resid 45 and name  HE* )(resid  48  and name  HD* ) 3.4 1.2 0.6 !m nu. 1260 6.831 39.080 2.895 vol 2.145e+05
assign (resid 45 and name  HE* )(resid  48  and name  HE* ) 4.2 2.0 1.2 !w nu. 1259 6.511 39.080 2.894 vol 5.428e+04
assign (resid 45 and name  HG* )(resid  45  and name  HB1 ) 3.4 1.2 0.6 !m nu. 1318 1.121 31.934 1.724 vol 8.610e+04
assign (resid 45 and name  HG* )(resid  45  and name  HB2 ) 3.4 1.2 0.6 !m nu. 1320 1.121 31.934 1.325 vol 1.105e+05
assign (resid 45 and name  HG* )(resid  45  and name  HE* ) 2.7 0.7 0.4 !s nu. 1391 2.900 26.738 1.650 vol 1.752e+06
assign (resid 45 and name  HG1 )(resid  45  and name  HE* ) 3.4 1.2 0.6 !m nu. 1328 2.905 21.541 1.265 vol 7.209e+04
assign (resid 45 and name  HG1 )(resid  45  and name  HN ) 4.2 2.0 1.2 !w nu. 1324 7.434 21.541 1.269 vol 3.268e+03
assign (resid 45 and name  HG2 )(resid  45  and name  HE* ) 3.4 1.2 0.6 !m nu. 1327 2.875 21.541 1.107 vol 1.124e+05
assign (resid 45 and name  HG2 )(resid  45  and name  HN ) 4.2 2.0 1.2 !w nu. 1325 7.419 21.541 1.115 vol 2.938e+04
assign (resid 45 and name  HN )(resid  45  and name  HE* ) 5.1 2.5 1.5 !vw nu. 1381 7.400 39.080 2.897 vol 4.400e+02
assign (resid 46 and name  HA )(resid  46  and name  HB* ) 4.2 2.0 1.2 !w nu. 1396 4.602 39.080 2.703 vol 5.496e+04
assign (resid 46 and name  HB* )(resid  47  and name  HG2* ) 3.4 1.2 0.6 !m nu. 1397 1.111 39.080 2.709 vol 2.457e+05
assign (resid 46 and name  HB* )(resid  47  and name  HG2* ) 3.4 1.2 0.6 !m nu. 1398 2.725 19.268 1.127 vol 8.270e+04
assign (resid 46 and name  HB* )(resid  47  and name  HN ) 4.2 2.0 1.2 !w nu. 1395 7.024 39.080 2.700 vol 1.473e+04
assign (resid 47 and name  HA )(resid  47  and name  HN ) 4.2 2.0 1.2 !w nu37 7.034 69.285 3.918 volume 5.620e+04
assign (resid 47 and name  HG2* )(resid  48  and name  HN ) 3.4 1.2 0.6 !m nu. 813 8.772 19.268 1.130 vol 2.069e+05
assign (resid 47 and name  HN )(resid  48  and name  HN ) 4.2 2.0 1.2 !w nu38 8.783 69.285 3.917 volume 6.835e+04
assign (resid 48 and name  HA )(resid  48  and name  HD* ) 4.2 2.0 1.2 !w nu16 4.900 129.695 6.881 volume 7.888e+04
assign (resid 48 and name  HB1 )(resid  48  and name  HA ) 3.4 1.2 0.6 !m nu. 113 4.901 42.978 3.589 vol 1.098e+05
assign (resid 48 and name  HB1 )(resid  48  and name  HB2 ) 3.4 1.2 0.6 !m nu. 109 2.121 42.978 3.576 vol 1.440e+05
assign (resid 48 and name  HB1 )(resid  48  and name  HB2 ) 3.4 1.2 0.6 !m nu. 117 3.579 42.978 2.131 vol 2.049e+05
assign (resid 48 and name  HB1 )(resid  48  and name  HB2 ) 4.2 2.0 1.2 !w nu. 1261 3.586 42.977 3.584 vol 4.502e+04
assign (resid 48 and name  HB1 )(resid  48  and name  HD* ) 2.7 0.7 0.3 !s nu234 3.545 129.045 6.865 volume 3.301e+03
assign (resid 48 and name  HB1 )(resid  48  and name  HD* ) 4.2 2.0 1.2 !w nu. 114 6.891 42.978 3.576 vol 7.786e+03
assign (resid 48 and name  HB1 )(resid  48  and name  HN ) 4.2 2.0 1.2 !w nu. 122 8.731 42.978 3.572 vol 1.690e+03
assign (resid 48 and name  HB1 )(resid  49  and name  HN ) 5.1 2.5 1.5 !vw nu. 123 9.030 42.978 3.576 vol 4.650e+02
assign (resid 48 and name  HB1 )(resid  52  and name  HB1 ) 3.8 1.0 0.6
assign (resid 48 and name  HB1 )(resid  52  and name  HB2 ) 3.8 1.0 0.6
assign (resid 48 and name  HB1 )(resid  53  and name  HG1* ) 3.2 1.0 0.6 !m nu. 814 3.577 19.593 0.786 vol 2.005e+05

assign (resid 48 and name  HB1 )(resid  53  and name  HN ) 4.2 2.0 1.2 !w nu. 121 8.349 42.978 3.566 vol 1.512e+03
assign (resid 48 and name  HB2 )(resid  28  and name  HN ) 5.1 2.5 1.5 !vw nu. 124 9.848 42.978 2.114 vol 4.100e+02
assign (resid 48 and name  HB2 )(resid  48  and name  HA ) 4.2 2.0 1.2 !w nu. 116 4.915 42.978 2.128 vol 5.933e+03
assign (resid 48 and name  HB2 )(resid  48  and name  HD* ) 4.2 2.0 1.2 !w nu. 115 6.891 42.978 2.141 vol 4.006e+04
assign (resid 48 and name  HB2 )(resid  48  and name  HD* ) 4.2 2.0 1.2 !w nu241 2.121 129.045 6.872 volume 5.053e+04
assign (resid 48 and name  HB2 )(resid  48  and name  HN ) 4.2 2.0 1.2 !w nu. 119 8.771 42.978 2.134 vol 6.812e+03
assign (resid 48 and name  HB2 )(resid  49  and name  HN ) 5.1 2.5 1.5 !vw nu. 120 9.044 42.978 2.131 vol 5.630e+02
assign (resid 48 and name  HB2 )(resid  52  and name  HB1 ) 4.2 3.4 0.6 !m nu. 136 2.147 19.918 0.767 vol 1.541e+05
assign (resid 48 and name  HB2 )(resid  53  and name  HG1* ) 3.2 1.0 0.6 !m nu. 815 2.118 19.593 0.793 vol 4.606e+05
assign (resid 48 and name  HD* )(resid  47  and name  HA ) 2.7 0.7 0.3 !s nu26 5.090 129.695 6.903 volume 2.408e+03
assign (resid 48 and name  HD* )(resid  48  and name  HA )  3.4 1.2 0.6 !m nu60 4.901 115.729 6.500 volume 4.627e+05
assign (resid 48 and name  HD* )(resid  49  and name  HN )  2.7 0.7 0.3 !s nu325 9.035 129.045 6.865 volume 5.550e+02
assign (resid 48 and name  HD* )(resid  52  and name  HB* )  3.5 1.0 0.8
assign (resid 48 and name  HD* )(resid  53  and name  HB )   5.1 2.5 1.5 !vw nu. 127 6.907 27.713 2.345 vol 4.960e+02
assign (resid 48 and name  HD* )(resid  53  and name  HG1* ) 3.2 3.0 0.6 !m nu236 0.782 129.045 6.878 volume 5.312e+05
assign (resid 48 and name  HE* )(resid  48  and name  HD* )  3.4 1.2 0.6 !m nu62 6.898 115.729 6.494 volume 4.574e+05
assign (resid 48 and name  HE* )(resid  52  and name  HB* )  4.8 2.0 2.0
assign (resid 48 and name  HE* )(resid  53  and name  HG1* ) 5.1 2.5 1.5 !vw nu. 820 6.516 19.593 0.804 vol 4.490e+02
assign (resid 48 and name  HE* )(resid  56  and name  HE* )  3.4 1.2 0.6 !m nu225 6.523 115.729 7.013 volume 1.202e+05
assign (resid 48 and name  HE* )(resid  56  and name  HE* ) 3.4 1.2 0.6 !m nu63 7.027 115.729 6.499 volume 8.612e+05
assign (resid 48 and name  HN )(resid   48  and name  HD* ) 4.2 2.0 1.2 !w nu229 8.775 129.045 6.869 volume 6.979e+04

assign (resid 49 and name  HA )(resid  49  and name  HG2* ) 3.4 1.2 0.6 !m nu. 175 5.415 19.593 1.323 vol 3.240e+05
assign (resid 49 and name  HA )(resid  50  and name  HN )   3.2 1.0 0.6 !w nu44 8.297 58.242 5.384 volume 7.191e+04
assign (resid 49 and name  HA )(resid  50  and name  HB* )  4.5 1.0 0.8
assign (resid 49 and name  HA )(resid  53  and name  HG1* ) 4.5 1.0 0.8
assign (resid 49 and name  HB )(resid  49  and name  HG2* ) 2.7 0.7 0.4 !s nu. 174 4.830 19.593 1.322 vol 1.198e+06
assign (resid 49 and name  HG2* )(resid  49  and name  HN ) 3.4 1.2 0.6 !m nu. 81 9.050 19.593 1.324 vol 1.506e+05
assign (resid 49 and name  HG2* )(resid  50  and name  HN ) 4.2 2.2 1.6 !w nu. 178 8.270 19.593 1.324 vol 2.514e+04
assign (resid 49 and name  HG2* )(resid  50  and name  HA ) 3.8 1.0 0.8
assign (resid 49 and name  HG2* )(resid  52  and name  HN ) 4.2 2.0 1.2 !w nu. 177 7.960 19.593 1.319 vol 3.202e+03
assign (resid 49 and name  HN )(resid  49  and name  HA ) 2.7 0.7 0.3 !s nu28 9.130 58.242 5.395 volume 2.384e+03
assign (resid 49 and name  HN )(resid  52  and name  HB1 ) 4.2 2.0 1.2 !w nu. 144 9.051 28.687 3.026 vol 1.624e+03
assign (resid 49 and name  HN )(resid  52  and name  HB2 ) 5.1 2.5 1.5 !vw nu. 143 9.046 28.687 2.312 vol 6.630e+02
assign (resid 49 and name  HB )(resid  50  and name  HB* ) 3.9 2.1 1.0
?assign (resid 49 and name  HB )(resid  51  and name  HB1 ) 4.5 2.1 1.0
assign (resid 51 and name  HN )(resid  52  and name  HB2 ) 3.4 1.2 0.6 !m nu. 139 8.652 29.012 2.218 vol 7.057e+04
assign (resid 52 and name  HA )(resid  52  and name  HB1 ) 3.4 1.2 0.6 !m nu. 150 4.171 28.687 2.977 vol 2.240e+05
assign (resid 52 and name  HA )(resid  52  and name  HB2 ) 4.2 2.0 1.2 !w nu. 826 4.139 28.687 2.329 vol 6.458e+04
assign (resid 52 and name  HA )(resid  53  and name  HN )  3.8 1.5 1.0
assign (resid 52 and name  HB1 )(resid  52  and name  HN ) 5.1 2.5 1.5 !vw nu. 145 8.351 28.687 3.015 vol 5.430e+02
assign (resid 52 and name  HB2 )(resid  52  and name  HN ) 5.1 2.5 1.5 !vw nu. 142 8.326 28.687 2.312 vol 6.580e+02
assign (resid 52 and name  HN )(resid  52  and name  HB2 ) 3.4 1.2 0.6 !m nu. 138 7.993 29.012 2.221 vol 2.575e+05
assign (resid 52 and name  HN )(resid  53  and name  HN ) 5.1 2.5 1.5 !vw nu. 129 7.997 27.713 2.368 vol 5.550e+02
assign (resid 52 and name  HB* )(resid  53  and name  HG1* ) 3.5 1.5 0.8
assign (resid 52 and name  HB* )(resid  53  and name  HG2* ) 4.0 1.5 0.8
assign (resid 52 and name  HB* )(resid  56  and name  HD* )  4.5 1.5 0.8
assign (resid 52 and name  HB* )(resid  56  and name  HE* )  4.0 1.5 0.8
assign (resid 53 and name  HA )(resid  56  and name  HB* ) 3.8 2.0 0.8
assign (resid 53 and name  HA )(resid  56  and name  HD* ) 4.2 3.4 0.6
assign (resid 53 and name  HB )(resid  53  and name  HA )  3.4 1.2 0.6 !m nu. 130 8.344 27.713 2.381 vol 5.284e+05
assign (resid 53 and name  HG1* )(resid  48  and name  HD* ) 4.2 2.0 1.2 !w nu. 821 6.879 19.593 0.796 vol 4.068e+04
assign (resid 53 and name  HN )(resid  53  and name  HG1* ) 2.7 0.7 0.4 !s nu. 819 8.344 19.593 0.779 vol 8.653e+05
assign (resid 55 and name  HB* )(resid  55  and name  HD* ) 3.4 1.2 0.6 !m nu270 3.152 128.720 6.529 volume 2.704e+05
assign (resid 55 and name  HB* )(resid  56  and name  HN ) 3.4 1.2 0.6 !m nu. 543 8.507 35.507 3.190 vol 2.225e+05
assign (resid 55 and name  HD* )(resid  55  and name  HE* ) 2.7 0.7 0.3 !s nu274 7.140 128.720 6.528 volume 1.403e+06
assign (resid 55 and name  HD* )(resid  55  and name  HN )  2.7 0.7 0.3 !s nu275 8.126 128.720 6.534 volume 5.800e+02
assign (resid 55 and name  HD* )(resid  56  and name  HN )  2.7 0.7 0.3 !s nu276 8.590 128.720 6.533 volume 7.170e+02
assign (resid 55 and name  HE* )(resid  55  and name  HB* ) 3.4 1.2 0.6 !m nu281 3.175 129.045 7.106 volume 5.201e+05
assign (resid 55 and name  HE* )(resid  55  and name  HD* ) 2.7 0.7 0.3 !s nu280 6.540 129.045 7.109 volume 1.439e+06
assign (resid 56 and name  HA )(resid  41  and name  HG1* ) 3.4 1.2 0.6 !m nu144 1.268 59.866 3.949 volume 2.641e+05
assign (resid 56 and name  HA )(resid  56  and name  HD* )  3.4 1.2 0.6 !m nu135 3.972 130.344 7.121 volume 6.170e+05
assign (resid 56 and name  HB1 )(resid  56  and name  HA ) 3.4 1.2 0.6 !m nu. 1362 3.970 35.832 2.928 vol 1.134e+05
assign (resid 56 and name  HB1 )(resid  56  and name  HE* ) 4.2 2.0 1.2 !w nu265 2.947 115.079 7.008 volume 2.994e+04
assign (resid 56 and name  HB1 )(resid  56  and name  HN ) 4.2 2.0 1.2 !w nu. 1359 8.599 35.832 2.877 vol 1.489e+03
assign (resid 56 and name  HB2 )(resid  56  and name  HA ) 4.2 2.0 1.2 !w nu. 1361 3.975 35.832 2.792 vol 3.053e+04
assign (resid 56 and name  HB2 )(resid  56  and name  HD* ) 3.4 1.2 0.6 !m nu. 1360 7.142 35.832 2.794 vol 1.614e+05
assign (resid 56 and name  HB2 )(resid  56  and name  HE* ) 4.2 2.0 1.2 !w nu266 2.801 115.079 7.002 volume 4.078e+04
assign (resid 56 and name  HB2 )(resid  56  and name  HN ) 4.2 2.0 1.2 !w nu. 1358 8.584 35.832 2.789 vol 3.304e+03
assign (resid 56 and name  HD* )(resid  55  and name  HD* ) 3.4 1.2 0.6 !m nu264 6.515 115.079 7.013 volume 1.941e+05
assign (resid 56 and name  HD* )(resid  59  and name  HG1 ) 2.7 0.7 0.3 !s nu329 2.048 130.344 7.125 volume 1.589e+03
assign (resid 56 and name  HD* )(resid  59  and name  HG2 ) 2.7 0.7 0.3 !s nu328 1.774 130.344 7.122 volume 6.860e+02
assign (resid 57 and name  HA )(resid  57  and name  HB1 ) 3.4 1.2 0.6 !m nu. 1294 3.955 39.404 1.770 vol 2.891e+05
assign (resid 57 and name  HB1 )(resid  57  and name  HD2* ) 3.4 1.2 0.6 !m nu. 1298 0.807 39.404 1.775 vol 5.844e+05
assign (resid 57 and name  HB1 )(resid  57  and name  HN ) 3.4 1.2 0.6 !m nu. 1296 8.942 39.404 1.768 vol 9.549e+04
assign (resid 57 and name  HB2 )(resid  57  and name  HA ) 3.4 1.2 0.6 !m nu. 1295 3.955 39.404 1.647 vol 3.008e+05
assign (resid 57 and name  HB2 )(resid  57  and name  HN ) 4.2 2.0 1.2 !w nu. 1297 8.934 39.404 1.647 vol 6.209e+04
assign (resid 57 and name  HG )(resid  57  and name  HD1* ) 2.7 0.7 0.4 !s nu. 1299 1.713 22.516 0.795 vol 3.453e+06
assign (resid 58 and name  HA* )(resid  61  and name  HB ) 5.1 2.5 1.5 !vw nu. 938 3.710 36.157 1.895 vol 6.590e+02
assign (resid 58 and name  HA1 )(resid  58  and name  HA2 ) 3.4 1.2 0.6 !m nu. 1268 3.973 44.926 3.711 vol 3.585e+05
assign (resid 58 and name  HA1 )(resid  58  and name  HN ) 3.4 1.2 0.6 !m nu. 1116 8.226 44.926 3.979 vol 1.389e+05
assign (resid 58 and name  HA1 )(resid  59  and name  HN ) 4.2 2.0 1.2 !w nu. 1267 7.717 44.926 3.967 vol 1.592e+03
assign (resid 58 and name  HA* )(resid  61  and name  HA   ) 5.0 2.0 0.8 
assign (resid 58 and name  HA* )(resid  61  and name  HD1* ) 3.5 4.2 1.0
assign (resid 58 and name  HA* )(resid  61  and name  HB   ) 4.0 2.0 0.8 
assign (resid 58 and name  HA* )(resid  61  and name  HG2* ) 3.7 2.0 0.8 

assign (resid 58 and name  HA2 )(resid  58  and name  HN ) 4.2 2.0 1.2 !w nu. 1115 8.226 44.926 3.722 vol 2.578e+04
assign (resid 59 and name  HA  )(resid  59  and name  HB* ) 2.7 0.7 0.4 !s nu. 1269 4.016 25.764 2.193 vol 6.927e+05
assign (resid 59 and name  HB* )(resid  59  and name  HN ) 4.2 2.0 1.2 !w nu. 1276 7.722 25.764 2.255 vol 3.702e+04
assign (resid 59 and name  HB1 )(resid  60  and name  HN ) 5.1 2.5 1.5 !vw nu. 1278 8.768 25.764 2.256 vol 6.670e+02
assign (resid 59 and name  HB2 )(resid  60  and name  HN ) 5.1 2.5 1.5 !vw nu. 1279 8.781 25.764 2.182 vol 7.110e+02
assign (resid 59 and name  HG1 )(resid  59  and name  HA ) 3.4 1.2 0.6 !m nu. 1285 4.003 30.960 2.075 vol 1.622e+05
assign (resid 59 and name  HG1 )(resid  59  and name  HE21 ) 3.4 1.2 0.6 !m nu. 1287 7.156 30.960 2.077 vol 1.459e+05
assign (resid 59 and name  HG1 )(resid  59  and name  HE22 ) 5.1 2.5 1.5 !vw nu. 1292 6.894 30.960 2.070 vol 4.040e+02
assign (resid 59 and name  HG1 )(resid  59  and name  HG2 ) 2.7 0.7 0.4 !s nu. 1280 1.793 30.960 2.079 vol 1.356e+06
assign (resid 59 and name  HG1 )(resid  59  and name  HN ) 3.4 1.2 0.6 !m nu. 1288 7.735 30.960 2.077 vol 7.330e+04
assign (resid 59 and name  HG2 )(resid  59  and name  HA ) 3.4 1.2 0.6 !m nu. 1284 4.003 30.960 1.796 vol 1.969e+05
assign (resid 59 and name  HG2 )(resid  59  and name  HE21 ) 3.4 1.2 0.6 !m nu. 1290 7.174 30.960 1.791 vol 1.272e+05
assign (resid 59 and name  HG2 )(resid  59  and name  HE22 ) 5.1 2.5 1.5 !vw nu. 1291 6.882 30.960 1.794 vol 4.650e+02
assign (resid 59 and name  HG2 )(resid  59  and name  HG1 ) 2.7 0.7 0.4 !s nu. 1282 2.073 30.960 1.794 vol 2.110e+06
assign (resid 59 and name  HG2 )(resid  59  and name  HN ) 3.4 1.2 0.6 !m nu. 1289 7.747 30.960 1.794 vol 1.403e+05
assign (resid 60 and name  HA  )(resid  63  and name  HB ) 3.4 3.4 0.8

assign (resid 60 and name  HB1 )(resid  60  and name  HE* ) 3.4 3.4 1.0 !s nu259 3.434 115.079 6.771 volume 6.350e+02
assign (resid 60 and name  HB2 )(resid  60  and name  HB1 ) 3.4 1.2 0.6 !m nu. 339 2.927 35.507 3.472 vol 3.973e+05
assign (resid 60 and name  HB2 )(resid  60  and name  HE* ) 3.4 3.4 0.9 !m nu260 2.876 115.079 6.770 volume 1.755e+05
assign (resid 60 and name  HN )(resid  60  and name  HB2 ) 4.2 2.0 1.2 !w nu. 331 8.806 35.507 3.474 vol 4.448e+04
assign (resid 60 and name  HD* )(resid  64  and name  HD* ) 3.8 4.2 0.8
assign (resid 60 and name  HD* )(resid  60  and name  HB* ) 4.2 3.0 1.0
assign (resid 61 and name  HA )(resid  61  and name  HD1* ) 3.4 1.2 0.6 !m nu. 951 3.308 11.798 0.933 vol 9.766e+04
assign (resid 61 and name  HB )(resid  61  and name  HA ) 5.1 2.5 1.5 !vw nu. 937 3.320 36.157 1.891 vol 5.820e+02
assign (resid 61 and name  HB )(resid  61  and name  HD1* ) 3.4 1.2 0.6 !m nu. 942 0.923 36.157 1.896 vol 4.081e+05
assign (resid 61 and name  HB )(resid  61  and name  HD1* ) 3.4 1.2 0.6 !m nu. 948 1.907 11.798 0.933 vol 5.053e+05
assign (resid 61 and name  HB )(resid  61  and name  HG2* ) 3.4 1.2 0.6 !m nu. 943 0.758 36.157 1.897 vol 3.399e+05
assign (resid 61 and name  HB )(resid  61  and name  HN ) 3.4 1.2 0.6 !m nu. 941 8.480 36.157 1.898 vol 8.136e+04
assign (resid 61 and name  HB )(resid  62  and name  HN ) 4.2 2.0 1.2 !w nu. 940 7.963 36.157 1.897 vol 1.789e+04
assign (resid 61 and name  HB )(resid  75  and name  HG1* ) 4.2 4.2 1.0
assign (resid 61 and name  HB )(resid  75  and name  HG2* ) 4.2 4.2 1.0

assign (resid 61 and name  HD1* )(resid  60  and name  HN ) 4.2 2.0 1.2 !w nu. 957 8.476 11.798 0.930 vol 6.093e+04
assign (resid 61 and name  HD1* )(resid  62  and name  HE* ) 5.1 2.5 1.5 !vw nu. 963 0.975 13.746 1.970 vol 3.290e+02
assign (resid 61 and name  HD1* )(resid  75  and name  HG1* ) 3.2 1.2 0.8
assign (resid 61 and name  HD1* )(resid  75  and name  HG2* ) 3.2 1.2 0.8
assign (resid 61 and name  HD1* )(resid  82  and name  HD2* ) 4.2 2.0 1.2 !w nu. 944 0.053 11.798 0.932 vol 1.624e+03
assign (resid 61 and name  HD1* )(resid  91  and name  HD* ) 3.4 1.2 0.6 !m nu. 955 6.893 11.798 0.931 vol 9.089e+04
assign (resid 61 and name  HD1* )(resid  91  and name  HE* ) 3.4 1.2 0.6 !m nu. 954 7.028 11.798 0.932 vol 5.083e+05


assign (resid 61 and name  HG1* )(resid  61  and name  HD1* ) 3.4 1.2 0.6 !m nu. 947 1.721 11.798 0.933 vol 2.315e+05
assign (resid 61 and name  HG2* )(resid  61  and name  HN ) 3.4 1.2 0.6 !m nu. 1058 8.466 15.370 0.745 vol 8.031e+04
assign (resid 61 and name  HG2* )(resid  62  and name  HE* ) 5.1 2.5 1.5 !vw nu. 962 0.743 13.746 1.970 vol 5.410e+02
assign (resid 61 and name  HG2* )(resid  91  and name  HD* ) 3.4 1.2 0.6 !m nu. 1055 6.905 15.370 0.744 vol 5.230e+05
assign (resid 61 and name  HG2* )(resid  67  and name  HB1 ) 3.8 2.0 0.6
assign (resid 61 and name  HG2* )(resid  67  and name  HB2 ) 3.4 2.0 0.6
assign (resid 62 and name  HA  )(resid  65  and name  HA   ) 5.1 5.1 1.0
assign (resid 62 and name  HB* )(resid  63  and name  HA   ) 4.5 2.0 1.0
assign (resid 62 and name  HE* )(resid  63  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 1342 1.962 18.618 1.312 vol 3.320e+02
assign (resid 62 and name  HE* )(resid  63  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 964 1.308 13.746 1.970 vol 6.460e+02
assign (resid 62 and name  HG* )(resid  63  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 1143 2.661 18.618 1.311 vol 5.710e+02
assign (resid 63 and name  HA )(resid  63  and name  HG2* ) 2.7 0.7 0.4 !s nu. 1140 4.076 18.618 1.309 vol 1.335e+06
assign (resid 63 and name  HA )(resid  64  and name  HG*  ) 4.2 2.7 0.6

assign (resid 63 and name  HB )(resid  63  and name  HG2* ) 2.7 0.7 0.4 !s nu. 1139 4.150 18.618 1.309 vol 9.298e+05
assign (resid 63 and name  HB )(resid  64  and name  HG*  ) 4.2 2.7 0.6
assign (resid 63 and name  HG2* )(resid  63  and name  HN ) 3.4 1.2 0.6 !m nu. 1134 8.633 18.618 1.309 vol 2.243e+05
assign (resid 63 and name  HG2* )(resid  64  and name  HN ) 4.2 2.0 1.2 !w nu. 1135 7.899 18.618 1.308 vol 5.335e+04
assign (resid 63 and name  HG2* )(resid  65  and name  HN ) 5.1 2.5 1.5 !vw nu. 1136 7.618 18.618 1.308 vol 5.650e+02
assign (resid 64 and name  HA )(resid  64  and name  HD1 ) 3.4 1.2 0.6 !m nu. 1005 4.123 24.789 1.353 vol 1.954e+05
assign (resid 64 and name  HA )(resid  64  and name  HD2 ) 3.4 1.2 0.6 !m nu. 1006 4.123 24.789 1.228 vol 1.310e+05
assign (resid 64 and name  HA  )(resid  65  and name  HA   ) 5.1 5.1 1.0
assign (resid 64 and name  HB1 )(resid  64  and name  HA ) 3.4 1.2 0.6 !m nu. 1147 4.120 28.037 1.644 vol 1.577e+05
assign (resid 64 and name  HB1 )(resid  64  and name  HB2 ) 2.7 0.7 0.4 !s nu. 1155 1.332 28.037 1.640 vol 1.010e+06
assign (resid 64 and name  HB1 )(resid  64  and name  HE* ) 3.4 1.2 0.6 !m nu. 1159 2.921 28.037 1.653 vol 1.225e+05
assign (resid 64 and name  HB1 )(resid  64  and name  HG* ) 3.4 1.2 0.6 !m nu. 1150 0.945 28.037 1.640 vol 3.094e+05
assign (resid 64 and name  HB1 )(resid  64  and name  HN ) 4.2 2.0 1.2 !w nu. 1145 7.890 28.037 1.636 vol 6.543e+04
assign (resid 64 and name  HB1 )(resid  66  and name  HD2* ) 3.4 1.2 0.6 !m nu. 1160 1.628 18.618 0.816 vol 1.691e+05
assign (resid 64 and name  HB2 )(resid  64  and name  HA ) 4.2 2.0 1.2 !w nu. 1148 4.106 28.037 1.333 vol 5.272e+03
assign (resid 64 and name  HB2 )(resid  64  and name  HG* ) 3.4 1.2 0.6 !m nu. 1152 0.918 28.037 1.324 vol 2.485e+05
assign (resid 64 and name  HB2 )(resid  64  and name  HN ) 4.2 2.0 1.2 !w nu. 1156 7.883 28.037 1.327 vol 3.533e+04
assign (resid 64 and name  HD1 )(resid  64  and name  HE* ) 3.4 1.2 0.6 !m nu. 1008 2.881 24.789 1.355 vol 1.666e+05
assign (resid 64 and name  HD2 )(resid  64  and name  HE* ) 3.4 1.2 0.6 !m nu. 1007 2.901 24.789 1.232 vol 2.146e+05
assign (resid 64 and name  HG1 )(resid  64  and name  HA ) 3.4 1.2 0.6 !m nu. 1168 4.127 21.866 0.976 vol 1.701e+05
assign (resid 64 and name  HG1 )(resid  64  and name  HA ) 4.2 2.0 1.2 !w nu. 1166 7.900 21.866 0.975 vol 5.750e+04
assign (resid 64 and name  HG2 )(resid  64  and name  HA ) 2.7 0.7 0.4 !s nu. 66 4.113 21.867 0.888 vol 6.636e+05
assign (resid 64 and name  HG2 )(resid  64  and name  HN ) 3.4 1.2 0.6 !m nu. 1167 7.890 21.866 0.886 vol 1.690e+05
assign (resid 64 and name  HD* )(resid  66  and name  HD1* or resid  66  and name  HD2*) 3.8 3.4 0.8

assign (resid 64 and name  HN )(resid  64  and name  HD2 ) 5.1 2.5 1.5 !vw nu. 1011 7.926 24.789 1.231 vol 4.070e+02
assign (resid 65 and name  HA  )(resid  66  and name  HD1*   ) 4.5 4.1 1.0
assign (resid 65 and name  HA  )(resid  66  and name  HD2*   ) 4.5 4.1 1.0
assign (resid 66 and name  HA )(resid  66  and name  HD2* ) 2.7 0.7 0.4 !s nu. 1165 4.455 18.618 0.817 vol 9.561e+05

assign (resid 66 and name  HB1 )(resid  66  and name  HD2* ) 2.7 0.7 0.4 !s nu. 1205 2.002 18.618 0.818 vol 1.106e+06
assign (resid 66 and name  HB1 )(resid  66  and name  HN ) 5.1 2.5 1.5 !vw nu. 961 7.666 39.404 1.996 vol 7.280e+02
assign (resid 66 and name  HB1 )(resid  75  and name  HG1* ) 3.4 1.2 0.6 !m nu. 1111 1.999 19.917 0.342 vol 1.024e+05
assign (resid 66 and name  HB1 )(resid  75  and name  HG2* ) 4.5 4.2 1.8 !w nu. 1114 1.985 19.917 0.436 vol 2.886e+04
assign (resid 66 and name  HB2 )(resid  66  and name  HA ) 4.2 2.0 1.2 !w nu. 1099 4.458 39.404 1.366 vol 3.641e+04
assign (resid 66 and name  HB2 )(resid  66  and name  HN ) 4.2 2.0 1.2 !w nu. 1098 7.695 39.404 1.374 vol 1.142e+04
assign (resid 66 and name  HB2 )(resid  75  and name  HG1* ) 3.4 1.2 0.6 !m nu. 1112 1.371 19.917 0.340 vol 2.175e+05
assign (resid 66 and name  HB2 )(resid  75  and name  HG2* ) 4.2 3.4 0.6 !m nu. 1113 1.348 19.917 0.433 vol 7.202e+04
assign (resid 66 and name  HD2* )(resid  66  and name  HN ) 3.4 1.2 0.6 !m nu. 1162 7.693 18.618 0.819 vol 8.386e+04
assign (resid 66 and name  HD2* )(resid  80  and name  HB* ) 3.2 2.0 0.6 !m nu. 1203 2.432 18.618 0.809 vol 1.200e+05
assign (resid 66 and name  HD1* )(resid  80  and name  HB* ) 3.2 2.0 0.6
assign (resid 66 and name  HD2* )(resid  80  and name  HA  ) 3.5 3.4 0.6
assign (resid 66 and name  HD1* )(resid  80  and name  HA  ) 3.5 3.4 0.6
assign (resid 66 and name  HN )(resid  67  and name  HD* )  2.7 0.7 0.3 !s nu322 7.678 130.344 6.914 volume 8.070e+02
assign (resid 66 and name  HN )(resid  67  and name  HE* )  4.2 2.0 1.2 !w nu332 7.657 115.404 6.831 volume 2.899e+04
assign (resid 67 and name  HA )(resid  67  and name  HB1 ) 4.2 2.0 1.2 !w nu. 1123 5.102 36.481 3.061 vol 3.788e+04
assign (resid 67 and name  HA )(resid  67  and name  HB2 ) 4.2 2.0 1.2 !w nu. 1119 5.110 36.481 2.641 vol 3.948e+04
assign (resid 67 and name  HA )(resid  67  and name  HD* ) 4.2 2.0 1.2 !w nu309 5.085 130.344 6.916 volume 2.935e+04
assign (resid 67 and name  HA )(resid  68  and name  HB2 ) 4.5 2.2 1.0
assign (resid 67 and name  HA )(resid  72  and name  HA  )   3.5 2.0 1.0
assign (resid 67 and name  HA )(resid  75  and name  HA  )   2.5 2.0 0.8
assign (resid 67 and name  HA )(resid  75  and name  HG1*  ) 3.5 2.0 0.8
assign (resid 67 and name  HA )(resid  75  and name  HG2*  ) 3.5 2.0 0.8

assign (resid 67 and name  HB1 )(resid  67  and name  HD* ) 3.4 1.2 0.6 !m nu314 3.043 130.344 6.913 volume 4.428e+05
assign (resid 67 and name  HB1 )(resid  67  and name  HN ) 5.1 2.5 1.5 !vw nu. 1121 8.693 36.481 3.059 vol 5.800e+02
assign (resid 67 and name  HB* )(resid  69  and name  HA   ) 4.5 2.0 1.2
assign (resid 67 and name  HB* )(resid  72  and name  HA   ) 3.5 2.0 0.8
assign (resid 67 and name  HB1 )(resid  75  and name  HG2* ) 4.2 2.0 1.0 !vw nu. 1126 0.442 36.481 3.059 vol 6.520e+02
assign (resid 67 and name  HB2 )(resid  75  and name  HG2* ) 4.2 2.0 1.0 !vw nu. 1129 3.015 19.917 0.436 vol 6.710e+02
assign (resid 67 and name  HB1 )(resid  75  and name  HA  ) 3.8 2.0 2.1
assign (resid 67 and name  HB2 )(resid  75  and name  HA  ) 3.8 2.0 0.8

assign (resid 67 and name  HB2 )(resid  67  and name  HB1 )  2.7 0.7 0.4 !s nu. 1124 2.648 36.481 3.059 vol 6.700e+05
assign (resid 67 and name  HB2 )(resid  67  and name  HD* ) 3.4 1.2 0.6 !m nu315 2.629 130.344 6.914 volume 2.169e+05
assign (resid 67 and name  HB2 )(resid  67  and name  HN ) 5.1 2.5 1.5 !vw nu. 1117 8.685 36.481 2.649 vol 5.920e+02
assign (resid 67 and name  HB2 )(resid  75  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 1127 0.451 36.481 2.647 vol 5.260e+02
assign (resid 67 and name  HB2 )(resid  75  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 1128 2.645 19.917 0.438 vol 6.640e+02
assign (resid 67 and name  HD* )(resid  67  and name  HB1 ) 3.4 1.2 0.6 !m nu. 1122 6.927 36.481 3.063 vol 4.279e+05
assign (resid 67 and name  HD* )(resid  67  and name  HB2 ) 3.4 1.2 0.6 !m nu. 1118 6.927 36.481 2.641 vol 2.333e+05

assign (resid 67 and name  HD* )(resid  69  and name  HA ) 3.5 2.0 0.8 !w nu312 4.009 130.344 6.918 volume 5.017e+04
assign (resid 67 and name  HD* )(resid  72  and name  HA )  3.2 3.4 0.6 !m nu311 4.451 130.344 6.916 volume 2.568e+05
assign (resid 67 and name  HD* )(resid  72  and name  HB* ) 4.2 2.0 1.2 !w nu317 1.884 130.344 6.917 volume 8.580e+04
assign (resid 67 and name  HD* )(resid  72  and name  HB1 ) 4.2 2.0 1.2 !w nu. 1132 6.901 24.789 1.913 vol 2.951e+04
assign (resid 67 and name  HD* )(resid  72  and name  HG* ) 4.2 2.0 1.2 !w nu316 2.409 130.344 6.916 volume 8.734e+04
assign (resid 67 and name  HD* )(resid  75  and name  HA  ) 4.2 2.2 1.2

assign (resid 67 and name  HE* )(resid  69  and name  HA )  3.5 3.4 0.6 !m nu331 4.017 115.404 6.826 volume 1.410e+05
assign (resid 67 and name  HE* )(resid  72  and name  HA )  3.2 3.4 0.6
assign (resid 67 and name  HN )(resid  67  and name  HD* )  4.2 2.0 1.2 !w nu323 8.699 130.344 6.915 volume 1.525e+04
assign (resid 68 and name  HA )(resid  69  and name  HA  )  4.5 2.7 0.6
assign (resid 68 and name  HA )(resid  76  and name  HD* )  2.7 0.7 0.3 !s nu334 4.496 130.020 7.101 volume 9.430e+03
assign (resid 68 and name  HA )(resid  76  and name  HE* )  3.4 1.2 0.6 !m nu335 4.485 115.404 6.770 volume 1.777e+05
assign (resid 68 and name  HB1 )(resid  68  and name  HA ) 3.4 1.2 0.6 !m nu. 1177 4.515 40.054 3.252 vol 7.394e+04
assign (resid 68 and name  HB1 )(resid  68  and name  HB2 ) 3.4 1.2 0.6 !m nu. 1173 3.246 40.054 2.425 vol 4.737e+05
assign (resid 68 and name  HB1 )(resid  68  and name  HN ) 3.4 1.2 0.6 !m nu. 1178 8.682 40.054 3.251 vol 1.471e+05
assign (resid 68 and name  HB1 )(resid  72  and name  HA ) 3.8 3.4 1.0

assign (resid 68 and name  HB1 )(resid  74  and name  HB ) 4.2 2.0 1.2 !w nu. 1190 3.237 34.208 1.769 vol 5.029e+03
assign (resid 68 and name  HB1 )(resid  74  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 1175 0.304 40.054 3.249 vol 6.350e+02
assign (resid 68 and name  HB2 )(resid  68  and name  HA ) 4.2 2.0 1.2 !w nu. 1174 4.523 40.054 2.425 vol 6.188e+04
assign (resid 68 and name  HB2 )(resid  68  and name  HN ) 3.4 1.2 0.6 !m nu. 1180 8.682 40.054 2.422 vol 1.625e+05
assign (resid 68 and name  HB2 )(resid  74  and name  HB ) 4.2 2.0 1.2 !w nu. 1172 1.780 40.054 2.426 vol 1.611e+03
assign (resid 68 and name  HB2 )(resid  74  and name  HB ) 4.2 2.0 1.2 !w nu. 1189 2.400 34.208 1.772 vol 6.123e+03
assign (resid 68 and name  HB2 )(resid  74  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 1171 0.298 40.054 2.430 vol 6.130e+02
assign (resid 69 and name  HA  )(resid  72  and name  HG* ) 3.2 1.5 0.6 

assign (resid 70 and name  HA )(resid  70  and name  HG1 ) 3.4 1.2 0.6 !m nu. 1014 4.418 22.191 1.526 vol 1.583e+05
assign (resid 70 and name  HA )(resid  70  and name  HG2 ) 3.4 1.2 0.6 !m nu. 1015 4.418 22.191 1.437 vol 2.312e+05
assign (resid 72 and name  HA )(resid  72  and name  HB1 ) 3.4 1.2 0.6 !m nu. 1131 4.413 24.789 1.908 vol 4.289e+05
assign (resid 72 and name  HB1 )(resid  72  and name  HN ) 4.2 2.0 1.2 !w nu. 1133 8.353 24.789 1.914 vol 4.154e+04
assign (resid 72 and name  HB1 )(resid  73  and name  HN ) 5.1 2.5 1.5 !vw nu. 1130 7.810 24.789 1.917 vol 6.020e+02
assign (resid 73 and name  HA )(resid  73  and name  HB1 ) 3.4 1.2 0.6 !m nu. 890 4.574 28.037 3.244 vol 1.119e+05
assign (resid 73 and name  HA )(resid  73  and name  HB2 ) 3.4 1.2 0.6 !m nu. 894 4.584 28.037 2.982 vol 1.831e+05
assign (resid 73 and name  HA )(resid  93  and name  HB ) 5.1 2.5 1.5 !vw nu. 1086 4.549 28.362 2.502 vol 6.250e+02
assign (resid 73 and name  HA )(resid  93  and name  HG1* ) 3.4 1.2 0.6 !m nu. 872 4.592 16.994 1.152 vol 4.387e+05
assign (resid 73 and name  HA )(resid  93  and name  HG2* ) 4.2 2.0 1.2 !w nu. 1097 4.584 19.268 1.104 vol 4.654e+04
assign (resid 73 and name  HB* )(resid  94  and name  HE* ) 4.5 2.1 1.0 !vw
assign (resid 73 and name  HB1 )(resid  73  and name  HB2 ) 3.4 1.2 0.6 !m nu. 896 3.245 28.037 2.983 vol 5.582e+05
assign (resid 73 and name  HB1 )(resid  74  and name  HD1* ) 5.1 2.5 1.5 !vw nu. 704 3.267 8.225 0.609 vol 6.130e+02
assign (resid 73 and name  HB1 )(resid  74  and name  HG2* ) 4.2 2.0 1.2 !w nu. 1344 3.234 13.746 0.267 vol 2.625e+04
assign (resid 73 and name  HB1 )(resid  93  and name  HB ) 5.1 2.5 1.5 !vw nu. 888 2.507 28.037 3.256 vol 6.950e+02
assign (resid 73 and name  HB1 )(resid  93  and name  HG1* ) 3.4 1.2 0.6 !m nu. 869 3.233 16.994 1.152 vol 1.858e+05
assign (resid 73 and name  HB1 )(resid  94  and name  HG* ) 4.1 2.1 1.0 !vw
assign (resid 73 and name  HB2 )(resid  73  and name  HN ) 5.1 2.5 1.5 !vw nu. 902 7.827 28.037 2.992 vol 7.180e+02
assign (resid 73 and name  HB2 )(resid  94  and name  HG* ) 3.3 2.0 1.0 !vw
assign (resid 73 and name  HB2* )(resid  93  and name  HG1* ) 3.4 1.2 0.6 !m nu. 868 2.978 16.994 1.153 vol 1.439e+05
assign (resid 73 and name  HN  )(resid  93  and name  HG1* ) 3.4 3.4 0.8 !m
assign (resid 73 and name  HN )(resid  74  and name  HD1* ) 5.1 2.5 1.5 !vw nu. 715 7.846 8.225 0.613 vol 7.910e+02
assign (resid 74 and name  HB )(resid  74  and name  HD1* ) 3.4 1.2 0.6 !m nu. 1192 0.591 34.208 1.771 vol 1.906e+05
assign (resid 74 and name  HB )(resid  74  and name  HD1* ) 3.4 1.2 0.6 !m nu. 701 1.811 8.225 0.613 vol 3.676e+05
assign (resid 74 and name  HB )(resid  74  and name  HG1* ) 4.2 2.0 1.2 !w nu. 1193 0.811 34.208 1.772 vol 5.925e+04
assign (resid 74 and name  HB )(resid  74  and name  HN ) 3.4 1.2 0.6 !m nu. 1195 7.762 34.208 1.774 vol 8.886e+04
assign (resid 74 and name  HD1* )(resid  74  and name  HG2* ) 2.7 0.7 0.4 !s nu. 697 0.268 8.225 0.615 vol 6.155e+05
assign (resid 74 and name  HD1* )(resid  75  and name  HN ) 4.2 2.0 1.2 !w nu. 716 8.407 8.225 0.615 vol 4.636e+04
assign (resid 74 and name  HD1* )(resid  76  and name  HD* ) 4.2 2.0 1.2 !w nu. 713 7.088 8.225 0.614 vol 4.579e+04
assign (resid 74 and name  HD1* )(resid  76  and name  HE* ) 5.1 2.5 1.5 !vw nu. 933 6.784 8.225 0.614 vol 4.130e+02
assign (resid 74 and name  HD1* )(resid  92  and name  HA ) 3.4 1.2 0.6 !m nu. 711 5.615 8.225 0.614 vol 9.454e+04
assign (resid 74 and name  HD1* )(resid  92  and name  HB1 ) 3.4 1.2 0.6 !m nu. 706 3.960 8.225 0.615 vol 1.099e+05
assign (resid 74 and name  HD1* )(resid  92  and name  HB2 ) 4.2 2.0 1.2 !w nu. 705 3.818 8.225 0.615 vol 6.667e+04
assign (resid 74 and name  HD1* )(resid  93  and name  HG2* ) 5.1 2.5 1.5 !vw nu. 700 1.124 8.225 0.615 vol 5.020e+02
assign (resid 74 and name  HD1* )(resid  93  and name  HN ) 5.1 2.5 1.5 !vw nu. 717 9.523 8.225 0.612 vol 5.670e+02
assign (resid 74 and name  HG1* )(resid  74  and name  HD1* ) 3.4 1.2 0.6 !m nu. 699 0.824 8.225 0.615 vol 4.116e+05
assign (resid 74 and name  HG2* )(resid  74  and name  HB ) 3.4 1.2 0.6 !m nu. 1191 0.266 34.208 1.767 vol 2.699e+05
assign (resid 74 and name  HG2* )(resid  74  and name  HB ) 3.4 1.2 0.6 !m nu. 1345 1.770 13.746 0.268 vol 4.387e+05
assign (resid 74 and name  HG2* )(resid  74  and name  HD1* ) 2.7 0.7 0.4 !s nu. 631 0.600 13.746 0.268 vol 9.113e+05
assign (resid 74 and name  HG2* )(resid  74  and name  HG1* ) 3.4 1.2 0.6 !m nu. 632 0.806 13.746 0.269 vol 1.562e+05
assign (resid 74 and name  HG2* )(resid  75  and name  HN ) 3.4 1.2 0.6 !m nu. 926 8.411 13.746 0.267 vol 2.192e+05
assign (resid 74 and name  HG2* )(resid  76  and name  HD* ) 4.2 2.0 1.2 !w nu. 922 6.787 13.746 0.266 vol 3.699e+04
assign (resid 74 and name  HG2* )(resid  76  and name  HD* ) 4.2 2.0 1.2 !w nu. 923 7.128 13.746 0.268 vol 8.734e+03
assign (resid 74 and name  HG2* )(resid  76  and name  HD* ) 4.2 2.0 1.2 !w nu247 0.256 130.020 7.105 volume 7.386e+04
assign (resid 74 and name  HG2* )(resid  92  and name  HA ) 5.1 2.5 1.5 !vw nu. 1343 5.633 13.746 0.273 vol 7.270e+02
assign (resid 74 and name  HN )(resid  74  and name  HD1* ) 3.8 3.8 0.6 !m nu. 714 7.754 8.225 0.614 vol 8.300e+04
assign (resid 74 and name  HN )(resid  74  and name  HG2* ) 4.2 2.0 1.2 !w nu. 924 7.746 13.746 0.269 vol 2.014e+04
assign (resid 75 and name  HA )(resid  75  and name  HB ) 5.1 2.5 1.5 !vw nu. 903 3.801 29.661 0.358 vol 6.050e+02
assign (resid 75 and name  HA )(resid  75  and name  HG1* ) 3.4 1.2 0.6 !m nu. 916 3.817 19.593 0.340 vol 2.036e+05
assign (resid 75 and name  HA )(resid  75  and name  HG2* ) 3.4 1.2 0.6 !m nu. 917 3.824 19.593 0.431 vol 1.650e+05
assign (resid 75 and name  HB )(resid  74  and name  HA ) 5.1 2.5 1.5 !vw nu. 904 4.137 29.661 0.361 vol 4.140e+02
assign (resid 75 and name  HB )(resid  75  and name  HN ) 4.2 2.0 1.2 !w nu. 907 8.391 29.661 0.364 vol 9.503e+03
assign (resid 75 and name  HB )(resid  91  and name  HD* ) 5.1 2.5 1.5 !vw nu. 906 6.925 29.661 0.367 vol 3.970e+02
assign (resid 75 and name  HG1* )(resid  75  and name  HA ) 4.2 2.0 1.2 !w nu. 1109 3.825 19.917 0.343 vol 3.003e+04
assign (resid 75 and name  HG1* )(resid  75  and name  HG2* ) 2.7 0.7 0.4 !s nu. 880 0.434 19.917 0.432 vol 1.088e+07
assign (resid 75 and name  HG1* )(resid  75  and name  HN ) 3.4 1.2 0.6 !m nu. 1102 8.404 19.917 0.343 vol 1.570e+05
assign (resid 75 and name  HG1* )(resid  75  and name  HN ) 3.4 1.2 0.6 !m nu. 910 8.397 19.593 0.338 vol 3.260e+05
assign (resid 75 and name  HG1* )(resid  91  and name  HD* ) 3.4 1.2 0.6 !m nu. 913 6.908 19.593 0.340 vol 9.040e+04
assign (resid 75 and name  HG1* )(resid  91  and name  HE* ) 3.4 1.2 0.6 !m nu. 912 7.042 19.593 0.338 vol 2.632e+05
assign (resid 75 and name  HG2* )(resid  75  and name  HA ) 3.4 1.2 0.6 !m nu. 1110 3.821 19.917 0.433 vol 9.530e+04
assign (resid 75 and name  HG2* )(resid  75  and name  HN ) 3.4 1.2 0.6 !m nu. 1103 8.404 19.917 0.431 vol 9.867e+04
assign (resid 75 and name  HG2* )(resid  75  and name  HN ) 3.4 1.2 0.6 !m nu. 911 8.405 19.593 0.431 vol 2.163e+05
assign (resid 75 and name  HG2* )(resid  91  and name  HD* ) 3.4 1.2 0.6 !m nu. 914 6.923 19.593 0.431 vol 1.222e+05
assign (resid 75 and name  HG2* )(resid  91  and name  HE* ) 3.4 1.2 0.6 !m nu. 915 7.027 19.593 0.428 vol 1.565e+05
assign (resid 75 and name  HG2* )(resid  93  and name  HA )  4.2 2.0 1.0
assign (resid 76 and name  HA  )(resid  90  and name  HA  )  3.2 2.4 0.6
assign (resid 76 and name  HA  )(resid  90  and name  HB*  ) 3.2 2.4 0.6
assign (resid 76 and name  HB1 )(resid  76  and name  HD* ) 3.4 1.2 0.6 !m nu. 919 7.120 36.157 3.215 vol 3.706e+05
assign (resid 76 and name  HB1 )(resid  76  and name  HD* ) 3.4 1.2 0.6 !m nu244 3.196 130.020 7.104 volume 6.050e+05
assign (resid 76 and name  HB1 )(resid  76  and name  HN ) 3.4 1.2 0.6 !m nu. 918 8.421 36.157 3.223 vol 3.106e+05
assign (resid 76 and name  HB2 )(resid  76  and name  HD* ) 3.4 1.2 0.6 !m nu. 921 7.113 36.157 2.859 vol 4.274e+05
assign (resid 76 and name  HB2 )(resid  76  and name  HD* ) 3.4 1.2 0.6 !m nu243 2.844 130.020 7.106 volume 8.548e+05
assign (resid 76 and name  HB2 )(resid  76  and name  HN ) 3.4 1.2 0.6 !m nu. 920 8.414 36.157 2.860 vol 2.154e+05
assign (resid 76 and name  HB* )(resid  90  and name  HA )  4.2 3.4 0.6
assign (resid 76 and name  HD* )(resid  76  and name  HE* ) 2.7 0.7 0.3 !s nu283 6.795 130.020 7.104 volume 3.406e+06
assign (resid 76 and name  HD* )(resid  76  and name  HN )  3.4 1.2 0.6 !m nu246 8.405 130.020 7.104 volume 1.058e+05
assign (resid 76 and name  HD* )(resid  90  and name  HA )  2.7 0.7 0.3 !s nu256 5.492 130.020 7.101 volume 5.900e+02
assign (resid 76 and name  HD* )(resid  90  and name  HB1 ) 3.4 1.2 0.6 !m nu255 3.970 130.020 7.111 volume 7.011e+05
assign (resid 76 and name  HD* )(resid  90  and name  HB2 ) 4.2 2.0 1.2 !w nu245 3.689 130.020 7.107 volume 7.170e+04
assign (resid 76 and name  HE* )(resid  74  and name  HD1* ) 4.2 2.0 1.2 !w nu253 0.601 115.404 6.764 volume 5.742e+04
assign (resid 76 and name  HE* )(resid  74  and name  HG1* ) 3.4 1.2 0.6 !m nu333 0.796 115.404 6.768 volume 9.169e+05
assign (resid 76 and name  HE* )(resid  74  and name  HG2* ) 4.2 2.0 1.2 !w nu252 0.258 115.404 6.768 volume 9.213e+04
assign (resid 76 and name  HE* )(resid  76  and name  HB1 ) 3.4 3.4 1.6 !m nu251 3.216 115.404 6.765 volume 1.350e+05
assign (resid 76 and name  HE* )(resid  76  and name  HB2 ) 3.4 3.4 1.6 !m nu250 2.868 115.404 6.768 volume 1.247e+05
assign (resid 76 and name  HE* )(resid  76  and name  HD* ) 2.7 0.7 0.3 !s nu249 7.097 115.404 6.767 volume 3.361e+06
assign (resid 76 and name  HE* )(resid  76  and name  HN )  2.7 2.7 1.3 !s nu248 8.428 115.404 6.770 volume 7.737e+03
assign (resid 77 and name  HB1 )(resid  82  and name  HB1 ) 3.2 2.0 0.6 !s
assign (resid 8 and name  HA )(resid  9  and name  HD1 ) 2.7 0.7 0.4 !s nu. 572 4.443 48.174 3.873 vol 1.228e+06
assign (resid 8 and name  HA )(resid  9  and name  HD2 ) 3.4 1.2 0.6 !m nu. 573 4.443 48.174 3.689 vol 5.424e+05
assign (resid 8 and name  HG1* )(resid  9  and name  HD1 ) 4.2 2.0 1.2 !w nu. 576 0.980 48.174 3.873 vol 2.532e+04
assign (resid 8 and name  HG1* )(resid  9  and name  HD2 ) 3.4 1.2 0.6 !m nu. 577 0.974 48.174 3.686 vol 7.453e+04
assign (resid 80 and name  HB* )(resid  80  and name  HN ) 3.4 1.2 0.6 !m nu. 1196 7.728 44.601 2.454 vol 7.120e+04

assign (resid 80 and name  HB* )(resid  82  and name  HB1 ) 4.2 3.0 1.0 !vw nu. 1201 1.608 44.601 2.465 vol 5.360e+02
assign (resid 80 and name  HB* )(resid  82  and name  HB2 ) 4.2 3.0 1.0 !vw nu. 1206 2.440 39.729 1.621 vol 7.400e+02
assign (resid 82 and name  HA )(resid  85  and name  HB2 ) 5.1 2.5 1.5 !vw nu. 771 3.635 38.755 1.413 vol 6.860e+02
assign (resid 82 and name  HA )(resid  85  and name  HD1* ) 5.1 2.5 1.5 !vw nu. 802 3.636 21.866 0.640 vol 5.330e+02
assign (resid 82 and name  HA )(resid  85  and name  HD2* ) 3.4 1.2 0.6 !m nu. 1239 3.646 23.165 0.588 vol 7.247e+04
assign (resid 82 and name  HA )(resid  85  and name  HG ) 4.2 2.0 1.2 !w nu. 784 3.649 23.815 1.638 vol 8.542e+03
assign (resid 82 and name  HB1 )(resid  82  and name  HD2* ) 3.4 1.2 0.6 !m nu. 378 0.090 39.729 1.613 vol 1.895e+05
assign (resid 82 and name  HB1 )(resid  82  and name  HN ) 4.2 2.0 1.2 !w nu. 384 9.897 39.729 1.616 vol 4.799e+04
assign (resid 82 and name  HB1 )(resid  83  and name  HN ) 5.1 2.5 1.5 !vw nu. 696 7.804 39.729 1.626 vol 4.970e+02
assign (resid 82 and name  HB2 )(resid  82  and name  HD2* ) 3.4 1.2 0.6 !m nu. 377 0.065 39.729 1.447 vol 1.243e+05
assign (resid 82 and name  HB2 )(resid  82  and name  HN ) 4.2 2.0 1.2 !w nu. 383 9.872 39.729 1.457 vol 4.845e+04
assign (resid 82 and name  HB2 )(resid  91  and name  HE* )  2.7 0.7 0.3 !s nu302 1.432 127.096 7.042 volume 5.300e+02
assign (resid 82 and name  HB2 )(resid  91  and name  HE* ) 5.1 2.5 1.5 !vw nu. 1054 7.061 39.729 1.458 vol 3.440e+02
assign (resid 82 and name  HD1* )(resid  82  and name  HA ) 4.2 2.0 1.2 !w nu. 356 3.639 23.165 0.745 vol 8.390e+03
assign (resid 82 and name  HD1* )(resid  91  and name  HE* ) 3.4 1.2 0.6 !m nu. 360 7.046 23.165 0.741 vol 2.614e+05
assign (resid 82 and name  HD1* )(resid  91  and name  HE* ) 5.1 2.5 1.5 !vw nu. 364 7.053 19.917 0.064 vol 5.470e+02
assign (resid 82 and name  HD2* )(resid  82  and name  HD1* ) 2.7 0.7 0.4 !s nu. 349 0.068 23.165 0.742 vol 6.347e+05
assign (resid 82 and name  HD2* )(resid  82  and name  HN ) 5.1 2.5 1.5 !vw nu. 367 9.841 19.917 0.073 vol 4.200e+02
assign (resid 82 and name  HD2* )(resid  85  and name  HA  ) 4.0 3.4 0.9
assign (resid 82 and name  HD2* )(resid  85  and name  HB1 ) 3.4 1.2 0.6 !m nu. 773 0.081 38.755 1.590 vol 1.016e+05
assign (resid 82 and name  HD2* )(resid  85  and name  HB2 ) 4.2 2.0 1.2 !w nu. 774 0.081 38.755 1.407 vol 2.666e+04
assign (resid 82 and name  HD2* )(resid  85  and name  HD1* ) 3.4 1.2 0.6 !m nu. 793 0.075 21.866 0.637 vol 1.978e+05
assign (resid 82 and name  HD2* )(resid  85  and name  HD2* ) 3.4 1.2 0.6 !m nu. 1232 0.074 23.165 0.587 vol 2.707e+05
assign (resid 82 and name  HD2* )(resid  85  and name  HG ) 5.1 2.5 1.5 !vw nu. 787 0.088 23.815 1.633 vol 6.360e+02
assign (resid 82 and name  HD2* )(resid  91  and name  HE* ) 2.7 0.7 0.3 !s nu303 0.073 127.096 7.041 volume 4.900e+02
assign (resid 82 and name  HN )(resid  82  and name  HD1* ) 5.1 2.5 1.5 !vw nu. 1052 9.922 23.165 0.739 vol 5.090e+02
assign (resid 83 and name  HA* )(resid  83  and name  HN ) 3.4 1.2 0.6 !m nu. 1300 7.786 44.926 4.154 vol 1.193e+05
assign (resid 83 and name  HA1 )(resid  83  and name  HA2 ) 3.0 3.0 0.6 !m nu. 1301 4.161 44.926 4.151 vol 5.587e+05
assign (resid 83 and name  HA* )(resid  86  and name  HB*  ) 4.2 3.0 0.8
assign (resid 83 and name  HA* )(resid  88  and name  HG2* ) 5.0 3.0 1.0

assign (resid 84 and name  HB1 )(resid  84  and name  HA ) 3.4 1.2 0.6 !m nu. 1209 4.443 37.131 2.933 vol 2.370e+05
assign (resid 84 and name  HB1 )(resid  84  and name  HA ) 3.4 1.2 0.6 !m nu. 1213 4.435 37.131 2.692 vol 4.073e+05
assign (resid 84 and name  HB1 )(resid  84  and name  HN ) 3.4 1.2 0.6 !m nu. 1208 7.571 37.131 2.932 vol 9.642e+04
assign (resid 84 and name  HB1 )(resid  85  and name  HD1* ) 5.1 2.5 1.5 !vw nu. 800 2.916 21.866 0.635 vol 7.250e+02
assign (resid 84 and name  HB1 )(resid  85  and name  HD2* ) 5.1 2.5 1.5 !vw nu. 1237 2.951 23.165 0.596 vol 5.410e+02
assign (resid 84 and name  HB1 )(resid  85  and name  HN ) 4.2 2.0 1.2 !w nu. 1207 8.161 37.131 2.929 vol 3.580e+04
assign (resid 84 and name  HB2 )(resid  84  and name  HN ) 3.4 1.2 0.6 !m nu. 1212 7.571 37.131 2.689 vol 8.494e+04
assign (resid 84 and name  HB2 )(resid  85  and name  HA  ) 4.5 4.2 1.8
assign (resid 84 and name  HB2 )(resid  85  and name  HD1* ) 4.2 2.0 1.2 !w nu. 799 2.666 21.866 0.634 vol 4.128e+03

assign (resid 84 and name  HB2 )(resid  85  and name  HD2* ) 4.2 2.0 1.2 !w nu. 1236 2.632 23.165 0.593 vol 2.790e+04
assign (resid 84 and name  HB2 )(resid  85  and name  HN ) 4.2 2.0 1.2 !w nu. 1211 8.153 37.131 2.686 vol 1.588e+03
assign (resid 84 and name  HN )(resid  85  and name  HB1 ) 5.1 2.5 1.5 !vw nu. 763 7.577 38.755 1.583 vol 5.310e+02
assign (resid 85 and name  HA )(resid  85  and name  HB1 ) 3.4 1.2 0.6 !m nu. 769 4.101 38.755 1.589 vol 1.890e+05
assign (resid 85 and name  HA )(resid  85  and name  HB1 ) 3.4 1.2 0.6 !m nu. 772 4.109 38.755 1.404 vol 3.675e+05
assign (resid 85 and name  HA )(resid  85  and name  HG ) 3.4 1.2 0.6 !m nu. 792 4.098 23.815 1.635 vol 5.413e+05
assign (resid 85 and name  HB1 )(resid  82  and name  HA ) 4.2 2.0 1.2 !w nu. 770 3.638 38.755 1.589 vol 2.775e+04
assign (resid 85 and name  HB1 )(resid  85  and name  HB2 ) 2.7 0.7 0.4 !s nu. 776 1.451 38.755 1.586 vol 1.164e+06
assign (resid 85 and name  HB1 )(resid  86  and name  HN ) 4.2 2.0 1.2 !w nu. 761 8.512 38.755 1.581 vol 3.482e+04
assign (resid 85 and name  HB2 )(resid  86  and name  HE* ) 5.1 2.5 1.5 !vw nu. 765 6.531 38.755 1.411 vol 6.440e+02
assign (resid 85 and name  HB2 )(resid  86  and name  HN ) 4.2 2.0 1.2 !w nu. 767 8.520 38.755 1.414 vol 3.291e+03
assign (resid 85 and name  HD1* )(resid  86  and name  HN ) 5.1 2.5 1.5 !vw nu. 809 8.524 21.866 0.636 vol 6.340e+02

assign (resid 85 and name  HD1* )(resid  86  and name  HA ) 4.2 2.0 1.0
assign (resid 85 and name  HG )(resid  85  and name  HN ) 2.7 0.7 0.4 !s nu. 797 1.643 21.866 0.636 vol 1.450e+06
assign (resid 85 and name  HG )(resid  86  and name  HN ) 3.4 1.2 0.6 !m nu. 779 8.543 23.815 1.629 vol 1.213e+05
assign (resid 85 and name  HG* )(resid  85  and name  HN ) 2.7 0.7 0.4 !s nu. 796 1.475 21.866 0.637 vol 9.878e+05
assign (resid 85 and name  HN )(resid  85  and name  HB1 ) 3.4 1.2 0.6 !m nu. 762 8.153 38.755 1.582 vol 1.470e+05
assign (resid 85 and name  HN )(resid  85  and name  HB2 ) 4.2 2.0 1.2 !w nu. 766 8.161 38.755 1.411 vol 6.668e+04
assign (resid 85 and name  HN )(resid  85  and name  HD1* ) 4.2 2.0 1.2 !w nu. 808 8.162 21.866 0.633 vol 2.607e+04
assign (resid 85 and name  HN )(resid  85  and name  HG ) 4.2 2.0 1.2 !w nu. 780 8.141 23.815 1.631 vol 6.819e+04

assign (resid 86 and name  HB* )(resid  88  and name  HG2* )  3.0 2.0 0.6
assign (resid 86 and name  HB* )(resid  102  and name  HE* )  5.1 3.0 2.1
assign (resid 86 and name  HD* )(resid  103  and name  HG1* ) 5.1 2.5 1.5 !vw nu. 992 7.058 26.413 0.705 vol 3.260e+02
assign (resid 86 and name  HE* )(resid  102  and name  HE* ) 2.7 0.7 0.3 !s nu340 1.244 126.772 6.545 volume 5.250e+02
assign (resid 86 and name  HE* )(resid  99  and name  HA )   2.7 0.7 0.3 !s nu339 3.194 126.772 6.503 volume 4.790e+02
assign (resid 86 and name  HE* )(resid  99  and name  HG1* ) 2.7 0.7 0.3 !s nu338 1.673 126.772 6.523 volume 6.665e+03
assign (resid 86 and name  HZ )(resid  103  and name  HD1* ) 4.2 2.0 1.2 !w nu. 727 6.652 11.473 0.579 vol 4.542e+04
assign (resid 86 and name  HZ )(resid  103  and name  HD1* ) 4.2 2.0 1.2 !w nu308 0.605 124.823 6.634 volume 6.420e+04
assign (resid 86 and name  HZ )(resid  99  and name  HG1* )  4.2 2.0 1.2 !w nu306 1.709 124.823 6.634 volume 3.063e+04
assign (resid 86 and name  HZ )(resid  99  and name  HG1* ) 5.1 2.5 1.5 !vw nu. 1071 6.635 26.413 1.709 vol 6.660e+02
assign (resid 87 and name  HA* )(resid  87  and name  HN )  3.4 1.2 0.6 !m nu. 1303 8.329 43.951 4.013 vol 4.712e+05
assign (resid 88 and name  HB  )(resid  89  and name  HD* ) 3.4 1.2 0.6
assign (resid 88 and name  HB  )(resid  89  and name  HG* ) 4.0 3.4 0.6

assign (resid 88 and name  HG1* )(resid  90  and name  HA )  4.8 4.2 1.8
assign (resid 88 and name  HG1* )(resid  89  and name  HA )  3.8 2.0 0.8
assign (resid 88 and name  HG1* )(resid  89  and name  HG* ) 3.8 2.0 0.8
assign (resid 88 and name  HG1* )(resid  89  and name  HD* ) 3.6 2.0 0.8
assign (resid 88 and name  HG2* )(resid  86  and name  HN ) 5.1 2.5 1.5 !vw nu. 854 8.489 16.020 0.810 vol 7.030e+02
assign (resid 88 and name  HG2* )(resid  87  and name  HA1 ) 4.2 2.0 1.2 !w nu. 845 4.038 16.020 0.807 vol 6.795e+04
assign (resid 88 and name  HG2* )(resid  87  and name  HN ) 5.1 2.5 1.5 !vw nu. 853 8.316 16.020 0.812 vol 8.000e+02
assign (resid 88 and name  HG2* )(resid  88  and name  HA )  3.4 1.2 0.6 !m nu. 844 3.801 16.020 0.809 vol 2.365e+05
assign (resid 88 and name  HG2* )(resid  88  and name  HA ) 4.2 2.0 1.2 !w nu. 848 5.041 16.020 0.812 vol 6.367e+04
assign (resid 88 and name  HG2* )(resid  88  and name  HB ) 3.4 1.2 0.6 !m nu. 859 2.446 16.020 0.811 vol 3.747e+05
assign (resid 88 and name  HG2* )(resid  88  and name  HN ) 3.4 1.2 0.6 !m nu. 851 7.130 16.020 0.812 vol 4.750e+05
assign (resid 88 and name  HG2* )(resid  90  and name  HN ) 3.4 1.2 0.6 !m nu. 852 7.249 16.020 0.811 vol 1.941e+05
assign (resid 88 and name  HG2* )(resid  90  and name  HA )  4.2 4.2 1.0
assign (resid 88 and name  HG2* )(resid  91  and name  HA )  4.5 4.2 1.8 !w nu. 847 4.859 16.020 0.809 vol 3.445e+03
assign (resid 88 and name  HG2* )(resid  91  and name  HB1 ) 3.4 1.2 0.6 !m nu. 841 0.810 36.806 3.257 vol 9.043e+04
assign (resid 88 and name  HG2* )(resid  91  and name  HB1 ) 3.4 1.2 0.6 !m nu. 861 3.237 16.020 0.811 vol 3.465e+05
assign (resid 88 and name  HG2* )(resid  91  and name  HB2 ) 3.4 1.2 0.6 !m nu. 860 3.117 16.020 0.811 vol 1.482e+05
assign (resid 88 and name  HG2* )(resid  91  and name  HB2 ) 4.2 2.0 1.2 !w nu. 842 0.828 36.806 3.104 vol 8.450e+03
assign (resid 88 and name  HG2* )(resid  91  and name  HD* ) 3.4 1.2 0.6 !m nu. 850 6.911 16.020 0.811 vol 2.813e+05

assign (resid 89 and name  HD1 )(resid  88  and name  HA ) 2.8 3.2 0.6 !m nu. 570 5.047 47.524 4.047 vol 1.688e+05
assign (resid 89 and name  HD2 )(resid  88  and name  HA ) 2.8 3.2 0.6 !m nu. 571 5.039 47.524 3.846 vol 3.285e+05
assign (resid 89 and name  HG* )(resid  90  and name  HA ) 4.5 3.2 0.8

assign (resid 91 and name  HB1 )(resid  102  and name  HE* ) 5.1 2.5 1.5 !vw nu. 1036 1.228 36.806 3.250 vol 5.870e+02
assign (resid 91 and name  HB1 )(resid  91  and name  HA ) 4.2 2.0 1.2 !w nu. 833 4.822 36.806 3.256 vol 6.424e+04
assign (resid 91 and name  HB1 )(resid  91  and name  HD* ) 4.2 2.0 1.2 !w nu. 832 6.938 36.806 3.260 vol 6.134e+04
assign (resid 91 and name  HB1 )(resid  92  and name  HN ) 5.1 2.5 1.5 !vw nu. 831 8.799 36.806 3.270 vol 6.050e+02
assign (resid 91 and name  HB2 )(resid  102  and name  HE* ) 3.4 1.2 0.6 !m nu. 1038 3.127 12.772 1.237 vol 7.427e+04
assign (resid 91 and name  HB2 )(resid  102  and name  HE* ) 5.1 2.5 1.5 !vw nu. 1037 1.205 36.806 3.109 vol 6.350e+02
assign (resid 91 and name  HB2 )(resid  91  and name  HA ) 4.2 2.0 1.2 !w nu. 837 4.831 36.806 3.104 vol 4.352e+04
assign (resid 91 and name  HB2 )(resid  91  and name  HD* ) 3.4 1.2 0.6 !m nu. 838 6.938 36.806 3.106 vol 1.868e+05
assign (resid 91 and name  HB2 )(resid  92  and name  HN ) 4.2 2.0 1.2 !w nu. 839 8.790 36.806 3.108 vol 7.535e+03
assign (resid 91 and name  HD* )(resid  91  and name  HB1 ) 3.4 1.2 0.6 !m nu20 3.236 129.695 6.897 volume 2.240e+05
assign (resid 91 and name  HD* )(resid  91  and name  HB2 ) 3.4 1.2 0.6 !m nu19 3.075 129.695 6.898 volume 4.003e+05
assign (resid 91 and name  HD* )(resid  91  and name  HN ) 2.7 0.7 0.3 !s nu14 8.270 129.695 6.892 volume 7.390e+02
assign (resid 91 and name  HD* )(resid  93  and name  HB ) 5.1 2.5 1.5 !vw nu. 1087 6.935 28.362 2.500 vol 3.540e+02
assign (resid 91 and name  HD* )(resid  93  and name  HG1* ) 4.2 2.0 1.2 !w nu. 874 6.903 16.994 1.152 vol 1.775e+04
assign (resid 91 and name  HD* )(resid  99  and name  HD1* ) 3.4 1.2 0.6 !m nu. 1047 6.924 11.473 0.976 vol 1.400e+05
assign (resid 91 and name  HD* )(resid  99  and name  HG1* ) 2.7 0.7 0.3 !s nu305 1.724 129.695 6.890 volume 6.170e+02
assign (resid 91 and name  HD* )(resid  99  and name  HG2* ) 3.4 1.2 0.6 !m nu. 1078 6.919 15.370 0.709 vol 1.244e+05
assign (resid 91 and name  HE* )(resid  93  and name  HA   ) 4.2 2.0 1.2
assign (resid 91 and name  HE* )(resid  93  and name  HG1* ) 4.2 2.0 1.2 !w nu. 875 7.057 16.994 1.153 vol 5.491e+03
assign (resid 91 and name  HE* )(resid  99  and name  HD1* ) 3.4 1.2 0.6 !m nu. 1048 7.067 11.473 0.979 vol 2.205e+05
assign (resid 91 and name  HE* )(resid  99  and name  HG2* ) 3.4 1.2 0.6 !m nu. 1079 7.036 15.370 0.709 vol 8.530e+04
assign (resid 92 and name  HB* )(resid  95  and name  HG* ) 5.1 2.1 1.0 !vw
assign (resid 92 and name  HB* )(resid  95  and name  HG* ) 5.1 2.1 1.0 !vw
assign (resid 93 and name  HA )(resid  93  and name  HG2* ) 2.7 0.7 0.4 !s nu. 1095 4.304 19.268 1.106 vol 7.850e+05
assign (resid 93 and name  HA )(resid  96  and name  HB*  ) 4.5 2.7 1.0
assign (resid 93 and name  HA )(resid  99  and name  HD1* ) 2.7 2.7 0.9 !m nu. 1080 4.308 11.473 0.980 vol 2.151e+05
assign (resid 93 and name  HB )(resid  93  and name  HA ) 3.4 1.2 0.6 !m nu. 1084 4.308 28.362 2.495 vol 2.929e+05
assign (resid 93 and name  HB )(resid  93  and name  HN ) 5.1 2.5 1.5 !vw nu. 1082 9.540 28.362 2.494 vol 5.020e+02
assign (resid 93 and name  HB )(resid  99  and name  HD1* ) 4.2 2.0 1.2 !w nu. 1041 2.502 11.473 0.982 vol 8.010e+02
assign (resid 93 and name  HG1* )(resid  92  and name  HA ) 5.1 2.5 1.5 !vw nu. 873 5.620 16.994 1.153 vol 5.410e+02
assign (resid 93 and name  HG1* )(resid  93  and name  HA ) 3.4 1.2 0.6 !m nu. 871 4.288 16.994 1.150 vol 1.085e+05
assign (resid 93 and name  HG1* )(resid  93  and name  HB ) 2.7 0.7 0.4 !s nu. 863 2.500 16.994 1.153 vol 6.053e+05
assign (resid 93 and name  HG1* )(resid  94  and name  HN ) 4.2 2.0 1.2 !w nu. 878 8.063 16.994 1.152 vol 2.416e+04
assign (resid 93 and name  HG1* )(resid  95  and name  HN ) 5.1 2.5 1.5 !vw nu. 876 7.377 16.994 1.153 vol 5.520e+02
assign (resid 93 and name  HG1* )(resid  99  and name  HG2* ) 3.5 3.4 1.2 !m nu. 882 1.156 15.370 0.729 vol 1.629e+05
assign (resid 93 and name  HG2* )(resid  91  and name  HE* ) 4.2 2.0 1.2 !w nu300 1.092 127.096 7.039 volume 3.260e+04
assign (resid 93 and name  HG2* )(resid  94  and name  HN ) 5.1 2.5 1.5 !vw nu. 1096 8.041 19.268 1.097 vol 7.810e+02
assign (resid 93 and name  HN )(resid  93  and name  HG1* ) 3.4 1.2 0.6 !m nu. 879 9.504 16.994 1.152 vol 2.364e+05
assign (resid 93 and name  HN )(resid  93  and name  HG2* ) 3.4 1.2 0.6 !m nu. 60 9.498 19.268 1.104 vol 1.992e+05
assign (resid 94 and name  HA )(resid  95  and name  HN  )  2.7 2.7 1.0 !s/m
assign (resid 95 and name  HN )(resid  94  and name  HG* )  3.3 2.0 1.0 !vw
assign (resid 95 and name  HN )(resid  99  and name  HB )   5.1 2.5 1.5 !vw nu. 1062 7.401 34.857 1.941 vol 3.480e+02
assign (resid 96 and name  HA )(resid  99  and name  HB )   4.2 2.0 1.2 !w nu. 1063 4.161 34.857 1.939 vol 1.830e+04
assign (resid 97 and name  HA )(resid  100  and name  HD* ) 4.2 2.0 1.2
assign (resid 97 and name  HA )(resid  100  and name  HB2 ) 4.2 2.0 1.2
assign (resid 98 and name  HA )(resid  98  and name  HG1 ) 4.2 2.0 1.2 !w nu. 1091 4.057 22.516 1.583 vol 6.861e+04
assign (resid 98 and name  HA )(resid  98  and name  HG2 ) 3.4 1.2 0.6 !m nu. 1090 4.057 22.516 1.419 vol 7.831e+04
assign (resid 98 and name  HB1 )(resid  102  and name  HE* ) 4.2 2.0 1.2 !w nu. 983 2.092 12.772 1.243 vol 4.044e+04
assign (resid 98 and name  HB2 )(resid  102  and name  HE* ) 3.4 1.2 0.6 !m nu. 984 1.945 12.772 1.239 vol 2.692e+05
assign (resid 98 and name  HG1 )(resid  98  and name  HN ) 4.2 2.0 1.2 !w nu. 1088 7.785 22.516 1.578 vol 1.752e+04
assign (resid 98 and name  HG2 )(resid  98  and name  HN ) 5.1 2.5 1.5 !vw nu. 1089 7.785 22.516 1.412 vol 6.540e+02
assign (resid 98 and name  HN )(resid  98  and name  HB1 ) 3.4 1.2 0.6 !m nu. 1092 7.799 29.986 2.020 vol 1.160e+05
assign (resid 98 and name  HN )(resid  98  and name  HB2 ) 3.4 1.2 0.6 !m nu. 1093 7.799 29.986 1.931 vol 1.110e+05
assign (resid 99 and name  HA )(resid  103  and name  HG1* ) 4.2 2.0 1.2 !w nu. 987 3.236 26.413 0.700 vol 2.284e+03
assign (resid 99 and name  HA )(resid  99  and name  HD1* ) 4.2 2.0 1.2 !w nu. 1040 3.223 11.473 0.980 vol 2.132e+04
assign (resid 99 and name  HA )(resid  99  and name  HG1* ) 4.2 2.0 1.2 !w nu. 1069 3.232 26.413 1.708 vol 1.913e+04
assign (resid 99 and name  HB )(resid  100  and name  HN ) 4.2 2.0 1.2 !w nu. 1060 8.685 34.857 1.938 vol 5.236e+03
assign (resid 99 and name  HB )(resid  99  and name  HA )  5.1 2.5 1.5 !vw nu. 1064 3.213 34.857 1.941 vol 6.880e+02
assign (resid 99 and name  HB )(resid  99  and name  HD1* ) 3.4 1.2 0.6 !m nu. 1067 0.958 34.857 1.934 vol 8.780e+04
assign (resid 99 and name  HB )(resid  99  and name  HG1* ) 5.1 2.5 1.5 !vw nu. 1066 1.706 34.857 1.937 vol 6.890e+02
assign (resid 99 and name  HB )(resid  99  and name  HG2* ) 2.7 0.7 0.4 !s nu. 1068 0.721 34.857 1.935 vol 6.728e+05
assign (resid 99 and name  HB )(resid  99  and name  HN )   3.4 1.2 0.6 !m nu. 1061 7.958 34.857 1.938 vol 1.227e+05
assign (resid 99 and name  HD1* )(resid  100  and name  HN ) 5.1 2.5 1.5 !vw nu. 1049 8.684 11.473 0.981 vol 3.340e+02
assign (resid 99 and name  HD1* )(resid  102  and name  HE* ) 3.4 1.2 0.6 !m nu. 1046 0.966 12.772 1.238 vol 1.603e+05
assign (resid 99 and name  HD1* )(resid  102  and name  HE* ) 5.1 2.5 1.5 !vw nu. 1045 1.255 11.473 0.970 vol 6.410e+02
assign (resid 99 and name  HD1* )(resid  99  and name  HN )  5.1 2.5 1.5 !vw nu. 1050 7.985 11.473 0.976 vol 6.770e+02
assign (resid 99 and name  HG1* )(resid  91  and name  HD* ) 5.1 2.5 1.5 !vw nu. 1072 6.919 26.413 1.708 vol 5.120e+02
assign (resid 99 and name  HG1* )(resid  99  and name  HG2* ) 2.7 0.7 0.4 !s nu. 1074 0.712 26.413 1.712 vol 1.402e+06
assign (resid 99 and name  HG1* )(resid  99  and name  HN ) 4.2 2.0 1.2 !w nu. 1073 7.956 26.413 1.710 vol 4.142e+04
assign (resid 99 and name  HG2* )(resid  100  and name  HA ) 4.2 2.0 1.2 !w nu216 0.726 60.191 3.572 volume 9.960e+04
assign (resid 99 and name  HG2* )(resid  103  and name  HN ) 4.2 2.0 1.2 !w nu. 94 8.274 15.371 0.719 vol 2.760e+04
assign (resid 99 and name  HN )(resid  102  and name  HE* )  5.1 2.5 1.5 !vw nu. 1002 7.967 12.772 1.239 vol 4.120e+02
assign (resid 99 and name  HN )(resid  103  and name  HG1* ) 5.1 2.5 1.5 !vw nu. 993 7.954 26.413 0.707 vol 5.000e+02
assign (resid 99 and name  HN )(resid  99  and name  HG2* )  4.2 2.0 1.2 !w nu. 90 7.955 15.371 0.722 vol 6.559e+04
! assign (resid 19 and name  HG2* )(resid  99  and name  HD1* ) 2.7 0.7 0.4 !s nu. 633 0.736 13.746 0.724 vol 9.080e+06
assign (resid 28 and name HG2* )(resid 48 and name HN ) 4.2 4.2 1.8 !nu4 0.783 121.736 8.746
assign (resid 47 and name HG2* )(resid 47 and name HN ) 2.7 2.7 0.3 !nu5 1.150 121.736 8.736
assign (resid 34 and name HN )(resid 35 and name HN ) 4.2 4.2 1.8 !nu6 8.632 120.218 7.426
assign (resid 34 and name HA )(resid 34 and name HN ) 4.2 4.2 1.8 !nu7 4.076 120.218 7.425
assign (resid 34 and name HN )(resid 33 and name HN ) 3.4 3.4 0.6 !nu8 9.011 120.218 7.431
assign (resid 45 and name HN )(resid 44 and name HN ) 2.7 2.7 0.3 !nu9 8.808 120.218 7.415
assign (resid 45 and name HA )(resid 45 and name HN ) 2.7 2.7 0.3 !nu10 4.635 120.218 7.410
assign (resid 45 and name HB2 )(resid 45 and name HN ) 2.7 2.7 0.3 !nu11 1.347 120.218 7.415
assign (resid 45 and name HG* )(resid 45 and name HN ) 2.7 2.7 0.3 !nu12 1.181 120.218 7.416
assign (resid 34 and name HB1 )(resid 34 and name HN ) 2.7 2.7 0.3 !nu13 2.024 120.218 7.429
assign (resid 45 and name HB1 )(resid 45 and name HN ) 3.4 3.4 0.6 !nu15 1.717 120.218 7.423
assign (resid 79 and name HN )(resid 80 and name HN ) 2.7 2.7 0.3 !nu18 7.686 120.218 8.811
assign (resid 43 and name HB* )(resid 44 and name HN ) 4.2 4.2 1.8 !nu20 0.593 119.914 8.810
assign (resid 44 and name HB* )(resid 44 and name HN ) 4.2 4.2 1.8 !nu21 1.832 119.914 8.809
assign (resid 44 and name HN )(resid 45 and name HN ) 4.2 4.2 1.8 !nu25 7.412 119.914 8.809
assign (resid 43 and name HA )(resid 44 and name HN ) 2.7 2.7 1.3 !nu26 4.057 119.914 8.810
assign (resid 44 and name HA )(resid 44 and name HN ) 4.2 4.2 1.8 !nu27 4.589 119.914 8.807
assign (resid 39 and name HA )(resid 44 and name HN ) 4.2 4.2 1.8 !nu28 4.327 119.914 8.814
assign (resid 39 and name HA )(resid 39 and name HN ) 2.7 2.7 0.3 !nu29 4.267 119.914 8.883
assign (resid 39 and name HB* )(resid 39 and name HN ) 4.2 4.2 1.8 !nu30 1.832 119.914 8.886
assign (resid 38 and name HN )(resid 39 and name HN ) 4.2 4.2 1.8 !nu31 8.202 119.914 8.884
assign (resid 39 and name HN )(resid 40 and name HN ) 4.2 4.2 1.8 !nu32 7.910 119.914 8.883
assign (resid 38 and name HN )(resid 39 and name HN ) 2.7 2.7 0.3 !nu33 8.886 122.344 8.197
assign (resid 37 and name HN )(resid 38 and name HN ) 4.2 4.2 1.8 !nu34 7.338 122.344 8.188
assign (resid 35 and name HA )(resid 38 and name HN ) 4.2 4.2 1.8 !nu35 3.811 122.344 8.183
assign (resid 38 and name HA )(resid 38 and name HN ) 4.2 4.2 1.8 !nu36 3.635 122.344 8.186
assign (resid 37 and name HB* )(resid 38 and name HN ) 4.2 4.2 1.8 !nu38 1.510 122.344 8.188
assign (resid 37 and name HD1* )(resid 38 and name HN ) 4.2 4.2 1.8 !nu39 0.267 122.344 8.189
assign (resid 38 and name HB2 )(resid 38 and name HN ) 4.2 4.2 1.8 !nu40 0.970 122.344 8.188
assign (resid 36 and name HN )(resid 37 and name HN ) 4.2 4.2 1.8 !nu41 7.986 123.255 7.324
assign (resid 37 and name HN )(resid 38 and name HN ) 4.2 4.2 1.8 !nu42 8.231 123.255 7.327
assign (resid 37 and name HA )(resid 37 and name HN ) 3.4 3.4 0.6 !nu43 3.759 123.255 7.327
assign (resid 37 and name HB* )(resid 37 and name HN ) 4.2 4.2 1.8 !nu44 1.500 123.255 7.329
assign (resid 37 and name HD1* )(resid 37 and name HN ) 2.9 2.7 0.9 !nu46 0.253 123.255 7.331
assign (resid 36 and name HN )(resid 37 and name HN ) 4.2 4.2 1.8 !nu50 7.338 120.218 7.966
assign (resid 35 and name HN )(resid 36 and name HN ) 4.2 4.2 1.8 !nu51 8.635 120.218 7.962
assign (resid 36 and name HA )(resid 36 and name HN ) 4.2 4.2 1.8 !nu52 4.188 120.218 7.962
assign (resid 35 and name HA )(resid 36 and name HN ) 4.2 4.2 1.8 !nu53 3.860 120.218 7.967
assign (resid 36 and name HB1 )(resid 36 and name HN ) 2.7 2.7 0.3 !nu54 2.059 120.218 7.967
assign (resid 36 and name HB2 )(resid 36 and name HN ) 4.2 4.2 1.8 !nu55 1.920 120.218 7.964
assign (resid 36 and name HG* )(resid 36 and name HN ) 4.2 4.2 1.8 !nu56 1.591 120.218 7.966
assign (resid 39 and name HA )(resid 39 and name HN ) 2.7 2.7 0.3 !nu59 4.299 120.218 8.885
assign (resid 36 and name HA )(resid 39 and name HN ) 4.2 4.2 1.8 !nu60 3.834 120.218 8.889
assign (resid 33 and name HN )(resid 34 and name HN ) 4.2 4.2 1.8 !nu61 7.423 120.218 8.998
assign (resid 33 and name HA )(resid 33 and name HN ) 3.4 3.4 0.6 !nu62 4.198 120.218 9.000
assign (resid 33 and name HB2 )(resid 33 and name HN ) 4.2 4.2 1.8 !nu64 1.499 120.218 9.000

assign (resid 35 and name HD1* )(resid 35 and name HN ) 4.2 4.2 1.8 !nu68 1.124 122.040 8.646
assign (resid 35 and name HB1 )(resid 35 and name HN ) 4.2 4.2 1.8 !nu70 1.915 122.040 8.634
assign (resid 35 and name HB2 )(resid 35 and name HN ) 4.2 4.2 1.8 !nu71 1.392 122.040 8.632
assign (resid 35 and name HA )(resid 35 and name HN ) 5 5 2 !nu72 3.842 122.040 8.633
assign (resid 34 and name HA )(resid 35 and name HN ) 3.4 3.4 0.6 !nu73 4.128 122.040 8.633
assign (resid 35 and name HN )(resid 36 and name HN ) 3.4 3.4 0.6 !nu74 7.967 122.040 8.632
assign (resid 65 and name HA )(resid 65 and name HN ) 2.7 2.7 0.3 !nu76 3.826 118.091 7.639
assign (resid 65 and name HB* )(resid 65 and name HN ) 4.2 4.2 1.8 !nu77 1.951 118.091 7.641
assign (resid 65 and name HG* )(resid 65 and name HN ) 4.2 4.2 1.8 !nu78 1.618 118.091 7.643
assign (resid 64 and name HA )(resid 65 and name HN ) 2.7 2.7 0.3 !nu80 4.159 118.091 7.638
assign (resid 65 and name HN )(resid 64 and name HN ) 2.7 2.7 0.3 !nu81 7.942 118.091 7.643
assign (resid 64 and name HN )(resid 65 and name HN ) 3.4 3.4 0.6 !nu82 7.647 120.218 7.912
assign (resid 64 and name HN )(resid 63 and name HN ) 4.2 4.2 1.8 !nu84 8.613 120.218 7.909
assign (resid 64 and name HA )(resid 64 and name HN ) 4.2 4.2 1.8 !nu85 4.125 120.218 7.912
assign (resid 63 and name HG2* )(resid 64 and name HN ) 4.2 4.2 1.8 !nu87 1.318 120.218 7.913
assign (resid 64 and name HG* )(resid 64 and name HN ) 2.7 2.7 0.3 !nu89 0.940 120.218 7.913
assign (resid 63 and name HB )(resid 63 and name HN ) 3.4 3.4 0.6 !nu90 4.185 118.395 8.615
assign (resid 63 and name HA )(resid 63 and name HN ) 3.4 3.4 0.6 !nu91 4.047 118.395 8.616
assign (resid 62 and name HG* )(resid 63 and name HN ) 3.4 3.4 0.6 !nu92 2.643 118.395 8.619
assign (resid 62 and name HB* )(resid 63 and name HN ) 3.4 3.4 0.6 !nu93 2.229 118.395 8.617
assign (resid 63 and name HG2* )(resid 63 and name HN ) 4.2 4.2 1.8 !nu94 1.288 118.395 8.613
assign (resid 61 and name HD1* )(resid 62 and name HN ) 2.7 2.7 0.9 !nu98 0.958 117.484 7.897
assign (resid 62 and name HB* )(resid 62 and name HN ) 2.7 2.7 0.3 !nu100 2.241 117.484 7.905
assign (resid 62 and name HG* )(resid 62 and name HN ) 2.7 2.7 0.3 !nu101 2.679 117.484 7.904
assign (resid 62 and name HA )(resid 62 and name HN ) 4.2 4.2 1.8 !nu102 4.485 117.484 7.911
assign (resid 61 and name HN )(resid 62 and name HN ) 2.7 2.7 0.3 !nu103 7.884 120.825 8.515
assign (resid 60 and name HD* )(resid 61 and name HN ) 2.7 2.7 0.9 !nu104 6.822 120.825 8.515
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assign (resid 61 and name HG2* )(resid 61 and name HN ) 2.7 2.7 1.3 !nu106 0.952 120.825 8.517
assign (resid 61 and name HB )(resid 61 and name HN ) 2.7 2.7 0.9 !nu107 1.930 120.825 8.517
assign (resid 60 and name HB2 )(resid 61 and name HN ) 3.4 3.4 0.6 !nu109 2.925 120.825 8.513
assign (resid 60 and name HB1 )(resid 61 and name HN ) 4.2 4.2 1.8 !nu110 3.477 120.825 8.518
assign (resid 60 and name HN )(resid 61 and name HN ) 2.7 2.7 0.3 !nu111 8.520 126.596 8.786
assign (resid 60 and name HD* )(resid 60 and name HN ) 4.2 4.2 1.8 !nu112 6.840 126.596 8.796
assign (resid 60 and name HN )(resid 59 and name HN ) 3.4 3.4 0.6 !nu113 7.698 126.596 8.790
assign (resid 41 and name HG2* )(resid 60 and name HN ) 4.2 4.2 1.8 !nu114 1.072 126.596 8.791
assign (resid 41 and name HG1* )(resid 60 and name HN ) 2.7 2.7 0.3 !nu115 1.288 126.596 8.796
assign (resid 59 and name HB* )(resid 60 and name HN ) 4.2 4.2 1.8 !nu116 2.241 126.596 8.790
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assign (resid 60 and name HB1 )(resid 60 and name HN ) 4.2 4.2 1.8 !nu118 3.459 126.596 8.788
assign (resid 60 and name HA )(resid 60 and name HN ) 4.2 4.2 1.8 !nu119 3.879 126.596 8.786
assign (resid 59 and name HN )(resid 58 and name HN ) 2.7 2.7 0.3 !nu121 8.203 122.648 7.683
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assign (resid 101 and name HN )(resid 102 and name HN ) 3.4 3.4 0.6 !nu123 7.646 115.965 8.226
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assign (resid 100 and name HN )(resid 101 and name HN ) 4.2 4.2 1.8 !nu125 8.223 123.559 8.629
assign (resid 100 and name HD* )(resid 100 and name HN ) 2.7 2.7 0.3 !nu126 7.041 123.559 8.633
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assign (resid 99 and name HB )(resid 100 and name  HN ) 4.2 4.2 1.8 !nu128 1.940 123.559 8.627
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assign (resid 100 and name HA )(resid 100 and name  HN ) 5 5 2 !nu131 3.562 123.559 8.629
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assign (resid 99 and name HN )(resid 100 and name HN ) 4.2 4.2 1.8 !nu133 8.633 120.825 8.007
assign (resid 99 and name HN )(resid 98 and name HN ) 2.7 2.7 0.3 !nu134 7.851 120.825 8.009
assign (resid 68 and name HA )(resid 68 and name HN ) 3.4 3.4 0.6 !nu137 4.514 125.381 8.666
assign (resid 13 and name HA )(resid 13 and name HN ) 4.2 4.2 1.8 !nu138 4.301 125.381 8.123
assign (resid 13 and name HB* )(resid 13 and name HN ) 4.2 4.2 1.8 !nu140 1.382 125.381 8.118
assign (resid 59 and name HB* )(resid 59 and name HN ) 4.2 4.2 1.8 !nu143 2.227 122.648 7.688
assign (resid 59 and name HG2 )(resid 59 and name HN ) 2.7 2.7 0.3 !nu144 1.781 122.648 7.690
assign (resid 57 and name HB1 )(resid 58 and name HN ) 2.7 2.7 0.3 !nu146 1.829 127.204 8.197
assign (resid 58 and name HA2 )(resid 58 and name HN ) 4.2 4.2 1.8 !nu147 3.786 127.204 8.197
assign (resid 58 and name HA1 )(resid 58 and name HN ) 2.7 2.7 0.3 !nu148 4.005 127.204 8.197
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assign (resid 57 and name HA )(resid 57 and name HN ) 4.2 4.2 1.8 !nu153 3.969 123.255 8.964
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assign (resid 57 and name HD1* )(resid 57 and name HN ) 4.2 4.2 1.8 !nu158 0.790 123.255 8.962
assign (resid 38 and name HD1* )(resid 57 and name HN ) 4.2 4.2 1.8 !nu159 0.510 123.255 8.965
       
assign (resid 56 and name HN )(resid 57 and name HN ) 4.2 4.2 1.8 !nu160 8.965 122.040 8.590
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assign (resid 56 and name HB2 )(resid 56 and name HN ) 3.4 3.4 0.6 !nu167 2.789 122.040 8.585
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assign (resid 52 and name HB2 )(resid 52 and name HN ) 4.2 4.2 1.8 !nu202 2.327 122.648 7.983
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assign (resid 26 and name HA )(resid 27 and name HN ) 3.4 3.4 0.6 !nu228 4.005 129.938 8.526
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assign (resid 27 and name HB1 )(resid 27 and name HN ) 4.2 4.2 1.8 !nu231 1.682 129.938 8.527
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assign (resid 27 and name HD1* )(resid 27 and name HN ) 3.4 3.4 0.6 !nu233 0.896 129.938 8.527
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assign (resid 26 and name HN )(resid 27 and name HD1* ) 4.2 4.2 1.8 !nu255 0.909 119.610 7.547
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assign (resid 40 and name HN )(resid 41 and name HG1* ) 4.2 4.2 1.8 !nu267 1.284 118.699 7.910
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assign (resid 84 and name HA )(resid 84 and name HN ) 2.7 2.7 0.3 !nu299 4.437 125.078 7.559
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assign (resid 84 and name HN )(resid 85 and name HN ) 4.2 4.2 1.8 !nu303 8.158 125.078 7.562
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assign (resid 107 and name HB* )(resid 107 and name HN ) 3.4 3.4 0.6 !nu362 1.679 130.849 8.512
assign (resid 107 and name HD1* )(resid 107 and name HN ) 4.2 4.2 1.8 !nu363 0.974 130.849 8.502
assign (resid 104 and name HN )(resid 104 and name HD* ) 2.7 2.7 0.3 !nu365 7.053 121.736 8.926
assign (resid 104 and name HN )(resid 103 and name HN ) 3.4 3.4 0.6 !nu366 8.276 121.736 8.932
assign (resid 103 and name HB )(resid 104 and name HN ) 5 5 2      !nu370 1.672 121.736 8.921
assign (resid 104 and name HB* )(resid 104 and name HN ) 3.4 3.4 0.6 !nu371 3.089 121.736 8.923
assign (resid 101 and name HA )(resid 104 and name HN ) 2.7 2.7 0.9 !nu372 3.949 121.736 8.921
assign (resid 104 and name HA )(resid 104 and name HN ) 2.7 2.7 0.3 !nu373 4.135 121.736 8.922
assign (resid 101 and name HA )(resid 104 and name HN ) 2.7 2.7 0.9 !nu374 4.350 121.736 8.951
assign (resid 99 and name HG2* )(resid 102 and name HN ) 4.2 4.2 1.8 !nu377 0.708 122.040 7.648
assign (resid 101 and name HG2* )(resid 102 and name HN ) 4.2 4.2 1.8 !nu378 1.138 122.040 7.645
assign (resid 102 and name HN )(resid 102 and name HG2 ) 3.4 3.4 0.6 !nu379 2.095 122.040 7.646
assign (resid 102 and name HN )(resid 102 and name HG1 ) 2.7 2.7 0.3 !nu380 2.622 122.040 7.646
assign (resid 101 and name HB )(resid 102 and name HN ) 4.2 4.2 1.8 !nu381 4.357 122.040 7.645
assign (resid 99 and name HA )(resid 102 and name  HN ) 2.7 2.7 1.3 !nu382 3.208 122.040 7.641
assign (resid 72 and name HN )(resid 73 and name HN ) 3.4 3.4 0.6 !nu383 8.373 114.446 7.867
assign (resid 73 and name HA )(resid 73 and name HN ) 4.2 4.2 1.8 !nu384 4.590 114.446 7.873
assign (resid 72 and name HA )(resid 73 and name HN ) 4.2 4.2 1.8 !nu385 4.409 114.446 7.870
assign (resid 73 and name HB1 )(resid 73 and name HN ) 4.2 4.2 1.8 !nu386 3.208 114.446 7.881
assign (resid 73 and name HB2 )(resid 73 and name HN ) 4.2 4.2 1.8 !nu387 2.993 114.446 7.877
assign (resid 72 and name HB* )(resid 73 and name HN ) 4.2 4.2 1.8 !nu388 1.850 114.446 7.872
assign (resid 97 and name HN )(resid 98 and name HN ) 4.2 4.2 1.8 !nu389 8.914 122.648 7.847
assign (resid 98 and name HN )(resid 99 and name HN ) 4.2 4.2 1.8 !nu390 8.006 122.648 7.844
assign (resid 98 and name HG1 )(resid 98 and name HN ) 4.2 4.2 1.8 !nu391 1.579 122.648 7.843
assign (resid 98 and name HB* )(resid 98 and name HN ) 4.2 4.2 1.8 !nu392 1.951 122.648 7.845
assign (resid 98 and name HN )(resid 98 and name HA ) 4.2 4.2 1.8 !nu393 4.051 122.648 7.845
assign (resid 97 and name HN )(resid 98 and name HN ) 5 5 2    !nu394 7.848 120.521 8.925
assign (resid 96 and name HB* )(resid 97 and name HN ) 2.7 2.7 0.9 !nu396 2.993 120.521 8.924
assign (resid 97 and name HB* )(resid 97 and name HN ) 3.4 3.4 0.6 !nu397 1.904 120.521 8.926
assign (resid 94 and name HN )(resid 95 and name HN ) 2.7 2.7 0.3 !nu398 8.024 121.736 7.400
assign (resid 95 and name HA )(resid 95 and name HN ) 4.2 4.2 1.8 !nu399 4.527 121.736 7.404
assign (resid 95 and name HB* )(resid 95 and name HN ) 4.2 4.2 1.8 !nu400 2.369 121.736 7.404
assign (resid 58 and name HA2 )(resid 61 and name HN ) 3.4 3.4 0.6 !nu401 3.803 120.825 8.525
assign (resid 56 and name HN )(resid 58 and name HN ) 3.4 3.4 1.6 !nu402 8.546 127.204 8.193
assign (resid 57 and name HB2 )(resid 58 and name HN ) 4.2 4.2 1.8 !nu403 1.618 127.204 8.195
assign (resid 66 and name HN )(resid 66 and name HA ) 4.2 4.2 1.8 !nu406 4.475 116.876 7.713
assign (resid 79 and name HN )(resid 80 and name HN ) 3.4 3.4 0.6 !nu408 8.837 120.825 7.689
assign (resid 79 and name HA )(resid 80 and name HN ) 4.2 4.2 1.8 !nu409 4.770 120.825 7.684
assign (resid 78 and name HA )(resid 79 and name HN ) 2.7 2.7 0.6 !nu421 4.331 120.218 8.814
assign (resid 79 and name HA )(resid 79 and name HN ) 4.2 4.2 1.8 !nu422 4.782 120.218 8.811
assign (resid 80 and name HB* )(resid 80 and name HN ) 3.4 3.4 0.6 !nu423 2.445 120.825 7.691
assign (resid 34 and name HN )(resid 35 and name HD1* ) 4.2 4.2 1.8 !nu426 1.127 120.218 7.417
assign (resid 21 and name HN )(resid 22 and name HN ) 4.2 4.2 1.8 !nu428 8.628 129.026 8.905
assign (resid 20 and name HA )(resid 21 and name HN ) 2.7 2.7 0.3 !nu429 4.411 129.026 8.903
! assign (resid 21 and name HA )(resid 21 and name HN ) 4.2 4.2 1.8 !nu430 4.035 129.026 8.902
assign (resid 21 and name HA )(resid 22 and name HN ) 2.7 2.7 0.3 !nu431 4.027 113.231 8.635
assign (resid 21 and name HB* )(resid 21 and name HN ) 4.2 4.2 1.8 !nu432 1.469 129.026 8.903
assign (resid 42 and name HA1 )(resid 42 and name HN ) 4.2 4.2 1.8 !nu436 4.449 127.508 7.537
assign (resid 42 and name HA2 )(resid 42 and name HN ) 4.2 4.2 1.8 !nu437 3.757 127.508 7.538
assign (resid 41 and name HG2* )(resid 42 and name HN ) 4.2 4.2 1.8 !nu438 1.055 127.508 7.534
assign (resid 41 and name HG1* )(resid 42 and name HN ) 2.7 2.7 0.3 !nu439 1.276 127.508 7.535
assign (resid 58 and name HA2 )(resid 59 and name HN ) 2.7 2.7 0.9 !nu442 3.784 122.648 7.681
assign (resid 59 and name HG1 )(resid 59 and name HN ) 4.2 4.2 1.8 !nu444 2.120 122.648 7.688
assign (resid 59 and name HG2 )(resid 59 and name HE21 ) 2.7 2.7 0.3 !nu445 1.790 115.358 7.173
assign (resid 59 and name HG1 )(resid 59 and name HE21 ) 4.2 4.2 1.8 !nu446 2.130 115.358 7.176
assign (resid 59 and name HE21 )(resid 59 and name HE22 ) 2.7 2.7 0.3 !nu450 6.889 115.358 7.174
assign (resid 38 and name HD1* )(resid 56 and name HN ) 4.2 4.2 1.8 !nu451 0.521 122.040 8.596
assign (resid 53 and name HN )(resid 56 and name HN ) 4.2 4.2 1.8 !nu452 8.372 122.040 8.589
assign (resid 55 and name HD* )(resid 56 and name HN ) 2.7 2.7 0.3 !nu453 6.540 122.040 8.587
assign (resid 82 and name HB1 )(resid 83 and name HN ) 3.4 3.4 0.6 !nu454 1.520 128.115 7.788
assign (resid 88 and name HG2* )(resid 88 and name HN ) 4.2 4.2 1.8 !nu456 0.804 129.938 7.121
assign (resid 88 and name HG1* )(resid 88 and name HN ) 2.8 2.7 0.6 !nu457 1.055 129.938 7.122
assign (resid 88 and name HA )(resid 88 and name HN ) 4.2 4.2 1.8 !nu458 5.024 129.938 7.119
assign (resid 87 and name HA* )(resid 88 and name HN ) 4.2 4.2 1.8 !nu459 4.004 129.938 7.123
assign (resid 86 and name HB* )(resid 88 and name HN ) 3.4 3.4 0.6 !nu460 3.188 129.938 7.120
assign (resid 87 and name HA* )(resid 87 and name HN ) 4.2 4.2 1.8 !nu461 3.996 129.938 8.344
assign (resid 11 and name HA )(resid 12 and name HN ) 2.7 2.7 0.3 !nu462 4.600 130.849 8.379
assign (resid 12 and name HA* )(resid 12 and name HN ) 4.2 4.2 1.8 !nu463 3.886 130.849 8.379
assign (resid 11 and name HB* )(resid 12 and name HN ) 4.2 4.2 1.8 !nu464 2.678 130.849 8.382
assign (resid 13 and name HA )(resid 13 and name HN ) 2.7 2.7 0.3 !nu465 4.294 125.078 8.122
assign (resid 12 and name HA* )(resid 13 and name HN ) 2.7 2.7 0.3 !nu466 3.894 125.078 8.120
assign (resid 13 and name HB* )(resid 13 and name HN ) 4.2 4.2 1.8 !nu467 1.368 125.078 8.120
assign (resid 13 and name HB* )(resid 14 and name HN ) 2.7 2.7 0.3 !nu468 1.376 121.433 8.213
assign (resid 13 and name HA )(resid 14 and name HN ) 2.7 2.7 0.3 !nu469 4.318 121.433 8.215
assign (resid 14 and name HA )(resid 14 and name HN ) 3.4 3.4 0.6 !nu470 4.200 121.433 8.214
assign (resid 14 and name HB )(resid 14 and name HN ) 2.7 2.7 0.3 !nu471 2.074 121.433 8.215
assign (resid 46 and name HN )(resid 47 and name HN ) 3.4 3.4 0.6 !nu474 8.507 112.928 7.017
assign (resid 47 and name HA )(resid 47 and name HN ) 4.2 4.2 1.8 !nu475 5.040 112.928 7.013
assign (resid 47 and name HB )(resid 47 and name HN ) 4.2 4.2 1.8 !nu477 3.949 112.928 7.013
assign (resid 45 and name HB1 )(resid 47 and name HN ) 2.7 2.7 0.3 !nu479 1.713 112.928 7.022
assign (resid 45 and name HB2 )(resid 47 and name HN ) 2.7 2.7 0.3 !nu480 1.314 112.928 7.019
assign (resid 47 and name HG2* )(resid 47 and name HN ) 2.7 2.7 0.3 !nu481 1.117 112.928 7.019
assign (resid 46 and name HN )(resid 47 and name HN ) 4.2 4.2 1.8 !nu482 7.035 119.306 8.508
assign (resid 46 and name HA )(resid 46 and name HN ) 2.7 2.7 0.3 !nu483 4.664 119.306 8.505
assign (resid 46 and name HB1 )(resid 46 and name HN ) 4.2 4.2 1.8 !nu484 2.699 119.306 8.500
assign (resid 45 and name HB1 )(resid 46 and name HN ) 4.2 4.2 1.8 !nu485 1.719 119.306 8.500
assign (resid 45 and name HB2 )(resid 46 and name HN ) 4.2 4.2 1.8 !nu486 1.330 119.306 8.496
assign (resid 39 and name HN )(resid 40 and name HN ) 4.2 4.2 1.8 !nu488 8.895 118.699 7.913
assign (resid 40 and name HN )(resid 41 and name HN ) 2.7 2.7 0.3 !nu489 7.290 118.699 7.915
assign (resid 40 and name HA )(resid 40 and name HN ) 3.4 3.4 0.6 !nu490 4.426 118.699 7.915
assign (resid 40 and name HB* )(resid 40 and name HN ) 4.2 4.2 1.8 !nu491 4.207 118.699 7.914
assign (resid 79 and name HA )(resid 79 and name HN ) 2.7 2.7 0.3 !nu492 4.772 119.914 8.805
assign (resid 40 and name HN )(resid 41 and name HN ) 2.7 2.7 0.3 !nu493 7.910 114.446 7.292
assign (resid 41 and name HN )(resid 42 and name HN ) 4.2 4.2 1.8 !nu494 7.539 114.446 7.294
assign (resid 41 and name HA )(resid 41 and name HN ) 4.2 4.2 1.8 !nu496 4.827 114.446 7.296
assign (resid 40 and name HB* )(resid 41 and name HN ) 2.7 2.7 0.3 !nu498 4.201 114.446 7.289
assign (resid 41 and name HG1* )(resid 41 and name HN ) 4.2 4.2 1.8 !nu499 1.281 114.446 7.294
assign (resid 41 and name HG2* )(resid 41 and name HN ) 2.7 2.7 0.9 !nu500 1.062 114.446 7.296
assign (resid 35 and name HA )(resid 37 and name HN ) 2.7 2.7 0.3 !nu502 3.836 123.255 7.326
assign (resid 36 and name HB1 )(resid 37 and name HN ) 3.4 3.4 0.6 !nu503 2.078 123.255 7.334
assign (resid 36 and name HB2 )(resid 37 and name HN ) 3.4 3.4 0.6 !nu504 1.883 123.255 7.331
assign (resid 37 and name HD2* )(resid 37 and name HN ) 4.2 4.2 1.8 !nu506 0.076 123.255 7.343
assign (resid 36 and name HB* )(resid 35 and name HN ) 4.2 4.2 1.8 !nu507 2.011 122.040 8.635
assign (resid 11 and name HB* )(resid 11 and name HN ) 3.4 3.4 0.6 !nu508 2.704 124.470 8.377
assign (resid 10 and name HA )(resid 11 and name HN ) 5 5 2    !nu509 4.312 124.470 8.377
assign (resid 11 and name HA )(resid 11 and name HN ) 4.2 4.2 1.8 !nu510 4.597 124.470 8.377
assign (resid 10 and name HA )(resid 10 and name HN ) 4.2 4.2 1.8 !nu512 4.312 115.965 8.333
assign (resid 10 and name HB )(resid 10 and name HN ) 3.4 3.4 0.6 !nu513 4.493 115.965 8.335
assign (resid 10 and name HG2* )(resid 10 and name HN ) 4.2 4.2 1.8 !nu514 1.226 115.965 8.328
assign (resid 8 and name HA )(resid 8 and name HN ) 2.7 2.7 0.3 !nu515 4.480 125.078 8.211
assign (resid 8 and name HB )(resid 8 and name HN ) 4.2 4.2 1.8 !nu516 2.094 125.078 8.204
assign (resid 7 and name HA )(resid 7 and name HN ) 4.2 4.2 1.8 !nu518 4.506 119.306 8.366
assign (resid 7 and name HB )(resid 7 and name HN ) 4.2 4.2 1.8 !nu519 3.858 119.306 8.363
assign (resid 16 and name HA )(resid 16 and name HN ) 2.7 2.7 0.3 !nu521 4.278 118.091 8.267
assign (resid 14 and name HG1* or resid 14 and name HG2*)(resid 16 and name HN ) 5 5 2 !nu523 0.941 118.091 8.267
assign (resid 28 and name HG1* )(resid 29 and name HN ) 4.2 4.2 1.8 !nu524 0.925 123.559 9.231
assign (resid 29 and name HG* )(resid 29 and name HN ) 2.7 2.7 0.3 !nu525 1.655 123.559 9.235
assign (resid 28 and name HB )(resid 29 and name HN ) 3.4 3.4 0.6 !nu526 2.069 123.559 9.229
assign (resid 28 and name HA )(resid 29 and name HN ) 4.2 4.2 1.8 !nu527 5.070 123.559 9.231
assign (resid 68 and name HB2 )(resid 68 and name HN ) 4.2 4.2 1.8 !nu528 2.409 125.381 8.661
assign (resid 68 and name HB1 )(resid 68 and name HN ) 4.2 4.2 1.8 !nu530 3.246 125.381 8.661
assign (resid 69 and name HA )(resid 69 and name HN ) 3.4 3.4 0.6 !nu531 3.996 124.774 8.674
assign (resid 69 and name HB* )(resid 69 and name HN ) 4.2 4.2 1.8 !nu532 1.964 124.774 8.673
assign (resid 69 and name HN )(resid 70 and name HN ) 4.2 4.2 1.8 !nu535 8.673 118.395 8.304
assign (resid 70 and name HN )(resid 71 and name HN ) 3.4 3.4 0.6 !nu536 8.441 118.395 8.300
assign (resid 70 and name HB* )(resid 70 and name HN ) 4.2 4.2 1.8 !nu537 1.898 118.395 8.302
assign (resid 69 and name HB* )(resid 70 and name HN ) 4.2 4.2 1.8 !nu538 2.064 118.395 8.302
assign (resid 69 and name HG* )(resid 70 and name HN ) 3.4 3.4 0.6 !nu539 2.372 118.395 8.307
assign (resid 70 and name HA )(resid 70 and name HN ) 2.7 2.7 0.3 !nu540 4.409 118.395 8.302
assign (resid 70 and name HG* )(resid 70 and name HN ) 2.7 2.7 0.3 !nu541 1.525 118.395 8.298
assign (resid 71 and name HG1 )(resid 71 and name HN ) 2.7 2.7 0.3 !nu543 2.321 122.951 8.406
assign (resid 68 and name HB1 )(resid 71 and name HN ) 3.4 3.4 0.6 !nu544 3.247 122.951 8.398
assign (resid 68 and name HB1 )(resid 70 and name HN ) 2.7 2.7 0.3 !nu545 3.247 118.395 8.310
assign (resid 71 and name HA )(resid 71 and name HN ) 4.2 4.2 1.8 !nu546 4.642 122.951 8.407
assign (resid 71 and name HG* )(resid 71 and name HN ) 4.2 4.2 1.8 !nu547 2.173 122.951 8.406
assign (resid 71 and name HE21 )(resid 71 and name HE22 ) 2.7 2.7 0.3 !nu549 7.668 116.876 6.973
assign (resid 94 and name H2 )(resid 94 and name HN ) 2.7 2.7 0.3 !nu550 1.520 118.395 8.017
assign (resid 74 and name HG2* )(resid 74 and name HN ) 4.2 4.2 1.8 !nu551 0.280 124.470 7.779
assign (resid 74 and name HD1* )(resid 74 and name HN ) 3.4 3.4 0.6 !nu552 0.578 124.470 7.776
assign (resid 74 and name HG1* )(resid 74 and name HN ) 2.7 2.7 0.3 !nu553 0.835 124.470 7.780
assign (resid 74 and name HB )(resid 74 and name HN ) 2.7 2.7 0.3 !nu554 1.791 124.470 7.780
assign (resid 68 and name HB1 )(resid 74 and name HN ) 2.7 2.7 0.3 !nu555 3.234 124.470 7.787
assign (resid 74 and name HA )(resid 74 and name HN ) 2.7 2.7 0.3 !nu556 4.088 124.470 7.776
assign (resid 73 and name HA )(resid 74 and name HN ) 4.2 4.2 1.8 !nu557 4.576 124.470 7.780
assign (resid 74 and name HN )(resid 75 and name HN ) 4.2 4.2 1.8 !nu559 8.396 124.470 7.781
assign (resid 74 and name HA )(resid 75 and name HN ) 4.2 4.2 1.8 !nu560 4.089 128.115 8.421
assign (resid 75 and name HA )(resid 75 and name HN ) 3.4 3.4 0.6 !nu561 3.779 128.115 8.406
assign (resid 75 and name HB )(resid 75 and name HN ) 3.4 3.4 0.6 !nu562 0.403 128.115 8.419
assign (resid 74 and name HD1* )(resid 75 and name HN ) 3.4 3.4 0.6 !nu563 0.592 128.115 8.419
assign (resid 75 and name HG1* )(resid 75 and name HN ) 4.2 4.2 1.8 !nu564 0.312 128.115 8.419
assign (resid 75 and name HG1* )(resid 77 and name HN ) 5.0 5.0 1.2 !nu628
assign (resid 76 and name HB* )(resid 77 and name HN ) 4.2 4.2 1.2 
assign (resid 76 and name HB2 )(resid 76 and name HN ) 4.2 4.2 1.8 !nu565 2.867 127.508 8.399
assign (resid 76 and name HB1 )(resid 76 and name HN ) 4.2 4.2 1.8 !nu566 3.195 127.508 8.399
assign (resid 77 and name HN )(resid 90 and name HA )  3.2 3.2 0.8 !nu567 5.503 119.610 8.455
assign (resid 77 and name HN )(resid 90 and name HB* ) 3.4 3.4 1.0 !nu568 3.961 119.610 8.455
assign (resid 77 and name HN )(resid 78 and name HN )  2.7 2.7 0.6 !nu570 7.807 119.610 8.453
assign (resid 78 and name HA )(resid 78 and name HN ) 4.2 4.2 1.8 !nu573 4.331 118.699 7.811
assign (resid 78 and name HB1 )(resid 78 and name HN ) 2.7 2.7 0.3 !nu574 3.934 118.699 7.811
assign (resid 86 and name HN )(resid 87 and name HN ) 4.2 4.2 1.8 !nu575 8.522 129.938 8.345
assign (resid 87 and name HN )(resid 88 and name HN ) 4.2 4.2 1.8 !nu576 7.107 129.938 8.341
assign (resid 87 and name HN )(resid 88 and name HG2* ) 4.2 4.2 1.8 !nu577 0.848 129.938 8.328
assign (resid 87 and name HN )(resid 88 and name HN ) 4.2 4.2 1.8 !nu578 8.341 129.938 7.120
assign (resid 91 and name HD* )(resid 91 and name HN ) 3.4 3.4 0.6 !nu579 6.900 116.573 8.255
assign (resid 90 and name HA )(resid 91 and name HN ) 4.2 4.2 1.8 !nu580 5.503 116.573 8.241
assign (resid 91 and name HA )(resid 91 and name HN ) 2.7 2.7 0.3 !nu581 4.854 116.573 8.246
assign (resid 90 and name HB1 )(resid 91 and name HN ) 3.4 3.4 0.6 !nu582 3.968 116.573 8.239
assign (resid 90 and name HB2 )(resid 91 and name HN ) 2.7 2.7 0.3 !nu583 3.745 116.573 8.242
assign (resid 75 and name HG2* )(resid 91 and name HN ) 2.7 2.7 0.3 !nu584 0.424 116.573 8.240
assign (resid 75 and name HG1* )(resid 91 and name HN ) 4.2 4.2 1.8 !nu585 0.316 116.573 8.239
assign (resid 91 and name HB* )(resid 91 and name HN ) 2.7 2.7 0.3 !nu586 3.277 116.573 8.238
assign (resid 75 and name HN )(resid 91 and name HN ) 2.7 2.7 0.3 !nu587 8.442 116.573 8.242
assign (resid 91 and name HB2 )(resid 92 and name HN ) 3.4 3.4 0.6 !nu589 3.079 114.750 8.805
assign (resid 91 and name HB1 )(resid 92 and name HN ) 2.7 2.7 0.3 !nu590 3.269 114.750 8.805
assign (resid 92 and name HB2 )(resid 92 and name HN ) 4.2 4.2 1.8 !nu591 3.786 114.750 8.813
assign (resid 92 and name HB1 )(resid 92 and name HN ) 2.7 2.7 0.3 !nu592 3.922 114.750 8.812
assign (resid 91 and name HA )(resid 92 and name HN ) 4.2 4.2 1.8 !nu593 4.839 114.750 8.813
assign (resid 92 and name HA )(resid 92 and name HN ) 4.2 4.2 1.8 !nu594 5.610 114.750 8.817
assign (resid 91 and name HB1 )(resid 93 and name HN ) 4.2 4.2 1.8 !nu596 3.269 125.381 9.483
assign (resid 93 and name HA )(resid 93 and name HN ) 4.2 4.2 1.8 !nu597 4.286 125.381 9.480
assign (resid 92 and name HA )(resid 93 and name HN ) 4.2 4.2 1.8 !nu598 5.616 125.381 9.477
assign (resid 93 and name HN )(resid 94 and name HN ) 4.2 4.2 1.8 !nu599 9.470 118.395 8.019
assign (resid 94 and name HN )(resid 95 and name HN ) 2.7 2.7 0.3 !nu600 7.404 118.395 8.021
assign (resid 94 and name HB1 )(resid 94 and name HN ) 2.7 2.7 0.3 !nu601 1.901 118.395 8.019
assign (resid 94 and name HG* )(resid 94 and name HN ) 4.2 4.2 1.8 !nu602 1.286 118.395 8.022
assign (resid 93 and name HB )(resid 94 and name HN )  4.2 4.2 1.8 !nu603 2.490 118.395 8.021
assign (resid 95 and name HG2 )(resid 95 and name HN ) 4.2 4.2 1.8 !nu604 2.193 121.736 7.399
assign (resid 96 and name HN )(resid 97 and name HN )  4.2 4.2 1.8 !nu605 8.922 122.344 7.620
assign (resid 96 and name HD1 )(resid 96 and name HN ) 4.2 4.2 1.8 !nu606 7.061 122.344 7.621
assign (resid 95 and name HA )(resid 96 and name HN )  5 5 2     !nu607 4.522 122.344 7.603
assign (resid 96 and name HA )(resid 96 and name HN )  4.2 4.2 1.8 !nu608 4.191 122.344 7.601
assign (resid 96 and name HB* )(resid 96 and name HN ) 4.2 4.2 1.8 !nu609 2.998 122.344 7.604
assign (resid 98 and name HA )(resid 99 and name HN ) 2.7 2.7 0.7 !nu610 4.033 120.825 8.006
assign (resid 99 and name HA )(resid 99 and name HN ) 4.2 4.2 1.8 !nu611 3.176 120.825 8.014
assign (resid 99 and name HB )(resid 99 and name HN ) 2.7 2.7 1.3 !nu612 1.946 120.825 8.010
assign (resid 99 and name HG1* )(resid 99 and name HN ) 4.2 4.2 1.8 !nu613 1.717 120.825 8.012
assign (resid 99 and name HG2* )(resid 99 and name HN ) 4.2 4.2 1.8 !nu614 0.707 120.825 8.012
assign (resid 101 and name HB )(resid 101 and name HN ) 4.2 4.2 1.8 !nu616 2.810 115.965 8.231
assign (resid 101 and name HA )(resid 101 and name HN ) 3.4 3.4 0.6 !nu617 3.940 115.965 8.230
assign (resid 101 and name HB )(resid 101 and name HN ) 4.2 4.2 1.8 !nu618 4.360 115.965 8.229
assign (resid 100 and name HB1 )(resid 101 and name HN ) 4.2 4.2 1.8 !nu619 3.237 115.965 8.225
assign (resid 35 and name HA )(resid 39 and name HN )  2.7 2.7 0.3 !nu620 3.842 119.914 8.885
assign (resid 39 and name HG1 )(resid 39 and name HN ) 4.2 4.2 1.8 !nu621 1.630 119.914 8.889
assign (resid 43 and name HB* )(resid 42 and name HN ) 4.2 4.2 1.8 !nu623 0.583 127.508 7.531
assign (resid 34 and name HN )(resid 34 and name HD* or resid 43 and name HB* ) 4.2 4.2 1.8 !nu14 0.593 120.218 7.419
assign (resid 44 and name HN )(resid 45 and name HN or resid 43 and name HN )  3.4 3.4 0.6 !nu17 7.412 120.218 8.809
assign (resid 44 and name HG* or resid 44 and name HB1)(resid 44 and name HN ) 4.2 4.2 1.8 !nu23 2.359 119.914 8.812
assign (resid 38 and name HB1 or resid 38 and name HG) (resid 38 and name HN ) 4.2 4.2 1.8 !nu37 1.735 122.344 8.189
assign (resid 33 and name HB1 or resid 33 and name HG) (resid 33 and name HN ) 4.2 4.2 1.8 !nu65 1.711 120.218 8.998
assign (resid 63 and name HN )(resid 64 and name HN or resid 62 and name HN ) 4.2 4.2 1.8 !nu96 7.908 118.395 8.618
assign (resid 62 and name HN )(resid 63 and name HN or resid 61 and name HN ) 3.4 3.4 0.6 !nu97 8.586 117.484 7.904
assign (resid 56 and name HA or resid 57 and name HA)(resid 60  and name HN ) 2.7 2.7 0.3 !nu120 3.981 126.596 8.785
assign (resid 93 and name HG1* or resid 93 and name HG2*)(resid 93 and name HN ) 5 5 2 !nu135 1.126 125.381 9.478
assign (resid 58 and name HA1  or resid 59 and name HA ) (resid 59 and name HN ) 2.7 2.7 0.3 !nu142 4.017 122.648 7.691
assign (resid 85 and name HB1  or resid 85 and name HG ) (resid 85 and name HN ) 4.2 4.2 1.8 !nu220 1.624 120.825 8.156
assign (resid 66 and name HD1* or resid 66 and name HD2*)(resid 66 and name HN ) 2.7 2.7 0.3 !nu248 0.816 116.876 7.711
assign (resid 27 and name HD2* or resid 27 and name HD1*)(resid 28 and name HN ) 4.2 4.2 1.8 !nu257 0.915 119.306 9.826
assign (resid 24 and name HN )(resid 25 and name HN or resid 23 and name HN ) 3.4 3.4 0.6 !nu293 7.593 121.129 7.933
assign (resid 110 and name HG1* or resid 110 and name HG2*)(resid 110 and name HN ) 3.4 3.4 0.6 !nu356 0.927 129.026 8.462
assign (resid 103 and name HD1* or resid 103 and name HG2* )(resid 104 and name HN ) 3.4 3.4 0.6 !nu368 0.582 121.736 8.923
assign (resid 102 and name HN )(resid 103 and name HN or resid 101 and name HN ) 2.7 2.7 0.3 !nu376 8.247 122.040 7.651
assign (resid 66 and name HN )(resid 67 and name HD*  or resid 67 and name HE* ) 4.2 4.2 1.8 !nu404 6.873 116.876 7.710
assign (resid 34 and name HN )(resid 34 and name HD1* or resid 34 and name HD2* ) 2.7 2.7 0.3 !nu425 0.839 120.218 7.427
assign (resid 20 and name HB* or resid 24 and name HG* )(resid  21 and name HN ) 4.2 4.2 1.8 !nu434 2.447 129.026 8.903
assign (resid 42 and name HN )(resid 41 and name HN or resid 43 and name HN ) 4.2 4.2 1.8 !nu435 7.328 127.508 7.538
assign (resid 14 and name HG1* or resid 14 and name HG2* )(resid 14 and name HN ) 2.7 2.7 0.3 !nu472 0.945 121.433 8.213
assign (resid 14 and name HG1* or resid 14 and name HG2* )(resid 15 and name HN ) 4.2 4.2 1.8 !nu473 0.945 119.9148.360
assign (resid 40 and name HA or resid 42 and name HA1)(resid 41 and name HN ) 4.2 4.2 1.8 !nu497 4.444 114.446 7.295
assign (resid 8 and name HG1* or resid 8 and name HG2*)(resid 8 and name HN ) 2.7 2.7 0.3 !nu517 0.966 125.078 8.204
assign (resid 15 and name HA or resid 16 and name HB) (resid 16 and name HN ) 2.7 2.7 0.3 !nu520 4.443 118.091 8.265
assign (resid 15 and name HG2* or resid 16 and name HG2*)(resid 16 and name HN ) 5 5 2 !nu522 1.212 118.091 8.269
assign (resid 70 and name HB*  or resid 71 and name HB* )(resid 71 and name HN ) 2.7 2.7 0.3 !nu542 1.902 122.951 8.405
assign (resid 92 and name HN )(resid 95 and name HG* or resid 95 and name HB* ) 3.4 3.4 0.6 !nu588 2.356 114.750 8.795



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1H        MET   1  10.290  13.014   6.983
    2   2H    MET   1          2H        MET   1  10.903  14.579   7.176
    3   3H    MET   1          3H        MET   1  10.572  13.984   5.626
    4    HA   MET   1           HA       MET   1   8.872  15.532   6.339
    5   1HB   MET   1          2HB       MET   1   8.277  13.687   4.828
    6   2HB   MET   1          1HB       MET   1   7.940  12.655   6.211
    7   1HG   MET   1          2HG       MET   1   6.120  14.132   6.881
    8   2HG   MET   1          1HG       MET   1   6.463  15.180   5.506
    9   1HE   MET   1          1HE       MET   1   5.226  11.637   6.650
   10   2HE   MET   1          2HE       MET   1   6.586  11.246   5.596
   11   3HE   MET   1          3HE       MET   1   4.942  10.841   5.101
   12    H    CYS   2           H        CYS   2   8.883  16.453   8.340
   13    HA   CYS   2           HA       CYS   2   7.282  15.110  10.369
   14   1HB   CYS   2          2HB       CYS   2   8.911  15.688  12.157
   15   2HB   CYS   2          1HB       CYS   2   9.526  14.488  11.024
   16    HG   CYS   2           HG       CYS   2  10.412  17.424   9.915
   17    H    ASN   3           H        ASN   3   8.428  17.909   8.798
   18    HA   ASN   3           HA       ASN   3   7.074  19.693  10.686
   19   1HB   ASN   3          2HB       ASN   3   8.833  20.270   8.294
   20   2HB   ASN   3          1HB       ASN   3   8.045  21.512   9.262
   21   1HD2  ASN   3          1HD2      ASN   3   9.998  22.413   9.879
   22   2HD2  ASN   3          2HD2      ASN   3  11.046  21.651  11.021
   23    H    THR   4           H        THR   4   5.959  17.755   8.508
   24    HA   THR   4           HA       THR   4   4.386  19.665   6.948
   25    HB   THR   4           HB       THR   4   4.485  16.648   6.744
   26    HG1  THR   4           1HG      THR   4   6.454  17.635   6.116
   27   1HG2  THR   4          1HG2      THR   4   3.278  18.717   4.903
   28   2HG2  THR   4          2HG2      THR   4   2.383  17.583   5.914
   29   3HG2  THR   4          3HG2      THR   4   3.374  16.986   4.582
   30    H    ASN   5           H        ASN   5   2.702  20.431   8.081
   31    HA   ASN   5           HA       ASN   5   0.865  18.466   9.271
   32   1HB   ASN   5          2HB       ASN   5   2.082  19.564  11.090
   33   2HB   ASN   5          1HB       ASN   5   1.624  21.143  10.462
   34   1HD2  ASN   5          2HD2      ASN   5   0.538  18.285  12.104
   35   2HD2  ASN   5          1HD2      ASN   5  -0.963  18.931  12.664
   36    H    MET   6           H        MET   6   1.373  21.359   7.459
   37    HA   MET   6           HA       MET   6  -1.433  21.349   6.667
   38   1HB   MET   6          2HB       MET   6  -1.130  22.989   8.570
   39   2HB   MET   6          1HB       MET   6  -0.076  23.913   7.508
   40   1HG   MET   6          2HG       MET   6  -1.920  24.214   5.937
   41   2HG   MET   6          1HG       MET   6  -2.976  23.287   7.000
   42   1HE   MET   6          1HE       MET   6  -0.887  26.580   6.575
   43   2HE   MET   6          2HE       MET   6  -0.205  25.882   8.044
   44   3HE   MET   6          3HE       MET   6  -1.147  27.371   8.129
   45    H    SER   7           H        SER   7   1.540  21.021   5.703
   46    HA   SER   7           HA       SER   7   2.664  21.245   3.743
   47   1HB   SER   7          1HB       SER   7   0.547  20.459   2.755
   48   2HB   SER   7          2HB       SER   7  -0.026  22.125   2.665
   49    HG   SER   7           HG       SER   7   0.838  21.936   0.731
   50    H    VAL   8           H        VAL   8   3.079  22.925   1.870
   51    HA   VAL   8           HA       VAL   8   2.853  25.653   2.931
   52    HB   VAL   8           HB       VAL   8   5.056  24.926   3.595
   53   1HG1  VAL   8          1HG2      VAL   8   5.501  24.219   0.697
   54   2HG1  VAL   8          2HG2      VAL   8   5.339  23.081   2.034
   55   3HG1  VAL   8          3HG2      VAL   8   6.723  24.172   1.967
   56   1HG2  VAL   8          1HG1      VAL   8   4.850  27.228   2.838
   57   2HG2  VAL   8          2HG1      VAL   8   5.199  26.730   1.182
   58   3HG2  VAL   8          3HG1      VAL   8   6.438  26.580   2.428
   59    HA   PRO   9           HA       PRO   9   1.729  26.304  -1.339
   60   1HB   PRO   9          2HB       PRO   9   1.081  28.896  -1.159
   61   2HB   PRO   9          1HB       PRO   9   0.076  27.641  -0.424
   62   1HG   PRO   9          2HG       PRO   9   2.089  29.452   0.854
   63   2HG   PRO   9          1HG       PRO   9   0.487  28.969   1.441
   64   1HD   PRO   9          1HD       PRO   9   2.845  27.835   2.282
   65   2HD   PRO   9          2HD       PRO   9   1.273  27.013   2.326
   66    H    THR  10           H        THR  10   4.593  26.647  -0.293
   67    HA   THR  10           HA       THR  10   5.474  28.492  -2.412
   68    HB   THR  10           HB       THR  10   6.782  28.189   0.299
   69    HG1  THR  10           1HG      THR  10   6.113  30.559   0.258
   70   1HG2  THR  10          1HG2      THR  10   8.393  28.640  -1.483
   71   2HG2  THR  10          2HG2      THR  10   8.207  30.049  -0.438
   72   3HG2  THR  10          3HG2      THR  10   7.428  30.015  -2.021
   73    H    ASP  11           H        ASP  11   6.264  27.168  -3.928
   74    HA   ASP  11           HA       ASP  11   7.501  25.569  -4.968
   75   1HB   ASP  11          1HB       ASP  11   9.275  25.948  -2.545
   76   2HB   ASP  11          2HB       ASP  11   9.746  25.113  -4.022
   77    H    GLY  12           H        GLY  12   5.376  24.702  -3.215
   78   1HA   GLY  12          1HA       GLY  12   6.296  21.947  -2.817
   79   2HA   GLY  12          2HA       GLY  12   5.538  22.768  -1.462
   80    H    ALA  13           H        ALA  13   4.353  23.650  -4.537
   81    HA   ALA  13           HA       ALA  13   2.357  23.347  -5.579
   82   1HB   ALA  13          1HB       ALA  13   1.525  21.070  -5.792
   83   2HB   ALA  13          2HB       ALA  13   2.574  20.549  -4.474
   84   3HB   ALA  13          3HB       ALA  13   3.277  21.114  -5.989
   85    H    VAL  14           H        VAL  14   0.034  22.124  -5.054
   86    HA   VAL  14           HA       VAL  14  -0.979  23.651  -2.851
   87    HB   VAL  14           HB       VAL  14  -2.416  21.595  -4.538
   88   1HG1  VAL  14          1HG1      VAL  14  -3.573  22.087  -2.455
   89   2HG1  VAL  14          2HG1      VAL  14  -4.445  22.775  -3.825
   90   3HG1  VAL  14          3HG1      VAL  14  -3.470  23.815  -2.788
   91   1HG2  VAL  14          1HG2      VAL  14  -2.195  24.583  -4.893
   92   2HG2  VAL  14          2HG2      VAL  14  -3.229  23.511  -5.837
   93   3HG2  VAL  14          3HG2      VAL  14  -1.476  23.351  -5.931
   94    H    THR  15           H        THR  15  -1.357  20.175  -3.568
   95    HA   THR  15           HA       THR  15  -1.048  19.635  -0.689
   96    HB   THR  15           HB       THR  15  -3.032  18.265  -2.516
   97    HG1  THR  15           1HG      THR  15  -4.081  20.079  -2.069
   98   1HG2  THR  15          1HG2      THR  15  -3.867  17.242  -0.450
   99   2HG2  THR  15          2HG2      THR  15  -2.587  18.038   0.464
  100   3HG2  THR  15          3HG2      THR  15  -2.181  16.814  -0.738
  101    H    THR  16           H        THR  16  -0.005  17.736  -0.129
  102    HA   THR  16           HA       THR  16   1.668  16.608  -2.218
  103    HB   THR  16           HB       THR  16   2.865  15.486  -0.379
  104    HG1  THR  16           1HG      THR  16   1.129  15.202   1.073
  105   1HG2  THR  16          1HG2      THR  16   3.738  17.500   0.717
  106   2HG2  THR  16          2HG2      THR  16   2.356  18.421   0.124
  107   3HG2  THR  16          3HG2      THR  16   3.524  17.753  -1.015
  108    H    SER  17           H        SER  17  -1.280  15.977  -1.870
  109    HA   SER  17           HA       SER  17  -1.211  13.121  -1.293
  110   1HB   SER  17          2HB       SER  17  -3.515  14.932  -2.062
  111   2HB   SER  17          1HB       SER  17  -3.664  13.231  -1.618
  112    HG   SER  17           HG       SER  17  -2.450  14.052   0.378
  113    H    GLN  18           H        GLN  18  -2.442  11.672  -2.861
  114    HA   GLN  18           HA       GLN  18  -2.401  12.384  -5.642
  115   1HB   GLN  18          2HB       GLN  18   0.027  11.897  -5.095
  116   2HB   GLN  18          1HB       GLN  18  -0.478  10.260  -4.700
  117   1HG   GLN  18          2HG       GLN  18   0.424  10.342  -6.935
  118   2HG   GLN  18          1HG       GLN  18  -1.294   9.939  -6.965
  119   1HE2  GLN  18          2HE2      GLN  18  -2.763  11.431  -7.776
  120   2HE2  GLN  18          1HE2      GLN  18  -2.272  12.783  -8.733
  121    H    ILE  19           H        ILE  19  -2.314   9.742  -3.276
  122    HA   ILE  19           HA       ILE  19  -3.404   8.072  -5.402
  123    HB   ILE  19           HB       ILE  19  -1.039   7.696  -4.904
  124   1HG1  ILE  19          1HG1      ILE  19  -2.712   5.780  -5.487
  125   2HG1  ILE  19          2HG1      ILE  19  -1.087   5.369  -4.954
  126   1HG2  ILE  19          1HG2      ILE  19  -0.946   8.377  -2.639
  127   2HG2  ILE  19          2HG2      ILE  19  -0.433   6.686  -2.711
  128   3HG2  ILE  19          3HG2      ILE  19  -2.059   7.098  -2.151
  129   1HD1  ILE  19          1HD1      ILE  19  -1.934   4.926  -2.709
  130   2HD1  ILE  19          2HD1      ILE  19  -2.743   3.932  -3.921
  131   3HD1  ILE  19          3HD1      ILE  19  -3.564   5.340  -3.244
  132    HA   PRO  20           HA       PRO  20  -6.835   7.117  -2.846
  133   1HB   PRO  20          2HB       PRO  20  -6.939   4.475  -4.156
  134   2HB   PRO  20          1HB       PRO  20  -8.115   5.792  -4.190
  135   1HG   PRO  20          2HG       PRO  20  -6.632   5.204  -6.340
  136   2HG   PRO  20          1HG       PRO  20  -7.041   6.882  -5.932
  137   1HD   PRO  20          1HD       PRO  20  -4.487   5.383  -5.440
  138   2HD   PRO  20          2HD       PRO  20  -4.709   7.039  -6.034
  139    H    ALA  21           H        ALA  21  -5.970   6.886  -0.797
  140    HA   ALA  21           HA       ALA  21  -5.801   4.231   0.273
  141   1HB   ALA  21          1HB       ALA  21  -3.572   4.430  -0.718
  142   2HB   ALA  21          2HB       ALA  21  -3.494   4.355   1.043
  143   3HB   ALA  21          3HB       ALA  21  -3.294   5.900   0.216
  144    H    SER  22           H        SER  22  -7.032   6.974   0.572
  145    HA   SER  22           HA       SER  22  -7.301   7.095   3.363
  146   1HB   SER  22          1HB       SER  22  -6.095   9.204   3.827
  147   2HB   SER  22          2HB       SER  22  -4.992   7.918   3.336
  148    HG   SER  22           HG       SER  22  -5.593   9.030   1.114
  149    H    GLU  23           H        GLU  23  -7.061   9.355   0.611
  150    HA   GLU  23           HA       GLU  23  -9.552  10.637   1.224
  151   1HB   GLU  23          1HB       GLU  23  -7.928  10.647  -1.327
  152   2HB   GLU  23          2HB       GLU  23  -9.282  11.713  -0.977
  153   1HG   GLU  23          2HG       GLU  23  -8.035  12.674   0.896
  154   2HG   GLU  23          1HG       GLU  23  -6.675  11.615   0.525
  155    H    GLN  24           H        GLN  24  -8.481   8.329  -1.270
  156    HA   GLN  24           HA       GLN  24 -11.285   7.460  -1.531
  157   1HB   GLN  24          2HB       GLN  24  -8.950   6.984  -3.395
  158   2HB   GLN  24          1HB       GLN  24 -10.585   6.387  -3.643
  159   1HG   GLN  24          2HG       GLN  24 -11.404   8.685  -3.776
  160   2HG   GLN  24          1HG       GLN  24  -9.762   9.281  -3.532
  161   1HE2  GLN  24          2HE2      GLN  24  -8.251   9.070  -5.183
  162   2HE2  GLN  24          1HE2      GLN  24  -8.714   8.731  -6.813
  163    H    GLU  25           H        GLU  25 -11.331   6.137   0.307
  164    HA   GLU  25           HA       GLU  25  -9.057   4.523   0.949
  165   1HB   GLU  25          2HB       GLU  25 -10.540   5.681   2.626
  166   2HB   GLU  25          1HB       GLU  25 -11.760   4.461   2.284
  167   1HG   GLU  25          2HG       GLU  25 -10.191   2.713   2.993
  168   2HG   GLU  25          1HG       GLU  25  -9.000   3.959   3.373
  169    H    THR  26           H        THR  26 -12.430   3.408   0.977
  170    HA   THR  26           HA       THR  26 -13.400   1.532   0.037
  171    HB   THR  26           HB       THR  26 -10.670   0.723  -0.976
  172    HG1  THR  26           1HG      THR  26 -11.339   1.638  -2.942
  173   1HG2  THR  26          1HG2      THR  26 -13.453  -0.182  -1.732
  174   2HG2  THR  26          2HG2      THR  26 -12.276  -1.112  -0.804
  175   3HG2  THR  26          3HG2      THR  26 -11.954  -0.717  -2.492
  176    H    LEU  27           H        LEU  27 -13.988  -0.061   1.362
  177    HA   LEU  27           HA       LEU  27 -12.202  -0.885   3.456
  178   1HB   LEU  27          1HB       LEU  27 -14.927  -0.674   3.276
  179   2HB   LEU  27          2HB       LEU  27 -14.687  -2.406   3.125
  180    HG   LEU  27           HG       LEU  27 -14.997  -2.020   5.433
  181   1HD1  LEU  27          1HD1      LEU  27 -12.045  -2.154   4.841
  182   2HD1  LEU  27          2HD1      LEU  27 -13.157  -3.520   5.014
  183   3HD1  LEU  27          3HD1      LEU  27 -12.769  -2.513   6.412
  184   1HD2  LEU  27          1HD2      LEU  27 -14.715   0.415   5.370
  185   2HD2  LEU  27          2HD2      LEU  27 -12.969   0.202   5.216
  186   3HD2  LEU  27          3HD2      LEU  27 -13.796  -0.312   6.688
  187    H    VAL  28           H        VAL  28 -10.562  -1.851   2.229
  188    HA   VAL  28           HA       VAL  28 -11.087  -3.484   0.023
  189    HB   VAL  28           HB       VAL  28  -8.611  -3.040   1.659
  190   1HG1  VAL  28          1HG2      VAL  28  -7.354  -4.245  -0.068
  191   2HG1  VAL  28          2HG2      VAL  28  -8.872  -4.733  -0.821
  192   3HG1  VAL  28          3HG2      VAL  28  -8.465  -5.308   0.796
  193   1HG2  VAL  28          1HG1      VAL  28  -9.346  -2.317  -1.155
  194   2HG2  VAL  28          2HG1      VAL  28  -7.905  -1.806  -0.277
  195   3HG2  VAL  28          3HG1      VAL  28  -9.498  -1.241   0.233
  196    H    ARG  29           H        ARG  29 -11.091  -5.647  -0.291
  197    HA   ARG  29           HA       ARG  29 -10.330  -7.318   1.932
  198   1HB   ARG  29          2HB       ARG  29 -12.898  -7.906   0.466
  199   2HB   ARG  29          1HB       ARG  29 -12.304  -8.653   1.942
  200   1HG   ARG  29          2HG       ARG  29 -12.675  -6.598   3.170
  201   2HG   ARG  29          1HG       ARG  29 -13.190  -5.781   1.691
  202   1HD   ARG  29          1HD       ARG  29 -15.095  -6.489   3.071
  203   2HD   ARG  29          2HD       ARG  29 -15.087  -7.276   1.493
  204    HE   ARG  29           HE       ARG  29 -13.780  -8.878   3.437
  205   1HH1  ARG  29          2HH1      ARG  29 -16.935  -7.873   2.352
  206   2HH1  ARG  29          1HH1      ARG  29 -17.729  -9.301   2.926
  207   1HH2  ARG  29          1HH2      ARG  29 -14.817 -10.762   4.194
  208   2HH2  ARG  29          2HH2      ARG  29 -16.525 -10.943   3.973
  209    HA   PRO  30           HA       PRO  30  -8.751  -9.000  -1.998
  210   1HB   PRO  30          2HB       PRO  30  -6.163  -9.030  -1.388
  211   2HB   PRO  30          1HB       PRO  30  -6.988  -7.507  -1.739
  212   1HG   PRO  30          2HG       PRO  30  -6.135  -8.647   0.878
  213   2HG   PRO  30          1HG       PRO  30  -6.192  -6.955   0.353
  214   1HD   PRO  30          1HD       PRO  30  -8.125  -8.310   1.908
  215   2HD   PRO  30          2HD       PRO  30  -8.294  -6.708   1.166
  216    H    LYS  31           H        LYS  31  -7.434 -10.960  -2.487
  217    HA   LYS  31           HA       LYS  31  -7.874 -13.120  -0.626
  218   1HB   LYS  31          2HB       LYS  31  -6.389 -13.044  -3.262
  219   2HB   LYS  31          1HB       LYS  31  -6.756 -14.503  -2.351
  220   1HG   LYS  31          2HG       LYS  31  -9.145 -14.082  -2.632
  221   2HG   LYS  31          1HG       LYS  31  -8.778 -12.616  -3.544
  222   1HD   LYS  31          2HD       LYS  31  -7.624 -13.951  -5.235
  223   2HD   LYS  31          1HD       LYS  31  -7.978 -15.419  -4.321
  224   1HE   LYS  31          2HE       LYS  31  -9.546 -15.136  -6.167
  225   2HE   LYS  31          1HE       LYS  31 -10.369 -15.034  -4.611
  226   1HZ   LYS  31          1HZ       LYS  31 -10.351 -12.625  -4.799
  227   2HZ   LYS  31          2HZ       LYS  31 -11.133 -13.319  -6.129
  228   3HZ   LYS  31          3HZ       LYS  31  -9.558 -12.722  -6.290
  229    HA   PRO  32           HA       PRO  32  -4.131 -13.425   1.699
  230   1HB   PRO  32          1HB       PRO  32  -3.508 -15.877   0.097
  231   2HB   PRO  32          2HB       PRO  32  -3.419 -15.627   1.845
  232   1HG   PRO  32          2HG       PRO  32  -5.471 -16.936   0.759
  233   2HG   PRO  32          1HG       PRO  32  -5.715 -15.828   2.121
  234   1HD   PRO  32          2HD       PRO  32  -6.412 -15.487  -0.744
  235   2HD   PRO  32          1HD       PRO  32  -7.178 -14.791   0.698
  236    H    LEU  33           H        LEU  33  -2.963 -11.686   0.935
  237    HA   LEU  33           HA       LEU  33  -0.698 -12.108  -0.712
  238   1HB   LEU  33          2HB       LEU  33  -2.633 -12.120  -2.377
  239   2HB   LEU  33          1HB       LEU  33  -2.839 -10.421  -1.996
  240    HG   LEU  33           HG       LEU  33  -0.431 -10.089  -2.710
  241   1HD1  LEU  33          1HD1      LEU  33   0.297 -12.404  -2.533
  242   2HD1  LEU  33          2HD1      LEU  33   0.523 -11.800  -4.174
  243   3HD1  LEU  33          3HD1      LEU  33  -0.831 -12.869  -3.807
  244   1HD2  LEU  33          1HD2      LEU  33  -2.310  -9.442  -4.116
  245   2HD2  LEU  33          2HD2      LEU  33  -2.402 -11.079  -4.765
  246   3HD2  LEU  33          3HD2      LEU  33  -0.986 -10.080  -5.092
  247    H    LEU  34           H        LEU  34  -3.080  -9.748   0.425
  248    HA   LEU  34           HA       LEU  34  -0.923  -7.839   0.960
  249   1HB   LEU  34          1HB       LEU  34  -3.896  -7.407   1.234
  250   2HB   LEU  34          2HB       LEU  34  -2.643  -6.182   1.250
  251    HG   LEU  34           HG       LEU  34  -3.464  -7.852  -1.128
  252   1HD1  LEU  34          1HD2      LEU  34  -4.245  -5.725  -2.041
  253   2HD1  LEU  34          2HD2      LEU  34  -3.813  -4.918  -0.534
  254   3HD1  LEU  34          3HD2      LEU  34  -5.089  -6.135  -0.549
  255   1HD2  LEU  34          1HD1      LEU  34  -1.893  -6.550  -2.404
  256   2HD2  LEU  34          2HD1      LEU  34  -1.050  -7.345  -1.073
  257   3HD2  LEU  34          3HD1      LEU  34  -1.440  -5.627  -0.972
  258    H    LEU  35           H        LEU  35  -2.579 -10.305   2.409
  259    HA   LEU  35           HA       LEU  35  -2.613  -9.041   5.043
  260   1HB   LEU  35          2HB       LEU  35  -3.667 -11.791   4.542
  261   2HB   LEU  35          1HB       LEU  35  -4.174 -10.615   5.735
  262    HG   LEU  35           HG       LEU  35  -5.967 -10.649   4.271
  263   1HD1  LEU  35          1HD1      LEU  35  -4.320  -8.515   2.950
  264   2HD1  LEU  35          2HD1      LEU  35  -4.959  -8.348   4.584
  265   3HD1  LEU  35          3HD1      LEU  35  -6.063  -8.550   3.224
  266   1HD2  LEU  35          1HD2      LEU  35  -3.968 -10.822   2.027
  267   2HD2  LEU  35          2HD2      LEU  35  -5.713 -10.666   1.811
  268   3HD2  LEU  35          3HD2      LEU  35  -5.046 -12.094   2.601
  269    H    LYS  36           H        LYS  36  -1.444 -11.979   3.400
  270    HA   LYS  36           HA       LYS  36   0.520 -12.686   5.280
  271   1HB   LYS  36          1HB       LYS  36   0.473 -12.828   2.266
  272   2HB   LYS  36          2HB       LYS  36   1.791 -13.472   3.232
  273   1HG   LYS  36          1HG       LYS  36   0.218 -14.976   4.362
  274   2HG   LYS  36          2HG       LYS  36  -1.089 -14.340   3.363
  275   1HD   LYS  36          2HD       LYS  36  -0.323 -16.423   2.425
  276   2HD   LYS  36          1HD       LYS  36   0.137 -15.102   1.349
  277   1HE   LYS  36          1HE       LYS  36   2.398 -15.127   2.282
  278   2HE   LYS  36          2HE       LYS  36   1.939 -16.444   3.361
  279   1HZ   LYS  36          1HZ       LYS  36   3.107 -17.261   1.413
  280   2HZ   LYS  36          2HZ       LYS  36   1.948 -16.570   0.394
  281   3HZ   LYS  36          3HZ       LYS  36   1.515 -17.833   1.432
  282    H    LEU  37           H        LEU  37   0.027  -9.847   3.586
  283    HA   LEU  37           HA       LEU  37   2.814  -9.031   3.511
  284   1HB   LEU  37          1HB       LEU  37   0.973  -8.528   1.746
  285   2HB   LEU  37          2HB       LEU  37   0.422  -7.315   2.884
  286    HG   LEU  37           HG       LEU  37   1.797  -6.277   1.202
  287   1HD1  LEU  37          1HD1      LEU  37   1.926  -5.411   3.470
  288   2HD1  LEU  37          2HD1      LEU  37   3.462  -5.214   2.618
  289   3HD1  LEU  37          3HD1      LEU  37   3.269  -6.499   3.812
  290   1HD2  LEU  37          1HD2      LEU  37   3.090  -8.251   0.541
  291   2HD2  LEU  37          2HD2      LEU  37   3.988  -8.161   2.056
  292   3HD2  LEU  37          3HD2      LEU  37   4.126  -6.862   0.871
  293    H    LEU  38           H        LEU  38  -0.222  -8.187   5.121
  294    HA   LEU  38           HA       LEU  38   1.143  -6.131   6.679
  295   1HB   LEU  38          1HB       LEU  38  -1.623  -6.670   5.824
  296   2HB   LEU  38          2HB       LEU  38  -1.458  -5.954   7.416
  297    HG   LEU  38           HG       LEU  38  -0.300  -4.041   6.481
  298   1HD1  LEU  38          1HD1      LEU  38  -0.591  -5.428   3.820
  299   2HD1  LEU  38          2HD1      LEU  38   0.917  -5.175   4.698
  300   3HD1  LEU  38          3HD1      LEU  38   0.019  -3.792   4.073
  301   1HD2  LEU  38          1HD2      LEU  38  -2.779  -4.726   4.911
  302   2HD2  LEU  38          2HD2      LEU  38  -2.102  -3.109   5.119
  303   3HD2  LEU  38          3HD2      LEU  38  -2.734  -3.988   6.513
  304    H    LYS  39           H        LYS  39  -0.932  -8.974   7.201
  305    HA   LYS  39           HA       LYS  39  -0.982  -8.995   9.970
  306   1HB   LYS  39          2HB       LYS  39  -0.904 -11.307   8.030
  307   2HB   LYS  39          1HB       LYS  39  -1.228 -11.486   9.749
  308   1HG   LYS  39          2HG       LYS  39  -3.267 -10.345   9.600
  309   2HG   LYS  39          1HG       LYS  39  -2.875  -9.678   8.013
  310   1HD   LYS  39          2HD       LYS  39  -3.124 -11.794   6.967
  311   2HD   LYS  39          1HD       LYS  39  -3.205 -12.627   8.523
  312   1HE   LYS  39          1HE       LYS  39  -5.234 -10.657   7.473
  313   2HE   LYS  39          2HE       LYS  39  -5.415 -12.411   7.472
  314   1HZ   LYS  39          1HZ       LYS  39  -5.156 -10.682   9.873
  315   2HZ   LYS  39          2HZ       LYS  39  -5.263 -12.370   9.899
  316   3HZ   LYS  39          3HZ       LYS  39  -6.567 -11.449   9.341
  317    H    SER  40           H        SER  40   1.642  -9.607   7.829
  318    HA   SER  40           HA       SER  40   3.312 -11.063   9.603
  319   1HB   SER  40          1HB       SER  40   4.024  -9.279   7.264
  320   2HB   SER  40          2HB       SER  40   5.150 -10.357   8.089
  321    HG   SER  40           HG       SER  40   4.068 -12.095   7.322
  322    H    VAL  41           H        VAL  41   3.295  -7.606   8.709
  323    HA   VAL  41           HA       VAL  41   5.269  -6.765  10.490
  324    HB   VAL  41           HB       VAL  41   3.278  -4.715  10.342
  325   1HG1  VAL  41          1HG2      VAL  41   5.715  -4.410  10.492
  326   2HG1  VAL  41          2HG2      VAL  41   4.999  -3.516   9.151
  327   3HG1  VAL  41          3HG2      VAL  41   5.876  -5.015   8.842
  328   1HG2  VAL  41          1HG1      VAL  41   3.226  -4.513   7.831
  329   2HG2  VAL  41          2HG1      VAL  41   2.215  -5.783   8.523
  330   3HG2  VAL  41          3HG1      VAL  41   3.756  -6.195   7.770
  331    H    GLY  42           H        GLY  42   1.778  -7.107  10.965
  332   1HA   GLY  42          1HA       GLY  42   1.841  -7.701  13.659
  333   2HA   GLY  42          2HA       GLY  42   1.773  -5.948  13.568
  334    H    ALA  43           H        ALA  43   0.220  -6.415  10.939
  335    HA   ALA  43           HA       ALA  43  -2.302  -5.818  11.926
  336   1HB   ALA  43          1HB       ALA  43  -1.586  -5.365   9.625
  337   2HB   ALA  43          2HB       ALA  43  -3.132  -6.213   9.677
  338   3HB   ALA  43          3HB       ALA  43  -1.658  -7.091   9.269
  339    H    GLN  44           H        GLN  44  -4.316  -7.051  11.731
  340    HA   GLN  44           HA       GLN  44  -4.370  -9.861  11.499
  341   1HB   GLN  44          1HB       GLN  44  -3.144  -9.720  13.648
  342   2HB   GLN  44          2HB       GLN  44  -4.488  -8.821  14.337
  343   1HG   GLN  44          2HG       GLN  44  -5.952 -10.744  14.005
  344   2HG   GLN  44          1HG       GLN  44  -4.611 -11.645  13.300
  345   1HE2  GLN  44          2HE2      GLN  44  -2.677 -10.518  15.179
  346   2HE2  GLN  44          1HE2      GLN  44  -2.950 -11.323  16.683
  347    H    LYS  45           H        LYS  45  -6.086  -8.929  10.169
  348    HA   LYS  45           HA       LYS  45  -8.581  -8.715  11.691
  349   1HB   LYS  45          2HB       LYS  45  -7.841  -6.851   9.428
  350   2HB   LYS  45          1HB       LYS  45  -9.356  -6.854  10.318
  351   1HG   LYS  45          1HG       LYS  45  -8.316  -6.068  12.287
  352   2HG   LYS  45          2HG       LYS  45  -6.703  -6.366  11.638
  353   1HD   LYS  45          1HD       LYS  45  -7.239  -3.988  11.585
  354   2HD   LYS  45          2HD       LYS  45  -7.056  -4.630   9.952
  355   1HE   LYS  45          1HE       LYS  45  -8.973  -3.136  10.084
  356   2HE   LYS  45          2HE       LYS  45  -9.485  -4.787   9.738
  357   1HZ   LYS  45          1HZ       LYS  45 -10.900  -3.753  11.397
  358   2HZ   LYS  45          2HZ       LYS  45  -9.568  -3.477  12.402
  359   3HZ   LYS  45          3HZ       LYS  45 -10.061  -5.060  12.069
  360    H    ASP  46           H        ASP  46 -10.511  -9.040  10.313
  361    HA   ASP  46           HA       ASP  46 -10.110 -11.127   8.375
  362   1HB   ASP  46          1HB       ASP  46 -12.629  -9.664   9.200
  363   2HB   ASP  46          2HB       ASP  46 -12.575 -11.100   8.181
  364    H    THR  47           H        THR  47 -10.562  -7.700   8.337
  365    HA   THR  47           HA       THR  47 -10.211  -7.730   5.429
  366    HB   THR  47           HB       THR  47 -11.802  -5.872   5.141
  367    HG1  THR  47           1HG      THR  47 -13.071  -5.194   6.835
  368   1HG2  THR  47          1HG2      THR  47 -13.878  -7.136   5.402
  369   2HG2  THR  47          2HG2      THR  47 -13.046  -8.292   6.445
  370   3HG2  THR  47          3HG2      THR  47 -12.592  -8.150   4.747
  371    H    TYR  48           H        TYR  48  -9.955  -5.270   4.746
  372    HA   TYR  48           HA       TYR  48  -8.428  -3.772   6.716
  373   1HB   TYR  48          2HB       TYR  48  -7.258  -4.839   4.152
  374   2HB   TYR  48          1HB       TYR  48  -6.555  -3.492   5.034
  375    HD1  TYR  48           1HD      TYR  48  -5.533  -3.814   7.191
  376    HD2  TYR  48           2HD      TYR  48  -7.090  -7.108   4.997
  377    HE1  TYR  48           1HE      TYR  48  -4.269  -5.364   8.632
  378    HE2  TYR  48           2HE      TYR  48  -5.823  -8.670   6.416
  379    HH   TYR  48           HH       TYR  48  -4.368  -7.717   9.335
  380    H    THR  49           H        THR  49  -7.500  -1.737   5.537
  381    HA   THR  49           HA       THR  49  -9.294  -0.880   3.372
  382    HB   THR  49           HB       THR  49  -9.528   1.343   4.277
  383    HG1  THR  49           1HG      THR  49  -7.756   1.761   5.473
  384   1HG2  THR  49          1HG2      THR  49 -11.190  -0.300   4.984
  385   2HG2  THR  49          2HG2      THR  49 -10.892   0.876   6.264
  386   3HG2  THR  49          3HG2      THR  49 -10.187  -0.736   6.368
  387    H    MET  50           H        MET  50  -8.411   0.813   2.036
  388    HA   MET  50           HA       MET  50  -5.714   0.428   1.376
  389   1HB   MET  50          1HB       MET  50  -7.675   2.594   0.644
  390   2HB   MET  50          2HB       MET  50  -6.050   2.516  -0.029
  391   1HG   MET  50          1HG       MET  50  -6.619   0.196  -0.826
  392   2HG   MET  50          2HG       MET  50  -8.282   0.532  -0.357
  393   1HE   MET  50          1HE       MET  50  -9.106  -0.001  -2.832
  394   2HE   MET  50          2HE       MET  50  -7.441  -0.355  -3.295
  395   3HE   MET  50          3HE       MET  50  -8.413   0.748  -4.270
  396    H    LYS  51           H        LYS  51  -7.053   2.175   3.914
  397    HA   LYS  51           HA       LYS  51  -4.938   4.167   4.046
  398   1HB   LYS  51          2HB       LYS  51  -7.230   4.768   4.732
  399   2HB   LYS  51          1HB       LYS  51  -7.170   3.543   5.992
  400   1HG   LYS  51          2HG       LYS  51  -5.321   4.751   7.062
  401   2HG   LYS  51          1HG       LYS  51  -5.426   5.992   5.811
  402   1HD   LYS  51          1HD       LYS  51  -6.643   6.890   7.586
  403   2HD   LYS  51          2HD       LYS  51  -7.884   6.218   6.526
  404   1HE   LYS  51          1HE       LYS  51  -6.735   4.807   8.930
  405   2HE   LYS  51          2HE       LYS  51  -8.243   5.719   8.933
  406   1HZ   LYS  51          1HZ       LYS  51  -7.656   3.284   7.342
  407   2HZ   LYS  51          2HZ       LYS  51  -9.071   4.198   7.203
  408   3HZ   LYS  51          3HZ       LYS  51  -8.718   3.404   8.653
  409    H    GLU  52           H        GLU  52  -6.099   1.415   5.974
  410    HA   GLU  52           HA       GLU  52  -3.915   1.183   7.697
  411   1HB   GLU  52          2HB       GLU  52  -6.237  -0.255   7.151
  412   2HB   GLU  52          1HB       GLU  52  -4.936  -1.384   6.793
  413   1HG   GLU  52          1HG       GLU  52  -4.008  -1.035   9.022
  414   2HG   GLU  52          2HG       GLU  52  -5.292   0.117   9.381
  415    H    VAL  53           H        VAL  53  -4.531  -0.613   4.688
  416    HA   VAL  53           HA       VAL  53  -2.035  -1.760   4.366
  417    HB   VAL  53           HB       VAL  53  -3.815  -0.761   2.138
  418   1HG1  VAL  53          1HG2      VAL  53  -2.794  -2.573   0.842
  419   2HG1  VAL  53          2HG2      VAL  53  -1.751  -2.960   2.211
  420   3HG1  VAL  53          3HG2      VAL  53  -1.588  -1.408   1.390
  421   1HG2  VAL  53          1HG1      VAL  53  -5.080  -2.134   3.702
  422   2HG2  VAL  53          2HG1      VAL  53  -3.854  -3.398   3.604
  423   3HG2  VAL  53          3HG1      VAL  53  -4.821  -2.995   2.185
  424    H    LEU  54           H        LEU  54  -3.077   1.527   3.670
  425    HA   LEU  54           HA       LEU  54  -0.980   2.420   2.093
  426   1HB   LEU  54          2HB       LEU  54  -2.851   3.852   2.579
  427   2HB   LEU  54          1HB       LEU  54  -2.470   3.848   4.290
  428    HG   LEU  54           HG       LEU  54  -0.368   5.071   3.795
  429   1HD1  LEU  54          1HD1      LEU  54  -1.476   5.222   0.995
  430   2HD1  LEU  54          2HD1      LEU  54  -0.053   4.308   1.496
  431   3HD1  LEU  54          3HD1      LEU  54  -0.051   6.068   1.597
  432   1HD2  LEU  54          1HD2      LEU  54  -1.427   7.219   3.301
  433   2HD2  LEU  54          2HD2      LEU  54  -2.365   6.286   4.465
  434   3HD2  LEU  54          3HD2      LEU  54  -2.888   6.379   2.784
  435    H    PHE  55           H        PHE  55  -1.110   3.010   5.618
  436    HA   PHE  55           HA       PHE  55   1.686   3.573   5.656
  437   1HB   PHE  55          1HB       PHE  55   1.390   3.785   8.114
  438   2HB   PHE  55          2HB       PHE  55   0.247   4.750   7.190
  439    HD1  PHE  55           1HD      PHE  55  -2.012   4.615   7.640
  440    HD2  PHE  55           2HD      PHE  55   0.555   1.485   8.947
  441    HE1  PHE  55           1HE      PHE  55  -3.878   3.612   8.891
  442    HE2  PHE  55           2HE      PHE  55  -1.306   0.474  10.198
  443    HZ   PHE  55           HZ       PHE  55  -3.526   1.537  10.171
  444    H    TYR  56           H        TYR  56  -0.177   0.711   6.080
  445    HA   TYR  56           HA       TYR  56   1.707  -0.639   7.770
  446   1HB   TYR  56          1HB       TYR  56  -0.962  -1.053   7.008
  447   2HB   TYR  56          2HB       TYR  56  -0.073  -2.444   6.399
  448    HD1  TYR  56           1HD      TYR  56   2.033  -2.601   8.558
  449    HD2  TYR  56           2HD      TYR  56  -2.180  -2.037   8.754
  450    HE1  TYR  56           1HE      TYR  56   2.012  -3.600  10.803
  451    HE2  TYR  56           2HE      TYR  56  -2.219  -3.028  10.998
  452    HH   TYR  56           HH       TYR  56  -0.857  -4.546  12.368
  453    H    LEU  57           H        LEU  57   0.713  -1.054   4.363
  454    HA   LEU  57           HA       LEU  57   2.722  -2.878   3.665
  455   1HB   LEU  57          2HB       LEU  57   0.897  -2.476   2.157
  456   2HB   LEU  57          1HB       LEU  57   1.305  -0.778   2.029
  457    HG   LEU  57           HG       LEU  57   3.228  -1.236   0.703
  458   1HD1  LEU  57          1HD1      LEU  57   2.765  -4.159   1.276
  459   2HD1  LEU  57          2HD1      LEU  57   4.065  -3.167   1.935
  460   3HD1  LEU  57          3HD1      LEU  57   3.999  -3.496   0.204
  461   1HD2  LEU  57          1HD2      LEU  57   1.074  -1.346  -0.470
  462   2HD2  LEU  57          2HD2      LEU  57   1.023  -3.087  -0.192
  463   3HD2  LEU  57          3HD2      LEU  57   2.285  -2.394  -1.209
  464    H    GLY  58           H        GLY  58   2.718   0.651   3.843
  465   1HA   GLY  58          2HA       GLY  58   5.328   1.190   3.048
  466   2HA   GLY  58          1HA       GLY  58   4.475   2.052   4.319
  467    H    GLN  59           H        GLN  59   4.144  -0.093   6.129
  468    HA   GLN  59           HA       GLN  59   6.603  -0.081   7.487
  469   1HB   GLN  59          1HB       GLN  59   4.340  -2.053   7.839
  470   2HB   GLN  59          2HB       GLN  59   5.610  -1.704   9.002
  471   1HG   GLN  59          2HG       GLN  59   3.394   0.118   8.112
  472   2HG   GLN  59          1HG       GLN  59   3.625  -0.601   9.704
  473   1HE2  GLN  59          1HE2      GLN  59   4.684   1.854   7.489
  474   2HE2  GLN  59          2HE2      GLN  59   5.603   2.772   8.628
  475    H    TYR  60           H        TYR  60   4.979  -2.806   5.816
  476    HA   TYR  60           HA       TYR  60   6.961  -4.670   6.388
  477   1HB   TYR  60          1HB       TYR  60   4.643  -5.163   5.528
  478   2HB   TYR  60          2HB       TYR  60   5.223  -4.733   3.921
  479    HD1  TYR  60           1HD      TYR  60   5.278  -7.250   6.555
  480    HD2  TYR  60           2HD      TYR  60   6.858  -6.139   2.768
  481    HE1  TYR  60           1HE      TYR  60   6.103  -9.540   6.235
  482    HE2  TYR  60           2HE      TYR  60   7.685  -8.426   2.436
  483    HH   TYR  60           HH       TYR  60   8.317 -10.375   3.817
  484    H    ILE  61           H        ILE  61   6.612  -2.578   3.546
  485    HA   ILE  61           HA       ILE  61   8.768  -3.491   2.036
  486    HB   ILE  61           HB       ILE  61   7.927  -0.606   2.346
  487   1HG1  ILE  61          1HG1      ILE  61   6.942  -2.542   0.257
  488   2HG1  ILE  61          2HG1      ILE  61   6.084  -2.279   1.774
  489   1HG2  ILE  61          1HG2      ILE  61  10.020  -0.797   1.189
  490   2HG2  ILE  61          2HG2      ILE  61   8.759  -0.419   0.013
  491   3HG2  ILE  61          3HG2      ILE  61   9.377  -2.065   0.146
  492   1HD1  ILE  61          1HD1      ILE  61   5.068  -0.902   0.145
  493   2HD1  ILE  61          2HD1      ILE  61   6.628  -0.285  -0.399
  494   3HD1  ILE  61          3HD1      ILE  61   6.016   0.153   1.198
  495    H    MET  62           H        MET  62   8.812  -0.585   4.085
  496    HA   MET  62           HA       MET  62  11.545  -0.226   4.232
  497   1HB   MET  62          2HB       MET  62   9.556   0.311   6.442
  498   2HB   MET  62          1HB       MET  62  11.146   1.045   6.280
  499   1HG   MET  62          2HG       MET  62   8.856   1.369   4.356
  500   2HG   MET  62          1HG       MET  62   9.367   2.548   5.563
  501   1HE   MET  62          1HE       MET  62   9.006   3.220   2.464
  502   2HE   MET  62          2HE       MET  62  10.438   4.205   2.167
  503   3HE   MET  62          3HE       MET  62   9.519   4.413   3.658
  504    H    THR  63           H        THR  63   9.560  -2.521   5.959
  505    HA   THR  63           HA       THR  63  11.765  -3.250   7.728
  506    HB   THR  63           HB       THR  63  10.167  -4.731   8.851
  507    HG1  THR  63           1HG      THR  63   8.743  -5.348   7.300
  508   1HG2  THR  63          1HG2      THR  63  10.328  -2.409   9.586
  509   2HG2  THR  63          2HG2      THR  63   8.676  -3.002   9.750
  510   3HG2  THR  63          3HG2      THR  63   9.102  -1.940   8.408
  511    H    LYS  64           H        LYS  64  11.576  -5.845   8.148
  512    HA   LYS  64           HA       LYS  64  12.189  -7.893   7.393
  513   1HB   LYS  64          2HB       LYS  64  10.702  -7.121   4.878
  514   2HB   LYS  64          1HB       LYS  64  11.128  -8.752   5.377
  515   1HG   LYS  64          2HG       LYS  64   9.279  -6.923   6.896
  516   2HG   LYS  64          1HG       LYS  64   8.760  -8.187   5.778
  517   1HD   LYS  64          2HD       LYS  64   9.831  -9.877   7.170
  518   2HD   LYS  64          1HD       LYS  64  10.391  -8.622   8.278
  519   1HE   LYS  64          2HE       LYS  64   7.514  -9.291   7.674
  520   2HE   LYS  64          1HE       LYS  64   8.395  -9.750   9.130
  521   1HZ   LYS  64          1HZ       LYS  64   8.670  -7.407   9.657
  522   2HZ   LYS  64          2HZ       LYS  64   7.030  -7.797   9.505
  523   3HZ   LYS  64          3HZ       LYS  64   7.821  -6.968   8.261
  524    H    ARG  65           H        ARG  65  13.516  -5.220   6.423
  525    HA   ARG  65           HA       ARG  65  15.293  -4.562   5.167
  526   1HB   ARG  65          2HB       ARG  65  16.071  -7.439   5.661
  527   2HB   ARG  65          1HB       ARG  65  17.166  -6.188   5.088
  528   1HG   ARG  65          1HG       ARG  65  16.789  -4.930   7.163
  529   2HG   ARG  65          2HG       ARG  65  15.739  -6.225   7.738
  530   1HD   ARG  65          1HD       ARG  65  17.599  -7.795   7.635
  531   2HD   ARG  65          2HD       ARG  65  18.653  -6.521   7.023
  532    HE   ARG  65           HE       ARG  65  17.467  -5.805   9.512
  533   1HH1  ARG  65          2HH1      ARG  65  20.010  -7.704   8.074
  534   2HH1  ARG  65          1HH1      ARG  65  21.020  -7.653   9.480
  535   1HH2  ARG  65          1HH2      ARG  65  18.789  -5.731  11.367
  536   2HH2  ARG  65          2HH2      ARG  65  20.326  -6.531  11.353
  537    H    LEU  66           H        LEU  66  13.595  -4.521   3.377
  538    HA   LEU  66           HA       LEU  66  14.627  -6.137   1.143
  539   1HB   LEU  66          2HB       LEU  66  11.840  -5.020   1.232
  540   2HB   LEU  66          1HB       LEU  66  12.479  -6.276   0.188
  541    HG   LEU  66           HG       LEU  66  12.006  -6.549   3.160
  542   1HD1  LEU  66          1HD1      LEU  66   9.936  -6.407   1.856
  543   2HD1  LEU  66          2HD1      LEU  66  10.177  -8.010   2.551
  544   3HD1  LEU  66          3HD1      LEU  66  10.497  -7.735   0.838
  545   1HD2  LEU  66          1HD2      LEU  66  12.834  -8.606   1.118
  546   2HD2  LEU  66          2HD2      LEU  66  12.502  -8.901   2.825
  547   3HD2  LEU  66          3HD2      LEU  66  13.878  -7.901   2.354
  548    H    TYR  67           H        TYR  67  14.332  -3.076   2.450
  549    HA   TYR  67           HA       TYR  67  13.750  -1.585   0.083
  550   1HB   TYR  67          1HB       TYR  67  14.088   0.368   1.410
  551   2HB   TYR  67          2HB       TYR  67  13.278  -0.817   2.429
  552    HD1  TYR  67           1HD      TYR  67  14.842  -2.265   3.949
  553    HD2  TYR  67           2HD      TYR  67  15.973   1.442   2.197
  554    HE1  TYR  67           1HE      TYR  67  16.609  -2.010   5.642
  555    HE2  TYR  67           2HE      TYR  67  17.741   1.709   3.880
  556    HH   TYR  67           HH       TYR  67  18.750  -0.816   5.905
  557    H    ASP  68           H        ASP  68  15.215   0.074  -0.805
  558    HA   ASP  68           HA       ASP  68  17.690  -0.757  -1.705
  559   1HB   ASP  68          1HB       ASP  68  18.012   1.503  -2.422
  560   2HB   ASP  68          2HB       ASP  68  16.283   1.217  -2.479
  561    H    GLU  69           H        GLU  69  19.395   1.470  -1.022
  562    HA   GLU  69           HA       GLU  69  19.526   1.614   1.866
  563   1HB   GLU  69          2HB       GLU  69  21.937   1.079   1.960
  564   2HB   GLU  69          1HB       GLU  69  20.971  -0.298   1.450
  565   1HG   GLU  69          2HG       GLU  69  21.590   0.133  -0.876
  566   2HG   GLU  69          1HG       GLU  69  22.566   1.507  -0.357
  567    H    LYS  70           H        LYS  70  19.099   3.268  -0.642
  568    HA   LYS  70           HA       LYS  70  21.168   5.305  -0.207
  569   1HB   LYS  70          2HB       LYS  70  19.101   5.068  -2.402
  570   2HB   LYS  70          1HB       LYS  70  20.315   6.334  -2.282
  571   1HG   LYS  70          1HG       LYS  70  22.084   4.683  -2.534
  572   2HG   LYS  70          2HG       LYS  70  20.881   3.395  -2.615
  573   1HD   LYS  70          2HD       LYS  70  21.598   3.951  -4.849
  574   2HD   LYS  70          1HD       LYS  70  19.926   4.469  -4.631
  575   1HE   LYS  70          1HE       LYS  70  20.693   6.758  -4.221
  576   2HE   LYS  70          2HE       LYS  70  22.362   6.238  -4.451
  577   1HZ   LYS  70          1HZ       LYS  70  21.475   7.256  -6.449
  578   2HZ   LYS  70          2HZ       LYS  70  20.219   6.124  -6.503
  579   3HZ   LYS  70          3HZ       LYS  70  21.818   5.621  -6.724
  580    H    GLN  71           H        GLN  71  17.654   5.240  -0.843
  581    HA   GLN  71           HA       GLN  71  17.296   7.198   1.313
  582   1HB   GLN  71          1HB       GLN  71  16.042   7.449  -1.427
  583   2HB   GLN  71          2HB       GLN  71  15.775   8.527  -0.063
  584   1HG   GLN  71          2HG       GLN  71  18.122   9.190  -0.121
  585   2HG   GLN  71          1HG       GLN  71  18.393   8.106  -1.486
  586   1HE2  GLN  71          2HE2      GLN  71  17.563   8.640  -3.504
  587   2HE2  GLN  71          1HE2      GLN  71  17.027  10.238  -3.884
  588    H    GLN  72           H        GLN  72  16.734   4.267   0.767
  589    HA   GLN  72           HA       GLN  72  15.120   2.715   1.195
  590   1HB   GLN  72          2HB       GLN  72  13.841   4.945   2.787
  591   2HB   GLN  72          1HB       GLN  72  13.617   3.216   3.018
  592   1HG   GLN  72          1HG       GLN  72  16.034   3.038   3.580
  593   2HG   GLN  72          2HG       GLN  72  16.132   4.797   3.495
  594   1HE2  GLN  72          2HE2      GLN  72  16.600   2.993   5.745
  595   2HE2  GLN  72          1HE2      GLN  72  15.526   3.506   6.997
  596    H    HIS  73           H        HIS  73  14.775   3.779  -1.253
  597    HA   HIS  73           HA       HIS  73  11.868   3.779  -1.517
  598   1HB   HIS  73          1HB       HIS  73  11.843   5.630  -3.051
  599   2HB   HIS  73          2HB       HIS  73  12.648   6.150  -1.575
  600    HD1  HIS  73           1HD      HIS  73  12.944   7.027  -4.789
  601    HD2  HIS  73           2HD      HIS  73  15.693   5.211  -2.258
  602    HE1  HIS  73           1HE      HIS  73  15.202   7.545  -5.767
  603    HE2  HIS  73           2HE      HIS  73  16.845   6.363  -4.267
  604    H    ILE  74           H        ILE  74  14.956   2.759  -2.629
  605    HA   ILE  74           HA       ILE  74  13.616   1.443  -4.901
  606    HB   ILE  74           HB       ILE  74  16.561   1.211  -4.389
  607   1HG1  ILE  74          2HG1      ILE  74  16.175   3.602  -4.405
  608   2HG1  ILE  74          1HG1      ILE  74  16.890   3.125  -5.942
  609   1HG2  ILE  74          1HG2      ILE  74  16.630   0.843  -6.795
  610   2HG2  ILE  74          2HG2      ILE  74  14.896   1.145  -6.903
  611   3HG2  ILE  74          3HG2      ILE  74  15.492  -0.265  -6.029
  612   1HD1  ILE  74          1HD1      ILE  74  14.767   3.283  -7.041
  613   2HD1  ILE  74          2HD1      ILE  74  15.071   4.781  -6.160
  614   3HD1  ILE  74          3HD1      ILE  74  13.950   3.584  -5.506
  615    H    VAL  75           H        VAL  75  12.456   0.087  -3.427
  616    HA   VAL  75           HA       VAL  75  13.988  -1.582  -1.624
  617    HB   VAL  75           HB       VAL  75  12.060  -0.912  -0.569
  618   1HG1  VAL  75          1HG2      VAL  75  11.027   0.167  -2.471
  619   2HG1  VAL  75          2HG2      VAL  75   9.844  -0.820  -1.613
  620   3HG1  VAL  75          3HG2      VAL  75  10.545  -1.398  -3.125
  621   1HG2  VAL  75          1HG1      VAL  75  12.215  -3.305  -0.332
  622   2HG2  VAL  75          2HG1      VAL  75  11.319  -3.547  -1.832
  623   3HG2  VAL  75          3HG1      VAL  75  10.516  -2.838  -0.431
  624    H    TYR  76           H        TYR  76  14.991  -3.258  -2.459
  625    HA   TYR  76           HA       TYR  76  14.016  -4.602  -4.816
  626   1HB   TYR  76          1HB       TYR  76  16.344  -5.503  -3.138
  627   2HB   TYR  76          2HB       TYR  76  16.104  -5.676  -4.875
  628    HD1  TYR  76           1HD      TYR  76  15.931  -3.400  -6.198
  629    HD2  TYR  76           2HD      TYR  76  17.763  -3.830  -2.381
  630    HE1  TYR  76           1HE      TYR  76  17.229  -1.342  -6.587
  631    HE2  TYR  76           2HE      TYR  76  19.059  -1.784  -2.764
  632    HH   TYR  76           HH       TYR  76  18.378   0.385  -5.281
  633    H    CYS  77           H        CYS  77  12.866  -6.434  -4.889
  634    HA   CYS  77           HA       CYS  77  12.561  -7.983  -2.408
  635   1HB   CYS  77          2HB       CYS  77  10.318  -7.059  -4.214
  636   2HB   CYS  77          1HB       CYS  77  10.132  -8.162  -2.855
  637    HG   CYS  77           HG       CYS  77  11.004  -4.860  -2.692
  638    H    SER  78           H        SER  78  14.180  -9.253  -3.724
  639    HA   SER  78           HA       SER  78  12.920 -11.012  -5.679
  640   1HB   SER  78          1HB       SER  78  15.243 -10.332  -6.082
  641   2HB   SER  78          2HB       SER  78  15.724 -11.023  -4.531
  642    HG   SER  78           HG       SER  78  14.423 -12.893  -5.887
  643    H    ASN  79           H        ASN  79  11.819 -12.742  -5.055
  644    HA   ASN  79           HA       ASN  79  10.927 -14.380  -3.756
  645   1HB   ASN  79          2HB       ASN  79  13.712 -14.463  -2.572
  646   2HB   ASN  79          1HB       ASN  79  12.474 -15.694  -2.346
  647   1HD2  ASN  79          2HD2      ASN  79  14.713 -14.252  -4.573
  648   2HD2  ASN  79          1HD2      ASN  79  14.636 -15.494  -5.771
  649    H    ASP  80           H        ASP  80   9.890 -12.247  -2.919
  650    HA   ASP  80           HA       ASP  80  10.079 -12.290   0.007
  651   1HB   ASP  80          2HB       ASP  80  10.128  -9.788  -1.688
  652   2HB   ASP  80          1HB       ASP  80   9.931  -9.813   0.063
  653    H    LEU  81           H        LEU  81   8.174 -11.491   1.083
  654    HA   LEU  81           HA       LEU  81   5.760 -12.279  -0.126
  655   1HB   LEU  81          2HB       LEU  81   6.337 -10.649   2.339
  656   2HB   LEU  81          1HB       LEU  81   4.708 -11.070   1.849
  657    HG   LEU  81           HG       LEU  81   5.332 -13.480   2.014
  658   1HD1  LEU  81          1HD2      LEU  81   7.376 -14.083   3.212
  659   2HD1  LEU  81          2HD2      LEU  81   7.874 -12.392   3.214
  660   3HD1  LEU  81          3HD2      LEU  81   7.735 -13.268   1.691
  661   1HD2  LEU  81          1HD1      LEU  81   5.346 -13.552   4.465
  662   2HD2  LEU  81          2HD1      LEU  81   4.182 -12.382   3.844
  663   3HD2  LEU  81          3HD1      LEU  81   5.722 -11.830   4.506
  664    H    LEU  82           H        LEU  82   7.203  -9.091   0.409
  665    HA   LEU  82           HA       LEU  82   5.303  -7.465  -0.790
  666   1HB   LEU  82          1HB       LEU  82   7.884  -7.142   0.095
  667   2HB   LEU  82          2HB       LEU  82   8.060  -6.915  -1.633
  668    HG   LEU  82           HG       LEU  82   7.740  -4.766  -0.642
  669   1HD1  LEU  82          1HD2      LEU  82   5.177  -5.686  -1.935
  670   2HD1  LEU  82          2HD2      LEU  82   6.615  -5.097  -2.769
  671   3HD1  LEU  82          3HD2      LEU  82   5.684  -4.008  -1.739
  672   1HD2  LEU  82          1HD1      LEU  82   6.747  -5.474   1.461
  673   2HD2  LEU  82          2HD1      LEU  82   5.254  -5.901   0.626
  674   3HD2  LEU  82          3HD1      LEU  82   5.772  -4.217   0.701
  675    H    GLY  83           H        GLY  83   7.567  -9.733  -2.195
  676   1HA   GLY  83          1HA       GLY  83   7.298  -8.993  -4.901
  677   2HA   GLY  83          2HA       GLY  83   7.775 -10.579  -4.315
  678    H    ASP  84           H        ASP  84   5.461 -11.298  -2.910
  679    HA   ASP  84           HA       ASP  84   3.812 -12.341  -4.886
  680   1HB   ASP  84          2HB       ASP  84   3.035 -11.706  -2.024
  681   2HB   ASP  84          1HB       ASP  84   2.173 -12.791  -3.111
  682    H    LEU  85           H        LEU  85   3.718  -9.221  -3.312
  683    HA   LEU  85           HA       LEU  85   1.159  -8.373  -4.010
  684   1HB   LEU  85          1HB       LEU  85   3.691  -6.732  -3.920
  685   2HB   LEU  85          2HB       LEU  85   2.061  -6.083  -3.921
  686    HG   LEU  85           HG       LEU  85   3.491  -7.567  -1.745
  687   1HD1  LEU  85          1HD2      LEU  85   1.856  -5.033  -1.781
  688   2HD1  LEU  85          2HD2      LEU  85   3.617  -5.118  -1.807
  689   3HD1  LEU  85          3HD2      LEU  85   2.727  -5.694  -0.397
  690   1HD2  LEU  85          1HD1      LEU  85   1.398  -7.850  -0.569
  691   2HD2  LEU  85          2HD1      LEU  85   1.322  -8.676  -2.128
  692   3HD2  LEU  85          3HD1      LEU  85   0.516  -7.124  -1.915
  693    H    PHE  86           H        PHE  86   4.120  -7.462  -5.774
  694    HA   PHE  86           HA       PHE  86   2.564  -7.856  -8.228
  695   1HB   PHE  86          1HB       PHE  86   4.810  -6.375  -8.979
  696   2HB   PHE  86          2HB       PHE  86   3.157  -5.796  -8.855
  697    HD1  PHE  86           1HD      PHE  86   2.998  -3.772  -7.841
  698    HD2  PHE  86           2HD      PHE  86   5.888  -6.549  -6.406
  699    HE1  PHE  86           1HE      PHE  86   3.694  -2.147  -6.126
  700    HE2  PHE  86           2HE      PHE  86   6.582  -4.937  -4.681
  701    HZ   PHE  86           HZ       PHE  86   5.486  -2.737  -4.538
  702    H    GLY  87           H        GLY  87   6.048  -7.651  -7.477
  703   1HA   GLY  87          2HA       GLY  87   7.034 -10.055  -7.438
  704   2HA   GLY  87          1HA       GLY  87   6.444 -10.074  -9.092
  705    H    VAL  88           H        VAL  88   7.474  -7.003  -8.137
  706    HA   VAL  88           HA       VAL  88   9.534  -6.916 -10.059
  707    HB   VAL  88           HB       VAL  88  10.075  -4.711  -9.169
  708   1HG1  VAL  88          1HG2      VAL  88   7.882  -3.650  -9.422
  709   2HG1  VAL  88          2HG2      VAL  88   7.106  -5.224  -9.251
  710   3HG1  VAL  88          3HG2      VAL  88   8.148  -4.901 -10.637
  711   1HG2  VAL  88          1HG1      VAL  88   8.926  -3.829  -7.196
  712   2HG2  VAL  88          2HG1      VAL  88   9.930  -5.221  -6.793
  713   3HG2  VAL  88          3HG1      VAL  88   8.181  -5.404  -6.927
  714    HA   PRO  89           HA       PRO  89  13.123  -7.912  -7.457
  715   1HB   PRO  89          2HB       PRO  89  15.042  -6.880  -9.022
  716   2HB   PRO  89          1HB       PRO  89  14.223  -8.389  -9.443
  717   1HG   PRO  89          2HG       PRO  89  13.762  -5.622 -10.490
  718   2HG   PRO  89          1HG       PRO  89  13.816  -7.157 -11.375
  719   1HD   PRO  89          1HD       PRO  89  11.495  -5.899 -10.622
  720   2HD   PRO  89          2HD       PRO  89  11.633  -7.647 -10.893
  721    H    SER  90           H        SER  90  11.910  -4.885  -8.452
  722    HA   SER  90           HA       SER  90  12.787  -3.576  -6.086
  723   1HB   SER  90          2HB       SER  90  14.095  -1.774  -7.212
  724   2HB   SER  90          1HB       SER  90  14.887  -3.347  -7.268
  725    HG   SER  90           HG       SER  90  15.014  -2.755  -9.320
  726    H    PHE  91           H        PHE  91  11.501  -1.808  -5.645
  727    HA   PHE  91           HA       PHE  91  10.032  -0.580  -7.837
  728   1HB   PHE  91          1HB       PHE  91   7.867  -0.827  -6.813
  729   2HB   PHE  91          2HB       PHE  91   8.593  -2.415  -7.011
  730    HD1  PHE  91           1HD      PHE  91   7.463   0.092  -4.618
  731    HD2  PHE  91           2HD      PHE  91   9.307  -3.713  -5.089
  732    HE1  PHE  91           1HE      PHE  91   7.018  -0.406  -2.257
  733    HE2  PHE  91           2HE      PHE  91   8.872  -4.218  -2.722
  734    HZ   PHE  91           HZ       PHE  91   7.724  -2.565  -1.302
  735    H    SER  92           H        SER  92   9.219   1.489  -7.404
  736    HA   SER  92           HA       SER  92  10.704   2.833  -5.287
  737   1HB   SER  92          1HB       SER  92  10.956   3.761  -7.512
  738   2HB   SER  92          2HB       SER  92   9.207   3.918  -7.682
  739    HG   SER  92           HG       SER  92  11.002   5.536  -6.381
  740    H    VAL  93           H        VAL  93   9.624   2.710  -3.408
  741    HA   VAL  93           HA       VAL  93   6.801   2.917  -3.139
  742    HB   VAL  93           HB       VAL  93   8.308   1.844  -1.459
  743   1HG1  VAL  93          1HG1      VAL  93  10.109   3.454  -1.442
  744   2HG1  VAL  93          2HG1      VAL  93   9.435   3.297   0.180
  745   3HG1  VAL  93          3HG1      VAL  93   9.026   4.696  -0.812
  746   1HG2  VAL  93          1HG2      VAL  93   6.020   2.438  -0.877
  747   2HG2  VAL  93          2HG2      VAL  93   6.544   4.056  -0.415
  748   3HG2  VAL  93          3HG2      VAL  93   7.091   2.657   0.507
  749    H    LYS  94           H        LYS  94   9.350   5.219  -3.441
  750    HA   LYS  94           HA       LYS  94   8.313   7.442  -2.137
  751   1HB   LYS  94          1HB       LYS  94  10.580   7.279  -3.162
  752   2HB   LYS  94          2HB       LYS  94   9.839   7.441  -4.748
  753   1HG   LYS  94          2HG       LYS  94   8.979   9.653  -4.093
  754   2HG   LYS  94          1HG       LYS  94   9.803   9.488  -2.542
  755   1HD   LYS  94          1HD       LYS  94  11.952   9.325  -3.699
  756   2HD   LYS  94          2HD       LYS  94  11.129   9.486  -5.252
  757   1HE   LYS  94          2HE       LYS  94  11.170  11.542  -3.046
  758   2HE   LYS  94          1HE       LYS  94  12.105  11.609  -4.539
  759   1HZ   LYS  94          1HZ       LYS  94   9.141  11.634  -4.355
  760   2HZ   LYS  94          2HZ       LYS  94  10.038  11.697  -5.788
  761   3HZ   LYS  94          3HZ       LYS  94  10.122  12.974  -4.682
  762    H    GLU  95           H        GLU  95   7.638   6.193  -5.369
  763    HA   GLU  95           HA       GLU  95   5.567   8.217  -5.763
  764   1HB   GLU  95          2HB       GLU  95   5.319   7.044  -8.008
  765   2HB   GLU  95          1HB       GLU  95   6.844   7.871  -7.722
  766   1HG   GLU  95          1HG       GLU  95   7.893   5.738  -7.154
  767   2HG   GLU  95          2HG       GLU  95   6.365   4.911  -7.449
  768    H    HIS  96           H        HIS  96   4.098   7.543  -4.163
  769    HA   HIS  96           HA       HIS  96   3.315   4.844  -3.837
  770   1HB   HIS  96          2HB       HIS  96   1.905   7.354  -2.913
  771   2HB   HIS  96          1HB       HIS  96   1.597   5.724  -2.324
  772    HD1  HIS  96           1HD      HIS  96   2.947   4.972  -0.371
  773    HD2  HIS  96           2HD      HIS  96   4.596   8.296  -2.241
  774    HE1  HIS  96           1HE      HIS  96   4.859   5.689   1.096
  775    HE2  HIS  96           2HE      HIS  96   5.784   7.756  -0.008
  776    H    ARG  97           H        ARG  97   2.352   7.257  -6.048
  777    HA   ARG  97           HA       ARG  97  -0.306   6.458  -6.545
  778   1HB   ARG  97          2HB       ARG  97   0.626   8.591  -7.339
  779   2HB   ARG  97          1HB       ARG  97   1.689   7.720  -8.436
  780   1HG   ARG  97          1HG       ARG  97  -0.243   6.868  -9.651
  781   2HG   ARG  97          2HG       ARG  97  -1.321   7.715  -8.538
  782   1HD   ARG  97          1HD       ARG  97  -0.353   9.852  -9.236
  783   2HD   ARG  97          2HD       ARG  97   0.715   9.004 -10.353
  784    HE   ARG  97           HE       ARG  97  -1.846   8.233 -11.018
  785   1HH1  ARG  97          2HH1      ARG  97  -0.053  11.216 -10.857
  786   2HH1  ARG  97          1HH1      ARG  97  -0.953  11.976 -12.126
  787   1HH2  ARG  97          1HH2      ARG  97  -3.037   9.226 -12.691
  788   2HH2  ARG  97          2HH2      ARG  97  -2.649  10.844 -13.168
  789    H    LYS  98           H        LYS  98   2.671   5.706  -8.365
  790    HA   LYS  98           HA       LYS  98   1.327   3.799 -10.010
  791   1HB   LYS  98          1HB       LYS  98   4.268   4.384  -9.654
  792   2HB   LYS  98          2HB       LYS  98   3.608   3.307 -10.877
  793   1HG   LYS  98          2HG       LYS  98   2.341   5.199 -11.820
  794   2HG   LYS  98          1HG       LYS  98   3.093   6.263 -10.630
  795   1HD   LYS  98          1HD       LYS  98   4.374   6.543 -12.575
  796   2HD   LYS  98          2HD       LYS  98   5.324   5.454 -11.564
  797   1HE   LYS  98          1HE       LYS  98   3.474   4.537 -13.758
  798   2HE   LYS  98          2HE       LYS  98   5.204   4.800 -13.972
  799   1HZ   LYS  98          1HZ       LYS  98   5.570   3.142 -12.187
  800   2HZ   LYS  98          2HZ       LYS  98   4.830   2.497 -13.565
  801   3HZ   LYS  98          3HZ       LYS  98   3.910   2.818 -12.183
  802    H    ILE  99           H        ILE  99   3.144   3.653  -7.052
  803    HA   ILE  99           HA       ILE  99   3.841   0.899  -7.225
  804    HB   ILE  99           HB       ILE  99   4.888   2.779  -5.757
  805   1HG1  ILE  99          1HG1      ILE  99   5.512   0.324  -5.886
  806   2HG1  ILE  99          2HG1      ILE  99   5.920   1.144  -4.384
  807   1HG2  ILE  99          1HG2      ILE  99   4.149   2.759  -3.426
  808   2HG2  ILE  99          2HG2      ILE  99   2.772   1.755  -3.883
  809   3HG2  ILE  99          3HG2      ILE  99   2.913   3.396  -4.514
  810   1HD1  ILE  99          1HD1      ILE  99   3.565  -0.673  -4.824
  811   2HD1  ILE  99          2HD1      ILE  99   3.950   0.166  -3.322
  812   3HD1  ILE  99          3HD1      ILE  99   5.046  -1.065  -3.950
  813    H    TYR 100           H        TYR 100   1.151   2.639  -5.729
  814    HA   TYR 100           HA       TYR 100   0.097   0.185  -4.611
  815   1HB   TYR 100          2HB       TYR 100  -0.624   3.074  -4.428
  816   2HB   TYR 100          1HB       TYR 100  -1.856   1.871  -4.051
  817    HD1  TYR 100           1HD      TYR 100  -1.762   3.016  -1.755
  818    HD2  TYR 100           2HD      TYR 100   1.460   0.751  -3.367
  819    HE1  TYR 100           1HE      TYR 100  -0.826   2.747   0.504
  820    HE2  TYR 100           2HE      TYR 100   2.398   0.475  -1.121
  821    HH   TYR 100           HH       TYR 100   0.674   1.197   1.703
  822    H    THR 101           H        THR 101  -0.365   2.134  -7.445
  823    HA   THR 101           HA       THR 101  -2.941   1.108  -8.122
  824    HB   THR 101           HB       THR 101  -1.957   3.238  -9.055
  825    HG1  THR 101           1HG      THR 101  -3.558   1.459 -10.162
  826   1HG2  THR 101          1HG2      THR 101  -0.541   3.036 -11.047
  827   2HG2  THR 101          2HG2      THR 101  -0.450   1.292 -10.804
  828   3HG2  THR 101          3HG2      THR 101   0.261   2.385  -9.617
  829    H    MET 102           H        MET 102   0.342   0.019  -8.588
  830    HA   MET 102           HA       MET 102  -0.528  -2.147 -10.329
  831   1HB   MET 102          2HB       MET 102   1.840  -2.814 -10.358
  832   2HB   MET 102          1HB       MET 102   1.618  -1.136 -10.832
  833   1HG   MET 102          1HG       MET 102   2.339  -0.394  -8.642
  834   2HG   MET 102          2HG       MET 102   2.498  -2.067  -8.110
  835   1HE   MET 102          1HE       MET 102   4.897  -1.156  -7.297
  836   2HE   MET 102          2HE       MET 102   4.857   0.382  -8.158
  837   3HE   MET 102          3HE       MET 102   6.208  -0.727  -8.397
  838    H    ILE 103           H        ILE 103   0.134  -1.564  -6.963
  839    HA   ILE 103           HA       ILE 103   0.178  -4.160  -5.960
  840    HB   ILE 103           HB       ILE 103  -1.183  -1.682  -4.916
  841   1HG1  ILE 103          2HG1      ILE 103   1.269  -1.676  -4.919
  842   2HG1  ILE 103          1HG1      ILE 103   0.643  -1.720  -3.275
  843   1HG2  ILE 103          1HG2      ILE 103  -0.951  -4.359  -3.547
  844   2HG2  ILE 103          2HG2      ILE 103  -2.441  -3.589  -4.094
  845   3HG2  ILE 103          3HG2      ILE 103  -1.502  -2.864  -2.788
  846   1HD1  ILE 103          1HD1      ILE 103   2.552  -3.190  -3.531
  847   2HD1  ILE 103          2HD1      ILE 103   1.719  -4.069  -4.815
  848   3HD1  ILE 103          3HD1      ILE 103   1.094  -4.113  -3.166
  849    H    TYR 104           H        TYR 104  -2.706  -2.163  -6.626
  850    HA   TYR 104           HA       TYR 104  -4.405  -4.513  -6.612
  851   1HB   TYR 104          1HB       TYR 104  -5.055  -1.618  -7.212
  852   2HB   TYR 104          2HB       TYR 104  -6.235  -2.914  -7.034
  853    HD1  TYR 104           1HD      TYR 104  -6.798  -3.794  -4.852
  854    HD2  TYR 104           2HD      TYR 104  -3.878  -0.729  -5.267
  855    HE1  TYR 104           1HE      TYR 104  -6.906  -3.372  -2.432
  856    HE2  TYR 104           2HE      TYR 104  -3.977  -0.300  -2.848
  857    HH   TYR 104           HH       TYR 104  -5.486  -2.407  -0.666
  858    H    ARG 105           H        ARG 105  -3.618  -5.700  -8.368
  859    HA   ARG 105           HA       ARG 105  -3.101  -4.560 -10.906
  860   1HB   ARG 105          1HB       ARG 105  -2.056  -6.651 -10.096
  861   2HB   ARG 105          2HB       ARG 105  -3.615  -7.455 -10.201
  862   1HG   ARG 105          2HG       ARG 105  -2.297  -8.033 -12.117
  863   2HG   ARG 105          1HG       ARG 105  -3.641  -7.011 -12.631
  864   1HD   ARG 105          2HD       ARG 105  -1.568  -6.361 -13.739
  865   2HD   ARG 105          1HD       ARG 105  -2.162  -5.075 -12.690
  866    HE   ARG 105           HE       ARG 105  -0.361  -6.607 -11.217
  867   1HH1  ARG 105          2HH1      ARG 105  -0.357  -4.504 -13.995
  868   2HH1  ARG 105          1HH1      ARG 105   1.277  -3.980 -13.757
  869   1HH2  ARG 105          1HH2      ARG 105   1.790  -5.923 -10.895
  870   2HH2  ARG 105          2HH2      ARG 105   2.498  -4.787 -11.995
  871    H    ASN 106           H        ASN 106  -5.543  -7.060 -10.194
  872    HA   ASN 106           HA       ASN 106  -7.041  -6.294 -12.525
  873   1HB   ASN 106          1HB       ASN 106  -7.628  -8.341 -10.376
  874   2HB   ASN 106          2HB       ASN 106  -8.565  -8.136 -11.853
  875   1HD2  ASN 106          1HD2      ASN 106  -8.130 -10.213 -12.551
  876   2HD2  ASN 106          2HD2      ASN 106  -6.577 -10.684 -13.143
  877    H    LEU 107           H        LEU 107  -8.474  -7.001  -9.368
  878    HA   LEU 107           HA       LEU 107  -9.356  -4.384  -8.815
  879   1HB   LEU 107          1HB       LEU 107 -11.667  -4.466  -9.388
  880   2HB   LEU 107          2HB       LEU 107 -10.744  -4.828 -10.828
  881    HG   LEU 107           HG       LEU 107 -12.539  -6.301 -10.935
  882   1HD1  LEU 107          1HD1      LEU 107 -11.647  -8.542 -10.572
  883   2HD1  LEU 107          2HD1      LEU 107 -10.343  -7.866  -9.596
  884   3HD1  LEU 107          3HD1      LEU 107 -10.453  -7.477 -11.313
  885   1HD2  LEU 107          1HD2      LEU 107 -13.380  -7.630  -9.080
  886   2HD2  LEU 107          2HD2      LEU 107 -13.421  -5.906  -8.704
  887   3HD2  LEU 107          3HD2      LEU 107 -12.161  -6.930  -8.015
  888    H    VAL 108           H        VAL 108 -10.386  -4.218  -6.838
  889    HA   VAL 108           HA       VAL 108 -11.676  -6.314  -5.495
  890    HB   VAL 108           HB       VAL 108  -9.539  -7.386  -5.276
  891   1HG1  VAL 108          1HG1      VAL 108  -8.532  -4.795  -4.109
  892   2HG1  VAL 108          2HG1      VAL 108  -8.096  -5.472  -5.678
  893   3HG1  VAL 108          3HG1      VAL 108  -7.624  -6.304  -4.197
  894   1HG2  VAL 108          1HG2      VAL 108 -10.289  -6.032  -2.688
  895   2HG2  VAL 108          2HG2      VAL 108  -9.307  -7.490  -2.839
  896   3HG2  VAL 108          3HG2      VAL 108 -10.999  -7.511  -3.335
  897    H    VAL 109           H        VAL 109 -13.117  -5.124  -4.446
  898    HA   VAL 109           HA       VAL 109 -12.199  -2.948  -2.720
  899    HB   VAL 109           HB       VAL 109 -14.015  -1.461  -3.515
  900   1HG1  VAL 109          1HG1      VAL 109 -12.036  -2.291  -5.635
  901   2HG1  VAL 109          2HG1      VAL 109 -11.746  -1.141  -4.330
  902   3HG1  VAL 109          3HG1      VAL 109 -12.917  -0.763  -5.594
  903   1HG2  VAL 109          1HG2      VAL 109 -15.095  -1.921  -5.665
  904   2HG2  VAL 109          2HG2      VAL 109 -15.491  -3.150  -4.462
  905   3HG2  VAL 109          3HG2      VAL 109 -14.306  -3.497  -5.722
  906    H    VAL 110           H        VAL 110 -14.428  -1.973  -1.703
  907    HA   VAL 110           HA       VAL 110 -15.437  -3.880   0.045
  908    HB   VAL 110           HB       VAL 110 -15.597  -1.471   0.461
  909   1HG1  VAL 110          1HG1      VAL 110 -17.722  -1.518  -1.673
  910   2HG1  VAL 110          2HG1      VAL 110 -16.144  -0.741  -1.788
  911   3HG1  VAL 110          3HG1      VAL 110 -17.339  -0.143  -0.636
  912   1HG2  VAL 110          1HG2      VAL 110 -17.864  -1.439   1.399
  913   2HG2  VAL 110          2HG2      VAL 110 -17.047  -2.971   1.714
  914   3HG2  VAL 110          3HG2      VAL 110 -18.271  -2.867   0.448
  915    H    ASN 111           H        ASN 111 -17.316  -5.089   0.139
  916    HA   ASN 111           HA       ASN 111 -18.408  -5.817  -2.450
  917   1HB   ASN 111          2HB       ASN 111 -17.729  -7.596  -0.913
  918   2HB   ASN 111          1HB       ASN 111 -18.865  -7.005   0.296
  919   1HD2  ASN 111          2HD2      ASN 111 -18.506  -8.651  -2.740
  920   2HD2  ASN 111          1HD2      ASN 111 -20.111  -9.284  -2.817
  921    H    GLN 112           H        GLN 112 -19.978  -5.381   0.721
  922    HA   GLN 112           HA       GLN 112 -21.988  -4.503   1.318
  923   1HB   GLN 112          1HB       GLN 112 -20.919  -2.418   0.585
  924   2HB   GLN 112          2HB       GLN 112 -21.479  -2.703  -1.058
  925   1HG   GLN 112          1HG       GLN 112 -23.794  -2.537  -0.300
  926   2HG   GLN 112          2HG       GLN 112 -23.232  -2.248   1.346
  927   1HE2  GLN 112          2HE2      GLN 112 -20.973  -0.626   0.442
  928   2HE2  GLN 112          1HE2      GLN 112 -21.639   0.898  -0.023
  929    H    GLN 113           H        GLN 113 -23.309  -6.253   0.940
  930    HA   GLN 113           HA       GLN 113 -24.251  -7.103  -1.556
  931   1HB   GLN 113          2HB       GLN 113 -25.997  -8.294  -0.282
  932   2HB   GLN 113          1HB       GLN 113 -24.398  -8.518   0.413
  933   1HG   GLN 113          1HG       GLN 113 -24.895  -6.856   2.121
  934   2HG   GLN 113          2HG       GLN 113 -26.491  -6.602   1.417
  935   1HE2  GLN 113          1HE2      GLN 113 -26.833  -9.439   0.802
  936   2HE2  GLN 113          2HE2      GLN 113 -27.178 -10.213   2.308
  937    H    GLU 114           H        GLU 114 -26.222  -6.788  -2.626
  938    HA   GLU 114           HA       GLU 114 -27.795  -4.457  -1.768
  939   1HB   GLU 114          2HB       GLU 114 -26.830  -5.015  -4.578
  940   2HB   GLU 114          1HB       GLU 114 -27.940  -3.728  -4.127
  941   1HG   GLU 114          1HG       GLU 114 -26.203  -2.716  -2.738
  942   2HG   GLU 114          2HG       GLU 114 -25.090  -4.004  -3.198
  943    H    SER 115           H        SER 115 -29.821  -4.311  -3.309
  944    HA   SER 115           HA       SER 115 -30.880  -6.999  -3.819
  945   1HB   SER 115          2HB       SER 115 -33.014  -6.384  -2.734
  946   2HB   SER 115          1HB       SER 115 -31.671  -6.360  -1.591
  947    HG   SER 115           HG       SER 115 -32.868  -4.127  -2.865
  948    H    SER 116           H        SER 116 -32.455  -7.128  -5.422
  949    HA   SER 116           HA       SER 116 -32.407  -4.917  -7.302
  950   1HB   SER 116          2HB       SER 116 -32.016  -7.219  -8.103
  951   2HB   SER 116          1HB       SER 116 -33.634  -7.674  -7.566
  952    HG   SER 116           HG       SER 116 -33.223  -6.981  -9.885
  953    H    ASP 117           H        ASP 117 -33.833  -4.347  -4.967
  954    HA   ASP 117           HA       ASP 117 -35.778  -3.409  -4.268
  955   1HB   ASP 117          2HB       ASP 117 -35.673  -2.186  -6.385
  956   2HB   ASP 117          1HB       ASP 117 -36.485  -3.514  -7.208
  957    H    SER 118           H        SER 118 -37.298  -5.157  -6.936
  958    HA   SER 118           HA       SER 118 -38.995  -6.531  -5.002
  959   1HB   SER 118          1HB       SER 118 -40.102  -5.391  -6.865
  960   2HB   SER 118          2HB       SER 118 -39.182  -6.357  -8.019
  961    HG   SER 118           HG       SER 118 -40.956  -7.429  -6.082
  962    H    SER 119           H        SER 119 -37.676  -8.149  -4.197
  963    HA   SER 119           HA       SER 119 -37.419 -10.474  -5.884
  964   1HB   SER 119          2HB       SER 119 -35.326  -9.314  -6.410
  965   2HB   SER 119          1HB       SER 119 -34.945  -9.194  -4.693
  966    HG   SER 119           HG       SER 119 -34.648 -11.304  -6.407
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1  30.048  20.201  22.010
    2   2H    MET   1          2H        MET   1  29.848  20.811  20.446
    3   3H    MET   1          3H        MET   1  31.378  20.318  20.972
    4    HA   MET   1           HA       MET   1  29.027  18.555  20.602
    5   1HB   MET   1          1HB       MET   1  31.569  18.814  18.980
    6   2HB   MET   1          2HB       MET   1  30.309  17.616  18.716
    7   1HG   MET   1          1HG       MET   1  28.721  19.394  18.196
    8   2HG   MET   1          2HG       MET   1  29.981  20.597  18.463
    9   1HE   MET   1          1HE       MET   1  32.141  20.846  16.930
   10   2HE   MET   1          2HE       MET   1  32.492  19.789  15.563
   11   3HE   MET   1          3HE       MET   1  32.525  19.147  17.207
   12    H    CYS   2           H        CYS   2  29.233  17.471  22.539
   13    HA   CYS   2           HA       CYS   2  31.815  16.177  23.080
   14   1HB   CYS   2          2HB       CYS   2  30.948  15.803  25.357
   15   2HB   CYS   2          1HB       CYS   2  30.941  17.510  24.929
   16    HG   CYS   2           HG       CYS   2  28.656  17.191  26.370
   17    H    ASN   3           H        ASN   3  28.563  15.590  22.130
   18    HA   ASN   3           HA       ASN   3  28.726  12.739  22.722
   19   1HB   ASN   3          2HB       ASN   3  26.392  12.664  21.920
   20   2HB   ASN   3          1HB       ASN   3  26.610  13.861  23.193
   21   1HD2  ASN   3          1HD2      ASN   3  26.009  13.346  19.815
   22   2HD2  ASN   3          2HD2      ASN   3  25.514  14.960  19.449
   23    H    THR   4           H        THR   4  29.008  11.168  21.228
   24    HA   THR   4           HA       THR   4  29.520  12.045  18.465
   25    HB   THR   4           HB       THR   4  30.548   9.568  19.864
   26    HG1  THR   4           1HG      THR   4  32.487  10.683  19.990
   27   1HG2  THR   4          1HG2      THR   4  32.012   9.352  17.903
   28   2HG2  THR   4          2HG2      THR   4  31.222  10.744  17.164
   29   3HG2  THR   4          3HG2      THR   4  30.309   9.262  17.450
   30    H    ASN   5           H        ASN   5  27.487  11.846  17.583
   31    HA   ASN   5           HA       ASN   5  26.660   9.177  16.912
   32   1HB   ASN   5          1HB       ASN   5  25.606   9.568  19.162
   33   2HB   ASN   5          2HB       ASN   5  24.703  10.900  18.447
   34   1HD2  ASN   5          2HD2      ASN   5  23.741   8.442  19.664
   35   2HD2  ASN   5          1HD2      ASN   5  22.788   7.650  18.461
   36    H    MET   6           H        MET   6  25.857   9.182  14.907
   37    HA   MET   6           HA       MET   6  24.949  11.757  13.798
   38   1HB   MET   6          1HB       MET   6  26.329   9.475  12.371
   39   2HB   MET   6          2HB       MET   6  25.768  10.960  11.614
   40   1HG   MET   6          1HG       MET   6  27.896  10.752  13.732
   41   2HG   MET   6          2HG       MET   6  28.163  11.011  12.008
   42   1HE   MET   6          1HE       MET   6  29.121  14.473  13.580
   43   2HE   MET   6          2HE       MET   6  29.660  13.139  12.560
   44   3HE   MET   6          3HE       MET   6  29.391  12.880  14.284
   45    H    SER   7           H        SER   7  23.067  10.285  15.065
   46    HA   SER   7           HA       SER   7  21.614   8.867  12.939
   47   1HB   SER   7          2HB       SER   7  20.232   7.925  14.750
   48   2HB   SER   7          1HB       SER   7  21.942   7.578  15.001
   49    HG   SER   7           HG       SER   7  20.837   9.879  16.156
   50    H    VAL   8           H        VAL   8  19.665   9.569  12.222
   51    HA   VAL   8           HA       VAL   8  18.283  11.709  13.627
   52    HB   VAL   8           HB       VAL   8  19.694  13.024  12.225
   53   1HG1  VAL   8          1HG2      VAL   8  19.821  12.722   9.793
   54   2HG1  VAL   8          2HG2      VAL   8  18.811  11.283   9.927
   55   3HG1  VAL   8          3HG2      VAL   8  20.412  11.310  10.666
   56   1HG2  VAL   8          1HG1      VAL   8  18.078  14.160  10.775
   57   2HG2  VAL   8          2HG1      VAL   8  17.384  13.776  12.352
   58   3HG2  VAL   8          3HG1      VAL   8  16.973  12.795  10.945
   59    HA   PRO   9           HA       PRO   9  15.262   8.640  12.070
   60   1HB   PRO   9          1HB       PRO   9  13.603  10.001  14.104
   61   2HB   PRO   9          2HB       PRO   9  13.935   8.279  13.893
   62   1HG   PRO   9          1HG       PRO   9  15.026   9.666  15.904
   63   2HG   PRO   9          2HG       PRO   9  15.924   8.383  15.071
   64   1HD   PRO   9          1HD       PRO   9  16.139  11.355  14.766
   65   2HD   PRO   9          2HD       PRO   9  17.425  10.129  14.804
   66    H    THR  10           H        THR  10  12.793   9.056  11.631
   67    HA   THR  10           HA       THR  10  11.175  10.148  10.468
   68    HB   THR  10           HB       THR  10  12.613  12.675  11.304
   69    HG1  THR  10           1HG      THR  10  11.825  12.178  13.198
   70   1HG2  THR  10          1HG2      THR  10  11.083  13.035   9.428
   71   2HG2  THR  10          2HG2      THR  10  10.451  13.767  10.903
   72   3HG2  THR  10          3HG2      THR  10   9.788  12.239  10.323
   73    H    ASP  11           H        ASP  11  10.948  10.297   8.335
   74    HA   ASP  11           HA       ASP  11  13.135  10.420   6.576
   75   1HB   ASP  11          1HB       ASP  11  10.198  10.893   6.014
   76   2HB   ASP  11          2HB       ASP  11  11.432  10.598   4.792
   77    H    GLY  12           H        GLY  12  14.136  12.054   5.554
   78   1HA   GLY  12          2HA       GLY  12  13.685  14.723   6.486
   79   2HA   GLY  12          1HA       GLY  12  14.887  14.222   5.307
   80    H    ALA  13           H        ALA  13  14.617  15.559   3.634
   81    HA   ALA  13           HA       ALA  13  13.679  16.650   1.874
   82   1HB   ALA  13          1HB       ALA  13  13.054  14.381   1.196
   83   2HB   ALA  13          2HB       ALA  13  11.839  15.563   0.707
   84   3HB   ALA  13          3HB       ALA  13  11.549  14.526   2.104
   85    H    VAL  14           H        VAL  14  11.225  17.394   1.110
   86    HA   VAL  14           HA       VAL  14  10.309  18.991   3.394
   87    HB   VAL  14           HB       VAL  14   9.750  19.407   0.454
   88   1HG1  VAL  14          1HG1      VAL  14   9.254  21.189   2.837
   89   2HG1  VAL  14          2HG1      VAL  14   8.025  20.350   1.891
   90   3HG1  VAL  14          3HG1      VAL  14   8.986  21.629   1.151
   91   1HG2  VAL  14          1HG2      VAL  14  11.361  21.250   0.605
   92   2HG2  VAL  14          2HG2      VAL  14  12.116  19.691   0.936
   93   3HG2  VAL  14          3HG2      VAL  14  11.731  20.784   2.266
   94    H    THR  15           H        THR  15   8.672  17.804   0.463
   95    HA   THR  15           HA       THR  15   6.285  17.296   2.063
   96    HB   THR  15           HB       THR  15   5.925  18.595   0.057
   97    HG1  THR  15           1HG      THR  15   4.904  16.076  -0.673
   98   1HG2  THR  15          1HG2      THR  15   6.334  17.654  -2.172
   99   2HG2  THR  15          2HG2      THR  15   7.065  16.230  -1.432
  100   3HG2  THR  15          3HG2      THR  15   7.830  17.807  -1.250
  101    H    THR  16           H        THR  16   5.177  15.320   2.047
  102    HA   THR  16           HA       THR  16   6.605  13.018   0.915
  103    HB   THR  16           HB       THR  16   6.158  11.705   2.957
  104    HG1  THR  16           1HG      THR  16   5.534  12.881   4.852
  105   1HG2  THR  16          1HG2      THR  16   7.880  12.731   4.372
  106   2HG2  THR  16          2HG2      THR  16   7.747  14.227   3.448
  107   3HG2  THR  16          3HG2      THR  16   8.344  12.762   2.672
  108    H    SER  17           H        SER  17   5.309  11.224   0.408
  109    HA   SER  17           HA       SER  17   3.451  10.139  -0.321
  110   1HB   SER  17          1HB       SER  17   2.814  10.170   2.052
  111   2HB   SER  17          2HB       SER  17   2.066  11.752   1.836
  112    HG   SER  17           HG       SER  17   1.284   9.527   0.285
  113    H    GLN  18           H        GLN  18   1.116  10.547  -1.171
  114    HA   GLN  18           HA       GLN  18   0.720  13.231  -2.214
  115   1HB   GLN  18          1HB       GLN  18   0.449  12.238  -4.550
  116   2HB   GLN  18          2HB       GLN  18   2.095  12.443  -3.966
  117   1HG   GLN  18          1HG       GLN  18   2.108  10.051  -3.323
  118   2HG   GLN  18          2HG       GLN  18   0.514   9.891  -4.064
  119   1HE2  GLN  18          1HE2      GLN  18   1.126  11.741  -6.218
  120   2HE2  GLN  18          2HE2      GLN  18   2.173  10.896  -7.302
  121    H    ILE  19           H        ILE  19  -0.325   9.905  -1.853
  122    HA   ILE  19           HA       ILE  19  -2.521  10.302  -3.604
  123    HB   ILE  19           HB       ILE  19  -3.073   7.919  -3.058
  124   1HG1  ILE  19          2HG1      ILE  19  -0.516   8.108  -1.445
  125   2HG1  ILE  19          1HG1      ILE  19  -2.132   7.897  -0.774
  126   1HG2  ILE  19          1HG2      ILE  19  -0.834   7.088  -4.048
  127   2HG2  ILE  19          2HG2      ILE  19  -0.403   8.800  -4.093
  128   3HG2  ILE  19          3HG2      ILE  19  -1.814   8.219  -4.983
  129   1HD1  ILE  19          1HD1      ILE  19  -0.749   5.964  -2.613
  130   2HD1  ILE  19          2HD1      ILE  19  -2.330   5.748  -1.861
  131   3HD1  ILE  19          3HD1      ILE  19  -0.877   5.804  -0.861
  132    HA   PRO  20           HA       PRO  20  -5.148  11.918  -0.342
  133   1HB   PRO  20          1HB       PRO  20  -7.202  11.654  -2.467
  134   2HB   PRO  20          2HB       PRO  20  -6.756  13.064  -1.502
  135   1HG   PRO  20          1HG       PRO  20  -6.047  12.884  -4.065
  136   2HG   PRO  20          2HG       PRO  20  -4.951  13.588  -2.860
  137   1HD   PRO  20          1HD       PRO  20  -4.892  10.875  -4.121
  138   2HD   PRO  20          2HD       PRO  20  -3.546  11.962  -3.719
  139    H    ALA  21           H        ALA  21  -6.541  11.019   1.099
  140    HA   ALA  21           HA       ALA  21  -7.177   8.231   0.869
  141   1HB   ALA  21          1HB       ALA  21  -8.051  10.240   2.942
  142   2HB   ALA  21          2HB       ALA  21  -6.600   9.239   3.025
  143   3HB   ALA  21          3HB       ALA  21  -8.196   8.487   3.066
  144    H    SER  22           H        SER  22  -9.396   7.399   1.194
  145    HA   SER  22           HA       SER  22 -11.529   7.131   0.461
  146   1HB   SER  22          2HB       SER  22 -11.607  10.152   0.667
  147   2HB   SER  22          1HB       SER  22 -13.016   9.108   0.482
  148    HG   SER  22           HG       SER  22 -11.187   9.114   2.652
  149    H    GLU  23           H        GLU  23  -9.167   8.125  -1.387
  150    HA   GLU  23           HA       GLU  23 -10.672   8.894  -3.743
  151   1HB   GLU  23          2HB       GLU  23  -8.430   9.823  -3.389
  152   2HB   GLU  23          1HB       GLU  23  -7.746   8.203  -3.407
  153   1HG   GLU  23          2HG       GLU  23  -7.375   9.320  -5.521
  154   2HG   GLU  23          1HG       GLU  23  -8.441   7.931  -5.729
  155    H    GLN  24           H        GLN  24  -8.166   6.388  -3.545
  156    HA   GLN  24           HA       GLN  24 -10.012   4.484  -4.797
  157   1HB   GLN  24          1HB       GLN  24  -7.042   4.268  -4.263
  158   2HB   GLN  24          2HB       GLN  24  -8.015   3.066  -5.101
  159   1HG   GLN  24          2HG       GLN  24  -8.507   4.685  -6.860
  160   2HG   GLN  24          1HG       GLN  24  -7.536   5.892  -6.020
  161   1HE2  GLN  24          1HE2      GLN  24  -5.542   3.921  -5.191
  162   2HE2  GLN  24          2HE2      GLN  24  -4.609   3.569  -6.600
  163    H    GLU  25           H        GLU  25 -11.130   4.685  -2.571
  164    HA   GLU  25           HA       GLU  25  -9.937   3.814  -0.217
  165   1HB   GLU  25          2HB       GLU  25 -12.057   4.995  -0.205
  166   2HB   GLU  25          1HB       GLU  25 -12.839   3.657  -1.038
  167   1HG   GLU  25          1HG       GLU  25 -12.341   2.210   0.905
  168   2HG   GLU  25          2HG       GLU  25 -11.681   3.618   1.739
  169    H    THR  26           H        THR  26 -12.240   1.917  -2.180
  170    HA   THR  26           HA       THR  26 -11.944  -0.174  -3.082
  171    HB   THR  26           HB       THR  26  -9.392  -0.026  -1.521
  172    HG1  THR  26           1HG      THR  26  -8.722   0.468  -3.455
  173   1HG2  THR  26          1HG2      THR  26 -10.273  -2.289  -1.160
  174   2HG2  THR  26          2HG2      THR  26  -8.834  -2.299  -2.181
  175   3HG2  THR  26          3HG2      THR  26 -10.429  -2.501  -2.906
  176    H    LEU  27           H        LEU  27 -11.611   0.365   0.338
  177    HA   LEU  27           HA       LEU  27 -11.888  -0.927   2.160
  178   1HB   LEU  27          1HB       LEU  27 -14.297  -0.813   1.020
  179   2HB   LEU  27          2HB       LEU  27 -14.007  -2.532   0.815
  180    HG   LEU  27           HG       LEU  27 -15.190  -2.358   2.843
  181   1HD1  LEU  27          1HD1      LEU  27 -13.300  -3.838   3.051
  182   2HD1  LEU  27          2HD1      LEU  27 -13.514  -2.969   4.573
  183   3HD1  LEU  27          3HD1      LEU  27 -12.241  -2.481   3.447
  184   1HD2  LEU  27          1HD2      LEU  27 -14.953   0.073   3.108
  185   2HD2  LEU  27          2HD2      LEU  27 -13.291  -0.157   3.654
  186   3HD2  LEU  27          3HD2      LEU  27 -14.632  -0.787   4.613
  187    H    VAL  28           H        VAL  28  -9.935  -1.980   2.043
  188    HA   VAL  28           HA       VAL  28  -9.449  -3.686  -0.185
  189    HB   VAL  28           HB       VAL  28  -7.695  -2.976   2.144
  190   1HG1  VAL  28          1HG2      VAL  28  -7.053  -4.310  -0.475
  191   2HG1  VAL  28          2HG2      VAL  28  -6.930  -5.019   1.136
  192   3HG1  VAL  28          3HG2      VAL  28  -5.852  -3.705   0.665
  193   1HG2  VAL  28          1HG1      VAL  28  -6.689  -1.410   0.528
  194   2HG2  VAL  28          2HG1      VAL  28  -8.384  -1.052   0.865
  195   3HG2  VAL  28          3HG1      VAL  28  -7.934  -1.863  -0.634
  196    H    ARG  29           H        ARG  29  -9.984  -5.710  -0.226
  197    HA   ARG  29           HA       ARG  29  -9.724  -7.253   2.211
  198   1HB   ARG  29          1HB       ARG  29 -12.221  -7.405   0.528
  199   2HB   ARG  29          2HB       ARG  29 -11.956  -8.091   2.125
  200   1HG   ARG  29          2HG       ARG  29 -11.979  -5.921   3.135
  201   2HG   ARG  29          1HG       ARG  29 -12.005  -5.128   1.556
  202   1HD   ARG  29          1HD       ARG  29 -14.222  -5.167   2.634
  203   2HD   ARG  29          2HD       ARG  29 -14.201  -6.034   1.099
  204    HE   ARG  29           HE       ARG  29 -13.716  -7.920   3.054
  205   1HH1  ARG  29          2HH1      ARG  29 -16.267  -5.688   2.243
  206   2HH1  ARG  29          1HH1      ARG  29 -17.522  -6.683   2.901
  207   1HH2  ARG  29          1HH2      ARG  29 -15.361  -9.237   3.923
  208   2HH2  ARG  29          2HH2      ARG  29 -17.007  -8.700   3.856
  209    HA   PRO  30           HA       PRO  30  -8.503  -9.446  -1.714
  210   1HB   PRO  30          1HB       PRO  30  -5.846  -9.371  -1.555
  211   2HB   PRO  30          2HB       PRO  30  -6.765  -7.942  -2.039
  212   1HG   PRO  30          2HG       PRO  30  -5.476  -8.578   0.574
  213   2HG   PRO  30          1HG       PRO  30  -5.631  -7.019  -0.251
  214   1HD   PRO  30          1HD       PRO  30  -7.261  -7.964   1.830
  215   2HD   PRO  30          2HD       PRO  30  -7.607  -6.582   0.774
  216    H    LYS  31           H        LYS  31  -7.536 -11.526  -2.084
  217    HA   LYS  31           HA       LYS  31  -7.569 -13.377   0.057
  218   1HB   LYS  31          2HB       LYS  31  -6.357 -13.567  -2.709
  219   2HB   LYS  31          1HB       LYS  31  -6.474 -14.919  -1.592
  220   1HG   LYS  31          1HG       LYS  31  -8.294 -15.199  -3.006
  221   2HG   LYS  31          2HG       LYS  31  -8.990 -14.442  -1.573
  222   1HD   LYS  31          1HD       LYS  31  -9.907 -13.378  -3.520
  223   2HD   LYS  31          2HD       LYS  31  -8.817 -12.242  -2.721
  224   1HE   LYS  31          1HE       LYS  31  -7.053 -12.817  -4.321
  225   2HE   LYS  31          2HE       LYS  31  -8.151 -13.940  -5.124
  226   1HZ   LYS  31          1HZ       LYS  31  -8.535 -11.004  -4.899
  227   2HZ   LYS  31          2HZ       LYS  31  -9.602 -12.077  -5.654
  228   3HZ   LYS  31          3HZ       LYS  31  -8.054 -11.837  -6.291
  229    HA   PRO  32           HA       PRO  32  -3.673 -13.322   2.091
  230   1HB   PRO  32          2HB       PRO  32  -2.583 -15.785   1.192
  231   2HB   PRO  32          1HB       PRO  32  -3.447 -15.485   2.701
  232   1HG   PRO  32          2HG       PRO  32  -4.441 -16.611   0.140
  233   2HG   PRO  32          1HG       PRO  32  -4.982 -16.929   1.798
  234   1HD   PRO  32          2HD       PRO  32  -6.442 -15.440   0.119
  235   2HD   PRO  32          1HD       PRO  32  -6.338 -15.045   1.849
  236    H    LEU  33           H        LEU  33  -2.682 -11.652   0.977
  237    HA   LEU  33           HA       LEU  33  -0.452 -12.263  -0.671
  238   1HB   LEU  33          2HB       LEU  33  -2.663 -12.401  -2.136
  239   2HB   LEU  33          1HB       LEU  33  -2.478 -10.658  -2.159
  240    HG   LEU  33           HG       LEU  33  -1.515 -11.760  -4.148
  241   1HD1  LEU  33          1HD1      LEU  33   0.604 -10.581  -4.139
  242   2HD1  LEU  33          2HD1      LEU  33   0.538 -10.439  -2.383
  243   3HD1  LEU  33          3HD1      LEU  33  -0.651  -9.603  -3.380
  244   1HD2  LEU  33          1HD2      LEU  33   0.409 -12.978  -2.171
  245   2HD2  LEU  33          2HD2      LEU  33   0.552 -13.050  -3.928
  246   3HD2  LEU  33          3HD2      LEU  33  -0.801 -13.843  -3.121
  247    H    LEU  34           H        LEU  34  -2.717  -9.989   0.664
  248    HA   LEU  34           HA       LEU  34  -0.562  -8.009   0.877
  249   1HB   LEU  34          1HB       LEU  34  -3.348  -7.687  -0.087
  250   2HB   LEU  34          2HB       LEU  34  -2.773  -6.456   1.020
  251    HG   LEU  34           HG       LEU  34  -1.009  -5.824  -0.471
  252   1HD1  LEU  34          1HD2      LEU  34  -1.850  -8.173  -2.158
  253   2HD1  LEU  34          2HD2      LEU  34  -0.339  -8.003  -1.260
  254   3HD1  LEU  34          3HD2      LEU  34  -0.673  -6.947  -2.635
  255   1HD2  LEU  34          1HD1      LEU  34  -3.556  -6.235  -2.028
  256   2HD2  LEU  34          2HD1      LEU  34  -2.269  -5.098  -2.428
  257   3HD2  LEU  34          3HD1      LEU  34  -3.205  -4.884  -0.949
  258    H    LEU  35           H        LEU  35  -1.718 -10.240   2.495
  259    HA   LEU  35           HA       LEU  35  -2.216  -8.688   4.915
  260   1HB   LEU  35          1HB       LEU  35  -3.660 -11.265   4.441
  261   2HB   LEU  35          2HB       LEU  35  -4.044  -9.982   5.571
  262    HG   LEU  35           HG       LEU  35  -4.406  -8.608   3.327
  263   1HD1  LEU  35          1HD2      LEU  35  -5.355  -9.976   1.576
  264   2HD1  LEU  35          2HD2      LEU  35  -5.059 -11.437   2.517
  265   3HD1  LEU  35          3HD2      LEU  35  -3.699 -10.498   1.898
  266   1HD2  LEU  35          1HD1      LEU  35  -6.712  -8.916   3.624
  267   2HD2  LEU  35          2HD1      LEU  35  -5.994  -9.195   5.214
  268   3HD2  LEU  35          3HD1      LEU  35  -6.498 -10.564   4.220
  269    H    LYS  36           H        LYS  36  -1.579 -11.994   3.683
  270    HA   LYS  36           HA       LYS  36   0.259 -12.792   5.629
  271   1HB   LYS  36          1HB       LYS  36  -0.489 -14.068   3.545
  272   2HB   LYS  36          2HB       LYS  36   0.687 -13.109   2.655
  273   1HG   LYS  36          2HG       LYS  36   2.473 -13.984   4.081
  274   2HG   LYS  36          1HG       LYS  36   1.288 -14.958   4.955
  275   1HD   LYS  36          1HD       LYS  36   2.395 -16.344   3.325
  276   2HD   LYS  36          2HD       LYS  36   0.721 -16.096   2.826
  277   1HE   LYS  36          2HE       LYS  36   1.444 -14.348   1.274
  278   2HE   LYS  36          1HE       LYS  36   3.116 -14.598   1.770
  279   1HZ   LYS  36          1HZ       LYS  36   1.384 -16.621   0.457
  280   2HZ   LYS  36          2HZ       LYS  36   2.989 -16.860   0.931
  281   3HZ   LYS  36          3HZ       LYS  36   2.626 -15.750  -0.293
  282    H    LEU  37           H        LEU  37   0.205 -10.106   3.587
  283    HA   LEU  37           HA       LEU  37   3.040  -9.529   3.757
  284   1HB   LEU  37          2HB       LEU  37   1.543  -8.947   1.786
  285   2HB   LEU  37          1HB       LEU  37   0.786  -7.750   2.817
  286    HG   LEU  37           HG       LEU  37   2.460  -6.793   1.275
  287   1HD1  LEU  37          1HD1      LEU  37   3.626  -6.442   3.978
  288   2HD1  LEU  37          2HD1      LEU  37   1.924  -6.038   3.744
  289   3HD1  LEU  37          3HD1      LEU  37   3.168  -5.236   2.774
  290   1HD2  LEU  37          1HD2      LEU  37   4.008  -8.682   1.210
  291   2HD2  LEU  37          2HD2      LEU  37   4.441  -8.387   2.894
  292   3HD2  LEU  37          3HD2      LEU  37   4.830  -7.188   1.660
  293    H    LEU  38           H        LEU  38  -0.020  -8.479   5.176
  294    HA   LEU  38           HA       LEU  38   1.339  -6.404   6.708
  295   1HB   LEU  38          2HB       LEU  38  -1.608  -7.026   6.574
  296   2HB   LEU  38          1HB       LEU  38  -0.866  -5.591   7.241
  297    HG   LEU  38           HG       LEU  38  -0.956  -6.376   4.339
  298   1HD1  LEU  38          1HD2      LEU  38  -3.032  -5.445   5.301
  299   2HD1  LEU  38          2HD2      LEU  38  -2.306  -4.396   4.082
  300   3HD1  LEU  38          3HD2      LEU  38  -2.126  -4.010   5.794
  301   1HD2  LEU  38          1HD1      LEU  38   1.191  -5.359   4.873
  302   2HD2  LEU  38          2HD1      LEU  38   0.365  -3.998   5.632
  303   3HD2  LEU  38          3HD1      LEU  38   0.196  -4.279   3.898
  304    H    LYS  39           H        LYS  39  -0.982  -9.028   7.376
  305    HA   LYS  39           HA       LYS  39  -0.919  -9.203  10.084
  306   1HB   LYS  39          1HB       LYS  39  -0.669 -11.530   8.171
  307   2HB   LYS  39          2HB       LYS  39  -1.204 -11.632   9.843
  308   1HG   LYS  39          2HG       LYS  39  -3.204 -10.468   9.378
  309   2HG   LYS  39          1HG       LYS  39  -2.626  -9.963   7.788
  310   1HD   LYS  39          2HD       LYS  39  -2.671 -12.255   7.009
  311   2HD   LYS  39          1HD       LYS  39  -3.156 -12.815   8.609
  312   1HE   LYS  39          2HE       LYS  39  -4.748 -10.964   6.843
  313   2HE   LYS  39          1HE       LYS  39  -5.051 -12.688   7.052
  314   1HZ   LYS  39          1HZ       LYS  39  -5.458 -12.281   9.407
  315   2HZ   LYS  39          2HZ       LYS  39  -6.515 -11.384   8.440
  316   3HZ   LYS  39          3HZ       LYS  39  -5.200 -10.624   9.182
  317    H    SER  40           H        SER  40   1.705  -9.860   7.896
  318    HA   SER  40           HA       SER  40   3.436 -11.178   9.704
  319   1HB   SER  40          2HB       SER  40   3.843 -11.179   7.288
  320   2HB   SER  40          1HB       SER  40   4.100  -9.435   7.318
  321    HG   SER  40           HG       SER  40   5.914 -11.257   7.630
  322    H    VAL  41           H        VAL  41   3.276  -7.754   8.708
  323    HA   VAL  41           HA       VAL  41   5.184  -6.746  10.476
  324    HB   VAL  41           HB       VAL  41   2.949  -4.913  10.222
  325   1HG1  VAL  41          1HG2      VAL  41   4.585  -3.428   9.452
  326   2HG1  VAL  41          2HG2      VAL  41   5.628  -4.732   8.880
  327   3HG1  VAL  41          3HG2      VAL  41   5.421  -4.459  10.612
  328   1HG2  VAL  41          1HG1      VAL  41   3.231  -4.675   7.705
  329   2HG2  VAL  41          2HG1      VAL  41   2.234  -6.012   8.285
  330   3HG2  VAL  41          3HG1      VAL  41   3.887  -6.313   7.739
  331    H    GLY  42           H        GLY  42   1.692  -7.188  10.919
  332   1HA   GLY  42          1HA       GLY  42   1.642  -7.747  13.603
  333   2HA   GLY  42          2HA       GLY  42   1.691  -5.992  13.517
  334    H    ALA  43           H        ALA  43   0.199  -6.489  10.813
  335    HA   ALA  43           HA       ALA  43  -2.301  -5.636  11.635
  336   1HB   ALA  43          1HB       ALA  43  -3.088  -6.235   9.397
  337   2HB   ALA  43          2HB       ALA  43  -1.634  -7.197   9.142
  338   3HB   ALA  43          3HB       ALA  43  -1.511  -5.447   9.338
  339    H    GLN  44           H        GLN  44  -4.262  -6.608  12.072
  340    HA   GLN  44           HA       GLN  44  -4.462  -9.507  12.099
  341   1HB   GLN  44          1HB       GLN  44  -4.574  -7.852  14.623
  342   2HB   GLN  44          2HB       GLN  44  -5.142  -9.511  14.515
  343   1HG   GLN  44          1HG       GLN  44  -2.890 -10.244  13.918
  344   2HG   GLN  44          2HG       GLN  44  -2.321  -8.578  14.033
  345   1HE2  GLN  44          1HE2      GLN  44  -2.139  -7.608  16.053
  346   2HE2  GLN  44          2HE2      GLN  44  -2.131  -8.526  17.515
  347    H    LYS  45           H        LYS  45  -6.005  -8.455  10.432
  348    HA   LYS  45           HA       LYS  45  -8.627  -8.528  11.731
  349   1HB   LYS  45          2HB       LYS  45  -7.993  -6.583   9.508
  350   2HB   LYS  45          1HB       LYS  45  -9.516  -6.747  10.367
  351   1HG   LYS  45          1HG       LYS  45  -8.434  -5.998  12.431
  352   2HG   LYS  45          2HG       LYS  45  -6.913  -5.809  11.556
  353   1HD   LYS  45          2HD       LYS  45  -9.466  -4.362  10.862
  354   2HD   LYS  45          1HD       LYS  45  -8.179  -3.684  11.862
  355   1HE   LYS  45          2HE       LYS  45  -7.892  -4.604   9.004
  356   2HE   LYS  45          1HE       LYS  45  -8.017  -2.928   9.537
  357   1HZ   LYS  45          1HZ       LYS  45  -5.724  -3.546   9.143
  358   2HZ   LYS  45          2HZ       LYS  45  -5.840  -4.818  10.254
  359   3HZ   LYS  45          3HZ       LYS  45  -5.963  -3.216  10.786
  360    H    ASP  46           H        ASP  46 -10.386  -9.037  10.183
  361    HA   ASP  46           HA       ASP  46  -9.581 -11.096   8.343
  362   1HB   ASP  46          2HB       ASP  46 -12.007 -11.363   7.945
  363   2HB   ASP  46          1HB       ASP  46 -11.612 -11.380   9.661
  364    H    THR  47           H        THR  47 -10.505  -7.754   8.166
  365    HA   THR  47           HA       THR  47  -9.930  -7.816   5.282
  366    HB   THR  47           HB       THR  47 -11.583  -5.984   4.945
  367    HG1  THR  47           1HG      THR  47 -11.644  -5.473   7.284
  368   1HG2  THR  47          1HG2      THR  47 -13.544  -7.372   4.893
  369   2HG2  THR  47          2HG2      THR  47 -12.845  -8.475   6.082
  370   3HG2  THR  47          3HG2      THR  47 -12.144  -8.358   4.467
  371    H    TYR  48           H        TYR  48  -9.695  -5.421   4.523
  372    HA   TYR  48           HA       TYR  48  -8.418  -3.763   6.560
  373   1HB   TYR  48          2HB       TYR  48  -7.123  -4.686   3.998
  374   2HB   TYR  48          1HB       TYR  48  -6.550  -3.299   4.920
  375    HD1  TYR  48           1HD      TYR  48  -5.465  -3.576   7.037
  376    HD2  TYR  48           2HD      TYR  48  -6.864  -6.942   4.851
  377    HE1  TYR  48           1HE      TYR  48  -4.112  -5.065   8.471
  378    HE2  TYR  48           2HE      TYR  48  -5.510  -8.435   6.258
  379    HH   TYR  48           HH       TYR  48  -3.539  -8.329   7.690
  380    H    THR  49           H        THR  49  -7.659  -1.645   5.375
  381    HA   THR  49           HA       THR  49  -9.163  -1.196   2.909
  382    HB   THR  49           HB       THR  49  -9.718   1.094   3.449
  383    HG1  THR  49           1HG      THR  49  -7.974   1.408   4.987
  384   1HG2  THR  49          1HG2      THR  49 -10.664  -0.804   5.604
  385   2HG2  THR  49          2HG2      THR  49 -11.377  -0.612   4.001
  386   3HG2  THR  49          3HG2      THR  49 -11.440   0.716   5.160
  387    H    MET  50           H        MET  50  -8.296   1.291   2.265
  388    HA   MET  50           HA       MET  50  -5.608   0.532   1.508
  389   1HB   MET  50          1HB       MET  50  -5.843   2.302  -0.183
  390   2HB   MET  50          2HB       MET  50  -7.181   1.160  -0.220
  391   1HG   MET  50          1HG       MET  50  -8.204   3.205  -0.474
  392   2HG   MET  50          2HG       MET  50  -8.425   2.835   1.232
  393   1HE   MET  50          1HE       MET  50  -5.294   5.830  -0.361
  394   2HE   MET  50          2HE       MET  50  -6.416   4.944  -1.392
  395   3HE   MET  50          3HE       MET  50  -5.132   4.083  -0.542
  396    H    LYS  51           H        LYS  51  -6.933   2.396   3.917
  397    HA   LYS  51           HA       LYS  51  -4.691   4.265   4.026
  398   1HB   LYS  51          2HB       LYS  51  -5.829   5.130   6.066
  399   2HB   LYS  51          1HB       LYS  51  -6.831   5.204   4.624
  400   1HG   LYS  51          2HG       LYS  51  -8.017   3.195   5.337
  401   2HG   LYS  51          1HG       LYS  51  -7.004   3.107   6.779
  402   1HD   LYS  51          1HD       LYS  51  -8.805   5.425   6.082
  403   2HD   LYS  51          2HD       LYS  51  -9.225   4.124   7.199
  404   1HE   LYS  51          1HE       LYS  51  -6.916   6.043   7.499
  405   2HE   LYS  51          2HE       LYS  51  -8.434   6.103   8.394
  406   1HZ   LYS  51          1HZ       LYS  51  -6.682   5.060   9.686
  407   2HZ   LYS  51          2HZ       LYS  51  -6.464   3.883   8.491
  408   3HZ   LYS  51          3HZ       LYS  51  -7.916   3.949   9.355
  409    H    GLU  52           H        GLU  52  -6.147   1.685   5.993
  410    HA   GLU  52           HA       GLU  52  -4.078   1.108   7.726
  411   1HB   GLU  52          2HB       GLU  52  -6.390  -0.107   7.144
  412   2HB   GLU  52          1HB       GLU  52  -5.309  -1.161   6.243
  413   1HG   GLU  52          1HG       GLU  52  -5.618  -2.141   8.365
  414   2HG   GLU  52          2HG       GLU  52  -3.988  -1.468   8.339
  415    H    VAL  53           H        VAL  53  -4.537  -0.476   4.573
  416    HA   VAL  53           HA       VAL  53  -2.009  -1.612   4.395
  417    HB   VAL  53           HB       VAL  53  -3.829  -0.748   2.142
  418   1HG1  VAL  53          1HG2      VAL  53  -2.617  -2.398   0.789
  419   2HG1  VAL  53          2HG2      VAL  53  -1.507  -2.675   2.129
  420   3HG1  VAL  53          3HG2      VAL  53  -1.560  -1.099   1.338
  421   1HG2  VAL  53          1HG1      VAL  53  -4.882  -2.305   3.699
  422   2HG2  VAL  53          2HG1      VAL  53  -3.521  -3.413   3.525
  423   3HG2  VAL  53          3HG1      VAL  53  -4.567  -3.079   2.146
  424    H    LEU  54           H        LEU  54  -3.074   1.639   3.597
  425    HA   LEU  54           HA       LEU  54  -0.993   2.584   2.067
  426   1HB   LEU  54          2HB       LEU  54  -2.887   3.973   2.705
  427   2HB   LEU  54          1HB       LEU  54  -2.358   3.968   4.375
  428    HG   LEU  54           HG       LEU  54  -0.340   5.226   3.735
  429   1HD1  LEU  54          1HD2      LEU  54  -0.175   6.192   1.491
  430   2HD1  LEU  54          2HD2      LEU  54  -1.585   5.259   0.990
  431   3HD1  LEU  54          3HD2      LEU  54  -0.098   4.431   1.452
  432   1HD2  LEU  54          1HD1      LEU  54  -2.918   6.483   2.808
  433   2HD2  LEU  54          2HD1      LEU  54  -1.446   7.349   3.253
  434   3HD2  LEU  54          3HD1      LEU  54  -2.330   6.425   4.470
  435    H    PHE  55           H        PHE  55  -1.047   3.024   5.612
  436    HA   PHE  55           HA       PHE  55   1.800   3.432   5.584
  437   1HB   PHE  55          2HB       PHE  55   1.501   3.676   8.084
  438   2HB   PHE  55          1HB       PHE  55   0.610   4.820   7.088
  439    HD1  PHE  55           1HD      PHE  55  -1.607   5.189   7.530
  440    HD2  PHE  55           2HD      PHE  55   0.161   1.525   8.777
  441    HE1  PHE  55           1HE      PHE  55  -3.693   4.581   8.683
  442    HE2  PHE  55           2HE      PHE  55  -1.923   0.908   9.931
  443    HZ   PHE  55           HZ       PHE  55  -3.853   2.437   9.884
  444    H    TYR  56           H        TYR  56  -0.204   0.712   5.883
  445    HA   TYR  56           HA       TYR  56   1.544  -0.785   7.625
  446   1HB   TYR  56          1HB       TYR  56  -1.118  -1.077   6.693
  447   2HB   TYR  56          2HB       TYR  56  -0.223  -2.513   6.206
  448    HD1  TYR  56           1HD      TYR  56  -2.492  -2.009   8.374
  449    HD2  TYR  56           2HD      TYR  56   1.723  -2.577   8.531
  450    HE1  TYR  56           1HE      TYR  56  -2.706  -2.900  10.652
  451    HE2  TYR  56           2HE      TYR  56   1.527  -3.475  10.810
  452    HH   TYR  56           HH       TYR  56  -1.479  -4.324  12.199
  453    H    LEU  57           H        LEU  57   0.528  -1.240   4.230
  454    HA   LEU  57           HA       LEU  57   2.544  -2.999   3.472
  455   1HB   LEU  57          2HB       LEU  57   0.495  -1.714   2.190
  456   2HB   LEU  57          1HB       LEU  57   1.886  -0.899   1.510
  457    HG   LEU  57           HG       LEU  57   1.369  -2.646   0.015
  458   1HD1  LEU  57          1HD1      LEU  57   3.603  -3.614   1.791
  459   2HD1  LEU  57          2HD1      LEU  57   3.748  -2.467   0.460
  460   3HD1  LEU  57          3HD1      LEU  57   3.302  -4.142   0.136
  461   1HD2  LEU  57          1HD2      LEU  57   1.227  -4.480   2.401
  462   2HD2  LEU  57          2HD2      LEU  57   1.086  -4.980   0.715
  463   3HD2  LEU  57          3HD2      LEU  57  -0.129  -3.915   1.424
  464    H    GLY  58           H        GLY  58   2.548   0.525   3.746
  465   1HA   GLY  58          2HA       GLY  58   5.113   1.119   2.892
  466   2HA   GLY  58          1HA       GLY  58   4.304   1.928   4.229
  467    H    GLN  59           H        GLN  59   4.122  -0.080   6.114
  468    HA   GLN  59           HA       GLN  59   6.602  -0.202   7.317
  469   1HB   GLN  59          1HB       GLN  59   4.570  -2.407   7.575
  470   2HB   GLN  59          2HB       GLN  59   5.698  -1.820   8.789
  471   1HG   GLN  59          1HG       GLN  59   3.460  -0.164   7.675
  472   2HG   GLN  59          2HG       GLN  59   3.305  -1.163   9.107
  473   1HE2  GLN  59          1HE2      GLN  59   6.061  -0.636   9.946
  474   2HE2  GLN  59          2HE2      GLN  59   6.064   0.970  10.581
  475    H    TYR  60           H        TYR  60   5.037  -3.002   5.695
  476    HA   TYR  60           HA       TYR  60   7.208  -4.652   6.238
  477   1HB   TYR  60          2HB       TYR  60   4.891  -5.407   5.652
  478   2HB   TYR  60          1HB       TYR  60   5.254  -5.047   3.968
  479    HD1  TYR  60           1HD      TYR  60   7.232  -6.278   2.901
  480    HD2  TYR  60           2HD      TYR  60   5.442  -7.485   6.561
  481    HE1  TYR  60           1HE      TYR  60   8.202  -8.519   2.629
  482    HE2  TYR  60           2HE      TYR  60   6.407  -9.726   6.303
  483    HH   TYR  60           HH       TYR  60   7.266 -11.176   4.566
  484    H    ILE  61           H        ILE  61   6.576  -2.640   3.414
  485    HA   ILE  61           HA       ILE  61   8.654  -3.440   1.743
  486    HB   ILE  61           HB       ILE  61   7.806  -0.590   2.280
  487   1HG1  ILE  61          2HG1      ILE  61   6.783  -2.408   0.102
  488   2HG1  ILE  61          1HG1      ILE  61   5.959  -2.220   1.648
  489   1HG2  ILE  61          1HG2      ILE  61   8.585  -0.193  -0.025
  490   2HG2  ILE  61          2HG2      ILE  61   9.177  -1.852  -0.089
  491   3HG2  ILE  61          3HG2      ILE  61   9.883  -0.708   1.054
  492   1HD1  ILE  61          1HD1      ILE  61   5.891   0.242   1.185
  493   2HD1  ILE  61          2HD1      ILE  61   4.901  -0.765   0.125
  494   3HD1  ILE  61          3HD1      ILE  61   6.445  -0.132  -0.449
  495    H    MET  62           H        MET  62   8.806  -0.645   3.937
  496    HA   MET  62           HA       MET  62  11.651  -0.620   4.002
  497   1HB   MET  62          2HB       MET  62  11.420   1.100   5.710
  498   2HB   MET  62          1HB       MET  62  10.305   1.399   4.384
  499   1HG   MET  62          1HG       MET  62   8.483   0.445   5.704
  500   2HG   MET  62          2HG       MET  62   9.602   0.165   7.037
  501   1HE   MET  62          1HE       MET  62  10.592   3.827   8.030
  502   2HE   MET  62          2HE       MET  62  11.426   2.779   6.883
  503   3HE   MET  62          3HE       MET  62  10.803   2.114   8.393
  504    H    THR  63           H        THR  63   9.645  -2.841   5.283
  505    HA   THR  63           HA       THR  63  11.334  -3.309   7.651
  506    HB   THR  63           HB       THR  63   8.594  -4.458   7.072
  507    HG1  THR  63           1HG      THR  63   7.798  -2.820   8.206
  508   1HG2  THR  63          1HG2      THR  63   9.950  -5.894   8.515
  509   2HG2  THR  63          2HG2      THR  63   8.644  -5.141   9.432
  510   3HG2  THR  63          3HG2      THR  63  10.290  -4.524   9.573
  511    H    LYS  64           H        LYS  64  11.731  -5.641   8.156
  512    HA   LYS  64           HA       LYS  64  12.411  -7.747   7.658
  513   1HB   LYS  64          2HB       LYS  64  10.817  -7.498   5.108
  514   2HB   LYS  64          1HB       LYS  64  11.298  -8.979   5.922
  515   1HG   LYS  64          2HG       LYS  64   9.436  -6.942   7.118
  516   2HG   LYS  64          1HG       LYS  64   8.903  -8.360   6.212
  517   1HD   LYS  64          2HD       LYS  64   9.985  -9.820   7.832
  518   2HD   LYS  64          1HD       LYS  64  10.574  -8.415   8.724
  519   1HE   LYS  64          2HE       LYS  64   8.264  -7.733   9.165
  520   2HE   LYS  64          1HE       LYS  64   7.683  -9.143   8.282
  521   1HZ   LYS  64          1HZ       LYS  64   8.767 -10.563   9.910
  522   2HZ   LYS  64          2HZ       LYS  64   7.664  -9.526  10.663
  523   3HZ   LYS  64          3HZ       LYS  64   9.321  -9.209  10.758
  524    H    ARG  65           H        ARG  65  13.550  -5.169   6.359
  525    HA   ARG  65           HA       ARG  65  15.312  -4.582   5.050
  526   1HB   ARG  65          2HB       ARG  65  16.436  -6.184   6.561
  527   2HB   ARG  65          1HB       ARG  65  16.087  -7.481   5.426
  528   1HG   ARG  65          1HG       ARG  65  17.474  -6.403   3.744
  529   2HG   ARG  65          2HG       ARG  65  17.800  -5.071   4.855
  530   1HD   ARG  65          2HD       ARG  65  19.653  -6.654   4.820
  531   2HD   ARG  65          1HD       ARG  65  18.879  -6.616   6.404
  532    HE   ARG  65           HE       ARG  65  17.715  -8.665   4.891
  533   1HH1  ARG  65          2HH1      ARG  65  20.749  -7.867   6.408
  534   2HH1  ARG  65          1HH1      ARG  65  21.195  -9.519   6.678
  535   1HH2  ARG  65          1HH2      ARG  65  18.295 -10.842   5.242
  536   2HH2  ARG  65          2HH2      ARG  65  19.801 -11.210   6.014
  537    H    LEU  66           H        LEU  66  13.807  -4.303   3.253
  538    HA   LEU  66           HA       LEU  66  14.672  -6.007   1.027
  539   1HB   LEU  66          1HB       LEU  66  11.878  -5.285   1.778
  540   2HB   LEU  66          2HB       LEU  66  12.281  -5.391   0.077
  541    HG   LEU  66           HG       LEU  66  11.413  -7.498   0.594
  542   1HD1  LEU  66          1HD1      LEU  66  13.507  -7.674  -0.629
  543   2HD1  LEU  66          2HD1      LEU  66  13.286  -9.055   0.445
  544   3HD1  LEU  66          3HD1      LEU  66  14.400  -7.763   0.888
  545   1HD2  LEU  66          1HD2      LEU  66  13.124  -7.583   3.071
  546   2HD2  LEU  66          2HD2      LEU  66  11.960  -8.802   2.543
  547   3HD2  LEU  66          3HD2      LEU  66  11.403  -7.201   3.035
  548    H    TYR  67           H        TYR  67  14.250  -2.937   2.350
  549    HA   TYR  67           HA       TYR  67  13.946  -1.514  -0.138
  550   1HB   TYR  67          1HB       TYR  67  14.082   0.508   1.224
  551   2HB   TYR  67          2HB       TYR  67  12.953  -0.641   1.932
  552    HD1  TYR  67           1HD      TYR  67  15.836   1.379   2.490
  553    HD2  TYR  67           2HD      TYR  67  13.791  -2.083   3.879
  554    HE1  TYR  67           1HE      TYR  67  17.032   1.539   4.629
  555    HE2  TYR  67           2HE      TYR  67  14.984  -1.933   6.025
  556    HH   TYR  67           HH       TYR  67  16.747   0.810   6.960
  557    H    ASP  68           H        ASP  68  15.491   0.273  -0.691
  558    HA   ASP  68           HA       ASP  68  17.871  -1.098  -1.406
  559   1HB   ASP  68          2HB       ASP  68  16.814   0.374  -2.998
  560   2HB   ASP  68          1HB       ASP  68  16.955   1.745  -1.901
  561    H    GLU  69           H        GLU  69  17.092   0.760   1.279
  562    HA   GLU  69           HA       GLU  69  18.311   1.287   3.124
  563   1HB   GLU  69          1HB       GLU  69  19.613  -0.749   2.678
  564   2HB   GLU  69          2HB       GLU  69  20.663   0.158   1.600
  565   1HG   GLU  69          2HG       GLU  69  21.359   1.563   3.492
  566   2HG   GLU  69          1HG       GLU  69  20.348   0.591   4.561
  567    H    LYS  70           H        LYS  70  19.185   2.411  -0.002
  568    HA   LYS  70           HA       LYS  70  20.992   4.458   0.829
  569   1HB   LYS  70          2HB       LYS  70  19.386   4.151  -1.715
  570   2HB   LYS  70          1HB       LYS  70  20.637   5.361  -1.461
  571   1HG   LYS  70          1HG       LYS  70  21.071   2.381  -1.371
  572   2HG   LYS  70          2HG       LYS  70  21.421   3.422  -2.753
  573   1HD   LYS  70          2HD       LYS  70  23.011   4.693  -1.376
  574   2HD   LYS  70          1HD       LYS  70  22.678   3.618  -0.017
  575   1HE   LYS  70          2HE       LYS  70  23.502   1.719  -1.319
  576   2HE   LYS  70          1HE       LYS  70  23.836   2.793  -2.677
  577   1HZ   LYS  70          1HZ       LYS  70  25.425   3.981  -1.299
  578   2HZ   LYS  70          2HZ       LYS  70  25.833   2.343  -1.400
  579   3HZ   LYS  70          3HZ       LYS  70  25.108   2.947   0.002
  580    H    GLN  71           H        GLN  71  17.654   4.638  -0.428
  581    HA   GLN  71           HA       GLN  71  17.189   6.899   1.387
  582   1HB   GLN  71          2HB       GLN  71  16.300   6.768  -1.500
  583   2HB   GLN  71          1HB       GLN  71  15.903   8.049  -0.364
  584   1HG   GLN  71          1HG       GLN  71  18.753   7.387  -0.969
  585   2HG   GLN  71          2HG       GLN  71  17.813   8.402  -2.061
  586   1HE2  GLN  71          1HE2      GLN  71  17.318   8.403   1.394
  587   2HE2  GLN  71          2HE2      GLN  71  17.955   9.981   1.681
  588    H    GLN  72           H        GLN  72  16.477   3.937   1.183
  589    HA   GLN  72           HA       GLN  72  14.717   2.575   1.670
  590   1HB   GLN  72          1HB       GLN  72  13.617   5.172   2.762
  591   2HB   GLN  72          2HB       GLN  72  12.892   3.596   3.045
  592   1HG   GLN  72          2HG       GLN  72  14.183   4.189   4.957
  593   2HG   GLN  72          1HG       GLN  72  15.004   2.872   4.120
  594   1HE2  GLN  72          2HE2      GLN  72  15.077   6.257   4.912
  595   2HE2  GLN  72          1HE2      GLN  72  16.730   6.527   4.489
  596    H    HIS  73           H        HIS  73  14.766   4.113  -0.921
  597    HA   HIS  73           HA       HIS  73  11.918   4.460  -1.481
  598   1HB   HIS  73          2HB       HIS  73  13.437   6.262  -2.158
  599   2HB   HIS  73          1HB       HIS  73  14.344   5.132  -3.156
  600    HD1  HIS  73           1HD      HIS  73  13.770   5.312  -5.541
  601    HD2  HIS  73           2HD      HIS  73  10.530   6.235  -3.109
  602    HE1  HIS  73           1HE      HIS  73  11.903   5.918  -7.111
  603    HE2  HIS  73           2HE      HIS  73   9.982   6.563  -5.615
  604    H    ILE  74           H        ILE  74  14.639   3.106  -3.370
  605    HA   ILE  74           HA       ILE  74  12.901   1.398  -4.857
  606    HB   ILE  74           HB       ILE  74  15.889   1.070  -4.609
  607   1HG1  ILE  74          2HG1      ILE  74  15.414   3.415  -5.144
  608   2HG1  ILE  74          1HG1      ILE  74  16.099   2.583  -6.537
  609   1HG2  ILE  74          1HG2      ILE  74  13.935   0.406  -6.806
  610   2HG2  ILE  74          2HG2      ILE  74  14.724  -0.743  -5.724
  611   3HG2  ILE  74          3HG2      ILE  74  15.681   0.176  -6.886
  612   1HD1  ILE  74          1HD1      ILE  74  14.294   4.058  -7.197
  613   2HD1  ILE  74          2HD1      ILE  74  13.188   3.213  -6.115
  614   3HD1  ILE  74          3HD1      ILE  74  13.871   2.374  -7.508
  615    H    VAL  75           H        VAL  75  12.505  -0.783  -4.633
  616    HA   VAL  75           HA       VAL  75  13.345  -1.920  -2.048
  617    HB   VAL  75           HB       VAL  75  10.657  -2.509  -3.222
  618   1HG1  VAL  75          1HG1      VAL  75  10.085  -2.898  -0.867
  619   2HG1  VAL  75          2HG1      VAL  75  11.732  -2.463  -0.406
  620   3HG1  VAL  75          3HG1      VAL  75  11.442  -3.897  -1.392
  621   1HG2  VAL  75          1HG2      VAL  75  11.353  -0.116  -1.531
  622   2HG2  VAL  75          2HG2      VAL  75   9.713  -0.692  -1.827
  623   3HG2  VAL  75          3HG2      VAL  75  10.701  -0.112  -3.169
  624    H    TYR  76           H        TYR  76  14.891  -3.284  -2.914
  625    HA   TYR  76           HA       TYR  76  14.255  -5.198  -4.954
  626   1HB   TYR  76          1HB       TYR  76  16.496  -5.495  -2.973
  627   2HB   TYR  76          2HB       TYR  76  16.436  -6.009  -4.657
  628    HD1  TYR  76           1HD      TYR  76  15.703  -3.721  -6.167
  629    HD2  TYR  76           2HD      TYR  76  18.132  -3.897  -2.678
  630    HE1  TYR  76           1HE      TYR  76  16.826  -1.639  -6.845
  631    HE2  TYR  76           2HE      TYR  76  19.255  -1.820  -3.346
  632    HH   TYR  76           HH       TYR  76  19.687  -0.536  -5.400
  633    H    CYS  77           H        CYS  77  12.440  -6.338  -4.318
  634    HA   CYS  77           HA       CYS  77  12.253  -7.483  -1.686
  635   1HB   CYS  77          2HB       CYS  77  10.161  -8.551  -2.636
  636   2HB   CYS  77          1HB       CYS  77  10.195  -6.791  -2.649
  637    HG   CYS  77           HG       CYS  77   9.289  -6.832  -5.061
  638    H    SER  78           H        SER  78  12.327  -8.914  -4.957
  639    HA   SER  78           HA       SER  78  13.020 -10.947  -5.708
  640   1HB   SER  78          1HB       SER  78  15.192  -9.945  -5.117
  641   2HB   SER  78          2HB       SER  78  15.054 -10.613  -3.491
  642    HG   SER  78           HG       SER  78  15.855 -11.816  -5.792
  643    H    ASN  79           H        ASN  79  11.190 -12.146  -5.146
  644    HA   ASN  79           HA       ASN  79  10.080 -13.903  -4.233
  645   1HB   ASN  79          2HB       ASN  79  12.765 -14.530  -2.988
  646   2HB   ASN  79          1HB       ASN  79  11.398 -15.635  -3.080
  647   1HD2  ASN  79          2HD2      ASN  79  10.821 -16.518  -5.068
  648   2HD2  ASN  79          1HD2      ASN  79  11.897 -16.508  -6.419
  649    H    ASP  80           H        ASP  80  10.705 -11.290  -2.668
  650    HA   ASP  80           HA       ASP  80  10.230 -12.039   0.067
  651   1HB   ASP  80          2HB       ASP  80  11.361  -9.921  -0.571
  652   2HB   ASP  80          1HB       ASP  80   9.849  -9.353  -1.274
  653    H    LEU  81           H        LEU  81   8.244 -11.199   1.226
  654    HA   LEU  81           HA       LEU  81   5.848 -12.104   0.017
  655   1HB   LEU  81          1HB       LEU  81   6.425 -10.502   2.495
  656   2HB   LEU  81          2HB       LEU  81   4.783 -10.850   1.991
  657    HG   LEU  81           HG       LEU  81   5.265 -13.272   2.143
  658   1HD1  LEU  81          1HD2      LEU  81   7.916 -12.379   3.266
  659   2HD1  LEU  81          2HD2      LEU  81   7.667 -13.197   1.724
  660   3HD1  LEU  81          3HD2      LEU  81   7.309 -14.034   3.236
  661   1HD2  LEU  81          1HD1      LEU  81   4.274 -12.094   4.034
  662   2HD2  LEU  81          2HD1      LEU  81   5.883 -11.719   4.651
  663   3HD2  LEU  81          3HD1      LEU  81   5.335 -13.394   4.575
  664    H    LEU  82           H        LEU  82   7.137  -8.849   0.651
  665    HA   LEU  82           HA       LEU  82   5.248  -7.325  -0.706
  666   1HB   LEU  82          1HB       LEU  82   7.799  -6.908   0.347
  667   2HB   LEU  82          2HB       LEU  82   7.967  -6.528  -1.354
  668    HG   LEU  82           HG       LEU  82   7.458  -4.479  -0.339
  669   1HD1  LEU  82          1HD2      LEU  82   4.840  -5.597  -1.331
  670   2HD1  LEU  82          2HD2      LEU  82   6.105  -4.874  -2.324
  671   3HD1  LEU  82          3HD2      LEU  82   5.231  -3.886  -1.153
  672   1HD2  LEU  82          1HD1      LEU  82   5.272  -5.887   1.181
  673   2HD2  LEU  82          2HD1      LEU  82   5.622  -4.159   1.247
  674   3HD2  LEU  82          3HD1      LEU  82   6.807  -5.321   1.840
  675    H    GLY  83           H        GLY  83   7.440  -9.701  -1.864
  676   1HA   GLY  83          2HA       GLY  83   7.490  -8.843  -4.605
  677   2HA   GLY  83          1HA       GLY  83   8.030 -10.397  -3.985
  678    H    ASP  84           H        ASP  84   5.634 -11.247  -2.763
  679    HA   ASP  84           HA       ASP  84   4.156 -12.363  -4.831
  680   1HB   ASP  84          2HB       ASP  84   3.175 -11.674  -2.045
  681   2HB   ASP  84          1HB       ASP  84   2.395 -12.792  -3.159
  682    H    LEU  85           H        LEU  85   3.935  -9.219  -3.350
  683    HA   LEU  85           HA       LEU  85   1.468  -8.327  -4.275
  684   1HB   LEU  85          2HB       LEU  85   4.093  -6.869  -4.008
  685   2HB   LEU  85          1HB       LEU  85   2.585  -6.067  -4.382
  686    HG   LEU  85           HG       LEU  85   3.661  -6.477  -1.874
  687   1HD1  LEU  85          1HD1      LEU  85   2.169  -4.688  -2.528
  688   2HD1  LEU  85          2HD1      LEU  85   1.538  -5.509  -1.100
  689   3HD1  LEU  85          3HD1      LEU  85   0.834  -5.829  -2.686
  690   1HD2  LEU  85          1HD2      LEU  85   2.057  -7.872  -0.685
  691   2HD2  LEU  85          2HD2      LEU  85   2.958  -8.813  -1.875
  692   3HD2  LEU  85          3HD2      LEU  85   1.299  -8.318  -2.214
  693    H    PHE  86           H        PHE  86   4.521  -7.412  -5.808
  694    HA   PHE  86           HA       PHE  86   3.060  -6.855  -8.255
  695   1HB   PHE  86          2HB       PHE  86   6.016  -6.439  -7.903
  696   2HB   PHE  86          1HB       PHE  86   4.892  -5.549  -8.924
  697    HD1  PHE  86           1HD      PHE  86   3.853  -3.598  -8.160
  698    HD2  PHE  86           2HD      PHE  86   5.892  -6.131  -5.414
  699    HE1  PHE  86           1HE      PHE  86   3.658  -1.863  -6.421
  700    HE2  PHE  86           2HE      PHE  86   5.695  -4.408  -3.674
  701    HZ   PHE  86           HZ       PHE  86   4.578  -2.275  -4.173
  702    H    GLY  87           H        GLY  87   5.994  -8.670  -7.350
  703   1HA   GLY  87          1HA       GLY  87   6.703 -10.656  -8.575
  704   2HA   GLY  87          2HA       GLY  87   5.863 -10.009  -9.978
  705    H    VAL  88           H        VAL  88   7.286  -7.471  -8.440
  706    HA   VAL  88           HA       VAL  88   9.224  -7.122 -10.513
  707    HB   VAL  88           HB       VAL  88   9.820  -5.042  -9.325
  708   1HG1  VAL  88          1HG2      VAL  88   6.862  -5.517  -9.641
  709   2HG1  VAL  88          2HG2      VAL  88   7.984  -4.974 -10.889
  710   3HG1  VAL  88          3HG2      VAL  88   7.626  -3.933  -9.510
  711   1HG2  VAL  88          1HG1      VAL  88   9.561  -5.817  -7.036
  712   2HG2  VAL  88          2HG1      VAL  88   7.820  -5.979  -7.270
  713   3HG2  VAL  88          3HG1      VAL  88   8.573  -4.385  -7.317
  714    HA   PRO  89           HA       PRO  89  12.890  -8.145  -7.966
  715   1HB   PRO  89          2HB       PRO  89  14.743  -6.697  -9.249
  716   2HB   PRO  89          1HB       PRO  89  14.091  -8.182  -9.951
  717   1HG   PRO  89          2HG       PRO  89  13.419  -5.335 -10.572
  718   2HG   PRO  89          1HG       PRO  89  13.616  -6.706 -11.677
  719   1HD   PRO  89          1HD       PRO  89  11.185  -5.742 -10.786
  720   2HD   PRO  89          2HD       PRO  89  11.455  -7.385 -11.396
  721    H    SER  90           H        SER  90  12.175  -4.828  -9.011
  722    HA   SER  90           HA       SER  90  12.537  -3.899  -6.266
  723   1HB   SER  90          2HB       SER  90  13.864  -1.945  -7.050
  724   2HB   SER  90          1HB       SER  90  14.704  -3.480  -7.274
  725    HG   SER  90           HG       SER  90  14.876  -2.879  -9.273
  726    H    PHE  91           H        PHE  91  11.219  -2.141  -5.722
  727    HA   PHE  91           HA       PHE  91   9.864  -0.760  -7.917
  728   1HB   PHE  91          1HB       PHE  91   7.687  -0.912  -6.883
  729   2HB   PHE  91          2HB       PHE  91   8.328  -2.531  -7.128
  730    HD1  PHE  91           1HD      PHE  91   9.080  -3.873  -5.219
  731    HD2  PHE  91           2HD      PHE  91   7.264  -0.061  -4.693
  732    HE1  PHE  91           1HE      PHE  91   8.662  -4.398  -2.849
  733    HE2  PHE  91           2HE      PHE  91   6.841  -0.573  -2.334
  734    HZ   PHE  91           HZ       PHE  91   7.542  -2.747  -1.403
  735    H    SER  92           H        SER  92   8.771   1.259  -7.196
  736    HA   SER  92           HA       SER  92  10.580   2.747  -5.541
  737   1HB   SER  92          2HB       SER  92   9.115   4.672  -6.126
  738   2HB   SER  92          1HB       SER  92   9.650   3.771  -7.544
  739    HG   SER  92           HG       SER  92   7.619   3.551  -7.991
  740    H    VAL  93           H        VAL  93   8.492   4.584  -4.556
  741    HA   VAL  93           HA       VAL  93   6.586   3.310  -2.962
  742    HB   VAL  93           HB       VAL  93   8.438   2.366  -1.708
  743   1HG1  VAL  93          1HG1      VAL  93  10.018   3.825  -0.504
  744   2HG1  VAL  93          2HG1      VAL  93   9.346   5.215  -1.361
  745   3HG1  VAL  93          3HG1      VAL  93  10.172   3.938  -2.257
  746   1HG2  VAL  93          1HG2      VAL  93   7.893   3.215   0.528
  747   2HG2  VAL  93          2HG2      VAL  93   6.447   2.989  -0.457
  748   3HG2  VAL  93          3HG2      VAL  93   7.097   4.608  -0.203
  749    H    LYS  94           H        LYS  94   8.883   6.013  -3.089
  750    HA   LYS  94           HA       LYS  94   7.048   7.954  -2.091
  751   1HB   LYS  94          1HB       LYS  94   9.463   8.282  -3.885
  752   2HB   LYS  94          2HB       LYS  94   8.592   9.600  -3.115
  753   1HG   LYS  94          1HG       LYS  94   9.185   8.707  -0.916
  754   2HG   LYS  94          2HG       LYS  94  10.068   7.393  -1.694
  755   1HD   LYS  94          1HD       LYS  94  11.563   9.021  -2.749
  756   2HD   LYS  94          2HD       LYS  94  10.680  10.334  -1.967
  757   1HE   LYS  94          1HE       LYS  94  12.181   8.131  -0.560
  758   2HE   LYS  94          2HE       LYS  94  12.739   9.791  -0.762
  759   1HZ   LYS  94          1HZ       LYS  94  11.780   9.458   1.422
  760   2HZ   LYS  94          2HZ       LYS  94  10.320   8.944   0.740
  761   3HZ   LYS  94          3HZ       LYS  94  10.835  10.544   0.532
  762    H    GLU  95           H        GLU  95   7.439   6.300  -5.064
  763    HA   GLU  95           HA       GLU  95   5.676   8.078  -6.534
  764   1HB   GLU  95          2HB       GLU  95   6.672   5.310  -7.250
  765   2HB   GLU  95          1HB       GLU  95   5.857   6.432  -8.330
  766   1HG   GLU  95          1HG       GLU  95   8.544   6.864  -7.047
  767   2HG   GLU  95          2HG       GLU  95   8.260   6.380  -8.719
  768    H    HIS  96           H        HIS  96   4.259   7.645  -4.423
  769    HA   HIS  96           HA       HIS  96   3.164   5.157  -3.909
  770   1HB   HIS  96          2HB       HIS  96   1.853   7.842  -3.429
  771   2HB   HIS  96          1HB       HIS  96   1.429   6.329  -2.635
  772    HD1  HIS  96           1HD      HIS  96   2.636   5.804  -0.519
  773    HD2  HIS  96           2HD      HIS  96   4.534   8.763  -2.731
  774    HE1  HIS  96           1HE      HIS  96   4.487   6.656   0.952
  775    HE2  HIS  96           2HE      HIS  96   5.571   8.505  -0.374
  776    H    ARG  97           H        ARG  97   2.177   7.575  -6.228
  777    HA   ARG  97           HA       ARG  97  -0.407   6.683  -6.785
  778   1HB   ARG  97          1HB       ARG  97   0.526   8.801  -7.631
  779   2HB   ARG  97          2HB       ARG  97   1.599   7.902  -8.693
  780   1HG   ARG  97          2HG       ARG  97  -0.253   8.713  -9.969
  781   2HG   ARG  97          1HG       ARG  97  -0.389   6.959  -9.829
  782   1HD   ARG  97          1HD       ARG  97  -2.553   8.025  -9.501
  783   2HD   ARG  97          2HD       ARG  97  -2.014   7.224  -8.025
  784    HE   ARG  97           HE       ARG  97  -1.193   9.888  -7.907
  785   1HH1  ARG  97          2HH1      ARG  97  -4.150   8.045  -7.925
  786   2HH1  ARG  97          1HH1      ARG  97  -5.032   9.209  -6.995
  787   1HH2  ARG  97          1HH2      ARG  97  -2.347  11.426  -6.682
  788   2HH2  ARG  97          2HH2      ARG  97  -4.008  11.130  -6.288
  789    H    LYS  98           H        LYS  98   2.581   5.940  -8.591
  790    HA   LYS  98           HA       LYS  98   1.310   3.941 -10.166
  791   1HB   LYS  98          1HB       LYS  98   3.243   5.221 -10.979
  792   2HB   LYS  98          2HB       LYS  98   4.252   4.488  -9.738
  793   1HG   LYS  98          2HG       LYS  98   3.872   2.285 -10.747
  794   2HG   LYS  98          1HG       LYS  98   2.896   3.044 -12.005
  795   1HD   LYS  98          2HD       LYS  98   5.737   3.868 -11.487
  796   2HD   LYS  98          1HD       LYS  98   5.338   2.523 -12.556
  797   1HE   LYS  98          1HE       LYS  98   5.605   4.477 -13.903
  798   2HE   LYS  98          2HE       LYS  98   3.888   4.077 -13.858
  799   1HZ   LYS  98          1HZ       LYS  98   3.514   5.806 -12.269
  800   2HZ   LYS  98          2HZ       LYS  98   4.354   6.468 -13.578
  801   3HZ   LYS  98          3HZ       LYS  98   5.171   6.128 -12.136
  802    H    ILE  99           H        ILE  99   3.077   3.917  -7.164
  803    HA   ILE  99           HA       ILE  99   3.801   1.165  -7.265
  804    HB   ILE  99           HB       ILE  99   4.852   3.110  -5.857
  805   1HG1  ILE  99          1HG1      ILE  99   5.460   0.614  -5.977
  806   2HG1  ILE  99          2HG1      ILE  99   5.998   1.519  -4.565
  807   1HG2  ILE  99          1HG2      ILE  99   2.762   2.073  -3.966
  808   2HG2  ILE  99          2HG2      ILE  99   2.960   3.730  -4.539
  809   3HG2  ILE  99          3HG2      ILE  99   4.178   3.008  -3.481
  810   1HD1  ILE  99          1HD1      ILE  99   5.148  -0.663  -3.941
  811   2HD1  ILE  99          2HD1      ILE  99   3.599  -0.292  -4.693
  812   3HD1  ILE  99          3HD1      ILE  99   4.131   0.616  -3.279
  813    H    TYR 100           H        TYR 100   1.072   2.930  -5.948
  814    HA   TYR 100           HA       TYR 100   0.003   0.505  -4.749
  815   1HB   TYR 100          2HB       TYR 100  -0.699   3.399  -4.640
  816   2HB   TYR 100          1HB       TYR 100  -1.971   2.223  -4.316
  817    HD1  TYR 100           1HD      TYR 100  -2.085   3.180  -2.002
  818    HD2  TYR 100           2HD      TYR 100   1.404   1.245  -3.487
  819    HE1  TYR 100           1HE      TYR 100  -1.263   2.902   0.300
  820    HE2  TYR 100           2HE      TYR 100   2.226   0.961  -1.200
  821    HH   TYR 100           HH       TYR 100   0.288   1.436   1.536
  822    H    THR 101           H        THR 101  -0.252   2.284  -7.680
  823    HA   THR 101           HA       THR 101  -2.804   1.291  -8.484
  824    HB   THR 101           HB       THR 101  -0.507   2.368 -10.133
  825    HG1  THR 101           1HG      THR 101  -2.455   3.517  -8.644
  826   1HG2  THR 101          1HG2      THR 101  -2.141   2.592 -11.952
  827   2HG2  THR 101          2HG2      THR 101  -3.349   1.771 -10.965
  828   3HG2  THR 101          3HG2      THR 101  -1.910   0.903 -11.497
  829    H    MET 102           H        MET 102   0.473   0.079  -8.619
  830    HA   MET 102           HA       MET 102  -0.344  -2.172 -10.279
  831   1HB   MET 102          2HB       MET 102   2.051  -2.843 -10.136
  832   2HB   MET 102          1HB       MET 102   1.795  -1.250 -10.836
  833   1HG   MET 102          1HG       MET 102   2.401  -0.217  -8.709
  834   2HG   MET 102          2HG       MET 102   2.659  -1.814  -8.009
  835   1HE   MET 102          1HE       MET 102   4.867   0.668  -8.152
  836   2HE   MET 102          2HE       MET 102   6.295  -0.343  -8.373
  837   3HE   MET 102          3HE       MET 102   5.025  -0.841  -7.254
  838    H    ILE 103           H        ILE 103   0.329  -1.421  -6.931
  839    HA   ILE 103           HA       ILE 103   0.279  -4.078  -5.944
  840    HB   ILE 103           HB       ILE 103  -0.480  -1.444  -4.698
  841   1HG1  ILE 103          1HG1      ILE 103   1.759  -3.418  -4.188
  842   2HG1  ILE 103          2HG1      ILE 103   1.908  -1.888  -5.046
  843   1HG2  ILE 103          1HG2      ILE 103  -0.561  -4.164  -3.391
  844   2HG2  ILE 103          2HG2      ILE 103  -1.945  -3.120  -3.720
  845   3HG2  ILE 103          3HG2      ILE 103  -0.721  -2.619  -2.553
  846   1HD1  ILE 103          1HD1      ILE 103   1.189  -2.216  -2.144
  847   2HD1  ILE 103          2HD1      ILE 103   1.345  -0.685  -3.005
  848   3HD1  ILE 103          3HD1      ILE 103   2.757  -1.719  -2.783
  849    H    TYR 104           H        TYR 104  -2.308  -1.702  -6.509
  850    HA   TYR 104           HA       TYR 104  -4.330  -3.658  -5.804
  851   1HB   TYR 104          1HB       TYR 104  -4.445  -0.756  -6.607
  852   2HB   TYR 104          2HB       TYR 104  -5.899  -1.736  -6.436
  853    HD1  TYR 104           1HD      TYR 104  -6.618  -2.525  -4.244
  854    HD2  TYR 104           2HD      TYR 104  -3.168  -0.074  -4.666
  855    HE1  TYR 104           1HE      TYR 104  -6.649  -2.073  -1.827
  856    HE2  TYR 104           2HE      TYR 104  -3.189   0.384  -2.252
  857    HH   TYR 104           HH       TYR 104  -5.084  -1.381  -0.062
  858    H    ARG 105           H        ARG 105  -3.751  -5.145  -7.523
  859    HA   ARG 105           HA       ARG 105  -5.205  -4.466  -9.987
  860   1HB   ARG 105          1HB       ARG 105  -2.542  -4.606 -10.049
  861   2HB   ARG 105          2HB       ARG 105  -2.881  -6.325 -10.172
  862   1HG   ARG 105          2HG       ARG 105  -4.016  -4.235 -12.018
  863   2HG   ARG 105          1HG       ARG 105  -2.576  -5.195 -12.356
  864   1HD   ARG 105          2HD       ARG 105  -3.904  -7.242 -12.218
  865   2HD   ARG 105          1HD       ARG 105  -5.345  -6.285 -11.872
  866    HE   ARG 105           HE       ARG 105  -4.306  -5.334 -14.257
  867   1HH1  ARG 105          2HH1      ARG 105  -5.621  -8.318 -13.027
  868   2HH1  ARG 105          1HH1      ARG 105  -6.243  -8.826 -14.562
  869   1HH2  ARG 105          1HH2      ARG 105  -5.122  -5.993 -16.281
  870   2HH2  ARG 105          2HH2      ARG 105  -5.960  -7.505 -16.410
  871    H    ASN 106           H        ASN 106  -6.806  -5.564  -8.454
  872    HA   ASN 106           HA       ASN 106  -6.750  -8.460  -8.946
  873   1HB   ASN 106          1HB       ASN 106  -7.530  -7.135  -6.339
  874   2HB   ASN 106          2HB       ASN 106  -7.661  -8.856  -6.690
  875   1HD2  ASN 106          2HD2      ASN 106  -5.505  -6.219  -6.020
  876   2HD2  ASN 106          1HD2      ASN 106  -4.106  -7.179  -5.698
  877    H    LEU 107           H        LEU 107  -9.039  -9.363  -8.209
  878    HA   LEU 107           HA       LEU 107 -11.057  -7.596  -9.429
  879   1HB   LEU 107          2HB       LEU 107 -10.796 -10.599  -9.594
  880   2HB   LEU 107          1HB       LEU 107 -12.187  -9.702 -10.170
  881    HG   LEU 107           HG       LEU 107 -10.561  -8.453 -11.695
  882   1HD1  LEU 107          1HD1      LEU 107  -8.799 -10.777 -10.932
  883   2HD1  LEU 107          2HD1      LEU 107  -8.497  -9.078 -10.571
  884   3HD1  LEU 107          3HD1      LEU 107  -8.492  -9.637 -12.243
  885   1HD2  LEU 107          1HD2      LEU 107 -12.135 -10.125 -12.504
  886   2HD2  LEU 107          2HD2      LEU 107 -10.992 -11.408 -12.106
  887   3HD2  LEU 107          3HD2      LEU 107 -10.600 -10.238 -13.365
  888    H    VAL 108           H        VAL 108 -10.641  -7.413  -6.730
  889    HA   VAL 108           HA       VAL 108 -13.200  -8.221  -5.686
  890    HB   VAL 108           HB       VAL 108 -11.893 -10.264  -5.293
  891   1HG1  VAL 108          1HG2      VAL 108 -10.089  -8.473  -3.669
  892   2HG1  VAL 108          2HG2      VAL 108  -9.670  -9.296  -5.170
  893   3HG1  VAL 108          3HG2      VAL 108 -10.008 -10.234  -3.715
  894   1HG2  VAL 108          1HG1      VAL 108 -12.491  -8.723  -2.769
  895   2HG2  VAL 108          2HG1      VAL 108 -12.319 -10.474  -2.891
  896   3HG2  VAL 108          3HG1      VAL 108 -13.649  -9.659  -3.715
  897    H    VAL 109           H        VAL 109 -10.261  -6.462  -5.543
  898    HA   VAL 109           HA       VAL 109 -10.328  -5.310  -3.025
  899    HB   VAL 109           HB       VAL 109  -9.299  -3.257  -4.301
  900   1HG1  VAL 109          1HG1      VAL 109  -7.139  -4.416  -4.354
  901   2HG1  VAL 109          2HG1      VAL 109  -7.971  -5.965  -4.224
  902   3HG1  VAL 109          3HG1      VAL 109  -8.050  -4.806  -2.896
  903   1HG2  VAL 109          1HG2      VAL 109  -9.190  -5.418  -6.404
  904   2HG2  VAL 109          2HG2      VAL 109  -8.316  -3.888  -6.456
  905   3HG2  VAL 109          3HG2      VAL 109 -10.078  -3.898  -6.520
  906    H    VAL 110           H        VAL 110 -11.055  -3.139  -5.709
  907    HA   VAL 110           HA       VAL 110 -12.907  -1.626  -4.208
  908    HB   VAL 110           HB       VAL 110 -12.569  -1.706  -7.212
  909   1HG1  VAL 110          1HG2      VAL 110 -13.771   0.396  -5.412
  910   2HG1  VAL 110          2HG2      VAL 110 -14.650  -0.643  -6.535
  911   3HG1  VAL 110          3HG2      VAL 110 -13.514   0.558  -7.150
  912   1HG2  VAL 110          1HG1      VAL 110 -11.236   0.048  -5.152
  913   2HG2  VAL 110          2HG1      VAL 110 -11.086   0.222  -6.900
  914   3HG2  VAL 110          3HG1      VAL 110 -10.459  -1.220  -6.101
  915    H    ASN 111           H        ASN 111 -15.096  -1.665  -4.092
  916    HA   ASN 111           HA       ASN 111 -16.433  -4.016  -5.182
  917   1HB   ASN 111          2HB       ASN 111 -17.411  -1.928  -3.221
  918   2HB   ASN 111          1HB       ASN 111 -18.289  -3.384  -3.683
  919   1HD2  ASN 111          2HD2      ASN 111 -15.601  -2.098  -1.906
  920   2HD2  ASN 111          1HD2      ASN 111 -15.256  -3.524  -0.996
  921    H    GLN 112           H        GLN 112 -16.616  -3.443  -7.363
  922    HA   GLN 112           HA       GLN 112 -17.782  -0.969  -8.191
  923   1HB   GLN 112          1HB       GLN 112 -16.206  -2.204  -9.616
  924   2HB   GLN 112          2HB       GLN 112 -17.351  -3.533  -9.738
  925   1HG   GLN 112          1HG       GLN 112 -18.936  -2.066 -10.877
  926   2HG   GLN 112          2HG       GLN 112 -17.790  -0.732 -10.754
  927   1HE2  GLN 112          1HE2      GLN 112 -15.491  -2.469 -11.245
  928   2HE2  GLN 112          2HE2      GLN 112 -15.514  -2.823 -12.935
  929    H    GLN 113           H        GLN 113 -19.793  -0.717  -7.287
  930    HA   GLN 113           HA       GLN 113 -21.869  -2.528  -8.311
  931   1HB   GLN 113          2HB       GLN 113 -21.746  -1.375  -5.517
  932   2HB   GLN 113          1HB       GLN 113 -23.092  -2.295  -6.177
  933   1HG   GLN 113          1HG       GLN 113 -21.636  -4.241  -6.431
  934   2HG   GLN 113          2HG       GLN 113 -20.291  -3.319  -5.761
  935   1HE2  GLN 113          2HE2      GLN 113 -23.309  -4.897  -5.081
  936   2HE2  GLN 113          1HE2      GLN 113 -23.149  -4.908  -3.361
  937    H    GLU 114           H        GLU 114 -22.923  -1.318  -9.752
  938    HA   GLU 114           HA       GLU 114 -23.771   1.380  -8.929
  939   1HB   GLU 114          2HB       GLU 114 -22.025   1.519 -10.650
  940   2HB   GLU 114          1HB       GLU 114 -22.978   0.486 -11.706
  941   1HG   GLU 114          1HG       GLU 114 -23.184   2.799 -12.367
  942   2HG   GLU 114          2HG       GLU 114 -24.731   2.186 -11.788
  943    H    SER 115           H        SER 115 -25.883   1.857  -9.160
  944    HA   SER 115           HA       SER 115 -27.621  -0.264 -10.189
  945   1HB   SER 115          2HB       SER 115 -28.273   2.135  -8.461
  946   2HB   SER 115          1HB       SER 115 -29.422   0.890  -8.950
  947    HG   SER 115           HG       SER 115 -27.808  -0.593  -7.911
  948    H    SER 116           H        SER 116 -26.989   0.426 -12.398
  949    HA   SER 116           HA       SER 116 -27.436   1.436 -14.385
  950   1HB   SER 116          2HB       SER 116 -29.719   0.700 -13.891
  951   2HB   SER 116          1HB       SER 116 -30.012   2.178 -12.976
  952    HG   SER 116           HG       SER 116 -30.620   2.973 -14.815
  953    H    ASP 117           H        ASP 117 -25.759   2.962 -14.191
  954    HA   ASP 117           HA       ASP 117 -26.245   5.533 -12.993
  955   1HB   ASP 117          2HB       ASP 117 -23.995   4.574 -12.972
  956   2HB   ASP 117          1HB       ASP 117 -23.968   4.563 -14.734
  957    H    SER 118           H        SER 118 -26.875   7.379 -13.953
  958    HA   SER 118           HA       SER 118 -27.650   7.226 -16.770
  959   1HB   SER 118          2HB       SER 118 -29.393   7.907 -15.190
  960   2HB   SER 118          1HB       SER 118 -28.386   9.246 -14.637
  961    HG   SER 118           HG       SER 118 -29.086  10.362 -16.261
  962    H    SER 119           H        SER 119 -25.993   7.767 -18.056
  963    HA   SER 119           HA       SER 119 -24.330   8.966 -19.038
  964   1HB   SER 119          2HB       SER 119 -26.073  10.673 -19.236
  965   2HB   SER 119          1HB       SER 119 -25.687  11.275 -17.623
  966    HG   SER 119           HG       SER 119 -24.717  12.382 -19.526
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1  -3.490   4.635  25.089
    2   2H    MET   1          2H        MET   1  -3.858   5.828  26.230
    3   3H    MET   1          3H        MET   1  -2.820   4.559  26.642
    4    HA   MET   1           HA       MET   1  -1.184   5.319  25.068
    5   1HB   MET   1          2HB       MET   1  -3.124   7.594  24.609
    6   2HB   MET   1          1HB       MET   1  -1.502   7.486  23.940
    7   1HG   MET   1          2HG       MET   1  -2.146   5.487  22.694
    8   2HG   MET   1          1HG       MET   1  -3.774   5.597  23.363
    9   1HE   MET   1          1HE       MET   1  -4.246   8.755  23.353
   10   2HE   MET   1          2HE       MET   1  -5.460   7.585  22.835
   11   3HE   MET   1          3HE       MET   1  -5.058   8.957  21.802
   12    H    CYS   2           H        CYS   2  -0.102   5.369  27.030
   13    HA   CYS   2           HA       CYS   2   0.037   8.017  28.273
   14   1HB   CYS   2          1HB       CYS   2  -0.232   5.426  29.813
   15   2HB   CYS   2          2HB       CYS   2   0.091   7.003  30.526
   16    HG   CYS   2           HG       CYS   2  -2.465   6.919  31.131
   17    H    ASN   3           H        ASN   3   1.666   6.022  26.530
   18    HA   ASN   3           HA       ASN   3   4.149   6.227  28.104
   19   1HB   ASN   3          1HB       ASN   3   3.250   3.882  27.551
   20   2HB   ASN   3          2HB       ASN   3   3.712   4.231  25.889
   21   1HD2  ASN   3          1HD2      ASN   3   4.726   2.190  27.660
   22   2HD2  ASN   3          2HD2      ASN   3   6.425   2.466  27.810
   23    H    THR   4           H        THR   4   3.098   8.311  26.486
   24    HA   THR   4           HA       THR   4   5.377   8.744  24.767
   25    HB   THR   4           HB       THR   4   2.604   8.767  23.559
   26    HG1  THR   4           1HG      THR   4   3.302   6.658  23.634
   27   1HG2  THR   4          1HG2      THR   4   3.773   9.265  21.457
   28   2HG2  THR   4          2HG2      THR   4   5.303   9.347  22.331
   29   3HG2  THR   4          3HG2      THR   4   4.037  10.530  22.658
   30    H    ASN   5           H        ASN   5   5.931  10.842  24.770
   31    HA   ASN   5           HA       ASN   5   4.054  12.743  25.982
   32   1HB   ASN   5          1HB       ASN   5   7.050  12.927  25.598
   33   2HB   ASN   5          2HB       ASN   5   6.050  14.151  26.377
   34   1HD2  ASN   5          1HD2      ASN   5   7.432  10.977  26.646
   35   2HD2  ASN   5          2HD2      ASN   5   7.146  10.776  28.339
   36    H    MET   6           H        MET   6   2.938  13.952  24.611
   37    HA   MET   6           HA       MET   6   3.950  14.452  21.930
   38   1HB   MET   6          1HB       MET   6   1.301  15.071  23.245
   39   2HB   MET   6          2HB       MET   6   1.695  15.513  21.591
   40   1HG   MET   6          2HG       MET   6   0.411  13.514  21.538
   41   2HG   MET   6          1HG       MET   6   2.069  13.107  21.100
   42   1HE   MET   6          1HE       MET   6  -0.123  10.942  21.943
   43   2HE   MET   6          2HE       MET   6   0.841   9.899  22.991
   44   3HE   MET   6          3HE       MET   6   1.534  10.533  21.497
   45    H    SER   7           H        SER   7   5.693  15.848  22.553
   46    HA   SER   7           HA       SER   7   4.833  18.537  23.390
   47   1HB   SER   7          2HB       SER   7   6.493  17.531  24.885
   48   2HB   SER   7          1HB       SER   7   7.581  17.272  23.521
   49    HG   SER   7           HG       SER   7   8.257  19.225  23.820
   50    H    VAL   8           H        VAL   8   7.366  17.046  21.363
   51    HA   VAL   8           HA       VAL   8   6.644  18.852  19.190
   52    HB   VAL   8           HB       VAL   8   8.360  20.131  20.246
   53   1HG1  VAL   8          1HG2      VAL   8  10.056  17.640  20.221
   54   2HG1  VAL   8          2HG2      VAL   8   9.334  18.395  21.641
   55   3HG1  VAL   8          3HG2      VAL   8  10.588  19.240  20.733
   56   1HG2  VAL   8          1HG1      VAL   8   9.521  18.645  17.894
   57   2HG2  VAL   8          2HG1      VAL   8  10.099  20.191  18.515
   58   3HG2  VAL   8          3HG1      VAL   8   8.482  20.067  17.824
   59    HA   PRO   9           HA       PRO   9   7.246  14.552  17.672
   60   1HB   PRO   9          2HB       PRO   9   5.573  15.654  15.492
   61   2HB   PRO   9          1HB       PRO   9   5.362  14.175  16.436
   62   1HG   PRO   9          2HG       PRO   9   3.786  16.300  16.825
   63   2HG   PRO   9          1HG       PRO   9   4.311  15.281  18.179
   64   1HD   PRO   9          2HD       PRO   9   5.329  17.960  17.314
   65   2HD   PRO   9          1HD       PRO   9   5.046  17.338  18.952
   66    H    THR  10           H        THR  10   6.897  17.187  15.288
   67    HA   THR  10           HA       THR  10   9.608  16.627  14.323
   68    HB   THR  10           HB       THR  10   8.832  16.718  11.971
   69    HG1  THR  10           1HG      THR  10   6.603  16.547  11.562
   70   1HG2  THR  10          1HG2      THR  10   7.869  14.460  11.892
   71   2HG2  THR  10          2HG2      THR  10   7.553  14.538  13.627
   72   3HG2  THR  10          3HG2      THR  10   9.213  14.550  13.033
   73    H    ASP  11           H        ASP  11  10.373  18.314  12.782
   74    HA   ASP  11           HA       ASP  11   9.279  20.939  13.544
   75   1HB   ASP  11          2HB       ASP  11  12.093  20.210  12.700
   76   2HB   ASP  11          1HB       ASP  11  11.540  21.832  13.108
   77    H    GLY  12           H        GLY  12   8.372  19.243  11.323
   78   1HA   GLY  12          2HA       GLY  12   7.886  21.110   9.374
   79   2HA   GLY  12          1HA       GLY  12   9.394  20.350   8.886
   80    H    ALA  13           H        ALA  13   5.997  20.099   8.976
   81    HA   ALA  13           HA       ALA  13   4.524  18.641   8.048
   82   1HB   ALA  13          1HB       ALA  13   5.280  17.138   6.293
   83   2HB   ALA  13          2HB       ALA  13   6.957  17.405   6.767
   84   3HB   ALA  13          3HB       ALA  13   6.007  18.733   6.102
   85    H    VAL  14           H        VAL  14   3.466  16.971   8.913
   86    HA   VAL  14           HA       VAL  14   4.987  15.150  10.652
   87    HB   VAL  14           HB       VAL  14   2.004  15.415  10.757
   88   1HG1  VAL  14          1HG1      VAL  14   2.367  14.865  13.121
   89   2HG1  VAL  14          2HG1      VAL  14   4.105  14.814  12.834
   90   3HG1  VAL  14          3HG1      VAL  14   3.045  13.642  12.047
   91   1HG2  VAL  14          1HG2      VAL  14   3.962  17.283  12.090
   92   2HG2  VAL  14          2HG2      VAL  14   2.229  17.214  12.413
   93   3HG2  VAL  14          3HG2      VAL  14   2.814  17.707  10.822
   94    H    THR  15           H        THR  15   3.797  12.954  10.923
   95    HA   THR  15           HA       THR  15   3.849  11.678   8.372
   96    HB   THR  15           HB       THR  15   3.015  10.537  11.048
   97    HG1  THR  15           1HG      THR  15   5.187   9.799  11.100
   98   1HG2  THR  15          1HG2      THR  15   3.873   9.169   8.494
   99   2HG2  THR  15          2HG2      THR  15   2.242   9.180   9.168
  100   3HG2  THR  15          3HG2      THR  15   3.548   8.368  10.030
  101    H    THR  16           H        THR  16   2.211  12.029   7.000
  102    HA   THR  16           HA       THR  16  -0.478  11.285   7.861
  103    HB   THR  16           HB       THR  16  -0.410  13.727   8.103
  104    HG1  THR  16           1HG      THR  16  -2.349  12.716   7.336
  105   1HG2  THR  16          1HG2      THR  16   1.339  14.233   6.480
  106   2HG2  THR  16          2HG2      THR  16  -0.121  15.156   6.124
  107   3HG2  THR  16          3HG2      THR  16   0.279  13.733   5.163
  108    H    SER  17           H        SER  17  -1.975  11.473   5.774
  109    HA   SER  17           HA       SER  17  -1.086   9.541   3.962
  110   1HB   SER  17          1HB       SER  17  -3.084  10.127   2.637
  111   2HB   SER  17          2HB       SER  17  -3.462   9.991   4.353
  112    HG   SER  17           HG       SER  17  -3.207  12.330   4.418
  113    H    GLN  18           H        GLN  18  -1.212   9.987   1.482
  114    HA   GLN  18           HA       GLN  18   0.138  12.466   0.737
  115   1HB   GLN  18          2HB       GLN  18   1.943  10.872   1.308
  116   2HB   GLN  18          1HB       GLN  18   1.272   9.725   0.157
  117   1HG   GLN  18          1HG       GLN  18   3.183  10.873  -0.783
  118   2HG   GLN  18          2HG       GLN  18   1.707  11.268  -1.667
  119   1HE2  GLN  18          2HE2      GLN  18   2.483  12.618   1.456
  120   2HE2  GLN  18          1HE2      GLN  18   2.763  14.232   0.908
  121    H    ILE  19           H        ILE  19  -1.459   9.471  -0.134
  122    HA   ILE  19           HA       ILE  19  -0.756   9.717  -2.860
  123    HB   ILE  19           HB       ILE  19  -1.639   7.602  -3.183
  124   1HG1  ILE  19          2HG1      ILE  19  -3.458   7.908  -0.789
  125   2HG1  ILE  19          1HG1      ILE  19  -3.960   8.286  -2.434
  126   1HG2  ILE  19          1HG2      ILE  19  -1.095   6.283  -1.171
  127   2HG2  ILE  19          2HG2      ILE  19  -1.045   7.774  -0.231
  128   3HG2  ILE  19          3HG2      ILE  19   0.122   7.508  -1.528
  129   1HD1  ILE  19          1HD1      ILE  19  -3.061   5.607  -1.411
  130   2HD1  ILE  19          2HD1      ILE  19  -3.477   5.970  -3.087
  131   3HD1  ILE  19          3HD1      ILE  19  -4.708   6.084  -1.828
  132    HA   PRO  20           HA       PRO  20  -4.234  11.803  -4.734
  133   1HB   PRO  20          1HB       PRO  20  -4.482   9.474  -6.562
  134   2HB   PRO  20          2HB       PRO  20  -4.288  11.187  -6.942
  135   1HG   PRO  20          2HG       PRO  20  -2.259   9.484  -7.240
  136   2HG   PRO  20          1HG       PRO  20  -1.988  11.128  -6.633
  137   1HD   PRO  20          1HD       PRO  20  -2.074   8.541  -5.134
  138   2HD   PRO  20          2HD       PRO  20  -1.013   9.947  -4.900
  139    H    ALA  21           H        ALA  21  -5.549  11.404  -2.832
  140    HA   ALA  21           HA       ALA  21  -7.926   9.936  -3.330
  141   1HB   ALA  21          1HB       ALA  21  -6.067   8.760  -1.265
  142   2HB   ALA  21          2HB       ALA  21  -6.472   8.034  -2.820
  143   3HB   ALA  21          3HB       ALA  21  -7.720   8.240  -1.590
  144    H    SER  22           H        SER  22  -8.882   9.528  -0.802
  145    HA   SER  22           HA       SER  22  -8.842  12.259   0.295
  146   1HB   SER  22          2HB       SER  22 -11.050  10.189   0.397
  147   2HB   SER  22          1HB       SER  22 -11.127  11.800   1.110
  148    HG   SER  22           HG       SER  22 -10.424  12.196  -1.357
  149    H    GLU  23           H        GLU  23  -7.038  10.016   0.986
  150    HA   GLU  23           HA       GLU  23  -6.093   9.047   2.812
  151   1HB   GLU  23          1HB       GLU  23  -6.016  11.409   3.520
  152   2HB   GLU  23          2HB       GLU  23  -7.591  11.225   4.277
  153   1HG   GLU  23          2HG       GLU  23  -6.661   9.559   5.806
  154   2HG   GLU  23          1HG       GLU  23  -5.080   9.761   5.054
  155    H    GLN  24           H        GLN  24  -7.032   7.045   2.861
  156    HA   GLN  24           HA       GLN  24  -8.324   5.315   3.585
  157   1HB   GLN  24          1HB       GLN  24  -7.779   6.153   5.832
  158   2HB   GLN  24          2HB       GLN  24  -9.154   7.245   5.760
  159   1HG   GLN  24          1HG       GLN  24 -10.669   5.331   5.640
  160   2HG   GLN  24          2HG       GLN  24  -9.287   4.238   5.713
  161   1HE2  GLN  24          2HE2      GLN  24 -11.276   6.471   7.478
  162   2HE2  GLN  24          1HE2      GLN  24 -10.722   6.033   9.056
  163    H    GLU  25           H        GLU  25 -10.468   4.492   3.425
  164    HA   GLU  25           HA       GLU  25 -12.720   6.065   2.781
  165   1HB   GLU  25          1HB       GLU  25 -12.614   5.708   0.276
  166   2HB   GLU  25          2HB       GLU  25 -11.513   6.918   0.924
  167   1HG   GLU  25          1HG       GLU  25  -9.659   5.433   0.752
  168   2HG   GLU  25          2HG       GLU  25 -10.711   4.072   0.358
  169    H    THR  26           H        THR  26 -11.047   3.238   1.398
  170    HA   THR  26           HA       THR  26 -13.629   1.832   1.365
  171    HB   THR  26           HB       THR  26 -11.192   1.345  -0.346
  172    HG1  THR  26           1HG      THR  26 -13.180   2.160  -1.832
  173   1HG2  THR  26          1HG2      THR  26 -13.998   0.244  -0.530
  174   2HG2  THR  26          2HG2      THR  26 -12.562  -0.652  -0.037
  175   3HG2  THR  26          3HG2      THR  26 -12.701  -0.049  -1.689
  176    H    LEU  27           H        LEU  27 -13.830   0.272   2.858
  177    HA   LEU  27           HA       LEU  27 -11.556  -1.014   4.007
  178   1HB   LEU  27          1HB       LEU  27 -13.980  -0.716   4.976
  179   2HB   LEU  27          2HB       LEU  27 -14.296  -2.207   4.105
  180    HG   LEU  27           HG       LEU  27 -13.742  -2.721   6.408
  181   1HD1  LEU  27          1HD2      LEU  27 -12.955  -4.268   4.681
  182   2HD1  LEU  27          2HD2      LEU  27 -11.861  -4.227   6.064
  183   3HD1  LEU  27          3HD2      LEU  27 -11.438  -3.371   4.578
  184   1HD2  LEU  27          1HD1      LEU  27 -12.497  -0.899   7.179
  185   2HD2  LEU  27          2HD1      LEU  27 -11.345  -1.005   5.845
  186   3HD2  LEU  27          3HD1      LEU  27 -11.331  -2.224   7.125
  187    H    VAL  28           H        VAL  28 -10.537  -1.551   2.037
  188    HA   VAL  28           HA       VAL  28 -11.780  -3.428   0.239
  189    HB   VAL  28           HB       VAL  28 -10.371  -2.164  -1.030
  190   1HG1  VAL  28          1HG1      VAL  28  -9.600  -0.738   0.729
  191   2HG1  VAL  28          2HG1      VAL  28  -8.190  -1.287  -0.189
  192   3HG1  VAL  28          3HG1      VAL  28  -8.569  -2.025   1.372
  193   1HG2  VAL  28          1HG2      VAL  28  -8.543  -4.319   0.027
  194   2HG2  VAL  28          2HG2      VAL  28  -8.182  -3.320  -1.385
  195   3HG2  VAL  28          3HG2      VAL  28  -9.579  -4.399  -1.402
  196    H    ARG  29           H        ARG  29 -11.405  -5.574   0.120
  197    HA   ARG  29           HA       ARG  29  -9.903  -6.674   2.382
  198   1HB   ARG  29          1HB       ARG  29 -12.600  -7.717   1.529
  199   2HB   ARG  29          2HB       ARG  29 -11.738  -8.032   3.029
  200   1HG   ARG  29          1HG       ARG  29 -12.116  -5.770   3.779
  201   2HG   ARG  29          2HG       ARG  29 -12.857  -5.343   2.234
  202   1HD   ARG  29          2HD       ARG  29 -14.639  -6.981   2.654
  203   2HD   ARG  29          1HD       ARG  29 -13.905  -7.371   4.208
  204    HE   ARG  29           HE       ARG  29 -14.349  -4.629   4.168
  205   1HH1  ARG  29          2HH1      ARG  29 -16.213  -7.571   4.086
  206   2HH1  ARG  29          1HH1      ARG  29 -17.594  -6.869   4.862
  207   1HH2  ARG  29          1HH2      ARG  29 -16.163  -3.696   5.189
  208   2HH2  ARG  29          2HH2      ARG  29 -17.565  -4.668   5.490
  209    HA   PRO  30           HA       PRO  30  -8.913  -8.714  -1.600
  210   1HB   PRO  30          1HB       PRO  30  -6.246  -8.602  -1.466
  211   2HB   PRO  30          2HB       PRO  30  -7.209  -7.161  -1.814
  212   1HG   PRO  30          2HG       PRO  30  -5.927  -8.014   0.750
  213   2HG   PRO  30          1HG       PRO  30  -6.027  -6.396   0.033
  214   1HD   PRO  30          1HD       PRO  30  -7.685  -7.340   2.035
  215   2HD   PRO  30          2HD       PRO  30  -8.084  -6.005   0.939
  216    H    LYS  31           H        LYS  31  -8.080 -10.744  -2.200
  217    HA   LYS  31           HA       LYS  31  -8.091 -12.816  -0.310
  218   1HB   LYS  31          2HB       LYS  31  -6.808 -12.757  -3.049
  219   2HB   LYS  31          1HB       LYS  31  -7.153 -14.207  -2.116
  220   1HG   LYS  31          1HG       LYS  31  -9.539 -13.734  -2.240
  221   2HG   LYS  31          2HG       LYS  31  -9.205 -12.262  -3.153
  222   1HD   LYS  31          2HD       LYS  31  -8.447 -15.041  -4.044
  223   2HD   LYS  31          1HD       LYS  31  -9.886 -14.172  -4.580
  224   1HE   LYS  31          1HE       LYS  31  -7.030 -13.288  -4.978
  225   2HE   LYS  31          2HE       LYS  31  -8.076 -13.991  -6.211
  226   1HZ   LYS  31          1HZ       LYS  31  -7.999 -11.585  -6.387
  227   2HZ   LYS  31          2HZ       LYS  31  -8.557 -11.423  -4.798
  228   3HZ   LYS  31          3HZ       LYS  31  -9.560 -12.098  -5.981
  229    HA   PRO  32           HA       PRO  32  -4.245 -12.712   1.734
  230   1HB   PRO  32          1HB       PRO  32  -3.485 -15.378   1.611
  231   2HB   PRO  32          2HB       PRO  32  -4.596 -14.691   2.800
  232   1HG   PRO  32          1HG       PRO  32  -5.197 -16.166   0.273
  233   2HG   PRO  32          2HG       PRO  32  -6.005 -16.261   1.849
  234   1HD   PRO  32          1HD       PRO  32  -7.086 -14.899  -0.187
  235   2HD   PRO  32          2HD       PRO  32  -7.212 -14.311   1.486
  236    H    LEU  33           H        LEU  33  -2.973 -11.512   0.315
  237    HA   LEU  33           HA       LEU  33  -0.906 -13.047  -1.013
  238   1HB   LEU  33          2HB       LEU  33  -2.836 -12.519  -2.664
  239   2HB   LEU  33          1HB       LEU  33  -2.231 -10.873  -2.600
  240    HG   LEU  33           HG       LEU  33  -0.031 -11.666  -3.399
  241   1HD1  LEU  33          1HD2      LEU  33  -1.431 -14.325  -3.655
  242   2HD1  LEU  33          2HD2      LEU  33  -0.109 -13.942  -2.553
  243   3HD1  LEU  33          3HD2      LEU  33   0.167 -13.941  -4.294
  244   1HD2  LEU  33          1HD1      LEU  33  -1.673 -10.832  -4.991
  245   2HD2  LEU  33          2HD1      LEU  33  -2.363 -12.447  -5.144
  246   3HD2  LEU  33          3HD1      LEU  33  -0.718 -12.133  -5.698
  247    H    LEU  34           H        LEU  34  -2.153 -10.153   0.367
  248    HA   LEU  34           HA       LEU  34   0.567  -9.057   0.473
  249   1HB   LEU  34          2HB       LEU  34  -0.200  -6.863   0.044
  250   2HB   LEU  34          1HB       LEU  34  -0.917  -7.872  -1.198
  251    HG   LEU  34           HG       LEU  34  -2.879  -7.901   0.688
  252   1HD1  LEU  34          1HD1      LEU  34  -1.789  -5.099   0.724
  253   2HD1  LEU  34          2HD1      LEU  34  -1.531  -6.263   2.022
  254   3HD1  LEU  34          3HD1      LEU  34  -3.167  -5.736   1.619
  255   1HD2  LEU  34          1HD2      LEU  34  -3.190  -7.516  -1.681
  256   2HD2  LEU  34          2HD2      LEU  34  -2.489  -5.904  -1.533
  257   3HD2  LEU  34          3HD2      LEU  34  -4.022  -6.274  -0.745
  258    H    LEU  35           H        LEU  35  -1.754 -10.461   2.122
  259    HA   LEU  35           HA       LEU  35  -1.709  -8.621   4.394
  260   1HB   LEU  35          2HB       LEU  35  -3.435 -11.072   4.135
  261   2HB   LEU  35          1HB       LEU  35  -3.650  -9.708   5.216
  262    HG   LEU  35           HG       LEU  35  -3.897  -8.365   2.961
  263   1HD1  LEU  35          1HD2      LEU  35  -3.327 -10.305   1.549
  264   2HD1  LEU  35          2HD2      LEU  35  -4.933  -9.659   1.203
  265   3HD1  LEU  35          3HD2      LEU  35  -4.761 -11.135   2.153
  266   1HD2  LEU  35          1HD1      LEU  35  -6.177 -10.127   3.790
  267   2HD2  LEU  35          2HD1      LEU  35  -6.217  -8.453   3.229
  268   3HD2  LEU  35          3HD1      LEU  35  -5.572  -8.833   4.827
  269    H    LYS  36           H        LYS  36  -0.991 -11.966   3.455
  270    HA   LYS  36           HA       LYS  36   0.512 -12.636   5.747
  271   1HB   LYS  36          1HB       LYS  36   0.940 -13.277   2.824
  272   2HB   LYS  36          2HB       LYS  36   1.890 -13.975   4.125
  273   1HG   LYS  36          2HG       LYS  36  -1.089 -14.266   3.800
  274   2HG   LYS  36          1HG       LYS  36   0.114 -15.474   3.347
  275   1HD   LYS  36          1HD       LYS  36  -0.086 -14.397   6.145
  276   2HD   LYS  36          2HD       LYS  36  -1.055 -15.766   5.599
  277   1HE   LYS  36          1HE       LYS  36   0.898 -16.623   6.677
  278   2HE   LYS  36          2HE       LYS  36   1.054 -16.916   4.944
  279   1HZ   LYS  36          1HZ       LYS  36   3.105 -16.083   6.004
  280   2HZ   LYS  36          2HZ       LYS  36   2.311 -14.633   6.367
  281   3HZ   LYS  36          3HZ       LYS  36   2.553 -15.084   4.755
  282    H    LEU  37           H        LEU  37   0.760 -10.155   3.502
  283    HA   LEU  37           HA       LEU  37   3.600  -9.676   3.851
  284   1HB   LEU  37          1HB       LEU  37   2.409  -9.290   1.689
  285   2HB   LEU  37          2HB       LEU  37   1.477  -8.024   2.466
  286    HG   LEU  37           HG       LEU  37   3.388  -7.262   1.016
  287   1HD1  LEU  37          1HD1      LEU  37   4.021  -6.193   3.665
  288   2HD1  LEU  37          2HD1      LEU  37   2.303  -6.202   3.257
  289   3HD1  LEU  37          3HD1      LEU  37   3.458  -5.373   2.206
  290   1HD2  LEU  37          1HD2      LEU  37   5.626  -7.307   1.995
  291   2HD2  LEU  37          2HD2      LEU  37   5.032  -8.931   1.645
  292   3HD2  LEU  37          3HD2      LEU  37   5.030  -8.330   3.303
  293    H    LEU  38           H        LEU  38   0.509  -8.538   5.035
  294    HA   LEU  38           HA       LEU  38   1.776  -6.274   6.395
  295   1HB   LEU  38          1HB       LEU  38  -1.133  -6.925   5.953
  296   2HB   LEU  38          2HB       LEU  38  -0.540  -5.485   6.754
  297    HG   LEU  38           HG       LEU  38  -0.219  -6.236   3.852
  298   1HD1  LEU  38          1HD2      LEU  38  -2.380  -5.257   4.572
  299   2HD1  LEU  38          2HD2      LEU  38  -1.493  -4.260   3.419
  300   3HD1  LEU  38          3HD2      LEU  38  -1.498  -3.831   5.131
  301   1HD2  LEU  38          1HD1      LEU  38   1.020  -4.161   3.586
  302   2HD2  LEU  38          2HD1      LEU  38   1.858  -5.278   4.663
  303   3HD2  LEU  38          3HD1      LEU  38   0.976  -3.905   5.331
  304    H    LYS  39           H        LYS  39  -0.600  -8.840   7.134
  305    HA   LYS  39           HA       LYS  39  -0.545  -8.718   9.898
  306   1HB   LYS  39          2HB       LYS  39  -0.660 -11.188   8.157
  307   2HB   LYS  39          1HB       LYS  39  -1.083 -11.132   9.864
  308   1HG   LYS  39          2HG       LYS  39  -2.891  -9.558   9.358
  309   2HG   LYS  39          1HG       LYS  39  -2.474  -9.641   7.644
  310   1HD   LYS  39          2HD       LYS  39  -3.293 -12.012   9.318
  311   2HD   LYS  39          1HD       LYS  39  -4.391 -11.092   8.286
  312   1HE   LYS  39          1HE       LYS  39  -3.014 -11.647   6.336
  313   2HE   LYS  39          2HE       LYS  39  -1.934 -12.580   7.370
  314   1HZ   LYS  39          1HZ       LYS  39  -3.781 -14.048   7.909
  315   2HZ   LYS  39          2HZ       LYS  39  -3.514 -14.007   6.239
  316   3HZ   LYS  39          3HZ       LYS  39  -4.811 -13.153   6.908
  317    H    SER  40           H        SER  40   1.957  -9.589   7.720
  318    HA   SER  40           HA       SER  40   3.634 -11.006   9.522
  319   1HB   SER  40          2HB       SER  40   4.016 -11.062   7.104
  320   2HB   SER  40          1HB       SER  40   4.355  -9.332   7.103
  321    HG   SER  40           HG       SER  40   6.335  -9.998   7.383
  322    H    VAL  41           H        VAL  41   3.565  -7.584   8.516
  323    HA   VAL  41           HA       VAL  41   5.554  -6.622  10.221
  324    HB   VAL  41           HB       VAL  41   3.303  -4.776  10.014
  325   1HG1  VAL  41          1HG2      VAL  41   5.762  -4.309  10.461
  326   2HG1  VAL  41          2HG2      VAL  41   4.935  -3.260   9.308
  327   3HG1  VAL  41          3HG2      VAL  41   6.002  -4.540   8.726
  328   1HG2  VAL  41          1HG1      VAL  41   3.714  -4.511   7.480
  329   2HG2  VAL  41          2HG1      VAL  41   2.601  -5.757   8.049
  330   3HG2  VAL  41          3HG1      VAL  41   4.241  -6.195   7.555
  331    H    GLY  42           H        GLY  42   2.139  -5.909  10.779
  332   1HA   GLY  42          1HA       GLY  42   2.287  -6.895  13.513
  333   2HA   GLY  42          2HA       GLY  42   2.072  -5.161  13.321
  334    H    ALA  43           H        ALA  43   0.589  -6.056  10.715
  335    HA   ALA  43           HA       ALA  43  -2.011  -5.638  11.628
  336   1HB   ALA  43          1HB       ALA  43  -1.106  -7.045   9.120
  337   2HB   ALA  43          2HB       ALA  43  -1.404  -5.317   9.306
  338   3HB   ALA  43          3HB       ALA  43  -2.741  -6.464   9.422
  339    H    GLN  44           H        GLN  44  -3.853  -7.142  11.530
  340    HA   GLN  44           HA       GLN  44  -3.320  -9.962  11.828
  341   1HB   GLN  44          1HB       GLN  44  -4.307 -10.131  14.079
  342   2HB   GLN  44          2HB       GLN  44  -2.818  -9.198  14.082
  343   1HG   GLN  44          2HG       GLN  44  -4.118  -7.128  14.128
  344   2HG   GLN  44          1HG       GLN  44  -5.608  -8.069  14.137
  345   1HE2  GLN  44          1HE2      GLN  44  -6.270  -7.228  16.102
  346   2HE2  GLN  44          2HE2      GLN  44  -5.525  -7.668  17.597
  347    H    LYS  45           H        LYS  45  -5.104  -7.599  10.636
  348    HA   LYS  45           HA       LYS  45  -7.716  -8.869  11.012
  349   1HB   LYS  45          2HB       LYS  45  -7.025  -6.292   9.589
  350   2HB   LYS  45          1HB       LYS  45  -8.640  -6.874   9.961
  351   1HG   LYS  45          1HG       LYS  45  -8.216  -6.639  12.331
  352   2HG   LYS  45          2HG       LYS  45  -6.553  -6.146  12.005
  353   1HD   LYS  45          1HD       LYS  45  -9.003  -4.664  11.055
  354   2HD   LYS  45          2HD       LYS  45  -8.066  -4.242  12.491
  355   1HE   LYS  45          1HE       LYS  45  -7.027  -4.312   9.658
  356   2HE   LYS  45          2HE       LYS  45  -7.441  -2.861  10.569
  357   1HZ   LYS  45          1HZ       LYS  45  -5.064  -3.282  10.601
  358   2HZ   LYS  45          2HZ       LYS  45  -5.315  -4.804  11.294
  359   3HZ   LYS  45          3HZ       LYS  45  -5.709  -3.406  12.161
  360    H    ASP  46           H        ASP  46  -8.815  -9.869   9.393
  361    HA   ASP  46           HA       ASP  46  -7.412 -10.598   6.998
  362   1HB   ASP  46          1HB       ASP  46 -10.291 -11.067   7.804
  363   2HB   ASP  46          2HB       ASP  46  -9.484 -11.814   6.428
  364    H    THR  47           H        THR  47  -8.962  -7.845   7.888
  365    HA   THR  47           HA       THR  47  -9.634  -7.178   5.097
  366    HB   THR  47           HB       THR  47 -11.355  -5.588   6.058
  367    HG1  THR  47           1HG      THR  47 -11.957  -5.856   8.175
  368   1HG2  THR  47          1HG2      THR  47 -12.022  -7.694   5.018
  369   2HG2  THR  47          2HG2      THR  47 -13.050  -7.345   6.409
  370   3HG2  THR  47          3HG2      THR  47 -11.763  -8.545   6.540
  371    H    TYR  48           H        TYR  48  -9.216  -5.055   4.420
  372    HA   TYR  48           HA       TYR  48  -7.691  -3.382   6.284
  373   1HB   TYR  48          2HB       TYR  48  -6.758  -4.376   3.601
  374   2HB   TYR  48          1HB       TYR  48  -6.063  -2.963   4.388
  375    HD1  TYR  48           1HD      TYR  48  -4.589  -3.170   6.229
  376    HD2  TYR  48           2HD      TYR  48  -6.483  -6.608   4.598
  377    HE1  TYR  48           1HE      TYR  48  -3.029  -4.615   7.482
  378    HE2  TYR  48           2HE      TYR  48  -4.926  -8.060   5.834
  379    HH   TYR  48           HH       TYR  48  -2.695  -7.930   6.832
  380    H    THR  49           H        THR  49  -7.011  -1.296   4.986
  381    HA   THR  49           HA       THR  49  -8.960  -0.743   2.862
  382    HB   THR  49           HB       THR  49  -8.863   1.667   3.407
  383    HG1  THR  49           1HG      THR  49  -8.231   1.666   5.938
  384   1HG2  THR  49          1HG2      THR  49 -10.839   0.711   4.108
  385   2HG2  THR  49          2HG2      THR  49 -10.232   1.461   5.584
  386   3HG2  THR  49          3HG2      THR  49 -10.048  -0.277   5.337
  387    H    MET  50           H        MET  50  -7.970   1.618   1.957
  388    HA   MET  50           HA       MET  50  -5.626   0.649   0.571
  389   1HB   MET  50          1HB       MET  50  -6.011   2.726  -0.815
  390   2HB   MET  50          2HB       MET  50  -7.327   1.560  -0.802
  391   1HG   MET  50          1HG       MET  50  -8.627   3.302  -0.375
  392   2HG   MET  50          2HG       MET  50  -8.010   3.173   1.271
  393   1HE   MET  50          1HE       MET  50  -6.486   6.139  -1.912
  394   2HE   MET  50          2HE       MET  50  -7.878   5.077  -2.117
  395   3HE   MET  50          3HE       MET  50  -6.253   4.396  -2.051
  396    H    LYS  51           H        LYS  51  -6.437   3.036   2.969
  397    HA   LYS  51           HA       LYS  51  -3.860   4.351   2.830
  398   1HB   LYS  51          1HB       LYS  51  -5.787   5.667   3.510
  399   2HB   LYS  51          2HB       LYS  51  -6.121   4.553   4.829
  400   1HG   LYS  51          2HG       LYS  51  -3.900   5.171   5.799
  401   2HG   LYS  51          1HG       LYS  51  -3.783   6.425   4.560
  402   1HD   LYS  51          2HD       LYS  51  -5.807   7.473   5.390
  403   2HD   LYS  51          1HD       LYS  51  -6.010   6.187   6.582
  404   1HE   LYS  51          2HE       LYS  51  -3.837   6.834   7.582
  405   2HE   LYS  51          1HE       LYS  51  -3.753   8.182   6.448
  406   1HZ   LYS  51          1HZ       LYS  51  -5.864   7.770   8.497
  407   2HZ   LYS  51          2HZ       LYS  51  -5.801   9.054   7.399
  408   3HZ   LYS  51          3HZ       LYS  51  -4.604   8.898   8.582
  409    H    GLU  52           H        GLU  52  -5.552   2.068   4.913
  410    HA   GLU  52           HA       GLU  52  -3.657   1.599   6.863
  411   1HB   GLU  52          2HB       GLU  52  -6.048   0.516   6.235
  412   2HB   GLU  52          1HB       GLU  52  -4.982  -0.783   5.714
  413   1HG   GLU  52          1HG       GLU  52  -5.714  -1.161   7.980
  414   2HG   GLU  52          2HG       GLU  52  -3.977  -0.860   7.938
  415    H    VAL  53           H        VAL  53  -4.051  -0.311   3.871
  416    HA   VAL  53           HA       VAL  53  -1.641  -1.710   4.083
  417    HB   VAL  53           HB       VAL  53  -3.089  -0.968   1.537
  418   1HG1  VAL  53          1HG2      VAL  53  -2.008  -2.968   0.613
  419   2HG1  VAL  53          2HG2      VAL  53  -1.134  -3.187   2.128
  420   3HG1  VAL  53          3HG2      VAL  53  -0.826  -1.766   1.130
  421   1HG2  VAL  53          1HG1      VAL  53  -4.128  -3.207   1.767
  422   2HG2  VAL  53          2HG1      VAL  53  -4.604  -2.079   3.035
  423   3HG2  VAL  53          3HG1      VAL  53  -3.414  -3.335   3.373
  424    H    LEU  54           H        LEU  54  -2.362   1.458   2.744
  425    HA   LEU  54           HA       LEU  54  -0.147   2.003   1.230
  426   1HB   LEU  54          2HB       LEU  54  -2.117   3.515   1.749
  427   2HB   LEU  54          1HB       LEU  54  -1.287   3.953   3.228
  428    HG   LEU  54           HG       LEU  54  -1.053   5.578   1.317
  429   1HD1  LEU  54          1HD1      LEU  54   1.315   6.002   1.716
  430   2HD1  LEU  54          2HD1      LEU  54   1.489   4.395   2.420
  431   3HD1  LEU  54          3HD1      LEU  54   0.474   5.599   3.214
  432   1HD2  LEU  54          1HD2      LEU  54   0.569   5.048  -0.429
  433   2HD2  LEU  54          2HD2      LEU  54  -0.824   3.969  -0.492
  434   3HD2  LEU  54          3HD2      LEU  54   0.701   3.401   0.191
  435    H    PHE  55           H        PHE  55  -0.294   3.151   4.605
  436    HA   PHE  55           HA       PHE  55   2.511   3.455   4.741
  437   1HB   PHE  55          2HB       PHE  55   2.145   3.823   7.177
  438   2HB   PHE  55          1HB       PHE  55   1.111   4.811   6.154
  439    HD1  PHE  55           1HD      PHE  55   1.121   1.653   8.116
  440    HD2  PHE  55           2HD      PHE  55  -1.173   4.850   6.498
  441    HE1  PHE  55           1HE      PHE  55  -0.855   0.850   9.343
  442    HE2  PHE  55           2HE      PHE  55  -3.154   4.052   7.720
  443    HZ   PHE  55           HZ       PHE  55  -2.995   2.050   9.145
  444    H    TYR  56           H        TYR  56   0.439   0.758   5.275
  445    HA   TYR  56           HA       TYR  56   2.121  -0.655   7.083
  446   1HB   TYR  56          1HB       TYR  56  -0.458  -1.018   5.953
  447   2HB   TYR  56          2HB       TYR  56   0.478  -2.474   5.636
  448    HD1  TYR  56           1HD      TYR  56  -1.974  -1.955   7.534
  449    HD2  TYR  56           2HD      TYR  56   2.223  -2.278   8.151
  450    HE1  TYR  56           1HE      TYR  56  -2.379  -2.707   9.836
  451    HE2  TYR  56           2HE      TYR  56   1.837  -3.041  10.455
  452    HH   TYR  56           HH       TYR  56  -1.227  -3.993  11.584
  453    H    LEU  57           H        LEU  57   1.814  -0.581   3.587
  454    HA   LEU  57           HA       LEU  57   3.646  -2.727   3.128
  455   1HB   LEU  57          2HB       LEU  57   1.924  -1.195   1.565
  456   2HB   LEU  57          1HB       LEU  57   3.520  -0.727   1.020
  457    HG   LEU  57           HG       LEU  57   2.845  -2.478  -0.407
  458   1HD1  LEU  57          1HD1      LEU  57   4.596  -3.707   1.719
  459   2HD1  LEU  57          2HD1      LEU  57   5.144  -2.714   0.368
  460   3HD1  LEU  57          3HD1      LEU  57   4.413  -4.290   0.064
  461   1HD2  LEU  57          1HD2      LEU  57   1.991  -4.624   0.392
  462   2HD2  LEU  57          2HD2      LEU  57   0.964  -3.286   0.903
  463   3HD2  LEU  57          3HD2      LEU  57   2.071  -4.037   2.053
  464    H    GLY  58           H        GLY  58   3.855   0.790   3.356
  465   1HA   GLY  58          2HA       GLY  58   6.619   1.098   3.026
  466   2HA   GLY  58          1HA       GLY  58   5.607   2.090   4.066
  467    H    GLN  59           H        GLN  59   4.740   0.055   5.840
  468    HA   GLN  59           HA       GLN  59   6.801  -0.030   7.719
  469   1HB   GLN  59          2HB       GLN  59   4.444  -1.909   7.463
  470   2HB   GLN  59          1HB       GLN  59   5.453  -1.732   8.890
  471   1HG   GLN  59          2HG       GLN  59   3.713   0.410   7.696
  472   2HG   GLN  59          1HG       GLN  59   3.330  -0.561   9.112
  473   1HE2  GLN  59          1HE2      GLN  59   3.157   1.231  10.434
  474   2HE2  GLN  59          2HE2      GLN  59   4.535   2.130  10.959
  475    H    TYR  60           H        TYR  60   5.577  -2.691   5.675
  476    HA   TYR  60           HA       TYR  60   7.292  -4.638   6.630
  477   1HB   TYR  60          1HB       TYR  60   5.319  -5.106   5.229
  478   2HB   TYR  60          2HB       TYR  60   6.162  -4.438   3.835
  479    HD1  TYR  60           1HD      TYR  60   7.962  -5.654   2.758
  480    HD2  TYR  60           2HD      TYR  60   5.927  -7.279   6.123
  481    HE1  TYR  60           1HE      TYR  60   8.931  -7.856   2.273
  482    HE2  TYR  60           2HE      TYR  60   6.894  -9.488   5.646
  483    HH   TYR  60           HH       TYR  60   7.842 -10.718   3.770
  484    H    ILE  61           H        ILE  61   7.741  -2.590   3.735
  485    HA   ILE  61           HA       ILE  61  10.116  -3.805   2.905
  486    HB   ILE  61           HB       ILE  61  10.560  -1.575   1.730
  487   1HG1  ILE  61          1HG1      ILE  61   7.776  -1.058   2.792
  488   2HG1  ILE  61          2HG1      ILE  61   9.227  -0.144   3.191
  489   1HG2  ILE  61          1HG2      ILE  61   8.829  -2.044   0.058
  490   2HG2  ILE  61          2HG2      ILE  61   8.009  -3.094   1.214
  491   3HG2  ILE  61          3HG2      ILE  61   9.619  -3.514   0.627
  492   1HD1  ILE  61          1HD1      ILE  61   8.006  -0.344   0.447
  493   2HD1  ILE  61          2HD1      ILE  61   9.402   0.631   0.911
  494   3HD1  ILE  61          3HD1      ILE  61   7.807   1.008   1.565
  495    H    MET  62           H        MET  62   9.643  -0.891   4.891
  496    HA   MET  62           HA       MET  62  12.409  -0.367   5.222
  497   1HB   MET  62          2HB       MET  62  10.123   0.467   7.012
  498   2HB   MET  62          1HB       MET  62  11.724   1.193   6.962
  499   1HG   MET  62          2HG       MET  62  11.303   1.859   4.622
  500   2HG   MET  62          1HG       MET  62   9.668   1.219   4.769
  501   1HE   MET  62          1HE       MET  62   7.852   2.195   6.469
  502   2HE   MET  62          2HE       MET  62   8.158   3.563   7.541
  503   3HE   MET  62          3HE       MET  62   8.992   2.031   7.805
  504    H    THR  63           H        THR  63  10.255  -2.585   6.733
  505    HA   THR  63           HA       THR  63  11.791  -2.758   9.186
  506    HB   THR  63           HB       THR  63   9.359  -4.305   8.280
  507    HG1  THR  63           1HG      THR  63   9.662  -1.849   9.290
  508   1HG2  THR  63          1HG2      THR  63  10.727  -4.243  10.973
  509   2HG2  THR  63          2HG2      THR  63  10.675  -5.615   9.866
  510   3HG2  THR  63          3HG2      THR  63   9.190  -5.035  10.621
  511    H    LYS  64           H        LYS  64  10.766  -5.137   6.722
  512    HA   LYS  64           HA       LYS  64  12.414  -7.136   7.956
  513   1HB   LYS  64          2HB       LYS  64  10.735  -7.250   5.446
  514   2HB   LYS  64          1HB       LYS  64  11.479  -8.635   6.235
  515   1HG   LYS  64          2HG       LYS  64   9.462  -6.834   7.554
  516   2HG   LYS  64          1HG       LYS  64   9.056  -8.336   6.721
  517   1HD   LYS  64          2HD       LYS  64  11.072  -8.252   8.947
  518   2HD   LYS  64          1HD       LYS  64   9.345  -8.426   9.264
  519   1HE   LYS  64          2HE       LYS  64  10.320 -10.610   9.219
  520   2HE   LYS  64          1HE       LYS  64   9.335 -10.416   7.770
  521   1HZ   LYS  64          1HZ       LYS  64  12.276 -10.032   7.843
  522   2HZ   LYS  64          2HZ       LYS  64  11.287 -10.052   6.471
  523   3HZ   LYS  64          3HZ       LYS  64  11.517 -11.467   7.366
  524    H    ARG  65           H        ARG  65  13.714  -4.806   6.589
  525    HA   ARG  65           HA       ARG  65  15.716  -4.478   5.565
  526   1HB   ARG  65          1HB       ARG  65  16.333  -6.555   6.832
  527   2HB   ARG  65          2HB       ARG  65  15.914  -7.489   5.403
  528   1HG   ARG  65          2HG       ARG  65  18.289  -7.196   5.476
  529   2HG   ARG  65          1HG       ARG  65  17.639  -6.247   4.137
  530   1HD   ARG  65          1HD       ARG  65  19.316  -4.972   5.341
  531   2HD   ARG  65          2HD       ARG  65  17.728  -4.232   5.533
  532    HE   ARG  65           HE       ARG  65  18.074  -5.926   7.693
  533   1HH1  ARG  65          2HH1      ARG  65  19.623  -3.094   6.378
  534   2HH1  ARG  65          1HH1      ARG  65  20.169  -2.519   7.919
  535   1HH2  ARG  65          1HH2      ARG  65  18.790  -5.178   9.724
  536   2HH2  ARG  65          2HH2      ARG  65  19.696  -3.704   9.821
  537    H    LEU  66           H        LEU  66  13.078  -5.715   4.107
  538    HA   LEU  66           HA       LEU  66  14.207  -5.981   1.446
  539   1HB   LEU  66          1HB       LEU  66  11.466  -6.201   2.616
  540   2HB   LEU  66          2HB       LEU  66  11.626  -5.893   0.900
  541    HG   LEU  66           HG       LEU  66  11.355  -8.222   1.113
  542   1HD1  LEU  66          1HD1      LEU  66  14.318  -7.747   0.860
  543   2HD1  LEU  66          2HD1      LEU  66  13.135  -7.557  -0.435
  544   3HD1  LEU  66          3HD1      LEU  66  13.424  -9.149   0.269
  545   1HD2  LEU  66          1HD2      LEU  66  12.573  -9.635   2.615
  546   2HD2  LEU  66          2HD2      LEU  66  11.826  -8.327   3.537
  547   3HD2  LEU  66          3HD2      LEU  66  13.552  -8.274   3.168
  548    H    TYR  67           H        TYR  67  15.193  -3.882   1.329
  549    HA   TYR  67           HA       TYR  67  13.676  -1.933   0.012
  550   1HB   TYR  67          1HB       TYR  67  13.429  -0.193   1.622
  551   2HB   TYR  67          2HB       TYR  67  12.752  -1.648   2.338
  552    HD1  TYR  67           1HD      TYR  67  14.562  -3.063   3.749
  553    HD2  TYR  67           2HD      TYR  67  14.736   1.117   2.976
  554    HE1  TYR  67           1HE      TYR  67  15.996  -2.761   5.725
  555    HE2  TYR  67           2HE      TYR  67  16.169   1.430   4.944
  556    HH   TYR  67           HH       TYR  67  16.669   0.283   7.062
  557    H    ASP  68           H        ASP  68  14.928   0.179  -0.195
  558    HA   ASP  68           HA       ASP  68  17.341  -0.620  -1.373
  559   1HB   ASP  68          2HB       ASP  68  16.059   1.189  -2.319
  560   2HB   ASP  68          1HB       ASP  68  16.217   2.141  -0.846
  561    H    GLU  69           H        GLU  69  16.692   0.257   1.816
  562    HA   GLU  69           HA       GLU  69  18.034   0.207   3.648
  563   1HB   GLU  69          2HB       GLU  69  19.338  -1.513   2.467
  564   2HB   GLU  69          1HB       GLU  69  20.290  -0.256   1.691
  565   1HG   GLU  69          1HG       GLU  69  21.121   0.463   3.871
  566   2HG   GLU  69          2HG       GLU  69  20.171  -0.803   4.647
  567    H    LYS  70           H        LYS  70  18.643   2.331   1.019
  568    HA   LYS  70           HA       LYS  70  19.787   4.285   2.909
  569   1HB   LYS  70          2HB       LYS  70  20.109   4.150  -0.095
  570   2HB   LYS  70          1HB       LYS  70  20.714   5.451   0.923
  571   1HG   LYS  70          2HG       LYS  70  22.136   3.830   2.109
  572   2HG   LYS  70          1HG       LYS  70  21.562   2.563   1.023
  573   1HD   LYS  70          2HD       LYS  70  22.479   3.777  -0.888
  574   2HD   LYS  70          1HD       LYS  70  23.038   5.061   0.189
  575   1HE   LYS  70          1HE       LYS  70  24.477   3.445   1.347
  576   2HE   LYS  70          2HE       LYS  70  23.934   2.181   0.244
  577   1HZ   LYS  70          1HZ       LYS  70  26.062   3.081  -0.438
  578   2HZ   LYS  70          2HZ       LYS  70  25.410   4.640  -0.531
  579   3HZ   LYS  70          3HZ       LYS  70  24.879   3.438  -1.595
  580    H    GLN  71           H        GLN  71  18.186   4.538  -0.259
  581    HA   GLN  71           HA       GLN  71  16.186   6.328   0.884
  582   1HB   GLN  71          2HB       GLN  71  16.555   5.355  -1.958
  583   2HB   GLN  71          1HB       GLN  71  15.380   6.555  -1.436
  584   1HG   GLN  71          1HG       GLN  71  18.372   6.835  -1.267
  585   2HG   GLN  71          2HG       GLN  71  17.329   7.583  -2.474
  586   1HE2  GLN  71          1HE2      GLN  71  15.992   9.288  -1.878
  587   2HE2  GLN  71          2HE2      GLN  71  16.228  10.171  -0.412
  588    H    GLN  72           H        GLN  72  14.999   4.969   2.211
  589    HA   GLN  72           HA       GLN  72  14.238   2.351   1.676
  590   1HB   GLN  72          1HB       GLN  72  12.633   4.348   3.284
  591   2HB   GLN  72          2HB       GLN  72  12.626   2.598   3.454
  592   1HG   GLN  72          1HG       GLN  72  14.971   2.672   4.176
  593   2HG   GLN  72          2HG       GLN  72  14.940   4.430   4.044
  594   1HE2  GLN  72          2HE2      GLN  72  13.840   1.670   5.841
  595   2HE2  GLN  72          1HE2      GLN  72  13.286   2.539   7.228
  596    H    HIS  73           H        HIS  73  13.077   5.249   0.289
  597    HA   HIS  73           HA       HIS  73  10.447   4.599  -0.379
  598   1HB   HIS  73          1HB       HIS  73  12.512   6.264  -1.812
  599   2HB   HIS  73          2HB       HIS  73  10.851   6.123  -2.374
  600    HD1  HIS  73           1HD      HIS  73  12.897   7.555   0.429
  601    HD2  HIS  73           2HD      HIS  73   8.983   7.596  -0.961
  602    HE1  HIS  73           1HE      HIS  73  11.736   9.357   1.746
  603    HE2  HIS  73           2HE      HIS  73   9.392   9.423   0.826
  604    H    ILE  74           H        ILE  74  13.471   3.451  -1.705
  605    HA   ILE  74           HA       ILE  74  11.983   1.900  -3.707
  606    HB   ILE  74           HB       ILE  74  14.973   1.856  -3.374
  607   1HG1  ILE  74          1HG1      ILE  74  14.390   4.200  -3.665
  608   2HG1  ILE  74          2HG1      ILE  74  15.099   3.575  -5.151
  609   1HG2  ILE  74          1HG2      ILE  74  14.913   1.218  -5.741
  610   2HG2  ILE  74          2HG2      ILE  74  13.151   1.314  -5.713
  611   3HG2  ILE  74          3HG2      ILE  74  13.984   0.105  -4.735
  612   1HD1  ILE  74          1HD1      ILE  74  13.214   5.018  -5.624
  613   2HD1  ILE  74          2HD1      ILE  74  12.166   3.997  -4.640
  614   3HD1  ILE  74          3HD1      ILE  74  12.874   3.362  -6.125
  615    H    VAL  75           H        VAL  75  12.387  -0.406  -3.855
  616    HA   VAL  75           HA       VAL  75  13.656  -1.710  -1.609
  617    HB   VAL  75           HB       VAL  75  11.678  -1.649  -0.466
  618   1HG1  VAL  75          1HG2      VAL  75  10.194  -1.865  -3.078
  619   2HG1  VAL  75          2HG2      VAL  75  10.432  -0.401  -2.125
  620   3HG1  VAL  75          3HG2      VAL  75   9.451  -1.718  -1.485
  621   1HG2  VAL  75          1HG1      VAL  75  10.505  -3.792  -0.687
  622   2HG2  VAL  75          2HG1      VAL  75  12.255  -3.991  -0.761
  623   3HG2  VAL  75          3HG1      VAL  75  11.299  -4.059  -2.240
  624    H    TYR  76           H        TYR  76  14.976  -2.951  -2.764
  625    HA   TYR  76           HA       TYR  76  13.982  -4.522  -5.001
  626   1HB   TYR  76          1HB       TYR  76  16.715  -4.821  -3.802
  627   2HB   TYR  76          2HB       TYR  76  16.210  -5.006  -5.481
  628    HD1  TYR  76           1HD      TYR  76  15.134  -2.742  -6.479
  629    HD2  TYR  76           2HD      TYR  76  17.968  -2.948  -3.311
  630    HE1  TYR  76           1HE      TYR  76  15.822  -0.424  -6.945
  631    HE2  TYR  76           2HE      TYR  76  18.659  -0.639  -3.769
  632    HH   TYR  76           HH       TYR  76  16.893   1.449  -5.779
  633    H    CYS  77           H        CYS  77  13.222  -6.538  -4.797
  634    HA   CYS  77           HA       CYS  77  13.739  -8.031  -2.339
  635   1HB   CYS  77          1HB       CYS  77  11.274  -8.304  -1.984
  636   2HB   CYS  77          2HB       CYS  77  11.863  -6.666  -1.722
  637    HG   CYS  77           HG       CYS  77  10.359  -7.660  -4.627
  638    H    SER  78           H        SER  78  14.821  -9.357  -3.992
  639    HA   SER  78           HA       SER  78  13.250 -10.894  -5.816
  640   1HB   SER  78          1HB       SER  78  15.978 -11.456  -4.624
  641   2HB   SER  78          2HB       SER  78  15.254 -12.340  -5.968
  642    HG   SER  78           HG       SER  78  16.258 -10.862  -7.094
  643    H    ASN  79           H        ASN  79  11.844 -12.425  -5.302
  644    HA   ASN  79           HA       ASN  79  10.693 -14.016  -4.160
  645   1HB   ASN  79          1HB       ASN  79  12.882 -15.224  -4.403
  646   2HB   ASN  79          2HB       ASN  79  13.328 -14.631  -2.807
  647   1HD2  ASN  79          2HD2      ASN  79  12.979 -17.361  -3.767
  648   2HD2  ASN  79          1HD2      ASN  79  11.787 -18.078  -2.742
  649    H    ASP  80           H        ASP  80   9.751 -12.029  -3.152
  650    HA   ASP  80           HA       ASP  80  10.193 -12.072  -0.236
  651   1HB   ASP  80          2HB       ASP  80  11.100 -10.003  -1.235
  652   2HB   ASP  80          1HB       ASP  80   9.518  -9.651  -1.923
  653    H    LEU  81           H        LEU  81   8.290 -11.361   1.025
  654    HA   LEU  81           HA       LEU  81   5.882 -12.568   0.280
  655   1HB   LEU  81          1HB       LEU  81   6.571 -10.468   2.313
  656   2HB   LEU  81          2HB       LEU  81   4.913 -10.981   2.077
  657    HG   LEU  81           HG       LEU  81   5.527 -13.282   2.670
  658   1HD1  LEU  81          1HD2      LEU  81   7.830 -13.285   1.883
  659   2HD1  LEU  81          2HD2      LEU  81   7.744 -13.776   3.574
  660   3HD1  LEU  81          3HD2      LEU  81   8.277 -12.148   3.154
  661   1HD2  LEU  81          1HD1      LEU  81   4.785 -11.741   4.416
  662   2HD2  LEU  81          2HD1      LEU  81   6.455 -11.252   4.696
  663   3HD2  LEU  81          3HD1      LEU  81   5.953 -12.908   5.038
  664    H    LEU  82           H        LEU  82   6.886  -9.157   0.089
  665    HA   LEU  82           HA       LEU  82   4.739  -8.042  -1.225
  666   1HB   LEU  82          2HB       LEU  82   6.677  -6.711  -0.673
  667   2HB   LEU  82          1HB       LEU  82   7.695  -7.668  -1.730
  668    HG   LEU  82           HG       LEU  82   6.952  -5.330  -2.507
  669   1HD1  LEU  82          1HD1      LEU  82   8.092  -6.954  -3.935
  670   2HD1  LEU  82          2HD1      LEU  82   6.888  -6.029  -4.829
  671   3HD1  LEU  82          3HD1      LEU  82   6.539  -7.687  -4.336
  672   1HD2  LEU  82          1HD2      LEU  82   4.589  -5.545  -1.975
  673   2HD2  LEU  82          2HD2      LEU  82   4.440  -6.872  -3.128
  674   3HD2  LEU  82          3HD2      LEU  82   4.825  -5.247  -3.697
  675    H    GLY  83           H        GLY  83   7.352 -10.030  -2.568
  676   1HA   GLY  83          1HA       GLY  83   6.745  -9.854  -5.263
  677   2HA   GLY  83          2HA       GLY  83   7.488 -11.255  -4.504
  678    H    ASP  84           H        ASP  84   5.303 -11.964  -2.817
  679    HA   ASP  84           HA       ASP  84   3.731 -13.549  -4.492
  680   1HB   ASP  84          2HB       ASP  84   2.862 -12.515  -1.785
  681   2HB   ASP  84          1HB       ASP  84   2.358 -14.005  -2.577
  682    H    LEU  85           H        LEU  85   3.115 -10.333  -3.139
  683    HA   LEU  85           HA       LEU  85   0.468 -10.261  -4.315
  684   1HB   LEU  85          2HB       LEU  85   0.009  -8.708  -2.782
  685   2HB   LEU  85          1HB       LEU  85   1.531  -9.178  -2.054
  686    HG   LEU  85           HG       LEU  85   2.484  -7.318  -3.683
  687   1HD1  LEU  85          1HD1      LEU  85  -0.336  -6.383  -3.170
  688   2HD1  LEU  85          2HD1      LEU  85   0.288  -6.913  -4.731
  689   3HD1  LEU  85          3HD1      LEU  85   0.950  -5.469  -3.960
  690   1HD2  LEU  85          1HD2      LEU  85   2.686  -7.341  -1.248
  691   2HD2  LEU  85          2HD2      LEU  85   1.047  -6.705  -1.105
  692   3HD2  LEU  85          3HD2      LEU  85   2.310  -5.725  -1.846
  693    H    PHE  86           H        PHE  86   3.644  -9.196  -5.119
  694    HA   PHE  86           HA       PHE  86   2.546  -7.635  -7.356
  695   1HB   PHE  86          2HB       PHE  86   4.022  -6.604  -5.201
  696   2HB   PHE  86          1HB       PHE  86   5.154  -6.674  -6.546
  697    HD1  PHE  86           1HD      PHE  86   2.175  -6.334  -8.157
  698    HD2  PHE  86           2HD      PHE  86   4.760  -4.093  -5.621
  699    HE1  PHE  86           1HE      PHE  86   1.238  -4.246  -9.051
  700    HE2  PHE  86           2HE      PHE  86   3.819  -1.993  -6.515
  701    HZ   PHE  86           HZ       PHE  86   2.059  -2.078  -8.229
  702    H    GLY  87           H        GLY  87   5.765  -8.737  -6.268
  703   1HA   GLY  87          1HA       GLY  87   6.850 -10.629  -7.284
  704   2HA   GLY  87          2HA       GLY  87   5.961 -10.292  -8.761
  705    H    VAL  88           H        VAL  88   6.849  -7.341  -7.786
  706    HA   VAL  88           HA       VAL  88   8.737  -6.967  -9.818
  707    HB   VAL  88           HB       VAL  88   9.157  -4.770  -8.862
  708   1HG1  VAL  88          1HG2      VAL  88   7.099  -5.084 -10.126
  709   2HG1  VAL  88          2HG2      VAL  88   6.872  -3.904  -8.834
  710   3HG1  VAL  88          3HG2      VAL  88   6.250  -5.545  -8.650
  711   1HG2  VAL  88          1HG1      VAL  88   9.318  -5.417  -6.516
  712   2HG2  VAL  88          2HG1      VAL  88   7.582  -5.735  -6.477
  713   3HG2  VAL  88          3HG1      VAL  88   8.173  -4.092  -6.731
  714    HA   PRO  89           HA       PRO  89  12.635  -7.812  -7.637
  715   1HB   PRO  89          1HB       PRO  89  14.284  -6.561  -9.352
  716   2HB   PRO  89          2HB       PRO  89  13.568  -8.131  -9.734
  717   1HG   PRO  89          1HG       PRO  89  12.734  -5.397 -10.630
  718   2HG   PRO  89          2HG       PRO  89  12.857  -6.891 -11.576
  719   1HD   PRO  89          2HD       PRO  89  10.502  -5.923 -10.580
  720   2HD   PRO  89          1HD       PRO  89  10.808  -7.648 -10.872
  721    H    SER  90           H        SER  90  11.073  -4.879  -8.381
  722    HA   SER  90           HA       SER  90  12.074  -3.593  -6.050
  723   1HB   SER  90          2HB       SER  90  13.048  -1.613  -7.219
  724   2HB   SER  90          1HB       SER  90  13.995  -3.088  -7.409
  725    HG   SER  90           HG       SER  90  13.769  -2.051  -9.401
  726    H    PHE  91           H        PHE  91  10.628  -2.076  -5.352
  727    HA   PHE  91           HA       PHE  91   9.117  -0.629  -7.383
  728   1HB   PHE  91          1HB       PHE  91   7.011  -0.826  -6.314
  729   2HB   PHE  91          2HB       PHE  91   7.654  -2.456  -6.447
  730    HD1  PHE  91           1HD      PHE  91   6.925   0.299  -4.116
  731    HD2  PHE  91           2HD      PHE  91   8.133  -3.762  -4.510
  732    HE1  PHE  91           1HE      PHE  91   6.493  -0.053  -1.729
  733    HE2  PHE  91           2HE      PHE  91   7.706  -4.123  -2.112
  734    HZ   PHE  91           HZ       PHE  91   6.885  -2.264  -0.720
  735    H    SER  92           H        SER  92   8.322   1.434  -6.689
  736    HA   SER  92           HA       SER  92   9.896   2.519  -4.451
  737   1HB   SER  92          1HB       SER  92  10.651   3.376  -6.608
  738   2HB   SER  92          2HB       SER  92   9.011   3.889  -7.001
  739    HG   SER  92           HG       SER  92  10.829   5.296  -5.787
  740    H    VAL  93           H        VAL  93   8.449   2.506  -2.800
  741    HA   VAL  93           HA       VAL  93   5.764   3.219  -2.840
  742    HB   VAL  93           HB       VAL  93   6.388   4.189  -0.451
  743   1HG1  VAL  93          1HG2      VAL  93   5.063   2.187  -0.865
  744   2HG1  VAL  93          2HG2      VAL  93   6.210   1.921   0.447
  745   3HG1  VAL  93          3HG2      VAL  93   6.537   1.261  -1.154
  746   1HG2  VAL  93          1HG1      VAL  93   8.797   4.219  -0.876
  747   2HG2  VAL  93          2HG1      VAL  93   8.770   2.470  -1.106
  748   3HG2  VAL  93          3HG1      VAL  93   8.382   3.157   0.470
  749    H    LYS  94           H        LYS  94   8.608   5.192  -3.141
  750    HA   LYS  94           HA       LYS  94   7.793   7.686  -2.351
  751   1HB   LYS  94          1HB       LYS  94  10.034   7.206  -3.224
  752   2HB   LYS  94          2HB       LYS  94   9.370   6.997  -4.839
  753   1HG   LYS  94          1HG       LYS  94   8.684   9.343  -4.861
  754   2HG   LYS  94          2HG       LYS  94   9.353   9.552  -3.241
  755   1HD   LYS  94          2HD       LYS  94  11.576   8.974  -4.082
  756   2HD   LYS  94          1HD       LYS  94  10.910   8.755  -5.702
  757   1HE   LYS  94          2HE       LYS  94  10.906  11.324  -4.122
  758   2HE   LYS  94          1HE       LYS  94  11.988  10.938  -5.460
  759   1HZ   LYS  94          1HZ       LYS  94  10.148  12.314  -6.189
  760   2HZ   LYS  94          2HZ       LYS  94   9.033  11.168  -5.637
  761   3HZ   LYS  94          3HZ       LYS  94  10.067  10.789  -6.921
  762    H    GLU  95           H        GLU  95   6.984   6.000  -5.344
  763    HA   GLU  95           HA       GLU  95   5.035   8.104  -5.970
  764   1HB   GLU  95          1HB       GLU  95   4.798   6.844  -8.147
  765   2HB   GLU  95          2HB       GLU  95   6.368   7.585  -7.869
  766   1HG   GLU  95          1HG       GLU  95   7.263   5.419  -7.166
  767   2HG   GLU  95          2HG       GLU  95   5.690   4.681  -7.469
  768    H    HIS  96           H        HIS  96   3.890   7.247  -3.995
  769    HA   HIS  96           HA       HIS  96   2.839   4.705  -3.749
  770   1HB   HIS  96          1HB       HIS  96   1.622   7.340  -2.899
  771   2HB   HIS  96          2HB       HIS  96   1.049   5.764  -2.365
  772    HD1  HIS  96           1HD      HIS  96   3.564   8.345  -1.663
  773    HD2  HIS  96           2HD      HIS  96   2.909   4.364  -0.669
  774    HE1  HIS  96           1HE      HIS  96   5.062   7.889   0.304
  775    HE2  HIS  96           2HE      HIS  96   4.723   5.447   0.824
  776    H    ARG  97           H        ARG  97   1.750   7.358  -5.745
  777    HA   ARG  97           HA       ARG  97  -0.833   6.528  -6.347
  778   1HB   ARG  97          2HB       ARG  97   0.067   8.698  -7.037
  779   2HB   ARG  97          1HB       ARG  97   1.167   7.901  -8.153
  780   1HG   ARG  97          1HG       ARG  97  -0.760   7.050  -9.420
  781   2HG   ARG  97          2HG       ARG  97  -1.839   7.912  -8.320
  782   1HD   ARG  97          2HD       ARG  97  -0.827  10.034  -8.977
  783   2HD   ARG  97          1HD       ARG  97   0.274   9.181 -10.059
  784    HE   ARG  97           HE       ARG  97  -2.453   8.604 -10.651
  785   1HH1  ARG  97          2HH1      ARG  97   0.052  10.990 -11.063
  786   2HH1  ARG  97          1HH1      ARG  97  -0.629  11.641 -12.517
  787   1HH2  ARG  97          1HH2      ARG  97  -3.356   9.453 -12.565
  788   2HH2  ARG  97          2HH2      ARG  97  -2.566  10.768 -13.370
  789    H    LYS  98           H        LYS  98   1.988   6.040  -8.477
  790    HA   LYS  98           HA       LYS  98   0.698   4.181 -10.132
  791   1HB   LYS  98          1HB       LYS  98   3.653   4.598  -9.663
  792   2HB   LYS  98          2HB       LYS  98   2.967   3.666 -10.987
  793   1HG   LYS  98          2HG       LYS  98   1.862   5.678 -11.832
  794   2HG   LYS  98          1HG       LYS  98   2.556   6.611 -10.505
  795   1HD   LYS  98          1HD       LYS  98   3.887   6.949 -12.485
  796   2HD   LYS  98          2HD       LYS  98   4.817   6.007 -11.319
  797   1HE   LYS  98          2HE       LYS  98   5.075   5.107 -13.567
  798   2HE   LYS  98          1HE       LYS  98   4.250   3.955 -12.517
  799   1HZ   LYS  98          1HZ       LYS  98   2.932   5.749 -14.483
  800   2HZ   LYS  98          2HZ       LYS  98   2.144   4.640 -13.479
  801   3HZ   LYS  98          3HZ       LYS  98   3.195   4.088 -14.683
  802    H    ILE  99           H        ILE  99   2.851   3.726  -7.375
  803    HA   ILE  99           HA       ILE  99   3.227   0.972  -7.579
  804    HB   ILE  99           HB       ILE  99   4.265   2.783  -5.957
  805   1HG1  ILE  99          2HG1      ILE  99   4.845   0.297  -6.346
  806   2HG1  ILE  99          1HG1      ILE  99   5.381   1.052  -4.850
  807   1HG2  ILE  99          1HG2      ILE  99   2.154   1.531  -4.222
  808   2HG2  ILE  99          2HG2      ILE  99   2.268   3.232  -4.677
  809   3HG2  ILE  99          3HG2      ILE  99   3.507   2.507  -3.647
  810   1HD1  ILE  99          1HD1      ILE  99   2.918  -0.652  -5.121
  811   2HD1  ILE  99          2HD1      ILE  99   3.589   0.018  -3.632
  812   3HD1  ILE  99          3HD1      ILE  99   4.483  -1.210  -4.528
  813    H    TYR 100           H        TYR 100   0.564   2.805  -6.189
  814    HA   TYR 100           HA       TYR 100  -0.762   0.308  -5.430
  815   1HB   TYR 100          2HB       TYR 100  -1.051   3.147  -4.595
  816   2HB   TYR 100          1HB       TYR 100  -2.485   2.123  -4.532
  817    HD1  TYR 100           1HD      TYR 100  -2.564   2.330  -2.077
  818    HD2  TYR 100           2HD      TYR 100   0.798   0.646  -4.065
  819    HE1  TYR 100           1HE      TYR 100  -1.792   1.363   0.050
  820    HE2  TYR 100           2HE      TYR 100   1.572  -0.323  -1.956
  821    HH   TYR 100           HH       TYR 100  -0.366  -0.473   0.827
  822    H    THR 101           H        THR 101  -0.583   2.248  -8.091
  823    HA   THR 101           HA       THR 101  -3.340   1.763  -8.910
  824    HB   THR 101           HB       THR 101  -1.039   3.008 -10.440
  825    HG1  THR 101           1HG      THR 101  -3.046   4.689 -10.034
  826   1HG2  THR 101          1HG2      THR 101  -2.641   1.930 -11.948
  827   2HG2  THR 101          2HG2      THR 101  -2.733   3.686 -12.074
  828   3HG2  THR 101          3HG2      THR 101  -3.964   2.802 -11.172
  829    H    MET 102           H        MET 102  -0.159   0.427  -9.234
  830    HA   MET 102           HA       MET 102  -0.961  -1.521 -11.220
  831   1HB   MET 102          1HB       MET 102   1.473  -1.655  -9.449
  832   2HB   MET 102          2HB       MET 102   1.228  -2.425 -11.010
  833   1HG   MET 102          2HG       MET 102   1.303  -0.287 -12.119
  834   2HG   MET 102          1HG       MET 102   1.413   0.536 -10.563
  835   1HE   MET 102          1HE       MET 102   4.946  -0.507  -9.288
  836   2HE   MET 102          2HE       MET 102   3.334  -1.083  -8.864
  837   3HE   MET 102          3HE       MET 102   3.626   0.643  -9.072
  838    H    ILE 103           H        ILE 103  -0.437  -1.373  -7.714
  839    HA   ILE 103           HA       ILE 103  -0.951  -4.071  -7.168
  840    HB   ILE 103           HB       ILE 103  -1.286  -1.598  -5.492
  841   1HG1  ILE 103          1HG1      ILE 103   0.617  -3.949  -5.428
  842   2HG1  ILE 103          2HG1      ILE 103   0.996  -2.306  -5.932
  843   1HG2  ILE 103          1HG2      ILE 103  -3.006  -3.161  -4.763
  844   2HG2  ILE 103          2HG2      ILE 103  -1.725  -3.041  -3.558
  845   3HG2  ILE 103          3HG2      ILE 103  -1.801  -4.442  -4.626
  846   1HD1  ILE 103          1HD1      ILE 103   0.608  -1.517  -3.662
  847   2HD1  ILE 103          2HD1      ILE 103   1.851  -2.767  -3.713
  848   3HD1  ILE 103          3HD1      ILE 103   0.225  -3.162  -3.155
  849    H    TYR 104           H        TYR 104  -3.196  -1.292  -6.985
  850    HA   TYR 104           HA       TYR 104  -5.465  -3.059  -6.721
  851   1HB   TYR 104          1HB       TYR 104  -5.266  -0.056  -6.998
  852   2HB   TYR 104          2HB       TYR 104  -6.785  -0.923  -6.797
  853    HD1  TYR 104           1HD      TYR 104  -3.601  -0.041  -5.163
  854    HD2  TYR 104           2HD      TYR 104  -7.473  -1.728  -4.656
  855    HE1  TYR 104           1HE      TYR 104  -3.313   0.044  -2.721
  856    HE2  TYR 104           2HE      TYR 104  -7.198  -1.645  -2.215
  857    HH   TYR 104           HH       TYR 104  -5.374  -1.578  -0.569
  858    H    ARG 105           H        ARG 105  -6.688  -3.836  -8.306
  859    HA   ARG 105           HA       ARG 105  -6.835  -2.449 -10.864
  860   1HB   ARG 105          2HB       ARG 105  -6.356  -4.509 -12.132
  861   2HB   ARG 105          1HB       ARG 105  -4.972  -3.979 -11.185
  862   1HG   ARG 105          2HG       ARG 105  -5.495  -5.656  -9.484
  863   2HG   ARG 105          1HG       ARG 105  -6.876  -6.192 -10.443
  864   1HD   ARG 105          1HD       ARG 105  -4.959  -7.657 -10.780
  865   2HD   ARG 105          2HD       ARG 105  -5.375  -6.808 -12.268
  866    HE   ARG 105           HE       ARG 105  -3.430  -5.306 -10.962
  867   1HH1  ARG 105          2HH1      ARG 105  -3.745  -8.431 -12.472
  868   2HH1  ARG 105          1HH1      ARG 105  -2.079  -8.516 -12.939
  869   1HH2  ARG 105          1HH2      ARG 105  -1.236  -5.412 -11.572
  870   2HH2  ARG 105          2HH2      ARG 105  -0.653  -6.801 -12.427
  871    H    ASN 106           H        ASN 106  -8.005  -4.836  -8.617
  872    HA   ASN 106           HA       ASN 106 -10.390  -5.401 -10.164
  873   1HB   ASN 106          2HB       ASN 106  -9.619  -6.232  -7.358
  874   2HB   ASN 106          1HB       ASN 106 -11.015  -6.828  -8.251
  875   1HD2  ASN 106          2HD2      ASN 106 -10.708  -8.229  -9.979
  876   2HD2  ASN 106          1HD2      ASN 106  -9.222  -9.075 -10.219
  877    H    LEU 107           H        LEU 107 -12.539  -5.010  -9.354
  878    HA   LEU 107           HA       LEU 107 -12.735  -2.363  -8.173
  879   1HB   LEU 107          2HB       LEU 107 -13.997  -3.054 -10.237
  880   2HB   LEU 107          1HB       LEU 107 -14.949  -4.123  -9.228
  881    HG   LEU 107           HG       LEU 107 -15.783  -2.186  -7.960
  882   1HD1  LEU 107          1HD2      LEU 107 -13.872  -0.705  -8.221
  883   2HD1  LEU 107          2HD2      LEU 107 -15.350   0.081  -8.778
  884   3HD1  LEU 107          3HD2      LEU 107 -14.199  -0.565  -9.948
  885   1HD2  LEU 107          1HD1      LEU 107 -16.125  -1.937 -10.946
  886   2HD2  LEU 107          2HD1      LEU 107 -17.193  -1.247  -9.722
  887   3HD2  LEU 107          3HD1      LEU 107 -17.047  -2.997  -9.879
  888    H    VAL 108           H        VAL 108 -12.255  -5.127  -6.771
  889    HA   VAL 108           HA       VAL 108 -14.412  -5.590  -5.036
  890    HB   VAL 108           HB       VAL 108 -12.717  -6.673  -3.542
  891   1HG1  VAL 108          1HG1      VAL 108 -12.164  -8.466  -5.120
  892   2HG1  VAL 108          2HG1      VAL 108 -12.600  -7.413  -6.465
  893   3HG1  VAL 108          3HG1      VAL 108 -13.831  -7.924  -5.311
  894   1HG2  VAL 108          1HG2      VAL 108 -10.821  -5.220  -4.005
  895   2HG2  VAL 108          2HG2      VAL 108 -10.790  -5.768  -5.680
  896   3HG2  VAL 108          3HG2      VAL 108 -10.417  -6.896  -4.375
  897    H    VAL 109           H        VAL 109 -15.247  -4.321  -3.538
  898    HA   VAL 109           HA       VAL 109 -13.504  -2.665  -1.878
  899    HB   VAL 109           HB       VAL 109 -14.995  -0.699  -2.136
  900   1HG1  VAL 109          1HG1      VAL 109 -14.144   0.010  -4.321
  901   2HG1  VAL 109          2HG1      VAL 109 -13.719  -1.659  -4.696
  902   3HG1  VAL 109          3HG1      VAL 109 -12.902  -0.817  -3.380
  903   1HG2  VAL 109          1HG2      VAL 109 -16.522  -0.593  -4.051
  904   2HG2  VAL 109          2HG2      VAL 109 -17.000  -1.845  -2.903
  905   3HG2  VAL 109          3HG2      VAL 109 -16.188  -2.289  -4.406
  906    H    VAL 110           H        VAL 110 -15.461  -1.248  -0.526
  907    HA   VAL 110           HA       VAL 110 -16.366  -2.974   1.425
  908    HB   VAL 110           HB       VAL 110 -17.679  -0.380   0.603
  909   1HG1  VAL 110          1HG2      VAL 110 -18.447  -0.291   2.933
  910   2HG1  VAL 110          2HG2      VAL 110 -17.751  -1.888   3.216
  911   3HG1  VAL 110          3HG2      VAL 110 -19.090  -1.697   2.084
  912   1HG2  VAL 110          1HG1      VAL 110 -16.253   0.645   2.314
  913   2HG2  VAL 110          2HG1      VAL 110 -15.302  -0.085   1.023
  914   3HG2  VAL 110          3HG1      VAL 110 -15.459  -0.907   2.576
  915    H    ASN 111           H        ASN 111 -18.596  -1.361  -0.838
  916    HA   ASN 111           HA       ASN 111 -20.538  -2.022  -1.810
  917   1HB   ASN 111          1HB       ASN 111 -19.250  -4.744  -1.543
  918   2HB   ASN 111          2HB       ASN 111 -20.744  -4.447  -2.426
  919   1HD2  ASN 111          2HD2      ASN 111 -18.127  -5.420  -3.334
  920   2HD2  ASN 111          1HD2      ASN 111 -17.645  -4.345  -4.598
  921    H    GLN 112           H        GLN 112 -20.218  -4.977   0.102
  922    HA   GLN 112           HA       GLN 112 -22.878  -4.872   0.997
  923   1HB   GLN 112          1HB       GLN 112 -21.586  -6.958   0.824
  924   2HB   GLN 112          2HB       GLN 112 -20.555  -6.430   2.146
  925   1HG   GLN 112          1HG       GLN 112 -22.483  -6.440   3.650
  926   2HG   GLN 112          2HG       GLN 112 -23.509  -6.984   2.323
  927   1HE2  GLN 112          2HE2      GLN 112 -22.916  -8.259   4.880
  928   2HE2  GLN 112          1HE2      GLN 112 -22.261  -9.812   4.499
  929    H    GLN 113           H        GLN 113 -23.785  -3.683   2.527
  930    HA   GLN 113           HA       GLN 113 -22.201  -2.944   4.886
  931   1HB   GLN 113          1HB       GLN 113 -23.981  -1.060   3.325
  932   2HB   GLN 113          2HB       GLN 113 -23.219  -0.691   4.867
  933   1HG   GLN 113          1HG       GLN 113 -21.018  -0.938   3.842
  934   2HG   GLN 113          2HG       GLN 113 -21.780  -1.313   2.296
  935   1HE2  GLN 113          2HE2      GLN 113 -23.038   1.066   4.515
  936   2HE2  GLN 113          1HE2      GLN 113 -22.676   2.449   3.546
  937    H    GLU 114           H        GLU 114 -25.489  -2.115   3.827
  938    HA   GLU 114           HA       GLU 114 -27.518  -2.394   4.819
  939   1HB   GLU 114          1HB       GLU 114 -26.239  -5.053   5.465
  940   2HB   GLU 114          2HB       GLU 114 -27.936  -4.697   5.759
  941   1HG   GLU 114          1HG       GLU 114 -27.726  -5.906   3.705
  942   2HG   GLU 114          2HG       GLU 114 -28.228  -4.253   3.352
  943    H    SER 115           H        SER 115 -27.086  -0.703   6.345
  944    HA   SER 115           HA       SER 115 -27.001   0.223   8.421
  945   1HB   SER 115          2HB       SER 115 -27.939  -2.531   9.258
  946   2HB   SER 115          1HB       SER 115 -28.008  -1.082  10.259
  947    HG   SER 115           HG       SER 115 -29.925  -1.814   8.858
  948    H    SER 116           H        SER 116 -24.612  -1.069   7.358
  949    HA   SER 116           HA       SER 116 -22.479  -1.522   7.977
  950   1HB   SER 116          1HB       SER 116 -22.696   0.482   9.360
  951   2HB   SER 116          2HB       SER 116 -23.403  -0.473  10.663
  952    HG   SER 116           HG       SER 116 -20.806  -0.880   9.595
  953    H    ASP 117           H        ASP 117 -23.740  -2.200  11.200
  954    HA   ASP 117           HA       ASP 117 -23.598  -4.058  12.504
  955   1HB   ASP 117          2HB       ASP 117 -24.353  -5.384   9.891
  956   2HB   ASP 117          1HB       ASP 117 -24.410  -6.170  11.467
  957    H    SER 118           H        SER 118 -21.156  -3.292  12.075
  958    HA   SER 118           HA       SER 118 -19.464  -5.030  10.628
  959   1HB   SER 118          2HB       SER 118 -18.765  -2.770  11.269
  960   2HB   SER 118          1HB       SER 118 -18.816  -3.224  12.972
  961    HG   SER 118           HG       SER 118 -17.064  -4.177  10.964
  962    H    SER 119           H        SER 119 -19.755  -7.166  11.096
  963    HA   SER 119           HA       SER 119 -18.682  -8.064  13.650
  964   1HB   SER 119          2HB       SER 119 -20.555  -9.671  13.978
  965   2HB   SER 119          1HB       SER 119 -21.066  -7.988  14.108
  966    HG   SER 119           HG       SER 119 -21.281  -8.745  11.565
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1 -25.578  34.524  -2.548
    2   2H    MET   1          2H        MET   1 -23.979  34.507  -3.101
    3   3H    MET   1          3H        MET   1 -24.346  33.927  -1.556
    4    HA   MET   1           HA       MET   1 -23.944  32.114  -3.084
    5   1HB   MET   1          2HB       MET   1 -26.838  32.382  -2.247
    6   2HB   MET   1          1HB       MET   1 -26.036  30.875  -2.669
    7   1HG   MET   1          2HG       MET   1 -24.518  31.150  -0.779
    8   2HG   MET   1          1HG       MET   1 -25.318  32.662  -0.356
    9   1HE   MET   1          1HE       MET   1 -26.467  30.244   2.506
   10   2HE   MET   1          2HE       MET   1 -25.711  31.791   2.125
   11   3HE   MET   1          3HE       MET   1 -24.892  30.285   1.711
   12    H    CYS   2           H        CYS   2 -23.514  32.587  -5.221
   13    HA   CYS   2           HA       CYS   2 -25.787  33.157  -6.980
   14   1HB   CYS   2          2HB       CYS   2 -23.830  34.617  -7.203
   15   2HB   CYS   2          1HB       CYS   2 -22.814  33.219  -7.537
   16    HG   CYS   2           HG       CYS   2 -24.057  35.090  -9.717
   17    H    ASN   3           H        ASN   3 -26.640  31.651  -8.260
   18    HA   ASN   3           HA       ASN   3 -25.381  29.015  -8.316
   19   1HB   ASN   3          2HB       ASN   3 -27.645  28.363  -9.340
   20   2HB   ASN   3          1HB       ASN   3 -27.625  28.836  -7.646
   21   1HD2  ASN   3          2HD2      ASN   3 -27.330  31.123 -10.272
   22   2HD2  ASN   3          1HD2      ASN   3 -28.869  31.874 -10.044
   23    H    THR   4           H        THR   4 -24.775  31.517 -10.032
   24    HA   THR   4           HA       THR   4 -25.110  30.283 -12.678
   25    HB   THR   4           HB       THR   4 -24.318  33.126 -12.011
   26    HG1  THR   4           1HG      THR   4 -26.598  33.207 -13.169
   27   1HG2  THR   4          1HG2      THR   4 -23.453  32.368 -14.173
   28   2HG2  THR   4          2HG2      THR   4 -24.739  33.556 -14.389
   29   3HG2  THR   4          3HG2      THR   4 -25.068  31.842 -14.642
   30    H    ASN   5           H        ASN   5 -23.381  29.760 -13.940
   31    HA   ASN   5           HA       ASN   5 -20.757  29.864 -12.626
   32   1HB   ASN   5          2HB       ASN   5 -20.128  28.041 -14.171
   33   2HB   ASN   5          1HB       ASN   5 -21.534  27.625 -13.195
   34   1HD2  ASN   5          2HD2      ASN   5 -20.375  28.415 -16.368
   35   2HD2  ASN   5          1HD2      ASN   5 -21.792  27.933 -17.229
   36    H    MET   6           H        MET   6 -21.931  32.123 -14.062
   37    HA   MET   6           HA       MET   6 -20.415  32.294 -16.535
   38   1HB   MET   6          2HB       MET   6 -22.699  33.200 -16.450
   39   2HB   MET   6          1HB       MET   6 -22.211  34.320 -15.186
   40   1HG   MET   6          2HG       MET   6 -22.328  35.436 -17.329
   41   2HG   MET   6          1HG       MET   6 -20.669  35.403 -16.733
   42   1HE   MET   6          1HE       MET   6 -19.799  36.056 -19.165
   43   2HE   MET   6          2HE       MET   6 -21.460  36.078 -19.756
   44   3HE   MET   6          3HE       MET   6 -20.228  35.164 -20.625
   45    H    SER   7           H        SER   7 -20.722  34.395 -13.665
   46    HA   SER   7           HA       SER   7 -17.922  35.204 -14.079
   47   1HB   SER   7          2HB       SER   7 -20.159  36.679 -12.667
   48   2HB   SER   7          1HB       SER   7 -18.501  37.258 -12.831
   49    HG   SER   7           HG       SER   7 -19.797  38.153 -14.448
   50    H    VAL   8           H        VAL   8 -18.937  32.824 -12.620
   51    HA   VAL   8           HA       VAL   8 -17.786  33.448  -9.979
   52    HB   VAL   8           HB       VAL   8 -19.911  31.376 -10.539
   53   1HG1  VAL   8          1HG1      VAL   8 -18.437  30.782  -8.691
   54   2HG1  VAL   8          2HG1      VAL   8 -20.047  31.196  -8.102
   55   3HG1  VAL   8          3HG1      VAL   8 -18.725  32.352  -7.943
   56   1HG2  VAL   8          1HG2      VAL   8 -20.827  33.614 -10.777
   57   2HG2  VAL   8          2HG2      VAL   8 -20.148  34.077  -9.216
   58   3HG2  VAL   8          3HG2      VAL   8 -21.423  32.860  -9.297
   59    HA   PRO   9           HA       PRO   9 -14.783  30.412 -11.255
   60   1HB   PRO   9          2HB       PRO   9 -13.426  30.250  -8.912
   61   2HB   PRO   9          1HB       PRO   9 -13.258  31.614 -10.023
   62   1HG   PRO   9          2HG       PRO   9 -14.908  31.387  -7.533
   63   2HG   PRO   9          1HG       PRO   9 -13.896  32.736  -8.086
   64   1HD   PRO   9          1HD       PRO   9 -16.588  32.715  -8.384
   65   2HD   PRO   9          2HD       PRO   9 -15.504  33.507  -9.546
   66    H    THR  10           H        THR  10 -14.573  28.224 -11.140
   67    HA   THR  10           HA       THR  10 -16.327  26.838  -9.230
   68    HB   THR  10           HB       THR  10 -16.282  24.939 -10.795
   69    HG1  THR  10           1HG      THR  10 -15.388  25.726 -13.000
   70   1HG2  THR  10          1HG2      THR  10 -18.045  26.620 -11.024
   71   2HG2  THR  10          2HG2      THR  10 -17.593  25.963 -12.597
   72   3HG2  THR  10          3HG2      THR  10 -17.018  27.558 -12.109
   73    H    ASP  11           H        ASP  11 -13.229  27.684  -9.401
   74    HA   ASP  11           HA       ASP  11 -12.087  25.096  -8.672
   75   1HB   ASP  11          2HB       ASP  11 -10.763  27.783  -9.098
   76   2HB   ASP  11          1HB       ASP  11  -9.916  26.278  -8.751
   77    H    GLY  12           H        GLY  12 -11.398  24.576  -6.659
   78   1HA   GLY  12          2HA       GLY  12 -11.145  26.597  -4.599
   79   2HA   GLY  12          1HA       GLY  12 -12.503  25.504  -4.386
   80    H    ALA  13           H        ALA  13 -10.141  23.820  -5.959
   81    HA   ALA  13           HA       ALA  13  -8.706  23.037  -3.533
   82   1HB   ALA  13          1HB       ALA  13 -10.641  21.544  -3.662
   83   2HB   ALA  13          2HB       ALA  13  -9.130  20.668  -3.908
   84   3HB   ALA  13          3HB       ALA  13 -10.157  21.059  -5.288
   85    H    VAL  14           H        VAL  14  -6.642  22.324  -3.886
   86    HA   VAL  14           HA       VAL  14  -5.740  22.289  -6.693
   87    HB   VAL  14           HB       VAL  14  -4.149  23.186  -4.285
   88   1HG1  VAL  14          1HG1      VAL  14  -2.761  22.202  -6.026
   89   2HG1  VAL  14          2HG1      VAL  14  -2.508  23.945  -5.940
   90   3HG1  VAL  14          3HG1      VAL  14  -3.497  23.260  -7.231
   91   1HG2  VAL  14          1HG2      VAL  14  -4.344  25.439  -5.235
   92   2HG2  VAL  14          2HG2      VAL  14  -5.919  24.773  -4.804
   93   3HG2  VAL  14          3HG2      VAL  14  -5.409  24.811  -6.493
   94    H    THR  15           H        THR  15  -5.179  20.986  -3.445
   95    HA   THR  15           HA       THR  15  -4.279  18.483  -4.641
   96    HB   THR  15           HB       THR  15  -2.626  19.926  -2.558
   97    HG1  THR  15           1HG      THR  15  -2.119  19.390  -5.315
   98   1HG2  THR  15          1HG2      THR  15  -1.034  18.085  -2.887
   99   2HG2  THR  15          2HG2      THR  15  -2.167  17.305  -3.990
  100   3HG2  THR  15          3HG2      THR  15  -2.584  17.497  -2.287
  101    H    THR  16           H        THR  16  -6.092  17.460  -3.850
  102    HA   THR  16           HA       THR  16  -6.077  16.998  -0.952
  103    HB   THR  16           HB       THR  16  -8.543  16.995  -0.893
  104    HG1  THR  16           1HG      THR  16  -9.688  17.782  -2.680
  105   1HG2  THR  16          1HG2      THR  16  -7.346  19.018  -0.229
  106   2HG2  THR  16          2HG2      THR  16  -8.870  19.426  -1.019
  107   3HG2  THR  16          3HG2      THR  16  -7.350  19.581  -1.901
  108    H    SER  17           H        SER  17  -5.401  15.604  -3.640
  109    HA   SER  17           HA       SER  17  -6.494  13.017  -2.853
  110   1HB   SER  17          2HB       SER  17  -7.170  12.480  -5.166
  111   2HB   SER  17          1HB       SER  17  -8.086  13.843  -4.524
  112    HG   SER  17           HG       SER  17  -7.370  14.952  -6.141
  113    H    GLN  18           H        GLN  18  -5.578  11.420  -4.816
  114    HA   GLN  18           HA       GLN  18  -2.890  12.032  -5.605
  115   1HB   GLN  18          2HB       GLN  18  -2.554  11.463  -3.202
  116   2HB   GLN  18          1HB       GLN  18  -3.337   9.912  -3.512
  117   1HG   GLN  18          2HG       GLN  18  -1.592   9.335  -5.110
  118   2HG   GLN  18          1HG       GLN  18  -0.768  10.856  -4.745
  119   1HE2  GLN  18          1HE2      GLN  18   0.248  11.121  -2.758
  120   2HE2  GLN  18          2HE2      GLN  18   0.612   9.785  -1.725
  121    H    ILE  19           H        ILE  19  -4.124   8.946  -4.511
  122    HA   ILE  19           HA       ILE  19  -3.875   8.063  -7.260
  123    HB   ILE  19           HB       ILE  19  -1.977   7.338  -5.913
  124   1HG1  ILE  19          1HG1      ILE  19  -3.084   5.857  -7.740
  125   2HG1  ILE  19          2HG1      ILE  19  -1.871   5.142  -6.686
  126   1HG2  ILE  19          1HG2      ILE  19  -3.963   5.804  -4.268
  127   2HG2  ILE  19          2HG2      ILE  19  -3.172   7.298  -3.765
  128   3HG2  ILE  19          3HG2      ILE  19  -2.210   5.846  -4.054
  129   1HD1  ILE  19          1HD1      ILE  19  -3.634   4.136  -5.335
  130   2HD1  ILE  19          2HD1      ILE  19  -3.741   3.639  -7.025
  131   3HD1  ILE  19          3HD1      ILE  19  -4.851   4.854  -6.390
  132    HA   PRO  20           HA       PRO  20  -8.013   7.280  -7.148
  133   1HB   PRO  20          1HB       PRO  20  -7.668   5.004  -9.007
  134   2HB   PRO  20          2HB       PRO  20  -8.505   6.540  -9.251
  135   1HG   PRO  20          2HG       PRO  20  -6.162   6.053 -10.435
  136   2HG   PRO  20          1HG       PRO  20  -6.555   7.666  -9.809
  137   1HD   PRO  20          2HD       PRO  20  -4.826   5.533  -8.598
  138   2HD   PRO  20          1HD       PRO  20  -4.548   7.283  -8.684
  139    H    ALA  21           H        ALA  21  -9.712   6.027  -6.400
  140    HA   ALA  21           HA       ALA  21  -9.487   3.280  -5.708
  141   1HB   ALA  21          1HB       ALA  21  -8.014   4.178  -3.972
  142   2HB   ALA  21          2HB       ALA  21  -9.484   3.495  -3.276
  143   3HB   ALA  21          3HB       ALA  21  -9.307   5.244  -3.424
  144    H    SER  22           H        SER  22 -11.290   3.198  -3.558
  145    HA   SER  22           HA       SER  22 -13.753   4.112  -4.789
  146   1HB   SER  22          1HB       SER  22 -13.278   2.633  -2.185
  147   2HB   SER  22          2HB       SER  22 -14.855   2.940  -2.912
  148    HG   SER  22           HG       SER  22 -13.863   0.828  -3.349
  149    H    GLU  23           H        GLU  23 -12.125   4.549  -1.655
  150    HA   GLU  23           HA       GLU  23 -12.591   7.380  -1.790
  151   1HB   GLU  23          2HB       GLU  23 -14.712   6.488  -0.791
  152   2HB   GLU  23          1HB       GLU  23 -13.760   5.855   0.544
  153   1HG   GLU  23          2HG       GLU  23 -14.813   7.946   1.153
  154   2HG   GLU  23          1HG       GLU  23 -13.060   8.119   1.125
  155    H    GLN  24           H        GLN  24 -10.212   6.375  -1.952
  156    HA   GLN  24           HA       GLN  24  -8.164   5.982  -1.051
  157   1HB   GLN  24          2HB       GLN  24  -9.319   8.017   0.836
  158   2HB   GLN  24          1HB       GLN  24  -7.661   7.452   0.977
  159   1HG   GLN  24          1HG       GLN  24  -7.198   8.247  -1.284
  160   2HG   GLN  24          2HG       GLN  24  -8.864   8.805  -1.428
  161   1HE2  GLN  24          2HE2      GLN  24  -5.770   9.359   0.048
  162   2HE2  GLN  24          1HE2      GLN  24  -6.099  10.956   0.620
  163    H    GLU  25           H        GLU  25 -10.134   4.055  -0.357
  164    HA   GLU  25           HA       GLU  25  -8.877   2.962   2.016
  165   1HB   GLU  25          1HB       GLU  25 -10.782   2.742   3.347
  166   2HB   GLU  25          2HB       GLU  25 -10.917   4.373   2.705
  167   1HG   GLU  25          2HG       GLU  25 -12.376   3.338   0.881
  168   2HG   GLU  25          1HG       GLU  25 -12.449   1.920   1.930
  169    H    THR  26           H        THR  26 -11.371   2.564  -0.472
  170    HA   THR  26           HA       THR  26 -11.843   0.825  -1.858
  171    HB   THR  26           HB       THR  26  -9.281  -0.190  -0.705
  172    HG1  THR  26           1HG      THR  26  -9.048  -0.257  -3.193
  173   1HG2  THR  26          1HG2      THR  26 -10.754  -2.150  -0.882
  174   2HG2  THR  26          2HG2      THR  26  -9.435  -2.208  -2.053
  175   3HG2  THR  26          3HG2      THR  26 -11.058  -1.757  -2.577
  176    H    LEU  27           H        LEU  27 -11.302   0.125   1.515
  177    HA   LEU  27           HA       LEU  27 -11.857  -1.564   2.883
  178   1HB   LEU  27          1HB       LEU  27 -14.190  -1.374   1.105
  179   2HB   LEU  27          2HB       LEU  27 -13.980  -2.932   1.885
  180    HG   LEU  27           HG       LEU  27 -15.426  -1.544   3.244
  181   1HD1  LEU  27          1HD1      LEU  27 -12.694  -1.639   4.518
  182   2HD1  LEU  27          2HD1      LEU  27 -13.749  -3.046   4.344
  183   3HD1  LEU  27          3HD1      LEU  27 -14.257  -1.675   5.336
  184   1HD2  LEU  27          1HD2      LEU  27 -14.582   0.563   4.208
  185   2HD2  LEU  27          2HD2      LEU  27 -14.718   0.635   2.451
  186   3HD2  LEU  27          3HD2      LEU  27 -13.136   0.420   3.205
  187    H    VAL  28           H        VAL  28  -9.892  -2.417   2.223
  188    HA   VAL  28           HA       VAL  28  -9.716  -3.975  -0.171
  189    HB   VAL  28           HB       VAL  28  -7.671  -3.522   1.978
  190   1HG1  VAL  28          1HG2      VAL  28  -7.111  -5.408   0.589
  191   2HG1  VAL  28          2HG2      VAL  28  -6.061  -4.048   0.186
  192   3HG1  VAL  28          3HG2      VAL  28  -7.412  -4.463  -0.870
  193   1HG2  VAL  28          1HG1      VAL  28  -8.126  -2.053  -0.599
  194   2HG2  VAL  28          2HG1      VAL  28  -6.893  -1.695   0.614
  195   3HG2  VAL  28          3HG1      VAL  28  -8.605  -1.469   0.993
  196    H    ARG  29           H        ARG  29 -10.251  -6.008  -0.268
  197    HA   ARG  29           HA       ARG  29  -9.886  -7.634   2.104
  198   1HB   ARG  29          2HB       ARG  29 -12.493  -7.662   0.593
  199   2HB   ARG  29          1HB       ARG  29 -12.148  -8.366   2.166
  200   1HG   ARG  29          2HG       ARG  29 -11.972  -6.171   3.159
  201   2HG   ARG  29          1HG       ARG  29 -12.173  -5.404   1.581
  202   1HD   ARG  29          1HD       ARG  29 -14.211  -7.124   2.997
  203   2HD   ARG  29          2HD       ARG  29 -14.254  -5.366   2.860
  204    HE   ARG  29           HE       ARG  29 -14.115  -6.418   0.283
  205   1HH1  ARG  29          2HH1      ARG  29 -16.315  -6.380   2.985
  206   2HH1  ARG  29          1HH1      ARG  29 -17.732  -6.520   1.999
  207   1HH2  ARG  29          1HH2      ARG  29 -15.974  -6.602  -1.024
  208   2HH2  ARG  29          2HH2      ARG  29 -17.538  -6.647  -0.280
  209    HA   PRO  30           HA       PRO  30  -9.056  -9.769  -1.951
  210   1HB   PRO  30          2HB       PRO  30  -6.397  -9.699  -2.070
  211   2HB   PRO  30          1HB       PRO  30  -7.359  -8.258  -2.421
  212   1HG   PRO  30          2HG       PRO  30  -5.777  -8.941   0.008
  213   2HG   PRO  30          1HG       PRO  30  -6.064  -7.361  -0.739
  214   1HD   PRO  30          1HD       PRO  30  -7.429  -8.459   1.479
  215   2HD   PRO  30          2HD       PRO  30  -7.876  -6.999   0.575
  216    H    LYS  31           H        LYS  31  -7.583 -11.701  -2.479
  217    HA   LYS  31           HA       LYS  31  -7.768 -13.750  -0.549
  218   1HB   LYS  31          2HB       LYS  31  -6.176 -13.486  -3.099
  219   2HB   LYS  31          1HB       LYS  31  -6.128 -14.938  -2.109
  220   1HG   LYS  31          2HG       LYS  31  -7.687 -15.330  -3.843
  221   2HG   LYS  31          1HG       LYS  31  -8.619 -15.081  -2.365
  222   1HD   LYS  31          2HD       LYS  31  -9.041 -12.759  -3.026
  223   2HD   LYS  31          1HD       LYS  31  -8.121 -13.019  -4.511
  224   1HE   LYS  31          1HE       LYS  31  -9.718 -14.745  -5.194
  225   2HE   LYS  31          2HE       LYS  31 -10.638 -14.477  -3.714
  226   1HZ   LYS  31          1HZ       LYS  31 -11.629 -13.311  -5.570
  227   2HZ   LYS  31          2HZ       LYS  31 -10.186 -12.478  -5.863
  228   3HZ   LYS  31          3HZ       LYS  31 -11.046 -12.200  -4.434
  229    HA   PRO  32           HA       PRO  32  -4.252 -13.362   2.063
  230   1HB   PRO  32          1HB       PRO  32  -3.032 -15.837   1.831
  231   2HB   PRO  32          2HB       PRO  32  -4.402 -15.477   2.887
  232   1HG   PRO  32          1HG       PRO  32  -4.373 -16.737   0.176
  233   2HG   PRO  32          2HG       PRO  32  -5.358 -17.144   1.595
  234   1HD   PRO  32          1HD       PRO  32  -6.374 -15.753  -0.457
  235   2HD   PRO  32          2HD       PRO  32  -6.842 -15.399   1.219
  236    H    LEU  33           H        LEU  33  -3.269 -11.807   0.614
  237    HA   LEU  33           HA       LEU  33  -0.599 -12.426   0.007
  238   1HB   LEU  33          1HB       LEU  33  -0.748 -11.995  -2.486
  239   2HB   LEU  33          2HB       LEU  33  -1.282 -13.567  -1.929
  240    HG   LEU  33           HG       LEU  33  -3.656 -12.531  -1.967
  241   1HD1  LEU  33          1HD1      LEU  33  -3.006 -10.220  -2.259
  242   2HD1  LEU  33          2HD1      LEU  33  -3.930 -10.768  -3.657
  243   3HD1  LEU  33          3HD1      LEU  33  -2.175 -10.618  -3.763
  244   1HD2  LEU  33          1HD2      LEU  33  -2.164 -13.077  -4.529
  245   2HD2  LEU  33          2HD2      LEU  33  -3.915 -13.131  -4.317
  246   3HD2  LEU  33          3HD2      LEU  33  -2.887 -14.290  -3.473
  247    H    LEU  34           H        LEU  34  -2.907 -10.405   0.835
  248    HA   LEU  34           HA       LEU  34  -1.101  -8.134   0.403
  249   1HB   LEU  34          1HB       LEU  34  -3.990  -8.309  -0.076
  250   2HB   LEU  34          2HB       LEU  34  -3.541  -6.981   0.977
  251    HG   LEU  34           HG       LEU  34  -3.681  -6.248  -1.341
  252   1HD1  LEU  34          1HD1      LEU  34  -0.885  -6.332  -0.217
  253   2HD1  LEU  34          2HD1      LEU  34  -2.107  -5.085   0.043
  254   3HD1  LEU  34          3HD1      LEU  34  -1.392  -5.299  -1.554
  255   1HD2  LEU  34          1HD2      LEU  34  -1.946  -7.098  -2.949
  256   2HD2  LEU  34          2HD2      LEU  34  -3.231  -8.237  -2.545
  257   3HD2  LEU  34          3HD2      LEU  34  -1.640  -8.407  -1.804
  258    H    LEU  35           H        LEU  35  -2.248 -10.375   2.409
  259    HA   LEU  35           HA       LEU  35  -2.177  -8.637   4.763
  260   1HB   LEU  35          1HB       LEU  35  -4.002 -10.976   4.797
  261   2HB   LEU  35          2HB       LEU  35  -4.151  -9.428   5.607
  262    HG   LEU  35           HG       LEU  35  -4.536  -8.523   3.170
  263   1HD1  LEU  35          1HD2      LEU  35  -5.674 -10.129   1.739
  264   2HD1  LEU  35          2HD2      LEU  35  -5.372 -11.409   2.913
  265   3HD1  LEU  35          3HD2      LEU  35  -4.020 -10.651   2.068
  266   1HD2  LEU  35          1HD1      LEU  35  -6.789  -8.461   3.630
  267   2HD2  LEU  35          2HD1      LEU  35  -6.110  -8.777   5.230
  268   3HD2  LEU  35          3HD1      LEU  35  -6.809 -10.098   4.290
  269    H    LYS  36           H        LYS  36  -1.693 -11.840   3.367
  270    HA   LYS  36           HA       LYS  36  -0.029 -12.860   5.410
  271   1HB   LYS  36          1HB       LYS  36   0.029 -13.122   2.404
  272   2HB   LYS  36          2HB       LYS  36   1.187 -13.934   3.444
  273   1HG   LYS  36          1HG       LYS  36  -1.800 -14.289   3.584
  274   2HG   LYS  36          2HG       LYS  36  -0.683 -15.383   2.764
  275   1HD   LYS  36          2HD       LYS  36   0.456 -15.812   4.889
  276   2HD   LYS  36          1HD       LYS  36  -0.663 -14.722   5.708
  277   1HE   LYS  36          2HE       LYS  36  -1.314 -17.054   6.018
  278   2HE   LYS  36          1HE       LYS  36  -2.532 -16.166   5.101
  279   1HZ   LYS  36          1HZ       LYS  36  -2.104 -18.340   4.140
  280   2HZ   LYS  36          2HZ       LYS  36  -0.469 -17.959   3.940
  281   3HZ   LYS  36          3HZ       LYS  36  -1.646 -17.114   3.067
  282    H    LEU  37           H        LEU  37   0.096 -10.050   3.635
  283    HA   LEU  37           HA       LEU  37   2.986  -9.731   3.828
  284   1HB   LEU  37          2HB       LEU  37   1.771  -9.191   1.716
  285   2HB   LEU  37          1HB       LEU  37   0.864  -7.967   2.581
  286    HG   LEU  37           HG       LEU  37   2.728  -7.096   1.170
  287   1HD1  LEU  37          1HD1      LEU  37   1.879  -6.384   3.724
  288   2HD1  LEU  37          2HD1      LEU  37   2.664  -5.350   2.520
  289   3HD1  LEU  37          3HD1      LEU  37   3.637  -6.190   3.731
  290   1HD2  LEU  37          1HD2      LEU  37   4.452  -8.421   3.255
  291   2HD2  LEU  37          2HD2      LEU  37   5.009  -7.281   2.029
  292   3HD2  LEU  37          3HD2      LEU  37   4.362  -8.849   1.546
  293    H    LEU  38           H        LEU  38  -0.040  -8.692   5.219
  294    HA   LEU  38           HA       LEU  38   1.285  -6.487   6.631
  295   1HB   LEU  38          1HB       LEU  38  -1.637  -7.052   6.169
  296   2HB   LEU  38          2HB       LEU  38  -1.018  -5.679   7.064
  297    HG   LEU  38           HG       LEU  38  -0.693  -6.243   4.119
  298   1HD1  LEU  38          1HD2      LEU  38  -2.846  -5.270   4.933
  299   2HD1  LEU  38          2HD2      LEU  38  -1.954  -4.252   3.798
  300   3HD1  LEU  38          3HD2      LEU  38  -1.922  -3.884   5.525
  301   1HD2  LEU  38          1HD1      LEU  38   0.527  -4.038   5.765
  302   2HD2  LEU  38          2HD1      LEU  38   0.577  -4.166   4.007
  303   3HD2  LEU  38          3HD1      LEU  38   1.392  -5.372   5.002
  304    H    LYS  39           H        LYS  39  -0.994  -9.159   7.256
  305    HA   LYS  39           HA       LYS  39  -1.042  -9.061  10.025
  306   1HB   LYS  39          2HB       LYS  39  -1.009 -11.501   8.240
  307   2HB   LYS  39          1HB       LYS  39  -1.446 -11.510   9.942
  308   1HG   LYS  39          2HG       LYS  39  -3.317  -9.994   9.452
  309   2HG   LYS  39          1HG       LYS  39  -2.894 -10.052   7.739
  310   1HD   LYS  39          1HD       LYS  39  -3.638 -12.450   9.412
  311   2HD   LYS  39          2HD       LYS  39  -4.743 -11.588   8.341
  312   1HE   LYS  39          2HE       LYS  39  -3.305 -12.116   6.432
  313   2HE   LYS  39          1HE       LYS  39  -2.200 -12.978   7.503
  314   1HZ   LYS  39          1HZ       LYS  39  -5.040 -13.701   7.014
  315   2HZ   LYS  39          2HZ       LYS  39  -3.970 -14.532   8.026
  316   3HZ   LYS  39          3HZ       LYS  39  -3.695 -14.492   6.358
  317    H    SER  40           H        SER  40   1.579  -9.715   7.942
  318    HA   SER  40           HA       SER  40   3.226 -11.141   9.787
  319   1HB   SER  40          1HB       SER  40   3.981  -9.459   7.384
  320   2HB   SER  40          2HB       SER  40   5.073 -10.537   8.255
  321    HG   SER  40           HG       SER  40   2.690 -11.654   7.382
  322    H    VAL  41           H        VAL  41   3.013  -7.715   8.831
  323    HA   VAL  41           HA       VAL  41   5.003  -6.716  10.523
  324    HB   VAL  41           HB       VAL  41   2.711  -4.920  10.346
  325   1HG1  VAL  41          1HG2      VAL  41   4.311  -3.371   9.604
  326   2HG1  VAL  41          2HG2      VAL  41   5.405  -4.640   9.049
  327   3HG1  VAL  41          3HG2      VAL  41   5.151  -4.387  10.778
  328   1HG2  VAL  41          1HG1      VAL  41   2.029  -5.954   8.379
  329   2HG2  VAL  41          2HG1      VAL  41   3.686  -6.269   7.857
  330   3HG2  VAL  41          3HG1      VAL  41   3.051  -4.624   7.823
  331    H    GLY  42           H        GLY  42   1.596  -6.006  11.140
  332   1HA   GLY  42          2HA       GLY  42   1.638  -7.359  13.684
  333   2HA   GLY  42          1HA       GLY  42   1.587  -5.607  13.813
  334    H    ALA  43           H        ALA  43   0.092  -6.707  11.012
  335    HA   ALA  43           HA       ALA  43  -2.531  -6.037  11.982
  336   1HB   ALA  43          1HB       ALA  43  -1.953  -5.473   9.714
  337   2HB   ALA  43          2HB       ALA  43  -3.266  -6.653   9.690
  338   3HB   ALA  43          3HB       ALA  43  -1.614  -7.161   9.337
  339    H    GLN  44           H        GLN  44  -4.407  -7.514  11.644
  340    HA   GLN  44           HA       GLN  44  -4.083 -10.309  11.431
  341   1HB   GLN  44          2HB       GLN  44  -3.074  -9.938  13.698
  342   2HB   GLN  44          1HB       GLN  44  -4.639  -9.348  14.243
  343   1HG   GLN  44          2HG       GLN  44  -5.637 -11.516  13.741
  344   2HG   GLN  44          1HG       GLN  44  -4.073 -12.109  13.183
  345   1HE2  GLN  44          2HE2      GLN  44  -5.781 -13.078  15.339
  346   2HE2  GLN  44          1HE2      GLN  44  -4.818 -13.026  16.772
  347    H    LYS  45           H        LYS  45  -5.765  -9.076   9.997
  348    HA   LYS  45           HA       LYS  45  -8.381  -9.698  11.148
  349   1HB   LYS  45          2HB       LYS  45  -7.783  -7.124   9.677
  350   2HB   LYS  45          1HB       LYS  45  -9.369  -7.650  10.224
  351   1HG   LYS  45          2HG       LYS  45  -8.700  -7.474  12.522
  352   2HG   LYS  45          1HG       LYS  45  -7.038  -7.120  12.050
  353   1HD   LYS  45          1HD       LYS  45  -9.396  -5.399  11.303
  354   2HD   LYS  45          2HD       LYS  45  -8.386  -5.120  12.725
  355   1HE   LYS  45          2HE       LYS  45  -7.453  -5.143   9.856
  356   2HE   LYS  45          1HE       LYS  45  -7.684  -3.712  10.861
  357   1HZ   LYS  45          1HZ       LYS  45  -5.955  -4.505  12.340
  358   2HZ   LYS  45          2HZ       LYS  45  -5.359  -4.379  10.762
  359   3HZ   LYS  45          3HZ       LYS  45  -5.744  -5.896  11.400
  360    H    ASP  46           H        ASP  46 -10.086  -9.349   9.245
  361    HA   ASP  46           HA       ASP  46  -9.050 -10.939   7.014
  362   1HB   ASP  46          2HB       ASP  46 -11.895 -10.410   7.897
  363   2HB   ASP  46          1HB       ASP  46 -11.431 -11.439   6.546
  364    H    THR  47           H        THR  47 -10.068  -7.783   7.782
  365    HA   THR  47           HA       THR  47 -10.033  -7.094   4.920
  366    HB   THR  47           HB       THR  47 -11.668  -5.277   5.373
  367    HG1  THR  47           1HG      THR  47 -11.640  -6.484   7.930
  368   1HG2  THR  47          1HG2      THR  47 -13.627  -6.633   5.322
  369   2HG2  THR  47          2HG2      THR  47 -12.797  -7.967   6.129
  370   3HG2  THR  47          3HG2      THR  47 -12.355  -7.518   4.481
  371    H    TYR  48           H        TYR  48  -9.361  -4.940   4.438
  372    HA   TYR  48           HA       TYR  48  -8.119  -3.471   6.656
  373   1HB   TYR  48          2HB       TYR  48  -6.911  -4.100   3.969
  374   2HB   TYR  48          1HB       TYR  48  -6.330  -2.789   4.989
  375    HD1  TYR  48           1HD      TYR  48  -4.836  -3.191   6.716
  376    HD2  TYR  48           2HD      TYR  48  -6.871  -6.453   4.908
  377    HE1  TYR  48           1HE      TYR  48  -3.367  -4.769   7.922
  378    HE2  TYR  48           2HE      TYR  48  -5.410  -8.032   6.099
  379    HH   TYR  48           HH       TYR  48  -3.200  -8.070   7.122
  380    H    THR  49           H        THR  49  -7.316  -1.248   5.550
  381    HA   THR  49           HA       THR  49  -9.004  -0.516   3.293
  382    HB   THR  49           HB       THR  49  -9.710   1.600   4.130
  383    HG1  THR  49           1HG      THR  49  -7.948   1.010   6.265
  384   1HG2  THR  49          1HG2      THR  49 -11.129  -0.266   4.817
  385   2HG2  THR  49          2HG2      THR  49 -11.119   0.997   6.049
  386   3HG2  THR  49          3HG2      THR  49 -10.169  -0.471   6.281
  387    H    MET  50           H        MET  50  -8.206   1.570   2.294
  388    HA   MET  50           HA       MET  50  -5.555   0.923   1.600
  389   1HB   MET  50          1HB       MET  50  -7.491   3.039   0.757
  390   2HB   MET  50          2HB       MET  50  -5.821   3.111   0.202
  391   1HG   MET  50          1HG       MET  50  -6.124   0.753  -0.633
  392   2HG   MET  50          2HG       MET  50  -7.844   0.948  -0.296
  393   1HE   MET  50          1HE       MET  50  -5.338   3.691  -1.594
  394   2HE   MET  50          2HE       MET  50  -5.523   3.526  -3.340
  395   3HE   MET  50          3HE       MET  50  -4.789   2.225  -2.404
  396    H    LYS  51           H        LYS  51  -6.686   2.874   4.091
  397    HA   LYS  51           HA       LYS  51  -4.346   4.616   4.111
  398   1HB   LYS  51          1HB       LYS  51  -6.507   5.554   4.806
  399   2HB   LYS  51          2HB       LYS  51  -6.629   4.349   6.081
  400   1HG   LYS  51          1HG       LYS  51  -4.638   5.288   7.153
  401   2HG   LYS  51          2HG       LYS  51  -4.535   6.506   5.880
  402   1HD   LYS  51          1HD       LYS  51  -6.893   6.148   7.728
  403   2HD   LYS  51          2HD       LYS  51  -5.610   7.337   7.956
  404   1HE   LYS  51          2HE       LYS  51  -6.175   8.357   5.806
  405   2HE   LYS  51          1HE       LYS  51  -7.456   7.168   5.576
  406   1HZ   LYS  51          1HZ       LYS  51  -8.558   8.030   7.547
  407   2HZ   LYS  51          2HZ       LYS  51  -8.329   9.258   6.408
  408   3HZ   LYS  51          3HZ       LYS  51  -7.327   9.169   7.767
  409    H    GLU  52           H        GLU  52  -5.822   2.074   6.077
  410    HA   GLU  52           HA       GLU  52  -3.715   1.479   7.784
  411   1HB   GLU  52          2HB       GLU  52  -6.125   0.417   7.397
  412   2HB   GLU  52          1HB       GLU  52  -5.187  -0.753   6.479
  413   1HG   GLU  52          1HG       GLU  52  -3.809  -1.201   8.443
  414   2HG   GLU  52          2HG       GLU  52  -4.755  -0.038   9.369
  415    H    VAL  53           H        VAL  53  -4.407  -0.069   4.651
  416    HA   VAL  53           HA       VAL  53  -2.016  -1.452   4.374
  417    HB   VAL  53           HB       VAL  53  -3.615  -0.263   2.104
  418   1HG1  VAL  53          1HG2      VAL  53  -1.829  -2.689   2.252
  419   2HG1  VAL  53          2HG2      VAL  53  -1.457  -1.171   1.435
  420   3HG1  VAL  53          3HG2      VAL  53  -2.770  -2.192   0.846
  421   1HG2  VAL  53          1HG1      VAL  53  -4.032  -2.838   3.615
  422   2HG2  VAL  53          2HG1      VAL  53  -4.841  -2.411   2.107
  423   3HG2  VAL  53          3HG1      VAL  53  -5.123  -1.453   3.560
  424    H    LEU  54           H        LEU  54  -2.775   1.909   3.700
  425    HA   LEU  54           HA       LEU  54  -0.635   2.667   2.133
  426   1HB   LEU  54          1HB       LEU  54  -2.564   4.093   2.962
  427   2HB   LEU  54          2HB       LEU  54  -1.664   4.294   4.451
  428    HG   LEU  54           HG       LEU  54  -0.449   5.040   1.807
  429   1HD1  LEU  54          1HD2      LEU  54  -2.581   6.204   1.924
  430   2HD1  LEU  54          2HD2      LEU  54  -1.241   7.326   2.155
  431   3HD1  LEU  54          3HD2      LEU  54  -2.188   6.787   3.542
  432   1HD2  LEU  54          1HD1      LEU  54  -0.002   6.006   4.627
  433   2HD2  LEU  54          2HD1      LEU  54   0.859   6.567   3.194
  434   3HD2  LEU  54          3HD1      LEU  54   1.038   4.897   3.733
  435    H    PHE  55           H        PHE  55  -0.690   3.055   5.691
  436    HA   PHE  55           HA       PHE  55   2.147   3.386   5.760
  437   1HB   PHE  55          2HB       PHE  55   1.927   3.771   8.069
  438   2HB   PHE  55          1HB       PHE  55   0.435   4.396   7.377
  439    HD1  PHE  55           1HD      PHE  55  -1.677   3.206   7.700
  440    HD2  PHE  55           2HD      PHE  55   1.926   1.874   9.528
  441    HE1  PHE  55           1HE      PHE  55  -2.982   1.806   9.247
  442    HE2  PHE  55           2HE      PHE  55   0.628   0.470  11.075
  443    HZ   PHE  55           HZ       PHE  55  -1.830   0.434  10.936
  444    H    TYR  56           H        TYR  56  -0.065   0.740   6.475
  445    HA   TYR  56           HA       TYR  56   1.710  -0.902   7.868
  446   1HB   TYR  56          1HB       TYR  56  -0.943  -1.122   6.820
  447   2HB   TYR  56          2HB       TYR  56  -0.047  -2.591   6.446
  448    HD1  TYR  56           1HD      TYR  56  -2.441  -2.165   8.389
  449    HD2  TYR  56           2HD      TYR  56   1.772  -2.386   8.952
  450    HE1  TYR  56           1HE      TYR  56  -2.797  -2.967  10.685
  451    HE2  TYR  56           2HE      TYR  56   1.432  -3.195  11.247
  452    HH   TYR  56           HH       TYR  56  -0.304  -3.119  12.988
  453    H    LEU  57           H        LEU  57   0.955  -0.821   4.399
  454    HA   LEU  57           HA       LEU  57   2.797  -2.851   3.688
  455   1HB   LEU  57          2HB       LEU  57   0.899  -1.395   2.349
  456   2HB   LEU  57          1HB       LEU  57   2.382  -0.705   1.722
  457    HG   LEU  57           HG       LEU  57   1.872  -2.384   0.194
  458   1HD1  LEU  57          1HD1      LEU  57   4.191  -2.545   0.941
  459   2HD1  LEU  57          2HD1      LEU  57   3.554  -4.124   0.484
  460   3HD1  LEU  57          3HD1      LEU  57   3.715  -3.699   2.186
  461   1HD2  LEU  57          1HD2      LEU  57   0.058  -3.412   1.444
  462   2HD2  LEU  57          2HD2      LEU  57   1.220  -4.197   2.511
  463   3HD2  LEU  57          3HD2      LEU  57   1.152  -4.637   0.805
  464    H    GLY  58           H        GLY  58   3.032   0.700   3.759
  465   1HA   GLY  58          2HA       GLY  58   5.677   1.068   3.085
  466   2HA   GLY  58          1HA       GLY  58   4.842   2.006   4.317
  467    H    GLN  59           H        GLN  59   4.356  -0.201   6.095
  468    HA   GLN  59           HA       GLN  59   6.748  -0.213   7.578
  469   1HB   GLN  59          1HB       GLN  59   4.423  -2.133   7.789
  470   2HB   GLN  59          2HB       GLN  59   5.659  -1.871   9.009
  471   1HG   GLN  59          2HG       GLN  59   3.512   0.026   8.119
  472   2HG   GLN  59          1HG       GLN  59   3.732  -0.706   9.708
  473   1HE2  GLN  59          1HE2      GLN  59   4.826   1.749   7.508
  474   2HE2  GLN  59          2HE2      GLN  59   5.762   2.643   8.651
  475    H    TYR  60           H        TYR  60   5.139  -2.992   5.990
  476    HA   TYR  60           HA       TYR  60   7.153  -4.805   6.574
  477   1HB   TYR  60          2HB       TYR  60   4.842  -5.353   5.756
  478   2HB   TYR  60          1HB       TYR  60   5.377  -4.926   4.134
  479    HD1  TYR  60           1HD      TYR  60   7.343  -6.247   3.153
  480    HD2  TYR  60           2HD      TYR  60   5.169  -7.503   6.582
  481    HE1  TYR  60           1HE      TYR  60   8.170  -8.538   2.833
  482    HE2  TYR  60           2HE      TYR  60   5.991  -9.794   6.276
  483    HH   TYR  60           HH       TYR  60   6.873 -11.211   4.488
  484    H    ILE  61           H        ILE  61   6.797  -2.692   3.772
  485    HA   ILE  61           HA       ILE  61   8.875  -3.703   2.193
  486    HB   ILE  61           HB       ILE  61   8.064  -0.803   2.414
  487   1HG1  ILE  61          1HG1      ILE  61   6.956  -2.835   0.481
  488   2HG1  ILE  61          2HG1      ILE  61   6.172  -2.458   2.012
  489   1HG2  ILE  61          1HG2      ILE  61   8.801  -0.699   0.060
  490   2HG2  ILE  61          2HG2      ILE  61   9.362  -2.366   0.188
  491   3HG2  ILE  61          3HG2      ILE  61  10.112  -1.106   1.171
  492   1HD1  ILE  61          1HD1      ILE  61   6.623  -0.649  -0.336
  493   2HD1  ILE  61          2HD1      ILE  61   6.159  -0.053   1.258
  494   3HD1  ILE  61          3HD1      ILE  61   5.093  -1.156   0.384
  495    H    MET  62           H        MET  62   9.035  -0.678   4.060
  496    HA   MET  62           HA       MET  62  11.814  -0.440   3.764
  497   1HB   MET  62          2HB       MET  62  11.680   1.420   5.280
  498   2HB   MET  62          1HB       MET  62  10.258   1.437   4.246
  499   1HG   MET  62          1HG       MET  62   8.940   0.436   6.043
  500   2HG   MET  62          2HG       MET  62  10.367   0.423   7.079
  501   1HE   MET  62          1HE       MET  62  11.562   2.613   7.986
  502   2HE   MET  62          2HE       MET  62  11.065   4.247   7.545
  503   3HE   MET  62          3HE       MET  62  11.752   3.173   6.325
  504    H    THR  63           H        THR  63  10.044  -2.405   5.916
  505    HA   THR  63           HA       THR  63  12.022  -2.234   8.048
  506    HB   THR  63           HB       THR  63   9.416  -3.764   7.927
  507    HG1  THR  63           1HG      THR  63   9.063  -2.014   9.660
  508   1HG2  THR  63          1HG2      THR  63  11.008  -4.838   9.441
  509   2HG2  THR  63          2HG2      THR  63   9.710  -4.058  10.347
  510   3HG2  THR  63          3HG2      THR  63  11.297  -3.294  10.245
  511    H    LYS  64           H        LYS  64  10.703  -4.668   5.820
  512    HA   LYS  64           HA       LYS  64  12.137  -6.799   7.084
  513   1HB   LYS  64          2HB       LYS  64  10.545  -6.690   4.522
  514   2HB   LYS  64          1HB       LYS  64  11.256  -8.162   5.169
  515   1HG   LYS  64          2HG       LYS  64   9.223  -6.455   6.590
  516   2HG   LYS  64          1HG       LYS  64   8.869  -7.939   5.701
  517   1HD   LYS  64          2HD       LYS  64  10.339  -9.187   7.221
  518   2HD   LYS  64          1HD       LYS  64  10.658  -7.702   8.119
  519   1HE   LYS  64          1HE       LYS  64   7.971  -9.029   7.777
  520   2HE   LYS  64          2HE       LYS  64   8.965  -9.061   9.233
  521   1HZ   LYS  64          1HZ       LYS  64   7.210  -7.403   9.378
  522   2HZ   LYS  64          2HZ       LYS  64   7.803  -6.622   8.000
  523   3HZ   LYS  64          3HZ       LYS  64   8.735  -6.670   9.412
  524    H    ARG  65           H        ARG  65  13.502  -4.451   5.617
  525    HA   ARG  65           HA       ARG  65  15.541  -4.151   4.666
  526   1HB   ARG  65          1HB       ARG  65  15.849  -7.107   5.214
  527   2HB   ARG  65          2HB       ARG  65  17.156  -6.009   4.793
  528   1HG   ARG  65          2HG       ARG  65  16.742  -4.737   6.842
  529   2HG   ARG  65          1HG       ARG  65  15.446  -5.857   7.268
  530   1HD   ARG  65          2HD       ARG  65  17.051  -7.698   7.327
  531   2HD   ARG  65          1HD       ARG  65  18.349  -6.586   6.891
  532    HE   ARG  65           HE       ARG  65  17.069  -5.642   9.206
  533   1HH1  ARG  65          2HH1      ARG  65  19.134  -8.244   8.150
  534   2HH1  ARG  65          1HH1      ARG  65  19.879  -8.453   9.699
  535   1HH2  ARG  65          1HH2      ARG  65  18.046  -5.910  11.249
  536   2HH2  ARG  65          2HH2      ARG  65  19.261  -7.127  11.461
  537    H    LEU  66           H        LEU  66  13.147  -5.213   3.071
  538    HA   LEU  66           HA       LEU  66  14.496  -6.240   0.714
  539   1HB   LEU  66          1HB       LEU  66  11.664  -5.519   1.373
  540   2HB   LEU  66          2HB       LEU  66  12.150  -5.691  -0.301
  541    HG   LEU  66           HG       LEU  66  11.175  -7.753   0.378
  542   1HD1  LEU  66          1HD1      LEU  66  12.993  -9.329   0.049
  543   2HD1  LEU  66          2HD1      LEU  66  14.171  -8.068   0.414
  544   3HD1  LEU  66          3HD1      LEU  66  13.164  -7.945  -1.029
  545   1HD2  LEU  66          1HD2      LEU  66  11.919  -9.039   2.287
  546   2HD2  LEU  66          2HD2      LEU  66  11.382  -7.437   2.798
  547   3HD2  LEU  66          3HD2      LEU  66  13.106  -7.797   2.687
  548    H    TYR  67           H        TYR  67  14.112  -3.265   2.172
  549    HA   TYR  67           HA       TYR  67  13.737  -1.687  -0.211
  550   1HB   TYR  67          2HB       TYR  67  13.827   0.231   1.243
  551   2HB   TYR  67          1HB       TYR  67  12.839  -1.006   2.012
  552    HD1  TYR  67           1HD      TYR  67  15.128   1.425   2.696
  553    HD2  TYR  67           2HD      TYR  67  14.451  -2.695   3.505
  554    HE1  TYR  67           1HE      TYR  67  16.503   1.604   4.723
  555    HE2  TYR  67           2HE      TYR  67  15.827  -2.528   5.537
  556    HH   TYR  67           HH       TYR  67  17.618  -1.101   6.435
  557    H    ASP  68           H        ASP  68  15.308   0.287  -0.412
  558    HA   ASP  68           HA       ASP  68  17.658  -0.980  -1.442
  559   1HB   ASP  68          2HB       ASP  68  16.553   0.679  -2.791
  560   2HB   ASP  68          1HB       ASP  68  16.684   1.884  -1.515
  561    H    GLU  69           H        GLU  69  16.946   0.381   1.520
  562    HA   GLU  69           HA       GLU  69  18.231   0.572   3.388
  563   1HB   GLU  69          2HB       GLU  69  19.580  -1.275   2.507
  564   2HB   GLU  69          1HB       GLU  69  20.538  -0.138   1.569
  565   1HG   GLU  69          2HG       GLU  69  21.326   0.904   3.631
  566   2HG   GLU  69          1HG       GLU  69  20.369  -0.241   4.572
  567    H    LYS  70           H        LYS  70  18.834   2.376   0.545
  568    HA   LYS  70           HA       LYS  70  20.472   4.341   1.955
  569   1HB   LYS  70          1HB       LYS  70  19.622   4.210  -0.942
  570   2HB   LYS  70          2HB       LYS  70  20.689   5.427  -0.255
  571   1HG   LYS  70          2HG       LYS  70  22.315   3.697   0.306
  572   2HG   LYS  70          1HG       LYS  70  21.244   2.470  -0.375
  573   1HD   LYS  70          2HD       LYS  70  21.395   3.556  -2.565
  574   2HD   LYS  70          1HD       LYS  70  22.469   4.779  -1.883
  575   1HE   LYS  70          2HE       LYS  70  23.738   3.069  -3.064
  576   2HE   LYS  70          1HE       LYS  70  24.104   3.046  -1.340
  577   1HZ   LYS  70          1HZ       LYS  70  22.610   1.169  -1.080
  578   2HZ   LYS  70          2HZ       LYS  70  23.814   0.816  -2.215
  579   3HZ   LYS  70          3HZ       LYS  70  22.250   1.193  -2.734
  580    H    GLN  71           H        GLN  71  17.768   4.700  -0.346
  581    HA   GLN  71           HA       GLN  71  16.816   6.934   1.305
  582   1HB   GLN  71          2HB       GLN  71  16.321   6.346  -1.616
  583   2HB   GLN  71          1HB       GLN  71  15.672   7.724  -0.740
  584   1HG   GLN  71          1HG       GLN  71  18.589   7.154  -1.214
  585   2HG   GLN  71          2HG       GLN  71  17.609   8.337  -2.080
  586   1HE2  GLN  71          1HE2      GLN  71  19.193   7.560   0.910
  587   2HE2  GLN  71          2HE2      GLN  71  19.092   9.137   1.610
  588    H    GLN  72           H        GLN  72  16.224   3.825   1.040
  589    HA   GLN  72           HA       GLN  72  14.479   2.452   1.550
  590   1HB   GLN  72          2HB       GLN  72  13.303   4.970   2.741
  591   2HB   GLN  72          1HB       GLN  72  12.851   3.318   3.141
  592   1HG   GLN  72          2HG       GLN  72  15.085   2.922   4.038
  593   2HG   GLN  72          1HG       GLN  72  15.540   4.576   3.634
  594   1HE2  GLN  72          2HE2      GLN  72  15.477   3.225   6.221
  595   2HE2  GLN  72          1HE2      GLN  72  14.434   4.167   7.225
  596    H    HIS  73           H        HIS  73  14.338   4.291  -0.941
  597    HA   HIS  73           HA       HIS  73  11.442   4.272  -1.369
  598   1HB   HIS  73          1HB       HIS  73  13.689   5.485  -2.978
  599   2HB   HIS  73          2HB       HIS  73  12.000   5.524  -3.467
  600    HD1  HIS  73           1HD      HIS  73  14.402   7.575  -1.887
  601    HD2  HIS  73           2HD      HIS  73  10.383   6.777  -1.203
  602    HE1  HIS  73           1HE      HIS  73  13.561   9.502  -0.509
  603    HE2  HIS  73           2HE      HIS  73  11.103   9.042  -0.182
  604    H    ILE  74           H        ILE  74  14.404   3.192  -3.069
  605    HA   ILE  74           HA       ILE  74  12.947   1.413  -4.780
  606    HB   ILE  74           HB       ILE  74  15.880   1.192  -4.118
  607   1HG1  ILE  74          2HG1      ILE  74  15.494   3.498  -4.771
  608   2HG1  ILE  74          1HG1      ILE  74  16.282   2.640  -6.093
  609   1HG2  ILE  74          1HG2      ILE  74  14.923  -0.675  -5.338
  610   2HG2  ILE  74          2HG2      ILE  74  16.016   0.243  -6.374
  611   3HG2  ILE  74          3HG2      ILE  74  14.271   0.428  -6.549
  612   1HD1  ILE  74          1HD1      ILE  74  14.541   4.121  -6.910
  613   2HD1  ILE  74          2HD1      ILE  74  13.349   3.284  -5.915
  614   3HD1  ILE  74          3HD1      ILE  74  14.145   2.435  -7.241
  615    H    VAL  75           H        VAL  75  12.753  -0.831  -4.623
  616    HA   VAL  75           HA       VAL  75  13.450  -2.000  -2.019
  617    HB   VAL  75           HB       VAL  75  10.779  -2.559  -3.257
  618   1HG1  VAL  75          1HG1      VAL  75  11.835  -2.736  -0.439
  619   2HG1  VAL  75          2HG1      VAL  75  11.579  -4.084  -1.546
  620   3HG1  VAL  75          3HG1      VAL  75  10.202  -3.159  -0.950
  621   1HG2  VAL  75          1HG2      VAL  75  10.785  -0.177  -3.004
  622   2HG2  VAL  75          2HG2      VAL  75  11.443  -0.306  -1.372
  623   3HG2  VAL  75          3HG2      VAL  75   9.810  -0.878  -1.712
  624    H    TYR  76           H        TYR  76  15.076  -3.184  -3.070
  625    HA   TYR  76           HA       TYR  76  14.552  -5.021  -5.161
  626   1HB   TYR  76          2HB       TYR  76  16.684  -5.289  -3.044
  627   2HB   TYR  76          1HB       TYR  76  16.717  -5.904  -4.697
  628    HD1  TYR  76           1HD      TYR  76  15.932  -3.672  -6.324
  629    HD2  TYR  76           2HD      TYR  76  18.347  -3.688  -2.818
  630    HE1  TYR  76           1HE      TYR  76  17.036  -1.605  -7.075
  631    HE2  TYR  76           2HE      TYR  76  19.453  -1.628  -3.564
  632    HH   TYR  76           HH       TYR  76  18.273   0.279  -6.109
  633    H    CYS  77           H        CYS  77  13.080  -6.573  -4.995
  634    HA   CYS  77           HA       CYS  77  13.136  -8.396  -2.731
  635   1HB   CYS  77          1HB       CYS  77  10.682  -8.141  -2.339
  636   2HB   CYS  77          2HB       CYS  77  11.618  -6.715  -1.901
  637    HG   CYS  77           HG       CYS  77   8.980  -6.786  -3.685
  638    H    SER  78           H        SER  78  13.881  -9.739  -4.516
  639    HA   SER  78           HA       SER  78  11.896 -10.428  -6.536
  640   1HB   SER  78          1HB       SER  78  14.743 -11.390  -6.158
  641   2HB   SER  78          2HB       SER  78  13.701 -11.801  -7.521
  642    HG   SER  78           HG       SER  78  15.252  -9.678  -7.243
  643    H    ASN  79           H        ASN  79  12.406 -11.297  -3.445
  644    HA   ASN  79           HA       ASN  79  10.943 -13.757  -3.752
  645   1HB   ASN  79          2HB       ASN  79  12.578 -15.136  -2.487
  646   2HB   ASN  79          1HB       ASN  79  13.185 -14.628  -4.059
  647   1HD2  ASN  79          1HD2      ASN  79  14.625 -15.462  -1.665
  648   2HD2  ASN  79          2HD2      ASN  79  15.686 -14.156  -1.268
  649    H    ASP  80           H        ASP  80   9.613 -12.057  -2.627
  650    HA   ASP  80           HA       ASP  80   9.890 -12.348   0.267
  651   1HB   ASP  80          2HB       ASP  80  11.067 -10.250  -0.356
  652   2HB   ASP  80          1HB       ASP  80   9.572  -9.652  -1.070
  653    H    LEU  81           H        LEU  81   7.915 -11.589   1.429
  654    HA   LEU  81           HA       LEU  81   5.475 -12.313   0.247
  655   1HB   LEU  81          1HB       LEU  81   6.168 -10.640   2.645
  656   2HB   LEU  81          2HB       LEU  81   4.503 -10.860   2.147
  657    HG   LEU  81           HG       LEU  81   5.066 -12.411   3.927
  658   1HD1  LEU  81          1HD1      LEU  81   3.462 -13.157   2.268
  659   2HD1  LEU  81          2HD1      LEU  81   4.433 -14.512   2.840
  660   3HD1  LEU  81          3HD1      LEU  81   4.767 -13.791   1.266
  661   1HD2  LEU  81          1HD2      LEU  81   7.466 -12.563   3.569
  662   2HD2  LEU  81          2HD2      LEU  81   7.198 -13.446   2.065
  663   3HD2  LEU  81          3HD2      LEU  81   6.736 -14.169   3.606
  664    H    LEU  82           H        LEU  82   7.090  -9.184   0.573
  665    HA   LEU  82           HA       LEU  82   5.226  -7.560  -0.714
  666   1HB   LEU  82          1HB       LEU  82   7.871  -7.312   0.145
  667   2HB   LEU  82          2HB       LEU  82   7.944  -7.015  -1.581
  668    HG   LEU  82           HG       LEU  82   7.685  -4.912  -0.467
  669   1HD1  LEU  82          1HD2      LEU  82   5.091  -5.800  -1.725
  670   2HD1  LEU  82          2HD2      LEU  82   6.489  -5.113  -2.556
  671   3HD1  LEU  82          3HD2      LEU  82   5.558  -4.123  -1.433
  672   1HD2  LEU  82          1HD1      LEU  82   6.769  -5.730   1.639
  673   2HD2  LEU  82          2HD1      LEU  82   5.240  -6.093   0.840
  674   3HD2  LEU  82          3HD1      LEU  82   5.785  -4.422   0.984
  675    H    GLY  83           H        GLY  83   7.447  -9.959  -1.952
  676   1HA   GLY  83          2HA       GLY  83   7.246  -9.392  -4.702
  677   2HA   GLY  83          1HA       GLY  83   7.612 -10.964  -4.007
  678    H    ASP  84           H        ASP  84   5.242 -11.435  -2.589
  679    HA   ASP  84           HA       ASP  84   3.458 -12.387  -4.508
  680   1HB   ASP  84          2HB       ASP  84   2.842 -11.583  -1.650
  681   2HB   ASP  84          1HB       ASP  84   1.818 -12.582  -2.675
  682    H    LEU  85           H        LEU  85   3.761  -9.227  -3.064
  683    HA   LEU  85           HA       LEU  85   1.293  -8.195  -4.076
  684   1HB   LEU  85          2HB       LEU  85   3.795  -6.703  -3.297
  685   2HB   LEU  85          1HB       LEU  85   2.207  -6.003  -3.530
  686    HG   LEU  85           HG       LEU  85   3.033  -7.912  -1.347
  687   1HD1  LEU  85          1HD2      LEU  85   2.418  -6.001   0.108
  688   2HD1  LEU  85          2HD2      LEU  85   2.209  -5.015  -1.340
  689   3HD1  LEU  85          3HD2      LEU  85   3.795  -5.672  -0.942
  690   1HD2  LEU  85          1HD1      LEU  85   0.330  -6.700  -1.897
  691   2HD2  LEU  85          2HD1      LEU  85   0.767  -7.675  -0.493
  692   3HD2  LEU  85          3HD1      LEU  85   0.759  -8.398  -2.101
  693    H    PHE  86           H        PHE  86   4.650  -7.469  -5.035
  694    HA   PHE  86           HA       PHE  86   3.638  -6.533  -7.615
  695   1HB   PHE  86          1HB       PHE  86   6.364  -6.212  -6.343
  696   2HB   PHE  86          2HB       PHE  86   5.871  -5.506  -7.878
  697    HD1  PHE  86           1HD      PHE  86   4.829  -5.602  -4.302
  698    HD2  PHE  86           2HD      PHE  86   5.085  -3.346  -7.901
  699    HE1  PHE  86           1HE      PHE  86   3.996  -3.619  -3.112
  700    HE2  PHE  86           2HE      PHE  86   4.253  -1.352  -6.715
  701    HZ   PHE  86           HZ       PHE  86   3.707  -1.494  -4.318
  702    H    GLY  87           H        GLY  87   6.386  -8.470  -6.412
  703   1HA   GLY  87          1HA       GLY  87   7.282 -10.404  -7.450
  704   2HA   GLY  87          2HA       GLY  87   6.327 -10.045  -8.883
  705    H    VAL  88           H        VAL  88   7.531  -7.168  -8.045
  706    HA   VAL  88           HA       VAL  88   9.368  -7.038 -10.182
  707    HB   VAL  88           HB       VAL  88   9.889  -4.797  -9.409
  708   1HG1  VAL  88          1HG2      VAL  88   7.785  -5.084 -10.581
  709   2HG1  VAL  88          2HG2      VAL  88   7.625  -3.842  -9.339
  710   3HG1  VAL  88          3HG2      VAL  88   6.966  -5.454  -9.063
  711   1HG2  VAL  88          1HG1      VAL  88   8.364  -5.518  -6.907
  712   2HG2  VAL  88          2HG1      VAL  88   9.006  -3.924  -7.303
  713   3HG2  VAL  88          3HG1      VAL  88  10.107  -5.274  -7.025
  714    HA   PRO  89           HA       PRO  89  13.255  -7.921  -8.009
  715   1HB   PRO  89          1HB       PRO  89  14.953  -6.572  -9.603
  716   2HB   PRO  89          2HB       PRO  89  14.224  -8.104 -10.101
  717   1HG   PRO  89          2HG       PRO  89  13.445  -5.307 -10.832
  718   2HG   PRO  89          1HG       PRO  89  13.556  -6.743 -11.867
  719   1HD   PRO  89          1HD       PRO  89  11.204  -5.796 -10.846
  720   2HD   PRO  89          2HD       PRO  89  11.484  -7.502 -11.241
  721    H    SER  90           H        SER  90  11.988  -4.786  -8.789
  722    HA   SER  90           HA       SER  90  12.760  -3.744  -6.239
  723   1HB   SER  90          2HB       SER  90  14.003  -1.778  -7.149
  724   2HB   SER  90          1HB       SER  90  14.856  -3.306  -7.354
  725    HG   SER  90           HG       SER  90  13.424  -3.055  -9.503
  726    H    PHE  91           H        PHE  91  11.387  -2.069  -5.624
  727    HA   PHE  91           HA       PHE  91   9.939  -0.692  -7.762
  728   1HB   PHE  91          1HB       PHE  91   7.793  -0.951  -6.785
  729   2HB   PHE  91          2HB       PHE  91   8.508  -2.553  -6.873
  730    HD1  PHE  91           1HD      PHE  91   7.517   0.168  -4.617
  731    HD2  PHE  91           2HD      PHE  91   8.991  -3.811  -4.903
  732    HE1  PHE  91           1HE      PHE  91   7.000  -0.179  -2.248
  733    HE2  PHE  91           2HE      PHE  91   8.487  -4.171  -2.523
  734    HZ   PHE  91           HZ       PHE  91   7.488  -2.353  -1.190
  735    H    SER  92           H        SER  92   8.835   1.291  -7.022
  736    HA   SER  92           HA       SER  92  10.620   2.620  -5.093
  737   1HB   SER  92          1HB       SER  92   9.347   3.678  -7.625
  738   2HB   SER  92          2HB       SER  92  10.245   4.674  -6.481
  739    HG   SER  92           HG       SER  92  11.671   4.038  -8.051
  740    H    VAL  93           H        VAL  93   9.383   2.617  -3.260
  741    HA   VAL  93           HA       VAL  93   6.669   3.374  -3.098
  742    HB   VAL  93           HB       VAL  93   7.410   4.091  -0.694
  743   1HG1  VAL  93          1HG2      VAL  93   7.329   1.754   0.025
  744   2HG1  VAL  93          2HG2      VAL  93   7.602   1.233  -1.637
  745   3HG1  VAL  93          3HG2      VAL  93   6.119   2.089  -1.212
  746   1HG2  VAL  93          1HG1      VAL  93   9.468   3.090   0.062
  747   2HG2  VAL  93          2HG1      VAL  93   9.802   4.210  -1.261
  748   3HG2  VAL  93          3HG1      VAL  93   9.793   2.471  -1.557
  749    H    LYS  94           H        LYS  94   9.460   5.189  -3.795
  750    HA   LYS  94           HA       LYS  94   8.771   7.747  -2.921
  751   1HB   LYS  94          1HB       LYS  94  10.915   7.191  -4.013
  752   2HB   LYS  94          2HB       LYS  94  10.072   6.965  -5.539
  753   1HG   LYS  94          2HG       LYS  94   9.410   9.322  -5.520
  754   2HG   LYS  94          1HG       LYS  94  10.274   9.545  -3.997
  755   1HD   LYS  94          1HD       LYS  94  11.545   8.632  -6.576
  756   2HD   LYS  94          2HD       LYS  94  11.564  10.293  -5.978
  757   1HE   LYS  94          1HE       LYS  94  12.750   9.558  -3.970
  758   2HE   LYS  94          2HE       LYS  94  12.725   7.895  -4.558
  759   1HZ   LYS  94          1HZ       LYS  94  14.845   8.935  -5.009
  760   2HZ   LYS  94          2HZ       LYS  94  14.093  10.183  -5.868
  761   3HZ   LYS  94          3HZ       LYS  94  14.049   8.601  -6.464
  762    H    GLU  95           H        GLU  95   7.397   5.729  -5.360
  763    HA   GLU  95           HA       GLU  95   5.721   7.867  -6.415
  764   1HB   GLU  95          1HB       GLU  95   5.479   4.941  -7.077
  765   2HB   GLU  95          2HB       GLU  95   4.999   6.324  -8.050
  766   1HG   GLU  95          2HG       GLU  95   7.399   6.908  -8.301
  767   2HG   GLU  95          1HG       GLU  95   7.802   5.415  -7.454
  768    H    HIS  96           H        HIS  96   3.307   6.923  -6.759
  769    HA   HIS  96           HA       HIS  96   2.232   5.431  -4.594
  770   1HB   HIS  96          1HB       HIS  96   0.835   7.454  -3.754
  771   2HB   HIS  96          2HB       HIS  96   2.481   7.249  -3.164
  772    HD1  HIS  96           1HD      HIS  96   2.882   9.720  -2.698
  773    HD2  HIS  96           2HD      HIS  96   1.791   8.932  -6.625
  774    HE1  HIS  96           1HE      HIS  96   3.285  11.865  -3.947
  775    HE2  HIS  96           2HE      HIS  96   2.706  11.336  -6.343
  776    H    ARG  97           H        ARG  97   1.723   7.663  -7.248
  777    HA   ARG  97           HA       ARG  97  -0.970   6.952  -7.770
  778   1HB   ARG  97          2HB       ARG  97   1.187   7.870  -9.684
  779   2HB   ARG  97          1HB       ARG  97  -0.533   7.809 -10.044
  780   1HG   ARG  97          1HG       ARG  97  -0.957   9.462  -8.289
  781   2HG   ARG  97          2HG       ARG  97   0.774   9.533  -7.948
  782   1HD   ARG  97          1HD       ARG  97   1.190  10.304 -10.234
  783   2HD   ARG  97          2HD       ARG  97  -0.540  10.238 -10.570
  784    HE   ARG  97           HE       ARG  97  -0.149  11.872  -8.339
  785   1HH1  ARG  97          2HH1      ARG  97   0.565  11.846 -11.749
  786   2HH1  ARG  97          1HH1      ARG  97   0.539  13.571 -11.899
  787   1HH2  ARG  97          1HH2      ARG  97  -0.184  14.144  -8.527
  788   2HH2  ARG  97          2HH2      ARG  97   0.115  14.877 -10.066
  789    H    LYS  98           H        LYS  98   1.963   5.968  -9.536
  790    HA   LYS  98           HA       LYS  98   0.681   3.715 -10.706
  791   1HB   LYS  98          2HB       LYS  98   3.578   4.540 -10.544
  792   2HB   LYS  98          1HB       LYS  98   3.036   3.104 -11.403
  793   1HG   LYS  98          2HG       LYS  98   3.289   4.793 -13.024
  794   2HG   LYS  98          1HG       LYS  98   1.552   4.617 -12.765
  795   1HD   LYS  98          1HD       LYS  98   1.578   6.565 -11.280
  796   2HD   LYS  98          2HD       LYS  98   3.314   6.741 -11.544
  797   1HE   LYS  98          1HE       LYS  98   2.913   7.101 -13.930
  798   2HE   LYS  98          2HE       LYS  98   1.179   6.925 -13.667
  799   1HZ   LYS  98          1HZ       LYS  98   1.815   9.246 -13.775
  800   2HZ   LYS  98          2HZ       LYS  98   2.901   9.042 -12.495
  801   3HZ   LYS  98          3HZ       LYS  98   1.240   8.869 -12.229
  802    H    ILE  99           H        ILE  99   2.679   4.204  -7.867
  803    HA   ILE  99           HA       ILE  99   3.447   1.482  -7.629
  804    HB   ILE  99           HB       ILE  99   4.322   3.835  -6.475
  805   1HG1  ILE  99          2HG1      ILE  99   5.474   1.618  -7.083
  806   2HG1  ILE  99          1HG1      ILE  99   6.113   2.516  -5.708
  807   1HG2  ILE  99          1HG2      ILE  99   2.935   2.175  -4.397
  808   2HG2  ILE  99          2HG2      ILE  99   2.871   3.921  -4.645
  809   3HG2  ILE  99          3HG2      ILE  99   4.336   3.171  -4.001
  810   1HD1  ILE  99          1HD1      ILE  99   5.877   0.027  -5.423
  811   2HD1  ILE  99          2HD1      ILE  99   4.132   0.287  -5.406
  812   3HD1  ILE  99          3HD1      ILE  99   5.148   1.027  -4.168
  813    H    TYR 100           H        TYR 100   0.804   3.364  -6.300
  814    HA   TYR 100           HA       TYR 100  -0.071   1.156  -4.650
  815   1HB   TYR 100          2HB       TYR 100  -1.118   3.912  -5.198
  816   2HB   TYR 100          1HB       TYR 100  -2.151   2.711  -4.426
  817    HD1  TYR 100           1HD      TYR 100  -2.101   4.544  -2.580
  818    HD2  TYR 100           2HD      TYR 100   1.263   2.168  -3.660
  819    HE1  TYR 100           1HE      TYR 100  -1.063   5.032  -0.404
  820    HE2  TYR 100           2HE      TYR 100   2.301   2.643  -1.495
  821    HH   TYR 100           HH       TYR 100   0.615   4.053   1.099
  822    H    THR 101           H        THR 101  -0.741   2.470  -7.821
  823    HA   THR 101           HA       THR 101  -3.076   1.013  -8.414
  824    HB   THR 101           HB       THR 101  -0.842   1.882 -10.261
  825    HG1  THR 101           1HG      THR 101  -2.556   3.322  -8.964
  826   1HG2  THR 101          1HG2      THR 101  -2.142   0.075 -11.269
  827   2HG2  THR 101          2HG2      THR 101  -2.478   1.609 -12.070
  828   3HG2  THR 101          3HG2      THR 101  -3.638   0.944 -10.919
  829    H    MET 102           H        MET 102   0.341   0.136  -8.509
  830    HA   MET 102           HA       MET 102  -0.070  -2.439  -9.665
  831   1HB   MET 102          2HB       MET 102   2.223  -1.510  -7.929
  832   2HB   MET 102          1HB       MET 102   2.217  -2.913  -8.989
  833   1HG   MET 102          2HG       MET 102   1.924  -1.416 -10.920
  834   2HG   MET 102          1HG       MET 102   2.017  -0.041  -9.823
  835   1HE   MET 102          1HE       MET 102   5.663  -0.160  -8.539
  836   2HE   MET 102          2HE       MET 102   4.088  -0.499  -7.819
  837   3HE   MET 102          3HE       MET 102   4.306   0.926  -8.834
  838    H    ILE 103           H        ILE 103   0.266  -1.239  -6.343
  839    HA   ILE 103           HA       ILE 103   0.304  -3.657  -5.015
  840    HB   ILE 103           HB       ILE 103  -0.984  -1.073  -4.131
  841   1HG1  ILE 103          2HG1      ILE 103   1.708  -2.314  -3.518
  842   2HG1  ILE 103          1HG1      ILE 103   1.427  -0.921  -4.559
  843   1HG2  ILE 103          1HG2      ILE 103  -0.847  -1.982  -1.849
  844   2HG2  ILE 103          2HG2      ILE 103  -0.320  -3.530  -2.510
  845   3HG2  ILE 103          3HG2      ILE 103  -1.934  -2.918  -2.873
  846   1HD1  ILE 103          1HD1      ILE 103   2.248  -0.226  -2.395
  847   2HD1  ILE 103          2HD1      ILE 103   0.912  -1.056  -1.599
  848   3HD1  ILE 103          3HD1      ILE 103   0.593   0.336  -2.633
  849    H    TYR 104           H        TYR 104  -2.424  -1.888  -6.349
  850    HA   TYR 104           HA       TYR 104  -4.187  -4.127  -5.605
  851   1HB   TYR 104          2HB       TYR 104  -4.954  -1.303  -6.380
  852   2HB   TYR 104          1HB       TYR 104  -6.064  -2.580  -5.886
  853    HD1  TYR 104           1HD      TYR 104  -3.704  -0.057  -4.766
  854    HD2  TYR 104           2HD      TYR 104  -6.088  -3.359  -3.541
  855    HE1  TYR 104           1HE      TYR 104  -3.447   0.636  -2.421
  856    HE2  TYR 104           2HE      TYR 104  -5.840  -2.675  -1.192
  857    HH   TYR 104           HH       TYR 104  -4.623   0.355  -0.278
  858    H    ARG 105           H        ARG 105  -3.501  -5.415  -7.370
  859    HA   ARG 105           HA       ARG 105  -3.771  -4.370 -10.059
  860   1HB   ARG 105          2HB       ARG 105  -1.875  -5.824  -9.509
  861   2HB   ARG 105          1HB       ARG 105  -2.981  -7.119  -9.077
  862   1HG   ARG 105          1HG       ARG 105  -2.085  -7.541 -11.260
  863   2HG   ARG 105          2HG       ARG 105  -3.801  -7.150 -11.408
  864   1HD   ARG 105          1HD       ARG 105  -3.228  -4.863 -12.042
  865   2HD   ARG 105          2HD       ARG 105  -1.514  -5.241 -11.881
  866    HE   ARG 105           HE       ARG 105  -2.755  -7.023 -13.694
  867   1HH1  ARG 105          2HH1      ARG 105  -1.638  -3.735 -13.412
  868   2HH1  ARG 105          1HH1      ARG 105  -1.343  -3.553 -15.108
  869   1HH2  ARG 105          1HH2      ARG 105  -2.370  -6.793 -15.929
  870   2HH2  ARG 105          2HH2      ARG 105  -1.759  -5.292 -16.540
  871    H    ASN 106           H        ASN 106  -4.802  -7.548  -8.871
  872    HA   ASN 106           HA       ASN 106  -7.491  -7.034  -9.933
  873   1HB   ASN 106          1HB       ASN 106  -5.800  -9.471 -10.534
  874   2HB   ASN 106          2HB       ASN 106  -7.493  -9.282 -10.979
  875   1HD2  ASN 106          2HD2      ASN 106  -5.121  -9.678 -12.644
  876   2HD2  ASN 106          1HD2      ASN 106  -5.095  -8.350 -13.749
  877    H    LEU 107           H        LEU 107  -9.156  -8.073  -8.892
  878    HA   LEU 107           HA       LEU 107 -10.261  -9.003  -7.136
  879   1HB   LEU 107          1HB       LEU 107  -7.941 -10.934  -7.221
  880   2HB   LEU 107          2HB       LEU 107  -9.453 -11.203  -6.376
  881    HG   LEU 107           HG       LEU 107  -9.220 -10.843  -9.364
  882   1HD1  LEU 107          1HD2      LEU 107  -8.098 -12.882  -8.671
  883   2HD1  LEU 107          2HD2      LEU 107  -9.613 -13.257  -9.493
  884   3HD1  LEU 107          3HD2      LEU 107  -9.515 -13.362  -7.735
  885   1HD2  LEU 107          1HD1      LEU 107 -11.388 -10.199  -8.452
  886   2HD2  LEU 107          2HD1      LEU 107 -11.513 -11.756  -7.632
  887   3HD2  LEU 107          3HD1      LEU 107 -11.511 -11.685  -9.394
  888    H    VAL 108           H        VAL 108  -9.459  -6.922  -6.075
  889    HA   VAL 108           HA       VAL 108  -8.470  -7.615  -3.455
  890    HB   VAL 108           HB       VAL 108  -6.353  -7.265  -4.602
  891   1HG1  VAL 108          1HG2      VAL 108  -5.788  -5.084  -5.579
  892   2HG1  VAL 108          2HG2      VAL 108  -7.444  -4.543  -5.310
  893   3HG1  VAL 108          3HG2      VAL 108  -7.120  -5.864  -6.432
  894   1HG2  VAL 108          1HG1      VAL 108  -5.425  -5.505  -3.176
  895   2HG2  VAL 108          2HG1      VAL 108  -6.524  -6.555  -2.279
  896   3HG2  VAL 108          3HG1      VAL 108  -7.057  -4.954  -2.795
  897    H    VAL 109           H        VAL 109  -9.639  -5.232  -5.735
  898    HA   VAL 109           HA       VAL 109 -10.467  -3.450  -3.570
  899    HB   VAL 109           HB       VAL 109  -9.420  -2.414  -5.526
  900   1HG1  VAL 109          1HG2      VAL 109 -10.560  -2.404  -7.697
  901   2HG1  VAL 109          2HG2      VAL 109 -11.761  -3.529  -7.065
  902   3HG1  VAL 109          3HG2      VAL 109 -10.077  -4.032  -7.218
  903   1HG2  VAL 109          1HG1      VAL 109 -11.058  -1.123  -4.275
  904   2HG2  VAL 109          2HG1      VAL 109 -12.356  -1.768  -5.282
  905   3HG2  VAL 109          3HG1      VAL 109 -11.128  -0.718  -5.991
  906    H    VAL 110           H        VAL 110 -12.629  -2.862  -3.226
  907    HA   VAL 110           HA       VAL 110 -14.504  -4.908  -3.344
  908    HB   VAL 110           HB       VAL 110 -14.682  -3.062  -1.759
  909   1HG1  VAL 110          1HG1      VAL 110 -13.958  -1.251  -3.199
  910   2HG1  VAL 110          2HG1      VAL 110 -15.526  -0.877  -2.484
  911   3HG1  VAL 110          3HG1      VAL 110 -15.426  -1.407  -4.163
  912   1HG2  VAL 110          1HG2      VAL 110 -17.101  -2.685  -1.916
  913   2HG2  VAL 110          2HG2      VAL 110 -16.680  -4.367  -2.238
  914   3HG2  VAL 110          3HG2      VAL 110 -17.081  -3.287  -3.573
  915    H    ASN 111           H        ASN 111 -16.157  -5.442  -4.700
  916    HA   ASN 111           HA       ASN 111 -16.342  -3.931  -7.224
  917   1HB   ASN 111          2HB       ASN 111 -16.664  -6.075  -8.400
  918   2HB   ASN 111          1HB       ASN 111 -15.098  -6.000  -7.599
  919   1HD2  ASN 111          2HD2      ASN 111 -14.716  -7.284  -5.796
  920   2HD2  ASN 111          1HD2      ASN 111 -15.721  -8.629  -5.398
  921    H    GLN 112           H        GLN 112 -18.378  -4.095  -8.342
  922    HA   GLN 112           HA       GLN 112 -20.605  -3.874  -6.596
  923   1HB   GLN 112          1HB       GLN 112 -20.421  -2.577  -8.674
  924   2HB   GLN 112          2HB       GLN 112 -20.524  -4.060  -9.613
  925   1HG   GLN 112          1HG       GLN 112 -22.780  -4.445  -8.750
  926   2HG   GLN 112          2HG       GLN 112 -22.676  -2.946  -7.830
  927   1HE2  GLN 112          2HE2      GLN 112 -22.981  -4.358 -10.989
  928   2HE2  GLN 112          1HE2      GLN 112 -23.452  -2.914 -11.813
  929    H    GLN 113           H        GLN 113 -21.733  -5.477  -5.738
  930    HA   GLN 113           HA       GLN 113 -21.536  -8.157  -6.828
  931   1HB   GLN 113          2HB       GLN 113 -22.971  -7.131  -4.372
  932   2HB   GLN 113          1HB       GLN 113 -22.772  -8.824  -4.801
  933   1HG   GLN 113          2HG       GLN 113 -20.352  -8.598  -4.598
  934   2HG   GLN 113          1HG       GLN 113 -20.546  -6.897  -4.178
  935   1HE2  GLN 113          2HE2      GLN 113 -22.730  -9.387  -3.088
  936   2HE2  GLN 113          1HE2      GLN 113 -22.273  -9.333  -1.423
  937    H    GLU 114           H        GLU 114 -22.826  -6.584  -8.631
  938    HA   GLU 114           HA       GLU 114 -25.679  -7.222  -8.311
  939   1HB   GLU 114          1HB       GLU 114 -25.160  -4.853  -8.724
  940   2HB   GLU 114          2HB       GLU 114 -24.341  -5.292 -10.217
  941   1HG   GLU 114          2HG       GLU 114 -26.554  -4.428 -10.674
  942   2HG   GLU 114          1HG       GLU 114 -26.441  -6.128 -11.132
  943    H    SER 115           H        SER 115 -22.847  -7.832 -10.220
  944    HA   SER 115           HA       SER 115 -24.088  -8.890 -12.522
  945   1HB   SER 115          2HB       SER 115 -21.890  -9.927 -12.977
  946   2HB   SER 115          1HB       SER 115 -21.731  -8.231 -12.512
  947    HG   SER 115           HG       SER 115 -20.372  -9.004 -11.106
  948    H    SER 116           H        SER 116 -25.247 -10.676 -12.740
  949    HA   SER 116           HA       SER 116 -24.935 -12.817 -10.748
  950   1HB   SER 116          2HB       SER 116 -27.183 -11.854 -10.832
  951   2HB   SER 116          1HB       SER 116 -27.278 -12.189 -12.561
  952    HG   SER 116           HG       SER 116 -26.636 -14.451 -11.361
  953    H    ASP 117           H        ASP 117 -23.620 -14.365 -11.465
  954    HA   ASP 117           HA       ASP 117 -23.486 -14.980 -14.308
  955   1HB   ASP 117          2HB       ASP 117 -21.882 -16.058 -11.979
  956   2HB   ASP 117          1HB       ASP 117 -21.581 -16.419 -13.677
  957    H    SER 118           H        SER 118 -25.699 -15.738 -12.260
  958    HA   SER 118           HA       SER 118 -25.677 -18.641 -12.621
  959   1HB   SER 118          2HB       SER 118 -27.603 -18.631 -11.060
  960   2HB   SER 118          1HB       SER 118 -26.181 -17.849 -10.369
  961    HG   SER 118           HG       SER 118 -27.645 -16.355  -9.980
  962    H    SER 119           H        SER 119 -26.301 -19.072 -14.672
  963    HA   SER 119           HA       SER 119 -27.629 -19.287 -16.503
  964   1HB   SER 119          2HB       SER 119 -29.213 -20.227 -14.889
  965   2HB   SER 119          1HB       SER 119 -29.814 -18.610 -14.519
  966    HG   SER 119           HG       SER 119 -30.818 -18.522 -16.421
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1   0.786  19.238  30.689
    2   2H    MET   1          2H        MET   1  -0.130  19.357  29.273
    3   3H    MET   1          3H        MET   1  -0.187  17.942  30.199
    4    HA   MET   1           HA       MET   1  -2.171  19.263  30.524
    5   1HB   MET   1          2HB       MET   1  -0.331  19.211  32.926
    6   2HB   MET   1          1HB       MET   1  -2.081  19.375  32.989
    7   1HG   MET   1          1HG       MET   1  -0.566  16.998  31.932
    8   2HG   MET   1          2HG       MET   1  -1.377  17.104  33.493
    9   1HE   MET   1          1HE       MET   1  -2.695  14.859  32.966
   10   2HE   MET   1          2HE       MET   1  -1.887  14.747  31.402
   11   3HE   MET   1          3HE       MET   1  -3.641  14.603  31.499
   12    H    CYS   2           H        CYS   2   0.557  20.942  32.100
   13    HA   CYS   2           HA       CYS   2  -0.861  23.477  31.714
   14   1HB   CYS   2          2HB       CYS   2   0.743  24.393  33.346
   15   2HB   CYS   2          1HB       CYS   2  -0.119  23.001  33.992
   16    HG   CYS   2           HG       CYS   2   2.114  22.113  34.927
   17    H    ASN   3           H        ASN   3   0.612  21.993  29.593
   18    HA   ASN   3           HA       ASN   3   2.336  24.211  28.755
   19   1HB   ASN   3          2HB       ASN   3   3.831  22.480  29.620
   20   2HB   ASN   3          1HB       ASN   3   3.078  21.283  28.569
   21   1HD2  ASN   3          2HD2      ASN   3   4.994  20.808  27.529
   22   2HD2  ASN   3          1HD2      ASN   3   5.739  21.894  26.411
   23    H    THR   4           H        THR   4   1.559  24.980  26.916
   24    HA   THR   4           HA       THR   4   0.728  23.110  24.823
   25    HB   THR   4           HB       THR   4  -0.945  25.495  25.638
   26    HG1  THR   4           1HG      THR   4  -1.625  24.033  27.043
   27   1HG2  THR   4          1HG2      THR   4  -1.405  23.376  23.534
   28   2HG2  THR   4          2HG2      THR   4  -1.000  25.065  23.230
   29   3HG2  THR   4          3HG2      THR   4  -2.542  24.648  23.978
   30    H    ASN   5           H        ASN   5   1.754  26.302  25.806
   31    HA   ASN   5           HA       ASN   5   2.896  27.954  24.750
   32   1HB   ASN   5          2HB       ASN   5   4.475  26.170  24.194
   33   2HB   ASN   5          1HB       ASN   5   3.531  25.761  22.764
   34   1HD2  ASN   5          2HD2      ASN   5   4.076  29.037  23.842
   35   2HD2  ASN   5          1HD2      ASN   5   5.101  29.504  22.531
   36    H    MET   6           H        MET   6   2.123  26.317  21.724
   37    HA   MET   6           HA       MET   6  -0.198  27.834  21.130
   38   1HB   MET   6          2HB       MET   6   0.748  29.264  19.356
   39   2HB   MET   6          1HB       MET   6   1.370  29.681  20.947
   40   1HG   MET   6          2HG       MET   6   3.428  28.465  20.471
   41   2HG   MET   6          1HG       MET   6   2.806  28.031  18.881
   42   1HE   MET   6          1HE       MET   6   2.347  29.792  16.939
   43   2HE   MET   6          2HE       MET   6   2.577  31.531  17.127
   44   3HE   MET   6          3HE       MET   6   1.304  30.706  18.028
   45    H    SER   7           H        SER   7  -0.183  27.913  18.418
   46    HA   SER   7           HA       SER   7  -0.584  25.237  17.672
   47   1HB   SER   7          2HB       SER   7  -0.833  26.117  15.377
   48   2HB   SER   7          1HB       SER   7  -1.720  27.095  16.548
   49    HG   SER   7           HG       SER   7   0.886  27.720  15.628
   50    H    VAL   8           H        VAL   8   0.527  24.003  16.023
   51    HA   VAL   8           HA       VAL   8   3.436  24.417  16.143
   52    HB   VAL   8           HB       VAL   8   2.772  22.292  17.068
   53   1HG1  VAL   8          1HG2      VAL   8   0.613  22.048  15.976
   54   2HG1  VAL   8          2HG2      VAL   8   1.594  20.602  15.738
   55   3HG1  VAL   8          3HG2      VAL   8   1.410  21.768  14.428
   56   1HG2  VAL   8          1HG1      VAL   8   3.978  21.930  14.327
   57   2HG2  VAL   8          2HG1      VAL   8   4.057  20.765  15.650
   58   3HG2  VAL   8          3HG1      VAL   8   4.853  22.331  15.805
   59    HA   PRO   9           HA       PRO   9   3.278  25.675  11.876
   60   1HB   PRO   9          2HB       PRO   9   6.151  24.945  11.932
   61   2HB   PRO   9          1HB       PRO   9   5.387  26.478  11.498
   62   1HG   PRO   9          2HG       PRO   9   6.689  26.202  13.811
   63   2HG   PRO   9          1HG       PRO   9   5.201  27.162  13.705
   64   1HD   PRO   9          1HD       PRO   9   5.602  24.394  14.772
   65   2HD   PRO   9          2HD       PRO   9   4.580  25.705  15.397
   66    H    THR  10           H        THR  10   4.844  22.694  12.929
   67    HA   THR  10           HA       THR  10   5.074  20.646  11.963
   68    HB   THR  10           HB       THR  10   2.628  21.473  10.389
   69    HG1  THR  10           1HG      THR  10   2.476  21.565  12.757
   70   1HG2  THR  10          1HG2      THR  10   3.716  19.484   9.479
   71   2HG2  THR  10          2HG2      THR  10   2.191  19.058  10.257
   72   3HG2  THR  10          3HG2      THR  10   3.718  18.740  11.080
   73    H    ASP  11           H        ASP  11   7.038  21.068  10.914
   74    HA   ASP  11           HA       ASP  11   7.064  22.137   8.234
   75   1HB   ASP  11          2HB       ASP  11   9.493  21.713   8.335
   76   2HB   ASP  11          1HB       ASP  11   8.926  22.616   9.737
   77    H    GLY  12           H        GLY  12   7.161  21.041   6.353
   78   1HA   GLY  12          1HA       GLY  12   8.164  18.727   5.569
   79   2HA   GLY  12          2HA       GLY  12   6.784  18.146   6.490
   80    H    ALA  13           H        ALA  13   7.232  20.867   4.233
   81    HA   ALA  13           HA       ALA  13   4.751  20.137   2.907
   82   1HB   ALA  13          1HB       ALA  13   5.133  22.481   3.510
   83   2HB   ALA  13          2HB       ALA  13   4.948  22.279   1.767
   84   3HB   ALA  13          3HB       ALA  13   6.552  22.506   2.464
   85    H    VAL  14           H        VAL  14   7.936  19.427   2.614
   86    HA   VAL  14           HA       VAL  14   8.535  19.555  -0.084
   87    HB   VAL  14           HB       VAL  14  10.404  18.843   0.903
   88   1HG1  VAL  14          1HG2      VAL  14   9.442  18.878   3.129
   89   2HG1  VAL  14          2HG2      VAL  14  10.518  17.492   2.950
   90   3HG1  VAL  14          3HG2      VAL  14   8.770  17.267   2.883
   91   1HG2  VAL  14          1HG1      VAL  14  10.016  17.034  -0.658
   92   2HG2  VAL  14          2HG1      VAL  14   9.137  16.134   0.578
   93   3HG2  VAL  14          3HG1      VAL  14  10.861  16.445   0.774
   94    H    THR  15           H        THR  15   8.625  17.860  -1.680
   95    HA   THR  15           HA       THR  15   6.019  16.545  -1.820
   96    HB   THR  15           HB       THR  15   8.080  16.925  -4.002
   97    HG1  THR  15           1HG      THR  15   5.965  18.392  -4.464
   98   1HG2  THR  15          1HG2      THR  15   5.174  16.107  -4.136
   99   2HG2  THR  15          2HG2      THR  15   6.560  15.055  -4.430
  100   3HG2  THR  15          3HG2      THR  15   6.227  16.401  -5.521
  101    H    THR  16           H        THR  16   6.377  14.730  -0.514
  102    HA   THR  16           HA       THR  16   8.247  12.744  -1.632
  103    HB   THR  16           HB       THR  16   7.200  12.898   1.204
  104    HG1  THR  16           1HG      THR  16   8.823  14.226   1.454
  105   1HG2  THR  16          1HG2      THR  16   9.250  11.068  -0.052
  106   2HG2  THR  16          2HG2      THR  16   7.635  10.603   0.480
  107   3HG2  THR  16          3HG2      THR  16   8.836  11.126   1.661
  108    H    SER  17           H        SER  17   5.048  13.235  -0.203
  109    HA   SER  17           HA       SER  17   4.139  10.578  -0.764
  110   1HB   SER  17          2HB       SER  17   1.916  11.453  -0.132
  111   2HB   SER  17          1HB       SER  17   3.148  11.887   1.055
  112    HG   SER  17           HG       SER  17   3.158  13.954   0.290
  113    H    GLN  18           H        GLN  18   1.663  10.906  -1.911
  114    HA   GLN  18           HA       GLN  18   1.978  12.296  -4.443
  115   1HB   GLN  18          2HB       GLN  18   2.979   9.970  -4.711
  116   2HB   GLN  18          1HB       GLN  18   1.369   9.344  -4.382
  117   1HG   GLN  18          2HG       GLN  18   1.661   9.361  -6.730
  118   2HG   GLN  18          1HG       GLN  18   0.516  10.637  -6.310
  119   1HE2  GLN  18          2HE2      GLN  18   2.191  10.314  -8.682
  120   2HE2  GLN  18          1HE2      GLN  18   3.157  11.743  -8.784
  121    H    ILE  19           H        ILE  19   0.072   9.836  -2.738
  122    HA   ILE  19           HA       ILE  19  -2.126  10.675  -4.433
  123    HB   ILE  19           HB       ILE  19  -1.301   8.421  -4.830
  124   1HG1  ILE  19          1HG1      ILE  19  -4.005   8.325  -3.469
  125   2HG1  ILE  19          2HG1      ILE  19  -3.732   8.888  -5.115
  126   1HG2  ILE  19          1HG2      ILE  19  -1.998   7.983  -1.944
  127   2HG2  ILE  19          2HG2      ILE  19  -0.389   7.929  -2.678
  128   3HG2  ILE  19          3HG2      ILE  19  -1.589   6.696  -3.078
  129   1HD1  ILE  19          1HD1      ILE  19  -3.201   6.110  -4.091
  130   2HD1  ILE  19          2HD1      ILE  19  -2.925   6.674  -5.740
  131   3HD1  ILE  19          3HD1      ILE  19  -4.564   6.612  -5.091
  132    HA   PRO  20           HA       PRO  20  -4.269  12.221  -1.007
  133   1HB   PRO  20          2HB       PRO  20  -6.818  11.651  -2.354
  134   2HB   PRO  20          1HB       PRO  20  -6.065  13.206  -1.993
  135   1HG   PRO  20          2HG       PRO  20  -6.228  12.258  -4.506
  136   2HG   PRO  20          1HG       PRO  20  -4.846  13.222  -3.954
  137   1HD   PRO  20          2HD       PRO  20  -5.069  10.247  -4.281
  138   2HD   PRO  20          1HD       PRO  20  -3.727  11.323  -4.717
  139    H    ALA  21           H        ALA  21  -4.134  10.899   0.746
  140    HA   ALA  21           HA       ALA  21  -5.438   8.382   0.961
  141   1HB   ALA  21          1HB       ALA  21  -4.348  10.168   3.134
  142   2HB   ALA  21          2HB       ALA  21  -3.446   8.926   2.266
  143   3HB   ALA  21          3HB       ALA  21  -4.789   8.469   3.314
  144    H    SER  22           H        SER  22  -7.232   7.809   2.245
  145    HA   SER  22           HA       SER  22  -9.373   7.996   2.982
  146   1HB   SER  22          1HB       SER  22  -8.446  10.737   3.876
  147   2HB   SER  22          2HB       SER  22  -9.928   9.938   4.403
  148    HG   SER  22           HG       SER  22  -8.074   8.196   4.851
  149    H    GLU  23           H        GLU  23  -8.387   9.281   0.321
  150    HA   GLU  23           HA       GLU  23 -10.830  10.823  -0.229
  151   1HB   GLU  23          2HB       GLU  23  -8.720  11.979  -0.746
  152   2HB   GLU  23          1HB       GLU  23  -8.262  10.664  -1.819
  153   1HG   GLU  23          1HG       GLU  23  -9.092  12.552  -3.080
  154   2HG   GLU  23          2HG       GLU  23 -10.167  11.167  -3.258
  155    H    GLN  24           H        GLN  24  -8.671   8.613  -2.026
  156    HA   GLN  24           HA       GLN  24 -11.086   7.201  -2.964
  157   1HB   GLN  24          1HB       GLN  24  -9.855   8.294  -4.795
  158   2HB   GLN  24          2HB       GLN  24  -8.398   7.425  -4.334
  159   1HG   GLN  24          1HG       GLN  24  -9.493   5.306  -4.859
  160   2HG   GLN  24          2HG       GLN  24 -10.954   6.179  -5.323
  161   1HE2  GLN  24          2HE2      GLN  24 -10.974   7.369  -7.229
  162   2HE2  GLN  24          1HE2      GLN  24  -9.788   7.145  -8.464
  163    H    GLU  25           H        GLU  25 -11.205   5.671  -1.331
  164    HA   GLU  25           HA       GLU  25  -8.727   4.278  -0.627
  165   1HB   GLU  25          1HB       GLU  25  -9.944   5.500   1.166
  166   2HB   GLU  25          2HB       GLU  25 -11.322   4.437   0.918
  167   1HG   GLU  25          1HG       GLU  25  -9.942   2.514   1.552
  168   2HG   GLU  25          2HG       GLU  25  -8.580   3.600   1.830
  169    H    THR  26           H        THR  26 -11.820   2.955   0.222
  170    HA   THR  26           HA       THR  26 -12.270   0.860  -1.444
  171    HB   THR  26           HB       THR  26  -9.781   0.500  -1.397
  172    HG1  THR  26           1HG      THR  26 -10.370  -1.472  -1.863
  173   1HG2  THR  26          1HG2      THR  26  -9.430   1.029   0.962
  174   2HG2  THR  26          2HG2      THR  26  -8.843  -0.589   0.576
  175   3HG2  THR  26          3HG2      THR  26 -10.380  -0.385   1.418
  176    H    LEU  27           H        LEU  27 -13.061  -1.166  -0.282
  177    HA   LEU  27           HA       LEU  27 -12.231  -1.216   2.474
  178   1HB   LEU  27          1HB       LEU  27 -14.859  -0.671   2.082
  179   2HB   LEU  27          2HB       LEU  27 -14.895  -2.426   2.075
  180    HG   LEU  27           HG       LEU  27 -15.296  -1.829   4.315
  181   1HD1  LEU  27          1HD1      LEU  27 -12.341  -2.375   4.038
  182   2HD1  LEU  27          2HD1      LEU  27 -13.624  -3.588   4.122
  183   3HD1  LEU  27          3HD1      LEU  27 -13.278  -2.569   5.522
  184   1HD2  LEU  27          1HD2      LEU  27 -12.992   0.097   4.067
  185   2HD2  LEU  27          2HD2      LEU  27 -13.917  -0.209   5.539
  186   3HD2  LEU  27          3HD2      LEU  27 -14.702   0.524   4.140
  187    H    VAL  28           H        VAL  28 -10.670  -2.490   1.278
  188    HA   VAL  28           HA       VAL  28 -11.698  -4.463  -0.545
  189    HB   VAL  28           HB       VAL  28  -9.880  -3.393  -1.479
  190   1HG1  VAL  28          1HG1      VAL  28  -9.178  -2.118   0.396
  191   2HG1  VAL  28          2HG1      VAL  28  -7.760  -2.980  -0.214
  192   3HG1  VAL  28          3HG1      VAL  28  -8.594  -3.563   1.231
  193   1HG2  VAL  28          1HG2      VAL  28  -7.993  -4.960  -1.546
  194   2HG2  VAL  28          2HG2      VAL  28  -9.541  -5.799  -1.666
  195   3HG2  VAL  28          3HG2      VAL  28  -8.653  -5.802  -0.142
  196    H    ARG  29           H        ARG  29 -11.319  -6.661  -0.521
  197    HA   ARG  29           HA       ARG  29 -10.391  -7.762   2.028
  198   1HB   ARG  29          2HB       ARG  29 -12.799  -8.924   0.665
  199   2HB   ARG  29          1HB       ARG  29 -12.321  -9.034   2.354
  200   1HG   ARG  29          2HG       ARG  29 -12.916  -6.698   2.693
  201   2HG   ARG  29          1HG       ARG  29 -13.356  -6.551   0.989
  202   1HD   ARG  29          1HD       ARG  29 -14.662  -8.379   3.005
  203   2HD   ARG  29          2HD       ARG  29 -15.329  -6.863   2.401
  204    HE   ARG  29           HE       ARG  29 -14.815  -8.448   0.188
  205   1HH1  ARG  29          2HH1      ARG  29 -16.831  -8.565   3.027
  206   2HH1  ARG  29          1HH1      ARG  29 -18.074  -9.499   2.262
  207   1HH2  ARG  29          1HH2      ARG  29 -16.446  -9.676  -0.826
  208   2HH2  ARG  29          2HH2      ARG  29 -17.855 -10.129   0.072
  209    HA   PRO  30           HA       PRO  30  -8.765  -9.727  -1.790
  210   1HB   PRO  30          2HB       PRO  30  -6.167  -9.213  -1.497
  211   2HB   PRO  30          1HB       PRO  30  -7.309  -7.927  -1.908
  212   1HG   PRO  30          2HG       PRO  30  -6.003  -8.547   0.698
  213   2HG   PRO  30          1HG       PRO  30  -6.428  -6.976   0.001
  214   1HD   PRO  30          1HD       PRO  30  -7.906  -8.411   1.920
  215   2HD   PRO  30          2HD       PRO  30  -8.465  -7.004   0.998
  216    H    LYS  31           H        LYS  31  -7.650 -11.642  -2.282
  217    HA   LYS  31           HA       LYS  31  -7.302 -13.639  -0.346
  218   1HB   LYS  31          1HB       LYS  31  -5.932 -13.362  -3.031
  219   2HB   LYS  31          2HB       LYS  31  -6.034 -14.838  -2.081
  220   1HG   LYS  31          1HG       LYS  31  -8.389 -13.351  -3.225
  221   2HG   LYS  31          2HG       LYS  31  -7.643 -14.785  -3.932
  222   1HD   LYS  31          1HD       LYS  31  -8.190 -16.062  -1.918
  223   2HD   LYS  31          2HD       LYS  31  -8.934 -14.627  -1.209
  224   1HE   LYS  31          1HE       LYS  31 -10.564 -14.577  -3.035
  225   2HE   LYS  31          2HE       LYS  31  -9.824 -16.017  -3.733
  226   1HZ   LYS  31          1HZ       LYS  31 -11.121 -15.862  -1.066
  227   2HZ   LYS  31          2HZ       LYS  31 -10.411 -17.243  -1.736
  228   3HZ   LYS  31          3HZ       LYS  31 -11.789 -16.571  -2.449
  229    HA   PRO  32           HA       PRO  32  -3.679 -12.846   1.920
  230   1HB   PRO  32          1HB       PRO  32  -2.586 -15.446   0.941
  231   2HB   PRO  32          2HB       PRO  32  -2.735 -14.839   2.595
  232   1HG   PRO  32          1HG       PRO  32  -4.433 -16.664   1.671
  233   2HG   PRO  32          2HG       PRO  32  -5.000 -15.346   2.714
  234   1HD   PRO  32          2HD       PRO  32  -5.313 -15.703  -0.229
  235   2HD   PRO  32          1HD       PRO  32  -6.424 -14.973   0.944
  236    H    LEU  33           H        LEU  33  -2.983 -11.139   0.497
  237    HA   LEU  33           HA       LEU  33  -0.406 -11.734  -0.690
  238   1HB   LEU  33          2HB       LEU  33  -2.708 -10.594  -2.250
  239   2HB   LEU  33          1HB       LEU  33  -1.044 -10.319  -2.724
  240    HG   LEU  33           HG       LEU  33  -2.322 -13.044  -2.459
  241   1HD1  LEU  33          1HD2      LEU  33  -2.324 -13.084  -4.894
  242   2HD1  LEU  33          2HD2      LEU  33  -1.709 -11.431  -4.931
  243   3HD1  LEU  33          3HD2      LEU  33  -3.317 -11.759  -4.285
  244   1HD2  LEU  33          1HD1      LEU  33   0.075 -13.087  -2.094
  245   2HD2  LEU  33          2HD1      LEU  33   0.338 -12.170  -3.577
  246   3HD2  LEU  33          3HD1      LEU  33  -0.318 -13.806  -3.655
  247    H    LEU  34           H        LEU  34  -2.632  -9.634   0.799
  248    HA   LEU  34           HA       LEU  34  -0.535  -7.585   1.022
  249   1HB   LEU  34          1HB       LEU  34  -3.488  -7.012   1.224
  250   2HB   LEU  34          2HB       LEU  34  -2.174  -5.861   1.084
  251    HG   LEU  34           HG       LEU  34  -3.213  -7.694  -1.074
  252   1HD1  LEU  34          1HD1      LEU  34  -3.761  -5.602  -2.210
  253   2HD1  LEU  34          2HD1      LEU  34  -3.176  -4.692  -0.817
  254   3HD1  LEU  34          3HD1      LEU  34  -4.592  -5.733  -0.660
  255   1HD2  LEU  34          1HD2      LEU  34  -1.546  -6.743  -2.533
  256   2HD2  LEU  34          2HD2      LEU  34  -0.759  -7.503  -1.147
  257   3HD2  LEU  34          3HD2      LEU  34  -0.919  -5.748  -1.219
  258    H    LEU  35           H        LEU  35  -1.615 -10.056   2.502
  259    HA   LEU  35           HA       LEU  35  -2.210  -8.776   5.064
  260   1HB   LEU  35          1HB       LEU  35  -3.540 -11.320   4.242
  261   2HB   LEU  35          2HB       LEU  35  -4.051 -10.143   5.439
  262    HG   LEU  35           HG       LEU  35  -4.049  -8.733   3.033
  263   1HD1  LEU  35          1HD2      LEU  35  -3.841 -10.808   1.800
  264   2HD1  LEU  35          2HD2      LEU  35  -5.441 -10.099   1.562
  265   3HD1  LEU  35          3HD2      LEU  35  -5.238 -11.470   2.653
  266   1HD2  LEU  35          1HD1      LEU  35  -5.635  -8.776   5.048
  267   2HD2  LEU  35          2HD1      LEU  35  -6.495 -10.034   4.158
  268   3HD2  LEU  35          3HD1      LEU  35  -6.305  -8.425   3.456
  269    H    LYS  36           H        LYS  36  -1.155 -11.783   3.454
  270    HA   LYS  36           HA       LYS  36   0.672 -12.459   5.551
  271   1HB   LYS  36          1HB       LYS  36   0.571 -13.032   2.596
  272   2HB   LYS  36          2HB       LYS  36   1.955 -13.496   3.572
  273   1HG   LYS  36          1HG       LYS  36   0.473 -14.835   5.006
  274   2HG   LYS  36          2HG       LYS  36  -0.889 -14.399   3.969
  275   1HD   LYS  36          2HD       LYS  36   0.148 -15.499   2.081
  276   2HD   LYS  36          1HD       LYS  36   1.588 -15.848   3.040
  277   1HE   LYS  36          2HE       LYS  36   0.166 -17.817   2.863
  278   2HE   LYS  36          1HE       LYS  36   0.259 -17.255   4.531
  279   1HZ   LYS  36          1HZ       LYS  36  -1.998 -17.830   3.960
  280   2HZ   LYS  36          2HZ       LYS  36  -1.981 -16.765   2.647
  281   3HZ   LYS  36          3HZ       LYS  36  -1.890 -16.161   4.224
  282    H    LEU  37           H        LEU  37   0.295  -9.819   3.593
  283    HA   LEU  37           HA       LEU  37   3.095  -9.044   3.527
  284   1HB   LEU  37          1HB       LEU  37   1.297  -8.652   1.688
  285   2HB   LEU  37          2HB       LEU  37   0.719  -7.371   2.733
  286    HG   LEU  37           HG       LEU  37   2.146  -6.495   0.969
  287   1HD1  LEU  37          1HD1      LEU  37   3.605  -5.170   2.338
  288   2HD1  LEU  37          2HD1      LEU  37   3.509  -6.359   3.641
  289   3HD1  LEU  37          3HD1      LEU  37   2.080  -5.434   3.189
  290   1HD2  LEU  37          1HD2      LEU  37   4.517  -7.020   0.880
  291   2HD2  LEU  37          2HD2      LEU  37   3.543  -8.466   0.613
  292   3HD2  LEU  37          3HD2      LEU  37   4.316  -8.201   2.175
  293    H    LEU  38           H        LEU  38   0.104  -8.458   5.227
  294    HA   LEU  38           HA       LEU  38   1.271  -6.150   6.616
  295   1HB   LEU  38          1HB       LEU  38  -1.342  -6.774   5.533
  296   2HB   LEU  38          2HB       LEU  38  -1.444  -6.252   7.203
  297    HG   LEU  38           HG       LEU  38  -0.357  -4.158   6.665
  298   1HD1  LEU  38          1HD1      LEU  38   1.187  -4.973   4.954
  299   2HD1  LEU  38          2HD1      LEU  38   0.264  -3.585   4.376
  300   3HD1  LEU  38          3HD1      LEU  38  -0.165  -5.211   3.845
  301   1HD2  LEU  38          1HD2      LEU  38  -2.530  -4.821   4.684
  302   2HD2  LEU  38          2HD2      LEU  38  -2.043  -3.200   5.190
  303   3HD2  LEU  38          3HD2      LEU  38  -2.770  -4.306   6.356
  304    H    LYS  39           H        LYS  39  -0.913  -8.904   7.299
  305    HA   LYS  39           HA       LYS  39  -0.869  -8.739  10.068
  306   1HB   LYS  39          2HB       LYS  39  -0.996 -11.240   8.375
  307   2HB   LYS  39          1HB       LYS  39  -1.431 -11.140  10.076
  308   1HG   LYS  39          2HG       LYS  39  -3.209  -9.534   9.496
  309   2HG   LYS  39          1HG       LYS  39  -2.797  -9.730   7.792
  310   1HD   LYS  39          1HD       LYS  39  -3.559 -12.050   9.549
  311   2HD   LYS  39          2HD       LYS  39  -4.752 -11.102   8.659
  312   1HE   LYS  39          2HE       LYS  39  -4.240 -12.998   7.326
  313   2HE   LYS  39          1HE       LYS  39  -3.461 -11.610   6.571
  314   1HZ   LYS  39          1HZ       LYS  39  -2.072 -13.516   8.372
  315   2HZ   LYS  39          2HZ       LYS  39  -1.366 -12.276   7.463
  316   3HZ   LYS  39          3HZ       LYS  39  -2.046 -13.613   6.684
  317    H    SER  40           H        SER  40   1.625  -9.629   7.905
  318    HA   SER  40           HA       SER  40   3.249 -11.075   9.761
  319   1HB   SER  40          2HB       SER  40   3.580 -11.315   7.348
  320   2HB   SER  40          1HB       SER  40   4.005  -9.608   7.222
  321    HG   SER  40           HG       SER  40   5.811 -11.118   7.350
  322    H    VAL  41           H        VAL  41   3.158  -7.690   8.665
  323    HA   VAL  41           HA       VAL  41   5.430  -6.968  10.254
  324    HB   VAL  41           HB       VAL  41   5.120  -5.783   8.198
  325   1HG1  VAL  41          1HG1      VAL  41   2.440  -4.916   9.271
  326   2HG1  VAL  41          2HG1      VAL  41   2.717  -6.054   7.953
  327   3HG1  VAL  41          3HG1      VAL  41   3.173  -4.360   7.767
  328   1HG2  VAL  41          1HG2      VAL  41   5.341  -3.544   8.912
  329   2HG2  VAL  41          2HG2      VAL  41   5.967  -4.541  10.226
  330   3HG2  VAL  41          3HG2      VAL  41   4.355  -3.827  10.348
  331    H    GLY  42           H        GLY  42   1.964  -6.915  10.681
  332   1HA   GLY  42          1HA       GLY  42   2.046  -6.748  13.435
  333   2HA   GLY  42          2HA       GLY  42   1.940  -5.088  12.873
  334    H    ALA  43           H        ALA  43   0.331  -6.047  10.503
  335    HA   ALA  43           HA       ALA  43  -2.168  -5.344  11.511
  336   1HB   ALA  43          1HB       ALA  43  -1.520  -5.136   9.148
  337   2HB   ALA  43          2HB       ALA  43  -3.062  -5.970   9.346
  338   3HB   ALA  43          3HB       ALA  43  -1.602  -6.890   8.983
  339    H    GLN  44           H        GLN  44  -4.188  -6.704  11.287
  340    HA   GLN  44           HA       GLN  44  -4.125  -9.508  11.425
  341   1HB   GLN  44          2HB       GLN  44  -2.991  -9.048  13.589
  342   2HB   GLN  44          1HB       GLN  44  -4.414  -8.164  14.119
  343   1HG   GLN  44          1HG       GLN  44  -5.748 -10.200  13.941
  344   2HG   GLN  44          2HG       GLN  44  -4.321 -11.088  13.408
  345   1HE2  GLN  44          1HE2      GLN  44  -5.910  -9.550  16.087
  346   2HE2  GLN  44          2HE2      GLN  44  -4.914 -10.223  17.328
  347    H    LYS  45           H        LYS  45  -5.802  -8.619   9.912
  348    HA   LYS  45           HA       LYS  45  -8.372  -8.682  11.302
  349   1HB   LYS  45          2HB       LYS  45  -7.732  -6.664   9.142
  350   2HB   LYS  45          1HB       LYS  45  -9.285  -6.874   9.939
  351   1HG   LYS  45          1HG       LYS  45  -8.248  -6.228  12.077
  352   2HG   LYS  45          2HG       LYS  45  -6.726  -5.949  11.228
  353   1HD   LYS  45          2HD       LYS  45  -9.322  -4.534  10.624
  354   2HD   LYS  45          1HD       LYS  45  -8.019  -3.872  11.613
  355   1HE   LYS  45          1HE       LYS  45  -6.499  -3.995   9.708
  356   2HE   LYS  45          2HE       LYS  45  -7.789  -4.678   8.716
  357   1HZ   LYS  45          1HZ       LYS  45  -7.530  -2.312   8.321
  358   2HZ   LYS  45          2HZ       LYS  45  -7.805  -1.978   9.955
  359   3HZ   LYS  45          3HZ       LYS  45  -9.044  -2.633   9.007
  360    H    ASP  46           H        ASP  46 -10.190  -8.826   9.550
  361    HA   ASP  46           HA       ASP  46  -9.418 -10.947   7.702
  362   1HB   ASP  46          1HB       ASP  46 -11.867 -11.242   7.401
  363   2HB   ASP  46          2HB       ASP  46 -11.364 -11.381   9.082
  364    H    THR  47           H        THR  47 -10.229  -7.609   7.715
  365    HA   THR  47           HA       THR  47  -9.846  -7.554   4.808
  366    HB   THR  47           HB       THR  47 -11.579  -5.858   4.502
  367    HG1  THR  47           1HG      THR  47 -12.014  -6.264   7.285
  368   1HG2  THR  47          1HG2      THR  47 -12.699  -8.279   5.917
  369   2HG2  THR  47          2HG2      THR  47 -12.207  -8.223   4.223
  370   3HG2  THR  47          3HG2      THR  47 -13.558  -7.236   4.783
  371    H    TYR  48           H        TYR  48  -9.501  -5.214   4.074
  372    HA   TYR  48           HA       TYR  48  -8.353  -3.547   6.179
  373   1HB   TYR  48          2HB       TYR  48  -6.873  -4.502   3.740
  374   2HB   TYR  48          1HB       TYR  48  -6.376  -3.088   4.664
  375    HD1  TYR  48           1HD      TYR  48  -5.410  -3.295   6.828
  376    HD2  TYR  48           2HD      TYR  48  -6.727  -6.733   4.711
  377    HE1  TYR  48           1HE      TYR  48  -4.188  -4.739   8.421
  378    HE2  TYR  48           2HE      TYR  48  -5.503  -8.184   6.269
  379    HH   TYR  48           HH       TYR  48  -4.279  -7.080   9.222
  380    H    THR  49           H        THR  49  -7.663  -1.405   5.294
  381    HA   THR  49           HA       THR  49  -9.171  -0.654   2.894
  382    HB   THR  49           HB       THR  49  -9.995   1.362   3.816
  383    HG1  THR  49           1HG      THR  49  -8.553   0.791   6.212
  384   1HG2  THR  49          1HG2      THR  49 -10.320  -0.791   5.911
  385   2HG2  THR  49          2HG2      THR  49 -11.303  -0.598   4.459
  386   3HG2  THR  49          3HG2      THR  49 -11.352   0.627   5.727
  387    H    MET  50           H        MET  50  -8.369   1.377   1.922
  388    HA   MET  50           HA       MET  50  -5.731   0.838   1.265
  389   1HB   MET  50          1HB       MET  50  -7.652   3.013   0.610
  390   2HB   MET  50          2HB       MET  50  -5.963   3.239   0.170
  391   1HG   MET  50          2HG       MET  50  -6.165   0.920  -0.926
  392   2HG   MET  50          1HG       MET  50  -7.903   1.180  -0.797
  393   1HE   MET  50          1HE       MET  50  -4.534   2.498  -2.325
  394   2HE   MET  50          2HE       MET  50  -5.120   3.892  -1.420
  395   3HE   MET  50          3HE       MET  50  -5.075   3.940  -3.181
  396    H    LYS  51           H        LYS  51  -6.916   2.697   3.853
  397    HA   LYS  51           HA       LYS  51  -4.559   4.407   3.994
  398   1HB   LYS  51          1HB       LYS  51  -6.851   5.301   4.462
  399   2HB   LYS  51          2HB       LYS  51  -6.920   4.262   5.877
  400   1HG   LYS  51          2HG       LYS  51  -4.663   6.188   5.576
  401   2HG   LYS  51          1HG       LYS  51  -6.243   6.760   6.115
  402   1HD   LYS  51          2HD       LYS  51  -6.197   5.102   7.938
  403   2HD   LYS  51          1HD       LYS  51  -4.588   4.598   7.416
  404   1HE   LYS  51          2HE       LYS  51  -3.730   6.835   7.852
  405   2HE   LYS  51          1HE       LYS  51  -5.339   7.370   8.333
  406   1HZ   LYS  51          1HZ       LYS  51  -3.981   6.865  10.256
  407   2HZ   LYS  51          2HZ       LYS  51  -3.724   5.289   9.703
  408   3HZ   LYS  51          3HZ       LYS  51  -5.275   5.781  10.160
  409    H    GLU  52           H        GLU  52  -6.235   1.992   5.979
  410    HA   GLU  52           HA       GLU  52  -4.400   1.574   7.987
  411   1HB   GLU  52          2HB       GLU  52  -6.680   0.363   7.270
  412   2HB   GLU  52          1HB       GLU  52  -5.541  -0.840   6.682
  413   1HG   GLU  52          1HG       GLU  52  -6.277  -1.381   8.922
  414   2HG   GLU  52          2HG       GLU  52  -4.555  -1.010   8.905
  415    H    VAL  53           H        VAL  53  -4.500  -0.076   4.836
  416    HA   VAL  53           HA       VAL  53  -1.924  -1.275   5.247
  417    HB   VAL  53           HB       VAL  53  -3.490  -2.565   4.012
  418   1HG1  VAL  53          1HG1      VAL  53  -5.013  -0.947   3.218
  419   2HG1  VAL  53          2HG1      VAL  53  -4.359  -1.756   1.793
  420   3HG1  VAL  53          3HG1      VAL  53  -3.776  -0.152   2.244
  421   1HG2  VAL  53          1HG2      VAL  53  -2.322  -2.975   1.894
  422   2HG2  VAL  53          2HG2      VAL  53  -1.203  -2.794   3.246
  423   3HG2  VAL  53          3HG2      VAL  53  -1.430  -1.468   2.106
  424    H    LEU  54           H        LEU  54  -3.052   1.707   3.924
  425    HA   LEU  54           HA       LEU  54  -0.996   2.497   2.261
  426   1HB   LEU  54          2HB       LEU  54  -3.015   3.844   3.135
  427   2HB   LEU  54          1HB       LEU  54  -1.982   4.265   4.484
  428    HG   LEU  54           HG       LEU  54  -1.159   4.794   1.639
  429   1HD1  LEU  54          1HD2      LEU  54  -3.302   5.893   1.988
  430   2HD1  LEU  54          2HD2      LEU  54  -1.994   7.073   1.917
  431   3HD1  LEU  54          3HD2      LEU  54  -2.696   6.626   3.472
  432   1HD2  LEU  54          1HD1      LEU  54  -0.338   6.008   4.273
  433   2HD2  LEU  54          2HD1      LEU  54   0.268   6.481   2.685
  434   3HD2  LEU  54          3HD1      LEU  54   0.605   4.868   3.313
  435    H    PHE  55           H        PHE  55  -1.009   3.231   5.753
  436    HA   PHE  55           HA       PHE  55   1.808   3.634   5.780
  437   1HB   PHE  55          2HB       PHE  55   1.560   3.843   8.225
  438   2HB   PHE  55          1HB       PHE  55   0.390   4.826   7.355
  439    HD1  PHE  55           1HD      PHE  55   0.816   1.700   9.279
  440    HD2  PHE  55           2HD      PHE  55  -1.920   4.529   7.661
  441    HE1  PHE  55           1HE      PHE  55  -1.005   0.677  10.580
  442    HE2  PHE  55           2HE      PHE  55  -3.745   3.508   8.958
  443    HZ   PHE  55           HZ       PHE  55  -3.289   1.581  10.420
  444    H    TYR  56           H        TYR  56  -0.278   0.911   6.492
  445    HA   TYR  56           HA       TYR  56   1.543  -0.588   8.020
  446   1HB   TYR  56          1HB       TYR  56  -1.079  -0.960   6.955
  447   2HB   TYR  56          2HB       TYR  56  -0.114  -2.389   6.596
  448    HD1  TYR  56           1HD      TYR  56   1.671  -2.417   8.989
  449    HD2  TYR  56           2HD      TYR  56  -2.515  -1.723   8.637
  450    HE1  TYR  56           1HE      TYR  56   1.352  -3.218  11.291
  451    HE2  TYR  56           2HE      TYR  56  -2.850  -2.513  10.936
  452    HH   TYR  56           HH       TYR  56  -0.284  -2.976  13.116
  453    H    LEU  57           H        LEU  57   0.597  -1.129   4.616
  454    HA   LEU  57           HA       LEU  57   2.647  -2.890   3.964
  455   1HB   LEU  57          2HB       LEU  57   0.581  -1.840   2.596
  456   2HB   LEU  57          1HB       LEU  57   1.882  -0.879   1.921
  457    HG   LEU  57           HG       LEU  57   1.850  -3.898   1.941
  458   1HD1  LEU  57          1HD2      LEU  57   1.281  -3.754  -0.421
  459   2HD1  LEU  57          2HD2      LEU  57   1.154  -1.999  -0.293
  460   3HD1  LEU  57          3HD2      LEU  57   0.021  -3.032   0.579
  461   1HD2  LEU  57          1HD1      LEU  57   4.075  -2.848   1.842
  462   2HD2  LEU  57          2HD1      LEU  57   3.569  -1.959   0.404
  463   3HD2  LEU  57          3HD1      LEU  57   3.666  -3.720   0.366
  464    H    GLY  58           H        GLY  58   2.614   0.627   4.144
  465   1HA   GLY  58          2HA       GLY  58   5.193   1.229   3.307
  466   2HA   GLY  58          1HA       GLY  58   4.357   2.046   4.619
  467    H    GLN  59           H        GLN  59   4.151   0.106   6.537
  468    HA   GLN  59           HA       GLN  59   6.657   0.088   7.747
  469   1HB   GLN  59          2HB       GLN  59   4.631  -2.038   8.338
  470   2HB   GLN  59          1HB       GLN  59   5.684  -1.172   9.448
  471   1HG   GLN  59          1HG       GLN  59   3.339   0.026   7.998
  472   2HG   GLN  59          2HG       GLN  59   3.324  -0.539   9.658
  473   1HE2  GLN  59          1HE2      GLN  59   6.048   0.408  10.161
  474   2HE2  GLN  59          2HE2      GLN  59   5.930   2.123  10.325
  475    H    TYR  60           H        TYR  60   4.982  -2.561   6.028
  476    HA   TYR  60           HA       TYR  60   6.856  -4.524   6.678
  477   1HB   TYR  60          1HB       TYR  60   4.563  -4.968   5.804
  478   2HB   TYR  60          2HB       TYR  60   5.116  -4.475   4.205
  479    HD1  TYR  60           1HD      TYR  60   6.254  -5.980   2.800
  480    HD2  TYR  60           2HD      TYR  60   5.625  -6.982   6.883
  481    HE1  TYR  60           1HE      TYR  60   7.032  -8.265   2.352
  482    HE2  TYR  60           2HE      TYR  60   6.401  -9.272   6.448
  483    HH   TYR  60           HH       TYR  60   6.609 -10.817   4.546
  484    H    ILE  61           H        ILE  61   6.632  -2.474   3.789
  485    HA   ILE  61           HA       ILE  61   8.825  -3.413   2.365
  486    HB   ILE  61           HB       ILE  61   8.124  -0.494   2.662
  487   1HG1  ILE  61          1HG1      ILE  61   6.961  -2.334   0.586
  488   2HG1  ILE  61          2HG1      ILE  61   6.170  -2.091   2.142
  489   1HG2  ILE  61          1HG2      ILE  61   8.908  -0.398   0.305
  490   2HG2  ILE  61          2HG2      ILE  61   9.416  -2.081   0.453
  491   3HG2  ILE  61          3HG2      ILE  61  10.168  -0.842   1.460
  492   1HD1  ILE  61          1HD1      ILE  61   6.166   0.353   1.664
  493   2HD1  ILE  61          2HD1      ILE  61   5.170  -0.618   0.577
  494   3HD1  ILE  61          3HD1      ILE  61   6.744  -0.026   0.042
  495    H    MET  62           H        MET  62   8.811  -0.626   4.577
  496    HA   MET  62           HA       MET  62  11.534  -0.241   4.803
  497   1HB   MET  62          2HB       MET  62   9.490   0.104   7.002
  498   2HB   MET  62          1HB       MET  62  11.072   0.868   6.930
  499   1HG   MET  62          1HG       MET  62  10.397   2.065   4.906
  500   2HG   MET  62          2HG       MET  62   8.806   1.311   5.002
  501   1HE   MET  62          1HE       MET  62  11.029   2.615   7.980
  502   2HE   MET  62          2HE       MET  62  10.437   4.267   8.149
  503   3HE   MET  62          3HE       MET  62  11.327   3.792   6.702
  504    H    THR  63           H        THR  63   9.534  -2.654   6.373
  505    HA   THR  63           HA       THR  63  11.675  -3.451   8.169
  506    HB   THR  63           HB       THR  63  10.091  -5.112   9.041
  507    HG1  THR  63           1HG      THR  63   8.942  -5.469   7.059
  508   1HG2  THR  63          1HG2      THR  63   8.924  -2.342   8.761
  509   2HG2  THR  63          2HG2      THR  63  10.062  -2.874   9.998
  510   3HG2  THR  63          3HG2      THR  63   8.430  -3.540   9.956
  511    H    LYS  64           H        LYS  64  12.079  -5.880   8.361
  512    HA   LYS  64           HA       LYS  64  13.024  -7.745   7.469
  513   1HB   LYS  64          2HB       LYS  64  10.852  -7.358   5.401
  514   2HB   LYS  64          1HB       LYS  64  11.801  -8.825   5.604
  515   1HG   LYS  64          2HG       LYS  64   9.994  -7.635   7.700
  516   2HG   LYS  64          1HG       LYS  64   9.568  -8.970   6.627
  517   1HD   LYS  64          1HD       LYS  64  11.405 -10.299   7.555
  518   2HD   LYS  64          2HD       LYS  64  11.825  -8.963   8.631
  519   1HE   LYS  64          2HE       LYS  64   9.635  -9.124   9.695
  520   2HE   LYS  64          1HE       LYS  64   9.199 -10.446   8.612
  521   1HZ   LYS  64          1HZ       LYS  64  10.986 -11.764   9.556
  522   2HZ   LYS  64          2HZ       LYS  64   9.918 -11.265  10.767
  523   3HZ   LYS  64          3HZ       LYS  64  11.414 -10.496  10.590
  524    H    ARG  65           H        ARG  65  13.760  -4.968   6.463
  525    HA   ARG  65           HA       ARG  65  15.150  -4.033   4.888
  526   1HB   ARG  65          1HB       ARG  65  17.305  -5.231   4.779
  527   2HB   ARG  65          2HB       ARG  65  16.672  -5.124   6.415
  528   1HG   ARG  65          1HG       ARG  65  15.898  -7.431   6.279
  529   2HG   ARG  65          2HG       ARG  65  16.509  -7.541   4.626
  530   1HD   ARG  65          2HD       ARG  65  18.160  -7.022   7.096
  531   2HD   ARG  65          1HD       ARG  65  18.064  -8.547   6.217
  532    HE   ARG  65           HE       ARG  65  18.853  -6.516   4.447
  533   1HH1  ARG  65          2HH1      ARG  65  20.064  -8.314   7.174
  534   2HH1  ARG  65          1HH1      ARG  65  21.722  -8.175   6.693
  535   1HH2  ARG  65          1HH2      ARG  65  21.032  -6.327   3.807
  536   2HH2  ARG  65          2HH2      ARG  65  22.273  -7.045   4.781
  537    H    LEU  66           H        LEU  66  13.129  -4.877   3.395
  538    HA   LEU  66           HA       LEU  66  14.265  -6.329   1.133
  539   1HB   LEU  66          1HB       LEU  66  11.557  -5.456   1.940
  540   2HB   LEU  66          2HB       LEU  66  11.880  -5.445   0.218
  541    HG   LEU  66           HG       LEU  66  10.877  -7.534   0.706
  542   1HD1  LEU  66          1HD1      LEU  66  12.751  -7.673  -0.834
  543   2HD1  LEU  66          2HD1      LEU  66  12.624  -9.145   0.129
  544   3HD1  LEU  66          3HD1      LEU  66  13.856  -7.942   0.514
  545   1HD2  LEU  66          1HD2      LEU  66  11.229  -7.504   3.132
  546   2HD2  LEU  66          2HD2      LEU  66  12.925  -7.923   2.880
  547   3HD2  LEU  66          3HD2      LEU  66  11.658  -9.059   2.415
  548    H    TYR  67           H        TYR  67  13.840  -3.123   2.258
  549    HA   TYR  67           HA       TYR  67  13.717  -1.788  -0.247
  550   1HB   TYR  67          2HB       TYR  67  14.116   0.239   1.004
  551   2HB   TYR  67          1HB       TYR  67  13.003  -0.777   1.914
  552    HD1  TYR  67           1HD      TYR  67  13.817  -2.005   3.925
  553    HD2  TYR  67           2HD      TYR  67  16.239   0.836   1.886
  554    HE1  TYR  67           1HE      TYR  67  15.289  -1.858   5.889
  555    HE2  TYR  67           2HE      TYR  67  17.717   0.991   3.840
  556    HH   TYR  67           HH       TYR  67  17.607  -1.222   6.410
  557    H    ASP  68           H        ASP  68  15.523  -0.012  -0.633
  558    HA   ASP  68           HA       ASP  68  17.789  -1.366  -1.566
  559   1HB   ASP  68          2HB       ASP  68  17.147   0.666  -2.642
  560   2HB   ASP  68          1HB       ASP  68  17.244   1.578  -1.138
  561    H    GLU  69           H        GLU  69  18.404   1.444   0.429
  562    HA   GLU  69           HA       GLU  69  19.333   0.269   2.762
  563   1HB   GLU  69          2HB       GLU  69  21.779   0.263   2.403
  564   2HB   GLU  69          1HB       GLU  69  20.957  -0.924   1.400
  565   1HG   GLU  69          2HG       GLU  69  21.101   0.596  -0.511
  566   2HG   GLU  69          1HG       GLU  69  21.940   1.773   0.496
  567    H    LYS  70           H        LYS  70  19.687   2.758   0.349
  568    HA   LYS  70           HA       LYS  70  19.991   4.729   2.516
  569   1HB   LYS  70          1HB       LYS  70  21.248   4.835  -0.233
  570   2HB   LYS  70          2HB       LYS  70  21.277   6.150   0.934
  571   1HG   LYS  70          1HG       LYS  70  22.522   4.718   2.492
  572   2HG   LYS  70          2HG       LYS  70  22.529   3.435   1.282
  573   1HD   LYS  70          1HD       LYS  70  23.774   4.864  -0.250
  574   2HD   LYS  70          2HD       LYS  70  23.740   6.175   0.932
  575   1HE   LYS  70          1HE       LYS  70  25.885   5.027   0.978
  576   2HE   LYS  70          2HE       LYS  70  25.019   4.799   2.497
  577   1HZ   LYS  70          1HZ       LYS  70  24.328   2.611   1.730
  578   2HZ   LYS  70          2HZ       LYS  70  26.016   2.740   1.738
  579   3HZ   LYS  70          3HZ       LYS  70  25.168   2.831   0.278
  580    H    GLN  71           H        GLN  71  19.307   4.709  -0.989
  581    HA   GLN  71           HA       GLN  71  16.935   6.312  -0.662
  582   1HB   GLN  71          1HB       GLN  71  17.895   4.667  -3.013
  583   2HB   GLN  71          2HB       GLN  71  16.540   5.787  -3.046
  584   1HG   GLN  71          2HG       GLN  71  18.057   7.635  -2.539
  585   2HG   GLN  71          1HG       GLN  71  19.414   6.509  -2.521
  586   1HE2  GLN  71          2HE2      GLN  71  20.140   5.621  -4.454
  587   2HE2  GLN  71          1HE2      GLN  71  19.717   6.292  -5.990
  588    H    GLN  72           H        GLN  72  16.024   4.947   1.043
  589    HA   GLN  72           HA       GLN  72  15.564   2.221   0.840
  590   1HB   GLN  72          2HB       GLN  72  13.865   4.241   2.314
  591   2HB   GLN  72          1HB       GLN  72  13.931   2.514   2.632
  592   1HG   GLN  72          2HG       GLN  72  16.289   2.728   3.261
  593   2HG   GLN  72          1HG       GLN  72  16.198   4.464   2.971
  594   1HE2  GLN  72          2HE2      GLN  72  15.048   5.765   4.396
  595   2HE2  GLN  72          1HE2      GLN  72  14.592   5.224   5.972
  596    H    HIS  73           H        HIS  73  14.004   4.771  -0.804
  597    HA   HIS  73           HA       HIS  73  11.512   3.407  -1.254
  598   1HB   HIS  73          1HB       HIS  73  10.982   5.252  -2.742
  599   2HB   HIS  73          2HB       HIS  73  11.673   5.879  -1.249
  600    HD1  HIS  73           1HD      HIS  73  11.880   6.319  -4.768
  601    HD2  HIS  73           2HD      HIS  73  14.636   6.365  -1.660
  602    HE1  HIS  73           1HE      HIS  73  13.875   7.564  -5.657
  603    HE2  HIS  73           2HE      HIS  73  15.565   7.497  -3.790
  604    H    ILE  74           H        ILE  74  14.401   2.465  -2.214
  605    HA   ILE  74           HA       ILE  74  13.281   1.438  -4.742
  606    HB   ILE  74           HB       ILE  74  16.218   1.333  -4.119
  607   1HG1  ILE  74          2HG1      ILE  74  15.615   3.696  -4.001
  608   2HG1  ILE  74          1HG1      ILE  74  16.504   3.371  -5.487
  609   1HG2  ILE  74          1HG2      ILE  74  16.406   1.136  -6.543
  610   2HG2  ILE  74          2HG2      ILE  74  14.658   1.310  -6.701
  611   3HG2  ILE  74          3HG2      ILE  74  15.334  -0.105  -5.892
  612   1HD1  ILE  74          1HD1      ILE  74  13.511   3.609  -5.292
  613   2HD1  ILE  74          2HD1      ILE  74  14.463   3.416  -6.764
  614   3HD1  ILE  74          3HD1      ILE  74  14.603   4.894  -5.812
  615    H    VAL  75           H        VAL  75  12.266  -0.363  -4.030
  616    HA   VAL  75           HA       VAL  75  13.489  -1.871  -1.850
  617    HB   VAL  75           HB       VAL  75  10.758  -2.441  -2.928
  618   1HG1  VAL  75          1HG1      VAL  75  11.626  -3.898  -1.204
  619   2HG1  VAL  75          2HG1      VAL  75  10.306  -2.925  -0.556
  620   3HG1  VAL  75          3HG1      VAL  75  11.976  -2.512  -0.170
  621   1HG2  VAL  75          1HG2      VAL  75  10.796  -0.038  -2.767
  622   2HG2  VAL  75          2HG2      VAL  75  11.484  -0.122  -1.144
  623   3HG2  VAL  75          3HG2      VAL  75   9.842  -0.699  -1.437
  624    H    TYR  76           H        TYR  76  15.002  -3.165  -2.858
  625    HA   TYR  76           HA       TYR  76  14.459  -4.760  -5.137
  626   1HB   TYR  76          1HB       TYR  76  16.533  -5.408  -3.053
  627   2HB   TYR  76          2HB       TYR  76  16.584  -5.727  -4.784
  628    HD1  TYR  76           1HD      TYR  76  15.742  -3.029  -5.795
  629    HD2  TYR  76           2HD      TYR  76  18.485  -4.142  -2.737
  630    HE1  TYR  76           1HE      TYR  76  16.979  -0.930  -6.140
  631    HE2  TYR  76           2HE      TYR  76  19.725  -2.050  -3.077
  632    HH   TYR  76           HH       TYR  76  20.063  -0.374  -4.843
  633    H    CYS  77           H        CYS  77  13.337  -6.586  -5.302
  634    HA   CYS  77           HA       CYS  77  12.691  -8.031  -2.816
  635   1HB   CYS  77          2HB       CYS  77  10.839  -7.511  -5.151
  636   2HB   CYS  77          1HB       CYS  77  10.435  -8.410  -3.693
  637    HG   CYS  77           HG       CYS  77   9.973  -5.285  -4.244
  638    H    SER  78           H        SER  78  11.340  -9.033  -5.835
  639    HA   SER  78           HA       SER  78  11.535 -10.942  -7.044
  640   1HB   SER  78          1HB       SER  78  13.628  -9.827  -7.734
  641   2HB   SER  78          2HB       SER  78  14.478 -10.636  -6.419
  642    HG   SER  78           HG       SER  78  13.088 -12.409  -7.912
  643    H    ASN  79           H        ASN  79  11.697 -10.972  -3.883
  644    HA   ASN  79           HA       ASN  79  11.303 -13.722  -3.569
  645   1HB   ASN  79          2HB       ASN  79  13.719 -13.902  -4.001
  646   2HB   ASN  79          1HB       ASN  79  14.041 -12.790  -2.672
  647   1HD2  ASN  79          1HD2      ASN  79  15.272 -14.284  -1.561
  648   2HD2  ASN  79          2HD2      ASN  79  14.576 -15.649  -0.764
  649    H    ASP  80           H        ASP  80   9.572 -12.506  -2.509
  650    HA   ASP  80           HA       ASP  80   9.764 -12.374   0.283
  651   1HB   ASP  80          1HB       ASP  80   9.650  -9.924   0.626
  652   2HB   ASP  80          2HB       ASP  80  11.188 -10.436  -0.061
  653    H    LEU  81           H        LEU  81   7.814 -11.321   1.275
  654    HA   LEU  81           HA       LEU  81   5.439 -12.013  -0.062
  655   1HB   LEU  81          1HB       LEU  81   6.000 -10.312   2.354
  656   2HB   LEU  81          2HB       LEU  81   4.369 -10.539   1.752
  657    HG   LEU  81           HG       LEU  81   4.801 -12.061   3.589
  658   1HD1  LEU  81          1HD1      LEU  81   3.329 -12.840   1.821
  659   2HD1  LEU  81          2HD1      LEU  81   4.251 -14.182   2.500
  660   3HD1  LEU  81          3HD1      LEU  81   4.710 -13.497   0.941
  661   1HD2  LEU  81          1HD2      LEU  81   6.495 -13.817   3.425
  662   2HD2  LEU  81          2HD2      LEU  81   7.220 -12.210   3.414
  663   3HD2  LEU  81          3HD2      LEU  81   7.068 -13.120   1.910
  664    H    LEU  82           H        LEU  82   7.296  -9.064   0.047
  665    HA   LEU  82           HA       LEU  82   5.339  -7.389  -1.162
  666   1HB   LEU  82          1HB       LEU  82   8.299  -7.233  -0.767
  667   2HB   LEU  82          2HB       LEU  82   7.512  -6.099  -1.846
  668    HG   LEU  82           HG       LEU  82   6.871  -6.479   1.082
  669   1HD1  LEU  82          1HD1      LEU  82   7.830  -4.239   1.333
  670   2HD1  LEU  82          2HD1      LEU  82   8.279  -4.244  -0.372
  671   3HD1  LEU  82          3HD1      LEU  82   9.020  -5.397   0.738
  672   1HD2  LEU  82          1HD2      LEU  82   4.959  -5.839  -0.443
  673   2HD2  LEU  82          2HD2      LEU  82   5.849  -4.352  -0.784
  674   3HD2  LEU  82          3HD2      LEU  82   5.322  -4.705   0.862
  675    H    GLY  83           H        GLY  83   7.543  -9.781  -2.351
  676   1HA   GLY  83          2HA       GLY  83   7.243  -9.111  -5.128
  677   2HA   GLY  83          1HA       GLY  83   7.801 -10.649  -4.478
  678    H    ASP  84           H        ASP  84   5.439 -10.995  -2.786
  679    HA   ASP  84           HA       ASP  84   3.593 -12.127  -4.615
  680   1HB   ASP  84          2HB       ASP  84   3.285 -11.437  -1.685
  681   2HB   ASP  84          1HB       ASP  84   2.114 -12.365  -2.619
  682    H    LEU  85           H        LEU  85   3.990  -8.938  -3.321
  683    HA   LEU  85           HA       LEU  85   1.458  -7.860  -3.853
  684   1HB   LEU  85          1HB       LEU  85   4.174  -6.593  -4.140
  685   2HB   LEU  85          2HB       LEU  85   2.663  -5.715  -4.246
  686    HG   LEU  85           HG       LEU  85   4.081  -6.766  -1.874
  687   1HD1  LEU  85          1HD2      LEU  85   3.186  -4.715  -0.896
  688   2HD1  LEU  85          2HD2      LEU  85   2.255  -4.417  -2.365
  689   3HD1  LEU  85          3HD2      LEU  85   4.017  -4.388  -2.416
  690   1HD2  LEU  85          1HD1      LEU  85   2.022  -6.850  -0.544
  691   2HD2  LEU  85          2HD1      LEU  85   2.045  -8.099  -1.788
  692   3HD2  LEU  85          3HD1      LEU  85   1.069  -6.648  -2.014
  693    H    PHE  86           H        PHE  86   4.311  -7.441  -5.915
  694    HA   PHE  86           HA       PHE  86   2.613  -7.962  -8.265
  695   1HB   PHE  86          2HB       PHE  86   4.686  -6.381  -9.210
  696   2HB   PHE  86          1HB       PHE  86   3.027  -5.864  -8.932
  697    HD1  PHE  86           1HD      PHE  86   2.825  -3.878  -7.833
  698    HD2  PHE  86           2HD      PHE  86   6.075  -6.440  -6.839
  699    HE1  PHE  86           1HE      PHE  86   3.617  -2.224  -6.189
  700    HE2  PHE  86           2HE      PHE  86   6.868  -4.799  -5.187
  701    HZ   PHE  86           HZ       PHE  86   5.639  -2.691  -4.859
  702    H    GLY  87           H        GLY  87   6.001  -7.840  -7.159
  703   1HA   GLY  87          2HA       GLY  87   7.276  -9.953  -7.337
  704   2HA   GLY  87          1HA       GLY  87   6.530 -10.159  -8.913
  705    H    VAL  88           H        VAL  88   7.737  -7.098  -7.702
  706    HA   VAL  88           HA       VAL  88   9.393  -6.823 -10.054
  707    HB   VAL  88           HB       VAL  88   9.786  -4.552  -9.322
  708   1HG1  VAL  88          1HG2      VAL  88   7.672  -4.979 -10.433
  709   2HG1  VAL  88          2HG2      VAL  88   7.474  -3.727  -9.206
  710   3HG1  VAL  88          3HG2      VAL  88   6.916  -5.369  -8.888
  711   1HG2  VAL  88          1HG1      VAL  88  10.088  -4.997  -6.937
  712   2HG2  VAL  88          2HG1      VAL  88   8.361  -5.317  -6.774
  713   3HG2  VAL  88          3HG1      VAL  88   8.922  -3.701  -7.203
  714    HA   PRO  89           HA       PRO  89  13.315  -7.555  -7.924
  715   1HB   PRO  89          2HB       PRO  89  14.968  -6.229  -9.578
  716   2HB   PRO  89          1HB       PRO  89  14.235  -7.771 -10.037
  717   1HG   PRO  89          2HG       PRO  89  13.436  -4.987 -10.797
  718   2HG   PRO  89          1HG       PRO  89  13.521  -6.441 -11.807
  719   1HD   PRO  89          1HD       PRO  89  11.196  -5.466 -10.734
  720   2HD   PRO  89          2HD       PRO  89  11.456  -7.175 -11.136
  721    H    SER  90           H        SER  90  11.818  -4.543  -8.526
  722    HA   SER  90           HA       SER  90  12.651  -3.452  -6.067
  723   1HB   SER  90          2HB       SER  90  13.887  -1.470  -6.955
  724   2HB   SER  90          1HB       SER  90  14.762  -2.990  -7.134
  725    HG   SER  90           HG       SER  90  13.169  -2.418  -9.276
  726    H    PHE  91           H        PHE  91  11.231  -1.854  -5.446
  727    HA   PHE  91           HA       PHE  91   9.679  -0.551  -7.569
  728   1HB   PHE  91          1HB       PHE  91   7.581  -0.890  -6.465
  729   2HB   PHE  91          2HB       PHE  91   8.356  -2.454  -6.664
  730    HD1  PHE  91           1HD      PHE  91   7.427   0.144  -4.227
  731    HD2  PHE  91           2HD      PHE  91   8.976  -3.781  -4.793
  732    HE1  PHE  91           1HE      PHE  91   7.086  -0.326  -1.842
  733    HE2  PHE  91           2HE      PHE  91   8.644  -4.256  -2.401
  734    HZ   PHE  91           HZ       PHE  91   7.696  -2.529  -0.923
  735    H    SER  92           H        SER  92   8.867   1.491  -7.107
  736    HA   SER  92           HA       SER  92  10.328   2.832  -4.958
  737   1HB   SER  92          1HB       SER  92  10.714   3.767  -7.149
  738   2HB   SER  92          2HB       SER  92   8.979   3.915  -7.439
  739    HG   SER  92           HG       SER  92   9.617   5.901  -6.789
  740    H    VAL  93           H        VAL  93   9.115   2.604  -3.149
  741    HA   VAL  93           HA       VAL  93   6.316   2.912  -2.980
  742    HB   VAL  93           HB       VAL  93   7.750   1.865  -1.222
  743   1HG1  VAL  93          1HG1      VAL  93   8.837   3.341   0.423
  744   2HG1  VAL  93          2HG1      VAL  93   8.475   4.725  -0.610
  745   3HG1  VAL  93          3HG1      VAL  93   9.565   3.461  -1.180
  746   1HG2  VAL  93          1HG2      VAL  93   5.452   2.487  -0.730
  747   2HG2  VAL  93          2HG2      VAL  93   5.968   4.118  -0.301
  748   3HG2  VAL  93          3HG2      VAL  93   6.475   2.746   0.682
  749    H    LYS  94           H        LYS  94   8.895   5.179  -3.253
  750    HA   LYS  94           HA       LYS  94   7.706   7.433  -2.065
  751   1HB   LYS  94          2HB       LYS  94  10.105   7.266  -2.663
  752   2HB   LYS  94          1HB       LYS  94   9.668   7.350  -4.364
  753   1HG   LYS  94          2HG       LYS  94   8.735   9.585  -4.011
  754   2HG   LYS  94          1HG       LYS  94   9.196   9.500  -2.309
  755   1HD   LYS  94          1HD       LYS  94  11.547   9.287  -2.958
  756   2HD   LYS  94          2HD       LYS  94  11.085   9.375  -4.659
  757   1HE   LYS  94          1HE       LYS  94  11.893  11.530  -3.865
  758   2HE   LYS  94          2HE       LYS  94  10.188  11.617  -4.306
  759   1HZ   LYS  94          1HZ       LYS  94  11.243  11.348  -1.543
  760   2HZ   LYS  94          2HZ       LYS  94   9.609  11.440  -1.968
  761   3HZ   LYS  94          3HZ       LYS  94  10.625  12.767  -2.229
  762    H    GLU  95           H        GLU  95   7.181   5.859  -5.098
  763    HA   GLU  95           HA       GLU  95   5.887   8.060  -6.394
  764   1HB   GLU  95          1HB       GLU  95   5.756   5.095  -6.976
  765   2HB   GLU  95          2HB       GLU  95   5.141   6.364  -8.027
  766   1HG   GLU  95          1HG       GLU  95   8.017   5.974  -7.232
  767   2HG   GLU  95          2HG       GLU  95   7.301   5.535  -8.782
  768    H    HIS  96           H        HIS  96   4.817   5.241  -4.561
  769    HA   HIS  96           HA       HIS  96   2.928   4.828  -3.380
  770   1HB   HIS  96          1HB       HIS  96   2.444   7.779  -3.820
  771   2HB   HIS  96          2HB       HIS  96   1.472   6.762  -2.763
  772    HD1  HIS  96           1HD      HIS  96   4.608   8.679  -2.897
  773    HD2  HIS  96           2HD      HIS  96   2.865   5.822  -0.434
  774    HE1  HIS  96           1HE      HIS  96   5.927   8.742  -0.757
  775    HE2  HIS  96           2HE      HIS  96   4.908   6.945   0.686
  776    H    ARG  97           H        ARG  97   1.587   7.303  -5.556
  777    HA   ARG  97           HA       ARG  97  -0.779   6.074  -6.138
  778   1HB   ARG  97          1HB       ARG  97  -0.208   8.353  -6.857
  779   2HB   ARG  97          2HB       ARG  97   0.904   7.701  -8.051
  780   1HG   ARG  97          1HG       ARG  97  -0.983   6.603  -9.182
  781   2HG   ARG  97          2HG       ARG  97  -2.082   7.327  -8.008
  782   1HD   ARG  97          1HD       ARG  97  -0.293   8.817  -9.925
  783   2HD   ARG  97          2HD       ARG  97  -2.038   8.618 -10.073
  784    HE   ARG  97           HE       ARG  97  -1.572   9.781  -7.603
  785   1HH1  ARG  97          2HH1      ARG  97  -1.072  10.570 -10.959
  786   2HH1  ARG  97          1HH1      ARG  97  -1.213  12.278 -10.712
  787   1HH2  ARG  97          1HH2      ARG  97  -1.760  12.028  -7.267
  788   2HH2  ARG  97          2HH2      ARG  97  -1.602  13.107  -8.613
  789    H    LYS  98           H        LYS  98   2.262   5.708  -7.947
  790    HA   LYS  98           HA       LYS  98   1.180   3.824  -9.783
  791   1HB   LYS  98          1HB       LYS  98   4.056   4.450  -9.102
  792   2HB   LYS  98          2HB       LYS  98   3.529   3.485 -10.474
  793   1HG   LYS  98          2HG       LYS  98   2.352   5.426 -11.386
  794   2HG   LYS  98          1HG       LYS  98   2.894   6.392 -10.013
  795   1HD   LYS  98          2HD       LYS  98   4.328   6.826 -11.901
  796   2HD   LYS  98          1HD       LYS  98   5.238   5.945 -10.673
  797   1HE   LYS  98          2HE       LYS  98   5.708   5.069 -12.896
  798   2HE   LYS  98          1HE       LYS  98   4.891   3.863 -11.903
  799   1HZ   LYS  98          1HZ       LYS  98   3.605   5.566 -13.967
  800   2HZ   LYS  98          2HZ       LYS  98   2.812   4.421 -13.009
  801   3HZ   LYS  98          3HZ       LYS  98   3.977   3.923 -14.130
  802    H    ILE  99           H        ILE  99   2.788   3.583  -6.696
  803    HA   ILE  99           HA       ILE  99   3.589   0.864  -6.999
  804    HB   ILE  99           HB       ILE  99   4.485   2.751  -5.378
  805   1HG1  ILE  99          2HG1      ILE  99   5.329   0.380  -5.768
  806   2HG1  ILE  99          1HG1      ILE  99   5.693   1.090  -4.200
  807   1HG2  ILE  99          1HG2      ILE  99   2.419   1.369  -3.693
  808   2HG2  ILE  99          2HG2      ILE  99   2.547   3.093  -4.045
  809   3HG2  ILE  99          3HG2      ILE  99   3.767   2.303  -3.042
  810   1HD1  ILE  99          1HD1      ILE  99   5.028  -1.220  -3.967
  811   2HD1  ILE  99          2HD1      ILE  99   3.505  -0.887  -4.789
  812   3HD1  ILE  99          3HD1      ILE  99   3.835  -0.160  -3.217
  813    H    TYR 100           H        TYR 100   0.777   2.446  -5.606
  814    HA   TYR 100           HA       TYR 100  -0.250  -0.058  -4.576
  815   1HB   TYR 100          2HB       TYR 100  -1.125   2.796  -4.452
  816   2HB   TYR 100          1HB       TYR 100  -2.305   1.527  -4.140
  817    HD1  TYR 100           1HD      TYR 100  -2.390   2.732  -1.858
  818    HD2  TYR 100           2HD      TYR 100   0.998   0.560  -3.243
  819    HE1  TYR 100           1HE      TYR 100  -1.577   2.531   0.456
  820    HE2  TYR 100           2HE      TYR 100   1.812   0.351  -0.942
  821    HH   TYR 100           HH       TYR 100  -0.099   1.064   1.767
  822    H    THR 101           H        THR 101  -0.573   1.902  -7.416
  823    HA   THR 101           HA       THR 101  -3.044   0.828  -8.327
  824    HB   THR 101           HB       THR 101  -0.786   2.124  -9.867
  825    HG1  THR 101           1HG      THR 101  -2.159   3.934  -9.777
  826   1HG2  THR 101          1HG2      THR 101  -2.114   0.696 -11.347
  827   2HG2  THR 101          2HG2      THR 101  -2.407   2.402 -11.686
  828   3HG2  THR 101          3HG2      THR 101  -3.592   1.468 -10.774
  829    H    MET 102           H        MET 102   0.326  -0.145  -8.677
  830    HA   MET 102           HA       MET 102  -0.370  -2.294 -10.490
  831   1HB   MET 102          1HB       MET 102   2.047  -2.883 -10.326
  832   2HB   MET 102          2HB       MET 102   1.747  -1.239 -10.874
  833   1HG   MET 102          1HG       MET 102   2.272  -0.378  -8.675
  834   2HG   MET 102          2HG       MET 102   2.493  -2.018  -8.066
  835   1HE   MET 102          1HE       MET 102   6.127  -0.549  -8.093
  836   2HE   MET 102          2HE       MET 102   4.709  -0.936  -7.115
  837   3HE   MET 102          3HE       MET 102   4.756   0.558  -8.051
  838    H    ILE 103           H        ILE 103   0.216  -1.854  -7.068
  839    HA   ILE 103           HA       ILE 103   0.303  -4.567  -6.311
  840    HB   ILE 103           HB       ILE 103  -0.709  -2.116  -4.887
  841   1HG1  ILE 103          2HG1      ILE 103   1.639  -3.942  -4.334
  842   2HG1  ILE 103          1HG1      ILE 103   1.744  -2.439  -5.245
  843   1HG2  ILE 103          1HG2      ILE 103  -0.908  -3.481  -2.854
  844   2HG2  ILE 103          2HG2      ILE 103  -0.598  -4.932  -3.808
  845   3HG2  ILE 103          3HG2      ILE 103  -2.053  -3.979  -4.097
  846   1HD1  ILE 103          1HD1      ILE 103   0.921  -2.700  -2.365
  847   2HD1  ILE 103          2HD1      ILE 103   1.024  -1.195  -3.278
  848   3HD1  ILE 103          3HD1      ILE 103   2.483  -2.134  -2.958
  849    H    TYR 104           H        TYR 104  -2.467  -2.351  -6.691
  850    HA   TYR 104           HA       TYR 104  -4.312  -4.590  -6.392
  851   1HB   TYR 104          2HB       TYR 104  -4.770  -1.615  -6.676
  852   2HB   TYR 104          1HB       TYR 104  -6.069  -2.798  -6.562
  853    HD1  TYR 104           1HD      TYR 104  -6.476  -4.003  -4.463
  854    HD2  TYR 104           2HD      TYR 104  -3.481  -0.994  -4.739
  855    HE1  TYR 104           1HE      TYR 104  -6.378  -3.883  -2.009
  856    HE2  TYR 104           2HE      TYR 104  -3.373  -0.867  -2.287
  857    HH   TYR 104           HH       TYR 104  -4.792  -3.186  -0.261
  858    H    ARG 105           H        ARG 105  -4.288  -5.798  -8.219
  859    HA   ARG 105           HA       ARG 105  -4.812  -4.415 -10.764
  860   1HB   ARG 105          2HB       ARG 105  -3.602  -7.145 -10.287
  861   2HB   ARG 105          1HB       ARG 105  -3.921  -6.440 -11.866
  862   1HG   ARG 105          2HG       ARG 105  -2.341  -4.640 -11.383
  863   2HG   ARG 105          1HG       ARG 105  -2.019  -5.352  -9.800
  864   1HD   ARG 105          2HD       ARG 105  -1.199  -7.387 -10.887
  865   2HD   ARG 105          1HD       ARG 105  -1.512  -6.669 -12.466
  866    HE   ARG 105           HE       ARG 105   0.160  -4.940 -11.053
  867   1HH1  ARG 105          2HH1      ARG 105   0.242  -8.139 -12.432
  868   2HH1  ARG 105          1HH1      ARG 105   1.946  -8.105 -12.736
  869   1HH2  ARG 105          1HH2      ARG 105   2.405  -4.887 -11.449
  870   2HH2  ARG 105          2HH2      ARG 105   3.177  -6.256 -12.177
  871    H    ASN 106           H        ASN 106  -6.766  -4.641 -11.614
  872    HA   ASN 106           HA       ASN 106  -8.901  -5.343 -11.967
  873   1HB   ASN 106          1HB       ASN 106  -7.652  -8.065 -11.518
  874   2HB   ASN 106          2HB       ASN 106  -9.229  -7.775 -12.247
  875   1HD2  ASN 106          2HD2      ASN 106  -6.853  -9.075 -13.338
  876   2HD2  ASN 106          1HD2      ASN 106  -6.463  -8.215 -14.783
  877    H    LEU 107           H        LEU 107  -8.177  -4.604  -9.287
  878    HA   LEU 107           HA       LEU 107  -9.145  -6.349  -7.328
  879   1HB   LEU 107          2HB       LEU 107  -9.248  -4.454  -5.869
  880   2HB   LEU 107          1HB       LEU 107  -7.830  -4.292  -6.886
  881    HG   LEU 107           HG       LEU 107 -10.420  -2.874  -7.486
  882   1HD1  LEU 107          1HD2      LEU 107  -9.429  -0.891  -6.449
  883   2HD1  LEU 107          2HD2      LEU 107  -8.065  -1.864  -5.901
  884   3HD1  LEU 107          3HD2      LEU 107  -9.684  -2.184  -5.277
  885   1HD2  LEU 107          1HD1      LEU 107  -8.873  -3.085  -9.352
  886   2HD2  LEU 107          2HD1      LEU 107  -7.580  -2.394  -8.371
  887   3HD2  LEU 107          3HD1      LEU 107  -8.977  -1.410  -8.807
  888    H    VAL 108           H        VAL 108 -11.126  -6.721  -6.447
  889    HA   VAL 108           HA       VAL 108 -13.428  -6.065  -8.053
  890    HB   VAL 108           HB       VAL 108 -13.246  -7.567  -5.437
  891   1HG1  VAL 108          1HG2      VAL 108 -15.470  -6.649  -5.776
  892   2HG1  VAL 108          2HG2      VAL 108 -15.487  -8.399  -5.996
  893   3HG1  VAL 108          3HG2      VAL 108 -15.523  -7.333  -7.401
  894   1HG2  VAL 108          1HG1      VAL 108 -13.482  -9.574  -6.821
  895   2HG2  VAL 108          2HG1      VAL 108 -12.024  -8.671  -7.232
  896   3HG2  VAL 108          3HG1      VAL 108 -13.444  -8.574  -8.273
  897    H    VAL 109           H        VAL 109 -12.451  -5.483  -4.682
  898    HA   VAL 109           HA       VAL 109 -13.028  -3.902  -3.160
  899    HB   VAL 109           HB       VAL 109 -11.940  -2.582  -5.144
  900   1HG1  VAL 109          1HG2      VAL 109 -14.782  -1.579  -5.228
  901   2HG1  VAL 109          2HG2      VAL 109 -13.888  -2.347  -6.541
  902   3HG1  VAL 109          3HG2      VAL 109 -13.403  -0.757  -5.956
  903   1HG2  VAL 109          1HG1      VAL 109 -11.893  -1.875  -2.821
  904   2HG2  VAL 109          2HG1      VAL 109 -13.524  -1.221  -2.969
  905   3HG2  VAL 109          3HG1      VAL 109 -12.197  -0.497  -3.879
  906    H    VAL 110           H        VAL 110 -14.733  -2.051  -2.692
  907    HA   VAL 110           HA       VAL 110 -17.378  -2.993  -3.589
  908    HB   VAL 110           HB       VAL 110 -16.703  -2.082  -0.787
  909   1HG1  VAL 110          1HG2      VAL 110 -18.969  -2.830  -0.246
  910   2HG1  VAL 110          2HG2      VAL 110 -19.243  -3.229  -1.942
  911   3HG1  VAL 110          3HG2      VAL 110 -18.987  -1.551  -1.461
  912   1HG2  VAL 110          1HG1      VAL 110 -17.275  -4.855  -1.827
  913   2HG2  VAL 110          2HG1      VAL 110 -17.065  -4.413  -0.133
  914   3HG2  VAL 110          3HG1      VAL 110 -15.715  -4.260  -1.257
  915    H    ASN 111           H        ASN 111 -18.916  -1.436  -3.972
  916    HA   ASN 111           HA       ASN 111 -19.655   0.579  -4.722
  917   1HB   ASN 111          2HB       ASN 111 -18.060   1.555  -2.343
  918   2HB   ASN 111          1HB       ASN 111 -19.180   2.552  -3.266
  919   1HD2  ASN 111          2HD2      ASN 111 -21.392   2.148  -3.132
  920   2HD2  ASN 111          1HD2      ASN 111 -22.071   1.221  -1.843
  921    H    GLN 112           H        GLN 112 -18.390   0.287  -6.653
  922    HA   GLN 112           HA       GLN 112 -15.906   1.845  -6.766
  923   1HB   GLN 112          2HB       GLN 112 -15.427   0.660  -8.839
  924   2HB   GLN 112          1HB       GLN 112 -15.777  -0.484  -7.551
  925   1HG   GLN 112          2HG       GLN 112 -17.806   0.394  -9.585
  926   2HG   GLN 112          1HG       GLN 112 -16.778  -1.024  -9.779
  927   1HE2  GLN 112          2HE2      GLN 112 -19.684  -0.824  -9.588
  928   2HE2  GLN 112          1HE2      GLN 112 -20.144  -1.820  -8.255
  929    H    GLN 113           H        GLN 113 -15.587   3.457  -8.293
  930    HA   GLN 113           HA       GLN 113 -18.041   4.699  -9.260
  931   1HB   GLN 113          1HB       GLN 113 -15.206   5.751  -9.212
  932   2HB   GLN 113          2HB       GLN 113 -16.632   6.673  -9.665
  933   1HG   GLN 113          1HG       GLN 113 -16.093   5.484  -6.953
  934   2HG   GLN 113          2HG       GLN 113 -15.917   7.182  -7.396
  935   1HE2  GLN 113          2HE2      GLN 113 -18.294   7.134  -9.095
  936   2HE2  GLN 113          1HE2      GLN 113 -19.648   7.140  -8.021
  937    H    GLU 114           H        GLU 114 -16.434   2.340 -10.475
  938    HA   GLU 114           HA       GLU 114 -16.328   3.439 -13.209
  939   1HB   GLU 114          2HB       GLU 114 -14.104   2.778 -12.401
  940   2HB   GLU 114          1HB       GLU 114 -14.704   1.162 -12.054
  941   1HG   GLU 114          1HG       GLU 114 -15.152   0.816 -14.430
  942   2HG   GLU 114          2HG       GLU 114 -14.547   2.437 -14.777
  943    H    SER 115           H        SER 115 -17.613   2.526 -14.688
  944    HA   SER 115           HA       SER 115 -19.455   0.475 -13.863
  945   1HB   SER 115          1HB       SER 115 -20.462   0.805 -16.095
  946   2HB   SER 115          2HB       SER 115 -20.233   2.336 -15.251
  947    HG   SER 115           HG       SER 115 -18.367   2.675 -16.498
  948    H    SER 116           H        SER 116 -19.138  -1.632 -14.057
  949    HA   SER 116           HA       SER 116 -16.940  -2.629 -15.670
  950   1HB   SER 116          2HB       SER 116 -18.847  -4.078 -13.817
  951   2HB   SER 116          1HB       SER 116 -17.437  -4.798 -14.595
  952    HG   SER 116           HG       SER 116 -16.196  -3.126 -13.484
  953    H    ASP 117           H        ASP 117 -17.210  -4.436 -17.141
  954    HA   ASP 117           HA       ASP 117 -19.895  -4.676 -18.300
  955   1HB   ASP 117          2HB       ASP 117 -17.365  -4.160 -19.880
  956   2HB   ASP 117          1HB       ASP 117 -18.945  -4.509 -20.573
  957    H    SER 118           H        SER 118 -17.943  -6.349 -16.663
  958    HA   SER 118           HA       SER 118 -18.256  -8.774 -18.268
  959   1HB   SER 118          2HB       SER 118 -15.946  -8.056 -18.664
  960   2HB   SER 118          1HB       SER 118 -15.661  -7.976 -16.925
  961    HG   SER 118           HG       SER 118 -14.908  -9.939 -17.780
  962    H    SER 119           H        SER 119 -16.832  -7.764 -15.154
  963    HA   SER 119           HA       SER 119 -18.208  -9.995 -13.857
  964   1HB   SER 119          2HB       SER 119 -16.067  -8.128 -12.807
  965   2HB   SER 119          1HB       SER 119 -16.738  -9.503 -11.930
  966    HG   SER 119           HG       SER 119 -15.673 -10.860 -13.197
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1  -6.574 -19.999 -18.242
    2   2H    MET   1          2H        MET   1  -6.481 -21.638 -17.831
    3   3H    MET   1          3H        MET   1  -7.139 -21.175 -19.319
    4    HA   MET   1           HA       MET   1  -4.913 -22.044 -19.595
    5   1HB   MET   1          2HB       MET   1  -5.124 -19.061 -20.052
    6   2HB   MET   1          1HB       MET   1  -3.975 -20.132 -20.840
    7   1HG   MET   1          2HG       MET   1  -6.970 -20.263 -21.099
    8   2HG   MET   1          1HG       MET   1  -5.852 -19.603 -22.292
    9   1HE   MET   1          1HE       MET   1  -6.894 -21.159 -24.176
   10   2HE   MET   1          2HE       MET   1  -8.035 -21.803 -22.993
   11   3HE   MET   1          3HE       MET   1  -7.093 -22.902 -24.001
   12    H    CYS   2           H        CYS   2  -2.557 -21.081 -19.581
   13    HA   CYS   2           HA       CYS   2  -0.677 -20.654 -18.384
   14   1HB   CYS   2          2HB       CYS   2  -1.719 -18.416 -18.137
   15   2HB   CYS   2          1HB       CYS   2  -2.489 -18.961 -16.651
   16    HG   CYS   2           HG       CYS   2  -0.585 -18.051 -15.202
   17    H    ASN   3           H        ASN   3  -2.806 -20.366 -15.577
   18    HA   ASN   3           HA       ASN   3  -2.365 -23.077 -14.736
   19   1HB   ASN   3          2HB       ASN   3  -1.140 -22.559 -12.689
   20   2HB   ASN   3          1HB       ASN   3  -0.218 -22.042 -14.099
   21   1HD2  ASN   3          2HD2      ASN   3  -2.074 -21.013 -11.348
   22   2HD2  ASN   3          1HD2      ASN   3  -1.574 -19.359 -11.376
   23    H    THR   4           H        THR   4  -3.748 -19.948 -14.368
   24    HA   THR   4           HA       THR   4  -5.193 -20.374 -11.971
   25    HB   THR   4           HB       THR   4  -4.852 -18.121 -12.798
   26    HG1  THR   4           1HG      THR   4  -7.404 -17.765 -13.067
   27   1HG2  THR   4          1HG2      THR   4  -6.612 -18.929 -15.116
   28   2HG2  THR   4          2HG2      THR   4  -4.885 -18.578 -15.197
   29   3HG2  THR   4          3HG2      THR   4  -6.028 -17.297 -14.791
   30    H    ASN   5           H        ASN   5  -7.358 -20.918 -11.643
   31    HA   ASN   5           HA       ASN   5  -8.854 -21.979 -13.921
   32   1HB   ASN   5          1HB       ASN   5  -9.387 -24.051 -12.688
   33   2HB   ASN   5          2HB       ASN   5  -7.663 -23.907 -13.017
   34   1HD2  ASN   5          2HD2      ASN   5  -6.243 -23.500 -11.326
   35   2HD2  ASN   5          1HD2      ASN   5  -6.696 -23.729  -9.673
   36    H    MET   6           H        MET   6  -8.816 -21.138 -10.490
   37    HA   MET   6           HA       MET   6 -10.404 -20.304  -9.092
   38   1HB   MET   6          1HB       MET   6 -10.333 -18.467 -10.730
   39   2HB   MET   6          2HB       MET   6 -11.581 -19.265 -11.676
   40   1HG   MET   6          2HG       MET   6 -13.145 -19.030  -9.817
   41   2HG   MET   6          1HG       MET   6 -11.895 -18.229  -8.868
   42   1HE   MET   6          1HE       MET   6 -14.786 -16.978  -9.364
   43   2HE   MET   6          2HE       MET   6 -14.358 -15.299  -9.697
   44   3HE   MET   6          3HE       MET   6 -13.525 -16.184  -8.419
   45    H    SER   7           H        SER   7 -11.195 -22.341  -8.448
   46    HA   SER   7           HA       SER   7 -13.675 -23.218  -9.761
   47   1HB   SER   7          2HB       SER   7 -11.933 -24.936  -9.642
   48   2HB   SER   7          1HB       SER   7 -11.833 -24.732  -7.893
   49    HG   SER   7           HG       SER   7 -13.494 -26.277  -9.292
   50    H    VAL   8           H        VAL   8 -14.973 -21.627  -8.730
   51    HA   VAL   8           HA       VAL   8 -15.637 -22.338  -5.959
   52    HB   VAL   8           HB       VAL   8 -16.052 -19.944  -5.448
   53   1HG1  VAL   8          1HG1      VAL   8 -13.698 -19.330  -5.145
   54   2HG1  VAL   8          2HG1      VAL   8 -13.225 -20.616  -6.255
   55   3HG1  VAL   8          3HG1      VAL   8 -13.993 -21.016  -4.719
   56   1HG2  VAL   8          1HG2      VAL   8 -14.632 -19.460  -8.066
   57   2HG2  VAL   8          2HG2      VAL   8 -15.060 -18.224  -6.883
   58   3HG2  VAL   8          3HG2      VAL   8 -16.326 -19.118  -7.724
   59    HA   PRO   9           HA       PRO   9 -19.703 -22.517  -7.702
   60   1HB   PRO   9          2HB       PRO   9 -21.129 -22.769  -5.429
   61   2HB   PRO   9          1HB       PRO   9 -20.110 -24.072  -6.050
   62   1HG   PRO   9          1HG       PRO   9 -19.537 -22.083  -3.885
   63   2HG   PRO   9          2HG       PRO   9 -19.218 -23.827  -3.912
   64   1HD   PRO   9          2HD       PRO   9 -17.306 -21.957  -4.425
   65   2HD   PRO   9          1HD       PRO   9 -17.291 -23.581  -5.142
   66    H    THR  10           H        THR  10 -18.532 -19.964  -5.830
   67    HA   THR  10           HA       THR  10 -21.043 -18.463  -5.941
   68    HB   THR  10           HB       THR  10 -19.911 -18.353  -3.807
   69    HG1  THR  10           1HG      THR  10 -20.217 -16.239  -3.627
   70   1HG2  THR  10          1HG2      THR  10 -17.633 -18.831  -4.560
   71   2HG2  THR  10          2HG2      THR  10 -17.677 -17.367  -3.578
   72   3HG2  THR  10          3HG2      THR  10 -17.549 -17.247  -5.332
   73    H    ASP  11           H        ASP  11 -17.762 -18.461  -7.205
   74    HA   ASP  11           HA       ASP  11 -16.746 -17.275  -8.860
   75   1HB   ASP  11          2HB       ASP  11 -19.589 -17.081  -9.875
   76   2HB   ASP  11          1HB       ASP  11 -18.146 -16.754 -10.829
   77    H    GLY  12           H        GLY  12 -16.127 -15.562  -7.447
   78   1HA   GLY  12          2HA       GLY  12 -17.482 -13.039  -8.107
   79   2HA   GLY  12          1HA       GLY  12 -17.180 -13.428  -6.421
   80    H    ALA  13           H        ALA  13 -16.145 -11.400  -8.553
   81    HA   ALA  13           HA       ALA  13 -13.357 -11.842  -8.773
   82   1HB   ALA  13          1HB       ALA  13 -14.583 -10.335 -10.265
   83   2HB   ALA  13          2HB       ALA  13 -13.233  -9.515  -9.482
   84   3HB   ALA  13          3HB       ALA  13 -14.879  -9.241  -8.914
   85    H    VAL  14           H        VAL  14 -11.669 -10.524  -7.771
   86    HA   VAL  14           HA       VAL  14 -12.001 -10.448  -4.910
   87    HB   VAL  14           HB       VAL  14  -9.567  -9.400  -6.309
   88   1HG1  VAL  14          1HG1      VAL  14  -9.976 -10.990  -3.779
   89   2HG1  VAL  14          2HG1      VAL  14  -9.657  -9.258  -3.885
   90   3HG1  VAL  14          3HG1      VAL  14  -8.425 -10.414  -4.392
   91   1HG2  VAL  14          1HG2      VAL  14 -10.251 -12.319  -5.970
   92   2HG2  VAL  14          2HG2      VAL  14  -8.690 -11.683  -6.487
   93   3HG2  VAL  14          3HG2      VAL  14 -10.115 -11.451  -7.499
   94    H    THR  15           H        THR  15 -10.962  -8.487  -3.744
   95    HA   THR  15           HA       THR  15 -12.473  -6.153  -4.602
   96    HB   THR  15           HB       THR  15 -10.863  -6.477  -2.064
   97    HG1  THR  15           1HG      THR  15 -12.526  -7.529  -1.227
   98   1HG2  THR  15          1HG2      THR  15 -12.364  -4.737  -1.214
   99   2HG2  THR  15          2HG2      THR  15 -13.159  -4.652  -2.787
  100   3HG2  THR  15          3HG2      THR  15 -11.469  -4.174  -2.625
  101    H    THR  16           H        THR  16 -11.565  -4.076  -4.871
  102    HA   THR  16           HA       THR  16  -8.674  -3.902  -5.201
  103    HB   THR  16           HB       THR  16 -10.570  -3.535  -7.529
  104    HG1  THR  16           1HG      THR  16 -10.102  -5.737  -7.048
  105   1HG2  THR  16          1HG2      THR  16  -8.704  -1.942  -7.573
  106   2HG2  THR  16          2HG2      THR  16  -8.551  -3.146  -8.853
  107   3HG2  THR  16          3HG2      THR  16  -7.562  -3.275  -7.398
  108    H    SER  17           H        SER  17  -7.886  -1.790  -5.404
  109    HA   SER  17           HA       SER  17  -9.734   0.446  -5.290
  110   1HB   SER  17          1HB       SER  17  -8.561   1.256  -3.154
  111   2HB   SER  17          2HB       SER  17  -9.740  -0.043  -2.979
  112    HG   SER  17           HG       SER  17  -7.647  -1.374  -3.347
  113    H    GLN  18           H        GLN  18  -7.838   2.329  -4.257
  114    HA   GLN  18           HA       GLN  18  -5.359   2.136  -5.648
  115   1HB   GLN  18          1HB       GLN  18  -5.855   4.132  -7.129
  116   2HB   GLN  18          2HB       GLN  18  -6.526   2.591  -7.650
  117   1HG   GLN  18          1HG       GLN  18  -8.678   3.276  -6.590
  118   2HG   GLN  18          2HG       GLN  18  -7.940   4.844  -6.244
  119   1HE2  GLN  18          2HE2      GLN  18 -10.265   4.156  -7.898
  120   2HE2  GLN  18          1HE2      GLN  18  -9.929   4.788  -9.471
  121    H    ILE  19           H        ILE  19  -5.393   5.029  -6.216
  122    HA   ILE  19           HA       ILE  19  -6.117   6.497  -3.989
  123    HB   ILE  19           HB       ILE  19  -4.478   5.238  -2.774
  124   1HG1  ILE  19          2HG1      ILE  19  -3.363   7.964  -3.508
  125   2HG1  ILE  19          1HG1      ILE  19  -4.447   7.597  -2.171
  126   1HG2  ILE  19          1HG2      ILE  19  -3.413   4.690  -5.059
  127   2HG2  ILE  19          2HG2      ILE  19  -2.406   4.655  -3.596
  128   3HG2  ILE  19          3HG2      ILE  19  -2.339   6.044  -4.686
  129   1HD1  ILE  19          1HD1      ILE  19  -2.706   6.293  -1.096
  130   2HD1  ILE  19          2HD1      ILE  19  -2.157   7.938  -1.420
  131   3HD1  ILE  19          3HD1      ILE  19  -1.621   6.609  -2.451
  132    HA   PRO  20           HA       PRO  20  -4.641   8.550  -8.046
  133   1HB   PRO  20          1HB       PRO  20  -7.035   9.956  -8.227
  134   2HB   PRO  20          2HB       PRO  20  -6.645   8.481  -9.116
  135   1HG   PRO  20          1HG       PRO  20  -8.208   8.818  -6.589
  136   2HG   PRO  20          2HG       PRO  20  -8.504   7.726  -7.956
  137   1HD   PRO  20          2HD       PRO  20  -7.421   6.815  -5.682
  138   2HD   PRO  20          1HD       PRO  20  -6.868   6.216  -7.258
  139    H    ALA  21           H        ALA  21  -5.511   9.338  -4.918
  140    HA   ALA  21           HA       ALA  21  -3.910  11.606  -4.722
  141   1HB   ALA  21          1HB       ALA  21  -5.538  13.407  -4.538
  142   2HB   ALA  21          2HB       ALA  21  -6.838  12.288  -4.945
  143   3HB   ALA  21          3HB       ALA  21  -5.600  12.675  -6.140
  144    H    SER  22           H        SER  22  -5.315   9.150  -3.426
  145    HA   SER  22           HA       SER  22  -5.944   8.418  -1.368
  146   1HB   SER  22          1HB       SER  22  -3.867   9.501  -0.603
  147   2HB   SER  22          2HB       SER  22  -4.732  11.025  -0.408
  148    HG   SER  22           HG       SER  22  -5.133  10.316   1.524
  149    H    GLU  23           H        GLU  23  -7.431  10.651  -3.008
  150    HA   GLU  23           HA       GLU  23  -9.391  11.350  -0.938
  151   1HB   GLU  23          1HB       GLU  23  -9.069  12.408  -3.754
  152   2HB   GLU  23          2HB       GLU  23 -10.290  12.938  -2.605
  153   1HG   GLU  23          1HG       GLU  23  -7.313  13.223  -2.263
  154   2HG   GLU  23          2HG       GLU  23  -8.429  14.503  -2.736
  155    H    GLN  24           H        GLN  24  -8.805   9.084  -3.332
  156    HA   GLN  24           HA       GLN  24 -11.637   8.288  -3.243
  157   1HB   GLN  24          1HB       GLN  24 -11.135   9.232  -5.476
  158   2HB   GLN  24          2HB       GLN  24  -9.840   8.058  -5.666
  159   1HG   GLN  24          1HG       GLN  24 -11.454   6.240  -5.577
  160   2HG   GLN  24          2HG       GLN  24 -12.761   7.403  -5.351
  161   1HE2  GLN  24          2HE2      GLN  24 -13.407   8.690  -7.077
  162   2HE2  GLN  24          1HE2      GLN  24 -12.981   8.318  -8.710
  163    H    GLU  25           H        GLU  25 -11.133   6.823  -1.561
  164    HA   GLU  25           HA       GLU  25  -8.704   5.265  -1.897
  165   1HB   GLU  25          2HB       GLU  25  -9.087   6.587   0.173
  166   2HB   GLU  25          1HB       GLU  25 -10.461   5.554   0.544
  167   1HG   GLU  25          2HG       GLU  25  -9.050   3.646   0.793
  168   2HG   GLU  25          1HG       GLU  25  -7.654   4.542   0.191
  169    H    THR  26           H        THR  26 -11.388   4.149   0.081
  170    HA   THR  26           HA       THR  26 -12.190   1.878  -1.295
  171    HB   THR  26           HB       THR  26  -9.656   1.584  -1.468
  172    HG1  THR  26           1HG      THR  26 -10.889  -0.179  -1.928
  173   1HG2  THR  26          1HG2      THR  26 -10.062   0.813   1.417
  174   2HG2  THR  26          2HG2      THR  26  -9.118   2.186   0.838
  175   3HG2  THR  26          3HG2      THR  26  -8.594   0.540   0.477
  176    H    LEU  27           H        LEU  27 -13.006   0.151   0.145
  177    HA   LEU  27           HA       LEU  27 -11.687   0.191   2.719
  178   1HB   LEU  27          1HB       LEU  27 -14.324   0.792   2.731
  179   2HB   LEU  27          2HB       LEU  27 -14.418  -0.960   2.766
  180    HG   LEU  27           HG       LEU  27 -14.457  -0.326   5.027
  181   1HD1  LEU  27          1HD1      LEU  27 -12.870  -2.127   4.623
  182   2HD1  LEU  27          2HD1      LEU  27 -12.298  -1.092   5.935
  183   3HD1  LEU  27          3HD1      LEU  27 -11.588  -0.947   4.324
  184   1HD2  LEU  27          1HD2      LEU  27 -13.849   2.009   4.716
  185   2HD2  LEU  27          2HD2      LEU  27 -12.176   1.541   4.396
  186   3HD2  LEU  27          3HD2      LEU  27 -12.874   1.282   5.996
  187    H    VAL  28           H        VAL  28 -10.338  -1.200   1.384
  188    HA   VAL  28           HA       VAL  28 -11.698  -3.181  -0.204
  189    HB   VAL  28           HB       VAL  28 -10.016  -2.133  -1.417
  190   1HG1  VAL  28          1HG1      VAL  28  -8.892  -0.947   0.285
  191   2HG1  VAL  28          2HG1      VAL  28  -7.668  -1.927  -0.529
  192   3HG1  VAL  28          3HG1      VAL  28  -8.312  -2.439   1.037
  193   1HG2  VAL  28          1HG2      VAL  28  -9.873  -4.515  -1.756
  194   2HG2  VAL  28          2HG2      VAL  28  -8.801  -4.681  -0.361
  195   3HG2  VAL  28          3HG2      VAL  28  -8.251  -3.820  -1.802
  196    H    ARG  29           H        ARG  29 -11.221  -5.409  -0.241
  197    HA   ARG  29           HA       ARG  29 -10.219  -6.412   2.325
  198   1HB   ARG  29          1HB       ARG  29 -12.604  -7.622   0.944
  199   2HB   ARG  29          2HB       ARG  29 -12.111  -7.780   2.627
  200   1HG   ARG  29          1HG       ARG  29 -12.721  -5.456   3.038
  201   2HG   ARG  29          2HG       ARG  29 -13.179  -5.266   1.344
  202   1HD   ARG  29          2HD       ARG  29 -14.451  -7.145   3.335
  203   2HD   ARG  29          1HD       ARG  29 -15.141  -5.633   2.746
  204    HE   ARG  29           HE       ARG  29 -14.588  -7.238   0.535
  205   1HH1  ARG  29          2HH1      ARG  29 -16.686  -7.228   3.318
  206   2HH1  ARG  29          1HH1      ARG  29 -17.939  -8.133   2.537
  207   1HH2  ARG  29          1HH2      ARG  29 -16.233  -8.430  -0.502
  208   2HH2  ARG  29          2HH2      ARG  29 -17.682  -8.816   0.366
  209    HA   PRO  30           HA       PRO  30  -8.340  -8.432  -1.406
  210   1HB   PRO  30          1HB       PRO  30  -5.762  -8.348  -0.593
  211   2HB   PRO  30          2HB       PRO  30  -6.570  -6.960  -1.330
  212   1HG   PRO  30          2HG       PRO  30  -6.061  -7.541   1.563
  213   2HG   PRO  30          1HG       PRO  30  -5.872  -6.016   0.680
  214   1HD   PRO  30          2HD       PRO  30  -8.034  -6.562   2.228
  215   2HD   PRO  30          1HD       PRO  30  -8.119  -5.529   0.788
  216    H    LYS  31           H        LYS  31  -7.768 -10.539  -1.728
  217    HA   LYS  31           HA       LYS  31  -7.855 -12.398   0.437
  218   1HB   LYS  31          2HB       LYS  31  -7.139 -14.043  -1.348
  219   2HB   LYS  31          1HB       LYS  31  -8.636 -13.179  -1.665
  220   1HG   LYS  31          1HG       LYS  31  -7.564 -13.118  -3.707
  221   2HG   LYS  31          2HG       LYS  31  -7.153 -11.552  -3.007
  222   1HD   LYS  31          1HD       LYS  31  -5.179 -12.509  -3.996
  223   2HD   LYS  31          2HD       LYS  31  -5.000 -12.511  -2.239
  224   1HE   LYS  31          2HE       LYS  31  -5.644 -14.868  -2.173
  225   2HE   LYS  31          1HE       LYS  31  -5.835 -14.868  -3.925
  226   1HZ   LYS  31          1HZ       LYS  31  -3.484 -14.365  -4.149
  227   2HZ   LYS  31          2HZ       LYS  31  -3.704 -15.791  -3.265
  228   3HZ   LYS  31          3HZ       LYS  31  -3.299 -14.356  -2.466
  229    HA   PRO  32           HA       PRO  32  -3.842 -12.589   2.092
  230   1HB   PRO  32          1HB       PRO  32  -3.713 -15.441   1.209
  231   2HB   PRO  32          2HB       PRO  32  -3.376 -14.740   2.796
  232   1HG   PRO  32          1HG       PRO  32  -5.664 -16.015   2.343
  233   2HG   PRO  32          2HG       PRO  32  -5.627 -14.544   3.332
  234   1HD   PRO  32          2HD       PRO  32  -6.592 -14.930   0.542
  235   2HD   PRO  32          1HD       PRO  32  -7.176 -13.820   1.797
  236    H    LEU  33           H        LEU  33  -2.815 -11.245   0.540
  237    HA   LEU  33           HA       LEU  33  -0.659 -12.475  -0.805
  238   1HB   LEU  33          2HB       LEU  33  -2.489 -13.002  -2.400
  239   2HB   LEU  33          1HB       LEU  33  -2.778 -11.285  -2.593
  240    HG   LEU  33           HG       LEU  33  -0.019 -12.202  -3.140
  241   1HD1  LEU  33          1HD2      LEU  33  -2.314 -12.853  -4.984
  242   2HD1  LEU  33          2HD2      LEU  33  -1.296 -14.016  -4.134
  243   3HD1  LEU  33          3HD2      LEU  33  -0.602 -12.984  -5.385
  244   1HD2  LEU  33          1HD1      LEU  33  -0.681  -9.872  -3.410
  245   2HD2  LEU  33          2HD1      LEU  33  -1.928 -10.352  -4.561
  246   3HD2  LEU  33          3HD1      LEU  33  -0.226 -10.585  -4.958
  247    H    LEU  34           H        LEU  34  -2.406  -9.795   0.279
  248    HA   LEU  34           HA       LEU  34  -0.057  -8.104  -0.195
  249   1HB   LEU  34          2HB       LEU  34  -1.661  -7.129  -1.613
  250   2HB   LEU  34          1HB       LEU  34  -2.975  -7.454  -0.503
  251    HG   LEU  34           HG       LEU  34  -2.249  -5.026  -0.806
  252   1HD1  LEU  34          1HD1      LEU  34  -3.718  -5.239   0.907
  253   2HD1  LEU  34          2HD1      LEU  34  -2.289  -4.786   1.838
  254   3HD1  LEU  34          3HD1      LEU  34  -2.765  -6.484   1.717
  255   1HD2  LEU  34          1HD2      LEU  34   0.133  -5.279  -0.703
  256   2HD2  LEU  34          2HD2      LEU  34   0.029  -6.014   0.896
  257   3HD2  LEU  34          3HD2      LEU  34  -0.396  -4.316   0.677
  258    H    LEU  35           H        LEU  35  -2.983  -8.645   1.744
  259    HA   LEU  35           HA       LEU  35  -1.526  -8.246   4.183
  260   1HB   LEU  35          2HB       LEU  35  -3.622  -9.895   4.802
  261   2HB   LEU  35          1HB       LEU  35  -3.651  -8.146   4.875
  262    HG   LEU  35           HG       LEU  35  -4.472  -8.180   2.475
  263   1HD1  LEU  35          1HD2      LEU  35  -3.773 -10.444   1.916
  264   2HD1  LEU  35          2HD2      LEU  35  -5.518 -10.258   1.714
  265   3HD1  LEU  35          3HD2      LEU  35  -4.880 -11.095   3.129
  266   1HD2  LEU  35          1HD1      LEU  35  -6.803  -8.933   3.209
  267   2HD2  LEU  35          2HD1      LEU  35  -6.046  -7.614   4.105
  268   3HD2  LEU  35          3HD1      LEU  35  -6.066  -9.245   4.783
  269    H    LYS  36           H        LYS  36  -1.857 -10.465   5.612
  270    HA   LYS  36           HA       LYS  36  -0.503 -12.193   6.197
  271   1HB   LYS  36          1HB       LYS  36  -1.718 -13.411   4.446
  272   2HB   LYS  36          2HB       LYS  36  -0.563 -12.844   3.250
  273   1HG   LYS  36          1HG       LYS  36   1.227 -14.045   4.407
  274   2HG   LYS  36          2HG       LYS  36   0.060 -14.625   5.598
  275   1HD   LYS  36          1HD       LYS  36  -1.177 -15.769   3.820
  276   2HD   LYS  36          2HD       LYS  36   0.001 -15.200   2.637
  277   1HE   LYS  36          1HE       LYS  36   0.578 -17.002   4.985
  278   2HE   LYS  36          2HE       LYS  36   0.446 -17.509   3.301
  279   1HZ   LYS  36          1HZ       LYS  36   2.474 -15.628   4.383
  280   2HZ   LYS  36          2HZ       LYS  36   2.349 -16.117   2.770
  281   3HZ   LYS  36          3HZ       LYS  36   2.751 -17.245   3.965
  282    H    LEU  37           H        LEU  37   0.526 -10.350   3.352
  283    HA   LEU  37           HA       LEU  37   3.282 -10.309   4.179
  284   1HB   LEU  37          1HB       LEU  37   2.874  -9.890   1.874
  285   2HB   LEU  37          2HB       LEU  37   1.614  -8.724   2.233
  286    HG   LEU  37           HG       LEU  37   4.374  -8.091   3.147
  287   1HD1  LEU  37          1HD2      LEU  37   3.450  -7.860   0.287
  288   2HD1  LEU  37          2HD2      LEU  37   4.759  -8.881   0.882
  289   3HD1  LEU  37          3HD2      LEU  37   4.907  -7.124   0.955
  290   1HD2  LEU  37          1HD1      LEU  37   2.039  -6.800   3.303
  291   2HD2  LEU  37          2HD1      LEU  37   2.608  -6.193   1.744
  292   3HD2  LEU  37          3HD1      LEU  37   3.596  -5.972   3.190
  293    H    LEU  38           H        LEU  38   0.327  -8.801   5.012
  294    HA   LEU  38           HA       LEU  38   1.746  -6.827   6.665
  295   1HB   LEU  38          1HB       LEU  38  -1.172  -6.899   5.909
  296   2HB   LEU  38          2HB       LEU  38  -0.361  -5.625   6.799
  297    HG   LEU  38           HG       LEU  38   0.305  -6.381   3.956
  298   1HD1  LEU  38          1HD2      LEU  38  -1.340  -4.058   4.941
  299   2HD1  LEU  38          2HD2      LEU  38  -1.992  -5.509   4.175
  300   3HD1  LEU  38          3HD2      LEU  38  -0.926  -4.436   3.268
  301   1HD2  LEU  38          1HD1      LEU  38   2.132  -5.336   5.168
  302   2HD2  LEU  38          2HD1      LEU  38   1.073  -4.009   5.645
  303   3HD2  LEU  38          3HD1      LEU  38   1.482  -4.245   3.944
  304    H    LYS  39           H        LYS  39  -0.444  -9.540   6.702
  305    HA   LYS  39           HA       LYS  39  -1.176  -9.391   9.440
  306   1HB   LYS  39          2HB       LYS  39  -1.048 -11.752   7.559
  307   2HB   LYS  39          1HB       LYS  39  -1.763 -11.799   9.165
  308   1HG   LYS  39          2HG       LYS  39  -3.441 -10.195   8.511
  309   2HG   LYS  39          1HG       LYS  39  -2.682 -10.003   6.928
  310   1HD   LYS  39          1HD       LYS  39  -3.143 -12.348   6.419
  311   2HD   LYS  39          2HD       LYS  39  -3.891 -12.550   8.005
  312   1HE   LYS  39          1HE       LYS  39  -4.837 -10.680   5.835
  313   2HE   LYS  39          2HE       LYS  39  -5.561 -12.237   6.239
  314   1HZ   LYS  39          1HZ       LYS  39  -6.772 -10.409   7.248
  315   2HZ   LYS  39          2HZ       LYS  39  -5.379  -9.893   8.055
  316   3HZ   LYS  39          3HZ       LYS  39  -6.074 -11.385   8.441
  317    H    SER  40           H        SER  40   1.792  -9.829   8.067
  318    HA   SER  40           HA       SER  40   2.771 -11.576  10.214
  319   1HB   SER  40          1HB       SER  40   3.397 -12.263   7.953
  320   2HB   SER  40          2HB       SER  40   4.122 -10.683   7.654
  321    HG   SER  40           HG       SER  40   5.159 -11.677   9.892
  322    H    VAL  41           H        VAL  41   2.962  -8.336   8.937
  323    HA   VAL  41           HA       VAL  41   5.260  -7.623  10.527
  324    HB   VAL  41           HB       VAL  41   5.179  -6.484   8.479
  325   1HG1  VAL  41          1HG1      VAL  41   2.922  -6.866   7.817
  326   2HG1  VAL  41          2HG1      VAL  41   3.212  -5.125   7.771
  327   3HG1  VAL  41          3HG1      VAL  41   2.307  -5.836   9.112
  328   1HG2  VAL  41          1HG2      VAL  41   5.137  -4.181   9.051
  329   2HG2  VAL  41          2HG2      VAL  41   5.691  -5.062  10.476
  330   3HG2  VAL  41          3HG2      VAL  41   4.031  -4.469  10.394
  331    H    GLY  42           H        GLY  42   1.772  -7.366  10.791
  332   1HA   GLY  42          2HA       GLY  42   1.617  -7.481  13.458
  333   2HA   GLY  42          1HA       GLY  42   1.961  -5.776  13.220
  334    H    ALA  43           H        ALA  43   0.078  -7.432  10.834
  335    HA   ALA  43           HA       ALA  43  -2.224  -5.806  11.380
  336   1HB   ALA  43          1HB       ALA  43  -1.642  -6.434   9.095
  337   2HB   ALA  43          2HB       ALA  43  -3.262  -6.992   9.514
  338   3HB   ALA  43          3HB       ALA  43  -1.916  -8.131   9.486
  339    H    GLN  44           H        GLN  44  -4.440  -7.042  11.294
  340    HA   GLN  44           HA       GLN  44  -4.594  -9.581  12.568
  341   1HB   GLN  44          1HB       GLN  44  -3.972  -8.204  14.522
  342   2HB   GLN  44          2HB       GLN  44  -5.370  -7.178  14.234
  343   1HG   GLN  44          2HG       GLN  44  -6.851  -9.075  14.636
  344   2HG   GLN  44          1HG       GLN  44  -5.451 -10.108  14.918
  345   1HE2  GLN  44          2HE2      GLN  44  -3.988  -7.993  16.306
  346   2HE2  GLN  44          1HE2      GLN  44  -4.709  -7.862  17.870
  347    H    LYS  45           H        LYS  45  -5.960  -6.753  11.207
  348    HA   LYS  45           HA       LYS  45  -8.713  -7.486  11.463
  349   1HB   LYS  45          2HB       LYS  45  -7.432  -5.584   9.493
  350   2HB   LYS  45          1HB       LYS  45  -9.140  -5.666   9.902
  351   1HG   LYS  45          1HG       LYS  45  -8.594  -5.010  12.212
  352   2HG   LYS  45          2HG       LYS  45  -6.899  -4.863  11.746
  353   1HD   LYS  45          2HD       LYS  45  -9.184  -3.296  10.549
  354   2HD   LYS  45          1HD       LYS  45  -8.052  -2.689  11.758
  355   1HE   LYS  45          2HE       LYS  45  -6.202  -3.010  10.201
  356   2HE   LYS  45          1HE       LYS  45  -7.318  -3.647   8.994
  357   1HZ   LYS  45          1HZ       LYS  45  -8.454  -1.496   8.998
  358   2HZ   LYS  45          2HZ       LYS  45  -6.831  -1.344   8.550
  359   3HZ   LYS  45          3HZ       LYS  45  -7.323  -0.892  10.103
  360    H    ASP  46           H        ASP  46 -10.094  -7.785   9.470
  361    HA   ASP  46           HA       ASP  46  -8.839  -9.796   7.742
  362   1HB   ASP  46          2HB       ASP  46 -11.146 -10.513   7.232
  363   2HB   ASP  46          1HB       ASP  46 -10.811 -10.557   8.959
  364    H    THR  47           H        THR  47  -9.571  -6.586   7.698
  365    HA   THR  47           HA       THR  47  -9.535  -6.570   4.760
  366    HB   THR  47           HB       THR  47 -11.079  -4.676   4.671
  367    HG1  THR  47           1HG      THR  47 -11.071  -5.002   7.485
  368   1HG2  THR  47          1HG2      THR  47 -12.287  -6.951   6.245
  369   2HG2  THR  47          2HG2      THR  47 -12.015  -6.949   4.502
  370   3HG2  THR  47          3HG2      THR  47 -13.153  -5.805   5.218
  371    H    TYR  48           H        TYR  48  -9.088  -4.260   3.973
  372    HA   TYR  48           HA       TYR  48  -7.479  -2.735   5.881
  373   1HB   TYR  48          2HB       TYR  48  -6.575  -3.740   3.200
  374   2HB   TYR  48          1HB       TYR  48  -5.869  -2.299   3.925
  375    HD1  TYR  48           1HD      TYR  48  -4.324  -2.438   5.687
  376    HD2  TYR  48           2HD      TYR  48  -6.351  -5.932   4.357
  377    HE1  TYR  48           1HE      TYR  48  -2.775  -3.827   7.003
  378    HE2  TYR  48           2HE      TYR  48  -4.792  -7.331   5.655
  379    HH   TYR  48           HH       TYR  48  -2.561  -7.195   6.606
  380    H    THR  49           H        THR  49  -6.932  -0.562   5.043
  381    HA   THR  49           HA       THR  49  -8.525   0.214   2.707
  382    HB   THR  49           HB       THR  49  -8.870   2.440   3.534
  383    HG1  THR  49           1HG      THR  49  -8.125   2.316   6.071
  384   1HG2  THR  49          1HG2      THR  49  -9.576   0.406   5.649
  385   2HG2  THR  49          2HG2      THR  49 -10.536   0.825   4.230
  386   3HG2  THR  49          3HG2      THR  49 -10.287   2.014   5.507
  387    H    MET  50           H        MET  50  -7.530   2.181   1.624
  388    HA   MET  50           HA       MET  50  -5.023   1.170   0.823
  389   1HB   MET  50          2HB       MET  50  -6.690   3.516  -0.008
  390   2HB   MET  50          1HB       MET  50  -5.097   3.242  -0.707
  391   1HG   MET  50          1HG       MET  50  -7.360   1.258  -0.733
  392   2HG   MET  50          2HG       MET  50  -6.935   2.319  -2.071
  393   1HE   MET  50          1HE       MET  50  -4.517   2.234  -3.276
  394   2HE   MET  50          2HE       MET  50  -3.287   1.032  -2.884
  395   3HE   MET  50          3HE       MET  50  -3.705   2.281  -1.711
  396    H    LYS  51           H        LYS  51  -5.896   3.655   3.043
  397    HA   LYS  51           HA       LYS  51  -3.193   4.734   3.125
  398   1HB   LYS  51          2HB       LYS  51  -4.036   6.129   4.973
  399   2HB   LYS  51          1HB       LYS  51  -5.036   6.274   3.534
  400   1HG   LYS  51          2HG       LYS  51  -6.712   4.837   4.493
  401   2HG   LYS  51          1HG       LYS  51  -5.689   4.527   5.897
  402   1HD   LYS  51          2HD       LYS  51  -7.369   6.165   6.472
  403   2HD   LYS  51          1HD       LYS  51  -5.780   6.932   6.453
  404   1HE   LYS  51          1HE       LYS  51  -6.233   7.816   4.217
  405   2HE   LYS  51          2HE       LYS  51  -7.820   7.046   4.233
  406   1HZ   LYS  51          1HZ       LYS  51  -6.906   9.159   6.111
  407   2HZ   LYS  51          2HZ       LYS  51  -8.429   8.423   6.122
  408   3HZ   LYS  51          3HZ       LYS  51  -7.966   9.385   4.811
  409    H    GLU  52           H        GLU  52  -5.289   2.572   4.915
  410    HA   GLU  52           HA       GLU  52  -3.642   2.118   7.149
  411   1HB   GLU  52          2HB       GLU  52  -6.120   1.268   6.293
  412   2HB   GLU  52          1HB       GLU  52  -5.162  -0.202   6.206
  413   1HG   GLU  52          1HG       GLU  52  -5.338   1.541   8.650
  414   2HG   GLU  52          2HG       GLU  52  -6.368   0.140   8.357
  415    H    VAL  53           H        VAL  53  -3.788   0.633   3.959
  416    HA   VAL  53           HA       VAL  53  -1.657  -1.230   4.601
  417    HB   VAL  53           HB       VAL  53  -3.472  -2.076   3.236
  418   1HG1  VAL  53          1HG1      VAL  53  -2.706   0.012   1.201
  419   2HG1  VAL  53          2HG1      VAL  53  -4.141   0.061   2.223
  420   3HG1  VAL  53          3HG1      VAL  53  -3.957  -1.219   1.024
  421   1HG2  VAL  53          1HG2      VAL  53  -2.208  -3.009   1.395
  422   2HG2  VAL  53          2HG2      VAL  53  -1.210  -2.947   2.847
  423   3HG2  VAL  53          3HG2      VAL  53  -0.983  -1.753   1.570
  424    H    LEU  54           H        LEU  54  -2.097   1.847   3.081
  425    HA   LEU  54           HA       LEU  54   0.251   2.179   1.659
  426   1HB   LEU  54          2HB       LEU  54  -1.565   3.883   2.043
  427   2HB   LEU  54          1HB       LEU  54  -0.876   4.172   3.627
  428    HG   LEU  54           HG       LEU  54   0.790   4.501   1.149
  429   1HD1  LEU  54          1HD1      LEU  54  -1.015   6.570   2.395
  430   2HD1  LEU  54          2HD1      LEU  54  -1.203   5.848   0.797
  431   3HD1  LEU  54          3HD1      LEU  54   0.189   6.875   1.142
  432   1HD2  LEU  54          1HD2      LEU  54   2.009   6.076   2.573
  433   2HD2  LEU  54          2HD2      LEU  54   1.951   4.465   3.287
  434   3HD2  LEU  54          3HD2      LEU  54   0.893   5.738   3.898
  435    H    PHE  55           H        PHE  55  -0.162   2.936   5.124
  436    HA   PHE  55           HA       PHE  55   2.643   3.152   5.539
  437   1HB   PHE  55          1HB       PHE  55   2.014   4.167   7.433
  438   2HB   PHE  55          2HB       PHE  55   0.348   3.913   6.928
  439    HD1  PHE  55           1HD      PHE  55   2.988   2.893   9.200
  440    HD2  PHE  55           2HD      PHE  55  -0.958   2.050   7.841
  441    HE1  PHE  55           1HE      PHE  55   2.602   1.499  11.192
  442    HE2  PHE  55           2HE      PHE  55  -1.348   0.657   9.830
  443    HZ   PHE  55           HZ       PHE  55   0.433   0.380  11.509
  444    H    TYR  56           H        TYR  56   0.284   0.582   6.004
  445    HA   TYR  56           HA       TYR  56   1.851  -1.041   7.689
  446   1HB   TYR  56          1HB       TYR  56  -0.688  -1.229   6.378
  447   2HB   TYR  56          2HB       TYR  56   0.198  -2.733   6.146
  448    HD1  TYR  56           1HD      TYR  56  -2.354  -1.950   7.882
  449    HD2  TYR  56           2HD      TYR  56   1.740  -2.724   8.754
  450    HE1  TYR  56           1HE      TYR  56  -2.978  -2.656  10.149
  451    HE2  TYR  56           2HE      TYR  56   1.127  -3.438  11.025
  452    HH   TYR  56           HH       TYR  56  -2.078  -4.061  11.956
  453    H    LEU  57           H        LEU  57   1.312  -1.250   4.170
  454    HA   LEU  57           HA       LEU  57   3.131  -3.295   3.653
  455   1HB   LEU  57          2HB       LEU  57   1.607  -2.504   1.945
  456   2HB   LEU  57          1HB       LEU  57   2.364  -0.924   1.949
  457    HG   LEU  57           HG       LEU  57   4.389  -1.836   0.976
  458   1HD1  LEU  57          1HD1      LEU  57   2.994  -4.505   1.080
  459   2HD1  LEU  57          2HD1      LEU  57   4.365  -4.018   2.074
  460   3HD1  LEU  57          3HD1      LEU  57   4.556  -4.179   0.327
  461   1HD2  LEU  57          1HD2      LEU  57   2.608  -1.173  -0.548
  462   2HD2  LEU  57          2HD2      LEU  57   1.928  -2.799  -0.474
  463   3HD2  LEU  57          3HD2      LEU  57   3.516  -2.540  -1.194
  464    H    GLY  58           H        GLY  58   3.648   0.222   3.778
  465   1HA   GLY  58          2HA       GLY  58   6.378   0.363   3.423
  466   2HA   GLY  58          1HA       GLY  58   5.487   1.363   4.560
  467    H    GLN  59           H        GLN  59   4.634  -0.559   6.378
  468    HA   GLN  59           HA       GLN  59   6.833  -0.793   8.074
  469   1HB   GLN  59          1HB       GLN  59   4.348  -2.513   8.116
  470   2HB   GLN  59          2HB       GLN  59   5.449  -2.237   9.457
  471   1HG   GLN  59          2HG       GLN  59   3.563  -0.281   8.184
  472   2HG   GLN  59          1HG       GLN  59   3.540  -0.903   9.832
  473   1HE2  GLN  59          1HE2      GLN  59   5.077   1.294   7.622
  474   2HE2  GLN  59          2HE2      GLN  59   5.928   2.215   8.811
  475    H    TYR  60           H        TYR  60   5.277  -3.309   6.069
  476    HA   TYR  60           HA       TYR  60   6.959  -5.393   6.886
  477   1HB   TYR  60          1HB       TYR  60   4.827  -5.779   5.741
  478   2HB   TYR  60          2HB       TYR  60   5.490  -5.095   4.262
  479    HD1  TYR  60           1HD      TYR  60   6.824  -6.392   2.802
  480    HD2  TYR  60           2HD      TYR  60   5.753  -7.924   6.619
  481    HE1  TYR  60           1HE      TYR  60   7.672  -8.601   2.145
  482    HE2  TYR  60           2HE      TYR  60   6.600 -10.139   5.975
  483    HH   TYR  60           HH       TYR  60   8.529 -10.647   3.251
  484    H    ILE  61           H        ILE  61   7.272  -3.148   4.136
  485    HA   ILE  61           HA       ILE  61   9.547  -4.253   2.945
  486    HB   ILE  61           HB       ILE  61   9.248  -1.273   3.199
  487   1HG1  ILE  61          2HG1      ILE  61   7.024  -1.799   2.681
  488   2HG1  ILE  61          1HG1      ILE  61   7.756  -1.512   1.106
  489   1HG2  ILE  61          1HG2      ILE  61  11.172  -2.348   1.980
  490   2HG2  ILE  61          2HG2      ILE  61  10.213  -1.209   1.033
  491   3HG2  ILE  61          3HG2      ILE  61   9.991  -2.943   0.805
  492   1HD1  ILE  61          1HD1      ILE  61   7.386  -4.226   2.332
  493   2HD1  ILE  61          2HD1      ILE  61   7.914  -3.859   0.685
  494   3HD1  ILE  61          3HD1      ILE  61   6.265  -3.483   1.188
  495    H    MET  62           H        MET  62   9.122  -2.365   5.804
  496    HA   MET  62           HA       MET  62  11.927  -1.895   6.266
  497   1HB   MET  62          1HB       MET  62   9.584  -1.667   8.163
  498   2HB   MET  62          2HB       MET  62  11.208  -1.066   8.466
  499   1HG   MET  62          1HG       MET  62  10.989   0.472   6.582
  500   2HG   MET  62          2HG       MET  62   9.358  -0.127   6.289
  501   1HE   MET  62          1HE       MET  62   8.435   2.366   6.372
  502   2HE   MET  62          2HE       MET  62  10.065   2.964   6.675
  503   3HE   MET  62          3HE       MET  62   8.734   3.473   7.713
  504    H    THR  63           H        THR  63   9.514  -4.213   7.400
  505    HA   THR  63           HA       THR  63  10.992  -5.221   9.564
  506    HB   THR  63           HB       THR  63   9.458  -7.153   9.513
  507    HG1  THR  63           1HG      THR  63   8.316  -7.596   7.771
  508   1HG2  THR  63          1HG2      THR  63   7.376  -5.896   9.838
  509   2HG2  THR  63          2HG2      THR  63   8.105  -4.491   9.060
  510   3HG2  THR  63          3HG2      THR  63   8.745  -5.081  10.594
  511    H    LYS  64           H        LYS  64  10.379  -6.822   6.429
  512    HA   LYS  64           HA       LYS  64  12.476  -8.730   6.982
  513   1HB   LYS  64          2HB       LYS  64  10.715  -8.406   4.547
  514   2HB   LYS  64          1HB       LYS  64  11.780  -9.770   4.864
  515   1HG   LYS  64          2HG       LYS  64   9.485  -8.971   6.640
  516   2HG   LYS  64          1HG       LYS  64   9.386 -10.196   5.371
  517   1HD   LYS  64          1HD       LYS  64  11.141 -11.490   6.486
  518   2HD   LYS  64          2HD       LYS  64  11.237 -10.265   7.753
  519   1HE   LYS  64          1HE       LYS  64   8.912 -10.708   8.361
  520   2HE   LYS  64          2HE       LYS  64   8.809 -11.926   7.090
  521   1HZ   LYS  64          1HZ       LYS  64   9.200 -12.941   9.237
  522   2HZ   LYS  64          2HZ       LYS  64  10.610 -12.031   9.449
  523   3HZ   LYS  64          3HZ       LYS  64  10.531 -13.195   8.223
  524    H    ARG  65           H        ARG  65  12.771  -5.723   6.219
  525    HA   ARG  65           HA       ARG  65  14.357  -4.450   5.170
  526   1HB   ARG  65          1HB       ARG  65  15.957  -6.930   5.820
  527   2HB   ARG  65          2HB       ARG  65  16.643  -5.357   5.439
  528   1HG   ARG  65          2HG       ARG  65  15.559  -4.406   7.414
  529   2HG   ARG  65          1HG       ARG  65  14.882  -5.991   7.799
  530   1HD   ARG  65          2HD       ARG  65  17.139  -6.903   8.021
  531   2HD   ARG  65          1HD       ARG  65  17.819  -5.323   7.630
  532    HE   ARG  65           HE       ARG  65  16.089  -5.056   9.824
  533   1HH1  ARG  65          2HH1      ARG  65  19.173  -6.450   8.997
  534   2HH1  ARG  65          1HH1      ARG  65  19.817  -6.297  10.597
  535   1HH2  ARG  65          1HH2      ARG  65  16.927  -4.851  11.934
  536   2HH2  ARG  65          2HH2      ARG  65  18.539  -5.387  12.268
  537    H    LEU  66           H        LEU  66  13.198  -4.694   3.081
  538    HA   LEU  66           HA       LEU  66  14.937  -6.039   1.124
  539   1HB   LEU  66          1HB       LEU  66  12.124  -4.981   0.887
  540   2HB   LEU  66          2HB       LEU  66  13.077  -5.462  -0.502
  541    HG   LEU  66           HG       LEU  66  11.641  -7.280   0.012
  542   1HD1  LEU  66          1HD1      LEU  66  13.903  -7.934  -0.583
  543   2HD1  LEU  66          2HD1      LEU  66  13.206  -9.076   0.565
  544   3HD1  LEU  66          3HD1      LEU  66  14.380  -7.882   1.114
  545   1HD2  LEU  66          1HD2      LEU  66  12.647  -7.155   2.849
  546   2HD2  LEU  66          2HD2      LEU  66  11.501  -8.327   2.195
  547   3HD2  LEU  66          3HD2      LEU  66  11.059  -6.621   2.294
  548    H    TYR  67           H        TYR  67  12.899  -3.194   0.552
  549    HA   TYR  67           HA       TYR  67  13.336  -0.956   0.644
  550   1HB   TYR  67          2HB       TYR  67  15.050  -2.205   2.579
  551   2HB   TYR  67          1HB       TYR  67  15.852  -0.804   1.884
  552    HD1  TYR  67           1HD      TYR  67  15.556   1.200   2.933
  553    HD2  TYR  67           2HD      TYR  67  12.476  -1.720   3.210
  554    HE1  TYR  67           1HE      TYR  67  14.289   2.692   4.410
  555    HE2  TYR  67           2HE      TYR  67  11.193  -0.230   4.690
  556    HH   TYR  67           HH       TYR  67  11.677   1.679   6.253
  557    H    ASP  68           H        ASP  68  14.958   0.752   0.085
  558    HA   ASP  68           HA       ASP  68  16.809  -0.120  -2.027
  559   1HB   ASP  68          1HB       ASP  68  16.750   2.289  -2.712
  560   2HB   ASP  68          2HB       ASP  68  15.178   1.508  -2.785
  561    H    GLU  69           H        GLU  69  16.511   1.481   1.028
  562    HA   GLU  69           HA       GLU  69  18.030   1.939   2.642
  563   1HB   GLU  69          2HB       GLU  69  20.129   0.848   0.765
  564   2HB   GLU  69          1HB       GLU  69  20.302   1.109   2.495
  565   1HG   GLU  69          2HG       GLU  69  18.605  -0.591   2.924
  566   2HG   GLU  69          1HG       GLU  69  18.430  -0.851   1.188
  567    H    LYS  70           H        LYS  70  18.498   3.037  -0.595
  568    HA   LYS  70           HA       LYS  70  20.454   5.020  -0.116
  569   1HB   LYS  70          1HB       LYS  70  18.288   4.944  -2.227
  570   2HB   LYS  70          2HB       LYS  70  19.698   5.994  -2.247
  571   1HG   LYS  70          1HG       LYS  70  19.785   2.984  -2.326
  572   2HG   LYS  70          2HG       LYS  70  19.934   4.048  -3.727
  573   1HD   LYS  70          1HD       LYS  70  21.938   5.057  -2.744
  574   2HD   LYS  70          2HD       LYS  70  21.791   3.987  -1.349
  575   1HE   LYS  70          1HE       LYS  70  22.064   2.044  -2.810
  576   2HE   LYS  70          2HE       LYS  70  22.205   3.112  -4.205
  577   1HZ   LYS  70          1HZ       LYS  70  24.064   3.046  -1.890
  578   2HZ   LYS  70          2HZ       LYS  70  24.201   4.062  -3.235
  579   3HZ   LYS  70          3HZ       LYS  70  24.371   2.390  -3.419
  580    H    GLN  71           H        GLN  71  17.088   5.734  -1.001
  581    HA   GLN  71           HA       GLN  71  17.021   7.715   1.179
  582   1HB   GLN  71          2HB       GLN  71  15.697   7.898  -1.533
  583   2HB   GLN  71          1HB       GLN  71  15.501   9.062  -0.231
  584   1HG   GLN  71          2HG       GLN  71  17.869   9.604  -0.336
  585   2HG   GLN  71          1HG       GLN  71  18.093   8.411  -1.615
  586   1HE2  GLN  71          2HE2      GLN  71  15.538   9.062  -2.873
  587   2HE2  GLN  71          1HE2      GLN  71  15.776  10.568  -3.684
  588    H    GLN  72           H        GLN  72  16.096   4.818   0.742
  589    HA   GLN  72           HA       GLN  72  14.409   3.476   1.467
  590   1HB   GLN  72          1HB       GLN  72  13.518   5.900   3.044
  591   2HB   GLN  72          2HB       GLN  72  13.209   4.211   3.424
  592   1HG   GLN  72          2HG       GLN  72  15.608   3.867   3.789
  593   2HG   GLN  72          1HG       GLN  72  15.894   5.571   3.442
  594   1HE2  GLN  72          2HE2      GLN  72  13.104   4.423   5.190
  595   2HE2  GLN  72          1HE2      GLN  72  13.552   5.074   6.725
  596    H    HIS  73           H        HIS  73  13.878   4.550  -0.994
  597    HA   HIS  73           HA       HIS  73  10.961   4.896  -0.856
  598   1HB   HIS  73          1HB       HIS  73  11.065   6.296  -2.878
  599   2HB   HIS  73          2HB       HIS  73  11.950   7.014  -1.536
  600    HD1  HIS  73           1HD      HIS  73  12.272   6.879  -4.945
  601    HD2  HIS  73           2HD      HIS  73  14.884   5.868  -1.877
  602    HE1  HIS  73           1HE      HIS  73  14.570   6.981  -5.959
  603    HE2  HIS  73           2HE      HIS  73  16.140   6.457  -4.060
  604    H    ILE  74           H        ILE  74  13.720   3.470  -2.542
  605    HA   ILE  74           HA       ILE  74  11.875   1.897  -4.196
  606    HB   ILE  74           HB       ILE  74  14.878   1.678  -4.242
  607   1HG1  ILE  74          1HG1      ILE  74  14.291   4.047  -4.569
  608   2HG1  ILE  74          2HG1      ILE  74  14.911   3.329  -6.052
  609   1HG2  ILE  74          1HG2      ILE  74  14.483   0.931  -6.545
  610   2HG2  ILE  74          2HG2      ILE  74  12.748   1.116  -6.299
  611   3HG2  ILE  74          3HG2      ILE  74  13.648  -0.084  -5.370
  612   1HD1  ILE  74          1HD1      ILE  74  13.023   4.781  -6.499
  613   2HD1  ILE  74          2HD1      ILE  74  12.014   3.829  -5.410
  614   3HD1  ILE  74          3HD1      ILE  74  12.634   3.107  -6.896
  615    H    VAL  75           H        VAL  75  12.406  -0.503  -4.359
  616    HA   VAL  75           HA       VAL  75  13.206  -1.622  -1.763
  617    HB   VAL  75           HB       VAL  75  10.593  -2.330  -3.093
  618   1HG1  VAL  75          1HG1      VAL  75  10.149  -3.522  -0.999
  619   2HG1  VAL  75          2HG1      VAL  75  11.757  -3.088  -0.418
  620   3HG1  VAL  75          3HG1      VAL  75  11.582  -4.144  -1.818
  621   1HG2  VAL  75          1HG2      VAL  75   9.565  -1.179  -1.124
  622   2HG2  VAL  75          2HG2      VAL  75  10.357  -0.112  -2.284
  623   3HG2  VAL  75          3HG2      VAL  75  11.158  -0.512  -0.763
  624    H    TYR  76           H        TYR  76  15.013  -2.382  -3.053
  625    HA   TYR  76           HA       TYR  76  14.731  -4.247  -5.150
  626   1HB   TYR  76          2HB       TYR  76  16.990  -4.243  -3.155
  627   2HB   TYR  76          1HB       TYR  76  17.038  -4.691  -4.858
  628    HD1  TYR  76           1HD      TYR  76  15.596  -2.397  -6.064
  629    HD2  TYR  76           2HD      TYR  76  18.551  -2.500  -3.004
  630    HE1  TYR  76           1HE      TYR  76  16.284  -0.112  -6.655
  631    HE2  TYR  76           2HE      TYR  76  19.244  -0.215  -3.586
  632    HH   TYR  76           HH       TYR  76  19.151   1.304  -5.515
  633    H    CYS  77           H        CYS  77  13.860  -6.214  -5.083
  634    HA   CYS  77           HA       CYS  77  14.250  -8.025  -2.901
  635   1HB   CYS  77          1HB       CYS  77  11.827  -8.151  -2.271
  636   2HB   CYS  77          2HB       CYS  77  12.623  -6.656  -1.791
  637    HG   CYS  77           HG       CYS  77  11.286  -6.254  -4.766
  638    H    SER  78           H        SER  78  14.926  -9.327  -4.663
  639    HA   SER  78           HA       SER  78  12.956 -10.114  -6.642
  640   1HB   SER  78          2HB       SER  78  14.766 -11.535  -7.545
  641   2HB   SER  78          1HB       SER  78  15.288  -9.862  -7.341
  642    HG   SER  78           HG       SER  78  16.170 -10.583  -5.273
  643    H    ASN  79           H        ASN  79  12.697 -10.721  -3.688
  644    HA   ASN  79           HA       ASN  79  11.531 -13.269  -3.906
  645   1HB   ASN  79          1HB       ASN  79  13.876 -14.034  -3.972
  646   2HB   ASN  79          2HB       ASN  79  14.176 -13.228  -2.435
  647   1HD2  ASN  79          1HD2      ASN  79  12.621 -15.899  -4.019
  648   2HD2  ASN  79          2HD2      ASN  79  12.294 -16.817  -2.593
  649    H    ASP  80           H        ASP  80   9.959 -11.816  -2.951
  650    HA   ASP  80           HA       ASP  80  10.102 -11.823  -0.039
  651   1HB   ASP  80          2HB       ASP  80  11.055  -9.640  -0.794
  652   2HB   ASP  80          1HB       ASP  80   9.519  -9.283  -1.577
  653    H    LEU  81           H        LEU  81   7.986 -11.207   0.952
  654    HA   LEU  81           HA       LEU  81   5.727 -12.309  -0.319
  655   1HB   LEU  81          2HB       LEU  81   6.153 -10.560   2.066
  656   2HB   LEU  81          1HB       LEU  81   4.525 -10.772   1.453
  657    HG   LEU  81           HG       LEU  81   4.667 -13.177   1.804
  658   1HD1  LEU  81          1HD2      LEU  81   7.031 -13.505   1.350
  659   2HD1  LEU  81          2HD2      LEU  81   6.602 -14.176   2.923
  660   3HD1  LEU  81          3HD2      LEU  81   7.451 -12.633   2.825
  661   1HD2  LEU  81          1HD1      LEU  81   3.888 -11.800   3.648
  662   2HD2  LEU  81          2HD1      LEU  81   5.544 -11.601   4.219
  663   3HD2  LEU  81          3HD1      LEU  81   4.787 -13.194   4.247
  664    H    LEU  82           H        LEU  82   7.017  -9.025  -0.193
  665    HA   LEU  82           HA       LEU  82   5.085  -7.684  -1.679
  666   1HB   LEU  82          2HB       LEU  82   7.045  -6.541  -0.787
  667   2HB   LEU  82          1HB       LEU  82   8.100  -7.476  -1.828
  668    HG   LEU  82           HG       LEU  82   7.608  -5.056  -2.485
  669   1HD1  LEU  82          1HD1      LEU  82   7.666  -5.555  -4.838
  670   2HD1  LEU  82          2HD1      LEU  82   7.055  -7.182  -4.543
  671   3HD1  LEU  82          3HD1      LEU  82   8.657  -6.726  -3.967
  672   1HD2  LEU  82          1HD2      LEU  82   5.569  -4.690  -3.780
  673   2HD2  LEU  82          2HD2      LEU  82   5.209  -5.079  -2.098
  674   3HD2  LEU  82          3HD2      LEU  82   5.005  -6.306  -3.350
  675    H    GLY  83           H        GLY  83   7.598  -9.948  -2.667
  676   1HA   GLY  83          1HA       GLY  83   7.293  -9.810  -5.442
  677   2HA   GLY  83          2HA       GLY  83   7.820 -11.232  -4.553
  678    H    ASP  84           H        ASP  84   5.452 -11.644  -3.030
  679    HA   ASP  84           HA       ASP  84   3.776 -13.062  -4.750
  680   1HB   ASP  84          2HB       ASP  84   2.968 -11.769  -2.130
  681   2HB   ASP  84          1HB       ASP  84   2.144 -13.096  -2.939
  682    H    LEU  85           H        LEU  85   3.722  -9.683  -3.792
  683    HA   LEU  85           HA       LEU  85   1.336  -9.048  -5.254
  684   1HB   LEU  85          2HB       LEU  85   3.582  -7.263  -4.318
  685   2HB   LEU  85          1HB       LEU  85   2.053  -6.705  -4.966
  686    HG   LEU  85           HG       LEU  85   2.289  -8.375  -2.471
  687   1HD1  LEU  85          1HD2      LEU  85   3.443  -6.267  -2.123
  688   2HD1  LEU  85          2HD2      LEU  85   1.921  -6.290  -1.235
  689   3HD1  LEU  85          3HD2      LEU  85   2.048  -5.382  -2.742
  690   1HD2  LEU  85          1HD1      LEU  85   0.125  -8.474  -3.604
  691   2HD2  LEU  85          2HD1      LEU  85   0.032  -6.713  -3.579
  692   3HD2  LEU  85          3HD1      LEU  85   0.009  -7.618  -2.066
  693    H    PHE  86           H        PHE  86   4.625  -7.836  -5.826
  694    HA   PHE  86           HA       PHE  86   3.934  -7.506  -8.637
  695   1HB   PHE  86          2HB       PHE  86   6.384  -6.550  -7.139
  696   2HB   PHE  86          1HB       PHE  86   5.911  -6.081  -8.768
  697    HD1  PHE  86           1HD      PHE  86   2.859  -6.008  -7.784
  698    HD2  PHE  86           2HD      PHE  86   6.493  -4.158  -6.564
  699    HE1  PHE  86           1HE      PHE  86   1.586  -4.114  -6.874
  700    HE2  PHE  86           2HE      PHE  86   5.222  -2.252  -5.650
  701    HZ   PHE  86           HZ       PHE  86   2.766  -2.238  -5.804
  702    H    GLY  87           H        GLY  87   6.333  -9.182  -6.637
  703   1HA   GLY  87          1HA       GLY  87   8.039 -10.636  -7.241
  704   2HA   GLY  87          2HA       GLY  87   7.380 -10.679  -8.871
  705    H    VAL  88           H        VAL  88   7.944  -7.630  -7.395
  706    HA   VAL  88           HA       VAL  88   9.373  -6.697  -9.621
  707    HB   VAL  88           HB       VAL  88   7.996  -5.414  -7.821
  708   1HG1  VAL  88          1HG1      VAL  88   9.366  -4.243  -6.168
  709   2HG1  VAL  88          2HG1      VAL  88  10.744  -5.244  -6.630
  710   3HG1  VAL  88          3HG1      VAL  88   9.322  -5.985  -5.895
  711   1HG2  VAL  88          1HG2      VAL  88  10.459  -4.279  -9.088
  712   2HG2  VAL  88          2HG2      VAL  88   9.163  -3.320  -8.372
  713   3HG2  VAL  88          3HG2      VAL  88   8.835  -4.339  -9.774
  714    HA   PRO  89           HA       PRO  89  13.683  -7.196  -8.201
  715   1HB   PRO  89          2HB       PRO  89  14.763  -5.279  -9.771
  716   2HB   PRO  89          1HB       PRO  89  14.368  -6.889 -10.382
  717   1HG   PRO  89          1HG       PRO  89  12.825  -4.334 -10.632
  718   2HG   PRO  89          2HG       PRO  89  13.137  -5.577 -11.858
  719   1HD   PRO  89          2HD       PRO  89  10.795  -5.402 -10.488
  720   2HD   PRO  89          1HD       PRO  89  11.454  -6.939 -11.082
  721    H    SER  90           H        SER  90  11.484  -4.570  -8.011
  722    HA   SER  90           HA       SER  90  12.524  -3.269  -5.800
  723   1HB   SER  90          2HB       SER  90  13.562  -1.257  -6.849
  724   2HB   SER  90          1HB       SER  90  14.520  -2.730  -6.987
  725    HG   SER  90           HG       SER  90  12.814  -2.418  -9.079
  726    H    PHE  91           H        PHE  91  10.941  -1.976  -5.070
  727    HA   PHE  91           HA       PHE  91   9.244  -0.672  -7.090
  728   1HB   PHE  91          1HB       PHE  91   7.249  -1.305  -6.125
  729   2HB   PHE  91          2HB       PHE  91   8.219  -2.751  -5.916
  730    HD1  PHE  91           1HD      PHE  91   6.834   0.194  -4.191
  731    HD2  PHE  91           2HD      PHE  91   8.690  -3.609  -3.744
  732    HE1  PHE  91           1HE      PHE  91   6.268   0.202  -1.799
  733    HE2  PHE  91           2HE      PHE  91   8.119  -3.614  -1.354
  734    HZ   PHE  91           HZ       PHE  91   6.910  -1.702  -0.377
  735    H    SER  92           H        SER  92   8.193   1.270  -6.450
  736    HA   SER  92           HA       SER  92   9.942   2.705  -4.572
  737   1HB   SER  92          2HB       SER  92   9.576   4.683  -6.038
  738   2HB   SER  92          1HB       SER  92  10.352   3.340  -6.876
  739    HG   SER  92           HG       SER  92   7.686   3.122  -7.078
  740    H    VAL  93           H        VAL  93   8.536   2.429  -2.798
  741    HA   VAL  93           HA       VAL  93   5.895   3.131  -2.520
  742    HB   VAL  93           HB       VAL  93   6.957   4.225  -0.247
  743   1HG1  VAL  93          1HG2      VAL  93   6.530   2.042   0.779
  744   2HG1  VAL  93          2HG2      VAL  93   6.471   1.304  -0.822
  745   3HG1  VAL  93          3HG2      VAL  93   5.252   2.490  -0.350
  746   1HG2  VAL  93          1HG1      VAL  93   8.885   2.124  -1.212
  747   2HG2  VAL  93          2HG1      VAL  93   8.844   2.808   0.413
  748   3HG2  VAL  93          3HG1      VAL  93   9.239   3.836  -0.966
  749    H    LYS  94           H        LYS  94   8.523   5.191  -3.323
  750    HA   LYS  94           HA       LYS  94   7.663   7.626  -2.265
  751   1HB   LYS  94          1HB       LYS  94   9.903   7.221  -3.240
  752   2HB   LYS  94          2HB       LYS  94   9.179   7.167  -4.840
  753   1HG   LYS  94          1HG       LYS  94  10.182   9.317  -4.495
  754   2HG   LYS  94          2HG       LYS  94   8.427   9.499  -4.541
  755   1HD   LYS  94          2HD       LYS  94   8.374   9.559  -2.090
  756   2HD   LYS  94          1HD       LYS  94  10.131   9.390  -2.053
  757   1HE   LYS  94          1HE       LYS  94   9.474  11.716  -1.751
  758   2HE   LYS  94          2HE       LYS  94  10.365  11.501  -3.257
  759   1HZ   LYS  94          1HZ       LYS  94   8.438  12.925  -3.559
  760   2HZ   LYS  94          2HZ       LYS  94   7.412  11.695  -3.016
  761   3HZ   LYS  94          3HZ       LYS  94   8.272  11.501  -4.459
  762    H    GLU  95           H        GLU  95   6.231   5.726  -4.661
  763    HA   GLU  95           HA       GLU  95   5.036   8.017  -6.043
  764   1HB   GLU  95          1HB       GLU  95   4.863   5.097  -6.792
  765   2HB   GLU  95          2HB       GLU  95   4.412   6.474  -7.786
  766   1HG   GLU  95          2HG       GLU  95   6.860   7.179  -7.606
  767   2HG   GLU  95          1HG       GLU  95   7.151   5.545  -7.007
  768    H    HIS  96           H        HIS  96   4.197   5.181  -4.144
  769    HA   HIS  96           HA       HIS  96   2.249   4.393  -3.269
  770   1HB   HIS  96          2HB       HIS  96   1.232   7.197  -3.776
  771   2HB   HIS  96          1HB       HIS  96   0.439   5.983  -2.778
  772    HD1  HIS  96           1HD      HIS  96   1.081   5.927  -0.371
  773    HD2  HIS  96           2HD      HIS  96   3.813   8.036  -2.682
  774    HE1  HIS  96           1HE      HIS  96   2.687   6.960   1.264
  775    HE2  HIS  96           2HE      HIS  96   4.274   8.311  -0.151
  776    H    ARG  97           H        ARG  97   0.930   6.679  -5.663
  777    HA   ARG  97           HA       ARG  97  -1.204   5.221  -6.471
  778   1HB   ARG  97          2HB       ARG  97  -0.501   7.557  -7.206
  779   2HB   ARG  97          1HB       ARG  97   0.476   6.774  -8.439
  780   1HG   ARG  97          1HG       ARG  97  -2.447   6.184  -8.205
  781   2HG   ARG  97          2HG       ARG  97  -1.873   7.620  -9.055
  782   1HD   ARG  97          2HD       ARG  97  -1.121   4.767  -9.676
  783   2HD   ARG  97          1HD       ARG  97  -2.235   5.773 -10.602
  784    HE   ARG  97           HE       ARG  97   0.210   7.111 -10.443
  785   1HH1  ARG  97          2HH1      ARG  97  -1.123   4.216 -11.854
  786   2HH1  ARG  97          1HH1      ARG  97  -0.013   4.199 -13.182
  787   1HH2  ARG  97          1HH2      ARG  97   1.677   7.094 -12.189
  788   2HH2  ARG  97          2HH2      ARG  97   1.580   5.834 -13.372
  789    H    LYS  98           H        LYS  98   2.129   4.790  -7.543
  790    HA   LYS  98           HA       LYS  98   1.497   2.990  -9.662
  791   1HB   LYS  98          1HB       LYS  98   3.562   4.322  -9.647
  792   2HB   LYS  98          2HB       LYS  98   4.118   3.445  -8.229
  793   1HG   LYS  98          2HG       LYS  98   5.213   2.584 -10.183
  794   2HG   LYS  98          1HG       LYS  98   4.111   1.362  -9.549
  795   1HD   LYS  98          2HD       LYS  98   3.914   1.427 -11.948
  796   2HD   LYS  98          1HD       LYS  98   2.434   2.068 -11.234
  797   1HE   LYS  98          2HE       LYS  98   3.148   3.425 -13.127
  798   2HE   LYS  98          1HE       LYS  98   3.225   4.346 -11.624
  799   1HZ   LYS  98          1HZ       LYS  98   5.608   3.940 -11.541
  800   2HZ   LYS  98          2HZ       LYS  98   5.183   4.718 -12.982
  801   3HZ   LYS  98          3HZ       LYS  98   5.532   3.064 -12.986
  802    H    ILE  99           H        ILE  99   3.454   2.286  -6.789
  803    HA   ILE  99           HA       ILE  99   3.304  -0.404  -6.584
  804    HB   ILE  99           HB       ILE  99   2.672   1.242  -4.142
  805   1HG1  ILE  99          1HG1      ILE  99   5.304   1.306  -4.039
  806   2HG1  ILE  99          2HG1      ILE  99   5.151   1.222  -5.794
  807   1HG2  ILE  99          1HG2      ILE  99   4.304  -1.251  -4.600
  808   2HG2  ILE  99          2HG2      ILE  99   2.756  -1.126  -3.764
  809   3HG2  ILE  99          3HG2      ILE  99   4.201  -0.392  -3.064
  810   1HD1  ILE  99          1HD1      ILE  99   4.831   3.415  -5.779
  811   2HD1  ILE  99          2HD1      ILE  99   4.729   3.441  -4.018
  812   3HD1  ILE  99          3HD1      ILE  99   3.283   3.116  -4.982
  813    H    TYR 100           H        TYR 100   0.700   1.857  -6.046
  814    HA   TYR 100           HA       TYR 100  -0.760  -0.104  -4.522
  815   1HB   TYR 100          2HB       TYR 100  -1.218   2.825  -5.054
  816   2HB   TYR 100          1HB       TYR 100  -2.363   1.828  -4.159
  817    HD1  TYR 100           1HD      TYR 100  -1.668   3.838  -2.502
  818    HD2  TYR 100           2HD      TYR 100   0.805   0.538  -3.553
  819    HE1  TYR 100           1HE      TYR 100  -0.352   4.171  -0.450
  820    HE2  TYR 100           2HE      TYR 100   2.111   0.855  -1.517
  821    HH   TYR 100           HH       TYR 100   2.638   2.646   0.080
  822    H    THR 101           H        THR 101  -0.710   1.184  -7.695
  823    HA   THR 101           HA       THR 101  -3.409   0.291  -8.323
  824    HB   THR 101           HB       THR 101  -2.475   2.398  -9.324
  825    HG1  THR 101           1HG      THR 101  -3.388   0.259 -10.953
  826   1HG2  THR 101          1HG2      THR 101  -0.941   2.169 -11.232
  827   2HG2  THR 101          2HG2      THR 101  -0.774   0.448 -10.881
  828   3HG2  THR 101          3HG2      THR 101  -0.194   1.644  -9.723
  829    H    MET 102           H        MET 102  -0.110  -0.754  -8.631
  830    HA   MET 102           HA       MET 102  -0.662  -2.885 -10.477
  831   1HB   MET 102          2HB       MET 102   1.686  -2.710  -8.594
  832   2HB   MET 102          1HB       MET 102   1.592  -3.571 -10.125
  833   1HG   MET 102          2HG       MET 102   1.423  -1.436 -11.305
  834   2HG   MET 102          1HG       MET 102   1.533  -0.594  -9.761
  835   1HE   MET 102          1HE       MET 102   3.572  -1.677  -8.055
  836   2HE   MET 102          2HE       MET 102   3.822  -0.010  -8.572
  837   3HE   MET 102          3HE       MET 102   5.160  -1.161  -8.627
  838    H    ILE 103           H        ILE 103  -0.518  -2.480  -6.994
  839    HA   ILE 103           HA       ILE 103  -0.950  -5.218  -6.369
  840    HB   ILE 103           HB       ILE 103  -1.504  -2.724  -4.761
  841   1HG1  ILE 103          1HG1      ILE 103   0.680  -4.804  -4.503
  842   2HG1  ILE 103          2HG1      ILE 103   0.880  -3.232  -5.270
  843   1HG2  ILE 103          1HG2      ILE 103  -1.762  -4.185  -2.826
  844   2HG2  ILE 103          2HG2      ILE 103  -1.589  -5.602  -3.863
  845   3HG2  ILE 103          3HG2      ILE 103  -2.981  -4.535  -4.051
  846   1HD1  ILE 103          1HD1      ILE 103   1.761  -3.224  -3.014
  847   2HD1  ILE 103          2HD1      ILE 103   0.187  -3.711  -2.382
  848   3HD1  ILE 103          3HD1      ILE 103   0.382  -2.135  -3.149
  849    H    TYR 104           H        TYR 104  -3.060  -2.421  -6.840
  850    HA   TYR 104           HA       TYR 104  -5.374  -4.247  -6.896
  851   1HB   TYR 104          1HB       TYR 104  -5.393  -1.288  -6.273
  852   2HB   TYR 104          2HB       TYR 104  -6.765  -2.387  -6.193
  853    HD1  TYR 104           1HD      TYR 104  -3.640  -1.360  -4.568
  854    HD2  TYR 104           2HD      TYR 104  -7.063  -3.874  -4.319
  855    HE1  TYR 104           1HE      TYR 104  -3.132  -1.808  -2.204
  856    HE2  TYR 104           2HE      TYR 104  -6.566  -4.327  -1.953
  857    HH   TYR 104           HH       TYR 104  -4.630  -4.290  -0.439
  858    H    ARG 105           H        ARG 105  -5.781  -4.678  -8.990
  859    HA   ARG 105           HA       ARG 105  -5.138  -2.698 -11.013
  860   1HB   ARG 105          2HB       ARG 105  -6.095  -5.550 -11.291
  861   2HB   ARG 105          1HB       ARG 105  -5.578  -4.518 -12.617
  862   1HG   ARG 105          2HG       ARG 105  -3.338  -4.398 -11.657
  863   2HG   ARG 105          1HG       ARG 105  -3.856  -5.429 -10.320
  864   1HD   ARG 105          1HD       ARG 105  -4.360  -7.225 -11.905
  865   2HD   ARG 105          2HD       ARG 105  -3.838  -6.195 -13.238
  866    HE   ARG 105           HE       ARG 105  -1.732  -6.336 -11.432
  867   1HH1  ARG 105          2HH1      ARG 105  -3.525  -8.488 -13.504
  868   2HH1  ARG 105          1HH1      ARG 105  -2.193  -9.570 -13.748
  869   1HH2  ARG 105          1HH2      ARG 105   0.025  -7.754 -11.746
  870   2HH2  ARG 105          2HH2      ARG 105  -0.175  -9.153 -12.749
  871    H    ASN 106           H        ASN 106  -7.841  -4.973 -11.160
  872    HA   ASN 106           HA       ASN 106  -9.427  -3.079 -12.562
  873   1HB   ASN 106          2HB       ASN 106 -10.193  -5.749 -11.360
  874   2HB   ASN 106          1HB       ASN 106 -11.182  -4.823 -12.484
  875   1HD2  ASN 106          2HD2      ASN 106  -8.873  -3.930 -14.030
  876   2HD2  ASN 106          1HD2      ASN 106  -8.369  -5.293 -14.962
  877    H    LEU 107           H        LEU 107  -9.974  -1.300 -11.406
  878    HA   LEU 107           HA       LEU 107 -10.357  -1.079  -8.702
  879   1HB   LEU 107          2HB       LEU 107 -10.204   0.733 -10.524
  880   2HB   LEU 107          1HB       LEU 107 -11.942   0.563 -10.658
  881    HG   LEU 107           HG       LEU 107 -11.221   2.472  -9.239
  882   1HD1  LEU 107          1HD1      LEU 107 -12.765   0.314  -7.809
  883   2HD1  LEU 107          2HD1      LEU 107 -13.426   1.495  -8.941
  884   3HD1  LEU 107          3HD1      LEU 107 -12.765   2.029  -7.396
  885   1HD2  LEU 107          1HD2      LEU 107 -10.227   0.308  -7.393
  886   2HD2  LEU 107          2HD2      LEU 107 -10.338   2.025  -7.007
  887   3HD2  LEU 107          3HD2      LEU 107  -9.229   1.472  -8.262
  888    H    VAL 108           H        VAL 108 -11.705  -2.188  -7.445
  889    HA   VAL 108           HA       VAL 108 -14.459  -1.650  -7.533
  890    HB   VAL 108           HB       VAL 108 -14.638  -3.249  -9.309
  891   1HG1  VAL 108          1HG2      VAL 108 -13.174  -5.182  -7.518
  892   2HG1  VAL 108          2HG2      VAL 108 -12.553  -4.445  -8.994
  893   3HG1  VAL 108          3HG2      VAL 108 -13.903  -5.578  -9.075
  894   1HG2  VAL 108          1HG1      VAL 108 -16.424  -3.298  -7.664
  895   2HG2  VAL 108          2HG1      VAL 108 -15.540  -4.490  -6.713
  896   3HG2  VAL 108          3HG1      VAL 108 -16.141  -4.911  -8.316
  897    H    VAL 109           H        VAL 109 -14.064  -1.088  -5.394
  898    HA   VAL 109           HA       VAL 109 -13.605  -3.353  -3.564
  899    HB   VAL 109           HB       VAL 109 -11.955  -1.802  -3.036
  900   1HG1  VAL 109          1HG2      VAL 109 -13.998   0.407  -3.234
  901   2HG1  VAL 109          2HG2      VAL 109 -12.752   0.037  -4.425
  902   3HG1  VAL 109          3HG2      VAL 109 -12.296   0.604  -2.819
  903   1HG2  VAL 109          1HG1      VAL 109 -12.587  -0.861  -0.852
  904   2HG2  VAL 109          2HG1      VAL 109 -13.135  -2.525  -1.051
  905   3HG2  VAL 109          3HG1      VAL 109 -14.279  -1.193  -1.215
  906    H    VAL 110           H        VAL 110 -15.215  -0.195  -3.127
  907    HA   VAL 110           HA       VAL 110 -17.369  -1.501  -1.693
  908    HB   VAL 110           HB       VAL 110 -16.993   1.430  -2.331
  909   1HG1  VAL 110          1HG2      VAL 110 -18.813   0.061  -0.352
  910   2HG1  VAL 110          2HG2      VAL 110 -19.312   0.857  -1.844
  911   3HG1  VAL 110          3HG2      VAL 110 -18.611   1.805  -0.532
  912   1HG2  VAL 110          1HG1      VAL 110 -16.307  -0.124   0.162
  913   2HG2  VAL 110          2HG1      VAL 110 -16.199   1.627  -0.020
  914   3HG2  VAL 110          3HG1      VAL 110 -15.159   0.576  -0.979
  915    H    ASN 111           H        ASN 111 -19.505  -1.595  -2.318
  916    HA   ASN 111           HA       ASN 111 -20.042  -2.022  -5.004
  917   1HB   ASN 111          1HB       ASN 111 -22.004  -1.332  -2.805
  918   2HB   ASN 111          2HB       ASN 111 -22.425  -2.046  -4.359
  919   1HD2  ASN 111          2HD2      ASN 111 -20.934  -2.574  -1.270
  920   2HD2  ASN 111          1HD2      ASN 111 -20.869  -4.297  -1.368
  921    H    GLN 112           H        GLN 112 -21.638   0.564  -3.153
  922    HA   GLN 112           HA       GLN 112 -22.381   2.626  -3.753
  923   1HB   GLN 112          2HB       GLN 112 -19.921   2.557  -5.511
  924   2HB   GLN 112          1HB       GLN 112 -20.850   3.999  -5.125
  925   1HG   GLN 112          2HG       GLN 112 -20.306   3.718  -2.759
  926   2HG   GLN 112          1HG       GLN 112 -19.367   2.277  -3.152
  927   1HE2  GLN 112          2HE2      GLN 112 -19.442   5.110  -5.184
  928   2HE2  GLN 112          1HE2      GLN 112 -17.813   5.603  -4.891
  929    H    GLN 113           H        GLN 113 -24.165   1.355  -4.782
  930    HA   GLN 113           HA       GLN 113 -24.356   2.114  -7.607
  931   1HB   GLN 113          2HB       GLN 113 -25.161  -0.576  -6.483
  932   2HB   GLN 113          1HB       GLN 113 -25.496  -0.022  -8.117
  933   1HG   GLN 113          2HG       GLN 113 -23.100   0.110  -8.568
  934   2HG   GLN 113          1HG       GLN 113 -22.763  -0.442  -6.927
  935   1HE2  GLN 113          2HE2      GLN 113 -21.666  -2.257  -7.642
  936   2HE2  GLN 113          1HE2      GLN 113 -22.475  -3.612  -8.343
  937    H    GLU 114           H        GLU 114 -25.998   1.174  -4.632
  938    HA   GLU 114           HA       GLU 114 -28.581   2.035  -5.586
  939   1HB   GLU 114          2HB       GLU 114 -27.585   1.136  -2.883
  940   2HB   GLU 114          1HB       GLU 114 -29.239   1.662  -3.161
  941   1HG   GLU 114          1HG       GLU 114 -29.128  -0.736  -3.215
  942   2HG   GLU 114          2HG       GLU 114 -29.509  -0.125  -4.824
  943    H    SER 115           H        SER 115 -28.548   4.187  -6.060
  944    HA   SER 115           HA       SER 115 -27.609   6.058  -4.011
  945   1HB   SER 115          1HB       SER 115 -28.418   6.546  -6.888
  946   2HB   SER 115          2HB       SER 115 -27.795   7.771  -5.783
  947    HG   SER 115           HG       SER 115 -26.331   5.419  -6.270
  948    H    SER 116           H        SER 116 -29.037   6.842  -2.624
  949    HA   SER 116           HA       SER 116 -31.652   7.700  -3.544
  950   1HB   SER 116          2HB       SER 116 -32.068   5.366  -2.925
  951   2HB   SER 116          1HB       SER 116 -31.355   5.647  -1.337
  952    HG   SER 116           HG       SER 116 -33.106   6.690  -0.716
  953    H    ASP 117           H        ASP 117 -28.994   7.860  -1.447
  954    HA   ASP 117           HA       ASP 117 -30.286   9.554   0.521
  955   1HB   ASP 117          2HB       ASP 117 -28.053   9.659   1.563
  956   2HB   ASP 117          1HB       ASP 117 -28.556   7.998   1.265
  957    H    SER 118           H        SER 118 -29.247  11.674   1.077
  958    HA   SER 118           HA       SER 118 -28.005  13.062  -1.159
  959   1HB   SER 118          2HB       SER 118 -30.399  13.348  -1.596
  960   2HB   SER 118          1HB       SER 118 -30.636  13.966   0.039
  961    HG   SER 118           HG       SER 118 -29.957  15.844  -0.601
  962    H    SER 119           H        SER 119 -26.285  13.969  -0.262
  963    HA   SER 119           HA       SER 119 -24.922  15.084   1.175
  964   1HB   SER 119          1HB       SER 119 -27.525  16.365   2.045
  965   2HB   SER 119          2HB       SER 119 -25.913  16.971   2.427
  966    HG   SER 119           HG       SER 119 -25.779  16.773  -0.085
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1 -11.972 -20.936 -31.154
    2   2H    MET   1          2H        MET   1 -12.212 -19.360 -31.716
    3   3H    MET   1          3H        MET   1 -13.542 -20.330 -31.330
    4    HA   MET   1           HA       MET   1 -13.140 -18.695 -29.611
    5   1HB   MET   1          2HB       MET   1 -14.001 -21.038 -29.131
    6   2HB   MET   1          1HB       MET   1 -12.369 -21.442 -28.619
    7   1HG   MET   1          1HG       MET   1 -12.481 -19.721 -26.891
    8   2HG   MET   1          2HG       MET   1 -14.120 -19.318 -27.403
    9   1HE   MET   1          1HE       MET   1 -12.486 -22.897 -27.185
   10   2HE   MET   1          2HE       MET   1 -12.933 -23.374 -25.546
   11   3HE   MET   1          3HE       MET   1 -11.801 -22.046 -25.801
   12    H    CYS   2           H        CYS   2 -10.539 -19.235 -31.184
   13    HA   CYS   2           HA       CYS   2  -8.295 -18.915 -30.962
   14   1HB   CYS   2          2HB       CYS   2  -7.685 -16.910 -29.854
   15   2HB   CYS   2          1HB       CYS   2  -9.328 -16.662 -30.433
   16    HG   CYS   2           HG       CYS   2  -8.143 -16.592 -27.330
   17    H    ASN   3           H        ASN   3  -6.684 -18.240 -28.786
   18    HA   ASN   3           HA       ASN   3  -7.059 -20.357 -26.815
   19   1HB   ASN   3          1HB       ASN   3  -4.611 -20.168 -28.586
   20   2HB   ASN   3          2HB       ASN   3  -4.773 -21.232 -27.191
   21   1HD2  ASN   3          1HD2      ASN   3  -5.770 -20.611 -30.457
   22   2HD2  ASN   3          2HD2      ASN   3  -6.492 -22.154 -30.744
   23    H    THR   4           H        THR   4  -7.202 -17.550 -26.551
   24    HA   THR   4           HA       THR   4  -4.733 -16.538 -25.502
   25    HB   THR   4           HB       THR   4  -6.071 -14.617 -24.734
   26    HG1  THR   4           1HG      THR   4  -8.077 -16.393 -24.918
   27   1HG2  THR   4          1HG2      THR   4  -6.725 -15.502 -27.547
   28   2HG2  THR   4          2HG2      THR   4  -5.267 -14.651 -27.040
   29   3HG2  THR   4          3HG2      THR   4  -6.836 -13.851 -26.937
   30    H    ASN   5           H        ASN   5  -4.014 -16.503 -23.442
   31    HA   ASN   5           HA       ASN   5  -5.801 -17.450 -21.314
   32   1HB   ASN   5          2HB       ASN   5  -4.030 -18.885 -20.411
   33   2HB   ASN   5          1HB       ASN   5  -4.460 -19.373 -22.048
   34   1HD2  ASN   5          2HD2      ASN   5  -2.012 -19.828 -20.519
   35   2HD2  ASN   5          1HD2      ASN   5  -0.731 -19.169 -21.473
   36    H    MET   6           H        MET   6  -3.135 -15.514 -22.364
   37    HA   MET   6           HA       MET   6  -3.136 -14.152 -19.760
   38   1HB   MET   6          1HB       MET   6  -0.686 -14.815 -21.403
   39   2HB   MET   6          2HB       MET   6  -0.695 -13.821 -19.953
   40   1HG   MET   6          1HG       MET   6  -1.451 -16.731 -20.106
   41   2HG   MET   6          2HG       MET   6   0.067 -16.083 -19.486
   42   1HE   MET   6          1HE       MET   6  -1.130 -14.133 -16.304
   43   2HE   MET   6          2HE       MET   6  -0.941 -13.485 -17.933
   44   3HE   MET   6          3HE       MET   6   0.256 -14.605 -17.285
   45    H    SER   7           H        SER   7  -3.113 -11.962 -19.838
   46    HA   SER   7           HA       SER   7  -2.457 -10.603 -22.329
   47   1HB   SER   7          1HB       SER   7  -5.150 -10.296 -20.976
   48   2HB   SER   7          2HB       SER   7  -4.571  -9.325 -22.331
   49    HG   SER   7           HG       SER   7  -5.961 -11.291 -22.733
   50    H    VAL   8           H        VAL   8  -0.690  -9.800 -21.122
   51    HA   VAL   8           HA       VAL   8  -1.390  -7.945 -18.946
   52    HB   VAL   8           HB       VAL   8   0.993  -8.092 -18.276
   53   1HG1  VAL   8          1HG1      VAL   8  -0.669  -9.506 -17.199
   54   2HG1  VAL   8          2HG1      VAL   8   0.870 -10.356 -17.343
   55   3HG1  VAL   8          3HG1      VAL   8  -0.452 -10.735 -18.447
   56   1HG2  VAL   8          1HG2      VAL   8   1.961  -8.668 -20.434
   57   2HG2  VAL   8          2HG2      VAL   8   1.139 -10.228 -20.401
   58   3HG2  VAL   8          3HG2      VAL   8   2.395  -9.869 -19.218
   59    HA   PRO   9           HA       PRO   9  -0.193  -4.645 -21.681
   60   1HB   PRO   9          2HB       PRO   9  -0.274  -2.618 -19.917
   61   2HB   PRO   9          1HB       PRO   9  -1.745  -3.410 -20.495
   62   1HG   PRO   9          1HG       PRO   9  -0.260  -3.806 -17.924
   63   2HG   PRO   9          2HG       PRO   9  -2.008  -3.683 -18.199
   64   1HD   PRO   9          2HD       PRO   9  -0.692  -6.057 -17.869
   65   2HD   PRO   9          1HD       PRO   9  -2.188  -5.887 -18.808
   66    H    THR  10           H        THR  10   1.724  -3.886 -22.347
   67    HA   THR  10           HA       THR  10   4.118  -4.501 -20.976
   68    HB   THR  10           HB       THR  10   3.735  -2.558 -23.264
   69    HG1  THR  10           1HG      THR  10   3.127  -4.991 -23.372
   70   1HG2  THR  10          1HG2      THR  10   6.091  -3.037 -23.756
   71   2HG2  THR  10          2HG2      THR  10   6.184  -4.050 -22.315
   72   3HG2  THR  10          3HG2      THR  10   5.902  -2.316 -22.158
   73    H    ASP  11           H        ASP  11   2.065  -1.691 -21.029
   74    HA   ASP  11           HA       ASP  11   4.043  -0.078 -19.615
   75   1HB   ASP  11          2HB       ASP  11   1.253   0.610 -20.564
   76   2HB   ASP  11          1HB       ASP  11   2.380   1.739 -19.817
   77    H    GLY  12           H        GLY  12   3.847   0.583 -17.507
   78   1HA   GLY  12          1HA       GLY  12   2.127  -1.068 -15.846
   79   2HA   GLY  12          2HA       GLY  12   3.405   0.003 -15.288
   80    H    ALA  13           H        ALA  13   1.331   1.490 -17.510
   81    HA   ALA  13           HA       ALA  13   0.087   3.020 -15.350
   82   1HB   ALA  13          1HB       ALA  13  -0.462   4.659 -17.067
   83   2HB   ALA  13          2HB       ALA  13   0.170   3.581 -18.313
   84   3HB   ALA  13          3HB       ALA  13   1.257   4.265 -17.104
   85    H    VAL  14           H        VAL  14  -2.029   2.938 -14.891
   86    HA   VAL  14           HA       VAL  14  -3.817   1.541 -16.766
   87    HB   VAL  14           HB       VAL  14  -3.860   1.220 -13.761
   88   1HG1  VAL  14          1HG1      VAL  14  -5.558  -0.496 -14.200
   89   2HG1  VAL  14          2HG1      VAL  14  -5.510  -0.095 -15.918
   90   3HG1  VAL  14          3HG1      VAL  14  -6.078   1.098 -14.749
   91   1HG2  VAL  14          1HG2      VAL  14  -3.014  -0.722 -15.908
   92   2HG2  VAL  14          2HG2      VAL  14  -3.165  -1.091 -14.190
   93   3HG2  VAL  14          3HG2      VAL  14  -1.954   0.066 -14.740
   94    H    THR  15           H        THR  15  -4.096   3.223 -13.631
   95    HA   THR  15           HA       THR  15  -6.127   4.971 -14.861
   96    HB   THR  15           HB       THR  15  -6.109   4.254 -11.934
   97    HG1  THR  15           1HG      THR  15  -7.816   2.737 -12.588
   98   1HG2  THR  15          1HG2      THR  15  -8.274   5.251 -13.792
   99   2HG2  THR  15          2HG2      THR  15  -7.406   6.223 -12.603
  100   3HG2  THR  15          3HG2      THR  15  -8.466   4.917 -12.072
  101    H    THR  16           H        THR  16  -3.219   5.344 -14.575
  102    HA   THR  16           HA       THR  16  -1.776   7.043 -14.146
  103    HB   THR  16           HB       THR  16  -4.233   8.604 -13.328
  104    HG1  THR  16           1HG      THR  16  -4.613   8.403 -15.412
  105   1HG2  THR  16          1HG2      THR  16  -2.159   9.617 -12.523
  106   2HG2  THR  16          2HG2      THR  16  -2.863  10.578 -13.823
  107   3HG2  THR  16          3HG2      THR  16  -1.478   9.535 -14.148
  108    H    SER  17           H        SER  17  -4.105   7.916 -11.621
  109    HA   SER  17           HA       SER  17  -2.007   7.339  -9.634
  110   1HB   SER  17          1HB       SER  17  -2.969   9.171  -8.284
  111   2HB   SER  17          2HB       SER  17  -2.433   9.740  -9.866
  112    HG   SER  17           HG       SER  17  -5.079   9.218  -9.005
  113    H    GLN  18           H        GLN  18  -3.178   7.364  -7.313
  114    HA   GLN  18           HA       GLN  18  -5.653   5.797  -7.426
  115   1HB   GLN  18          2HB       GLN  18  -3.753   4.206  -7.213
  116   2HB   GLN  18          1HB       GLN  18  -3.236   5.064  -5.763
  117   1HG   GLN  18          2HG       GLN  18  -4.432   3.049  -5.179
  118   2HG   GLN  18          1HG       GLN  18  -5.319   4.484  -4.656
  119   1HE2  GLN  18          2HE2      GLN  18  -7.241   5.028  -5.682
  120   2HE2  GLN  18          1HE2      GLN  18  -8.101   3.911  -6.681
  121    H    ILE  19           H        ILE  19  -3.318   7.663  -5.570
  122    HA   ILE  19           HA       ILE  19  -4.776   7.243  -3.191
  123    HB   ILE  19           HB       ILE  19  -3.019   8.622  -2.093
  124   1HG1  ILE  19          2HG1      ILE  19  -1.792   8.620  -4.861
  125   2HG1  ILE  19          1HG1      ILE  19  -2.497  10.032  -4.078
  126   1HG2  ILE  19          1HG2      ILE  19  -2.263   6.280  -3.823
  127   2HG2  ILE  19          2HG2      ILE  19  -2.776   6.264  -2.133
  128   3HG2  ILE  19          3HG2      ILE  19  -1.206   6.944  -2.573
  129   1HD1  ILE  19          1HD1      ILE  19  -0.081  10.043  -3.904
  130   2HD1  ILE  19          2HD1      ILE  19  -0.121   8.475  -3.097
  131   3HD1  ILE  19          3HD1      ILE  19  -0.826   9.888  -2.313
  132    HA   PRO  20           HA       PRO  20  -5.870  11.915  -3.757
  133   1HB   PRO  20          2HB       PRO  20  -6.240  12.685  -6.316
  134   2HB   PRO  20          1HB       PRO  20  -4.675  12.828  -5.508
  135   1HG   PRO  20          2HG       PRO  20  -5.640  10.744  -7.428
  136   2HG   PRO  20          1HG       PRO  20  -4.058  11.542  -7.343
  137   1HD   PRO  20          1HD       PRO  20  -4.550   9.039  -6.340
  138   2HD   PRO  20          2HD       PRO  20  -3.297  10.117  -5.705
  139    H    ALA  21           H        ALA  21  -7.126   9.149  -4.166
  140    HA   ALA  21           HA       ALA  21  -9.587   9.618  -5.545
  141   1HB   ALA  21          1HB       ALA  21 -10.280   7.475  -4.605
  142   2HB   ALA  21          2HB       ALA  21  -8.873   7.478  -3.541
  143   3HB   ALA  21          3HB       ALA  21  -8.658   7.368  -5.288
  144    H    SER  22           H        SER  22 -11.104   8.284  -3.265
  145    HA   SER  22           HA       SER  22 -12.142  10.682  -2.112
  146   1HB   SER  22          1HB       SER  22 -13.593   8.758  -2.582
  147   2HB   SER  22          2HB       SER  22 -12.698   7.789  -1.411
  148    HG   SER  22           HG       SER  22 -14.699   8.787  -0.642
  149    H    GLU  23           H        GLU  23  -9.348   9.177  -1.482
  150    HA   GLU  23           HA       GLU  23  -7.964   8.854   0.294
  151   1HB   GLU  23          1HB       GLU  23  -8.199  11.312   0.376
  152   2HB   GLU  23          2HB       GLU  23  -9.565  11.134   1.467
  153   1HG   GLU  23          1HG       GLU  23  -8.109  10.091   3.125
  154   2HG   GLU  23          2HG       GLU  23  -6.738  10.268   2.031
  155    H    GLN  24           H        GLN  24  -8.577   6.814   0.977
  156    HA   GLN  24           HA       GLN  24  -9.681   5.163   2.094
  157   1HB   GLN  24          1HB       GLN  24  -9.057   6.430   4.122
  158   2HB   GLN  24          2HB       GLN  24 -10.530   7.377   3.973
  159   1HG   GLN  24          1HG       GLN  24 -11.866   5.360   4.293
  160   2HG   GLN  24          2HG       GLN  24 -10.389   4.405   4.436
  161   1HE2  GLN  24          2HE2      GLN  24 -10.893   3.724   6.507
  162   2HE2  GLN  24          1HE2      GLN  24 -10.808   4.775   7.874
  163    H    GLU  25           H        GLU  25 -11.712   4.174   2.090
  164    HA   GLU  25           HA       GLU  25 -14.137   5.538   1.523
  165   1HB   GLU  25          1HB       GLU  25 -14.325   4.898  -0.865
  166   2HB   GLU  25          2HB       GLU  25 -13.055   6.080  -0.576
  167   1HG   GLU  25          2HG       GLU  25 -11.355   4.470  -0.839
  168   2HG   GLU  25          1HG       GLU  25 -12.501   3.130  -0.749
  169    H    THR  26           H        THR  26 -12.198   2.632   1.252
  170    HA   THR  26           HA       THR  26 -14.478   1.016   0.515
  171    HB   THR  26           HB       THR  26 -12.193   0.786  -0.525
  172    HG1  THR  26           1HG      THR  26 -13.820  -0.888  -0.602
  173   1HG2  THR  26          1HG2      THR  26 -10.526  -0.522   0.667
  174   2HG2  THR  26          2HG2      THR  26 -11.565  -0.572   2.091
  175   3HG2  THR  26          3HG2      THR  26 -10.891   0.963   1.544
  176    H    LEU  27           H        LEU  27 -14.403  -1.337   1.615
  177    HA   LEU  27           HA       LEU  27 -12.722  -1.276   3.960
  178   1HB   LEU  27          1HB       LEU  27 -15.397  -1.283   4.415
  179   2HB   LEU  27          2HB       LEU  27 -15.095  -3.007   4.283
  180    HG   LEU  27           HG       LEU  27 -14.896  -2.560   6.576
  181   1HD1  LEU  27          1HD1      LEU  27 -12.120  -2.419   5.405
  182   2HD1  LEU  27          2HD1      LEU  27 -13.037  -3.891   5.755
  183   3HD1  LEU  27          3HD1      LEU  27 -12.503  -2.847   7.076
  184   1HD2  LEU  27          1HD2      LEU  27 -13.183  -0.175   5.886
  185   2HD2  LEU  27          2HD2      LEU  27 -13.650  -0.695   7.507
  186   3HD2  LEU  27          3HD2      LEU  27 -14.876  -0.111   6.381
  187    H    VAL  28           H        VAL  28 -11.191  -2.329   2.750
  188    HA   VAL  28           HA       VAL  28 -12.128  -4.054   0.683
  189    HB   VAL  28           HB       VAL  28  -9.603  -2.687   1.323
  190   1HG1  VAL  28          1HG2      VAL  28  -8.281  -4.025  -0.249
  191   2HG1  VAL  28          2HG2      VAL  28  -9.608  -5.180  -0.379
  192   3HG1  VAL  28          3HG2      VAL  28  -8.765  -4.972   1.157
  193   1HG2  VAL  28          1HG1      VAL  28  -9.731  -2.210  -1.074
  194   2HG2  VAL  28          2HG1      VAL  28 -11.237  -1.817  -0.234
  195   3HG2  VAL  28          3HG1      VAL  28 -11.117  -3.296  -1.195
  196    H    ARG  29           H        ARG  29 -11.439  -6.145   0.207
  197    HA   ARG  29           HA       ARG  29 -10.620  -7.632   2.580
  198   1HB   ARG  29          1HB       ARG  29 -12.616  -8.629   0.553
  199   2HB   ARG  29          2HB       ARG  29 -12.216  -9.356   2.103
  200   1HG   ARG  29          2HG       ARG  29 -13.201  -7.455   3.265
  201   2HG   ARG  29          1HG       ARG  29 -13.575  -6.691   1.718
  202   1HD   ARG  29          1HD       ARG  29 -15.026  -8.579   1.143
  203   2HD   ARG  29          2HD       ARG  29 -14.653  -9.337   2.691
  204    HE   ARG  29           HE       ARG  29 -15.650  -6.772   3.188
  205   1HH1  ARG  29          2HH1      ARG  29 -16.732  -9.837   1.931
  206   2HH1  ARG  29          1HH1      ARG  29 -18.374  -9.607   2.433
  207   1HH2  ARG  29          1HH2      ARG  29 -17.808  -6.463   3.853
  208   2HH2  ARG  29          2HH2      ARG  29 -18.986  -7.690   3.524
  209    HA   PRO  30           HA       PRO  30  -7.713  -8.488  -0.910
  210   1HB   PRO  30          1HB       PRO  30  -5.765  -8.699   1.288
  211   2HB   PRO  30          2HB       PRO  30  -5.716  -7.689  -0.158
  212   1HG   PRO  30          2HG       PRO  30  -6.141  -6.644   2.278
  213   2HG   PRO  30          1HG       PRO  30  -6.924  -5.987   0.828
  214   1HD   PRO  30          1HD       PRO  30  -8.050  -7.801   2.931
  215   2HD   PRO  30          2HD       PRO  30  -8.799  -6.402   2.132
  216    H    LYS  31           H        LYS  31  -7.710 -10.512  -1.648
  217    HA   LYS  31           HA       LYS  31  -7.895 -12.841  -0.055
  218   1HB   LYS  31          1HB       LYS  31  -7.281 -14.047  -2.120
  219   2HB   LYS  31          2HB       LYS  31  -8.546 -12.859  -2.399
  220   1HG   LYS  31          1HG       LYS  31  -6.899 -11.314  -3.324
  221   2HG   LYS  31          2HG       LYS  31  -5.627 -12.503  -3.041
  222   1HD   LYS  31          2HD       LYS  31  -6.738 -14.062  -4.559
  223   2HD   LYS  31          1HD       LYS  31  -8.023 -12.883  -4.834
  224   1HE   LYS  31          1HE       LYS  31  -6.407 -12.861  -6.660
  225   2HE   LYS  31          2HE       LYS  31  -6.406 -11.328  -5.788
  226   1HZ   LYS  31          1HZ       LYS  31  -4.432 -13.517  -5.429
  227   2HZ   LYS  31          2HZ       LYS  31  -4.430 -12.044  -4.599
  228   3HZ   LYS  31          3HZ       LYS  31  -4.161 -12.074  -6.269
  229    HA   PRO  32           HA       PRO  32  -3.998 -13.525   1.774
  230   1HB   PRO  32          1HB       PRO  32  -4.012 -16.148   0.326
  231   2HB   PRO  32          2HB       PRO  32  -3.667 -15.805   2.025
  232   1HG   PRO  32          1HG       PRO  32  -6.029 -16.794   1.291
  233   2HG   PRO  32          2HG       PRO  32  -5.911 -15.571   2.570
  234   1HD   PRO  32          1HD       PRO  32  -6.879 -15.298  -0.225
  235   2HD   PRO  32          2HD       PRO  32  -7.347 -14.393   1.228
  236    H    LEU  33           H        LEU  33  -2.690 -12.055   0.700
  237    HA   LEU  33           HA       LEU  33  -0.944 -13.090  -1.362
  238   1HB   LEU  33          2HB       LEU  33  -3.199 -11.998  -2.292
  239   2HB   LEU  33          1HB       LEU  33  -2.273 -10.528  -2.069
  240    HG   LEU  33           HG       LEU  33  -2.131 -11.370  -4.370
  241   1HD1  LEU  33          1HD1      LEU  33   0.297 -11.304  -4.601
  242   2HD1  LEU  33          2HD1      LEU  33   0.472 -11.558  -2.864
  243   3HD1  LEU  33          3HD1      LEU  33  -0.275 -10.080  -3.469
  244   1HD2  LEU  33          1HD2      LEU  33  -2.376 -13.746  -3.926
  245   2HD2  LEU  33          2HD2      LEU  33  -0.806 -13.773  -3.124
  246   3HD2  LEU  33          3HD2      LEU  33  -0.908 -13.434  -4.851
  247    H    LEU  34           H        LEU  34  -1.956 -10.419   0.694
  248    HA   LEU  34           HA       LEU  34   0.857  -9.801   1.146
  249   1HB   LEU  34          2HB       LEU  34   0.673  -7.518   0.719
  250   2HB   LEU  34          1HB       LEU  34  -0.188  -8.263  -0.614
  251    HG   LEU  34           HG       LEU  34  -2.135  -7.814   1.344
  252   1HD1  LEU  34          1HD1      LEU  34  -0.426  -5.360   0.994
  253   2HD1  LEU  34          2HD1      LEU  34  -0.482  -6.344   2.456
  254   3HD1  LEU  34          3HD1      LEU  34  -1.928  -5.493   1.911
  255   1HD2  LEU  34          1HD2      LEU  34  -2.456  -7.681  -1.060
  256   2HD2  LEU  34          2HD2      LEU  34  -1.452  -6.232  -1.129
  257   3HD2  LEU  34          3HD2      LEU  34  -2.996  -6.196  -0.277
  258    H    LEU  35           H        LEU  35  -1.822 -10.855   2.403
  259    HA   LEU  35           HA       LEU  35  -1.897  -9.136   4.751
  260   1HB   LEU  35          1HB       LEU  35  -3.595 -11.566   4.244
  261   2HB   LEU  35          2HB       LEU  35  -3.902 -10.256   5.369
  262    HG   LEU  35           HG       LEU  35  -3.907  -8.813   3.142
  263   1HD1  LEU  35          1HD2      LEU  35  -3.300 -10.714   1.713
  264   2HD1  LEU  35          2HD2      LEU  35  -4.874 -10.043   1.285
  265   3HD1  LEU  35          3HD2      LEU  35  -4.776 -11.541   2.205
  266   1HD2  LEU  35          1HD1      LEU  35  -6.303 -10.508   3.773
  267   2HD2  LEU  35          2HD1      LEU  35  -6.250  -8.832   3.217
  268   3HD2  LEU  35          3HD1      LEU  35  -5.736  -9.236   4.857
  269    H    LYS  36           H        LYS  36  -1.000 -12.398   3.767
  270    HA   LYS  36           HA       LYS  36   0.247 -13.101   6.224
  271   1HB   LYS  36          1HB       LYS  36   0.840 -13.792   3.347
  272   2HB   LYS  36          2HB       LYS  36   1.779 -14.424   4.689
  273   1HG   LYS  36          1HG       LYS  36  -0.222 -15.477   5.606
  274   2HG   LYS  36          2HG       LYS  36  -1.175 -14.827   4.269
  275   1HD   LYS  36          2HD       LYS  36  -0.630 -17.127   3.802
  276   2HD   LYS  36          1HD       LYS  36   0.263 -16.087   2.691
  277   1HE   LYS  36          2HE       LYS  36   2.255 -16.297   4.095
  278   2HE   LYS  36          1HE       LYS  36   1.362 -17.336   5.206
  279   1HZ   LYS  36          1HZ       LYS  36   1.947 -17.939   2.358
  280   2HZ   LYS  36          2HZ       LYS  36   1.073 -18.934   3.410
  281   3HZ   LYS  36          3HZ       LYS  36   2.713 -18.636   3.696
  282    H    LEU  37           H        LEU  37   0.668 -10.570   4.111
  283    HA   LEU  37           HA       LEU  37   3.485 -10.163   4.805
  284   1HB   LEU  37          2HB       LEU  37   3.086 -10.091   2.448
  285   2HB   LEU  37          1HB       LEU  37   1.702  -9.037   2.652
  286    HG   LEU  37           HG       LEU  37   4.371  -8.034   3.511
  287   1HD1  LEU  37          1HD2      LEU  37   4.811  -7.239   1.237
  288   2HD1  LEU  37          2HD2      LEU  37   3.422  -8.156   0.652
  289   3HD1  LEU  37          3HD2      LEU  37   4.817  -9.001   1.324
  290   1HD2  LEU  37          1HD1      LEU  37   2.383  -6.483   1.966
  291   2HD2  LEU  37          2HD1      LEU  37   3.394  -5.995   3.328
  292   3HD2  LEU  37          3HD1      LEU  37   1.941  -6.963   3.606
  293    H    LEU  38           H        LEU  38   0.301  -9.124   5.458
  294    HA   LEU  38           HA       LEU  38   1.213  -6.538   6.515
  295   1HB   LEU  38          1HB       LEU  38  -1.030  -7.301   4.965
  296   2HB   LEU  38          2HB       LEU  38  -1.637  -6.820   6.536
  297    HG   LEU  38           HG       LEU  38  -0.664  -4.630   6.319
  298   1HD1  LEU  38          1HD1      LEU  38   0.567  -3.966   4.297
  299   2HD1  LEU  38          2HD1      LEU  38   0.528  -5.639   3.741
  300   3HD1  LEU  38          3HD1      LEU  38   1.408  -5.217   5.210
  301   1HD2  LEU  38          1HD2      LEU  38  -2.831  -4.987   5.249
  302   2HD2  LEU  38          2HD2      LEU  38  -2.023  -5.433   3.748
  303   3HD2  LEU  38          3HD2      LEU  38  -1.875  -3.789   4.378
  304    H    LYS  39           H        LYS  39  -1.019  -9.202   7.322
  305    HA   LYS  39           HA       LYS  39  -1.384  -8.598  10.023
  306   1HB   LYS  39          1HB       LYS  39  -1.307 -11.283   8.641
  307   2HB   LYS  39          2HB       LYS  39  -1.860 -11.036  10.292
  308   1HG   LYS  39          2HG       LYS  39  -3.657  -9.603   9.494
  309   2HG   LYS  39          1HG       LYS  39  -3.090  -9.805   7.834
  310   1HD   LYS  39          2HD       LYS  39  -3.956 -12.088   9.598
  311   2HD   LYS  39          1HD       LYS  39  -5.030 -11.258   8.470
  312   1HE   LYS  39          2HE       LYS  39  -3.583 -11.881   6.610
  313   2HE   LYS  39          1HE       LYS  39  -2.473 -12.677   7.727
  314   1HZ   LYS  39          1HZ       LYS  39  -4.232 -14.225   8.314
  315   2HZ   LYS  39          2HZ       LYS  39  -3.939 -14.265   6.649
  316   3HZ   LYS  39          3HZ       LYS  39  -5.299 -13.459   7.250
  317    H    SER  40           H        SER  40   1.394  -9.691   8.363
  318    HA   SER  40           HA       SER  40   2.655 -10.886  10.673
  319   1HB   SER  40          1HB       SER  40   3.712 -10.228   7.917
  320   2HB   SER  40          2HB       SER  40   4.647 -11.046   9.168
  321    HG   SER  40           HG       SER  40   3.787 -12.755   8.271
  322    H    VAL  41           H        VAL  41   2.851  -7.837   8.893
  323    HA   VAL  41           HA       VAL  41   5.099  -6.908  10.421
  324    HB   VAL  41           HB       VAL  41   5.052  -6.084   8.221
  325   1HG1  VAL  41          1HG1      VAL  41   2.758  -6.513   7.643
  326   2HG1  VAL  41          2HG1      VAL  41   3.139  -4.828   7.281
  327   3HG1  VAL  41          3HG1      VAL  41   2.204  -5.232   8.724
  328   1HG2  VAL  41          1HG2      VAL  41   4.978  -3.688   8.466
  329   2HG2  VAL  41          2HG2      VAL  41   5.647  -4.405   9.933
  330   3HG2  VAL  41          3HG2      VAL  41   3.976  -3.834   9.912
  331    H    GLY  42           H        GLY  42   1.616  -6.577  10.577
  332   1HA   GLY  42          1HA       GLY  42   1.817  -5.460  13.221
  333   2HA   GLY  42          2HA       GLY  42   1.230  -4.306  12.035
  334    H    ALA  43           H        ALA  43  -0.381  -5.882  10.448
  335    HA   ALA  43           HA       ALA  43  -2.749  -5.671  11.920
  336   1HB   ALA  43          1HB       ALA  43  -2.652  -5.462   9.482
  337   2HB   ALA  43          2HB       ALA  43  -3.863  -6.639   9.984
  338   3HB   ALA  43          3HB       ALA  43  -2.314  -7.187   9.348
  339    H    GLN  44           H        GLN  44  -4.416  -7.565  11.869
  340    HA   GLN  44           HA       GLN  44  -3.440 -10.207  12.281
  341   1HB   GLN  44          2HB       GLN  44  -4.000 -10.402  14.673
  342   2HB   GLN  44          1HB       GLN  44  -2.675  -9.280  14.397
  343   1HG   GLN  44          2HG       GLN  44  -4.214  -7.401  14.629
  344   2HG   GLN  44          1HG       GLN  44  -5.545  -8.525  14.902
  345   1HE2  GLN  44          1HE2      GLN  44  -5.661  -9.654  16.842
  346   2HE2  GLN  44          2HE2      GLN  44  -4.757  -9.179  18.236
  347    H    LYS  45           H        LYS  45  -5.675  -8.249  11.243
  348    HA   LYS  45           HA       LYS  45  -8.040  -9.614  12.258
  349   1HB   LYS  45          2HB       LYS  45  -7.923  -7.442  10.167
  350   2HB   LYS  45          1HB       LYS  45  -9.318  -7.945  11.111
  351   1HG   LYS  45          2HG       LYS  45  -8.214  -7.116  13.147
  352   2HG   LYS  45          1HG       LYS  45  -6.859  -6.558  12.162
  353   1HD   LYS  45          1HD       LYS  45  -9.725  -5.639  11.909
  354   2HD   LYS  45          2HD       LYS  45  -8.414  -4.734  12.669
  355   1HE   LYS  45          1HE       LYS  45  -7.231  -4.612  10.556
  356   2HE   LYS  45          2HE       LYS  45  -8.466  -5.602   9.780
  357   1HZ   LYS  45          1HZ       LYS  45  -8.830  -3.293   9.281
  358   2HZ   LYS  45          2HZ       LYS  45  -8.855  -2.888  10.922
  359   3HZ   LYS  45          3HZ       LYS  45 -10.087  -3.846  10.269
  360    H    ASP  46           H        ASP  46  -9.699  -9.536  10.062
  361    HA   ASP  46           HA       ASP  46  -8.456 -11.472   8.231
  362   1HB   ASP  46          2HB       ASP  46 -11.385 -10.910   8.754
  363   2HB   ASP  46          1HB       ASP  46 -10.761 -12.124   7.640
  364    H    THR  47           H        THR  47 -10.166  -8.419   8.410
  365    HA   THR  47           HA       THR  47  -9.900  -8.110   5.492
  366    HB   THR  47           HB       THR  47 -11.547  -6.170   5.875
  367    HG1  THR  47           1HG      THR  47 -12.338  -5.944   7.822
  368   1HG2  THR  47          1HG2      THR  47 -12.124  -8.321   4.787
  369   2HG2  THR  47          2HG2      THR  47 -13.465  -7.611   5.686
  370   3HG2  THR  47          3HG2      THR  47 -12.563  -8.966   6.371
  371    H    TYR  48           H        TYR  48  -9.943  -5.632   4.976
  372    HA   TYR  48           HA       TYR  48  -8.207  -4.073   6.704
  373   1HB   TYR  48          2HB       TYR  48  -7.438  -5.041   3.961
  374   2HB   TYR  48          1HB       TYR  48  -6.753  -3.575   4.648
  375    HD1  TYR  48           1HD      TYR  48  -5.215  -3.666   6.500
  376    HD2  TYR  48           2HD      TYR  48  -6.863  -7.222   4.848
  377    HE1  TYR  48           1HE      TYR  48  -3.480  -4.996   7.642
  378    HE2  TYR  48           2HE      TYR  48  -5.133  -8.555   5.977
  379    HH   TYR  48           HH       TYR  48  -2.884  -8.253   6.882
  380    H    THR  49           H        THR  49  -7.653  -1.947   5.275
  381    HA   THR  49           HA       THR  49  -9.886  -1.349   3.486
  382    HB   THR  49           HB       THR  49  -9.029   0.857   5.299
  383    HG1  THR  49           1HG      THR  49  -9.588  -1.018   6.632
  384   1HG2  THR  49          1HG2      THR  49 -11.332   1.593   4.963
  385   2HG2  THR  49          2HG2      THR  49 -11.676   0.123   4.053
  386   3HG2  THR  49          3HG2      THR  49 -10.533   1.305   3.416
  387    H    MET  50           H        MET  50  -9.427   0.962   2.493
  388    HA   MET  50           HA       MET  50  -7.208   0.632   0.849
  389   1HB   MET  50          1HB       MET  50  -9.200   2.758   1.345
  390   2HB   MET  50          2HB       MET  50  -7.720   3.256   0.529
  391   1HG   MET  50          2HG       MET  50  -8.212   1.204  -1.000
  392   2HG   MET  50          1HG       MET  50  -9.850   1.379  -0.377
  393   1HE   MET  50          1HE       MET  50  -8.993   1.573  -3.483
  394   2HE   MET  50          2HE       MET  50 -10.006   2.921  -4.005
  395   3HE   MET  50          3HE       MET  50 -10.663   1.690  -2.925
  396    H    LYS  51           H        LYS  51  -7.639   2.820   3.628
  397    HA   LYS  51           HA       LYS  51  -4.982   3.902   3.306
  398   1HB   LYS  51          2HB       LYS  51  -7.149   4.324   5.362
  399   2HB   LYS  51          1HB       LYS  51  -5.564   5.074   5.493
  400   1HG   LYS  51          1HG       LYS  51  -7.415   5.426   3.147
  401   2HG   LYS  51          2HG       LYS  51  -7.305   6.541   4.511
  402   1HD   LYS  51          1HD       LYS  51  -5.005   5.799   2.705
  403   2HD   LYS  51          2HD       LYS  51  -5.980   7.263   2.547
  404   1HE   LYS  51          1HE       LYS  51  -4.314   6.497   4.942
  405   2HE   LYS  51          2HE       LYS  51  -3.888   7.706   3.732
  406   1HZ   LYS  51          1HZ       LYS  51  -6.238   7.826   5.545
  407   2HZ   LYS  51          2HZ       LYS  51  -5.834   8.985   4.382
  408   3HZ   LYS  51          3HZ       LYS  51  -4.816   8.728   5.709
  409    H    GLU  52           H        GLU  52  -6.599   1.538   5.287
  410    HA   GLU  52           HA       GLU  52  -4.666   1.057   7.229
  411   1HB   GLU  52          2HB       GLU  52  -7.065  -0.036   6.575
  412   2HB   GLU  52          1HB       GLU  52  -5.971  -1.318   6.071
  413   1HG   GLU  52          1HG       GLU  52  -5.030  -1.458   8.279
  414   2HG   GLU  52          2HG       GLU  52  -5.989  -0.076   8.811
  415    H    VAL  53           H        VAL  53  -5.051  -0.457   4.031
  416    HA   VAL  53           HA       VAL  53  -2.599  -1.892   4.151
  417    HB   VAL  53           HB       VAL  53  -4.139  -1.093   1.676
  418   1HG1  VAL  53          1HG2      VAL  53  -3.085  -3.070   0.688
  419   2HG1  VAL  53          2HG2      VAL  53  -2.198  -3.344   2.187
  420   3HG1  VAL  53          3HG2      VAL  53  -1.883  -1.897   1.229
  421   1HG2  VAL  53          1HG1      VAL  53  -5.627  -2.230   3.203
  422   2HG2  VAL  53          2HG1      VAL  53  -4.447  -3.518   3.443
  423   3HG2  VAL  53          3HG1      VAL  53  -5.214  -3.306   1.870
  424    H    LEU  54           H        LEU  54  -3.468   1.346   3.268
  425    HA   LEU  54           HA       LEU  54  -1.367   2.089   1.622
  426   1HB   LEU  54          2HB       LEU  54  -3.286   3.534   2.194
  427   2HB   LEU  54          1HB       LEU  54  -2.638   3.739   3.808
  428    HG   LEU  54           HG       LEU  54  -0.919   4.512   1.495
  429   1HD1  LEU  54          1HD1      LEU  54  -3.081   5.484   0.933
  430   2HD1  LEU  54          2HD1      LEU  54  -1.939   6.731   1.433
  431   3HD1  LEU  54          3HD1      LEU  54  -3.195   6.188   2.547
  432   1HD2  LEU  54          1HD2      LEU  54  -0.027   4.612   3.757
  433   2HD2  LEU  54          2HD2      LEU  54  -1.363   5.653   4.250
  434   3HD2  LEU  54          3HD2      LEU  54  -0.183   6.231   3.074
  435    H    PHE  55           H        PHE  55  -1.430   2.799   5.129
  436    HA   PHE  55           HA       PHE  55   1.367   3.296   5.150
  437   1HB   PHE  55          2HB       PHE  55   1.115   3.483   7.605
  438   2HB   PHE  55          1HB       PHE  55  -0.070   4.443   6.728
  439    HD1  PHE  55           1HD      PHE  55  -2.367   4.127   7.049
  440    HD2  PHE  55           2HD      PHE  55   0.396   1.299   8.620
  441    HE1  PHE  55           1HE      PHE  55  -4.182   3.073   8.332
  442    HE2  PHE  55           2HE      PHE  55  -1.414   0.237   9.903
  443    HZ   PHE  55           HZ       PHE  55  -3.706   1.124   9.761
  444    H    TYR  56           H        TYR  56  -0.588   0.478   5.822
  445    HA   TYR  56           HA       TYR  56   1.324  -0.938   7.342
  446   1HB   TYR  56          1HB       TYR  56  -1.293  -1.462   6.222
  447   2HB   TYR  56          2HB       TYR  56  -0.239  -2.865   6.075
  448    HD1  TYR  56           1HD      TYR  56   1.409  -2.483   8.545
  449    HD2  TYR  56           2HD      TYR  56  -2.785  -2.160   7.906
  450    HE1  TYR  56           1HE      TYR  56   1.017  -3.049  10.904
  451    HE2  TYR  56           2HE      TYR  56  -3.195  -2.717  10.264
  452    HH   TYR  56           HH       TYR  56  -2.053  -3.869  12.112
  453    H    LEU  57           H        LEU  57   0.472  -1.146   3.891
  454    HA   LEU  57           HA       LEU  57   2.486  -2.953   3.156
  455   1HB   LEU  57          2HB       LEU  57   0.501  -1.872   1.797
  456   2HB   LEU  57          1HB       LEU  57   1.713  -0.688   1.357
  457    HG   LEU  57           HG       LEU  57   1.438  -2.462  -0.338
  458   1HD1  LEU  57          1HD2      LEU  57   3.561  -1.291  -0.161
  459   2HD1  LEU  57          2HD2      LEU  57   3.806  -2.973  -0.630
  460   3HD1  LEU  57          3HD2      LEU  57   4.122  -2.465   1.031
  461   1HD2  LEU  57          1HD1      LEU  57   2.489  -4.286   1.818
  462   2HD2  LEU  57          2HD1      LEU  57   2.245  -4.720   0.126
  463   3HD2  LEU  57          3HD1      LEU  57   0.861  -4.306   1.138
  464    H    GLY  58           H        GLY  58   2.492   0.588   3.383
  465   1HA   GLY  58          2HA       GLY  58   5.144   1.091   2.701
  466   2HA   GLY  58          1HA       GLY  58   4.214   2.029   3.860
  467    H    GLN  59           H        GLN  59   3.802  -0.225   5.672
  468    HA   GLN  59           HA       GLN  59   6.149  -0.002   7.237
  469   1HB   GLN  59          1HB       GLN  59   3.913  -2.028   7.458
  470   2HB   GLN  59          2HB       GLN  59   5.122  -1.700   8.690
  471   1HG   GLN  59          2HG       GLN  59   2.915   0.097   7.741
  472   2HG   GLN  59          1HG       GLN  59   3.150  -0.591   9.346
  473   1HE2  GLN  59          1HE2      GLN  59   4.175   1.852   7.100
  474   2HE2  GLN  59          2HE2      GLN  59   5.061   2.809   8.232
  475    H    TYR  60           H        TYR  60   4.784  -2.790   5.457
  476    HA   TYR  60           HA       TYR  60   6.836  -4.552   6.185
  477   1HB   TYR  60          1HB       TYR  60   4.643  -5.283   5.336
  478   2HB   TYR  60          2HB       TYR  60   5.069  -4.680   3.737
  479    HD1  TYR  60           1HD      TYR  60   6.745  -5.812   2.383
  480    HD2  TYR  60           2HD      TYR  60   5.573  -7.346   6.170
  481    HE1  TYR  60           1HE      TYR  60   7.780  -7.969   1.821
  482    HE2  TYR  60           2HE      TYR  60   6.605  -9.508   5.622
  483    HH   TYR  60           HH       TYR  60   8.698  -9.930   2.981
  484    H    ILE  61           H        ILE  61   6.619  -2.270   3.524
  485    HA   ILE  61           HA       ILE  61   8.911  -3.119   2.098
  486    HB   ILE  61           HB       ILE  61   8.040  -0.247   2.392
  487   1HG1  ILE  61          2HG1      ILE  61   7.014  -2.160   0.301
  488   2HG1  ILE  61          1HG1      ILE  61   6.153  -1.874   1.811
  489   1HG2  ILE  61          1HG2      ILE  61   8.884  -0.125   0.044
  490   2HG2  ILE  61          2HG2      ILE  61   9.483  -1.773   0.231
  491   3HG2  ILE  61          3HG2      ILE  61  10.126  -0.481   1.246
  492   1HD1  ILE  61          1HD1      ILE  61   6.799   0.146  -0.317
  493   2HD1  ILE  61          2HD1      ILE  61   6.086   0.537   1.248
  494   3HD1  ILE  61          3HD1      ILE  61   5.210  -0.490   0.110
  495    H    MET  62           H        MET  62   8.656  -0.263   4.216
  496    HA   MET  62           HA       MET  62  11.372   0.061   4.713
  497   1HB   MET  62          1HB       MET  62   9.063   0.691   6.559
  498   2HB   MET  62          2HB       MET  62  10.693   1.328   6.717
  499   1HG   MET  62          1HG       MET  62  10.457   2.420   4.529
  500   2HG   MET  62          2HG       MET  62   8.803   1.821   4.429
  501   1HE   MET  62          1HE       MET  62   6.858   2.569   6.102
  502   2HE   MET  62          2HE       MET  62   7.110   3.687   7.442
  503   3HE   MET  62          3HE       MET  62   7.867   2.095   7.469
  504    H    THR  63           H        THR  63   9.285  -0.937   7.394
  505    HA   THR  63           HA       THR  63  11.177  -2.452   8.762
  506    HB   THR  63           HB       THR  63   8.189  -2.933   8.723
  507    HG1  THR  63           1HG      THR  63   8.187  -1.467  10.485
  508   1HG2  THR  63          1HG2      THR  63   8.542  -3.818  10.985
  509   2HG2  THR  63          2HG2      THR  63  10.279  -3.573  10.809
  510   3HG2  THR  63          3HG2      THR  63   9.445  -4.743   9.786
  511    H    LYS  64           H        LYS  64  11.476  -4.747   8.943
  512    HA   LYS  64           HA       LYS  64  11.981  -6.769   8.035
  513   1HB   LYS  64          2HB       LYS  64   9.543  -6.274   6.310
  514   2HB   LYS  64          1HB       LYS  64  10.379  -7.812   6.481
  515   1HG   LYS  64          2HG       LYS  64   9.006  -6.333   8.716
  516   2HG   LYS  64          1HG       LYS  64   8.324  -7.690   7.818
  517   1HD   LYS  64          2HD       LYS  64  10.158  -9.118   8.580
  518   2HD   LYS  64          1HD       LYS  64  10.842  -7.760   9.478
  519   1HE   LYS  64          1HE       LYS  64   8.139  -9.012   9.949
  520   2HE   LYS  64          2HE       LYS  64   9.575  -9.255  10.942
  521   1HZ   LYS  64          1HZ       LYS  64   8.091  -7.615  11.912
  522   2HZ   LYS  64          2HZ       LYS  64   8.192  -6.661  10.519
  523   3HZ   LYS  64          3HZ       LYS  64   9.563  -6.902  11.479
  524    H    ARG  65           H        ARG  65  13.886  -5.760   7.234
  525    HA   ARG  65           HA       ARG  65  14.074  -3.949   5.237
  526   1HB   ARG  65          2HB       ARG  65  16.455  -4.707   4.941
  527   2HB   ARG  65          1HB       ARG  65  15.975  -4.371   6.599
  528   1HG   ARG  65          2HG       ARG  65  15.692  -6.766   7.003
  529   2HG   ARG  65          1HG       ARG  65  16.180  -7.099   5.341
  530   1HD   ARG  65          2HD       ARG  65  18.040  -7.427   6.880
  531   2HD   ARG  65          1HD       ARG  65  18.362  -6.094   5.773
  532    HE   ARG  65           HE       ARG  65  17.214  -5.081   8.130
  533   1HH1  ARG  65          2HH1      ARG  65  20.169  -6.533   6.985
  534   2HH1  ARG  65          1HH1      ARG  65  21.164  -5.746   8.164
  535   1HH2  ARG  65          1HH2      ARG  65  18.516  -4.041   9.685
  536   2HH2  ARG  65          2HH2      ARG  65  20.225  -4.329   9.700
  537    H    LEU  66           H        LEU  66  12.975  -4.173   3.395
  538    HA   LEU  66           HA       LEU  66  14.026  -6.191   1.522
  539   1HB   LEU  66          1HB       LEU  66  11.348  -5.031   1.906
  540   2HB   LEU  66          2HB       LEU  66  11.878  -5.108   0.240
  541    HG   LEU  66           HG       LEU  66  12.029  -7.472   0.289
  542   1HD1  LEU  66          1HD2      LEU  66  11.700  -8.809   2.305
  543   2HD1  LEU  66          2HD2      LEU  66  11.579  -7.333   3.267
  544   3HD1  LEU  66          3HD2      LEU  66  13.097  -7.741   2.466
  545   1HD2  LEU  66          1HD1      LEU  66   9.767  -8.134   0.965
  546   2HD2  LEU  66          2HD1      LEU  66   9.776  -6.612   0.071
  547   3HD2  LEU  66          3HD1      LEU  66   9.590  -6.603   1.826
  548    H    TYR  67           H        TYR  67  13.877  -2.903   2.381
  549    HA   TYR  67           HA       TYR  67  13.961  -1.722  -0.189
  550   1HB   TYR  67          1HB       TYR  67  14.411   0.344   0.941
  551   2HB   TYR  67          2HB       TYR  67  13.258  -0.561   1.917
  552    HD1  TYR  67           1HD      TYR  67  14.059  -1.724   3.989
  553    HD2  TYR  67           2HD      TYR  67  16.524   0.961   1.798
  554    HE1  TYR  67           1HE      TYR  67  15.541  -1.501   5.941
  555    HE2  TYR  67           2HE      TYR  67  18.012   1.193   3.738
  556    HH   TYR  67           HH       TYR  67  17.911   0.913   6.182
  557    H    ASP  68           H        ASP  68  15.843  -0.211  -0.790
  558    HA   ASP  68           HA       ASP  68  18.055  -1.732  -1.481
  559   1HB   ASP  68          2HB       ASP  68  17.576   0.252  -2.722
  560   2HB   ASP  68          1HB       ASP  68  17.705   1.268  -1.287
  561    H    GLU  69           H        GLU  69  18.817   1.175   0.321
  562    HA   GLU  69           HA       GLU  69  19.583   0.117   2.767
  563   1HB   GLU  69          1HB       GLU  69  21.139  -1.286   1.470
  564   2HB   GLU  69          2HB       GLU  69  21.863   0.159   0.778
  565   1HG   GLU  69          2HG       GLU  69  22.594   0.856   3.008
  566   2HG   GLU  69          1HG       GLU  69  21.881  -0.606   3.688
  567    H    LYS  70           H        LYS  70  20.219   2.386   0.193
  568    HA   LYS  70           HA       LYS  70  20.622   4.484   2.209
  569   1HB   LYS  70          1HB       LYS  70  22.312   5.557   0.797
  570   2HB   LYS  70          2HB       LYS  70  22.821   3.962   1.327
  571   1HG   LYS  70          1HG       LYS  70  21.536   4.375  -1.344
  572   2HG   LYS  70          2HG       LYS  70  23.259   4.637  -1.089
  573   1HD   LYS  70          1HD       LYS  70  21.805   2.074  -0.462
  574   2HD   LYS  70          2HD       LYS  70  22.727   2.367  -1.937
  575   1HE   LYS  70          1HE       LYS  70  23.819   2.413   0.873
  576   2HE   LYS  70          2HE       LYS  70  24.039   1.115  -0.299
  577   1HZ   LYS  70          1HZ       LYS  70  25.226   2.654  -1.731
  578   2HZ   LYS  70          2HZ       LYS  70  25.967   2.564  -0.214
  579   3HZ   LYS  70          3HZ       LYS  70  25.012   3.903  -0.609
  580    H    GLN  71           H        GLN  71  20.008   3.868  -1.245
  581    HA   GLN  71           HA       GLN  71  17.968   5.953  -1.239
  582   1HB   GLN  71          2HB       GLN  71  18.756   3.975  -3.391
  583   2HB   GLN  71          1HB       GLN  71  17.583   5.273  -3.580
  584   1HG   GLN  71          2HG       GLN  71  19.341   6.920  -3.176
  585   2HG   GLN  71          1HG       GLN  71  20.516   5.618  -2.994
  586   1HE2  GLN  71          1HE2      GLN  71  19.287   4.020  -5.112
  587   2HE2  GLN  71          2HE2      GLN  71  19.747   4.768  -6.599
  588    H    GLN  72           H        GLN  72  16.804   4.908   0.525
  589    HA   GLN  72           HA       GLN  72  16.022   2.244   0.558
  590   1HB   GLN  72          1HB       GLN  72  14.551   4.584   1.784
  591   2HB   GLN  72          2HB       GLN  72  14.399   2.898   2.259
  592   1HG   GLN  72          2HG       GLN  72  16.755   2.891   2.942
  593   2HG   GLN  72          1HG       GLN  72  16.874   4.593   2.501
  594   1HE2  GLN  72          1HE2      GLN  72  15.850   6.140   3.769
  595   2HE2  GLN  72          2HE2      GLN  72  15.300   5.797   5.370
  596    H    HIS  73           H        HIS  73  14.775   4.860  -1.281
  597    HA   HIS  73           HA       HIS  73  12.166   3.786  -1.741
  598   1HB   HIS  73          1HB       HIS  73  11.975   5.510  -3.457
  599   2HB   HIS  73          2HB       HIS  73  12.652   6.189  -1.981
  600    HD1  HIS  73           1HD      HIS  73  13.143   6.223  -5.505
  601    HD2  HIS  73           2HD      HIS  73  15.665   6.260  -2.205
  602    HE1  HIS  73           1HE      HIS  73  15.341   7.107  -6.348
  603    HE2  HIS  73           2HE      HIS  73  16.876   7.039  -4.352
  604    H    ILE  74           H        ILE  74  15.062   2.547  -2.602
  605    HA   ILE  74           HA       ILE  74  13.832   1.278  -4.963
  606    HB   ILE  74           HB       ILE  74  16.754   1.041  -4.295
  607   1HG1  ILE  74          1HG1      ILE  74  16.366   3.419  -4.536
  608   2HG1  ILE  74          2HG1      ILE  74  17.162   2.815  -5.987
  609   1HG2  ILE  74          1HG2      ILE  74  15.776  -0.579  -5.848
  610   2HG2  ILE  74          2HG2      ILE  74  16.938   0.471  -6.658
  611   3HG2  ILE  74          3HG2      ILE  74  15.209   0.743  -6.869
  612   1HD1  ILE  74          1HD1      ILE  74  14.208   3.320  -5.739
  613   2HD1  ILE  74          2HD1      ILE  74  15.084   2.853  -7.197
  614   3HD1  ILE  74          3HD1      ILE  74  15.371   4.432  -6.464
  615    H    VAL  75           H        VAL  75  12.577  -0.051  -3.588
  616    HA   VAL  75           HA       VAL  75  13.991  -1.705  -1.661
  617    HB   VAL  75           HB       VAL  75  12.110  -0.941  -0.613
  618   1HG1  VAL  75          1HG2      VAL  75  11.143   0.278  -2.423
  619   2HG1  VAL  75          2HG2      VAL  75   9.887  -0.729  -1.701
  620   3HG1  VAL  75          3HG2      VAL  75  10.639  -1.212  -3.222
  621   1HG2  VAL  75          1HG1      VAL  75  10.432  -2.725  -0.474
  622   2HG2  VAL  75          2HG1      VAL  75  12.080  -3.354  -0.434
  623   3HG2  VAL  75          3HG1      VAL  75  11.126  -3.475  -1.912
  624    H    TYR  76           H        TYR  76  14.945  -3.413  -2.493
  625    HA   TYR  76           HA       TYR  76  14.031  -4.747  -4.836
  626   1HB   TYR  76          1HB       TYR  76  16.032  -5.859  -2.878
  627   2HB   TYR  76          2HB       TYR  76  15.955  -6.097  -4.621
  628    HD1  TYR  76           1HD      TYR  76  15.775  -3.466  -5.737
  629    HD2  TYR  76           2HD      TYR  76  17.998  -4.756  -2.347
  630    HE1  TYR  76           1HE      TYR  76  17.347  -1.601  -6.062
  631    HE2  TYR  76           2HE      TYR  76  19.573  -2.902  -2.668
  632    HH   TYR  76           HH       TYR  76  18.951  -0.295  -4.743
  633    H    CYS  77           H        CYS  77  12.899  -6.605  -5.072
  634    HA   CYS  77           HA       CYS  77  12.300  -8.300  -2.813
  635   1HB   CYS  77          1HB       CYS  77   9.839  -8.013  -3.009
  636   2HB   CYS  77          2HB       CYS  77  10.657  -6.564  -2.434
  637    HG   CYS  77           HG       CYS  77  10.592  -5.339  -5.006
  638    H    SER  78           H        SER  78  13.555  -9.510  -4.523
  639    HA   SER  78           HA       SER  78  11.881 -10.486  -6.710
  640   1HB   SER  78          1HB       SER  78  14.208  -9.936  -7.245
  641   2HB   SER  78          2HB       SER  78  14.771 -11.077  -6.024
  642    HG   SER  78           HG       SER  78  13.886 -12.753  -7.242
  643    H    ASN  79           H        ASN  79  12.533 -11.229  -3.524
  644    HA   ASN  79           HA       ASN  79  11.200 -13.788  -3.787
  645   1HB   ASN  79          1HB       ASN  79  13.595 -14.370  -3.999
  646   2HB   ASN  79          2HB       ASN  79  13.907 -13.597  -2.447
  647   1HD2  ASN  79          2HD2      ASN  79  14.662 -15.479  -1.518
  648   2HD2  ASN  79          1HD2      ASN  79  13.618 -16.791  -1.097
  649    H    ASP  80           H        ASP  80   9.784 -12.007  -2.775
  650    HA   ASP  80           HA       ASP  80   9.906 -12.300   0.130
  651   1HB   ASP  80          1HB       ASP  80   9.654  -9.619  -1.246
  652   2HB   ASP  80          2HB       ASP  80   9.538  -9.901   0.489
  653    H    LEU  81           H        LEU  81   7.853 -11.435   1.157
  654    HA   LEU  81           HA       LEU  81   5.560 -12.506  -0.034
  655   1HB   LEU  81          2HB       LEU  81   5.739 -10.353   2.077
  656   2HB   LEU  81          1HB       LEU  81   4.309 -11.293   1.701
  657    HG   LEU  81           HG       LEU  81   6.887 -12.423   2.797
  658   1HD1  LEU  81          1HD1      LEU  81   5.734 -11.029   4.430
  659   2HD1  LEU  81          2HD1      LEU  81   5.630 -12.735   4.866
  660   3HD1  LEU  81          3HD1      LEU  81   4.240 -11.922   4.149
  661   1HD2  LEU  81          1HD2      LEU  81   4.203 -13.712   2.320
  662   2HD2  LEU  81          2HD2      LEU  81   5.584 -14.469   3.111
  663   3HD2  LEU  81          3HD2      LEU  81   5.682 -14.019   1.409
  664    H    LEU  82           H        LEU  82   6.813  -9.197   0.031
  665    HA   LEU  82           HA       LEU  82   4.724  -8.001  -1.439
  666   1HB   LEU  82          1HB       LEU  82   7.195  -7.200  -0.347
  667   2HB   LEU  82          2HB       LEU  82   7.274  -6.818  -2.057
  668    HG   LEU  82           HG       LEU  82   5.006  -5.943  -0.273
  669   1HD1  LEU  82          1HD1      LEU  82   7.081  -4.968   0.538
  670   2HD1  LEU  82          2HD1      LEU  82   6.078  -3.745  -0.241
  671   3HD1  LEU  82          3HD1      LEU  82   7.472  -4.415  -1.089
  672   1HD2  LEU  82          1HD2      LEU  82   4.565  -4.364  -2.089
  673   2HD2  LEU  82          2HD2      LEU  82   4.475  -6.035  -2.649
  674   3HD2  LEU  82          3HD2      LEU  82   5.898  -5.058  -3.014
  675    H    GLY  83           H        GLY  83   7.399 -10.012  -2.334
  676   1HA   GLY  83          1HA       GLY  83   7.386  -9.611  -5.123
  677   2HA   GLY  83          2HA       GLY  83   7.855 -11.094  -4.304
  678    H    ASP  84           H        ASP  84   5.409 -11.692  -3.037
  679    HA   ASP  84           HA       ASP  84   3.907 -12.967  -5.013
  680   1HB   ASP  84          2HB       ASP  84   2.698 -11.992  -2.422
  681   2HB   ASP  84          1HB       ASP  84   2.288 -13.432  -3.348
  682    H    LEU  85           H        LEU  85   3.586  -9.744  -3.617
  683    HA   LEU  85           HA       LEU  85   1.228  -9.017  -5.025
  684   1HB   LEU  85          1HB       LEU  85   3.451  -7.357  -3.849
  685   2HB   LEU  85          2HB       LEU  85   2.014  -6.667  -4.578
  686    HG   LEU  85           HG       LEU  85   2.002  -8.526  -2.208
  687   1HD1  LEU  85          1HD2      LEU  85   1.447  -6.515  -0.900
  688   2HD1  LEU  85          2HD2      LEU  85   1.738  -5.527  -2.330
  689   3HD1  LEU  85          3HD2      LEU  85   3.061  -6.438  -1.604
  690   1HD2  LEU  85          1HD1      LEU  85  -0.044  -8.596  -3.541
  691   2HD2  LEU  85          2HD1      LEU  85  -0.180  -6.842  -3.433
  692   3HD2  LEU  85          3HD1      LEU  85  -0.326  -7.829  -1.979
  693    H    PHE  86           H        PHE  86   4.381  -7.520  -5.528
  694    HA   PHE  86           HA       PHE  86   3.686  -7.152  -8.338
  695   1HB   PHE  86          2HB       PHE  86   5.878  -5.960  -6.632
  696   2HB   PHE  86          1HB       PHE  86   5.674  -5.617  -8.345
  697    HD1  PHE  86           1HD      PHE  86   2.450  -5.992  -7.226
  698    HD2  PHE  86           2HD      PHE  86   5.737  -3.306  -6.895
  699    HE1  PHE  86           1HE      PHE  86   0.898  -4.165  -6.679
  700    HE2  PHE  86           2HE      PHE  86   4.186  -1.473  -6.349
  701    HZ   PHE  86           HZ       PHE  86   1.766  -1.905  -6.239
  702    H    GLY  87           H        GLY  87   6.638  -8.062  -6.546
  703   1HA   GLY  87          2HA       GLY  87   7.911 -10.017  -6.998
  704   2HA   GLY  87          1HA       GLY  87   7.162 -10.103  -8.584
  705    H    VAL  88           H        VAL  88   7.791  -6.998  -8.512
  706    HA   VAL  88           HA       VAL  88   9.862  -6.925 -10.286
  707    HB   VAL  88           HB       VAL  88   9.608  -4.765  -8.224
  708   1HG1  VAL  88          1HG1      VAL  88  11.275  -4.610 -10.016
  709   2HG1  VAL  88          2HG1      VAL  88  10.060  -3.331 -10.107
  710   3HG1  VAL  88          3HG1      VAL  88   9.974  -4.710 -11.203
  711   1HG2  VAL  88          1HG2      VAL  88   7.313  -5.435  -8.752
  712   2HG2  VAL  88          2HG2      VAL  88   7.657  -5.242 -10.472
  713   3HG2  VAL  88          3HG2      VAL  88   7.694  -3.840  -9.402
  714    HA   PRO  89           HA       PRO  89  13.709  -7.654  -8.017
  715   1HB   PRO  89          1HB       PRO  89  15.166  -5.820  -9.518
  716   2HB   PRO  89          2HB       PRO  89  14.979  -7.533  -9.896
  717   1HG   PRO  89          2HG       PRO  89  13.507  -5.178 -10.989
  718   2HG   PRO  89          1HG       PRO  89  14.047  -6.650 -11.818
  719   1HD   PRO  89          1HD       PRO  89  11.484  -6.304 -11.126
  720   2HD   PRO  89          2HD       PRO  89  12.257  -7.900 -11.027
  721    H    SER  90           H        SER  90  12.230  -4.554  -8.701
  722    HA   SER  90           HA       SER  90  12.692  -3.595  -6.066
  723   1HB   SER  90          2HB       SER  90  14.098  -1.636  -6.685
  724   2HB   SER  90          1HB       SER  90  14.941  -3.175  -6.857
  725    HG   SER  90           HG       SER  90  15.181  -1.682  -8.656
  726    H    PHE  91           H        PHE  91  11.279  -1.961  -5.575
  727    HA   PHE  91           HA       PHE  91  10.015  -0.565  -7.831
  728   1HB   PHE  91          1HB       PHE  91   7.845  -0.655  -6.772
  729   2HB   PHE  91          2HB       PHE  91   8.466  -2.286  -6.975
  730    HD1  PHE  91           1HD      PHE  91   7.617   0.331  -4.555
  731    HD2  PHE  91           2HD      PHE  91   9.021  -3.654  -5.074
  732    HE1  PHE  91           1HE      PHE  91   7.162  -0.129  -2.189
  733    HE2  PHE  91           2HE      PHE  91   8.572  -4.123  -2.700
  734    HZ   PHE  91           HZ       PHE  91   7.641  -2.359  -1.256
  735    H    SER  92           H        SER  92   9.335   1.572  -7.447
  736    HA   SER  92           HA       SER  92  10.829   2.842  -5.280
  737   1HB   SER  92          2HB       SER  92  10.337   4.957  -6.578
  738   2HB   SER  92          1HB       SER  92  11.332   3.772  -7.423
  739    HG   SER  92           HG       SER  92   9.837   3.601  -8.880
  740    H    VAL  93           H        VAL  93   9.868   3.612  -3.542
  741    HA   VAL  93           HA       VAL  93   6.966   3.425  -3.382
  742    HB   VAL  93           HB       VAL  93   8.325   2.326  -1.657
  743   1HG1  VAL  93          1HG1      VAL  93   9.270   5.117  -1.056
  744   2HG1  VAL  93          2HG1      VAL  93  10.243   3.740  -1.578
  745   3HG1  VAL  93          3HG1      VAL  93   9.498   3.740   0.021
  746   1HG2  VAL  93          1HG2      VAL  93   6.081   3.068  -1.079
  747   2HG2  VAL  93          2HG2      VAL  93   6.708   4.649  -0.612
  748   3HG2  VAL  93          3HG2      VAL  93   7.158   3.214   0.310
  749    H    LYS  94           H        LYS  94   9.472   5.830  -3.417
  750    HA   LYS  94           HA       LYS  94   8.165   7.989  -2.236
  751   1HB   LYS  94          1HB       LYS  94  10.131   7.906  -4.525
  752   2HB   LYS  94          2HB       LYS  94   9.583   9.400  -3.778
  753   1HG   LYS  94          1HG       LYS  94  10.991   7.168  -2.330
  754   2HG   LYS  94          2HG       LYS  94  11.764   8.636  -2.933
  755   1HD   LYS  94          1HD       LYS  94  10.307   9.985  -1.493
  756   2HD   LYS  94          2HD       LYS  94   9.554   8.509  -0.881
  757   1HE   LYS  94          2HE       LYS  94  11.707   7.775   0.008
  758   2HE   LYS  94          1HE       LYS  94  12.469   9.238  -0.614
  759   1HZ   LYS  94          1HZ       LYS  94  11.964   9.442   1.734
  760   2HZ   LYS  94          2HZ       LYS  94  10.326   9.143   1.440
  761   3HZ   LYS  94          3HZ       LYS  94  11.051  10.550   0.840
  762    H    GLU  95           H        GLU  95   7.521   6.365  -5.194
  763    HA   GLU  95           HA       GLU  95   6.138   8.434  -6.546
  764   1HB   GLU  95          1HB       GLU  95   5.679   5.453  -6.753
  765   2HB   GLU  95          2HB       GLU  95   5.193   6.668  -7.926
  766   1HG   GLU  95          2HG       GLU  95   7.692   7.222  -8.090
  767   2HG   GLU  95          1HG       GLU  95   7.941   5.673  -7.282
  768    H    HIS  96           H        HIS  96   4.740   5.546  -5.000
  769    HA   HIS  96           HA       HIS  96   2.824   5.213  -3.822
  770   1HB   HIS  96          1HB       HIS  96   3.201   8.134  -3.472
  771   2HB   HIS  96          2HB       HIS  96   1.586   7.504  -3.168
  772    HD1  HIS  96           1HD      HIS  96   1.364   5.750  -1.212
  773    HD2  HIS  96           2HD      HIS  96   5.067   7.607  -1.518
  774    HE1  HIS  96           1HE      HIS  96   2.523   5.301   0.974
  775    HE2  HIS  96           2HE      HIS  96   4.798   6.357   0.730
  776    H    ARG  97           H        ARG  97   2.544   7.858  -6.183
  777    HA   ARG  97           HA       ARG  97  -0.102   7.402  -6.959
  778   1HB   ARG  97          1HB       ARG  97   1.151   9.374  -7.672
  779   2HB   ARG  97          2HB       ARG  97   2.245   8.364  -8.606
  780   1HG   ARG  97          2HG       ARG  97   0.371   7.694 -10.046
  781   2HG   ARG  97          1HG       ARG  97  -0.695   8.760  -9.126
  782   1HD   ARG  97          1HD       ARG  97   0.051   9.832 -11.183
  783   2HD   ARG  97          2HD       ARG  97   0.666  10.682  -9.765
  784    HE   ARG  97           HE       ARG  97   2.620   8.871 -10.518
  785   1HH1  ARG  97          2HH1      ARG  97   1.020  11.646 -11.889
  786   2HH1  ARG  97          1HH1      ARG  97   2.381  12.116 -12.851
  787   1HH2  ARG  97          1HH2      ARG  97   4.417   9.484 -11.780
  788   2HH2  ARG  97          2HH2      ARG  97   4.312  10.887 -12.789
  789    H    LYS  98           H        LYS  98   2.886   6.233  -8.515
  790    HA   LYS  98           HA       LYS  98   1.416   4.371 -10.137
  791   1HB   LYS  98          1HB       LYS  98   4.386   4.765  -9.756
  792   2HB   LYS  98          2HB       LYS  98   3.667   3.676 -10.934
  793   1HG   LYS  98          2HG       LYS  98   2.558   5.603 -11.998
  794   2HG   LYS  98          1HG       LYS  98   3.374   6.671 -10.853
  795   1HD   LYS  98          2HD       LYS  98   5.545   5.907 -11.688
  796   2HD   LYS  98          1HD       LYS  98   4.728   4.841 -12.834
  797   1HE   LYS  98          2HE       LYS  98   4.520   7.849 -12.757
  798   2HE   LYS  98          1HE       LYS  98   5.471   6.908 -13.907
  799   1HZ   LYS  98          1HZ       LYS  98   3.426   5.900 -14.712
  800   2HZ   LYS  98          2HZ       LYS  98   3.359   7.584 -14.856
  801   3HZ   LYS  98          3HZ       LYS  98   2.517   6.808 -13.612
  802    H    ILE  99           H        ILE  99   3.318   4.247  -7.203
  803    HA   ILE  99           HA       ILE  99   3.782   1.459  -7.240
  804    HB   ILE  99           HB       ILE  99   4.809   3.480  -5.770
  805   1HG1  ILE  99          2HG1      ILE  99   5.742   1.199  -6.231
  806   2HG1  ILE  99          1HG1      ILE  99   6.080   1.801  -4.610
  807   1HG2  ILE  99          1HG2      ILE  99   4.284   3.068  -3.402
  808   2HG2  ILE  99          2HG2      ILE  99   2.959   2.016  -3.907
  809   3HG2  ILE  99          3HG2      ILE  99   2.923   3.735  -4.307
  810   1HD1  ILE  99          1HD1      ILE  99   5.463  -0.568  -4.631
  811   2HD1  ILE  99          2HD1      ILE  99   3.892  -0.140  -5.310
  812   3HD1  ILE  99          3HD1      ILE  99   4.335   0.410  -3.693
  813    H    TYR 100           H        TYR 100   1.163   3.424  -5.981
  814    HA   TYR 100           HA       TYR 100  -0.075   1.128  -4.712
  815   1HB   TYR 100          2HB       TYR 100  -0.722   4.053  -4.828
  816   2HB   TYR 100          1HB       TYR 100  -1.934   2.891  -4.291
  817    HD1  TYR 100           1HD      TYR 100   1.211   1.620  -3.479
  818    HD2  TYR 100           2HD      TYR 100  -1.610   4.546  -2.225
  819    HE1  TYR 100           1HE      TYR 100   2.202   1.604  -1.238
  820    HE2  TYR 100           2HE      TYR 100  -0.619   4.545   0.024
  821    HH   TYR 100           HH       TYR 100   0.717   3.137   1.448
  822    H    THR 101           H        THR 101  -0.531   3.129  -7.590
  823    HA   THR 101           HA       THR 101  -3.057   2.159  -8.334
  824    HB   THR 101           HB       THR 101  -1.855   4.105  -9.407
  825    HG1  THR 101           1HG      THR 101  -3.327   2.119 -10.662
  826   1HG2  THR 101          1HG2      THR 101  -0.409   3.596 -11.328
  827   2HG2  THR 101          2HG2      THR 101  -0.474   1.883 -10.914
  828   3HG2  THR 101          3HG2      THR 101   0.294   3.028  -9.814
  829    H    MET 102           H        MET 102   0.105   0.736  -8.520
  830    HA   MET 102           HA       MET 102  -0.835  -1.555 -10.036
  831   1HB   MET 102          1HB       MET 102   1.719  -1.332  -8.443
  832   2HB   MET 102          2HB       MET 102   1.362  -2.461  -9.742
  833   1HG   MET 102          2HG       MET 102   1.358  -0.679 -11.353
  834   2HG   MET 102          1HG       MET 102   1.557   0.513 -10.070
  835   1HE   MET 102          1HE       MET 102   3.876   0.935  -8.758
  836   2HE   MET 102          2HE       MET 102   5.154  -0.282  -8.760
  837   3HE   MET 102          3HE       MET 102   3.553  -0.683  -8.138
  838    H    ILE 103           H        ILE 103  -0.063  -0.721  -6.681
  839    HA   ILE 103           HA       ILE 103  -0.353  -3.137  -5.431
  840    HB   ILE 103           HB       ILE 103  -1.118  -0.370  -4.568
  841   1HG1  ILE 103          1HG1      ILE 103   1.264  -1.050  -4.649
  842   2HG1  ILE 103          2HG1      ILE 103   0.732  -0.653  -3.019
  843   1HG2  ILE 103          1HG2      ILE 103  -2.769  -1.795  -3.511
  844   2HG2  ILE 103          2HG2      ILE 103  -1.606  -1.221  -2.314
  845   3HG2  ILE 103          3HG2      ILE 103  -1.501  -2.871  -2.928
  846   1HD1  ILE 103          1HD1      ILE 103   1.055  -3.427  -4.138
  847   2HD1  ILE 103          2HD1      ILE 103   0.534  -3.024  -2.502
  848   3HD1  ILE 103          3HD1      ILE 103   2.164  -2.613  -3.035
  849    H    TYR 104           H        TYR 104  -2.924  -0.980  -6.553
  850    HA   TYR 104           HA       TYR 104  -4.940  -2.950  -5.762
  851   1HB   TYR 104          2HB       TYR 104  -5.233  -0.123  -6.802
  852   2HB   TYR 104          1HB       TYR 104  -6.574  -1.173  -6.361
  853    HD1  TYR 104           1HD      TYR 104  -7.063  -1.661  -4.032
  854    HD2  TYR 104           2HD      TYR 104  -3.808   0.865  -5.096
  855    HE1  TYR 104           1HE      TYR 104  -6.914  -0.882  -1.705
  856    HE2  TYR 104           2HE      TYR 104  -3.650   1.649  -2.770
  857    HH   TYR 104           HH       TYR 104  -5.251   0.117  -0.201
  858    H    ARG 105           H        ARG 105  -4.968  -0.768  -8.547
  859    HA   ARG 105           HA       ARG 105  -5.404  -1.105 -10.750
  860   1HB   ARG 105          1HB       ARG 105  -3.222  -2.231 -10.678
  861   2HB   ARG 105          2HB       ARG 105  -4.013  -3.742 -10.252
  862   1HG   ARG 105          2HG       ARG 105  -5.160  -3.763 -12.400
  863   2HG   ARG 105          1HG       ARG 105  -4.401  -2.229 -12.827
  864   1HD   ARG 105          1HD       ARG 105  -3.236  -4.111 -13.857
  865   2HD   ARG 105          2HD       ARG 105  -2.201  -3.269 -12.704
  866    HE   ARG 105           HE       ARG 105  -3.527  -5.437 -11.456
  867   1HH1  ARG 105          2HH1      ARG 105  -0.929  -4.706 -13.660
  868   2HH1  ARG 105          1HH1      ARG 105  -0.030  -6.136 -13.277
  869   1HH2  ARG 105          1HH2      ARG 105  -2.349  -7.321 -10.944
  870   2HH2  ARG 105          2HH2      ARG 105  -0.838  -7.623 -11.734
  871    H    ASN 106           H        ASN 106  -5.623  -4.544  -9.998
  872    HA   ASN 106           HA       ASN 106  -8.522  -4.400 -10.513
  873   1HB   ASN 106          2HB       ASN 106  -7.323  -5.529 -12.336
  874   2HB   ASN 106          1HB       ASN 106  -6.615  -6.654 -11.180
  875   1HD2  ASN 106          2HD2      ASN 106  -7.508  -8.434 -12.194
  876   2HD2  ASN 106          1HD2      ASN 106  -9.195  -8.800 -12.103
  877    H    LEU 107           H        LEU 107  -8.890  -4.129  -8.252
  878    HA   LEU 107           HA       LEU 107  -8.577  -6.626  -6.725
  879   1HB   LEU 107          1HB       LEU 107  -7.006  -4.910  -5.920
  880   2HB   LEU 107          2HB       LEU 107  -8.345  -3.811  -5.656
  881    HG   LEU 107           HG       LEU 107  -9.259  -5.399  -3.967
  882   1HD1  LEU 107          1HD1      LEU 107  -6.637  -6.827  -4.388
  883   2HD1  LEU 107          2HD1      LEU 107  -8.234  -7.445  -4.806
  884   3HD1  LEU 107          3HD1      LEU 107  -7.809  -7.172  -3.117
  885   1HD2  LEU 107          1HD2      LEU 107  -6.443  -4.441  -3.477
  886   2HD2  LEU 107          2HD2      LEU 107  -7.617  -4.876  -2.235
  887   3HD2  LEU 107          3HD2      LEU 107  -7.915  -3.488  -3.283
  888    H    VAL 108           H        VAL 108 -10.241  -7.124  -5.250
  889    HA   VAL 108           HA       VAL 108 -12.835  -6.233  -6.088
  890    HB   VAL 108           HB       VAL 108 -13.634  -7.754  -4.217
  891   1HG1  VAL 108          1HG1      VAL 108 -11.826  -8.912  -6.337
  892   2HG1  VAL 108          2HG1      VAL 108 -13.524  -8.480  -6.538
  893   3HG1  VAL 108          3HG1      VAL 108 -13.072  -9.797  -5.455
  894   1HG2  VAL 108          1HG2      VAL 108 -11.983  -9.319  -3.294
  895   2HG2  VAL 108          2HG2      VAL 108 -11.643  -7.656  -2.815
  896   3HG2  VAL 108          3HG2      VAL 108 -10.691  -8.418  -4.089
  897    H    VAL 109           H        VAL 109 -12.512  -3.953  -5.523
  898    HA   VAL 109           HA       VAL 109 -12.506  -3.289  -2.695
  899    HB   VAL 109           HB       VAL 109 -11.221  -1.871  -4.205
  900   1HG1  VAL 109          1HG2      VAL 109 -12.537  -2.162  -6.229
  901   2HG1  VAL 109          2HG2      VAL 109 -12.333  -0.449  -5.863
  902   3HG1  VAL 109          3HG2      VAL 109 -13.866  -1.250  -5.514
  903   1HG2  VAL 109          1HG1      VAL 109 -12.153  -0.850  -2.201
  904   2HG2  VAL 109          2HG1      VAL 109 -13.633  -0.452  -3.076
  905   3HG2  VAL 109          3HG1      VAL 109 -12.109   0.311  -3.527
  906    H    VAL 110           H        VAL 110 -14.202  -2.398  -1.565
  907    HA   VAL 110           HA       VAL 110 -16.844  -2.846  -2.735
  908    HB   VAL 110           HB       VAL 110 -16.083  -2.286   0.136
  909   1HG1  VAL 110          1HG2      VAL 110 -18.365  -3.011   0.658
  910   2HG1  VAL 110          2HG2      VAL 110 -18.708  -3.164  -1.066
  911   3HG1  VAL 110          3HG2      VAL 110 -18.359  -1.580  -0.372
  912   1HG2  VAL 110          1HG1      VAL 110 -15.208  -4.424  -0.626
  913   2HG2  VAL 110          2HG1      VAL 110 -16.802  -4.879  -1.229
  914   3HG2  VAL 110          3HG1      VAL 110 -16.540  -4.669   0.504
  915    H    ASN 111           H        ASN 111 -18.204  -1.243  -3.246
  916    HA   ASN 111           HA       ASN 111 -17.667   1.456  -2.215
  917   1HB   ASN 111          1HB       ASN 111 -18.129   2.399  -4.448
  918   2HB   ASN 111          2HB       ASN 111 -16.710   1.357  -4.458
  919   1HD2  ASN 111          2HD2      ASN 111 -16.801  -0.632  -5.496
  920   2HD2  ASN 111          1HD2      ASN 111 -18.046  -1.016  -6.632
  921    H    GLN 112           H        GLN 112 -19.528   2.935  -2.492
  922    HA   GLN 112           HA       GLN 112 -22.065   1.451  -2.285
  923   1HB   GLN 112          2HB       GLN 112 -21.260   4.037  -0.942
  924   2HB   GLN 112          1HB       GLN 112 -22.841   3.277  -0.811
  925   1HG   GLN 112          1HG       GLN 112 -21.830   1.337   0.260
  926   2HG   GLN 112          2HG       GLN 112 -20.238   2.079   0.112
  927   1HE2  GLN 112          2HE2      GLN 112 -19.705   3.830   1.415
  928   2HE2  GLN 112          1HE2      GLN 112 -20.609   4.227   2.835
  929    H    GLN 113           H        GLN 113 -23.603   1.904  -3.715
  930    HA   GLN 113           HA       GLN 113 -23.177   3.705  -5.848
  931   1HB   GLN 113          2HB       GLN 113 -24.654   1.588  -5.755
  932   2HB   GLN 113          1HB       GLN 113 -25.879   2.637  -5.060
  933   1HG   GLN 113          1HG       GLN 113 -24.561   3.089  -7.727
  934   2HG   GLN 113          2HG       GLN 113 -26.115   2.293  -7.496
  935   1HE2  GLN 113          2HE2      GLN 113 -24.395   5.299  -7.429
  936   2HE2  GLN 113          1HE2      GLN 113 -25.780   6.327  -7.330
  937    H    GLU 114           H        GLU 114 -22.957   5.818  -5.316
  938    HA   GLU 114           HA       GLU 114 -24.398   7.143  -3.292
  939   1HB   GLU 114          1HB       GLU 114 -22.998   8.302  -5.709
  940   2HB   GLU 114          2HB       GLU 114 -23.520   9.216  -4.300
  941   1HG   GLU 114          2HG       GLU 114 -21.470   7.014  -4.309
  942   2HG   GLU 114          1HG       GLU 114 -21.134   8.742  -4.233
  943    H    SER 115           H        SER 115 -26.578   7.087  -3.390
  944    HA   SER 115           HA       SER 115 -27.830   8.294  -5.767
  945   1HB   SER 115          1HB       SER 115 -29.787   6.832  -5.401
  946   2HB   SER 115          2HB       SER 115 -28.327   5.896  -5.722
  947    HG   SER 115           HG       SER 115 -29.727   6.244  -3.308
  948    H    SER 116           H        SER 116 -27.247   8.531  -2.497
  949    HA   SER 116           HA       SER 116 -29.385  10.516  -2.207
  950   1HB   SER 116          2HB       SER 116 -30.137   8.450  -1.076
  951   2HB   SER 116          1HB       SER 116 -28.673   8.465  -0.094
  952    HG   SER 116           HG       SER 116 -30.464   9.409   0.986
  953    H    ASP 117           H        ASP 117 -26.502  10.659  -2.750
  954    HA   ASP 117           HA       ASP 117 -24.719  11.944  -2.185
  955   1HB   ASP 117          1HB       ASP 117 -26.662  13.184  -0.225
  956   2HB   ASP 117          2HB       ASP 117 -25.092  13.854  -0.660
  957    H    SER 118           H        SER 118 -26.094  11.984   1.071
  958    HA   SER 118           HA       SER 118 -24.233   9.952   1.983
  959   1HB   SER 118          2HB       SER 118 -24.105  12.793   3.022
  960   2HB   SER 118          1HB       SER 118 -23.230  11.420   3.700
  961    HG   SER 118           HG       SER 118 -22.889  12.665   1.189
  962    H    SER 119           H        SER 119 -27.049  11.845   2.311
  963    HA   SER 119           HA       SER 119 -27.847  10.250   4.645
  964   1HB   SER 119          1HB       SER 119 -29.041  12.232   5.557
  965   2HB   SER 119          2HB       SER 119 -27.293  12.456   5.504
  966    HG   SER 119           HG       SER 119 -28.357  13.284   3.196
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1 -28.059  30.749 -22.640
    2   2H    MET   1          2H        MET   1 -26.579  31.377 -23.163
    3   3H    MET   1          3H        MET   1 -27.481  32.203 -21.997
    4    HA   MET   1           HA       MET   1 -25.658  31.094 -20.943
    5   1HB   MET   1          2HB       MET   1 -28.331  29.776 -20.425
    6   2HB   MET   1          1HB       MET   1 -26.943  29.657 -19.355
    7   1HG   MET   1          2HG       MET   1 -28.326  31.309 -18.434
    8   2HG   MET   1          1HG       MET   1 -26.996  32.172 -19.202
    9   1HE   MET   1          1HE       MET   1 -29.725  33.566 -18.311
   10   2HE   MET   1          2HE       MET   1 -30.034  34.599 -19.706
   11   3HE   MET   1          3HE       MET   1 -28.395  34.433 -19.079
   12    H    CYS   2           H        CYS   2 -25.995  29.861 -23.663
   13    HA   CYS   2           HA       CYS   2 -25.652  27.022 -23.111
   14   1HB   CYS   2          2HB       CYS   2 -27.011  27.676 -25.041
   15   2HB   CYS   2          1HB       CYS   2 -25.641  28.544 -25.726
   16    HG   CYS   2           HG       CYS   2 -26.416  25.812 -26.769
   17    H    ASN   3           H        ASN   3 -23.761  29.838 -23.712
   18    HA   ASN   3           HA       ASN   3 -21.395  28.354 -24.491
   19   1HB   ASN   3          2HB       ASN   3 -21.922  31.289 -24.025
   20   2HB   ASN   3          1HB       ASN   3 -20.322  30.655 -24.396
   21   1HD2  ASN   3          1HD2      ASN   3 -23.266  29.337 -25.739
   22   2HD2  ASN   3          2HD2      ASN   3 -22.989  29.864 -27.360
   23    H    THR   4           H        THR   4 -22.848  29.566 -21.621
   24    HA   THR   4           HA       THR   4 -20.351  29.382 -20.108
   25    HB   THR   4           HB       THR   4 -21.716  31.327 -19.623
   26    HG1  THR   4           1HG      THR   4 -20.679  30.649 -17.805
   27   1HG2  THR   4          1HG2      THR   4 -23.901  30.424 -20.250
   28   2HG2  THR   4          2HG2      THR   4 -23.947  31.111 -18.625
   29   3HG2  THR   4          3HG2      THR   4 -23.874  29.362 -18.842
   30    H    ASN   5           H        ASN   5 -20.039  27.955 -18.410
   31    HA   ASN   5           HA       ASN   5 -21.697  25.554 -18.513
   32   1HB   ASN   5          2HB       ASN   5 -19.027  26.047 -17.177
   33   2HB   ASN   5          1HB       ASN   5 -19.859  24.496 -17.242
   34   1HD2  ASN   5          1HD2      ASN   5 -18.096  26.884 -19.043
   35   2HD2  ASN   5          2HD2      ASN   5 -17.793  25.906 -20.434
   36    H    MET   6           H        MET   6 -23.433  25.702 -17.226
   37    HA   MET   6           HA       MET   6 -23.293  27.069 -14.676
   38   1HB   MET   6          2HB       MET   6 -25.271  27.169 -16.271
   39   2HB   MET   6          1HB       MET   6 -25.627  25.515 -15.794
   40   1HG   MET   6          2HG       MET   6 -25.395  27.743 -13.799
   41   2HG   MET   6          1HG       MET   6 -26.904  27.368 -14.626
   42   1HE   MET   6          1HE       MET   6 -27.498  25.963 -11.013
   43   2HE   MET   6          2HE       MET   6 -28.104  27.039 -12.274
   44   3HE   MET   6          3HE       MET   6 -26.589  27.410 -11.451
   45    H    SER   7           H        SER   7 -23.202  26.145 -12.705
   46    HA   SER   7           HA       SER   7 -22.843  24.582 -11.095
   47   1HB   SER   7          1HB       SER   7 -25.115  23.826 -11.695
   48   2HB   SER   7          2HB       SER   7 -24.431  22.769 -12.930
   49    HG   SER   7           HG       SER   7 -24.517  21.414 -11.288
   50    H    VAL   8           H        VAL   8 -22.001  22.183 -10.814
   51    HA   VAL   8           HA       VAL   8 -20.209  20.797 -11.027
   52    HB   VAL   8           HB       VAL   8 -20.477  21.320 -13.991
   53   1HG1  VAL   8          1HG1      VAL   8 -18.391  20.225 -13.381
   54   2HG1  VAL   8          2HG1      VAL   8 -19.458  19.100 -14.223
   55   3HG1  VAL   8          3HG1      VAL   8 -19.280  19.004 -12.471
   56   1HG2  VAL   8          1HG2      VAL   8 -22.613  20.618 -13.062
   57   2HG2  VAL   8          2HG2      VAL   8 -21.835  19.243 -12.277
   58   3HG2  VAL   8          3HG2      VAL   8 -21.908  19.329 -14.037
   59    HA   PRO   9           HA       PRO   9 -17.313  24.413 -11.124
   60   1HB   PRO   9          2HB       PRO   9 -16.030  22.632  -9.121
   61   2HB   PRO   9          1HB       PRO   9 -16.351  24.367  -9.041
   62   1HG   PRO   9          1HG       PRO   9 -17.821  22.643  -7.639
   63   2HG   PRO   9          2HG       PRO   9 -18.561  24.061  -8.406
   64   1HD   PRO   9          2HD       PRO   9 -18.605  21.197  -9.267
   65   2HD   PRO   9          1HD       PRO   9 -19.893  22.419  -9.343
   66    H    THR  10           H        THR  10 -15.244  24.561 -11.986
   67    HA   THR  10           HA       THR  10 -14.367  22.231 -13.482
   68    HB   THR  10           HB       THR  10 -12.773  23.776 -14.563
   69    HG1  THR  10           1HG      THR  10 -12.475  25.764 -13.820
   70   1HG2  THR  10          1HG2      THR  10 -14.427  25.183 -15.705
   71   2HG2  THR  10          2HG2      THR  10 -15.602  24.830 -14.438
   72   3HG2  THR  10          3HG2      THR  10 -15.025  23.538 -15.489
   73    H    ASP  11           H        ASP  11 -13.105  20.821 -12.462
   74    HA   ASP  11           HA       ASP  11 -11.440  19.917 -11.207
   75   1HB   ASP  11          1HB       ASP  11 -10.092  22.560 -11.798
   76   2HB   ASP  11          2HB       ASP  11  -9.284  21.125 -11.175
   77    H    GLY  12           H        GLY  12 -12.806  19.966  -9.330
   78   1HA   GLY  12          1HA       GLY  12 -12.087  22.058  -7.379
   79   2HA   GLY  12          2HA       GLY  12 -13.551  21.089  -7.319
   80    H    ALA  13           H        ALA  13 -10.034  20.942  -6.994
   81    HA   ALA  13           HA       ALA  13 -10.340  18.487  -5.398
   82   1HB   ALA  13          1HB       ALA  13  -7.879  19.535  -6.793
   83   2HB   ALA  13          2HB       ALA  13  -8.928  18.246  -7.384
   84   3HB   ALA  13          3HB       ALA  13  -8.003  18.020  -5.899
   85    H    VAL  14           H        VAL  14  -9.808  18.485  -3.305
   86    HA   VAL  14           HA       VAL  14  -8.957  20.967  -2.071
   87    HB   VAL  14           HB       VAL  14  -9.658  18.309  -0.815
   88   1HG1  VAL  14          1HG1      VAL  14  -9.829  19.584   1.279
   89   2HG1  VAL  14          2HG1      VAL  14  -9.230  21.017   0.442
   90   3HG1  VAL  14          3HG1      VAL  14  -8.192  19.602   0.622
   91   1HG2  VAL  14          1HG2      VAL  14 -11.772  19.391  -0.216
   92   2HG2  VAL  14          2HG2      VAL  14 -11.553  19.313  -1.964
   93   3HG2  VAL  14          3HG2      VAL  14 -11.284  20.833  -1.109
   94    H    THR  15           H        THR  15  -7.722  17.720  -2.619
   95    HA   THR  15           HA       THR  15  -5.257  18.328  -1.181
   96    HB   THR  15           HB       THR  15  -6.192  16.134  -0.776
   97    HG1  THR  15           1HG      THR  15  -3.906  15.873  -2.462
   98   1HG2  THR  15          1HG2      THR  15  -7.425  15.873  -2.872
   99   2HG2  THR  15          2HG2      THR  15  -6.398  14.474  -2.563
  100   3HG2  THR  15          3HG2      THR  15  -5.907  15.684  -3.748
  101    H    THR  16           H        THR  16  -3.171  17.729  -2.238
  102    HA   THR  16           HA       THR  16  -3.203  18.468  -5.090
  103    HB   THR  16           HB       THR  16  -1.212  19.448  -3.034
  104    HG1  THR  16           1HG      THR  16  -3.613  20.456  -3.970
  105   1HG2  THR  16          1HG2      THR  16  -0.236  19.174  -5.263
  106   2HG2  THR  16          2HG2      THR  16  -0.394  20.880  -4.846
  107   3HG2  THR  16          3HG2      THR  16  -1.542  20.136  -5.958
  108    H    SER  17           H        SER  17  -1.700  16.653  -2.509
  109    HA   SER  17           HA       SER  17  -0.209  15.110  -4.509
  110   1HB   SER  17          1HB       SER  17   1.770  15.057  -3.030
  111   2HB   SER  17          2HB       SER  17   1.388  16.696  -3.556
  112    HG   SER  17           HG       SER  17   1.244  17.196  -1.534
  113    H    GLN  18           H        GLN  18  -0.939  13.103  -4.374
  114    HA   GLN  18           HA       GLN  18  -0.631  11.582  -1.991
  115   1HB   GLN  18          1HB       GLN  18  -3.050  10.823  -1.952
  116   2HB   GLN  18          2HB       GLN  18  -2.722  12.398  -1.243
  117   1HG   GLN  18          2HG       GLN  18  -3.488  13.455  -3.330
  118   2HG   GLN  18          1HG       GLN  18  -3.810  11.852  -4.000
  119   1HE2  GLN  18          1HE2      GLN  18  -5.989  12.290  -4.287
  120   2HE2  GLN  18          2HE2      GLN  18  -7.096  12.384  -2.966
  121    H    ILE  19           H        ILE  19  -2.506   9.577  -2.564
  122    HA   ILE  19           HA       ILE  19  -2.430   9.248  -5.460
  123    HB   ILE  19           HB       ILE  19  -1.366   7.307  -4.678
  124   1HG1  ILE  19          1HG1      ILE  19  -4.308   6.592  -4.845
  125   2HG1  ILE  19          2HG1      ILE  19  -3.210   6.741  -6.214
  126   1HG2  ILE  19          1HG2      ILE  19  -1.628   6.412  -2.635
  127   2HG2  ILE  19          2HG2      ILE  19  -3.389   6.564  -2.682
  128   3HG2  ILE  19          3HG2      ILE  19  -2.392   7.972  -2.301
  129   1HD1  ILE  19          1HD1      ILE  19  -2.995   4.715  -4.003
  130   2HD1  ILE  19          2HD1      ILE  19  -1.909   4.861  -5.386
  131   3HD1  ILE  19          3HD1      ILE  19  -3.598   4.420  -5.635
  132    HA   PRO  20           HA       PRO  20  -6.635  10.245  -5.471
  133   1HB   PRO  20          2HB       PRO  20  -7.033   8.389  -7.723
  134   2HB   PRO  20          1HB       PRO  20  -7.151  10.150  -7.687
  135   1HG   PRO  20          2HG       PRO  20  -5.118   8.891  -8.920
  136   2HG   PRO  20          1HG       PRO  20  -4.895  10.442  -8.089
  137   1HD   PRO  20          1HD       PRO  20  -4.208   7.675  -7.152
  138   2HD   PRO  20          2HD       PRO  20  -3.281   9.179  -6.979
  139    H    ALA  21           H        ALA  21  -8.154   9.569  -4.114
  140    HA   ALA  21           HA       ALA  21  -9.423   8.233  -2.785
  141   1HB   ALA  21          1HB       ALA  21 -10.502   7.679  -4.912
  142   2HB   ALA  21          2HB       ALA  21 -10.495   6.307  -3.804
  143   3HB   ALA  21          3HB       ALA  21  -9.354   6.362  -5.147
  144    H    SER  22           H        SER  22  -8.219   7.643  -1.095
  145    HA   SER  22           HA       SER  22  -7.154   5.074  -0.766
  146   1HB   SER  22          1HB       SER  22  -4.763   5.480  -0.843
  147   2HB   SER  22          2HB       SER  22  -5.466   5.907  -2.404
  148    HG   SER  22           HG       SER  22  -4.599   7.786  -2.107
  149    H    GLU  23           H        GLU  23  -7.882   8.171   0.227
  150    HA   GLU  23           HA       GLU  23  -6.581   8.102   2.791
  151   1HB   GLU  23          2HB       GLU  23  -7.965  10.075   3.304
  152   2HB   GLU  23          1HB       GLU  23  -7.111  10.252   1.778
  153   1HG   GLU  23          1HG       GLU  23  -9.969   9.345   1.947
  154   2HG   GLU  23          2HG       GLU  23  -9.504  11.040   1.830
  155    H    GLN  24           H        GLN  24  -7.728   5.722   2.566
  156    HA   GLN  24           HA       GLN  24  -9.070   4.227   3.643
  157   1HB   GLN  24          2HB       GLN  24  -8.649   5.551   5.671
  158   2HB   GLN  24          1HB       GLN  24  -9.983   6.617   5.257
  159   1HG   GLN  24          2HG       GLN  24 -11.543   4.750   5.470
  160   2HG   GLN  24          1HG       GLN  24 -10.203   3.683   5.891
  161   1HE2  GLN  24          2HE2      GLN  24 -11.071   3.192   7.895
  162   2HE2  GLN  24          1HE2      GLN  24 -11.089   4.324   9.199
  163    H    GLU  25           H        GLU  25 -11.021   3.320   3.166
  164    HA   GLU  25           HA       GLU  25 -13.337   4.702   2.331
  165   1HB   GLU  25          2HB       GLU  25 -13.116   4.332  -0.117
  166   2HB   GLU  25          1HB       GLU  25 -11.974   5.513   0.511
  167   1HG   GLU  25          2HG       GLU  25 -10.179   3.955   0.404
  168   2HG   GLU  25          1HG       GLU  25 -11.278   2.622   0.047
  169    H    THR  26           H        THR  26 -11.293   1.878   1.686
  170    HA   THR  26           HA       THR  26 -13.727   0.308   1.154
  171    HB   THR  26           HB       THR  26 -10.973   0.022  -0.054
  172    HG1  THR  26           1HG      THR  26 -13.083   0.435  -1.739
  173   1HG2  THR  26          1HG2      THR  26 -12.063  -2.151   0.202
  174   2HG2  THR  26          2HG2      THR  26 -12.004  -1.680  -1.496
  175   3HG2  THR  26          3HG2      THR  26 -13.511  -1.531  -0.590
  176    H    LEU  27           H        LEU  27 -14.133  -1.175   2.686
  177    HA   LEU  27           HA       LEU  27 -11.996  -2.341   4.226
  178   1HB   LEU  27          2HB       LEU  27 -14.970  -2.671   4.152
  179   2HB   LEU  27          1HB       LEU  27 -13.985  -3.903   4.920
  180    HG   LEU  27           HG       LEU  27 -14.803  -2.303   6.570
  181   1HD1  LEU  27          1HD1      LEU  27 -12.542  -3.344   6.797
  182   2HD1  LEU  27          2HD1      LEU  27 -12.720  -1.803   7.640
  183   3HD1  LEU  27          3HD1      LEU  27 -11.853  -1.869   6.103
  184   1HD2  LEU  27          1HD2      LEU  27 -13.360  -0.270   4.874
  185   2HD2  LEU  27          2HD2      LEU  27 -13.999   0.041   6.490
  186   3HD2  LEU  27          3HD2      LEU  27 -15.097  -0.362   5.170
  187    H    VAL  28           H        VAL  28 -11.249  -2.662   1.854
  188    HA   VAL  28           HA       VAL  28 -12.161  -4.783   0.290
  189    HB   VAL  28           HB       VAL  28 -10.641  -3.489  -0.851
  190   1HG1  VAL  28          1HG1      VAL  28  -8.499  -2.709   0.148
  191   2HG1  VAL  28          2HG1      VAL  28  -8.982  -3.490   1.659
  192   3HG1  VAL  28          3HG1      VAL  28  -9.939  -2.147   1.009
  193   1HG2  VAL  28          1HG2      VAL  28  -9.943  -5.797  -1.154
  194   2HG2  VAL  28          2HG2      VAL  28  -8.914  -5.693   0.277
  195   3HG2  VAL  28          3HG2      VAL  28  -8.534  -4.736  -1.157
  196    H    ARG  29           H        ARG  29 -11.621  -6.938   0.200
  197    HA   ARG  29           HA       ARG  29 -10.122  -7.985   2.482
  198   1HB   ARG  29          1HB       ARG  29 -12.778  -9.153   1.655
  199   2HB   ARG  29          2HB       ARG  29 -11.865  -9.470   3.123
  200   1HG   ARG  29          1HG       ARG  29 -12.372  -7.299   3.990
  201   2HG   ARG  29          2HG       ARG  29 -13.097  -6.797   2.460
  202   1HD   ARG  29          2HD       ARG  29 -14.120  -8.984   4.272
  203   2HD   ARG  29          1HD       ARG  29 -14.804  -7.366   4.117
  204    HE   ARG  29           HE       ARG  29 -14.718  -8.583   1.585
  205   1HH1  ARG  29          2HH1      ARG  29 -16.401  -8.817   4.626
  206   2HH1  ARG  29          1HH1      ARG  29 -17.850  -9.453   3.923
  207   1HH2  ARG  29          1HH2      ARG  29 -16.621  -9.421   0.650
  208   2HH2  ARG  29          2HH2      ARG  29 -17.974  -9.798   1.662
  209    HA   PRO  30           HA       PRO  30  -9.247  -9.915  -1.608
  210   1HB   PRO  30          2HB       PRO  30  -6.631  -9.419  -1.789
  211   2HB   PRO  30          1HB       PRO  30  -7.821  -8.133  -2.015
  212   1HG   PRO  30          2HG       PRO  30  -6.122  -8.753   0.363
  213   2HG   PRO  30          1HG       PRO  30  -6.568  -7.178  -0.315
  214   1HD   PRO  30          1HD       PRO  30  -7.793  -8.398   1.866
  215   2HD   PRO  30          2HD       PRO  30  -8.497  -7.094   0.891
  216    H    LYS  31           H        LYS  31  -7.736 -11.630  -2.360
  217    HA   LYS  31           HA       LYS  31  -7.509 -13.803  -0.595
  218   1HB   LYS  31          1HB       LYS  31  -6.118 -14.824  -2.370
  219   2HB   LYS  31          2HB       LYS  31  -7.602 -14.123  -2.999
  220   1HG   LYS  31          2HG       LYS  31  -6.361 -12.157  -3.748
  221   2HG   LYS  31          1HG       LYS  31  -4.870 -12.862  -3.118
  222   1HD   LYS  31          2HD       LYS  31  -4.828 -13.359  -5.405
  223   2HD   LYS  31          1HD       LYS  31  -5.377 -14.851  -4.642
  224   1HE   LYS  31          2HE       LYS  31  -7.210 -12.782  -5.842
  225   2HE   LYS  31          1HE       LYS  31  -6.649 -14.221  -6.690
  226   1HZ   LYS  31          1HZ       LYS  31  -8.797 -14.653  -5.787
  227   2HZ   LYS  31          2HZ       LYS  31  -8.327 -14.138  -4.245
  228   3HZ   LYS  31          3HZ       LYS  31  -7.675 -15.556  -4.898
  229    HA   PRO  32           HA       PRO  32  -3.790 -13.302   1.684
  230   1HB   PRO  32          2HB       PRO  32  -2.362 -15.598   1.143
  231   2HB   PRO  32          1HB       PRO  32  -3.692 -15.493   2.300
  232   1HG   PRO  32          1HG       PRO  32  -3.710 -16.462  -0.530
  233   2HG   PRO  32          2HG       PRO  32  -4.532 -17.134   0.891
  234   1HD   PRO  32          1HD       PRO  32  -5.855 -15.667  -0.918
  235   2HD   PRO  32          2HD       PRO  32  -6.228 -15.549   0.815
  236    H    LEU  33           H        LEU  33  -3.193 -11.540   0.169
  237    HA   LEU  33           HA       LEU  33  -0.523 -12.036  -0.846
  238   1HB   LEU  33          2HB       LEU  33  -2.746 -10.989  -2.596
  239   2HB   LEU  33          1HB       LEU  33  -1.048 -10.807  -2.986
  240    HG   LEU  33           HG       LEU  33  -2.435 -13.466  -2.633
  241   1HD1  LEU  33          1HD2      LEU  33  -1.684 -11.998  -5.157
  242   2HD1  LEU  33          2HD2      LEU  33  -3.322 -12.280  -4.566
  243   3HD1  LEU  33          3HD2      LEU  33  -2.320 -13.641  -5.067
  244   1HD2  LEU  33          1HD1      LEU  33  -0.417 -14.369  -3.674
  245   2HD2  LEU  33          2HD1      LEU  33  -0.046 -13.534  -2.165
  246   3HD2  LEU  33          3HD1      LEU  33   0.289 -12.752  -3.710
  247    H    LEU  34           H        LEU  34  -2.804 -10.146   0.679
  248    HA   LEU  34           HA       LEU  34  -0.995  -7.837   0.699
  249   1HB   LEU  34          1HB       LEU  34  -3.952  -7.884   0.218
  250   2HB   LEU  34          2HB       LEU  34  -3.245  -6.524   1.068
  251    HG   LEU  34           HG       LEU  34  -3.450  -5.920  -1.232
  252   1HD1  LEU  34          1HD2      LEU  34  -1.450  -5.092  -0.223
  253   2HD1  LEU  34          2HD2      LEU  34  -1.064  -5.588  -1.871
  254   3HD1  LEU  34          3HD2      LEU  34  -0.610  -6.617  -0.510
  255   1HD2  LEU  34          1HD1      LEU  34  -1.903  -8.420  -1.895
  256   2HD2  LEU  34          2HD1      LEU  34  -2.461  -7.200  -3.041
  257   3HD2  LEU  34          3HD1      LEU  34  -3.630  -8.181  -2.157
  258    H    LEU  35           H        LEU  35  -2.373 -10.286   2.285
  259    HA   LEU  35           HA       LEU  35  -1.959  -8.931   4.826
  260   1HB   LEU  35          2HB       LEU  35  -3.609 -11.215   5.251
  261   2HB   LEU  35          1HB       LEU  35  -3.958  -9.541   5.610
  262    HG   LEU  35           HG       LEU  35  -5.724 -10.556   4.278
  263   1HD1  LEU  35          1HD1      LEU  35  -4.432  -8.703   2.360
  264   2HD1  LEU  35          2HD1      LEU  35  -4.773  -8.120   3.989
  265   3HD1  LEU  35          3HD1      LEU  35  -6.086  -8.729   2.980
  266   1HD2  LEU  35          1HD2      LEU  35  -3.603 -10.948   2.176
  267   2HD2  LEU  35          2HD2      LEU  35  -5.332 -11.232   1.970
  268   3HD2  LEU  35          3HD2      LEU  35  -4.404 -12.219   3.098
  269    H    LYS  36           H        LYS  36  -1.160 -10.437   6.497
  270    HA   LYS  36           HA       LYS  36   0.712 -11.555   7.127
  271   1HB   LYS  36          1HB       LYS  36  -0.442 -13.534   6.230
  272   2HB   LYS  36          2HB       LYS  36   0.228 -13.198   4.642
  273   1HG   LYS  36          2HG       LYS  36   2.487 -13.519   5.529
  274   2HG   LYS  36          1HG       LYS  36   1.804 -13.878   7.117
  275   1HD   LYS  36          2HD       LYS  36   0.618 -15.800   6.167
  276   2HD   LYS  36          1HD       LYS  36   1.315 -15.445   4.585
  277   1HE   LYS  36          2HE       LYS  36   2.549 -17.227   5.693
  278   2HE   LYS  36          1HE       LYS  36   3.558 -15.796   5.490
  279   1HZ   LYS  36          1HZ       LYS  36   2.164 -16.581   7.992
  280   2HZ   LYS  36          2HZ       LYS  36   3.142 -15.215   7.796
  281   3HZ   LYS  36          3HZ       LYS  36   3.818 -16.760   7.687
  282    H    LEU  37           H        LEU  37   0.466 -10.489   3.781
  283    HA   LEU  37           HA       LEU  37   3.134  -9.494   3.674
  284   1HB   LEU  37          1HB       LEU  37   1.537  -9.726   1.733
  285   2HB   LEU  37          2HB       LEU  37   0.595  -8.416   2.417
  286    HG   LEU  37           HG       LEU  37   2.101  -7.790   0.513
  287   1HD1  LEU  37          1HD1      LEU  37   3.176  -6.016   2.415
  288   2HD1  LEU  37          2HD1      LEU  37   1.573  -6.508   2.981
  289   3HD1  LEU  37          3HD1      LEU  37   1.767  -5.793   1.376
  290   1HD2  LEU  37          1HD2      LEU  37   4.475  -7.395   1.076
  291   2HD2  LEU  37          2HD2      LEU  37   4.046  -9.106   1.017
  292   3HD2  LEU  37          3HD2      LEU  37   4.237  -8.297   2.573
  293    H    LEU  38           H        LEU  38   0.220  -8.792   5.345
  294    HA   LEU  38           HA       LEU  38   1.440  -6.381   6.514
  295   1HB   LEU  38          1HB       LEU  38  -1.493  -6.851   5.986
  296   2HB   LEU  38          2HB       LEU  38  -0.811  -5.441   6.773
  297    HG   LEU  38           HG       LEU  38  -0.520  -6.264   3.889
  298   1HD1  LEU  38          1HD2      LEU  38  -2.582  -5.084   4.515
  299   2HD1  LEU  38          2HD2      LEU  38  -1.562  -4.133   3.436
  300   3HD1  LEU  38          3HD2      LEU  38  -1.610  -3.759   5.160
  301   1HD2  LEU  38          1HD1      LEU  38   0.903  -4.291   3.625
  302   2HD2  LEU  38          2HD1      LEU  38   1.630  -5.513   4.667
  303   3HD2  LEU  38          3HD1      LEU  38   0.903  -4.070   5.374
  304    H    LYS  39           H        LYS  39  -0.476  -9.278   7.001
  305    HA   LYS  39           HA       LYS  39  -1.019  -8.796   9.761
  306   1HB   LYS  39          1HB       LYS  39  -1.028 -11.429   8.270
  307   2HB   LYS  39          2HB       LYS  39  -1.782 -11.112   9.828
  308   1HG   LYS  39          2HG       LYS  39  -3.262  -9.465   8.726
  309   2HG   LYS  39          1HG       LYS  39  -2.557  -9.921   7.175
  310   1HD   LYS  39          1HD       LYS  39  -3.960 -11.837   9.035
  311   2HD   LYS  39          2HD       LYS  39  -4.730 -11.025   7.667
  312   1HE   LYS  39          1HE       LYS  39  -4.131 -13.170   6.895
  313   2HE   LYS  39          2HE       LYS  39  -2.955 -12.052   6.206
  314   1HZ   LYS  39          1HZ       LYS  39  -1.334 -12.736   7.777
  315   2HZ   LYS  39          2HZ       LYS  39  -2.006 -14.148   7.131
  316   3HZ   LYS  39          3HZ       LYS  39  -2.460 -13.625   8.674
  317    H    SER  40           H        SER  40   1.818  -9.366   8.229
  318    HA   SER  40           HA       SER  40   2.981 -10.920  10.426
  319   1HB   SER  40          1HB       SER  40   3.547 -11.676   8.169
  320   2HB   SER  40          2HB       SER  40   4.175 -10.074   7.775
  321    HG   SER  40           HG       SER  40   5.196 -11.503   9.974
  322    H    VAL  41           H        VAL  41   2.901  -7.727   9.046
  323    HA   VAL  41           HA       VAL  41   5.213  -6.833  10.548
  324    HB   VAL  41           HB       VAL  41   5.063  -5.859   8.401
  325   1HG1  VAL  41          1HG1      VAL  41   2.705  -6.335   7.968
  326   2HG1  VAL  41          2HG1      VAL  41   3.110  -4.665   7.569
  327   3HG1  VAL  41          3HG1      VAL  41   2.239  -5.030   9.058
  328   1HG2  VAL  41          1HG2      VAL  41   5.684  -4.311  10.221
  329   2HG2  VAL  41          2HG2      VAL  41   4.000  -3.786  10.313
  330   3HG2  VAL  41          3HG2      VAL  41   4.938  -3.494   8.846
  331    H    GLY  42           H        GLY  42   1.706  -6.600  10.709
  332   1HA   GLY  42          1HA       GLY  42   1.712  -6.063  13.468
  333   2HA   GLY  42          2HA       GLY  42   1.510  -4.544  12.612
  334    H    ALA  43           H        ALA  43   0.045  -6.001  10.421
  335    HA   ALA  43           HA       ALA  43  -2.534  -5.389  11.407
  336   1HB   ALA  43          1HB       ALA  43  -1.765  -6.848   8.879
  337   2HB   ALA  43          2HB       ALA  43  -1.918  -5.102   9.058
  338   3HB   ALA  43          3HB       ALA  43  -3.339  -6.133   9.225
  339    H    GLN  44           H        GLN  44  -4.403  -6.854  11.415
  340    HA   GLN  44           HA       GLN  44  -4.007  -9.676  11.597
  341   1HB   GLN  44          1HB       GLN  44  -4.363 -10.022  13.923
  342   2HB   GLN  44          2HB       GLN  44  -3.066  -8.844  13.784
  343   1HG   GLN  44          2HG       GLN  44  -5.877  -7.908  14.121
  344   2HG   GLN  44          1HG       GLN  44  -4.976  -8.502  15.514
  345   1HE2  GLN  44          1HE2      GLN  44  -4.967  -6.504  16.509
  346   2HE2  GLN  44          2HE2      GLN  44  -3.992  -5.193  15.950
  347    H    LYS  45           H        LYS  45  -5.804  -7.276  10.688
  348    HA   LYS  45           HA       LYS  45  -8.383  -8.101  11.731
  349   1HB   LYS  45          2HB       LYS  45  -7.710  -6.023   9.638
  350   2HB   LYS  45          1HB       LYS  45  -9.282  -6.260  10.387
  351   1HG   LYS  45          1HG       LYS  45  -8.297  -5.683  12.572
  352   2HG   LYS  45          2HG       LYS  45  -6.760  -5.366  11.766
  353   1HD   LYS  45          1HD       LYS  45  -9.355  -3.949  11.167
  354   2HD   LYS  45          2HD       LYS  45  -8.066  -3.311  12.189
  355   1HE   LYS  45          2HE       LYS  45  -6.526  -3.364  10.297
  356   2HE   LYS  45          1HE       LYS  45  -7.797  -4.028   9.272
  357   1HZ   LYS  45          1HZ       LYS  45  -7.842  -1.364  10.583
  358   2HZ   LYS  45          2HZ       LYS  45  -9.077  -2.002   9.619
  359   3HZ   LYS  45          3HZ       LYS  45  -7.567  -1.656   8.938
  360    H    ASP  46           H        ASP  46 -10.042  -9.016  10.536
  361    HA   ASP  46           HA       ASP  46  -9.281 -10.811   8.474
  362   1HB   ASP  46          1HB       ASP  46 -12.037  -9.969   9.394
  363   2HB   ASP  46          2HB       ASP  46 -11.692 -11.341   8.345
  364    H    THR  47           H        THR  47 -10.027  -7.532   8.433
  365    HA   THR  47           HA       THR  47 -10.270  -7.619   5.503
  366    HB   THR  47           HB       THR  47 -11.854  -5.810   5.470
  367    HG1  THR  47           1HG      THR  47 -11.051  -5.518   8.070
  368   1HG2  THR  47          1HG2      THR  47 -12.859  -8.005   5.703
  369   2HG2  THR  47          2HG2      THR  47 -13.802  -6.811   6.598
  370   3HG2  THR  47          3HG2      THR  47 -12.722  -7.906   7.460
  371    H    TYR  48           H        TYR  48  -9.856  -5.357   4.577
  372    HA   TYR  48           HA       TYR  48  -8.000  -3.822   6.233
  373   1HB   TYR  48          2HB       TYR  48  -7.395  -5.067   3.575
  374   2HB   TYR  48          1HB       TYR  48  -6.560  -3.610   4.103
  375    HD1  TYR  48           1HD      TYR  48  -4.894  -3.679   5.775
  376    HD2  TYR  48           2HD      TYR  48  -7.143  -7.171   4.856
  377    HE1  TYR  48           1HE      TYR  48  -3.288  -5.044   7.055
  378    HE2  TYR  48           2HE      TYR  48  -5.534  -8.545   6.120
  379    HH   TYR  48           HH       TYR  48  -3.571  -7.519   8.309
  380    H    THR  49           H        THR  49  -7.483  -1.721   5.338
  381    HA   THR  49           HA       THR  49  -9.420  -0.775   3.349
  382    HB   THR  49           HB       THR  49  -9.217   1.481   4.699
  383    HG1  THR  49           1HG      THR  49  -9.386   0.008   6.994
  384   1HG2  THR  49          1HG2      THR  49 -11.323   0.444   4.233
  385   2HG2  THR  49          2HG2      THR  49 -11.277   0.853   5.949
  386   3HG2  THR  49          3HG2      THR  49 -11.024  -0.814   5.432
  387    H    MET  50           H        MET  50  -8.742   1.062   2.131
  388    HA   MET  50           HA       MET  50  -6.161   0.728   1.149
  389   1HB   MET  50          2HB       MET  50  -8.242   2.854   0.787
  390   2HB   MET  50          1HB       MET  50  -6.669   3.000   0.011
  391   1HG   MET  50          1HG       MET  50  -7.121   0.671  -0.932
  392   2HG   MET  50          2HG       MET  50  -8.788   0.924  -0.418
  393   1HE   MET  50          1HE       MET  50  -6.185   3.527  -1.844
  394   2HE   MET  50          2HE       MET  50  -6.597   3.497  -3.558
  395   3HE   MET  50          3HE       MET  50  -5.905   2.067  -2.792
  396    H    LYS  51           H        LYS  51  -7.210   2.514   3.861
  397    HA   LYS  51           HA       LYS  51  -4.829   4.205   3.892
  398   1HB   LYS  51          1HB       LYS  51  -6.976   5.170   4.622
  399   2HB   LYS  51          2HB       LYS  51  -7.081   3.964   5.896
  400   1HG   LYS  51          2HG       LYS  51  -5.081   4.872   6.942
  401   2HG   LYS  51          1HG       LYS  51  -4.938   6.064   5.649
  402   1HD   LYS  51          2HD       LYS  51  -7.109   7.006   6.284
  403   2HD   LYS  51          1HD       LYS  51  -7.245   5.817   7.580
  404   1HE   LYS  51          2HE       LYS  51  -6.483   7.970   8.437
  405   2HE   LYS  51          1HE       LYS  51  -5.247   6.729   8.639
  406   1HZ   LYS  51          1HZ       LYS  51  -4.121   7.578   6.679
  407   2HZ   LYS  51          2HZ       LYS  51  -4.301   8.801   7.836
  408   3HZ   LYS  51          3HZ       LYS  51  -5.309   8.766   6.478
  409    H    GLU  52           H        GLU  52  -6.311   1.556   5.705
  410    HA   GLU  52           HA       GLU  52  -4.287   0.934   7.488
  411   1HB   GLU  52          2HB       GLU  52  -6.595  -0.229   6.880
  412   2HB   GLU  52          1HB       GLU  52  -5.551  -1.264   5.914
  413   1HG   GLU  52          1HG       GLU  52  -5.927  -2.271   8.063
  414   2HG   GLU  52          2HG       GLU  52  -4.237  -1.792   7.919
  415    H    VAL  53           H        VAL  53  -4.689  -0.478   4.251
  416    HA   VAL  53           HA       VAL  53  -2.186  -1.639   4.008
  417    HB   VAL  53           HB       VAL  53  -3.835  -0.454   1.770
  418   1HG1  VAL  53          1HG2      VAL  53  -1.753  -2.635   1.766
  419   2HG1  VAL  53          2HG2      VAL  53  -1.572  -1.018   1.085
  420   3HG1  VAL  53          3HG2      VAL  53  -2.730  -2.147   0.382
  421   1HG2  VAL  53          1HG1      VAL  53  -5.176  -1.960   3.131
  422   2HG2  VAL  53          2HG1      VAL  53  -3.933  -3.206   3.004
  423   3HG2  VAL  53          3HG1      VAL  53  -4.818  -2.693   1.567
  424    H    LEU  54           H        LEU  54  -3.198   1.687   3.398
  425    HA   LEU  54           HA       LEU  54  -1.055   2.712   2.029
  426   1HB   LEU  54          1HB       LEU  54  -2.935   4.095   2.611
  427   2HB   LEU  54          2HB       LEU  54  -2.587   3.935   4.320
  428    HG   LEU  54           HG       LEU  54  -0.474   5.199   3.973
  429   1HD1  LEU  54          1HD2      LEU  54  -1.561   5.601   1.190
  430   2HD1  LEU  54          2HD2      LEU  54  -0.118   4.683   1.621
  431   3HD1  LEU  54          3HD2      LEU  54  -0.165   6.426   1.883
  432   1HD2  LEU  54          1HD1      LEU  54  -2.491   6.331   4.739
  433   2HD2  LEU  54          2HD1      LEU  54  -2.988   6.596   3.067
  434   3HD2  LEU  54          3HD1      LEU  54  -1.537   7.381   3.692
  435    H    PHE  55           H        PHE  55  -1.212   3.104   5.576
  436    HA   PHE  55           HA       PHE  55   1.577   3.611   5.690
  437   1HB   PHE  55          2HB       PHE  55   1.278   3.674   8.136
  438   2HB   PHE  55          1HB       PHE  55   0.074   4.643   7.298
  439    HD1  PHE  55           1HD      PHE  55  -2.224   4.208   7.528
  440    HD2  PHE  55           2HD      PHE  55   0.626   1.454   9.074
  441    HE1  PHE  55           1HE      PHE  55  -4.018   3.036   8.736
  442    HE2  PHE  55           2HE      PHE  55  -1.163   0.274  10.283
  443    HZ   PHE  55           HZ       PHE  55  -3.489   1.065  10.115
  444    H    TYR  56           H        TYR  56  -0.374   0.748   6.230
  445    HA   TYR  56           HA       TYR  56   1.552  -0.724   7.673
  446   1HB   TYR  56          1HB       TYR  56  -1.060  -1.229   6.506
  447   2HB   TYR  56          2HB       TYR  56   0.012  -2.616   6.346
  448    HD1  TYR  56           1HD      TYR  56  -2.573  -2.154   8.089
  449    HD2  TYR  56           2HD      TYR  56   1.602  -2.109   8.912
  450    HE1  TYR  56           1HE      TYR  56  -3.033  -2.777  10.420
  451    HE2  TYR  56           2HE      TYR  56   1.156  -2.738  11.246
  452    HH   TYR  56           HH       TYR  56  -0.698  -2.592  12.870
  453    H    LEU  57           H        LEU  57   0.645  -0.895   4.224
  454    HA   LEU  57           HA       LEU  57   2.592  -2.731   3.448
  455   1HB   LEU  57          2HB       LEU  57   0.642  -1.278   2.166
  456   2HB   LEU  57          1HB       LEU  57   2.106  -0.564   1.526
  457    HG   LEU  57           HG       LEU  57   1.659  -2.206  -0.032
  458   1HD1  LEU  57          1HD1      LEU  57   3.215  -4.088   0.340
  459   2HD1  LEU  57          2HD1      LEU  57   3.393  -3.576   2.017
  460   3HD1  LEU  57          3HD1      LEU  57   3.929  -2.519   0.712
  461   1HD2  LEU  57          1HD2      LEU  57  -0.250  -3.175   1.107
  462   2HD2  LEU  57          2HD2      LEU  57   0.822  -4.031   2.215
  463   3HD2  LEU  57          3HD2      LEU  57   0.817  -4.440   0.498
  464    H    GLY  58           H        GLY  58   2.731   0.823   3.574
  465   1HA   GLY  58          2HA       GLY  58   5.348   1.275   2.845
  466   2HA   GLY  58          1HA       GLY  58   4.516   2.177   4.105
  467    H    GLN  59           H        GLN  59   4.163   0.193   6.020
  468    HA   GLN  59           HA       GLN  59   6.634   0.044   7.318
  469   1HB   GLN  59          1HB       GLN  59   4.309  -1.853   7.688
  470   2HB   GLN  59          2HB       GLN  59   5.596  -1.534   8.841
  471   1HG   GLN  59          2HG       GLN  59   3.359   0.279   8.005
  472   2HG   GLN  59          1HG       GLN  59   3.713  -0.360   9.608
  473   1HE2  GLN  59          1HE2      GLN  59   4.575   1.999   7.211
  474   2HE2  GLN  59          2HE2      GLN  59   5.559   2.981   8.237
  475    H    TYR  60           H        TYR  60   4.842  -2.712   5.890
  476    HA   TYR  60           HA       TYR  60   6.805  -4.563   6.483
  477   1HB   TYR  60          2HB       TYR  60   4.485  -5.132   5.838
  478   2HB   TYR  60          1HB       TYR  60   4.860  -4.705   4.171
  479    HD1  TYR  60           1HD      TYR  60   6.336  -6.125   2.833
  480    HD2  TYR  60           2HD      TYR  60   5.257  -7.188   6.804
  481    HE1  TYR  60           1HE      TYR  60   7.125  -8.418   2.429
  482    HE2  TYR  60           2HE      TYR  60   6.039  -9.482   6.413
  483    HH   TYR  60           HH       TYR  60   6.425 -10.999   4.511
  484    H    ILE  61           H        ILE  61   6.491  -2.516   3.644
  485    HA   ILE  61           HA       ILE  61   8.543  -3.568   2.061
  486    HB   ILE  61           HB       ILE  61   7.852  -0.650   2.433
  487   1HG1  ILE  61          2HG1      ILE  61   6.829  -2.482   0.271
  488   2HG1  ILE  61          1HG1      ILE  61   5.958  -2.242   1.783
  489   1HG2  ILE  61          1HG2      ILE  61   9.959  -0.904   1.305
  490   2HG2  ILE  61          2HG2      ILE  61   8.737  -0.421   0.130
  491   3HG2  ILE  61          3HG2      ILE  61   9.272  -2.099   0.205
  492   1HD1  ILE  61          1HD1      ILE  61   5.986   0.210   1.286
  493   2HD1  ILE  61          2HD1      ILE  61   5.012  -0.775   0.193
  494   3HD1  ILE  61          3HD1      ILE  61   6.601  -0.197  -0.316
  495    H    MET  62           H        MET  62   8.843  -0.658   4.087
  496    HA   MET  62           HA       MET  62  11.717  -1.029   4.170
  497   1HB   MET  62          1HB       MET  62  11.782   1.168   5.219
  498   2HB   MET  62          2HB       MET  62  10.780   1.200   3.775
  499   1HG   MET  62          2HG       MET  62   8.775   1.083   5.160
  500   2HG   MET  62          1HG       MET  62   9.778   1.044   6.609
  501   1HE   MET  62          1HE       MET  62   7.405   3.144   6.140
  502   2HE   MET  62          2HE       MET  62   8.164   4.614   6.750
  503   3HE   MET  62          3HE       MET  62   8.395   3.086   7.597
  504    H    THR  63           H        THR  63   9.882  -2.858   5.691
  505    HA   THR  63           HA       THR  63  11.064  -2.439   8.357
  506    HB   THR  63           HB       THR  63   8.631  -4.043   7.566
  507    HG1  THR  63           1HG      THR  63   7.970  -2.454   9.443
  508   1HG2  THR  63          1HG2      THR  63   9.953  -3.815  10.275
  509   2HG2  THR  63          2HG2      THR  63   9.895  -5.262   9.268
  510   3HG2  THR  63          3HG2      THR  63   8.407  -4.599   9.946
  511    H    LYS  64           H        LYS  64  10.271  -5.024   6.032
  512    HA   LYS  64           HA       LYS  64  11.888  -6.896   7.533
  513   1HB   LYS  64          2HB       LYS  64  10.318  -7.279   4.979
  514   2HB   LYS  64          1HB       LYS  64  11.053  -8.561   5.932
  515   1HG   LYS  64          2HG       LYS  64   8.903  -6.703   6.931
  516   2HG   LYS  64          1HG       LYS  64   8.622  -8.329   6.300
  517   1HD   LYS  64          2HD       LYS  64  10.359  -7.667   8.679
  518   2HD   LYS  64          1HD       LYS  64   8.697  -8.253   8.770
  519   1HE   LYS  64          2HE       LYS  64  11.011  -9.723   7.514
  520   2HE   LYS  64          1HE       LYS  64  10.326 -10.056   9.104
  521   1HZ   LYS  64          1HZ       LYS  64   9.471 -11.582   7.448
  522   2HZ   LYS  64          2HZ       LYS  64   8.890 -10.296   6.516
  523   3HZ   LYS  64          3HZ       LYS  64   8.223 -10.603   8.040
  524    H    ARG  65           H        ARG  65  13.121  -4.618   6.042
  525    HA   ARG  65           HA       ARG  65  15.037  -4.215   4.890
  526   1HB   ARG  65          2HB       ARG  65  15.820  -5.875   6.630
  527   2HB   ARG  65          1HB       ARG  65  15.681  -7.121   5.396
  528   1HG   ARG  65          2HG       ARG  65  17.312  -5.910   4.014
  529   2HG   ARG  65          1HG       ARG  65  17.476  -4.705   5.292
  530   1HD   ARG  65          2HD       ARG  65  19.287  -6.331   5.391
  531   2HD   ARG  65          1HD       ARG  65  18.267  -6.432   6.826
  532    HE   ARG  65           HE       ARG  65  17.242  -8.293   5.100
  533   1HH1  ARG  65          2HH1      ARG  65  20.355  -7.695   6.548
  534   2HH1  ARG  65          1HH1      ARG  65  20.809  -9.366   6.567
  535   1HH2  ARG  65          1HH2      ARG  65  17.833 -10.494   5.122
  536   2HH2  ARG  65          2HH2      ARG  65  19.376 -10.957   5.757
  537    H    LEU  66           H        LEU  66  12.901  -4.694   3.248
  538    HA   LEU  66           HA       LEU  66  14.039  -6.269   1.049
  539   1HB   LEU  66          1HB       LEU  66  11.309  -5.367   1.761
  540   2HB   LEU  66          2HB       LEU  66  11.693  -5.405   0.052
  541    HG   LEU  66           HG       LEU  66  10.640  -7.475   0.625
  542   1HD1  LEU  66          1HD1      LEU  66  13.613  -7.878   0.350
  543   2HD1  LEU  66          2HD1      LEU  66  12.464  -7.643  -0.968
  544   3HD1  LEU  66          3HD1      LEU  66  12.377  -9.096   0.030
  545   1HD2  LEU  66          1HD2      LEU  66  11.044  -7.428   3.034
  546   2HD2  LEU  66          2HD2      LEU  66  12.745  -7.806   2.754
  547   3HD2  LEU  66          3HD2      LEU  66  11.498  -8.981   2.329
  548    H    TYR  67           H        TYR  67  13.695  -3.075   2.179
  549    HA   TYR  67           HA       TYR  67  13.740  -1.729  -0.335
  550   1HB   TYR  67          1HB       TYR  67  14.178   0.276   0.939
  551   2HB   TYR  67          2HB       TYR  67  12.967  -0.679   1.789
  552    HD1  TYR  67           1HD      TYR  67  13.584  -1.907   3.853
  553    HD2  TYR  67           2HD      TYR  67  16.305   0.727   1.917
  554    HE1  TYR  67           1HE      TYR  67  14.956  -1.837   5.892
  555    HE2  TYR  67           2HE      TYR  67  17.686   0.805   3.946
  556    HH   TYR  67           HH       TYR  67  17.285  -1.359   6.529
  557    H    ASP  68           H        ASP  68  15.665  -0.059  -0.625
  558    HA   ASP  68           HA       ASP  68  17.912  -1.585  -1.374
  559   1HB   ASP  68          2HB       ASP  68  17.401   0.417  -2.594
  560   2HB   ASP  68          1HB       ASP  68  17.510   1.407  -1.140
  561    H    GLU  69           H        GLU  69  18.667   1.312   0.394
  562    HA   GLU  69           HA       GLU  69  19.326   0.348   2.900
  563   1HB   GLU  69          2HB       GLU  69  20.828  -1.216   1.736
  564   2HB   GLU  69          1HB       GLU  69  21.647   0.136   0.970
  565   1HG   GLU  69          2HG       GLU  69  22.938  -0.716   2.832
  566   2HG   GLU  69          1HG       GLU  69  22.393   0.930   3.151
  567    H    LYS  70           H        LYS  70  20.134   2.422   0.219
  568    HA   LYS  70           HA       LYS  70  20.803   4.566   2.132
  569   1HB   LYS  70          1HB       LYS  70  22.191   5.574   0.335
  570   2HB   LYS  70          2HB       LYS  70  22.786   4.008   0.866
  571   1HG   LYS  70          1HG       LYS  70  21.785   2.954  -1.093
  572   2HG   LYS  70          2HG       LYS  70  21.166   4.519  -1.622
  573   1HD   LYS  70          1HD       LYS  70  24.084   3.867  -1.228
  574   2HD   LYS  70          2HD       LYS  70  23.249   3.847  -2.783
  575   1HE   LYS  70          2HE       LYS  70  23.561   6.241  -0.975
  576   2HE   LYS  70          1HE       LYS  70  24.476   5.936  -2.452
  577   1HZ   LYS  70          1HZ       LYS  70  21.535   6.325  -2.295
  578   2HZ   LYS  70          2HZ       LYS  70  22.417   6.041  -3.709
  579   3HZ   LYS  70          3HZ       LYS  70  22.654   7.472  -2.838
  580    H    GLN  71           H        GLN  71  19.437   3.842  -1.061
  581    HA   GLN  71           HA       GLN  71  17.485   5.990  -0.597
  582   1HB   GLN  71          2HB       GLN  71  18.039   4.395  -3.107
  583   2HB   GLN  71          1HB       GLN  71  16.825   5.659  -2.953
  584   1HG   GLN  71          2HG       GLN  71  18.586   7.292  -2.504
  585   2HG   GLN  71          1HG       GLN  71  19.800   6.024  -2.670
  586   1HE2  GLN  71          1HE2      GLN  71  17.513   8.043  -4.329
  587   2HE2  GLN  71          2HE2      GLN  71  18.093   7.737  -5.927
  588    H    GLN  72           H        GLN  72  16.303   4.883   0.991
  589    HA   GLN  72           HA       GLN  72  15.620   2.195   0.963
  590   1HB   GLN  72          2HB       GLN  72  14.157   4.530   2.206
  591   2HB   GLN  72          1HB       GLN  72  13.782   2.845   2.540
  592   1HG   GLN  72          2HG       GLN  72  15.129   3.625   4.315
  593   2HG   GLN  72          1HG       GLN  72  16.140   2.569   3.330
  594   1HE2  GLN  72          2HE2      GLN  72  15.502   5.851   4.289
  595   2HE2  GLN  72          1HE2      GLN  72  16.992   6.517   3.723
  596    H    HIS  73           H        HIS  73  14.424   4.701  -0.996
  597    HA   HIS  73           HA       HIS  73  11.855   3.465  -1.497
  598   1HB   HIS  73          1HB       HIS  73  11.587   5.315  -3.154
  599   2HB   HIS  73          2HB       HIS  73  11.916   5.869  -1.516
  600    HD1  HIS  73           1HD      HIS  73  14.026   7.218  -1.132
  601    HD2  HIS  73           2HD      HIS  73  13.745   5.684  -4.983
  602    HE1  HIS  73           1HE      HIS  73  15.852   8.348  -2.440
  603    HE2  HIS  73           2HE      HIS  73  15.601   7.475  -4.790
  604    H    ILE  74           H        ILE  74  14.697   2.346  -2.279
  605    HA   ILE  74           HA       ILE  74  13.634   1.332  -4.839
  606    HB   ILE  74           HB       ILE  74  16.531   1.118  -4.051
  607   1HG1  ILE  74          2HG1      ILE  74  15.998   3.501  -4.179
  608   2HG1  ILE  74          1HG1      ILE  74  16.980   3.012  -5.557
  609   1HG2  ILE  74          1HG2      ILE  74  15.721  -0.447  -5.733
  610   2HG2  ILE  74          2HG2      ILE  74  16.840   0.715  -6.445
  611   3HG2  ILE  74          3HG2      ILE  74  15.104   0.894  -6.697
  612   1HD1  ILE  74          1HD1      ILE  74  15.175   4.552  -6.175
  613   2HD1  ILE  74          2HD1      ILE  74  13.994   3.370  -5.611
  614   3HD1  ILE  74          3HD1      ILE  74  15.035   2.992  -6.983
  615    H    VAL  75           H        VAL  75  12.459  -0.371  -4.087
  616    HA   VAL  75           HA       VAL  75  13.504  -1.896  -1.837
  617    HB   VAL  75           HB       VAL  75  10.817  -2.375  -3.061
  618   1HG1  VAL  75          1HG1      VAL  75  10.210  -2.866  -0.746
  619   2HG1  VAL  75          2HG1      VAL  75  11.843  -2.447  -0.228
  620   3HG1  VAL  75          3HG1      VAL  75  11.579  -3.843  -1.274
  621   1HG2  VAL  75          1HG2      VAL  75  11.547  -0.069  -1.267
  622   2HG2  VAL  75          2HG2      VAL  75   9.899  -0.592  -1.607
  623   3HG2  VAL  75          3HG2      VAL  75  10.918   0.018  -2.912
  624    H    TYR  76           H        TYR  76  15.005  -3.288  -2.700
  625    HA   TYR  76           HA       TYR  76  14.546  -4.944  -4.949
  626   1HB   TYR  76          1HB       TYR  76  16.396  -5.603  -2.663
  627   2HB   TYR  76          2HB       TYR  76  16.560  -6.047  -4.360
  628    HD1  TYR  76           1HD      TYR  76  15.931  -3.330  -5.556
  629    HD2  TYR  76           2HD      TYR  76  18.454  -4.489  -2.327
  630    HE1  TYR  76           1HE      TYR  76  17.330  -1.342  -5.934
  631    HE2  TYR  76           2HE      TYR  76  19.855  -2.508  -2.704
  632    HH   TYR  76           HH       TYR  76  20.388  -0.948  -4.538
  633    H    CYS  77           H        CYS  77  13.065  -6.485  -5.094
  634    HA   CYS  77           HA       CYS  77  12.594  -8.239  -2.794
  635   1HB   CYS  77          2HB       CYS  77  10.381  -6.901  -4.367
  636   2HB   CYS  77          1HB       CYS  77  10.161  -8.079  -3.076
  637    HG   CYS  77           HG       CYS  77   9.477  -5.675  -1.967
  638    H    SER  78           H        SER  78  13.957  -9.571  -4.249
  639    HA   SER  78           HA       SER  78  12.595 -10.618  -6.605
  640   1HB   SER  78          2HB       SER  78  14.989 -10.122  -6.792
  641   2HB   SER  78          1HB       SER  78  15.333 -11.242  -5.474
  642    HG   SER  78           HG       SER  78  13.859 -12.386  -7.458
  643    H    ASN  79           H        ASN  79  12.591 -11.228  -3.356
  644    HA   ASN  79           HA       ASN  79  11.282 -13.744  -3.671
  645   1HB   ASN  79          2HB       ASN  79  12.833 -15.125  -2.391
  646   2HB   ASN  79          1HB       ASN  79  13.620 -14.497  -3.832
  647   1HD2  ASN  79          1HD2      ASN  79  13.977 -11.829  -2.698
  648   2HD2  ASN  79          2HD2      ASN  79  15.258 -11.969  -1.550
  649    H    ASP  80           H        ASP  80   9.813 -12.133  -2.660
  650    HA   ASP  80           HA       ASP  80   9.813 -12.509   0.217
  651   1HB   ASP  80          1HB       ASP  80  11.098 -10.409  -0.142
  652   2HB   ASP  80          2HB       ASP  80   9.692  -9.722  -0.951
  653    H    LEU  81           H        LEU  81   7.742 -11.535   1.176
  654    HA   LEU  81           HA       LEU  81   5.466 -12.443  -0.173
  655   1HB   LEU  81          2HB       LEU  81   5.852 -10.545   2.125
  656   2HB   LEU  81          1HB       LEU  81   4.254 -10.895   1.495
  657    HG   LEU  81           HG       LEU  81   4.713 -12.262   3.449
  658   1HD1  LEU  81          1HD1      LEU  81   4.743 -13.883   0.910
  659   2HD1  LEU  81          2HD1      LEU  81   3.315 -13.220   1.703
  660   3HD1  LEU  81          3HD1      LEU  81   4.269 -14.470   2.503
  661   1HD2  LEU  81          1HD2      LEU  81   7.057 -13.328   1.886
  662   2HD2  LEU  81          2HD2      LEU  81   6.483 -13.948   3.435
  663   3HD2  LEU  81          3HD2      LEU  81   7.139 -12.316   3.328
  664    H    LEU  82           H        LEU  82   6.845  -9.184   0.092
  665    HA   LEU  82           HA       LEU  82   5.034  -7.784  -1.488
  666   1HB   LEU  82          1HB       LEU  82   7.531  -7.280  -0.369
  667   2HB   LEU  82          2HB       LEU  82   7.799  -7.105  -2.092
  668    HG   LEU  82           HG       LEU  82   7.276  -4.949  -1.181
  669   1HD1  LEU  82          1HD2      LEU  82   6.368  -5.407  -3.385
  670   2HD1  LEU  82          2HD2      LEU  82   5.275  -4.363  -2.476
  671   3HD1  LEU  82          3HD2      LEU  82   4.904  -6.078  -2.665
  672   1HD2  LEU  82          1HD1      LEU  82   4.759  -6.207  -0.099
  673   2HD2  LEU  82          2HD1      LEU  82   5.173  -4.494  -0.025
  674   3HD2  LEU  82          3HD1      LEU  82   6.146  -5.674   0.851
  675    H    GLY  83           H        GLY  83   7.554 -10.054  -2.355
  676   1HA   GLY  83          2HA       GLY  83   7.592  -9.672  -5.137
  677   2HA   GLY  83          1HA       GLY  83   7.975 -11.175  -4.310
  678    H    ASP  84           H        ASP  84   5.501 -11.709  -3.109
  679    HA   ASP  84           HA       ASP  84   3.961 -12.887  -5.105
  680   1HB   ASP  84          2HB       ASP  84   3.054 -11.888  -2.392
  681   2HB   ASP  84          1HB       ASP  84   2.137 -12.979  -3.425
  682    H    LEU  85           H        LEU  85   3.937  -9.619  -3.870
  683    HA   LEU  85           HA       LEU  85   1.578  -8.816  -5.294
  684   1HB   LEU  85          1HB       LEU  85   3.812  -7.187  -4.091
  685   2HB   LEU  85          2HB       LEU  85   2.340  -6.515  -4.761
  686    HG   LEU  85           HG       LEU  85   2.453  -8.398  -2.411
  687   1HD1  LEU  85          1HD2      LEU  85   2.051  -5.410  -2.497
  688   2HD1  LEU  85          2HD2      LEU  85   3.460  -6.255  -1.858
  689   3HD1  LEU  85          3HD2      LEU  85   1.896  -6.429  -1.065
  690   1HD2  LEU  85          1HD1      LEU  85   0.106  -7.741  -2.110
  691   2HD2  LEU  85          2HD1      LEU  85   0.374  -8.563  -3.647
  692   3HD2  LEU  85          3HD1      LEU  85   0.186  -6.810  -3.606
  693    H    PHE  86           H        PHE  86   4.806  -7.422  -5.675
  694    HA   PHE  86           HA       PHE  86   4.125  -6.720  -8.394
  695   1HB   PHE  86          1HB       PHE  86   6.588  -6.120  -6.742
  696   2HB   PHE  86          2HB       PHE  86   6.272  -5.466  -8.346
  697    HD1  PHE  86           1HD      PHE  86   5.527  -3.304  -8.392
  698    HD2  PHE  86           2HD      PHE  86   4.441  -5.783  -5.108
  699    HE1  PHE  86           1HE      PHE  86   4.304  -1.421  -7.374
  700    HE2  PHE  86           2HE      PHE  86   3.215  -3.911  -4.093
  701    HZ   PHE  86           HZ       PHE  86   3.145  -1.728  -5.227
  702    H    GLY  87           H        GLY  87   6.837  -8.443  -6.841
  703   1HA   GLY  87          1HA       GLY  87   8.079 -10.227  -7.720
  704   2HA   GLY  87          2HA       GLY  87   7.211 -10.053  -9.239
  705    H    VAL  88           H        VAL  88   8.003  -7.012  -8.542
  706    HA   VAL  88           HA       VAL  88   9.950  -6.708 -10.509
  707    HB   VAL  88           HB       VAL  88  10.320  -4.473  -9.646
  708   1HG1  VAL  88          1HG2      VAL  88   8.016  -3.639  -9.618
  709   2HG1  VAL  88          2HG2      VAL  88   7.427  -5.286  -9.385
  710   3HG1  VAL  88          3HG2      VAL  88   8.258  -4.850 -10.880
  711   1HG2  VAL  88          1HG1      VAL  88   9.341  -3.725  -7.534
  712   2HG2  VAL  88          2HG1      VAL  88  10.508  -5.022  -7.277
  713   3HG2  VAL  88          3HG1      VAL  88   8.778  -5.365  -7.212
  714    HA   PRO  89           HA       PRO  89  13.836  -7.448  -8.286
  715   1HB   PRO  89          1HB       PRO  89  15.441  -5.708  -9.593
  716   2HB   PRO  89          2HB       PRO  89  14.937  -7.246 -10.304
  717   1HG   PRO  89          2HG       PRO  89  13.842  -4.496 -10.760
  718   2HG   PRO  89          1HG       PRO  89  14.184  -5.773 -11.941
  719   1HD   PRO  89          1HD       PRO  89  11.686  -5.254 -10.999
  720   2HD   PRO  89          2HD       PRO  89  12.209  -6.871 -11.509
  721    H    SER  90           H        SER  90  12.512  -4.245  -8.863
  722    HA   SER  90           HA       SER  90  12.849  -3.518  -6.117
  723   1HB   SER  90          2HB       SER  90  14.203  -1.468  -6.572
  724   2HB   SER  90          1HB       SER  90  15.094  -2.967  -6.823
  725    HG   SER  90           HG       SER  90  13.905  -1.342  -8.822
  726    H    PHE  91           H        PHE  91  11.406  -1.891  -5.531
  727    HA   PHE  91           HA       PHE  91  10.089  -0.463  -7.739
  728   1HB   PHE  91          1HB       PHE  91   7.911  -0.724  -6.736
  729   2HB   PHE  91          2HB       PHE  91   8.626  -2.309  -6.980
  730    HD1  PHE  91           1HD      PHE  91   7.693   0.207  -4.470
  731    HD2  PHE  91           2HD      PHE  91   9.125  -3.742  -5.141
  732    HE1  PHE  91           1HE      PHE  91   7.230  -0.346  -2.126
  733    HE2  PHE  91           2HE      PHE  91   8.673  -4.307  -2.789
  734    HZ   PHE  91           HZ       PHE  91   7.724  -2.608  -1.277
  735    H    SER  92           H        SER  92   9.020   1.538  -7.117
  736    HA   SER  92           HA       SER  92  10.633   2.884  -5.077
  737   1HB   SER  92          1HB       SER  92  10.761   3.795  -7.353
  738   2HB   SER  92          2HB       SER  92   9.015   4.041  -7.360
  739    HG   SER  92           HG       SER  92  11.008   5.427  -5.964
  740    H    VAL  93           H        VAL  93   9.562   2.629  -3.172
  741    HA   VAL  93           HA       VAL  93   6.744   2.909  -2.880
  742    HB   VAL  93           HB       VAL  93   8.244   1.679  -1.282
  743   1HG1  VAL  93          1HG1      VAL  93  10.039   3.303  -1.133
  744   2HG1  VAL  93          2HG1      VAL  93   9.364   2.987   0.466
  745   3HG1  VAL  93          3HG1      VAL  93   8.945   4.470  -0.391
  746   1HG2  VAL  93          1HG2      VAL  93   5.950   2.230  -0.687
  747   2HG2  VAL  93          2HG2      VAL  93   6.465   3.815  -0.108
  748   3HG2  VAL  93          3HG2      VAL  93   7.002   2.355   0.724
  749    H    LYS  94           H        LYS  94   9.304   5.139  -3.215
  750    HA   LYS  94           HA       LYS  94   8.493   7.349  -1.768
  751   1HB   LYS  94          2HB       LYS  94  10.563   7.058  -3.248
  752   2HB   LYS  94          1HB       LYS  94   9.536   7.535  -4.592
  753   1HG   LYS  94          2HG       LYS  94   9.831   9.245  -2.146
  754   2HG   LYS  94          1HG       LYS  94  10.967   9.334  -3.494
  755   1HD   LYS  94          1HD       LYS  94   9.116   9.857  -5.013
  756   2HD   LYS  94          2HD       LYS  94   7.986   9.779  -3.658
  757   1HE   LYS  94          2HE       LYS  94  10.287  11.709  -3.939
  758   2HE   LYS  94          1HE       LYS  94   8.584  12.088  -4.191
  759   1HZ   LYS  94          1HZ       LYS  94   9.312  12.776  -2.001
  760   2HZ   LYS  94          2HZ       LYS  94   9.799  11.199  -1.631
  761   3HZ   LYS  94          3HZ       LYS  94   8.161  11.544  -1.871
  762    H    GLU  95           H        GLU  95   7.530   6.459  -5.082
  763    HA   GLU  95           HA       GLU  95   5.331   8.314  -5.098
  764   1HB   GLU  95          1HB       GLU  95   4.678   7.117  -7.185
  765   2HB   GLU  95          2HB       GLU  95   6.326   7.728  -7.212
  766   1HG   GLU  95          1HG       GLU  95   7.165   5.493  -6.693
  767   2HG   GLU  95          2HG       GLU  95   5.511   4.881  -6.666
  768    H    HIS  96           H        HIS  96   3.079   7.663  -5.211
  769    HA   HIS  96           HA       HIS  96   2.486   5.147  -3.828
  770   1HB   HIS  96          2HB       HIS  96   0.709   6.775  -2.604
  771   2HB   HIS  96          1HB       HIS  96   2.280   6.358  -1.926
  772    HD1  HIS  96           1HD      HIS  96   0.279   9.201  -3.088
  773    HD2  HIS  96           2HD      HIS  96   4.281   8.408  -2.304
  774    HE1  HIS  96           1HE      HIS  96   1.389  11.451  -2.921
  775    HE2  HIS  96           2HE      HIS  96   3.793  10.948  -2.355
  776    H    ARG  97           H        ARG  97   1.480   7.743  -5.909
  777    HA   ARG  97           HA       ARG  97  -1.159   6.947  -6.395
  778   1HB   ARG  97          1HB       ARG  97  -0.739   8.010  -8.691
  779   2HB   ARG  97          2HB       ARG  97  -0.566   9.033  -7.271
  780   1HG   ARG  97          1HG       ARG  97   1.853   8.744  -7.355
  781   2HG   ARG  97          2HG       ARG  97   1.679   7.724  -8.784
  782   1HD   ARG  97          2HD       ARG  97   0.677   9.595  -9.999
  783   2HD   ARG  97          1HD       ARG  97   0.846  10.616  -8.571
  784    HE   ARG  97           HE       ARG  97   3.358   9.559  -9.261
  785   1HH1  ARG  97          2HH1      ARG  97   0.997  11.854 -10.402
  786   2HH1  ARG  97          1HH1      ARG  97   2.165  12.851 -11.204
  787   1HH2  ARG  97          1HH2      ARG  97   4.903  10.865 -10.314
  788   2HH2  ARG  97          2HH2      ARG  97   4.385  12.289 -11.154
  789    H    LYS  98           H        LYS  98   1.724   6.221  -8.371
  790    HA   LYS  98           HA       LYS  98   0.301   4.224  -9.852
  791   1HB   LYS  98          1HB       LYS  98   2.062   5.633 -10.869
  792   2HB   LYS  98          2HB       LYS  98   3.254   4.861  -9.832
  793   1HG   LYS  98          2HG       LYS  98   3.358   3.887 -12.021
  794   2HG   LYS  98          1HG       LYS  98   2.721   2.693 -10.888
  795   1HD   LYS  98          2HD       LYS  98   0.453   3.160 -11.643
  796   2HD   LYS  98          1HD       LYS  98   1.062   4.393 -12.749
  797   1HE   LYS  98          1HE       LYS  98   0.602   2.310 -13.927
  798   2HE   LYS  98          2HE       LYS  98   2.323   2.694 -13.963
  799   1HZ   LYS  98          1HZ       LYS  98   1.028   0.753 -12.126
  800   2HZ   LYS  98          2HZ       LYS  98   2.678   1.117 -12.172
  801   3HZ   LYS  98          3HZ       LYS  98   1.944   0.356 -13.493
  802    H    ILE  99           H        ILE  99   2.606   4.244  -7.210
  803    HA   ILE  99           HA       ILE  99   3.383   1.536  -7.466
  804    HB   ILE  99           HB       ILE  99   4.340   3.654  -6.028
  805   1HG1  ILE  99          2HG1      ILE  99   5.445   1.519  -6.901
  806   2HG1  ILE  99          1HG1      ILE  99   6.100   2.196  -5.413
  807   1HG2  ILE  99          1HG2      ILE  99   2.803   3.498  -4.218
  808   2HG2  ILE  99          2HG2      ILE  99   4.357   2.882  -3.649
  809   3HG2  ILE  99          3HG2      ILE  99   3.063   1.759  -4.071
  810   1HD1  ILE  99          1HD1      ILE  99   4.137  -0.077  -5.547
  811   2HD1  ILE  99          2HD1      ILE  99   4.942   0.547  -4.106
  812   3HD1  ILE  99          3HD1      ILE  99   5.883  -0.251  -5.366
  813    H    TYR 100           H        TYR 100   0.744   3.102  -5.813
  814    HA   TYR 100           HA       TYR 100  -0.016   0.632  -4.485
  815   1HB   TYR 100          2HB       TYR 100  -1.058   3.439  -4.448
  816   2HB   TYR 100          1HB       TYR 100  -2.074   2.118  -3.874
  817    HD1  TYR 100           1HD      TYR 100   1.430   1.571  -3.440
  818    HD2  TYR 100           2HD      TYR 100  -1.981   3.393  -1.665
  819    HE1  TYR 100           1HE      TYR 100   2.581   1.608  -1.282
  820    HE2  TYR 100           2HE      TYR 100  -0.828   3.441   0.507
  821    HH   TYR 100           HH       TYR 100   2.500   2.853   0.835
  822    H    THR 101           H        THR 101  -0.889   2.528  -7.300
  823    HA   THR 101           HA       THR 101  -3.210   1.141  -8.064
  824    HB   THR 101           HB       THR 101  -1.059   2.352  -9.814
  825    HG1  THR 101           1HG      THR 101  -3.236   3.358  -8.415
  826   1HG2  THR 101          1HG2      THR 101  -2.405   0.734 -11.062
  827   2HG2  THR 101          2HG2      THR 101  -2.767   2.381 -11.575
  828   3HG2  THR 101          3HG2      THR 101  -3.881   1.525 -10.509
  829    H    MET 102           H        MET 102   0.192   0.319  -8.283
  830    HA   MET 102           HA       MET 102  -0.237  -2.065  -9.825
  831   1HB   MET 102          1HB       MET 102   2.127  -1.371  -8.074
  832   2HB   MET 102          2HB       MET 102   2.078  -2.586  -9.344
  833   1HG   MET 102          2HG       MET 102   1.645  -0.765 -10.979
  834   2HG   MET 102          1HG       MET 102   1.887   0.386  -9.667
  835   1HE   MET 102          1HE       MET 102   5.610   0.144  -8.831
  836   2HE   MET 102          2HE       MET 102   4.074  -0.144  -8.010
  837   3HE   MET 102          3HE       MET 102   4.293   1.305  -8.991
  838    H    ILE 103           H        ILE 103   0.172  -1.281  -6.395
  839    HA   ILE 103           HA       ILE 103   0.269  -3.846  -5.368
  840    HB   ILE 103           HB       ILE 103  -0.928  -1.343  -4.193
  841   1HG1  ILE 103          2HG1      ILE 103   1.649  -2.862  -3.750
  842   2HG1  ILE 103          1HG1      ILE 103   1.467  -1.257  -4.452
  843   1HG2  ILE 103          1HG2      ILE 103  -0.999  -2.499  -2.035
  844   2HG2  ILE 103          2HG2      ILE 103  -0.530  -4.002  -2.827
  845   3HG2  ILE 103          3HG2      ILE 103  -2.079  -3.251  -3.208
  846   1HD1  ILE 103          1HD1      ILE 103   0.923  -2.026  -1.596
  847   2HD1  ILE 103          2HD1      ILE 103   0.663  -0.424  -2.287
  848   3HD1  ILE 103          3HD1      ILE 103   2.293  -1.093  -2.197
  849    H    TYR 104           H        TYR 104  -2.574  -1.884  -6.177
  850    HA   TYR 104           HA       TYR 104  -4.346  -4.093  -5.490
  851   1HB   TYR 104          2HB       TYR 104  -4.895  -1.262  -6.397
  852   2HB   TYR 104          1HB       TYR 104  -6.157  -2.451  -6.089
  853    HD1  TYR 104           1HD      TYR 104  -3.692  -0.223  -4.580
  854    HD2  TYR 104           2HD      TYR 104  -6.626  -3.205  -3.809
  855    HE1  TYR 104           1HE      TYR 104  -3.694   0.403  -2.201
  856    HE2  TYR 104           2HE      TYR 104  -6.637  -2.588  -1.429
  857    HH   TYR 104           HH       TYR 104  -5.146  -1.502   0.200
  858    H    ARG 105           H        ARG 105  -3.640  -5.537  -7.147
  859    HA   ARG 105           HA       ARG 105  -4.204  -4.787  -9.905
  860   1HB   ARG 105          2HB       ARG 105  -2.153  -6.049  -9.414
  861   2HB   ARG 105          1HB       ARG 105  -3.116  -7.362  -8.751
  862   1HG   ARG 105          1HG       ARG 105  -4.134  -7.718 -10.950
  863   2HG   ARG 105          2HG       ARG 105  -3.140  -6.417 -11.610
  864   1HD   ARG 105          2HD       ARG 105  -2.121  -8.971 -10.372
  865   2HD   ARG 105          1HD       ARG 105  -2.173  -8.606 -12.096
  866    HE   ARG 105           HE       ARG 105  -0.723  -6.579 -10.868
  867   1HH1  ARG 105          2HH1      ARG 105  -0.464 -10.015 -11.385
  868   2HH1  ARG 105          1HH1      ARG 105   1.268 -10.015 -11.386
  869   1HH2  ARG 105          1HH2      ARG 105   1.556  -6.569 -10.867
  870   2HH2  ARG 105          2HH2      ARG 105   2.416  -8.056 -11.091
  871    H    ASN 106           H        ASN 106  -5.525  -6.710  -7.316
  872    HA   ASN 106           HA       ASN 106  -7.416  -8.097  -8.991
  873   1HB   ASN 106          2HB       ASN 106  -7.226  -7.860  -5.980
  874   2HB   ASN 106          1HB       ASN 106  -8.344  -8.916  -6.837
  875   1HD2  ASN 106          2HD2      ASN 106  -7.486 -10.758  -5.911
  876   2HD2  ASN 106          1HD2      ASN 106  -5.942 -11.389  -6.364
  877    H    LEU 107           H        LEU 107  -9.313  -7.344  -9.655
  878    HA   LEU 107           HA       LEU 107 -10.260  -4.786  -8.677
  879   1HB   LEU 107          1HB       LEU 107 -10.226  -5.337 -11.098
  880   2HB   LEU 107          2HB       LEU 107 -11.423  -6.584 -10.806
  881    HG   LEU 107           HG       LEU 107 -12.981  -4.800  -9.986
  882   1HD1  LEU 107          1HD1      LEU 107 -11.310  -3.122  -9.403
  883   2HD1  LEU 107          2HD1      LEU 107 -12.480  -2.481 -10.556
  884   3HD1  LEU 107          3HD1      LEU 107 -10.873  -2.957 -11.104
  885   1HD2  LEU 107          1HD2      LEU 107 -11.962  -4.533 -12.812
  886   2HD2  LEU 107          2HD2      LEU 107 -13.527  -3.965 -12.226
  887   3HD2  LEU 107          3HD2      LEU 107 -13.162  -5.692 -12.239
  888    H    VAL 108           H        VAL 108 -10.659  -5.778  -6.505
  889    HA   VAL 108           HA       VAL 108 -13.476  -6.484  -6.341
  890    HB   VAL 108           HB       VAL 108 -12.471  -8.675  -6.348
  891   1HG1  VAL 108          1HG1      VAL 108 -10.196  -8.053  -5.733
  892   2HG1  VAL 108          2HG1      VAL 108 -10.793  -9.352  -4.701
  893   3HG1  VAL 108          3HG1      VAL 108 -10.727  -7.700  -4.088
  894   1HG2  VAL 108          1HG2      VAL 108 -13.242  -7.852  -3.550
  895   2HG2  VAL 108          2HG2      VAL 108 -13.195  -9.508  -4.154
  896   3HG2  VAL 108          3HG2      VAL 108 -14.342  -8.355  -4.834
  897    H    VAL 109           H        VAL 109 -14.349  -5.098  -4.966
  898    HA   VAL 109           HA       VAL 109 -12.949  -4.413  -2.494
  899    HB   VAL 109           HB       VAL 109 -13.429  -2.000  -2.807
  900   1HG1  VAL 109          1HG1      VAL 109 -11.655  -3.229  -4.913
  901   2HG1  VAL 109          2HG1      VAL 109 -11.199  -2.863  -3.249
  902   3HG1  VAL 109          3HG1      VAL 109 -11.590  -1.554  -4.366
  903   1HG2  VAL 109          1HG2      VAL 109 -13.923  -1.160  -5.058
  904   2HG2  VAL 109          2HG2      VAL 109 -15.221  -2.178  -4.441
  905   3HG2  VAL 109          3HG2      VAL 109 -14.092  -2.817  -5.634
  906    H    VAL 110           H        VAL 110 -14.435  -2.887  -1.154
  907    HA   VAL 110           HA       VAL 110 -17.254  -3.651  -1.526
  908    HB   VAL 110           HB       VAL 110 -15.808  -3.574   1.129
  909   1HG1  VAL 110          1HG2      VAL 110 -17.902  -4.462   2.040
  910   2HG1  VAL 110          2HG2      VAL 110 -18.650  -4.327   0.449
  911   3HG1  VAL 110          3HG2      VAL 110 -18.134  -2.876   1.307
  912   1HG2  VAL 110          1HG1      VAL 110 -16.175  -5.997   1.174
  913   2HG2  VAL 110          2HG1      VAL 110 -15.154  -5.518  -0.182
  914   3HG2  VAL 110          3HG1      VAL 110 -16.849  -5.921  -0.454
  915    H    ASN 111           H        ASN 111 -17.761  -1.624  -2.367
  916    HA   ASN 111           HA       ASN 111 -17.139   0.748  -0.798
  917   1HB   ASN 111          2HB       ASN 111 -18.129   1.988  -2.687
  918   2HB   ASN 111          1HB       ASN 111 -16.871   0.877  -3.224
  919   1HD2  ASN 111          1HD2      ASN 111 -17.441  -0.961  -4.387
  920   2HD2  ASN 111          2HD2      ASN 111 -18.986  -1.124  -5.140
  921    H    GLN 112           H        GLN 112 -18.593   1.950   0.323
  922    HA   GLN 112           HA       GLN 112 -21.226   0.744   0.743
  923   1HB   GLN 112          2HB       GLN 112 -19.770   2.868   2.327
  924   2HB   GLN 112          1HB       GLN 112 -21.326   2.170   2.755
  925   1HG   GLN 112          1HG       GLN 112 -18.792   0.574   2.488
  926   2HG   GLN 112          2HG       GLN 112 -19.374   1.254   4.006
  927   1HE2  GLN 112          2HE2      GLN 112 -19.597  -0.760   4.954
  928   2HE2  GLN 112          1HE2      GLN 112 -20.858  -1.856   4.515
  929    H    GLN 113           H        GLN 113 -23.061   1.677   0.084
  930    HA   GLN 113           HA       GLN 113 -22.885   4.145  -1.432
  931   1HB   GLN 113          2HB       GLN 113 -25.213   3.644  -2.080
  932   2HB   GLN 113          1HB       GLN 113 -24.126   2.301  -2.408
  933   1HG   GLN 113          2HG       GLN 113 -24.898   1.181  -0.378
  934   2HG   GLN 113          1HG       GLN 113 -25.991   2.526  -0.056
  935   1HE2  GLN 113          2HE2      GLN 113 -25.350  -0.234  -2.064
  936   2HE2  GLN 113          1HE2      GLN 113 -26.910  -0.319  -2.799
  937    H    GLU 114           H        GLU 114 -23.250   3.473   1.733
  938    HA   GLU 114           HA       GLU 114 -25.322   5.448   2.281
  939   1HB   GLU 114          2HB       GLU 114 -25.295   3.356   3.579
  940   2HB   GLU 114          1HB       GLU 114 -23.687   3.747   4.173
  941   1HG   GLU 114          2HG       GLU 114 -25.358   4.246   5.846
  942   2HG   GLU 114          1HG       GLU 114 -24.579   5.727   5.292
  943    H    SER 115           H        SER 115 -24.910   7.503   2.768
  944    HA   SER 115           HA       SER 115 -22.429   8.296   4.017
  945   1HB   SER 115          2HB       SER 115 -21.813   9.904   2.243
  946   2HB   SER 115          1HB       SER 115 -21.760   8.240   1.661
  947    HG   SER 115           HG       SER 115 -23.731   8.568   0.641
  948    H    SER 116           H        SER 116 -22.454  10.947   3.770
  949    HA   SER 116           HA       SER 116 -23.414  12.869   4.501
  950   1HB   SER 116          1HB       SER 116 -24.899  12.628   2.573
  951   2HB   SER 116          2HB       SER 116 -25.968  11.582   3.509
  952    HG   SER 116           HG       SER 116 -25.755  14.312   3.495
  953    H    ASP 117           H        ASP 117 -26.238  10.861   5.213
  954    HA   ASP 117           HA       ASP 117 -26.044  11.665   8.004
  955   1HB   ASP 117          1HB       ASP 117 -28.322  10.743   8.204
  956   2HB   ASP 117          2HB       ASP 117 -28.207  11.924   6.901
  957    H    SER 118           H        SER 118 -27.029   9.790   9.507
  958    HA   SER 118           HA       SER 118 -24.956   7.882   9.712
  959   1HB   SER 118          1HB       SER 118 -27.655   7.947  11.086
  960   2HB   SER 118          2HB       SER 118 -26.291   6.936  11.565
  961    HG   SER 118           HG       SER 118 -26.546   8.986  12.721
  962    H    SER 119           H        SER 119 -28.435   7.168   9.404
  963    HA   SER 119           HA       SER 119 -27.788   5.076   7.455
  964   1HB   SER 119          1HB       SER 119 -29.493   4.660   9.923
  965   2HB   SER 119          2HB       SER 119 -29.277   3.486   8.624
  966    HG   SER 119           HG       SER 119 -27.585   2.867   9.685
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1 -24.429  30.505 -31.019
    2   2H    MET   1          2H        MET   1 -22.782  30.206 -31.260
    3   3H    MET   1          3H        MET   1 -23.285  31.679 -30.596
    4    HA   MET   1           HA       MET   1 -24.105  30.573 -28.636
    5   1HB   MET   1          2HB       MET   1 -24.687  28.446 -29.731
    6   2HB   MET   1          1HB       MET   1 -22.979  28.086 -29.943
    7   1HG   MET   1          2HG       MET   1 -22.687  28.024 -27.524
    8   2HG   MET   1          1HG       MET   1 -24.395  28.397 -27.306
    9   1HE   MET   1          1HE       MET   1 -24.169  24.650 -26.181
   10   2HE   MET   1          2HE       MET   1 -24.671  26.279 -25.727
   11   3HE   MET   1          3HE       MET   1 -22.960  25.908 -25.932
   12    H    CYS   2           H        CYS   2 -22.785  30.805 -26.917
   13    HA   CYS   2           HA       CYS   2 -19.980  31.304 -27.465
   14   1HB   CYS   2          2HB       CYS   2 -19.915  32.177 -25.163
   15   2HB   CYS   2          1HB       CYS   2 -21.211  32.913 -26.101
   16    HG   CYS   2           HG       CYS   2 -22.718  32.632 -24.011
   17    H    ASN   3           H        ASN   3 -18.262  30.202 -26.600
   18    HA   ASN   3           HA       ASN   3 -18.835  27.491 -25.725
   19   1HB   ASN   3          2HB       ASN   3 -16.210  28.837 -26.404
   20   2HB   ASN   3          1HB       ASN   3 -16.407  27.126 -26.034
   21   1HD2  ASN   3          2HD2      ASN   3 -16.987  29.644 -28.353
   22   2HD2  ASN   3          1HD2      ASN   3 -17.384  28.610 -29.678
   23    H    THR   4           H        THR   4 -19.600  29.261 -23.799
   24    HA   THR   4           HA       THR   4 -17.653  29.890 -21.866
   25    HB   THR   4           HB       THR   4 -20.596  29.341 -21.425
   26    HG1  THR   4           1HG      THR   4 -19.489  31.224 -22.852
   27   1HG2  THR   4          1HG2      THR   4 -19.312  29.332 -19.345
   28   2HG2  THR   4          2HG2      THR   4 -20.332  30.768 -19.446
   29   3HG2  THR   4          3HG2      THR   4 -18.602  30.892 -19.766
   30    H    ASN   5           H        ASN   5 -16.653  28.705 -20.363
   31    HA   ASN   5           HA       ASN   5 -16.863  25.876 -20.380
   32   1HB   ASN   5          1HB       ASN   5 -15.217  25.937 -18.563
   33   2HB   ASN   5          2HB       ASN   5 -14.755  27.027 -19.868
   34   1HD2  ASN   5          1HD2      ASN   5 -13.989  27.036 -17.055
   35   2HD2  ASN   5          2HD2      ASN   5 -14.443  28.585 -16.442
   36    H    MET   6           H        MET   6 -17.183  24.579 -18.352
   37    HA   MET   6           HA       MET   6 -19.813  24.901 -17.462
   38   1HB   MET   6          1HB       MET   6 -17.587  23.269 -16.229
   39   2HB   MET   6          2HB       MET   6 -19.297  23.091 -15.861
   40   1HG   MET   6          2HG       MET   6 -19.726  22.464 -18.187
   41   2HG   MET   6          1HG       MET   6 -18.006  22.623 -18.538
   42   1HE   MET   6          1HE       MET   6 -19.660  21.181 -15.271
   43   2HE   MET   6          2HE       MET   6 -19.751  19.463 -15.662
   44   3HE   MET   6          3HE       MET   6 -20.737  20.623 -16.551
   45    H    SER   7           H        SER   7 -17.069  24.797 -15.206
   46    HA   SER   7           HA       SER   7 -17.625  27.332 -14.038
   47   1HB   SER   7          2HB       SER   7 -19.573  26.143 -13.151
   48   2HB   SER   7          1HB       SER   7 -18.523  24.885 -12.498
   49    HG   SER   7           HG       SER   7 -17.610  26.436 -11.125
   50    H    VAL   8           H        VAL   8 -16.612  24.175 -12.721
   51    HA   VAL   8           HA       VAL   8 -14.019  25.407 -12.054
   52    HB   VAL   8           HB       VAL   8 -15.232  24.859 -10.038
   53   1HG1  VAL   8          1HG2      VAL   8 -15.410  22.052 -11.126
   54   2HG1  VAL   8          2HG2      VAL   8 -16.749  23.185 -10.937
   55   3HG1  VAL   8          3HG2      VAL   8 -15.913  22.565  -9.515
   56   1HG2  VAL   8          1HG1      VAL   8 -13.634  23.345  -8.967
   57   2HG2  VAL   8          2HG1      VAL   8 -12.822  24.521  -9.999
   58   3HG2  VAL   8          3HG1      VAL   8 -13.034  22.860 -10.552
   59    HA   PRO   9           HA       PRO   9 -12.404  22.332 -14.848
   60   1HB   PRO   9          1HB       PRO   9  -9.803  22.973 -14.643
   61   2HB   PRO   9          2HB       PRO   9 -10.956  24.015 -15.484
   62   1HG   PRO   9          2HG       PRO   9  -9.845  24.264 -12.714
   63   2HG   PRO   9          1HG       PRO   9 -10.098  25.524 -13.933
   64   1HD   PRO   9          2HD       PRO   9 -11.814  25.060 -11.854
   65   2HD   PRO   9          1HD       PRO   9 -12.315  25.762 -13.404
   66    H    THR  10           H        THR  10 -11.984  22.452 -11.505
   67    HA   THR  10           HA       THR  10 -11.406  20.908  -9.939
   68    HB   THR  10           HB       THR  10 -11.330  18.817 -12.107
   69    HG1  THR  10           1HG      THR  10 -13.569  18.725 -11.993
   70   1HG2  THR  10          1HG2      THR  10 -12.239  17.389 -10.330
   71   2HG2  THR  10          2HG2      THR  10 -12.223  18.759  -9.220
   72   3HG2  THR  10          3HG2      THR  10 -10.705  18.115  -9.846
   73    H    ASP  11           H        ASP  11  -9.351  22.213 -11.784
   74    HA   ASP  11           HA       ASP  11  -7.169  20.428 -12.046
   75   1HB   ASP  11          1HB       ASP  11  -7.201  23.449 -11.872
   76   2HB   ASP  11          2HB       ASP  11  -5.813  22.481 -12.361
   77    H    GLY  12           H        GLY  12  -5.026  20.859 -10.912
   78   1HA   GLY  12          1HA       GLY  12  -5.064  21.914  -8.260
   79   2HA   GLY  12          2HA       GLY  12  -5.171  20.160  -8.249
   80    H    ALA  13           H        ALA  13  -3.185  19.781  -7.334
   81    HA   ALA  13           HA       ALA  13  -0.780  21.027  -8.153
   82   1HB   ALA  13          1HB       ALA  13   0.339  19.319  -6.827
   83   2HB   ALA  13          2HB       ALA  13  -1.158  18.393  -6.734
   84   3HB   ALA  13          3HB       ALA  13  -1.049  19.974  -5.960
   85    H    VAL  14           H        VAL  14   0.621  20.571  -9.737
   86    HA   VAL  14           HA       VAL  14  -0.128  18.696 -11.774
   87    HB   VAL  14           HB       VAL  14   2.399  20.338 -11.534
   88   1HG1  VAL  14          1HG1      VAL  14   2.653  18.471 -13.070
   89   2HG1  VAL  14          2HG1      VAL  14   2.580  19.994 -13.958
   90   3HG1  VAL  14          3HG1      VAL  14   1.171  18.935 -13.906
   91   1HG2  VAL  14          1HG2      VAL  14  -0.177  20.930 -12.989
   92   2HG2  VAL  14          2HG2      VAL  14   1.296  21.899 -13.070
   93   3HG2  VAL  14          3HG2      VAL  14   0.419  21.752 -11.546
   94    H    THR  15           H        THR  15   2.268  18.831  -9.214
   95    HA   THR  15           HA       THR  15   3.343  16.232 -10.050
   96    HB   THR  15           HB       THR  15   5.048  17.895  -9.635
   97    HG1  THR  15           1HG      THR  15   6.178  16.750  -7.927
   98   1HG2  THR  15          1HG2      THR  15   3.795  19.353  -8.130
   99   2HG2  THR  15          2HG2      THR  15   5.345  18.904  -7.419
  100   3HG2  THR  15          3HG2      THR  15   3.864  18.123  -6.868
  101    H    THR  16           H        THR  16   3.298  14.443  -8.724
  102    HA   THR  16           HA       THR  16   1.583  14.667  -6.335
  103    HB   THR  16           HB       THR  16   0.760  12.394  -6.803
  104    HG1  THR  16           1HG      THR  16   2.400  12.674  -9.110
  105   1HG2  THR  16          1HG2      THR  16  -0.521  14.309  -7.622
  106   2HG2  THR  16          2HG2      THR  16  -0.652  12.946  -8.733
  107   3HG2  THR  16          3HG2      THR  16   0.409  14.302  -9.120
  108    H    SER  17           H        SER  17   2.013  13.236  -4.603
  109    HA   SER  17           HA       SER  17   4.531  11.745  -4.714
  110   1HB   SER  17          1HB       SER  17   5.105  13.942  -3.779
  111   2HB   SER  17          2HB       SER  17   3.849  13.759  -2.556
  112    HG   SER  17           HG       SER  17   6.335  12.507  -2.766
  113    H    GLN  18           H        GLN  18   1.339  11.729  -4.098
  114    HA   GLN  18           HA       GLN  18   1.485   9.274  -2.578
  115   1HB   GLN  18          1HB       GLN  18  -0.243  10.131  -0.948
  116   2HB   GLN  18          2HB       GLN  18   1.406  10.682  -0.688
  117   1HG   GLN  18          1HG       GLN  18   0.831  12.796  -1.822
  118   2HG   GLN  18          2HG       GLN  18  -0.819  12.198  -2.035
  119   1HE2  GLN  18          2HE2      GLN  18   0.166  14.558  -0.611
  120   2HE2  GLN  18          1HE2      GLN  18  -0.402  14.405   1.014
  121    H    ILE  19           H        ILE  19  -1.257   9.516  -1.688
  122    HA   ILE  19           HA       ILE  19  -2.722  10.360  -4.017
  123    HB   ILE  19           HB       ILE  19  -3.815   8.422  -4.471
  124   1HG1  ILE  19          2HG1      ILE  19  -3.421   7.459  -1.626
  125   2HG1  ILE  19          1HG1      ILE  19  -4.841   8.344  -2.176
  126   1HG2  ILE  19          1HG2      ILE  19  -2.259   6.423  -3.765
  127   2HG2  ILE  19          2HG2      ILE  19  -1.188   7.735  -3.246
  128   3HG2  ILE  19          3HG2      ILE  19  -1.719   7.633  -4.929
  129   1HD1  ILE  19          1HD1      ILE  19  -5.340   6.549  -3.754
  130   2HD1  ILE  19          2HD1      ILE  19  -5.284   5.970  -2.088
  131   3HD1  ILE  19          3HD1      ILE  19  -3.931   5.659  -3.176
  132    HA   PRO  20           HA       PRO  20  -5.438  12.356  -1.208
  133   1HB   PRO  20          1HB       PRO  20  -7.724  11.326  -2.782
  134   2HB   PRO  20          2HB       PRO  20  -7.256  12.992  -2.437
  135   1HG   PRO  20          1HG       PRO  20  -6.908  11.930  -4.867
  136   2HG   PRO  20          2HG       PRO  20  -5.731  13.064  -4.177
  137   1HD   PRO  20          2HD       PRO  20  -5.581  10.083  -4.413
  138   2HD   PRO  20          1HD       PRO  20  -4.306  11.297  -4.631
  139    H    ALA  21           H        ALA  21  -6.032  11.712   0.758
  140    HA   ALA  21           HA       ALA  21  -6.720   8.983   1.309
  141   1HB   ALA  21          1HB       ALA  21  -5.386  10.305   2.878
  142   2HB   ALA  21          2HB       ALA  21  -6.859   9.699   3.636
  143   3HB   ALA  21          3HB       ALA  21  -6.756  11.386   3.132
  144    H    SER  22           H        SER  22  -8.673   8.194   2.160
  145    HA   SER  22           HA       SER  22 -10.927   7.953   2.299
  146   1HB   SER  22          2HB       SER  22 -10.864  10.959   2.662
  147   2HB   SER  22          1HB       SER  22 -12.255   9.925   2.988
  148    HG   SER  22           HG       SER  22 -11.182  10.232   4.907
  149    H    GLU  23           H        GLU  23  -9.474   8.956  -0.282
  150    HA   GLU  23           HA       GLU  23 -11.935   9.553  -1.785
  151   1HB   GLU  23          1HB       GLU  23  -9.044  10.028  -2.531
  152   2HB   GLU  23          2HB       GLU  23 -10.413  10.329  -3.595
  153   1HG   GLU  23          2HG       GLU  23  -9.902  11.685  -0.955
  154   2HG   GLU  23          1HG       GLU  23  -9.613  12.378  -2.551
  155    H    GLN  24           H        GLN  24  -8.812   7.997  -2.555
  156    HA   GLN  24           HA       GLN  24 -10.281   5.777  -3.780
  157   1HB   GLN  24          1HB       GLN  24  -7.330   6.441  -3.828
  158   2HB   GLN  24          2HB       GLN  24  -8.080   5.092  -4.671
  159   1HG   GLN  24          1HG       GLN  24  -9.389   6.654  -6.014
  160   2HG   GLN  24          2HG       GLN  24  -8.644   8.009  -5.165
  161   1HE2  GLN  24          1HE2      GLN  24  -7.774   8.858  -7.043
  162   2HE2  GLN  24          2HE2      GLN  24  -6.436   8.129  -7.858
  163    H    GLU  25           H        GLU  25 -10.892   5.355  -1.403
  164    HA   GLU  25           HA       GLU  25  -8.794   4.288   0.263
  165   1HB   GLU  25          1HB       GLU  25 -10.598   5.544   1.300
  166   2HB   GLU  25          2HB       GLU  25 -11.785   4.408   0.672
  167   1HG   GLU  25          1HG       GLU  25 -10.685   2.619   2.011
  168   2HG   GLU  25          2HG       GLU  25  -9.659   3.864   2.728
  169    H    THR  26           H        THR  26 -11.909   2.883  -0.791
  170    HA   THR  26           HA       THR  26 -12.495   0.735  -1.308
  171    HB   THR  26           HB       THR  26  -9.539   0.136  -1.467
  172    HG1  THR  26           1HG      THR  26 -10.704   1.814  -2.953
  173   1HG2  THR  26          1HG2      THR  26 -10.242  -1.736  -2.873
  174   2HG2  THR  26          2HG2      THR  26 -11.932  -1.282  -2.647
  175   3HG2  THR  26          3HG2      THR  26 -10.977  -1.841  -1.273
  176    H    LEU  27           H        LEU  27 -13.408  -0.229   0.404
  177    HA   LEU  27           HA       LEU  27 -11.911  -0.581   2.824
  178   1HB   LEU  27          1HB       LEU  27 -14.566  -0.249   2.335
  179   2HB   LEU  27          2HB       LEU  27 -14.484  -1.985   2.585
  180    HG   LEU  27           HG       LEU  27 -14.932  -1.082   4.720
  181   1HD1  LEU  27          1HD1      LEU  27 -12.896  -1.556   5.998
  182   2HD1  LEU  27          2HD1      LEU  27 -11.947  -1.470   4.509
  183   3HD1  LEU  27          3HD1      LEU  27 -13.144  -2.753   4.724
  184   1HD2  LEU  27          1HD2      LEU  27 -12.694   0.887   4.244
  185   2HD2  LEU  27          2HD2      LEU  27 -13.713   0.786   5.682
  186   3HD2  LEU  27          3HD2      LEU  27 -14.417   1.259   4.135
  187    H    VAL  28           H        VAL  28 -10.245  -1.906   2.069
  188    HA   VAL  28           HA       VAL  28 -10.639  -3.704   0.033
  189    HB   VAL  28           HB       VAL  28  -8.400  -3.336   1.983
  190   1HG1  VAL  28          1HG2      VAL  28  -8.394  -5.289  -0.319
  191   2HG1  VAL  28          2HG2      VAL  28  -8.493  -5.744   1.384
  192   3HG1  VAL  28          3HG2      VAL  28  -7.051  -4.930   0.768
  193   1HG2  VAL  28          1HG1      VAL  28  -8.568  -2.978  -0.990
  194   2HG2  VAL  28          2HG1      VAL  28  -7.298  -2.399   0.088
  195   3HG2  VAL  28          3HG1      VAL  28  -8.921  -1.703   0.175
  196    H    ARG  29           H        ARG  29 -10.632  -5.919  -0.133
  197    HA   ARG  29           HA       ARG  29 -11.086  -7.320   2.373
  198   1HB   ARG  29          1HB       ARG  29 -12.503  -8.007  -0.195
  199   2HB   ARG  29          2HB       ARG  29 -12.840  -8.635   1.412
  200   1HG   ARG  29          2HG       ARG  29 -13.578  -6.407   2.123
  201   2HG   ARG  29          1HG       ARG  29 -13.260  -5.787   0.501
  202   1HD   ARG  29          1HD       ARG  29 -15.627  -6.277   0.795
  203   2HD   ARG  29          2HD       ARG  29 -14.911  -7.342  -0.415
  204    HE   ARG  29           HE       ARG  29 -14.802  -8.646   2.048
  205   1HH1  ARG  29          2HH1      ARG  29 -17.191  -7.516  -0.224
  206   2HH1  ARG  29          1HH1      ARG  29 -18.350  -8.731   0.195
  207   1HH2  ARG  29          1HH2      ARG  29 -16.324 -10.249   2.606
  208   2HH2  ARG  29          2HH2      ARG  29 -17.859 -10.284   1.805
  209    HA   PRO  30           HA       PRO  30  -7.439  -9.541   1.779
  210   1HB   PRO  30          1HB       PRO  30  -8.885 -12.051   2.177
  211   2HB   PRO  30          2HB       PRO  30  -7.670 -11.284   3.199
  212   1HG   PRO  30          1HG       PRO  30 -10.582 -11.183   3.405
  213   2HG   PRO  30          2HG       PRO  30  -9.360 -10.694   4.592
  214   1HD   PRO  30          2HD       PRO  30 -10.936  -8.900   3.314
  215   2HD   PRO  30          1HD       PRO  30  -9.266  -8.528   3.790
  216    H    LYS  31           H        LYS  31  -7.263  -9.128  -0.511
  217    HA   LYS  31           HA       LYS  31  -7.601 -11.614  -2.031
  218   1HB   LYS  31          1HB       LYS  31  -7.993  -9.512  -3.253
  219   2HB   LYS  31          2HB       LYS  31  -6.368  -8.974  -2.852
  220   1HG   LYS  31          1HG       LYS  31  -5.434 -10.828  -4.142
  221   2HG   LYS  31          2HG       LYS  31  -7.066 -11.365  -4.545
  222   1HD   LYS  31          2HD       LYS  31  -7.486  -9.231  -5.676
  223   2HD   LYS  31          1HD       LYS  31  -5.846  -8.705  -5.282
  224   1HE   LYS  31          1HE       LYS  31  -5.970  -9.515  -7.575
  225   2HE   LYS  31          2HE       LYS  31  -4.934 -10.552  -6.595
  226   1HZ   LYS  31          1HZ       LYS  31  -6.766 -12.115  -6.379
  227   2HZ   LYS  31          2HZ       LYS  31  -6.394 -11.850  -8.007
  228   3HZ   LYS  31          3HZ       LYS  31  -7.757 -11.120  -7.323
  229    HA   PRO  32           HA       PRO  32  -4.136 -12.470   0.698
  230   1HB   PRO  32          2HB       PRO  32  -3.966 -14.868  -1.085
  231   2HB   PRO  32          1HB       PRO  32  -3.887 -14.772   0.679
  232   1HG   PRO  32          2HG       PRO  32  -6.122 -15.554  -0.536
  233   2HG   PRO  32          1HG       PRO  32  -6.183 -14.513   0.898
  234   1HD   PRO  32          2HD       PRO  32  -6.685 -13.841  -1.952
  235   2HD   PRO  32          1HD       PRO  32  -7.365 -13.117  -0.482
  236    H    LEU  33           H        LEU  33  -2.832 -10.752  -0.182
  237    HA   LEU  33           HA       LEU  33  -0.469 -11.831  -1.432
  238   1HB   LEU  33          1HB       LEU  33  -2.156  -9.749  -2.784
  239   2HB   LEU  33          2HB       LEU  33  -0.427  -9.828  -3.061
  240    HG   LEU  33           HG       LEU  33  -2.397 -12.045  -3.638
  241   1HD1  LEU  33          1HD2      LEU  33  -1.933 -11.550  -5.981
  242   2HD1  LEU  33          2HD2      LEU  33  -0.900 -10.205  -5.499
  243   3HD1  LEU  33          3HD2      LEU  33  -2.630 -10.151  -5.162
  244   1HD2  LEU  33          1HD1      LEU  33  -0.506 -13.138  -4.741
  245   2HD2  LEU  33          2HD1      LEU  33  -0.207 -12.909  -3.019
  246   3HD2  LEU  33          3HD1      LEU  33   0.559 -11.842  -4.196
  247    H    LEU  34           H        LEU  34  -2.137  -9.404   0.354
  248    HA   LEU  34           HA       LEU  34   0.415  -8.047   0.923
  249   1HB   LEU  34          1HB       LEU  34  -2.375  -6.892   0.919
  250   2HB   LEU  34          2HB       LEU  34  -0.919  -6.026   1.373
  251    HG   LEU  34           HG       LEU  34  -0.824  -7.228  -1.305
  252   1HD1  LEU  34          1HD1      LEU  34  -2.731  -4.968  -0.724
  253   2HD1  LEU  34          2HD1      LEU  34  -3.182  -6.599  -1.222
  254   3HD1  LEU  34          3HD1      LEU  34  -2.275  -5.560  -2.322
  255   1HD2  LEU  34          1HD2      LEU  34   0.869  -5.708  -0.311
  256   2HD2  LEU  34          2HD2      LEU  34  -0.339  -4.420  -0.332
  257   3HD2  LEU  34          3HD2      LEU  34   0.211  -5.138  -1.847
  258    H    LEU  35           H        LEU  35  -1.968 -10.016   2.060
  259    HA   LEU  35           HA       LEU  35  -2.082  -8.848   4.714
  260   1HB   LEU  35          1HB       LEU  35  -3.612 -11.257   3.802
  261   2HB   LEU  35          2HB       LEU  35  -4.014 -10.124   5.082
  262    HG   LEU  35           HG       LEU  35  -4.010  -8.455   2.954
  263   1HD1  LEU  35          1HD2      LEU  35  -5.102  -9.544   1.083
  264   2HD1  LEU  35          2HD2      LEU  35  -5.007 -11.098   1.910
  265   3HD1  LEU  35          3HD2      LEU  35  -3.530 -10.284   1.392
  266   1HD2  LEU  35          1HD1      LEU  35  -6.316  -8.374   3.188
  267   2HD2  LEU  35          2HD1      LEU  35  -5.756  -8.979   4.748
  268   3HD2  LEU  35          3HD1      LEU  35  -6.437 -10.095   3.562
  269    H    LYS  36           H        LYS  36  -1.055 -11.780   3.050
  270    HA   LYS  36           HA       LYS  36   0.384 -12.835   5.272
  271   1HB   LYS  36          1HB       LYS  36   0.757 -13.028   2.286
  272   2HB   LYS  36          2HB       LYS  36   1.843 -13.806   3.424
  273   1HG   LYS  36          1HG       LYS  36  -0.018 -15.104   4.323
  274   2HG   LYS  36          2HG       LYS  36  -1.116 -14.309   3.193
  275   1HD   LYS  36          2HD       LYS  36  -0.517 -16.474   2.320
  276   2HD   LYS  36          1HD       LYS  36   0.218 -15.221   1.317
  277   1HE   LYS  36          1HE       LYS  36   1.788 -17.038   1.745
  278   2HE   LYS  36          2HE       LYS  36   2.345 -15.532   2.474
  279   1HZ   LYS  36          1HZ       LYS  36   2.636 -17.389   3.980
  280   2HZ   LYS  36          2HZ       LYS  36   0.985 -17.750   3.906
  281   3HZ   LYS  36          3HZ       LYS  36   1.502 -16.301   4.608
  282    H    LEU  37           H        LEU  37   0.566  -9.957   3.583
  283    HA   LEU  37           HA       LEU  37   3.424  -9.600   4.132
  284   1HB   LEU  37          1HB       LEU  37   2.724  -9.283   1.803
  285   2HB   LEU  37          2HB       LEU  37   1.544  -8.085   2.311
  286    HG   LEU  37           HG       LEU  37   4.250  -7.426   3.170
  287   1HD1  LEU  37          1HD2      LEU  37   4.853  -8.552   1.092
  288   2HD1  LEU  37          2HD2      LEU  37   5.057  -6.807   0.945
  289   3HD1  LEU  37          3HD2      LEU  37   3.659  -7.595   0.217
  290   1HD2  LEU  37          1HD1      LEU  37   1.887  -6.174   2.815
  291   2HD2  LEU  37          2HD1      LEU  37   2.734  -5.722   1.329
  292   3HD2  LEU  37          3HD1      LEU  37   3.448  -5.351   2.901
  293    H    LEU  38           H        LEU  38   0.461  -9.020   5.441
  294    HA   LEU  38           HA       LEU  38   1.352  -6.551   6.776
  295   1HB   LEU  38          1HB       LEU  38  -1.114  -7.144   5.340
  296   2HB   LEU  38          2HB       LEU  38  -1.404  -6.539   6.958
  297    HG   LEU  38           HG       LEU  38  -0.379  -4.471   6.497
  298   1HD1  LEU  38          1HD1      LEU  38   0.902  -4.008   4.465
  299   2HD1  LEU  38          2HD1      LEU  38   0.711  -5.688   3.961
  300   3HD1  LEU  38          3HD1      LEU  38   1.638  -5.302   5.411
  301   1HD2  LEU  38          1HD2      LEU  38  -1.677  -5.176   3.881
  302   2HD2  LEU  38          2HD2      LEU  38  -1.634  -3.608   4.697
  303   3HD2  LEU  38          3HD2      LEU  38  -2.590  -4.930   5.372
  304    H    LYS  39           H        LYS  39  -1.042  -9.185   7.122
  305    HA   LYS  39           HA       LYS  39  -1.336  -9.104   9.875
  306   1HB   LYS  39          1HB       LYS  39  -1.323 -11.557   8.106
  307   2HB   LYS  39          2HB       LYS  39  -1.993 -11.471   9.729
  308   1HG   LYS  39          2HG       LYS  39  -3.651  -9.863   8.987
  309   2HG   LYS  39          1HG       LYS  39  -2.955  -9.872   7.366
  310   1HD   LYS  39          2HD       LYS  39  -3.488 -12.258   7.160
  311   2HD   LYS  39          1HD       LYS  39  -4.209 -12.228   8.771
  312   1HE   LYS  39          1HE       LYS  39  -5.848 -10.577   7.998
  313   2HE   LYS  39          2HE       LYS  39  -5.133 -10.628   6.388
  314   1HZ   LYS  39          1HZ       LYS  39  -5.732 -12.961   6.230
  315   2HZ   LYS  39          2HZ       LYS  39  -7.103 -12.017   6.529
  316   3HZ   LYS  39          3HZ       LYS  39  -6.411 -12.919   7.781
  317    H    SER  40           H        SER  40   1.383  -9.999   8.015
  318    HA   SER  40           HA       SER  40   2.711 -11.518  10.064
  319   1HB   SER  40          2HB       SER  40   3.804 -10.185   7.575
  320   2HB   SER  40          1HB       SER  40   4.701 -11.298   8.608
  321    HG   SER  40           HG       SER  40   3.630 -12.935   7.794
  322    H    VAL  41           H        VAL  41   3.074  -8.206   8.773
  323    HA   VAL  41           HA       VAL  41   5.186  -7.528  10.523
  324    HB   VAL  41           HB       VAL  41   5.133  -6.216   8.607
  325   1HG1  VAL  41          1HG1      VAL  41   3.186  -5.000   7.782
  326   2HG1  VAL  41          2HG1      VAL  41   2.224  -5.623   9.126
  327   3HG1  VAL  41          3HG1      VAL  41   2.858  -6.729   7.906
  328   1HG2  VAL  41          1HG2      VAL  41   5.461  -4.909  10.721
  329   2HG2  VAL  41          2HG2      VAL  41   3.777  -4.398  10.585
  330   3HG2  VAL  41          3HG2      VAL  41   4.937  -3.964   9.329
  331    H    GLY  42           H        GLY  42   1.681  -7.083  10.732
  332   1HA   GLY  42          2HA       GLY  42   1.455  -7.359  13.415
  333   2HA   GLY  42          1HA       GLY  42   1.870  -5.661  13.242
  334    H    ALA  43           H        ALA  43   0.009  -7.167  10.750
  335    HA   ALA  43           HA       ALA  43  -2.276  -5.506  11.397
  336   1HB   ALA  43          1HB       ALA  43  -3.204  -6.336   9.280
  337   2HB   ALA  43          2HB       ALA  43  -1.838  -7.439   9.123
  338   3HB   ALA  43          3HB       ALA  43  -1.574  -5.696   9.076
  339    H    GLN  44           H        GLN  44  -4.435  -6.338  11.659
  340    HA   GLN  44           HA       GLN  44  -4.408  -8.972  12.982
  341   1HB   GLN  44          1HB       GLN  44  -4.331  -7.137  14.617
  342   2HB   GLN  44          2HB       GLN  44  -5.801  -6.463  13.928
  343   1HG   GLN  44          1HG       GLN  44  -7.027  -8.474  14.575
  344   2HG   GLN  44          2HG       GLN  44  -5.552  -9.145  15.272
  345   1HE2  GLN  44          2HE2      GLN  44  -6.446  -9.283  17.321
  346   2HE2  GLN  44          1HE2      GLN  44  -6.738  -7.890  18.299
  347    H    LYS  45           H        LYS  45  -6.657  -6.460  11.782
  348    HA   LYS  45           HA       LYS  45  -8.940  -8.043  11.953
  349   1HB   LYS  45          2HB       LYS  45  -8.646  -5.907   9.859
  350   2HB   LYS  45          1HB       LYS  45 -10.077  -6.359  10.774
  351   1HG   LYS  45          1HG       LYS  45  -9.108  -5.421  12.798
  352   2HG   LYS  45          2HG       LYS  45  -7.648  -4.988  11.907
  353   1HD   LYS  45          1HD       LYS  45 -10.415  -3.962  11.280
  354   2HD   LYS  45          2HD       LYS  45  -9.203  -3.084  12.215
  355   1HE   LYS  45          2HE       LYS  45  -7.695  -3.118  10.287
  356   2HE   LYS  45          1HE       LYS  45  -8.911  -3.988   9.353
  357   1HZ   LYS  45          1HZ       LYS  45 -10.394  -2.092   9.592
  358   2HZ   LYS  45          2HZ       LYS  45  -8.945  -1.629   8.855
  359   3HZ   LYS  45          3HZ       LYS  45  -9.220  -1.257  10.481
  360    H    ASP  46           H        ASP  46 -10.339  -8.696  10.075
  361    HA   ASP  46           HA       ASP  46  -8.894 -10.408   8.284
  362   1HB   ASP  46          1HB       ASP  46 -11.837  -9.702   8.375
  363   2HB   ASP  46          2HB       ASP  46 -11.128 -10.989   7.406
  364    H    THR  47           H        THR  47 -10.679  -7.369   8.012
  365    HA   THR  47           HA       THR  47  -9.948  -7.198   5.173
  366    HB   THR  47           HB       THR  47 -11.493  -5.100   5.337
  367    HG1  THR  47           1HG      THR  47 -12.861  -6.491   7.320
  368   1HG2  THR  47          1HG2      THR  47 -12.008  -7.171   4.086
  369   2HG2  THR  47          2HG2      THR  47 -13.436  -6.438   4.818
  370   3HG2  THR  47          3HG2      THR  47 -12.695  -7.859   5.560
  371    H    TYR  48           H        TYR  48  -9.896  -4.621   4.654
  372    HA   TYR  48           HA       TYR  48  -8.033  -3.268   6.416
  373   1HB   TYR  48          2HB       TYR  48  -7.259  -4.392   3.730
  374   2HB   TYR  48          1HB       TYR  48  -6.409  -3.029   4.448
  375    HD1  TYR  48           1HD      TYR  48  -5.160  -3.325   6.557
  376    HD2  TYR  48           2HD      TYR  48  -6.904  -6.611   4.495
  377    HE1  TYR  48           1HE      TYR  48  -3.725  -4.881   7.827
  378    HE2  TYR  48           2HE      TYR  48  -5.470  -8.165   5.748
  379    HH   TYR  48           HH       TYR  48  -3.951  -7.462   8.488
  380    H    THR  49           H        THR  49  -7.153  -1.257   5.085
  381    HA   THR  49           HA       THR  49  -8.890  -0.594   2.837
  382    HB   THR  49           HB       THR  49  -9.171   1.713   3.440
  383    HG1  THR  49           1HG      THR  49  -7.166   1.138   5.215
  384   1HG2  THR  49          1HG2      THR  49  -9.828  -0.029   5.817
  385   2HG2  THR  49          2HG2      THR  49 -10.829   0.187   4.380
  386   3HG2  THR  49          3HG2      THR  49 -10.541   1.546   5.468
  387    H    MET  50           H        MET  50  -7.847   1.391   1.633
  388    HA   MET  50           HA       MET  50  -5.163   0.623   1.035
  389   1HB   MET  50          2HB       MET  50  -7.007   2.759   0.030
  390   2HB   MET  50          1HB       MET  50  -5.304   2.789  -0.411
  391   1HG   MET  50          1HG       MET  50  -5.533   0.515  -1.330
  392   2HG   MET  50          2HG       MET  50  -7.253   0.558  -0.948
  393   1HE   MET  50          1HE       MET  50  -7.906  -0.018  -3.436
  394   2HE   MET  50          2HE       MET  50  -6.195  -0.118  -3.851
  395   3HE   MET  50          3HE       MET  50  -7.287   0.851  -4.839
  396    H    LYS  51           H        LYS  51  -6.471   2.617   3.396
  397    HA   LYS  51           HA       LYS  51  -4.095   4.304   3.613
  398   1HB   LYS  51          1HB       LYS  51  -6.613   4.177   5.285
  399   2HB   LYS  51          2HB       LYS  51  -5.293   5.309   5.550
  400   1HG   LYS  51          2HG       LYS  51  -6.920   5.146   3.021
  401   2HG   LYS  51          1HG       LYS  51  -7.214   6.285   4.337
  402   1HD   LYS  51          1HD       LYS  51  -4.639   6.082   2.776
  403   2HD   LYS  51          2HD       LYS  51  -5.912   7.266   2.473
  404   1HE   LYS  51          1HE       LYS  51  -5.634   8.140   4.744
  405   2HE   LYS  51          2HE       LYS  51  -4.352   6.966   5.037
  406   1HZ   LYS  51          1HZ       LYS  51  -3.458   9.134   4.457
  407   2HZ   LYS  51          2HZ       LYS  51  -4.289   9.111   2.982
  408   3HZ   LYS  51          3HZ       LYS  51  -3.056   7.991   3.276
  409    H    GLU  52           H        GLU  52  -5.904   1.973   5.592
  410    HA   GLU  52           HA       GLU  52  -4.096   1.266   7.515
  411   1HB   GLU  52          2HB       GLU  52  -6.398   0.227   6.778
  412   2HB   GLU  52          1HB       GLU  52  -5.380  -0.883   5.872
  413   1HG   GLU  52          2HG       GLU  52  -5.922  -1.889   7.962
  414   2HG   GLU  52          1HG       GLU  52  -4.210  -1.464   7.971
  415    H    VAL  53           H        VAL  53  -4.254  -0.241   4.292
  416    HA   VAL  53           HA       VAL  53  -1.802  -1.595   4.504
  417    HB   VAL  53           HB       VAL  53  -3.236  -0.753   1.981
  418   1HG1  VAL  53          1HG2      VAL  53  -1.192  -2.919   2.467
  419   2HG1  VAL  53          2HG2      VAL  53  -0.938  -1.428   1.560
  420   3HG1  VAL  53          3HG2      VAL  53  -2.058  -2.647   0.955
  421   1HG2  VAL  53          1HG1      VAL  53  -4.219  -3.009   2.046
  422   2HG2  VAL  53          2HG1      VAL  53  -4.708  -2.023   3.423
  423   3HG2  VAL  53          3HG1      VAL  53  -3.477  -3.269   3.625
  424    H    LEU  54           H        LEU  54  -2.596   1.656   3.462
  425    HA   LEU  54           HA       LEU  54  -0.368   2.411   2.052
  426   1HB   LEU  54          2HB       LEU  54  -2.364   3.833   2.718
  427   2HB   LEU  54          1HB       LEU  54  -1.558   4.094   4.252
  428    HG   LEU  54           HG       LEU  54  -0.208   4.787   1.656
  429   1HD1  LEU  54          1HD1      LEU  54  -1.039   7.073   1.925
  430   2HD1  LEU  54          2HD1      LEU  54  -2.045   6.549   3.275
  431   3HD1  LEU  54          3HD1      LEU  54  -2.358   5.934   1.652
  432   1HD2  LEU  54          1HD2      LEU  54   0.087   5.803   4.480
  433   2HD2  LEU  54          2HD2      LEU  54   1.005   6.365   3.082
  434   3HD2  LEU  54          3HD2      LEU  54   1.187   4.704   3.647
  435    H    PHE  55           H        PHE  55  -0.645   2.902   5.586
  436    HA   PHE  55           HA       PHE  55   2.213   3.209   5.757
  437   1HB   PHE  55          2HB       PHE  55   1.752   3.504   8.221
  438   2HB   PHE  55          1HB       PHE  55   0.958   4.659   7.157
  439    HD1  PHE  55           1HD      PHE  55   0.379   1.521   9.053
  440    HD2  PHE  55           2HD      PHE  55  -1.338   4.970   7.247
  441    HE1  PHE  55           1HE      PHE  55  -1.791   0.972  10.077
  442    HE2  PHE  55           2HE      PHE  55  -3.510   4.428   8.267
  443    HZ   PHE  55           HZ       PHE  55  -3.738   2.427   9.684
  444    H    TYR  56           H        TYR  56  -0.049   0.630   6.244
  445    HA   TYR  56           HA       TYR  56   1.578  -0.947   7.971
  446   1HB   TYR  56          1HB       TYR  56  -0.989  -1.214   6.690
  447   2HB   TYR  56          2HB       TYR  56  -0.062  -2.703   6.536
  448    HD1  TYR  56           1HD      TYR  56  -2.614  -1.734   8.288
  449    HD2  TYR  56           2HD      TYR  56   1.462  -2.671   9.077
  450    HE1  TYR  56           1HE      TYR  56  -3.206  -2.336  10.596
  451    HE2  TYR  56           2HE      TYR  56   0.885  -3.282  11.387
  452    HH   TYR  56           HH       TYR  56  -0.890  -2.793  13.030
  453    H    LEU  57           H        LEU  57   0.845  -1.286   4.500
  454    HA   LEU  57           HA       LEU  57   2.795  -3.133   3.831
  455   1HB   LEU  57          2HB       LEU  57   0.972  -1.788   2.419
  456   2HB   LEU  57          1HB       LEU  57   2.368  -0.810   2.016
  457    HG   LEU  57           HG       LEU  57   2.209  -3.790   1.570
  458   1HD1  LEU  57          1HD2      LEU  57   1.801  -1.522  -0.373
  459   2HD1  LEU  57          2HD2      LEU  57   0.563  -2.642   0.198
  460   3HD1  LEU  57          3HD2      LEU  57   1.899  -3.233  -0.792
  461   1HD2  LEU  57          1HD1      LEU  57   4.160  -1.718   0.580
  462   2HD2  LEU  57          2HD1      LEU  57   4.163  -3.431   0.159
  463   3HD2  LEU  57          3HD1      LEU  57   4.478  -2.930   1.821
  464    H    GLY  58           H        GLY  58   3.069   0.404   4.102
  465   1HA   GLY  58          2HA       GLY  58   5.770   0.753   3.646
  466   2HA   GLY  58          1HA       GLY  58   4.854   1.646   4.851
  467    H    GLN  59           H        GLN  59   4.227  -0.262   6.695
  468    HA   GLN  59           HA       GLN  59   6.482  -0.427   8.283
  469   1HB   GLN  59          2HB       GLN  59   4.132  -2.331   8.331
  470   2HB   GLN  59          1HB       GLN  59   5.270  -2.057   9.643
  471   1HG   GLN  59          2HG       GLN  59   3.204  -0.168   8.564
  472   2HG   GLN  59          1HG       GLN  59   3.302  -0.876  10.174
  473   1HE2  GLN  59          1HE2      GLN  59   3.165   1.927   9.339
  474   2HE2  GLN  59          2HE2      GLN  59   4.553   2.692  10.028
  475    H    TYR  60           H        TYR  60   5.079  -2.988   6.225
  476    HA   TYR  60           HA       TYR  60   6.946  -4.938   7.070
  477   1HB   TYR  60          1HB       TYR  60   4.715  -5.473   6.147
  478   2HB   TYR  60          2HB       TYR  60   5.258  -4.926   4.564
  479    HD1  TYR  60           1HD      TYR  60   5.800  -7.483   7.179
  480    HD2  TYR  60           2HD      TYR  60   6.501  -6.333   3.147
  481    HE1  TYR  60           1HE      TYR  60   6.657  -9.735   6.694
  482    HE2  TYR  60           2HE      TYR  60   7.358  -8.578   2.649
  483    HH   TYR  60           HH       TYR  60   6.959 -11.211   4.750
  484    H    ILE  61           H        ILE  61   6.831  -2.840   4.213
  485    HA   ILE  61           HA       ILE  61   9.096  -3.825   2.883
  486    HB   ILE  61           HB       ILE  61   8.222  -0.932   2.981
  487   1HG1  ILE  61          1HG1      ILE  61   6.267  -2.039   2.347
  488   2HG1  ILE  61          2HG1      ILE  61   7.025  -1.678   0.800
  489   1HG2  ILE  61          1HG2      ILE  61   9.265  -0.721   0.836
  490   2HG2  ILE  61          2HG2      ILE  61   9.606  -2.450   0.776
  491   3HG2  ILE  61          3HG2      ILE  61  10.437  -1.427   1.950
  492   1HD1  ILE  61          1HD1      ILE  61   7.779  -3.910   0.556
  493   2HD1  ILE  61          2HD1      ILE  61   6.078  -3.980   1.026
  494   3HD1  ILE  61          3HD1      ILE  61   7.341  -4.297   2.222
  495    H    MET  62           H        MET  62   8.733  -1.999   5.738
  496    HA   MET  62           HA       MET  62  11.603  -1.393   5.871
  497   1HB   MET  62          2HB       MET  62   9.409  -0.661   7.818
  498   2HB   MET  62          1HB       MET  62  11.068  -0.079   7.851
  499   1HG   MET  62          2HG       MET  62  10.708   1.008   5.678
  500   2HG   MET  62          1HG       MET  62   9.031   0.467   5.710
  501   1HE   MET  62          1HE       MET  62   7.244   1.292   7.509
  502   2HE   MET  62          2HE       MET  62   7.624   2.416   8.814
  503   3HE   MET  62          3HE       MET  62   8.330   0.800   8.809
  504    H    THR  63           H        THR  63   9.305  -3.669   6.952
  505    HA   THR  63           HA       THR  63  10.533  -4.423   9.403
  506    HB   THR  63           HB       THR  63   8.664  -6.024   7.647
  507    HG1  THR  63           1HG      THR  63   7.680  -4.948   9.967
  508   1HG2  THR  63          1HG2      THR  63   8.175  -7.292   9.688
  509   2HG2  THR  63          2HG2      THR  63   9.397  -6.364  10.558
  510   3HG2  THR  63          3HG2      THR  63   9.873  -7.434   9.239
  511    H    LYS  64           H        LYS  64  10.235  -6.397   6.448
  512    HA   LYS  64           HA       LYS  64  12.480  -8.007   7.292
  513   1HB   LYS  64          2HB       LYS  64  10.763  -8.166   4.808
  514   2HB   LYS  64          1HB       LYS  64  11.954  -9.363   5.298
  515   1HG   LYS  64          2HG       LYS  64   9.539  -8.604   6.927
  516   2HG   LYS  64          1HG       LYS  64   9.619  -9.989   5.834
  517   1HD   LYS  64          1HD       LYS  64  11.486 -10.901   7.143
  518   2HD   LYS  64          2HD       LYS  64  11.373  -9.527   8.246
  519   1HE   LYS  64          2HE       LYS  64   9.213 -11.568   7.734
  520   2HE   LYS  64          1HE       LYS  64  10.253 -11.501   9.156
  521   1HZ   LYS  64          1HZ       LYS  64   9.315  -9.350   9.705
  522   2HZ   LYS  64          2HZ       LYS  64   8.089 -10.509   9.579
  523   3HZ   LYS  64          3HZ       LYS  64   8.330  -9.394   8.331
  524    H    ARG  65           H        ARG  65  12.839  -5.167   6.451
  525    HA   ARG  65           HA       ARG  65  14.212  -3.895   5.122
  526   1HB   ARG  65          2HB       ARG  65  16.579  -4.689   5.289
  527   2HB   ARG  65          1HB       ARG  65  15.716  -4.640   6.819
  528   1HG   ARG  65          1HG       ARG  65  15.369  -7.052   6.710
  529   2HG   ARG  65          2HG       ARG  65  16.231  -7.104   5.170
  530   1HD   ARG  65          1HD       ARG  65  17.678  -7.764   7.025
  531   2HD   ARG  65          2HD       ARG  65  18.249  -6.284   6.255
  532    HE   ARG  65           HE       ARG  65  16.573  -5.685   8.459
  533   1HH1  ARG  65          2HH1      ARG  65  19.777  -6.799   7.658
  534   2HH1  ARG  65          1HH1      ARG  65  20.492  -6.189   9.113
  535   1HH2  ARG  65          1HH2      ARG  65  17.507  -4.879  10.378
  536   2HH2  ARG  65          2HH2      ARG  65  19.203  -5.099  10.659
  537    H    LEU  66           H        LEU  66  13.012  -4.286   3.164
  538    HA   LEU  66           HA       LEU  66  14.463  -5.909   1.193
  539   1HB   LEU  66          1HB       LEU  66  11.697  -4.897   1.455
  540   2HB   LEU  66          2HB       LEU  66  12.356  -4.904  -0.167
  541    HG   LEU  66           HG       LEU  66  12.519  -7.237  -0.227
  542   1HD1  LEU  66          1HD2      LEU  66  12.130  -7.260   2.764
  543   2HD1  LEU  66          2HD2      LEU  66  13.621  -7.628   1.895
  544   3HD1  LEU  66          3HD2      LEU  66  12.220  -8.691   1.732
  545   1HD2  LEU  66          1HD1      LEU  66  10.297  -8.022   0.387
  546   2HD2  LEU  66          2HD1      LEU  66  10.227  -6.422  -0.353
  547   3HD2  LEU  66          3HD1      LEU  66  10.067  -6.592   1.395
  548    H    TYR  67           H        TYR  67  13.642  -2.647   2.102
  549    HA   TYR  67           HA       TYR  67  13.892  -1.398  -0.378
  550   1HB   TYR  67          1HB       TYR  67  14.131   0.703   0.910
  551   2HB   TYR  67          2HB       TYR  67  12.800  -0.296   1.479
  552    HD1  TYR  67           1HD      TYR  67  13.194  -1.731   3.559
  553    HD2  TYR  67           2HD      TYR  67  15.794   1.425   2.389
  554    HE1  TYR  67           1HE      TYR  67  14.087  -1.628   5.848
  555    HE2  TYR  67           2HE      TYR  67  16.697   1.536   4.672
  556    HH   TYR  67           HH       TYR  67  16.018   0.937   6.953
  557    H    ASP  68           H        ASP  68  15.553   0.403  -0.767
  558    HA   ASP  68           HA       ASP  68  17.902  -0.967  -1.459
  559   1HB   ASP  68          2HB       ASP  68  17.194   0.783  -2.891
  560   2HB   ASP  68          1HB       ASP  68  17.117   1.944  -1.567
  561    H    GLU  69           H        GLU  69  17.070   0.811   1.349
  562    HA   GLU  69           HA       GLU  69  18.130   0.997   3.345
  563   1HB   GLU  69          2HB       GLU  69  18.980  -1.263   2.953
  564   2HB   GLU  69          1HB       GLU  69  20.318  -0.613   2.017
  565   1HG   GLU  69          2HG       GLU  69  21.158   0.526   4.007
  566   2HG   GLU  69          1HG       GLU  69  19.817  -0.132   4.946
  567    H    LYS  70           H        LYS  70  19.472   2.120   0.435
  568    HA   LYS  70           HA       LYS  70  21.260   3.946   1.901
  569   1HB   LYS  70          1HB       LYS  70  21.362   3.132  -1.010
  570   2HB   LYS  70          2HB       LYS  70  22.465   4.255  -0.225
  571   1HG   LYS  70          1HG       LYS  70  23.266   2.471   1.228
  572   2HG   LYS  70          2HG       LYS  70  22.142   1.341   0.469
  573   1HD   LYS  70          2HD       LYS  70  24.334   2.826  -0.981
  574   2HD   LYS  70          1HD       LYS  70  24.457   1.162  -0.404
  575   1HE   LYS  70          1HE       LYS  70  22.573   0.528  -1.831
  576   2HE   LYS  70          2HE       LYS  70  22.447   2.190  -2.403
  577   1HZ   LYS  70          1HZ       LYS  70  24.791   0.407  -2.784
  578   2HZ   LYS  70          2HZ       LYS  70  24.667   2.001  -3.336
  579   3HZ   LYS  70          3HZ       LYS  70  23.651   0.807  -3.970
  580    H    GLN  71           H        GLN  71  18.548   3.694  -0.241
  581    HA   GLN  71           HA       GLN  71  18.028   6.515   0.229
  582   1HB   GLN  71          2HB       GLN  71  17.320   6.858  -2.133
  583   2HB   GLN  71          1HB       GLN  71  19.047   6.587  -1.949
  584   1HG   GLN  71          1HG       GLN  71  18.699   4.224  -2.589
  585   2HG   GLN  71          2HG       GLN  71  16.998   4.590  -2.881
  586   1HE2  GLN  71          1HE2      GLN  71  19.572   6.833  -3.584
  587   2HE2  GLN  71          2HE2      GLN  71  19.441   6.751  -5.305
  588    H    GLN  72           H        GLN  72  17.063   3.492   0.517
  589    HA   GLN  72           HA       GLN  72  15.144   2.595   1.319
  590   1HB   GLN  72          2HB       GLN  72  14.359   5.502   1.370
  591   2HB   GLN  72          1HB       GLN  72  13.286   4.228   1.932
  592   1HG   GLN  72          1HG       GLN  72  14.335   5.022   3.857
  593   2HG   GLN  72          2HG       GLN  72  15.177   3.523   3.472
  594   1HE2  GLN  72          1HE2      GLN  72  17.038   4.077   4.546
  595   2HE2  GLN  72          2HE2      GLN  72  18.115   5.306   3.988
  596    H    HIS  73           H        HIS  73  13.840   5.209  -0.749
  597    HA   HIS  73           HA       HIS  73  11.467   3.943  -1.211
  598   1HB   HIS  73          1HB       HIS  73  11.300   5.449  -3.266
  599   2HB   HIS  73          2HB       HIS  73  11.567   6.234  -1.715
  600    HD1  HIS  73           1HD      HIS  73  13.699   7.572  -1.429
  601    HD2  HIS  73           2HD      HIS  73  13.557   5.471  -5.010
  602    HE1  HIS  73           1HE      HIS  73  15.625   8.438  -2.795
  603    HE2  HIS  73           2HE      HIS  73  15.470   7.211  -4.988
  604    H    ILE  74           H        ILE  74  14.481   3.160  -2.734
  605    HA   ILE  74           HA       ILE  74  13.096   1.641  -4.819
  606    HB   ILE  74           HB       ILE  74  16.069   1.694  -4.318
  607   1HG1  ILE  74          2HG1      ILE  74  15.282   3.984  -4.731
  608   2HG1  ILE  74          1HG1      ILE  74  16.210   3.375  -6.098
  609   1HG2  ILE  74          1HG2      ILE  74  14.427   0.962  -6.739
  610   2HG2  ILE  74          2HG2      ILE  74  15.260  -0.163  -5.667
  611   3HG2  ILE  74          3HG2      ILE  74  16.189   0.967  -6.652
  612   1HD1  ILE  74          1HD1      ILE  74  13.208   3.525  -5.938
  613   2HD1  ILE  74          2HD1      ILE  74  14.144   2.926  -7.308
  614   3HD1  ILE  74          3HD1      ILE  74  14.260   4.621  -6.834
  615    H    VAL  75           H        VAL  75  12.195  -0.186  -4.077
  616    HA   VAL  75           HA       VAL  75  13.406  -1.479  -1.754
  617    HB   VAL  75           HB       VAL  75  10.706  -2.072  -2.941
  618   1HG1  VAL  75          1HG1      VAL  75  11.567  -3.737  -1.397
  619   2HG1  VAL  75          2HG1      VAL  75  10.209  -2.871  -0.679
  620   3HG1  VAL  75          3HG1      VAL  75  11.858  -2.487  -0.188
  621   1HG2  VAL  75          1HG2      VAL  75   9.803  -0.533  -1.211
  622   2HG2  VAL  75          2HG2      VAL  75  10.715   0.273  -2.488
  623   3HG2  VAL  75          3HG2      VAL  75  11.452   0.018  -0.906
  624    H    TYR  76           H        TYR  76  15.073  -2.598  -2.903
  625    HA   TYR  76           HA       TYR  76  14.693  -4.482  -4.911
  626   1HB   TYR  76          1HB       TYR  76  16.628  -4.719  -2.603
  627   2HB   TYR  76          2HB       TYR  76  16.778  -5.464  -4.190
  628    HD1  TYR  76           1HD      TYR  76  15.751  -2.869  -5.642
  629    HD2  TYR  76           2HD      TYR  76  18.796  -3.637  -2.767
  630    HE1  TYR  76           1HE      TYR  76  17.004  -0.909  -6.444
  631    HE2  TYR  76           2HE      TYR  76  20.054  -1.684  -3.569
  632    HH   TYR  76           HH       TYR  76  20.235  -0.319  -5.603
  633    H    CYS  77           H        CYS  77  14.124  -6.617  -4.966
  634    HA   CYS  77           HA       CYS  77  13.414  -7.969  -2.483
  635   1HB   CYS  77          1HB       CYS  77  11.359  -6.812  -3.044
  636   2HB   CYS  77          2HB       CYS  77  11.424  -7.426  -4.693
  637    HG   CYS  77           HG       CYS  77   9.953  -8.734  -2.111
  638    H    SER  78           H        SER  78  12.162  -8.820  -5.644
  639    HA   SER  78           HA       SER  78  12.380 -10.697  -6.898
  640   1HB   SER  78          1HB       SER  78  14.579  -9.668  -7.367
  641   2HB   SER  78          2HB       SER  78  15.270 -10.562  -6.013
  642    HG   SER  78           HG       SER  78  15.364 -11.451  -8.307
  643    H    ASN  79           H        ASN  79  12.281 -10.805  -3.731
  644    HA   ASN  79           HA       ASN  79  11.694 -13.523  -3.516
  645   1HB   ASN  79          1HB       ASN  79  14.112 -13.870  -3.795
  646   2HB   ASN  79          2HB       ASN  79  14.427 -12.808  -2.425
  647   1HD2  ASN  79          2HD2      ASN  79  15.474 -14.408  -1.273
  648   2HD2  ASN  79          1HD2      ASN  79  14.634 -15.733  -0.551
  649    H    ASP  80           H        ASP  80   9.972 -12.276  -2.509
  650    HA   ASP  80           HA       ASP  80  10.098 -12.400   0.305
  651   1HB   ASP  80          1HB       ASP  80  11.395 -10.262  -0.183
  652   2HB   ASP  80          2HB       ASP  80   9.858  -9.575  -0.702
  653    H    LEU  81           H        LEU  81   8.052 -11.324   1.293
  654    HA   LEU  81           HA       LEU  81   5.718 -12.118  -0.030
  655   1HB   LEU  81          1HB       LEU  81   6.281 -10.284   2.265
  656   2HB   LEU  81          2HB       LEU  81   4.660 -10.363   1.605
  657    HG   LEU  81           HG       LEU  81   4.919 -11.821   3.559
  658   1HD1  LEU  81          1HD1      LEU  81   4.557 -13.335   0.979
  659   2HD1  LEU  81          2HD1      LEU  81   3.310 -12.432   1.838
  660   3HD1  LEU  81          3HD1      LEU  81   4.023 -13.868   2.573
  661   1HD2  LEU  81          1HD2      LEU  81   6.325 -13.818   3.434
  662   2HD2  LEU  81          2HD2      LEU  81   7.285 -12.342   3.342
  663   3HD2  LEU  81          3HD2      LEU  81   6.958 -13.274   1.881
  664    H    LEU  82           H        LEU  82   7.315  -8.952   0.144
  665    HA   LEU  82           HA       LEU  82   5.672  -7.471  -1.523
  666   1HB   LEU  82          2HB       LEU  82   7.428  -6.217  -0.733
  667   2HB   LEU  82          1HB       LEU  82   8.595  -7.508  -0.965
  668    HG   LEU  82           HG       LEU  82   8.566  -7.066  -3.397
  669   1HD1  LEU  82          1HD2      LEU  82   6.292  -6.173  -3.551
  670   2HD1  LEU  82          2HD2      LEU  82   7.476  -5.067  -4.253
  671   3HD1  LEU  82          3HD2      LEU  82   6.799  -4.738  -2.658
  672   1HD2  LEU  82          1HD1      LEU  82   9.156  -4.660  -1.681
  673   2HD2  LEU  82          2HD1      LEU  82   9.767  -4.936  -3.312
  674   3HD2  LEU  82          3HD1      LEU  82  10.249  -6.008  -1.997
  675    H    GLY  83           H        GLY  83   8.078  -9.934  -2.332
  676   1HA   GLY  83          1HA       GLY  83   8.094  -9.727  -5.102
  677   2HA   GLY  83          2HA       GLY  83   8.322 -11.226  -4.214
  678    H    ASP  84           H        ASP  84   5.784 -11.409  -3.006
  679    HA   ASP  84           HA       ASP  84   4.214 -12.533  -5.056
  680   1HB   ASP  84          2HB       ASP  84   3.308 -11.612  -2.318
  681   2HB   ASP  84          1HB       ASP  84   2.442 -12.721  -3.376
  682    H    LEU  85           H        LEU  85   4.382  -9.302  -3.759
  683    HA   LEU  85           HA       LEU  85   1.862  -8.358  -4.523
  684   1HB   LEU  85          1HB       LEU  85   4.416  -6.762  -4.450
  685   2HB   LEU  85          2HB       LEU  85   2.784  -6.133  -4.339
  686    HG   LEU  85           HG       LEU  85   4.222  -7.813  -2.286
  687   1HD1  LEU  85          1HD2      LEU  85   3.943  -5.838  -0.874
  688   2HD1  LEU  85          2HD2      LEU  85   3.189  -4.983  -2.220
  689   3HD1  LEU  85          3HD2      LEU  85   4.879  -5.470  -2.323
  690   1HD2  LEU  85          1HD1      LEU  85   1.892  -8.491  -2.389
  691   2HD2  LEU  85          2HD1      LEU  85   1.382  -6.807  -2.278
  692   3HD2  LEU  85          3HD1      LEU  85   2.205  -7.570  -0.917
  693    H    PHE  86           H        PHE  86   4.903  -7.526  -6.186
  694    HA   PHE  86           HA       PHE  86   3.392  -7.505  -8.718
  695   1HB   PHE  86          2HB       PHE  86   6.051  -6.176  -8.543
  696   2HB   PHE  86          1HB       PHE  86   4.631  -5.725  -9.477
  697    HD1  PHE  86           1HD      PHE  86   5.858  -5.860  -5.967
  698    HD2  PHE  86           2HD      PHE  86   3.372  -3.910  -8.817
  699    HE1  PHE  86           1HE      PHE  86   5.351  -4.106  -4.321
  700    HE2  PHE  86           2HE      PHE  86   2.865  -2.145  -7.172
  701    HZ   PHE  86           HZ       PHE  86   3.853  -2.254  -4.921
  702    H    GLY  87           H        GLY  87   6.402  -8.481  -7.158
  703   1HA   GLY  87          2HA       GLY  87   7.734 -10.344  -7.930
  704   2HA   GLY  87          1HA       GLY  87   7.101 -10.061  -9.546
  705    H    VAL  88           H        VAL  88   7.877  -7.233  -7.831
  706    HA   VAL  88           HA       VAL  88   9.711  -6.395  -9.800
  707    HB   VAL  88           HB       VAL  88  10.107  -4.440  -8.362
  708   1HG1  VAL  88          1HG2      VAL  88   7.752  -3.657  -8.216
  709   2HG1  VAL  88          2HG2      VAL  88   7.230  -5.294  -8.609
  710   3HG1  VAL  88          3HG2      VAL  88   8.174  -4.367  -9.774
  711   1HG2  VAL  88          1HG1      VAL  88   8.962  -4.240  -6.206
  712   2HG2  VAL  88          2HG1      VAL  88  10.131  -5.560  -6.201
  713   3HG2  VAL  88          3HG1      VAL  88   8.409  -5.908  -6.348
  714    HA   PRO  89           HA       PRO  89  13.643  -7.357  -7.693
  715   1HB   PRO  89          1HB       PRO  89  15.235  -5.869  -9.253
  716   2HB   PRO  89          2HB       PRO  89  14.602  -7.423  -9.806
  717   1HG   PRO  89          1HG       PRO  89  13.661  -4.655 -10.448
  718   2HG   PRO  89          2HG       PRO  89  13.838  -6.053 -11.523
  719   1HD   PRO  89          2HD       PRO  89  11.453  -5.242 -10.417
  720   2HD   PRO  89          1HD       PRO  89  11.794  -6.900 -10.949
  721    H    SER  90           H        SER  90  11.851  -4.523  -8.136
  722    HA   SER  90           HA       SER  90  12.622  -3.367  -5.697
  723   1HB   SER  90          2HB       SER  90  13.672  -1.274  -6.585
  724   2HB   SER  90          1HB       SER  90  14.675  -2.709  -6.780
  725    HG   SER  90           HG       SER  90  12.987  -1.656  -8.801
  726    H    PHE  91           H        PHE  91  11.092  -1.820  -5.070
  727    HA   PHE  91           HA       PHE  91   9.495  -0.641  -7.237
  728   1HB   PHE  91          1HB       PHE  91   7.430  -1.045  -6.252
  729   2HB   PHE  91          2HB       PHE  91   8.296  -2.548  -5.986
  730    HD1  PHE  91           1HD      PHE  91   7.057   0.520  -4.382
  731    HD2  PHE  91           2HD      PHE  91   8.764  -3.330  -3.780
  732    HE1  PHE  91           1HE      PHE  91   6.507   0.650  -1.990
  733    HE2  PHE  91           2HE      PHE  91   8.217  -3.209  -1.390
  734    HZ   PHE  91           HZ       PHE  91   7.088  -1.212  -0.491
  735    H    SER  92           H        SER  92   8.498   1.411  -6.745
  736    HA   SER  92           HA       SER  92  10.684   2.909  -5.608
  737   1HB   SER  92          1HB       SER  92   9.865   3.440  -7.856
  738   2HB   SER  92          2HB       SER  92   8.282   3.844  -7.193
  739    HG   SER  92           HG       SER  92   9.841   5.627  -7.589
  740    H    VAL  93           H        VAL  93   7.349   2.316  -4.857
  741    HA   VAL  93           HA       VAL  93   5.936   3.048  -3.236
  742    HB   VAL  93           HB       VAL  93   7.972   2.027  -1.948
  743   1HG1  VAL  93          1HG1      VAL  93   8.903   3.626  -0.292
  744   2HG1  VAL  93          2HG1      VAL  93   8.185   4.940  -1.223
  745   3HG1  VAL  93          3HG1      VAL  93   9.432   3.925  -1.947
  746   1HG2  VAL  93          1HG2      VAL  93   5.696   2.091  -1.107
  747   2HG2  VAL  93          2HG2      VAL  93   5.908   3.766  -0.605
  748   3HG2  VAL  93          3HG2      VAL  93   6.836   2.487   0.179
  749    H    LYS  94           H        LYS  94   7.549   5.140  -4.957
  750    HA   LYS  94           HA       LYS  94   7.071   7.480  -3.242
  751   1HB   LYS  94          1HB       LYS  94   9.383   7.061  -4.191
  752   2HB   LYS  94          2HB       LYS  94   8.703   7.387  -5.778
  753   1HG   LYS  94          1HG       LYS  94   8.046   9.633  -5.009
  754   2HG   LYS  94          2HG       LYS  94   8.813   9.297  -3.453
  755   1HD   LYS  94          2HD       LYS  94  10.326  10.578  -4.826
  756   2HD   LYS  94          1HD       LYS  94  10.959   8.942  -4.632
  757   1HE   LYS  94          1HE       LYS  94  10.076   8.340  -6.834
  758   2HE   LYS  94          2HE       LYS  94   9.446   9.975  -7.028
  759   1HZ   LYS  94          1HZ       LYS  94  12.312   9.250  -6.733
  760   2HZ   LYS  94          2HZ       LYS  94  11.709  10.818  -6.919
  761   3HZ   LYS  94          3HZ       LYS  94  11.549   9.699  -8.175
  762    H    GLU  95           H        GLU  95   6.692   6.340  -6.585
  763    HA   GLU  95           HA       GLU  95   5.008   8.323  -7.559
  764   1HB   GLU  95          1HB       GLU  95   4.053   6.401  -8.976
  765   2HB   GLU  95          2HB       GLU  95   5.769   6.755  -9.127
  766   1HG   GLU  95          1HG       GLU  95   6.156   4.924  -7.421
  767   2HG   GLU  95          2HG       GLU  95   4.466   4.482  -7.666
  768    H    HIS  96           H        HIS  96   4.220   5.397  -5.731
  769    HA   HIS  96           HA       HIS  96   2.637   5.031  -4.156
  770   1HB   HIS  96          1HB       HIS  96   3.177   7.547  -3.708
  771   2HB   HIS  96          2HB       HIS  96   1.590   7.826  -4.416
  772    HD1  HIS  96           1HD      HIS  96  -0.224   5.893  -3.206
  773    HD2  HIS  96           2HD      HIS  96   2.922   7.511  -1.029
  774    HE1  HIS  96           1HE      HIS  96  -0.862   5.607  -0.791
  775    HE2  HIS  96           2HE      HIS  96   1.019   6.668   0.507
  776    H    ARG  97           H        ARG  97   0.911   7.440  -6.146
  777    HA   ARG  97           HA       ARG  97  -1.507   6.135  -6.308
  778   1HB   ARG  97          1HB       ARG  97  -1.123   8.413  -7.152
  779   2HB   ARG  97          2HB       ARG  97  -0.175   7.765  -8.481
  780   1HG   ARG  97          1HG       ARG  97  -2.151   6.602  -9.328
  781   2HG   ARG  97          2HG       ARG  97  -3.103   7.262  -7.996
  782   1HD   ARG  97          1HD       ARG  97  -3.441   8.557 -10.031
  783   2HD   ARG  97          2HD       ARG  97  -2.651   9.528  -8.787
  784    HE   ARG  97           HE       ARG  97  -0.657   8.402 -10.373
  785   1HH1  ARG  97          2HH1      ARG  97  -3.277  10.678 -10.684
  786   2HH1  ARG  97          1HH1      ARG  97  -2.505  11.593 -11.935
  787   1HH2  ARG  97          1HH2      ARG  97   0.368   9.601 -12.020
  788   2HH2  ARG  97          2HH2      ARG  97  -0.433  10.980 -12.695
  789    H    LYS  98           H        LYS  98   1.332   5.739  -8.388
  790    HA   LYS  98           HA       LYS  98   0.049   3.800 -10.065
  791   1HB   LYS  98          2HB       LYS  98   2.972   4.529  -9.850
  792   2HB   LYS  98          1HB       LYS  98   2.237   3.588 -11.139
  793   1HG   LYS  98          1HG       LYS  98   1.570   6.454 -10.502
  794   2HG   LYS  98          2HG       LYS  98   2.665   5.922 -11.779
  795   1HD   LYS  98          1HD       LYS  98   0.828   4.702 -12.845
  796   2HD   LYS  98          2HD       LYS  98  -0.268   5.242 -11.571
  797   1HE   LYS  98          2HE       LYS  98  -0.512   6.610 -13.574
  798   2HE   LYS  98          1HE       LYS  98   0.104   7.563 -12.224
  799   1HZ   LYS  98          1HZ       LYS  98   2.326   7.364 -13.138
  800   2HZ   LYS  98          2HZ       LYS  98   1.282   8.052 -14.277
  801   3HZ   LYS  98          3HZ       LYS  98   1.747   6.433 -14.425
  802    H    ILE  99           H        ILE  99   2.129   3.720  -7.259
  803    HA   ILE  99           HA       ILE  99   3.000   1.033  -7.584
  804    HB   ILE  99           HB       ILE  99   4.091   2.877  -6.162
  805   1HG1  ILE  99          1HG1      ILE  99   4.578   0.311  -6.257
  806   2HG1  ILE  99          2HG1      ILE  99   5.299   1.284  -4.978
  807   1HG2  ILE  99          1HG2      ILE  99   3.477   2.922  -3.802
  808   2HG2  ILE  99          2HG2      ILE  99   2.101   1.872  -4.145
  809   3HG2  ILE  99          3HG2      ILE  99   2.165   3.491  -4.833
  810   1HD1  ILE  99          1HD1      ILE  99   4.445  -0.825  -4.128
  811   2HD1  ILE  99          2HD1      ILE  99   2.833  -0.417  -4.712
  812   3HD1  ILE  99          3HD1      ILE  99   3.575   0.542  -3.431
  813    H    TYR 100           H        TYR 100   0.306   2.517  -5.868
  814    HA   TYR 100           HA       TYR 100  -0.463  -0.002  -4.681
  815   1HB   TYR 100          2HB       TYR 100  -1.503   2.803  -4.534
  816   2HB   TYR 100          1HB       TYR 100  -2.511   1.465  -3.987
  817    HD1  TYR 100           1HD      TYR 100  -2.267   2.936  -1.814
  818    HD2  TYR 100           2HD      TYR 100   0.882   0.650  -3.536
  819    HE1  TYR 100           1HE      TYR 100  -1.097   2.925   0.350
  820    HE2  TYR 100           2HE      TYR 100   2.052   0.628  -1.387
  821    HH   TYR 100           HH       TYR 100   2.141   1.963   0.683
  822    H    THR 101           H        THR 101  -1.372   1.958  -7.439
  823    HA   THR 101           HA       THR 101  -3.833   0.610  -7.951
  824    HB   THR 101           HB       THR 101  -3.266   2.883  -8.851
  825    HG1  THR 101           1HG      THR 101  -3.985   2.059 -11.146
  826   1HG2  THR 101          1HG2      THR 101  -0.979   2.411  -9.577
  827   2HG2  THR 101          2HG2      THR 101  -1.958   3.004 -10.918
  828   3HG2  THR 101          3HG2      THR 101  -1.589   1.284 -10.788
  829    H    MET 102           H        MET 102  -0.502  -0.063  -8.681
  830    HA   MET 102           HA       MET 102  -1.229  -2.151 -10.574
  831   1HB   MET 102          1HB       MET 102   1.173  -2.517 -10.836
  832   2HB   MET 102          2HB       MET 102   0.763  -0.824 -11.061
  833   1HG   MET 102          1HG       MET 102   1.593  -0.280  -8.869
  834   2HG   MET 102          2HG       MET 102   1.889  -1.984  -8.525
  835   1HE   MET 102          1HE       MET 102   4.115   0.691  -8.536
  836   2HE   MET 102          2HE       MET 102   5.484  -0.376  -8.851
  837   3HE   MET 102          3HE       MET 102   4.213  -0.876  -7.735
  838    H    ILE 103           H        ILE 103  -0.347  -1.791  -7.221
  839    HA   ILE 103           HA       ILE 103   0.035  -4.495  -6.561
  840    HB   ILE 103           HB       ILE 103  -1.160  -2.209  -5.007
  841   1HG1  ILE 103          1HG1      ILE 103   1.416  -3.763  -4.687
  842   2HG1  ILE 103          2HG1      ILE 103   1.274  -2.198  -5.479
  843   1HG2  ILE 103          1HG2      ILE 103  -2.239  -4.238  -4.217
  844   2HG2  ILE 103          2HG2      ILE 103  -1.096  -3.640  -3.014
  845   3HG2  ILE 103          3HG2      ILE 103  -0.668  -5.019  -4.026
  846   1HD1  ILE 103          1HD1      ILE 103   0.701  -2.778  -2.585
  847   2HD1  ILE 103          2HD1      ILE 103   0.527  -1.209  -3.374
  848   3HD1  ILE 103          3HD1      ILE 103   2.120  -1.952  -3.230
  849    H    TYR 104           H        TYR 104  -2.991  -2.590  -6.474
  850    HA   TYR 104           HA       TYR 104  -4.523  -4.977  -5.964
  851   1HB   TYR 104          1HB       TYR 104  -5.334  -2.094  -6.366
  852   2HB   TYR 104          2HB       TYR 104  -6.473  -3.389  -6.010
  853    HD1  TYR 104           1HD      TYR 104  -6.401  -4.531  -3.814
  854    HD2  TYR 104           2HD      TYR 104  -3.957  -1.152  -4.654
  855    HE1  TYR 104           1HE      TYR 104  -6.004  -4.227  -1.406
  856    HE2  TYR 104           2HE      TYR 104  -3.552  -0.840  -2.249
  857    HH   TYR 104           HH       TYR 104  -4.317  -3.187   0.065
  858    H    ARG 105           H        ARG 105  -5.187  -6.306  -7.492
  859    HA   ARG 105           HA       ARG 105  -6.106  -5.186 -10.046
  860   1HB   ARG 105          2HB       ARG 105  -4.381  -7.650  -9.737
  861   2HB   ARG 105          1HB       ARG 105  -5.104  -7.101 -11.242
  862   1HG   ARG 105          2HG       ARG 105  -3.783  -5.064 -11.157
  863   2HG   ARG 105          1HG       ARG 105  -3.081  -5.571  -9.619
  864   1HD   ARG 105          2HD       ARG 105  -1.560  -6.026 -11.469
  865   2HD   ARG 105          1HD       ARG 105  -2.096  -7.521 -10.704
  866    HE   ARG 105           HE       ARG 105  -3.786  -6.933 -12.871
  867   1HH1  ARG 105          2HH1      ARG 105  -0.521  -7.954 -12.206
  868   2HH1  ARG 105          1HH1      ARG 105  -0.352  -8.824 -13.694
  869   1HH2  ARG 105          1HH2      ARG 105  -3.572  -8.077 -14.834
  870   2HH2  ARG 105          2HH2      ARG 105  -2.087  -8.892 -15.188
  871    H    ASN 106           H        ASN 106  -7.258  -7.054 -11.324
  872    HA   ASN 106           HA       ASN 106  -9.035  -8.462 -11.483
  873   1HB   ASN 106          2HB       ASN 106  -7.537 -10.001 -10.222
  874   2HB   ASN 106          1HB       ASN 106  -8.234  -9.400  -8.721
  875   1HD2  ASN 106          1HD2      ASN 106  -9.020 -11.399  -8.130
  876   2HD2  ASN 106          2HD2      ASN 106 -10.368 -12.138  -8.918
  877    H    LEU 107           H        LEU 107 -11.227  -8.828 -10.699
  878    HA   LEU 107           HA       LEU 107 -12.194  -6.437  -9.366
  879   1HB   LEU 107          1HB       LEU 107 -13.704  -8.694 -10.686
  880   2HB   LEU 107          2HB       LEU 107 -14.417  -7.210 -10.085
  881    HG   LEU 107           HG       LEU 107 -12.369  -7.330 -12.300
  882   1HD1  LEU 107          1HD2      LEU 107 -15.364  -7.034 -12.458
  883   2HD1  LEU 107          2HD2      LEU 107 -14.425  -8.429 -12.991
  884   3HD1  LEU 107          3HD2      LEU 107 -14.241  -6.877 -13.808
  885   1HD2  LEU 107          1HD1      LEU 107 -12.397  -5.219 -11.077
  886   2HD2  LEU 107          2HD1      LEU 107 -14.138  -5.090 -11.331
  887   3HD2  LEU 107          3HD1      LEU 107 -13.040  -5.020 -12.708
  888    H    VAL 108           H        VAL 108 -11.378  -7.033  -7.249
  889    HA   VAL 108           HA       VAL 108 -13.328  -8.717  -5.832
  890    HB   VAL 108           HB       VAL 108 -10.386  -8.605  -5.152
  891   1HG1  VAL 108          1HG1      VAL 108 -11.831  -8.946  -3.220
  892   2HG1  VAL 108          2HG1      VAL 108 -10.924 -10.411  -3.589
  893   3HG1  VAL 108          3HG1      VAL 108 -12.626 -10.291  -4.038
  894   1HG2  VAL 108          1HG2      VAL 108 -10.299 -10.935  -5.919
  895   2HG2  VAL 108          2HG2      VAL 108 -10.713  -9.826  -7.226
  896   3HG2  VAL 108          3HG2      VAL 108 -11.968 -10.809  -6.471
  897    H    VAL 109           H        VAL 109 -10.894  -6.158  -5.593
  898    HA   VAL 109           HA       VAL 109 -11.654  -5.217  -3.037
  899    HB   VAL 109           HB       VAL 109 -10.427  -3.164  -3.629
  900   1HG1  VAL 109          1HG1      VAL 109  -8.237  -4.209  -3.989
  901   2HG1  VAL 109          2HG1      VAL 109  -9.038  -5.715  -4.438
  902   3HG1  VAL 109          3HG1      VAL 109  -9.197  -5.087  -2.798
  903   1HG2  VAL 109          1HG2      VAL 109 -11.095  -2.977  -5.962
  904   2HG2  VAL 109          2HG2      VAL 109 -10.176  -4.430  -6.355
  905   3HG2  VAL 109          3HG2      VAL 109  -9.338  -2.977  -5.817
  906    H    VAL 110           H        VAL 110 -12.619  -3.064  -2.614
  907    HA   VAL 110           HA       VAL 110 -15.079  -2.784  -4.126
  908    HB   VAL 110           HB       VAL 110 -14.151  -1.308  -1.657
  909   1HG1  VAL 110          1HG2      VAL 110 -16.876  -1.460  -2.943
  910   2HG1  VAL 110          2HG2      VAL 110 -15.817  -0.050  -2.916
  911   3HG1  VAL 110          3HG2      VAL 110 -16.502  -0.667  -1.413
  912   1HG2  VAL 110          1HG1      VAL 110 -15.688  -2.791  -0.451
  913   2HG2  VAL 110          2HG1      VAL 110 -14.396  -3.692  -1.242
  914   3HG2  VAL 110          3HG1      VAL 110 -16.012  -3.665  -1.948
  915    H    ASN 111           H        ASN 111 -14.734  -1.737  -6.020
  916    HA   ASN 111           HA       ASN 111 -12.927   0.482  -6.240
  917   1HB   ASN 111          2HB       ASN 111 -14.943  -0.646  -8.195
  918   2HB   ASN 111          1HB       ASN 111 -13.767   0.607  -8.580
  919   1HD2  ASN 111          2HD2      ASN 111 -12.788  -0.645 -10.151
  920   2HD2  ASN 111          1HD2      ASN 111 -11.788  -1.999  -9.763
  921    H    GLN 112           H        GLN 112 -13.461   2.340  -5.290
  922    HA   GLN 112           HA       GLN 112 -14.524   4.305  -4.888
  923   1HB   GLN 112          1HB       GLN 112 -14.861   4.323  -7.337
  924   2HB   GLN 112          2HB       GLN 112 -16.374   3.452  -7.123
  925   1HG   GLN 112          1HG       GLN 112 -17.286   5.326  -5.861
  926   2HG   GLN 112          2HG       GLN 112 -15.766   6.198  -6.050
  927   1HE2  GLN 112          2HE2      GLN 112 -17.147   4.218  -8.567
  928   2HE2  GLN 112          1HE2      GLN 112 -17.562   5.514  -9.631
  929    H    GLN 113           H        GLN 113 -16.151   5.102  -3.583
  930    HA   GLN 113           HA       GLN 113 -17.674   3.094  -2.193
  931   1HB   GLN 113          2HB       GLN 113 -17.561   6.091  -1.806
  932   2HB   GLN 113          1HB       GLN 113 -18.335   4.952  -0.713
  933   1HG   GLN 113          2HG       GLN 113 -16.178   3.900  -0.275
  934   2HG   GLN 113          1HG       GLN 113 -15.400   5.034  -1.378
  935   1HE2  GLN 113          1HE2      GLN 113 -14.943   4.575   1.466
  936   2HE2  GLN 113          2HE2      GLN 113 -15.191   6.099   2.242
  937    H    GLU 114           H        GLU 114 -18.233   4.728  -4.977
  938    HA   GLU 114           HA       GLU 114 -21.135   4.897  -4.523
  939   1HB   GLU 114          2HB       GLU 114 -19.444   6.213  -6.657
  940   2HB   GLU 114          1HB       GLU 114 -21.190   6.361  -6.515
  941   1HG   GLU 114          1HG       GLU 114 -19.174   7.287  -4.481
  942   2HG   GLU 114          2HG       GLU 114 -20.040   8.313  -5.622
  943    H    SER 115           H        SER 115 -22.514   4.267  -6.356
  944    HA   SER 115           HA       SER 115 -23.286   2.674  -7.783
  945   1HB   SER 115          2HB       SER 115 -21.818   3.818  -9.373
  946   2HB   SER 115          1HB       SER 115 -20.457   2.828  -8.850
  947    HG   SER 115           HG       SER 115 -21.207   1.182  -9.960
  948    H    SER 116           H        SER 116 -23.587   1.148  -6.094
  949    HA   SER 116           HA       SER 116 -21.514  -0.758  -5.486
  950   1HB   SER 116          2HB       SER 116 -23.121  -0.095  -3.757
  951   2HB   SER 116          1HB       SER 116 -24.447  -0.730  -4.730
  952    HG   SER 116           HG       SER 116 -23.465  -2.801  -4.547
  953    H    ASP 117           H        ASP 117 -24.008  -0.459  -7.812
  954    HA   ASP 117           HA       ASP 117 -23.266  -2.987  -8.995
  955   1HB   ASP 117          2HB       ASP 117 -25.028  -3.686  -7.440
  956   2HB   ASP 117          1HB       ASP 117 -26.121  -2.488  -8.127
  957    H    SER 118           H        SER 118 -25.935  -0.624  -9.181
  958    HA   SER 118           HA       SER 118 -25.011   0.273 -11.774
  959   1HB   SER 118          1HB       SER 118 -27.152  -0.201 -12.909
  960   2HB   SER 118          2HB       SER 118 -26.350  -1.684 -12.388
  961    HG   SER 118           HG       SER 118 -27.844  -1.022 -10.382
  962    H    SER 119           H        SER 119 -26.808   1.872 -12.672
  963    HA   SER 119           HA       SER 119 -27.784   3.910 -12.418
  964   1HB   SER 119          1HB       SER 119 -28.808   2.668  -9.852
  965   2HB   SER 119          2HB       SER 119 -29.436   4.141 -10.593
  966    HG   SER 119           HG       SER 119 -29.943   2.848 -12.450
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1   9.698  34.712 -19.362
    2   2H    MET   1          2H        MET   1  10.568  33.860 -18.189
    3   3H    MET   1          3H        MET   1  10.455  35.544 -18.097
    4    HA   MET   1           HA       MET   1   8.095  35.417 -17.712
    5   1HB   MET   1          1HB       MET   1   8.556  32.426 -17.745
    6   2HB   MET   1          2HB       MET   1   7.047  33.222 -17.327
    7   1HG   MET   1          1HG       MET   1   8.413  33.313 -20.007
    8   2HG   MET   1          2HG       MET   1   6.992  32.355 -19.594
    9   1HE   MET   1          1HE       MET   1   7.129  34.337 -22.093
   10   2HE   MET   1          2HE       MET   1   5.548  35.111 -21.985
   11   3HE   MET   1          3HE       MET   1   5.705  33.380 -21.689
   12    H    CYS   2           H        CYS   2  10.626  35.693 -16.332
   13    HA   CYS   2           HA       CYS   2  10.360  34.236 -13.846
   14   1HB   CYS   2          1HB       CYS   2  12.591  34.699 -14.733
   15   2HB   CYS   2          2HB       CYS   2  12.278  36.430 -14.662
   16    HG   CYS   2           HG       CYS   2  12.589  34.321 -11.986
   17    H    ASN   3           H        ASN   3   8.687  34.847 -12.615
   18    HA   ASN   3           HA       ASN   3   7.332  36.116 -11.302
   19   1HB   ASN   3          1HB       ASN   3   9.832  37.810 -11.276
   20   2HB   ASN   3          2HB       ASN   3   8.417  38.185 -10.299
   21   1HD2  ASN   3          2HD2      ASN   3   9.457  34.923 -10.998
   22   2HD2  ASN   3          1HD2      ASN   3   9.957  34.534  -9.393
   23    H    THR   4           H        THR   4   7.132  36.455 -14.154
   24    HA   THR   4           HA       THR   4   6.739  39.236 -14.728
   25    HB   THR   4           HB       THR   4   7.299  37.723 -16.542
   26    HG1  THR   4           1HG      THR   4   4.662  38.315 -17.212
   27   1HG2  THR   4          1HG2      THR   4   4.647  36.395 -15.968
   28   2HG2  THR   4          2HG2      THR   4   6.240  35.692 -15.688
   29   3HG2  THR   4          3HG2      THR   4   5.703  36.034 -17.333
   30    H    ASN   5           H        ASN   5   4.960  36.931 -13.042
   31    HA   ASN   5           HA       ASN   5   2.372  38.143 -13.647
   32   1HB   ASN   5          2HB       ASN   5   1.420  36.331 -12.309
   33   2HB   ASN   5          1HB       ASN   5   2.510  35.687 -13.535
   34   1HD2  ASN   5          2HD2      ASN   5   1.614  34.522 -11.016
   35   2HD2  ASN   5          1HD2      ASN   5   3.047  34.174 -10.115
   36    H    MET   6           H        MET   6   0.960  38.834 -11.904
   37    HA   MET   6           HA       MET   6   2.447  40.325  -9.893
   38   1HB   MET   6          2HB       MET   6  -0.488  40.387 -10.621
   39   2HB   MET   6          1HB       MET   6   0.301  41.470  -9.483
   40   1HG   MET   6          2HG       MET   6   1.699  42.347 -11.281
   41   2HG   MET   6          1HG       MET   6   0.913  41.257 -12.422
   42   1HE   MET   6          1HE       MET   6   0.357  43.315 -14.008
   43   2HE   MET   6          2HE       MET   6   1.141  44.410 -12.870
   44   3HE   MET   6          3HE       MET   6  -0.480  44.769 -13.464
   45    H    SER   7           H        SER   7   0.869  40.591  -7.795
   46    HA   SER   7           HA       SER   7   0.229  39.651  -5.828
   47   1HB   SER   7          1HB       SER   7  -1.656  38.787  -7.126
   48   2HB   SER   7          2HB       SER   7  -0.697  37.393  -7.619
   49    HG   SER   7           HG       SER   7  -0.773  36.602  -5.588
   50    H    VAL   8           H        VAL   8   2.121  39.343  -4.768
   51    HA   VAL   8           HA       VAL   8   3.602  36.852  -5.251
   52    HB   VAL   8           HB       VAL   8   4.444  39.302  -3.694
   53   1HG1  VAL   8          1HG2      VAL   8   5.496  37.278  -2.848
   54   2HG1  VAL   8          2HG2      VAL   8   6.672  38.275  -3.702
   55   3HG1  VAL   8          3HG2      VAL   8   6.002  36.841  -4.480
   56   1HG2  VAL   8          1HG1      VAL   8   4.272  39.755  -6.080
   57   2HG2  VAL   8          2HG1      VAL   8   5.272  38.345  -6.433
   58   3HG2  VAL   8          3HG1      VAL   8   5.961  39.723  -5.572
   59    HA   PRO   9           HA       PRO   9   1.490  35.658  -1.399
   60   1HB   PRO   9          2HB       PRO   9   1.756  32.997  -1.755
   61   2HB   PRO   9          1HB       PRO   9   0.512  33.939  -2.584
   62   1HG   PRO   9          2HG       PRO   9   3.161  32.986  -3.605
   63   2HG   PRO   9          1HG       PRO   9   1.581  32.969  -4.410
   64   1HD   PRO   9          2HD       PRO   9   3.474  34.862  -4.896
   65   2HD   PRO   9          1HD       PRO   9   1.733  35.181  -5.025
   66    H    THR  10           H        THR  10   2.188  34.196   0.416
   67    HA   THR  10           HA       THR  10   5.113  34.334   0.716
   68    HB   THR  10           HB       THR  10   4.712  34.308   3.154
   69    HG1  THR  10           1HG      THR  10   2.736  34.074   3.952
   70   1HG2  THR  10          1HG2      THR  10   3.775  36.572   3.336
   71   2HG2  THR  10          2HG2      THR  10   3.187  36.459   1.677
   72   3HG2  THR  10          3HG2      THR  10   4.921  36.452   2.000
   73    H    ASP  11           H        ASP  11   4.618  32.217  -0.672
   74    HA   ASP  11           HA       ASP  11   4.755  29.952  -0.809
   75   1HB   ASP  11          2HB       ASP  11   5.775  30.241   2.026
   76   2HB   ASP  11          1HB       ASP  11   5.934  28.796   1.031
   77    H    GLY  12           H        GLY  12   2.476  29.717  -0.982
   78   1HA   GLY  12          2HA       GLY  12   1.163  28.769   1.487
   79   2HA   GLY  12          1HA       GLY  12   0.315  29.480   0.122
   80    H    ALA  13           H        ALA  13   0.203  28.256  -1.864
   81    HA   ALA  13           HA       ALA  13  -0.224  26.378  -3.071
   82   1HB   ALA  13          1HB       ALA  13   2.180  25.997  -2.803
   83   2HB   ALA  13          2HB       ALA  13   1.281  24.481  -2.832
   84   3HB   ALA  13          3HB       ALA  13   1.872  25.125  -1.301
   85    H    VAL  14           H        VAL  14  -0.904  23.985  -2.840
   86    HA   VAL  14           HA       VAL  14  -2.392  23.615  -0.325
   87    HB   VAL  14           HB       VAL  14  -3.550  22.700  -2.931
   88   1HG1  VAL  14          1HG1      VAL  14  -4.538  21.868  -0.875
   89   2HG1  VAL  14          2HG1      VAL  14  -5.661  22.946  -1.705
   90   3HG1  VAL  14          3HG1      VAL  14  -4.767  23.518  -0.296
   91   1HG2  VAL  14          1HG2      VAL  14  -4.824  24.790  -3.100
   92   2HG2  VAL  14          2HG2      VAL  14  -3.091  25.063  -3.277
   93   3HG2  VAL  14          3HG2      VAL  14  -3.893  25.458  -1.758
   94    H    THR  15           H        THR  15  -3.283  21.273  -0.244
   95    HA   THR  15           HA       THR  15  -1.124  19.460  -1.106
   96    HB   THR  15           HB       THR  15  -2.872  19.199   1.350
   97    HG1  THR  15           1HG      THR  15  -0.272  20.213   0.919
   98   1HG2  THR  15          1HG2      THR  15  -1.339  17.385   1.964
   99   2HG2  THR  15          2HG2      THR  15  -0.491  17.583   0.430
  100   3HG2  THR  15          3HG2      THR  15  -2.168  17.037   0.447
  101    H    THR  16           H        THR  16  -2.059  18.746  -3.000
  102    HA   THR  16           HA       THR  16  -4.449  17.068  -2.663
  103    HB   THR  16           HB       THR  16  -5.240  17.732  -4.904
  104    HG1  THR  16           1HG      THR  16  -2.853  19.148  -4.856
  105   1HG2  THR  16          1HG2      THR  16  -6.049  19.970  -4.308
  106   2HG2  THR  16          2HG2      THR  16  -4.852  20.058  -3.016
  107   3HG2  THR  16          3HG2      THR  16  -6.148  18.865  -2.937
  108    H    SER  17           H        SER  17  -4.650  16.024  -5.163
  109    HA   SER  17           HA       SER  17  -3.885  14.273  -6.397
  110   1HB   SER  17          1HB       SER  17  -1.754  14.659  -7.562
  111   2HB   SER  17          2HB       SER  17  -2.737  16.122  -7.533
  112    HG   SER  17           HG       SER  17  -1.414  16.991  -6.014
  113    H    GLN  18           H        GLN  18  -3.967  12.696  -4.764
  114    HA   GLN  18           HA       GLN  18  -1.356  11.614  -4.070
  115   1HB   GLN  18          1HB       GLN  18  -2.249  11.156  -1.725
  116   2HB   GLN  18          2HB       GLN  18  -1.685  12.788  -2.064
  117   1HG   GLN  18          2HG       GLN  18  -4.050  13.440  -2.462
  118   2HG   GLN  18          1HG       GLN  18  -4.529  11.804  -2.003
  119   1HE2  GLN  18          1HE2      GLN  18  -1.902  13.514  -0.470
  120   2HE2  GLN  18          2HE2      GLN  18  -2.678  13.744   1.056
  121    H    ILE  19           H        ILE  19  -2.876   9.999  -2.002
  122    HA   ILE  19           HA       ILE  19  -5.068   8.833  -3.173
  123    HB   ILE  19           HB       ILE  19  -3.894   7.699  -4.780
  124   1HG1  ILE  19          2HG1      ILE  19  -3.660   5.721  -2.505
  125   2HG1  ILE  19          1HG1      ILE  19  -5.183   6.111  -3.300
  126   1HG2  ILE  19          1HG2      ILE  19  -1.695   6.864  -2.937
  127   2HG2  ILE  19          2HG2      ILE  19  -1.711   8.480  -3.649
  128   3HG2  ILE  19          3HG2      ILE  19  -1.672   7.050  -4.692
  129   1HD1  ILE  19          1HD1      ILE  19  -2.765   4.951  -4.660
  130   2HD1  ILE  19          2HD1      ILE  19  -4.331   5.276  -5.402
  131   3HD1  ILE  19          3HD1      ILE  19  -4.189   4.046  -4.147
  132    HA   PRO  20           HA       PRO  20  -3.420   6.291   0.761
  133   1HB   PRO  20          1HB       PRO  20  -2.200   8.674   2.063
  134   2HB   PRO  20          2HB       PRO  20  -1.694   6.982   2.111
  135   1HG   PRO  20          2HG       PRO  20  -0.365   8.756   0.635
  136   2HG   PRO  20          1HG       PRO  20  -0.637   7.104   0.049
  137   1HD   PRO  20          2HD       PRO  20  -2.016   9.642  -0.725
  138   2HD   PRO  20          1HD       PRO  20  -1.565   8.255  -1.731
  139    H    ALA  21           H        ALA  21  -5.526   6.179   1.351
  140    HA   ALA  21           HA       ALA  21  -7.492   6.646   2.392
  141   1HB   ALA  21          1HB       ALA  21  -5.858   8.658   3.937
  142   2HB   ALA  21          2HB       ALA  21  -6.038   6.951   4.347
  143   3HB   ALA  21          3HB       ALA  21  -7.438   8.023   4.393
  144    H    SER  22           H        SER  22  -9.062   8.508   2.916
  145    HA   SER  22           HA       SER  22 -10.220  10.373   2.326
  146   1HB   SER  22          1HB       SER  22  -7.612  11.267   1.076
  147   2HB   SER  22          2HB       SER  22  -9.032  12.287   1.309
  148    HG   SER  22           HG       SER  22  -7.445  12.492   2.987
  149    H    GLU  23           H        GLU  23  -8.028   9.985  -0.467
  150    HA   GLU  23           HA       GLU  23  -9.831  10.450  -2.477
  151   1HB   GLU  23          2HB       GLU  23  -7.417  10.152  -2.839
  152   2HB   GLU  23          1HB       GLU  23  -7.579   8.432  -2.515
  153   1HG   GLU  23          1HG       GLU  23  -9.015   8.193  -4.471
  154   2HG   GLU  23          2HG       GLU  23  -8.862   9.919  -4.795
  155    H    GLN  24           H        GLN  24  -8.762   7.096  -2.012
  156    HA   GLN  24           HA       GLN  24 -11.591   6.303  -1.809
  157   1HB   GLN  24          2HB       GLN  24 -11.050   4.257  -3.104
  158   2HB   GLN  24          1HB       GLN  24 -10.880   5.736  -4.039
  159   1HG   GLN  24          1HG       GLN  24  -8.429   5.649  -3.594
  160   2HG   GLN  24          2HG       GLN  24  -8.679   4.065  -2.859
  161   1HE2  GLN  24          2HE2      GLN  24 -10.501   5.200  -5.607
  162   2HE2  GLN  24          1HE2      GLN  24  -9.817   4.111  -6.760
  163    H    GLU  25           H        GLU  25 -12.057   4.572  -0.442
  164    HA   GLU  25           HA       GLU  25  -9.865   3.920   1.415
  165   1HB   GLU  25          1HB       GLU  25 -11.732   5.439   2.242
  166   2HB   GLU  25          2HB       GLU  25 -12.790   4.037   2.137
  167   1HG   GLU  25          1HG       GLU  25 -11.256   2.841   3.684
  168   2HG   GLU  25          2HG       GLU  25 -10.349   4.343   3.867
  169    H    THR  26           H        THR  26 -13.135   2.570   1.350
  170    HA   THR  26           HA       THR  26 -13.937   0.538   0.675
  171    HB   THR  26           HB       THR  26 -11.172  -0.005  -0.400
  172    HG1  THR  26           1HG      THR  26 -13.038   1.687  -1.255
  173   1HG2  THR  26          1HG2      THR  26 -12.288  -1.703  -1.769
  174   2HG2  THR  26          2HG2      THR  26 -13.822  -1.335  -0.983
  175   3HG2  THR  26          3HG2      THR  26 -12.499  -2.035  -0.051
  176    H    LEU  27           H        LEU  27 -14.217  -1.398   1.742
  177    HA   LEU  27           HA       LEU  27 -12.237  -2.231   3.674
  178   1HB   LEU  27          2HB       LEU  27 -14.985  -3.030   2.964
  179   2HB   LEU  27          1HB       LEU  27 -13.934  -4.341   3.478
  180    HG   LEU  27           HG       LEU  27 -15.197  -3.404   5.367
  181   1HD1  LEU  27          1HD1      LEU  27 -13.336  -3.119   6.866
  182   2HD1  LEU  27          2HD1      LEU  27 -12.272  -2.690   5.524
  183   3HD1  LEU  27          3HD1      LEU  27 -12.906  -4.335   5.660
  184   1HD2  LEU  27          1HD2      LEU  27 -14.706  -1.123   6.137
  185   2HD2  LEU  27          2HD2      LEU  27 -15.455  -1.125   4.540
  186   3HD2  LEU  27          3HD2      LEU  27 -13.715  -0.860   4.698
  187    H    VAL  28           H        VAL  28 -10.778  -2.070   1.761
  188    HA   VAL  28           HA       VAL  28 -11.105  -3.730  -0.481
  189    HB   VAL  28           HB       VAL  28  -9.715  -2.007  -1.028
  190   1HG1  VAL  28          1HG1      VAL  28  -8.455  -2.299   1.687
  191   2HG1  VAL  28          2HG1      VAL  28  -9.646  -1.079   1.201
  192   3HG1  VAL  28          3HG1      VAL  28  -8.022  -1.066   0.498
  193   1HG2  VAL  28          1HG2      VAL  28  -7.348  -2.735  -1.120
  194   2HG2  VAL  28          2HG2      VAL  28  -8.470  -3.984  -1.658
  195   3HG2  VAL  28          3HG2      VAL  28  -7.750  -4.079  -0.050
  196    H    ARG  29           H        ARG  29 -10.171  -5.637  -1.045
  197    HA   ARG  29           HA       ARG  29  -8.740  -7.061   1.065
  198   1HB   ARG  29          1HB       ARG  29 -10.931  -8.392  -0.519
  199   2HB   ARG  29          2HB       ARG  29 -10.189  -8.928   0.982
  200   1HG   ARG  29          1HG       ARG  29 -11.318  -7.238   2.233
  201   2HG   ARG  29          2HG       ARG  29 -11.897  -6.451   0.762
  202   1HD   ARG  29          1HD       ARG  29 -13.652  -7.779   1.845
  203   2HD   ARG  29          2HD       ARG  29 -13.263  -8.388   0.236
  204    HE   ARG  29           HE       ARG  29 -11.709  -9.806   2.051
  205   1HH1  ARG  29          2HH1      ARG  29 -15.084  -9.366   1.301
  206   2HH1  ARG  29          1HH1      ARG  29 -15.542 -10.948   1.839
  207   1HH2  ARG  29          1HH2      ARG  29 -12.304 -11.890   2.760
  208   2HH2  ARG  29          2HH2      ARG  29 -13.962 -12.382   2.670
  209    HA   PRO  30           HA       PRO  30  -6.920  -7.054  -3.130
  210   1HB   PRO  30          2HB       PRO  30  -4.298  -7.014  -1.859
  211   2HB   PRO  30          1HB       PRO  30  -5.076  -5.771  -2.840
  212   1HG   PRO  30          1HG       PRO  30  -4.643  -5.484  -0.179
  213   2HG   PRO  30          2HG       PRO  30  -6.015  -4.736  -1.019
  214   1HD   PRO  30          1HD       PRO  30  -5.942  -7.226   0.648
  215   2HD   PRO  30          2HD       PRO  30  -7.159  -5.931   0.613
  216    H    LYS  31           H        LYS  31  -7.751  -9.446  -2.790
  217    HA   LYS  31           HA       LYS  31  -7.405 -11.685  -2.961
  218   1HB   LYS  31          2HB       LYS  31  -4.666 -10.799  -3.892
  219   2HB   LYS  31          1HB       LYS  31  -5.322 -12.421  -4.074
  220   1HG   LYS  31          1HG       LYS  31  -7.114 -11.530  -5.488
  221   2HG   LYS  31          2HG       LYS  31  -6.431  -9.912  -5.319
  222   1HD   LYS  31          2HD       LYS  31  -5.721 -10.848  -7.421
  223   2HD   LYS  31          1HD       LYS  31  -4.329 -10.746  -6.340
  224   1HE   LYS  31          1HE       LYS  31  -4.574 -13.118  -5.799
  225   2HE   LYS  31          2HE       LYS  31  -5.966 -13.221  -6.876
  226   1HZ   LYS  31          1HZ       LYS  31  -4.529 -12.639  -8.730
  227   2HZ   LYS  31          2HZ       LYS  31  -3.961 -14.027  -7.948
  228   3HZ   LYS  31          3HZ       LYS  31  -3.194 -12.541  -7.696
  229    HA   PRO  32           HA       PRO  32  -5.173 -13.086   0.680
  230   1HB   PRO  32          2HB       PRO  32  -4.731 -15.678   0.107
  231   2HB   PRO  32          1HB       PRO  32  -6.349 -15.067   0.470
  232   1HG   PRO  32          1HG       PRO  32  -5.097 -15.664  -2.185
  233   2HG   PRO  32          2HG       PRO  32  -6.735 -16.029  -1.613
  234   1HD   PRO  32          2HD       PRO  32  -6.135 -13.899  -3.218
  235   2HD   PRO  32          1HD       PRO  32  -7.502 -13.921  -2.087
  236    H    LEU  33           H        LEU  33  -3.548 -11.616  -0.987
  237    HA   LEU  33           HA       LEU  33  -1.268 -12.726  -2.020
  238   1HB   LEU  33          1HB       LEU  33  -1.526 -10.240  -0.340
  239   2HB   LEU  33          2HB       LEU  33  -0.089 -10.663  -1.250
  240    HG   LEU  33           HG       LEU  33  -2.814 -10.023  -2.385
  241   1HD1  LEU  33          1HD1      LEU  33  -0.170  -8.585  -2.552
  242   2HD1  LEU  33          2HD1      LEU  33  -1.577  -8.074  -1.619
  243   3HD1  LEU  33          3HD1      LEU  33  -1.654  -8.112  -3.381
  244   1HD2  LEU  33          1HD2      LEU  33  -1.748 -11.781  -3.691
  245   2HD2  LEU  33          2HD2      LEU  33  -0.277 -10.813  -3.812
  246   3HD2  LEU  33          3HD2      LEU  33  -1.764 -10.257  -4.581
  247    H    LEU  34           H        LEU  34  -1.022 -11.271   1.202
  248    HA   LEU  34           HA       LEU  34  -0.628 -13.918   2.314
  249   1HB   LEU  34          1HB       LEU  34   1.291 -11.656   2.851
  250   2HB   LEU  34          2HB       LEU  34   1.269 -13.184   3.707
  251    HG   LEU  34           HG       LEU  34   1.594 -14.162   1.265
  252   1HD1  LEU  34          1HD2      LEU  34   2.810 -11.410   1.077
  253   2HD1  LEU  34          2HD2      LEU  34   1.431 -11.998   0.148
  254   3HD1  LEU  34          3HD2      LEU  34   3.023 -12.719  -0.087
  255   1HD2  LEU  34          1HD1      LEU  34   3.108 -14.500   3.146
  256   2HD2  LEU  34          2HD1      LEU  34   3.803 -12.901   2.884
  257   3HD2  LEU  34          3HD1      LEU  34   4.005 -14.161   1.666
  258    H    LEU  35           H        LEU  35  -0.534 -10.487   3.193
  259    HA   LEU  35           HA       LEU  35  -1.472  -9.319   4.883
  260   1HB   LEU  35          1HB       LEU  35  -3.505 -11.554   4.829
  261   2HB   LEU  35          2HB       LEU  35  -3.685 -10.063   5.733
  262    HG   LEU  35           HG       LEU  35  -3.351  -8.930   3.390
  263   1HD1  LEU  35          1HD2      LEU  35  -2.767 -10.906   2.148
  264   2HD1  LEU  35          2HD2      LEU  35  -4.330 -10.316   1.581
  265   3HD1  LEU  35          3HD2      LEU  35  -4.253 -11.710   2.659
  266   1HD2  LEU  35          1HD1      LEU  35  -5.968 -10.330   3.847
  267   2HD2  LEU  35          2HD1      LEU  35  -5.674  -8.719   3.184
  268   3HD2  LEU  35          3HD1      LEU  35  -5.411  -9.028   4.902
  269    H    LYS  36           H        LYS  36  -0.583 -12.651   5.394
  270    HA   LYS  36           HA       LYS  36   0.351 -11.982   8.046
  271   1HB   LYS  36          1HB       LYS  36   1.128 -14.119   6.058
  272   2HB   LYS  36          2HB       LYS  36   1.932 -13.909   7.604
  273   1HG   LYS  36          2HG       LYS  36  -0.184 -14.318   8.762
  274   2HG   LYS  36          1HG       LYS  36  -0.985 -14.536   7.205
  275   1HD   LYS  36          2HD       LYS  36   1.313 -16.215   8.207
  276   2HD   LYS  36          1HD       LYS  36  -0.389 -16.674   8.307
  277   1HE   LYS  36          1HE       LYS  36   1.154 -16.127   5.774
  278   2HE   LYS  36          2HE       LYS  36   0.702 -17.717   6.387
  279   1HZ   LYS  36          1HZ       LYS  36  -0.816 -16.969   4.667
  280   2HZ   LYS  36          2HZ       LYS  36  -1.191 -15.582   5.562
  281   3HZ   LYS  36          3HZ       LYS  36  -1.623 -17.109   6.147
  282    H    LEU  37           H        LEU  37   0.967 -11.079   4.891
  283    HA   LEU  37           HA       LEU  37   3.672 -10.187   5.215
  284   1HB   LEU  37          1HB       LEU  37   2.831 -10.639   3.011
  285   2HB   LEU  37          2HB       LEU  37   1.446  -9.601   3.261
  286    HG   LEU  37           HG       LEU  37   3.235  -8.747   1.704
  287   1HD1  LEU  37          1HD1      LEU  37   2.585  -6.641   2.134
  288   2HD1  LEU  37          2HD1      LEU  37   2.957  -6.760   3.858
  289   3HD1  LEU  37          3HD1      LEU  37   1.469  -7.473   3.224
  290   1HD2  LEU  37          1HD2      LEU  37   5.083  -7.511   2.902
  291   2HD2  LEU  37          2HD2      LEU  37   5.250  -9.264   2.786
  292   3HD2  LEU  37          3HD2      LEU  37   4.721  -8.529   4.298
  293    H    LEU  38           H        LEU  38   0.712  -9.311   6.494
  294    HA   LEU  38           HA       LEU  38   1.568  -6.538   6.979
  295   1HB   LEU  38          1HB       LEU  38  -0.593  -7.407   5.388
  296   2HB   LEU  38          2HB       LEU  38  -1.286  -6.744   6.852
  297    HG   LEU  38           HG       LEU  38  -0.430  -4.600   6.437
  298   1HD1  LEU  38          1HD1      LEU  38   1.855  -5.183   5.909
  299   2HD1  LEU  38          2HD1      LEU  38   1.203  -4.130   4.651
  300   3HD1  LEU  38          3HD1      LEU  38   1.348  -5.864   4.364
  301   1HD2  LEU  38          1HD2      LEU  38  -1.114  -4.115   4.111
  302   2HD2  LEU  38          2HD2      LEU  38  -2.278  -5.113   4.985
  303   3HD2  LEU  38          3HD2      LEU  38  -1.192  -5.855   3.806
  304    H    LYS  39           H        LYS  39  -1.079  -8.745   7.912
  305    HA   LYS  39           HA       LYS  39  -1.525  -7.874  10.477
  306   1HB   LYS  39          1HB       LYS  39  -1.582 -10.695   9.408
  307   2HB   LYS  39          2HB       LYS  39  -2.184 -10.248  10.999
  308   1HG   LYS  39          2HG       LYS  39  -3.835  -8.786   9.994
  309   2HG   LYS  39          1HG       LYS  39  -3.203  -9.148   8.386
  310   1HD   LYS  39          2HD       LYS  39  -4.262 -11.269  10.239
  311   2HD   LYS  39          1HD       LYS  39  -5.283 -10.410   9.084
  312   1HE   LYS  39          1HE       LYS  39  -3.914 -11.201   7.242
  313   2HE   LYS  39          2HE       LYS  39  -2.820 -12.000   8.373
  314   1HZ   LYS  39          1HZ       LYS  39  -4.638 -13.435   9.061
  315   2HZ   LYS  39          2HZ       LYS  39  -4.377 -13.563   7.396
  316   3HZ   LYS  39          3HZ       LYS  39  -5.687 -12.667   7.979
  317    H    SER  40           H        SER  40   1.239  -9.556   9.262
  318    HA   SER  40           HA       SER  40   2.303 -10.314  11.810
  319   1HB   SER  40          1HB       SER  40   3.053 -11.427   9.764
  320   2HB   SER  40          2HB       SER  40   3.695  -9.902   9.154
  321    HG   SER  40           HG       SER  40   5.222  -9.916  10.775
  322    H    VAL  41           H        VAL  41   2.972  -7.623   9.567
  323    HA   VAL  41           HA       VAL  41   4.866  -6.402  11.301
  324    HB   VAL  41           HB       VAL  41   4.973  -6.049   8.893
  325   1HG1  VAL  41          1HG1      VAL  41   2.678  -6.086   8.260
  326   2HG1  VAL  41          2HG1      VAL  41   3.336  -4.512   7.806
  327   3HG1  VAL  41          3HG1      VAL  41   2.323  -4.667   9.245
  328   1HG2  VAL  41          1HG2      VAL  41   4.346  -3.446  10.266
  329   2HG2  VAL  41          2HG2      VAL  41   5.402  -3.695   8.871
  330   3HG2  VAL  41          3HG2      VAL  41   5.861  -4.334  10.451
  331    H    GLY  42           H        GLY  42   1.506  -6.560  11.431
  332   1HA   GLY  42          1HA       GLY  42   1.349  -5.263  13.846
  333   2HA   GLY  42          2HA       GLY  42   1.021  -4.013  12.659
  334    H    ALA  43           H        ALA  43  -0.442  -5.529  10.785
  335    HA   ALA  43           HA       ALA  43  -2.956  -4.937  11.850
  336   1HB   ALA  43          1HB       ALA  43  -2.360  -6.648   9.438
  337   2HB   ALA  43          2HB       ALA  43  -2.443  -4.886   9.451
  338   3HB   ALA  43          3HB       ALA  43  -3.885  -5.840   9.796
  339    H    GLN  44           H        GLN  44  -4.838  -6.626  11.502
  340    HA   GLN  44           HA       GLN  44  -4.375  -9.353  12.031
  341   1HB   GLN  44          1HB       GLN  44  -3.722  -8.435  14.256
  342   2HB   GLN  44          2HB       GLN  44  -5.342  -7.774  14.424
  343   1HG   GLN  44          2HG       GLN  44  -6.276 -10.025  14.343
  344   2HG   GLN  44          1HG       GLN  44  -4.654 -10.693  14.165
  345   1HE2  GLN  44          2HE2      GLN  44  -6.912  -9.177  16.324
  346   2HE2  GLN  44          1HE2      GLN  44  -6.051  -9.508  17.784
  347    H    LYS  45           H        LYS  45  -5.862  -8.921  10.158
  348    HA   LYS  45           HA       LYS  45  -8.658  -8.834  11.031
  349   1HB   LYS  45          2HB       LYS  45  -7.519  -7.095   8.835
  350   2HB   LYS  45          1HB       LYS  45  -9.215  -7.207   9.280
  351   1HG   LYS  45          2HG       LYS  45  -8.892  -6.082  11.291
  352   2HG   LYS  45          1HG       LYS  45  -7.151  -6.366  11.277
  353   1HD   LYS  45          1HD       LYS  45  -7.666  -4.039  10.746
  354   2HD   LYS  45          2HD       LYS  45  -6.910  -4.852   9.375
  355   1HE   LYS  45          2HE       LYS  45  -8.767  -3.461   8.642
  356   2HE   LYS  45          1HE       LYS  45  -9.102  -5.167   8.346
  357   1HZ   LYS  45          1HZ       LYS  45 -10.465  -5.211  10.339
  358   2HZ   LYS  45          2HZ       LYS  45 -11.026  -4.031   9.264
  359   3HZ   LYS  45          3HZ       LYS  45 -10.139  -3.575  10.629
  360    H    ASP  46           H        ASP  46 -10.159  -9.371   9.184
  361    HA   ASP  46           HA       ASP  46  -9.022 -11.459   7.495
  362   1HB   ASP  46          2HB       ASP  46 -11.893 -10.570   7.864
  363   2HB   ASP  46          1HB       ASP  46 -11.369 -11.952   6.906
  364    H    THR  47           H        THR  47  -9.913  -8.180   7.356
  365    HA   THR  47           HA       THR  47  -9.312  -8.152   4.480
  366    HB   THR  47           HB       THR  47 -10.992  -6.422   4.070
  367    HG1  THR  47           1HG      THR  47 -11.041  -5.636   6.278
  368   1HG2  THR  47          1HG2      THR  47 -11.739  -8.656   3.639
  369   2HG2  THR  47          2HG2      THR  47 -13.061  -7.778   4.413
  370   3HG2  THR  47          3HG2      THR  47 -12.094  -8.922   5.346
  371    H    TYR  48           H        TYR  48  -9.113  -5.659   3.845
  372    HA   TYR  48           HA       TYR  48  -7.962  -4.161   6.081
  373   1HB   TYR  48          2HB       TYR  48  -6.673  -4.717   3.433
  374   2HB   TYR  48          1HB       TYR  48  -6.276  -3.260   4.343
  375    HD1  TYR  48           1HD      TYR  48  -6.321  -6.963   4.545
  376    HD2  TYR  48           2HD      TYR  48  -4.784  -3.330   6.130
  377    HE1  TYR  48           1HE      TYR  48  -4.706  -8.238   5.891
  378    HE2  TYR  48           2HE      TYR  48  -3.168  -4.599   7.489
  379    HH   TYR  48           HH       TYR  48  -2.555  -7.904   6.984
  380    H    THR  49           H        THR  49  -7.617  -1.837   5.468
  381    HA   THR  49           HA       THR  49  -9.569  -0.990   3.442
  382    HB   THR  49           HB       THR  49 -10.154   0.967   4.734
  383    HG1  THR  49           1HG      THR  49  -9.018   0.357   7.104
  384   1HG2  THR  49          1HG2      THR  49 -10.274  -1.514   6.454
  385   2HG2  THR  49          2HG2      THR  49 -11.431  -1.063   5.202
  386   3HG2  THR  49          3HG2      THR  49 -11.272  -0.075   6.654
  387    H    MET  50           H        MET  50  -9.046   1.032   2.373
  388    HA   MET  50           HA       MET  50  -6.690   0.776   1.099
  389   1HB   MET  50          1HB       MET  50  -8.772   2.681   1.118
  390   2HB   MET  50          2HB       MET  50  -7.260   3.579   1.153
  391   1HG   MET  50          2HG       MET  50  -7.515   1.344  -0.780
  392   2HG   MET  50          1HG       MET  50  -8.391   2.838  -1.108
  393   1HE   MET  50          1HE       MET  50  -6.234   1.695  -3.111
  394   2HE   MET  50          2HE       MET  50  -5.321   3.149  -3.507
  395   3HE   MET  50          3HE       MET  50  -7.078   3.221  -3.373
  396    H    LYS  51           H        LYS  51  -7.219   2.967   3.862
  397    HA   LYS  51           HA       LYS  51  -4.568   4.029   3.695
  398   1HB   LYS  51          2HB       LYS  51  -5.129   5.108   5.869
  399   2HB   LYS  51          1HB       LYS  51  -6.315   5.418   4.610
  400   1HG   LYS  51          2HG       LYS  51  -7.775   3.703   5.562
  401   2HG   LYS  51          1HG       LYS  51  -6.587   3.405   6.833
  402   1HD   LYS  51          1HD       LYS  51  -7.945   6.051   6.334
  403   2HD   LYS  51          2HD       LYS  51  -8.442   4.879   7.557
  404   1HE   LYS  51          2HE       LYS  51  -6.259   5.076   8.636
  405   2HE   LYS  51          1HE       LYS  51  -5.752   6.237   7.409
  406   1HZ   LYS  51          1HZ       LYS  51  -7.988   6.617   9.327
  407   2HZ   LYS  51          2HZ       LYS  51  -7.496   7.732   8.153
  408   3HZ   LYS  51          3HZ       LYS  51  -6.462   7.342   9.434
  409    H    GLU  52           H        GLU  52  -6.231   1.757   5.809
  410    HA   GLU  52           HA       GLU  52  -4.235   1.103   7.585
  411   1HB   GLU  52          2HB       GLU  52  -6.754   0.223   7.053
  412   2HB   GLU  52          1HB       GLU  52  -5.802  -1.164   6.553
  413   1HG   GLU  52          1HG       GLU  52  -6.493  -1.409   8.851
  414   2HG   GLU  52          2HG       GLU  52  -4.740  -1.244   8.751
  415    H    VAL  53           H        VAL  53  -5.020  -0.825   4.691
  416    HA   VAL  53           HA       VAL  53  -2.766  -2.460   4.827
  417    HB   VAL  53           HB       VAL  53  -4.668  -3.138   3.524
  418   1HG1  VAL  53          1HG1      VAL  53  -4.053  -0.796   1.728
  419   2HG1  VAL  53          2HG1      VAL  53  -5.446  -0.957   2.797
  420   3HG1  VAL  53          3HG1      VAL  53  -5.267  -2.037   1.415
  421   1HG2  VAL  53          1HG2      VAL  53  -2.264  -2.676   1.761
  422   2HG2  VAL  53          2HG2      VAL  53  -3.580  -3.798   1.413
  423   3HG2  VAL  53          3HG2      VAL  53  -2.546  -4.061   2.817
  424    H    LEU  54           H        LEU  54  -3.201   0.681   3.294
  425    HA   LEU  54           HA       LEU  54  -1.003   0.587   1.563
  426   1HB   LEU  54          2HB       LEU  54  -2.588   2.789   2.791
  427   2HB   LEU  54          1HB       LEU  54  -1.071   3.192   2.008
  428    HG   LEU  54           HG       LEU  54  -3.472   1.879   0.732
  429   1HD1  LEU  54          1HD1      LEU  54  -3.508   3.900  -0.642
  430   2HD1  LEU  54          2HD1      LEU  54  -2.149   4.547   0.276
  431   3HD1  LEU  54          3HD1      LEU  54  -3.699   4.276   1.070
  432   1HD2  LEU  54          1HD2      LEU  54  -1.437   0.895  -0.160
  433   2HD2  LEU  54          2HD2      LEU  54  -0.780   2.502  -0.466
  434   3HD2  LEU  54          3HD2      LEU  54  -2.199   1.946  -1.354
  435    H    PHE  55           H        PHE  55  -1.091   2.522   4.578
  436    HA   PHE  55           HA       PHE  55   1.731   2.761   4.572
  437   1HB   PHE  55          2HB       PHE  55   1.415   3.720   6.886
  438   2HB   PHE  55          1HB       PHE  55   0.524   4.525   5.602
  439    HD1  PHE  55           1HD      PHE  55  -1.469   5.334   6.331
  440    HD2  PHE  55           2HD      PHE  55  -0.153   1.555   7.775
  441    HE1  PHE  55           1HE      PHE  55  -3.548   5.111   7.628
  442    HE2  PHE  55           2HE      PHE  55  -2.231   1.321   9.072
  443    HZ   PHE  55           HZ       PHE  55  -3.931   3.101   9.000
  444    H    TYR  56           H        TYR  56  -0.290   0.240   5.552
  445    HA   TYR  56           HA       TYR  56   1.536  -0.889   7.478
  446   1HB   TYR  56          1HB       TYR  56  -1.116  -1.487   6.536
  447   2HB   TYR  56          2HB       TYR  56  -0.114  -2.935   6.491
  448    HD1  TYR  56           1HD      TYR  56   1.666  -2.385   8.829
  449    HD2  TYR  56           2HD      TYR  56  -2.537  -1.920   8.353
  450    HE1  TYR  56           1HE      TYR  56   1.371  -2.677  11.249
  451    HE2  TYR  56           2HE      TYR  56  -2.850  -2.206  10.771
  452    HH   TYR  56           HH       TYR  56  -1.662  -3.220  12.678
  453    H    LEU  57           H        LEU  57   0.908  -1.180   4.044
  454    HA   LEU  57           HA       LEU  57   2.890  -3.163   3.557
  455   1HB   LEU  57          2HB       LEU  57   1.021  -2.134   2.000
  456   2HB   LEU  57          1HB       LEU  57   2.283  -0.990   1.592
  457    HG   LEU  57           HG       LEU  57   2.125  -2.838  -0.028
  458   1HD1  LEU  57          1HD2      LEU  57   4.464  -3.341  -0.157
  459   2HD1  LEU  57          2HD2      LEU  57   4.684  -2.962   1.550
  460   3HD1  LEU  57          3HD2      LEU  57   4.272  -1.681   0.408
  461   1HD2  LEU  57          1HD1      LEU  57   1.377  -4.566   1.568
  462   2HD2  LEU  57          2HD1      LEU  57   3.004  -4.606   2.248
  463   3HD2  LEU  57          3HD1      LEU  57   2.737  -5.088   0.574
  464    H    GLY  58           H        GLY  58   2.913   0.397   3.384
  465   1HA   GLY  58          2HA       GLY  58   5.600   0.880   3.003
  466   2HA   GLY  58          1HA       GLY  58   4.556   1.878   4.004
  467    H    GLN  59           H        GLN  59   3.961   0.003   6.022
  468    HA   GLN  59           HA       GLN  59   6.108   0.139   7.776
  469   1HB   GLN  59          2HB       GLN  59   3.822  -1.831   7.651
  470   2HB   GLN  59          1HB       GLN  59   4.978  -1.787   8.972
  471   1HG   GLN  59          2HG       GLN  59   2.991   0.317   8.188
  472   2HG   GLN  59          1HG       GLN  59   3.067  -0.608   9.685
  473   1HE2  GLN  59          1HE2      GLN  59   4.412   2.028   7.873
  474   2HE2  GLN  59          2HE2      GLN  59   5.309   2.732   9.171
  475    H    TYR  60           H        TYR  60   5.051  -2.701   5.877
  476    HA   TYR  60           HA       TYR  60   7.113  -4.352   6.807
  477   1HB   TYR  60          2HB       TYR  60   4.938  -5.047   5.668
  478   2HB   TYR  60          1HB       TYR  60   5.755  -4.714   4.144
  479    HD1  TYR  60           1HD      TYR  60   8.058  -5.916   3.815
  480    HD2  TYR  60           2HD      TYR  60   5.080  -7.149   6.585
  481    HE1  TYR  60           1HE      TYR  60   9.055  -8.163   3.875
  482    HE2  TYR  60           2HE      TYR  60   6.071  -9.398   6.663
  483    HH   TYR  60           HH       TYR  60   9.136 -10.103   5.384
  484    H    ILE  61           H        ILE  61   6.874  -2.416   3.835
  485    HA   ILE  61           HA       ILE  61   9.145  -3.205   2.494
  486    HB   ILE  61           HB       ILE  61   8.385  -0.300   2.765
  487   1HG1  ILE  61          1HG1      ILE  61   7.189  -2.187   0.748
  488   2HG1  ILE  61          2HG1      ILE  61   6.421  -1.889   2.306
  489   1HG2  ILE  61          1HG2      ILE  61   9.103  -0.268   0.366
  490   2HG2  ILE  61          2HG2      ILE  61   9.667  -1.925   0.580
  491   3HG2  ILE  61          3HG2      ILE  61  10.392  -0.621   1.519
  492   1HD1  ILE  61          1HD1      ILE  61   5.410  -0.460   0.702
  493   2HD1  ILE  61          2HD1      ILE  61   6.979   0.108   0.133
  494   3HD1  ILE  61          3HD1      ILE  61   6.419   0.537   1.751
  495    H    MET  62           H        MET  62   8.988  -0.415   4.697
  496    HA   MET  62           HA       MET  62  11.716  -0.013   5.028
  497   1HB   MET  62          1HB       MET  62   9.578   0.383   7.128
  498   2HB   MET  62          2HB       MET  62  11.153   1.162   7.086
  499   1HG   MET  62          1HG       MET  62  10.538   2.305   5.021
  500   2HG   MET  62          2HG       MET  62   8.961   1.520   5.057
  501   1HE   MET  62          1HE       MET  62  11.004   2.926   8.115
  502   2HE   MET  62          2HE       MET  62  10.376   4.570   8.219
  503   3HE   MET  62          3HE       MET  62  11.346   4.083   6.829
  504    H    THR  63           H        THR  63   9.657  -2.459   6.374
  505    HA   THR  63           HA       THR  63  11.576  -3.218   8.420
  506    HB   THR  63           HB       THR  63   8.978  -4.578   7.679
  507    HG1  THR  63           1HG      THR  63   8.219  -3.386   9.568
  508   1HG2  THR  63          1HG2      THR  63   9.113  -5.518   9.939
  509   2HG2  THR  63          2HG2      THR  63  10.666  -4.719  10.182
  510   3HG2  THR  63          3HG2      THR  63  10.508  -5.990   8.969
  511    H    LYS  64           H        LYS  64  12.394  -5.416   8.588
  512    HA   LYS  64           HA       LYS  64  13.392  -7.307   7.827
  513   1HB   LYS  64          2HB       LYS  64  11.127  -7.249   5.825
  514   2HB   LYS  64          1HB       LYS  64  12.148  -8.638   6.169
  515   1HG   LYS  64          2HG       LYS  64  10.417  -7.298   8.223
  516   2HG   LYS  64          1HG       LYS  64   9.920  -8.694   7.265
  517   1HD   LYS  64          1HD       LYS  64  11.818  -9.968   8.158
  518   2HD   LYS  64          2HD       LYS  64  12.285  -8.574   9.134
  519   1HE   LYS  64          2HE       LYS  64  11.050 -10.180  10.470
  520   2HE   LYS  64          1HE       LYS  64  10.143  -8.677  10.303
  521   1HZ   LYS  64          1HZ       LYS  64   8.812  -9.716   8.573
  522   2HZ   LYS  64          2HZ       LYS  64   8.717 -10.598  10.013
  523   3HZ   LYS  64          3HZ       LYS  64   9.679 -11.159   8.741
  524    H    ARG  65           H        ARG  65  13.864  -4.587   6.463
  525    HA   ARG  65           HA       ARG  65  15.282  -3.784   4.852
  526   1HB   ARG  65          2HB       ARG  65  16.651  -6.382   5.561
  527   2HB   ARG  65          1HB       ARG  65  17.420  -5.011   4.771
  528   1HG   ARG  65          2HG       ARG  65  16.993  -3.635   6.745
  529   2HG   ARG  65          1HG       ARG  65  16.228  -5.014   7.537
  530   1HD   ARG  65          1HD       ARG  65  18.528  -4.741   8.292
  531   2HD   ARG  65          2HD       ARG  65  18.325  -6.257   7.413
  532    HE   ARG  65           HE       ARG  65  19.171  -4.327   5.591
  533   1HH1  ARG  65          2HH1      ARG  65  20.378  -5.985   8.408
  534   2HH1  ARG  65          1HH1      ARG  65  22.035  -5.889   7.912
  535   1HH2  ARG  65          1HH2      ARG  65  21.349  -4.195   4.931
  536   2HH2  ARG  65          2HH2      ARG  65  22.588  -4.870   5.937
  537    H    LEU  66           H        LEU  66  13.270  -4.590   3.411
  538    HA   LEU  66           HA       LEU  66  14.397  -6.214   1.241
  539   1HB   LEU  66          1HB       LEU  66  11.689  -5.664   2.194
  540   2HB   LEU  66          2HB       LEU  66  11.851  -5.491   0.458
  541    HG   LEU  66           HG       LEU  66  11.149  -7.712   0.817
  542   1HD1  LEU  66          1HD1      LEU  66  14.138  -7.734   0.446
  543   2HD1  LEU  66          2HD1      LEU  66  12.922  -7.549  -0.821
  544   3HD1  LEU  66          3HD1      LEU  66  13.052  -9.071   0.063
  545   1HD2  LEU  66          1HD2      LEU  66  12.179  -9.251   2.370
  546   2HD2  LEU  66          2HD2      LEU  66  11.629  -7.806   3.221
  547   3HD2  LEU  66          3HD2      LEU  66  13.342  -8.015   2.858
  548    H    TYR  67           H        TYR  67  14.295  -3.074   2.210
  549    HA   TYR  67           HA       TYR  67  13.522  -1.728  -0.164
  550   1HB   TYR  67          1HB       TYR  67  14.414   0.268   0.883
  551   2HB   TYR  67          2HB       TYR  67  13.529  -0.672   2.079
  552    HD1  TYR  67           1HD      TYR  67  14.807  -2.025   3.761
  553    HD2  TYR  67           2HD      TYR  67  16.708   0.760   1.169
  554    HE1  TYR  67           1HE      TYR  67  16.773  -2.002   5.239
  555    HE2  TYR  67           2HE      TYR  67  18.677   0.791   2.636
  556    HH   TYR  67           HH       TYR  67  19.232   0.319   4.989
  557    H    ASP  68           H        ASP  68  15.497   0.099  -0.693
  558    HA   ASP  68           HA       ASP  68  17.210  -1.522  -2.364
  559   1HB   ASP  68          2HB       ASP  68  16.179   0.385  -3.400
  560   2HB   ASP  68          1HB       ASP  68  16.795   1.471  -2.158
  561    H    GLU  69           H        GLU  69  18.301   1.516  -0.989
  562    HA   GLU  69           HA       GLU  69  19.757   0.641   1.188
  563   1HB   GLU  69          1HB       GLU  69  22.059   0.540   0.330
  564   2HB   GLU  69          2HB       GLU  69  21.057  -0.730  -0.359
  565   1HG   GLU  69          2HG       GLU  69  20.807   0.572  -2.409
  566   2HG   GLU  69          1HG       GLU  69  21.811   1.847  -1.718
  567    H    LYS  70           H        LYS  70  19.408   2.838  -1.478
  568    HA   LYS  70           HA       LYS  70  21.151   4.850  -0.397
  569   1HB   LYS  70          1HB       LYS  70  19.141   4.982  -2.649
  570   2HB   LYS  70          2HB       LYS  70  20.292   6.249  -2.254
  571   1HG   LYS  70          1HG       LYS  70  22.139   4.711  -2.726
  572   2HG   LYS  70          2HG       LYS  70  20.971   3.457  -3.151
  573   1HD   LYS  70          1HD       LYS  70  20.118   4.854  -4.962
  574   2HD   LYS  70          2HD       LYS  70  21.266   6.125  -4.530
  575   1HE   LYS  70          2HE       LYS  70  21.967   3.344  -5.468
  576   2HE   LYS  70          1HE       LYS  70  22.063   4.819  -6.432
  577   1HZ   LYS  70          1HZ       LYS  70  24.223   4.190  -5.552
  578   2HZ   LYS  70          2HZ       LYS  70  23.627   4.261  -3.970
  579   3HZ   LYS  70          3HZ       LYS  70  23.723   5.671  -4.900
  580    H    GLN  71           H        GLN  71  17.749   5.271  -1.337
  581    HA   GLN  71           HA       GLN  71  17.372   6.835   1.127
  582   1HB   GLN  71          2HB       GLN  71  15.951   7.100  -1.528
  583   2HB   GLN  71          1HB       GLN  71  15.607   8.058  -0.095
  584   1HG   GLN  71          1HG       GLN  71  18.206   8.024  -1.613
  585   2HG   GLN  71          2HG       GLN  71  16.977   9.286  -1.685
  586   1HE2  GLN  71          2HE2      GLN  71  16.708  10.671   0.064
  587   2HE2  GLN  71          1HE2      GLN  71  17.902  10.830   1.301
  588    H    GLN  72           H        GLN  72  16.908   3.889   0.268
  589    HA   GLN  72           HA       GLN  72  15.503   2.209   0.880
  590   1HB   GLN  72          1HB       GLN  72  14.397   4.256   2.810
  591   2HB   GLN  72          2HB       GLN  72  14.261   2.508   2.945
  592   1HG   GLN  72          2HG       GLN  72  16.707   2.359   3.164
  593   2HG   GLN  72          1HG       GLN  72  16.800   4.119   3.098
  594   1HE2  GLN  72          2HE2      GLN  72  14.336   4.457   4.630
  595   2HE2  GLN  72          1HE2      GLN  72  14.741   4.096   6.269
  596    H    HIS  73           H        HIS  73  14.575   4.451  -1.051
  597    HA   HIS  73           HA       HIS  73  11.687   4.176  -0.868
  598   1HB   HIS  73          1HB       HIS  73  13.483   5.644  -2.806
  599   2HB   HIS  73          2HB       HIS  73  11.733   5.569  -2.982
  600    HD1  HIS  73           1HD      HIS  73  14.200   7.752  -1.764
  601    HD2  HIS  73           2HD      HIS  73  10.502   6.516  -0.328
  602    HE1  HIS  73           1HE      HIS  73  13.497   9.514  -0.113
  603    HE2  HIS  73           2HE      HIS  73  11.292   8.706   0.799
  604    H    ILE  74           H        ILE  74  14.319   3.169  -3.038
  605    HA   ILE  74           HA       ILE  74  12.566   1.516  -4.623
  606    HB   ILE  74           HB       ILE  74  15.581   1.390  -4.454
  607   1HG1  ILE  74          2HG1      ILE  74  14.871   3.659  -5.042
  608   2HG1  ILE  74          1HG1      ILE  74  15.591   2.856  -6.434
  609   1HG2  ILE  74          1HG2      ILE  74  15.410   0.400  -6.690
  610   2HG2  ILE  74          2HG2      ILE  74  13.652   0.467  -6.578
  611   3HG2  ILE  74          3HG2      ILE  74  14.566  -0.564  -5.478
  612   1HD1  ILE  74          1HD1      ILE  74  12.646   3.212  -5.933
  613   2HD1  ILE  74          2HD1      ILE  74  13.366   2.410  -7.328
  614   3HD1  ILE  74          3HD1      ILE  74  13.631   4.134  -7.068
  615    H    VAL  75           H        VAL  75  12.526  -0.803  -4.592
  616    HA   VAL  75           HA       VAL  75  13.357  -1.962  -2.024
  617    HB   VAL  75           HB       VAL  75  10.547  -2.324  -3.015
  618   1HG1  VAL  75          1HG1      VAL  75  10.136  -2.947  -0.683
  619   2HG1  VAL  75          2HG1      VAL  75  11.835  -2.657  -0.310
  620   3HG1  VAL  75          3HG1      VAL  75  11.385  -3.954  -1.416
  621   1HG2  VAL  75          1HG2      VAL  75  11.527  -0.212  -1.103
  622   2HG2  VAL  75          2HG2      VAL  75   9.836  -0.607  -1.409
  623   3HG2  VAL  75          3HG2      VAL  75  10.835   0.057  -2.701
  624    H    TYR  76           H        TYR  76  14.797  -3.279  -3.160
  625    HA   TYR  76           HA       TYR  76  14.065  -4.983  -5.283
  626   1HB   TYR  76          1HB       TYR  76  16.302  -5.127  -3.267
  627   2HB   TYR  76          2HB       TYR  76  16.136  -6.259  -4.607
  628    HD1  TYR  76           1HD      TYR  76  18.066  -5.746  -5.847
  629    HD2  TYR  76           2HD      TYR  76  15.418  -2.622  -4.706
  630    HE1  TYR  76           1HE      TYR  76  19.282  -4.191  -7.316
  631    HE2  TYR  76           2HE      TYR  76  16.624  -1.057  -6.165
  632    HH   TYR  76           HH       TYR  76  18.849  -0.826  -7.187
  633    H    CYS  77           H        CYS  77  13.105  -6.919  -5.347
  634    HA   CYS  77           HA       CYS  77  12.998  -8.723  -3.153
  635   1HB   CYS  77          2HB       CYS  77  10.530  -8.584  -2.771
  636   2HB   CYS  77          1HB       CYS  77  11.419  -7.174  -2.207
  637    HG   CYS  77           HG       CYS  77   8.773  -7.076  -3.878
  638    H    SER  78           H        SER  78  13.797  -9.902  -5.038
  639    HA   SER  78           HA       SER  78  11.881 -10.571  -7.103
  640   1HB   SER  78          2HB       SER  78  13.672 -12.040  -7.968
  641   2HB   SER  78          1HB       SER  78  14.250 -10.397  -7.693
  642    HG   SER  78           HG       SER  78  15.696 -11.976  -6.876
  643    H    ASN  79           H        ASN  79  12.572 -11.613  -3.986
  644    HA   ASN  79           HA       ASN  79  10.813 -13.900  -4.288
  645   1HB   ASN  79          1HB       ASN  79  13.622 -14.188  -3.199
  646   2HB   ASN  79          2HB       ASN  79  12.374 -15.427  -3.108
  647   1HD2  ASN  79          2HD2      ASN  79  11.742 -16.503  -4.978
  648   2HD2  ASN  79          1HD2      ASN  79  12.703 -16.482  -6.414
  649    H    ASP  80           H        ASP  80   9.723 -12.033  -3.084
  650    HA   ASP  80           HA       ASP  80  10.252 -12.296  -0.198
  651   1HB   ASP  80          1HB       ASP  80  11.150 -10.151  -1.069
  652   2HB   ASP  80          2HB       ASP  80   9.534  -9.727  -1.627
  653    H    LEU  81           H        LEU  81   8.373 -11.539   1.143
  654    HA   LEU  81           HA       LEU  81   5.882 -12.568   0.375
  655   1HB   LEU  81          2HB       LEU  81   6.579 -10.453   2.412
  656   2HB   LEU  81          1HB       LEU  81   4.984 -11.155   2.242
  657    HG   LEU  81           HG       LEU  81   6.078 -13.411   2.697
  658   1HD1  LEU  81          1HD1      LEU  81   8.384 -12.759   2.265
  659   2HD1  LEU  81          2HD1      LEU  81   8.196 -13.358   3.913
  660   3HD1  LEU  81          3HD1      LEU  81   8.326 -11.625   3.613
  661   1HD2  LEU  81          1HD2      LEU  81   6.103 -11.311   4.858
  662   2HD2  LEU  81          2HD2      LEU  81   6.072 -13.055   5.116
  663   3HD2  LEU  81          3HD2      LEU  81   4.707 -12.255   4.337
  664    H    LEU  82           H        LEU  82   7.227  -9.296   0.181
  665    HA   LEU  82           HA       LEU  82   5.074  -8.073  -1.153
  666   1HB   LEU  82          1HB       LEU  82   7.996  -7.578  -0.937
  667   2HB   LEU  82          2HB       LEU  82   7.151  -6.802  -2.261
  668    HG   LEU  82           HG       LEU  82   7.286  -5.274  -0.406
  669   1HD1  LEU  82          1HD2      LEU  82   4.853  -4.894   0.012
  670   2HD1  LEU  82          2HD2      LEU  82   4.529  -6.416  -0.819
  671   3HD1  LEU  82          3HD2      LEU  82   5.285  -5.079  -1.688
  672   1HD2  LEU  82          1HD1      LEU  82   5.902  -7.408   1.209
  673   2HD2  LEU  82          2HD1      LEU  82   6.259  -5.770   1.755
  674   3HD2  LEU  82          3HD1      LEU  82   7.576  -6.886   1.392
  675    H    GLY  83           H        GLY  83   7.576 -10.267  -2.214
  676   1HA   GLY  83          2HA       GLY  83   7.418 -10.033  -4.972
  677   2HA   GLY  83          1HA       GLY  83   7.719 -11.541  -4.119
  678    H    ASP  84           H        ASP  84   5.316 -11.921  -2.805
  679    HA   ASP  84           HA       ASP  84   3.557 -12.851  -4.807
  680   1HB   ASP  84          2HB       ASP  84   2.638 -12.155  -2.022
  681   2HB   ASP  84          1HB       ASP  84   2.075 -13.446  -3.078
  682    H    LEU  85           H        LEU  85   3.671  -9.851  -2.959
  683    HA   LEU  85           HA       LEU  85   1.177  -8.809  -3.721
  684   1HB   LEU  85          2HB       LEU  85   3.749  -7.407  -3.001
  685   2HB   LEU  85          1HB       LEU  85   2.218  -6.586  -3.213
  686    HG   LEU  85           HG       LEU  85   3.255  -7.570  -0.847
  687   1HD1  LEU  85          1HD1      LEU  85   1.102  -6.880   0.093
  688   2HD1  LEU  85          2HD1      LEU  85   0.410  -6.847  -1.529
  689   3HD1  LEU  85          3HD1      LEU  85   1.698  -5.721  -1.096
  690   1HD2  LEU  85          1HD2      LEU  85   0.990  -9.352  -1.719
  691   2HD2  LEU  85          2HD2      LEU  85   1.651  -9.253  -0.088
  692   3HD2  LEU  85          3HD2      LEU  85   2.652  -9.852  -1.411
  693    H    PHE  86           H        PHE  86   4.274  -7.520  -4.840
  694    HA   PHE  86           HA       PHE  86   3.006  -6.631  -7.301
  695   1HB   PHE  86          1HB       PHE  86   5.832  -6.174  -6.320
  696   2HB   PHE  86          2HB       PHE  86   5.050  -5.352  -7.666
  697    HD1  PHE  86           1HD      PHE  86   4.701  -5.911  -4.005
  698    HD2  PHE  86           2HD      PHE  86   3.993  -3.333  -7.315
  699    HE1  PHE  86           1HE      PHE  86   3.909  -4.163  -2.468
  700    HE2  PHE  86           2HE      PHE  86   3.200  -1.574  -5.784
  701    HZ   PHE  86           HZ       PHE  86   3.157  -1.994  -3.355
  702    H    GLY  87           H        GLY  87   6.066  -8.290  -6.506
  703   1HA   GLY  87          2HA       GLY  87   6.852 -10.217  -7.740
  704   2HA   GLY  87          1HA       GLY  87   5.888  -9.672  -9.106
  705    H    VAL  88           H        VAL  88   7.145  -6.936  -7.900
  706    HA   VAL  88           HA       VAL  88   8.989  -6.607 -10.034
  707    HB   VAL  88           HB       VAL  88   9.472  -4.430  -9.087
  708   1HG1  VAL  88          1HG2      VAL  88   7.209  -3.494  -8.987
  709   2HG1  VAL  88          2HG2      VAL  88   6.550  -5.122  -8.812
  710   3HG1  VAL  88          3HG2      VAL  88   7.377  -4.660 -10.300
  711   1HG2  VAL  88          1HG1      VAL  88   8.567  -3.724  -6.932
  712   2HG2  VAL  88          2HG1      VAL  88   9.665  -5.092  -6.743
  713   3HG2  VAL  88          3HG1      VAL  88   7.921  -5.343  -6.666
  714    HA   PRO  89           HA       PRO  89  12.795  -7.730  -7.861
  715   1HB   PRO  89          2HB       PRO  89  14.562  -6.569  -9.513
  716   2HB   PRO  89          1HB       PRO  89  13.693  -8.037  -9.975
  717   1HG   PRO  89          1HG       PRO  89  13.157  -5.193 -10.741
  718   2HG   PRO  89          2HG       PRO  89  13.109  -6.651 -11.750
  719   1HD   PRO  89          1HD       PRO  89  10.885  -5.457 -10.672
  720   2HD   PRO  89          2HD       PRO  89  10.981  -7.177 -11.096
  721    H    SER  90           H        SER  90  11.396  -4.714  -8.272
  722    HA   SER  90           HA       SER  90  12.512  -3.539  -5.985
  723   1HB   SER  90          2HB       SER  90  13.783  -1.683  -7.088
  724   2HB   SER  90          1HB       SER  90  14.563  -3.259  -7.201
  725    HG   SER  90           HG       SER  90  13.661  -1.632  -9.180
  726    H    PHE  91           H        PHE  91  11.187  -1.861  -5.358
  727    HA   PHE  91           HA       PHE  91   9.714  -0.447  -7.459
  728   1HB   PHE  91          1HB       PHE  91   7.594  -0.653  -6.399
  729   2HB   PHE  91          2HB       PHE  91   8.266  -2.270  -6.537
  730    HD1  PHE  91           1HD      PHE  91   7.546   0.476  -4.176
  731    HD2  PHE  91           2HD      PHE  91   8.674  -3.600  -4.631
  732    HE1  PHE  91           1HE      PHE  91   7.105   0.101  -1.795
  733    HE2  PHE  91           2HE      PHE  91   8.242  -3.987  -2.238
  734    HZ   PHE  91           HZ       PHE  91   7.458  -2.136  -0.816
  735    H    SER  92           H        SER  92   8.940   1.637  -6.896
  736    HA   SER  92           HA       SER  92  10.537   2.859  -4.767
  737   1HB   SER  92          1HB       SER  92  10.838   3.810  -6.998
  738   2HB   SER  92          2HB       SER  92   9.106   4.118  -7.119
  739    HG   SER  92           HG       SER  92   9.842   6.007  -6.407
  740    H    VAL  93           H        VAL  93   9.408   2.709  -2.913
  741    HA   VAL  93           HA       VAL  93   6.655   2.865  -2.560
  742    HB   VAL  93           HB       VAL  93   8.187   2.098  -0.808
  743   1HG1  VAL  93          1HG1      VAL  93   9.404   3.785   0.553
  744   2HG1  VAL  93          2HG1      VAL  93   9.001   4.992  -0.668
  745   3HG1  VAL  93          3HG1      VAL  93  10.016   3.612  -1.093
  746   1HG2  VAL  93          1HG2      VAL  93   6.518   4.468   0.026
  747   2HG2  VAL  93          2HG2      VAL  93   7.116   3.205   1.101
  748   3HG2  VAL  93          3HG2      VAL  93   5.951   2.809  -0.163
  749    H    LYS  94           H        LYS  94   9.021   5.390  -3.000
  750    HA   LYS  94           HA       LYS  94   7.592   7.556  -1.932
  751   1HB   LYS  94          2HB       LYS  94  10.060   7.369  -2.774
  752   2HB   LYS  94          1HB       LYS  94   9.382   7.868  -4.318
  753   1HG   LYS  94          1HG       LYS  94   8.994   9.423  -1.774
  754   2HG   LYS  94          2HG       LYS  94  10.331   9.704  -2.890
  755   1HD   LYS  94          2HD       LYS  94   7.416   9.844  -3.650
  756   2HD   LYS  94          1HD       LYS  94   8.405  11.241  -3.220
  757   1HE   LYS  94          2HE       LYS  94   9.918  10.732  -5.081
  758   2HE   LYS  94          1HE       LYS  94   8.911   9.351  -5.516
  759   1HZ   LYS  94          1HZ       LYS  94   7.079  10.862  -5.944
  760   2HZ   LYS  94          2HZ       LYS  94   8.421  11.282  -6.884
  761   3HZ   LYS  94          3HZ       LYS  94   8.035  12.189  -5.510
  762    H    GLU  95           H        GLU  95   7.765   6.323  -5.262
  763    HA   GLU  95           HA       GLU  95   5.831   8.133  -6.302
  764   1HB   GLU  95          2HB       GLU  95   6.770   5.455  -7.347
  765   2HB   GLU  95          1HB       GLU  95   5.790   6.602  -8.251
  766   1HG   GLU  95          1HG       GLU  95   8.572   7.113  -7.221
  767   2HG   GLU  95          2HG       GLU  95   8.151   6.691  -8.880
  768    H    HIS  96           H        HIS  96   4.164   7.936  -4.661
  769    HA   HIS  96           HA       HIS  96   2.939   5.412  -4.141
  770   1HB   HIS  96          1HB       HIS  96   1.347   6.692  -2.780
  771   2HB   HIS  96          2HB       HIS  96   3.007   7.161  -2.432
  772    HD1  HIS  96           1HD      HIS  96   0.297   8.891  -2.060
  773    HD2  HIS  96           2HD      HIS  96   3.209   9.340  -4.988
  774    HE1  HIS  96           1HE      HIS  96   0.105  11.274  -2.837
  775    HE2  HIS  96           2HE      HIS  96   1.937  11.550  -4.545
  776    H    ARG  97           H        ARG  97   2.418   7.899  -6.471
  777    HA   ARG  97           HA       ARG  97  -0.207   7.347  -7.255
  778   1HB   ARG  97          2HB       ARG  97   2.229   8.308  -8.716
  779   2HB   ARG  97          1HB       ARG  97   0.764   7.936  -9.612
  780   1HG   ARG  97          1HG       ARG  97   0.913   9.885  -7.322
  781   2HG   ARG  97          2HG       ARG  97   0.994  10.327  -9.030
  782   1HD   ARG  97          2HD       ARG  97  -1.225   9.284  -9.362
  783   2HD   ARG  97          1HD       ARG  97  -1.307   8.969  -7.629
  784    HE   ARG  97           HE       ARG  97  -0.863  11.644  -7.782
  785   1HH1  ARG  97          2HH1      ARG  97  -3.228   9.492  -9.167
  786   2HH1  ARG  97          1HH1      ARG  97  -4.478  10.690  -9.218
  787   1HH2  ARG  97          1HH2      ARG  97  -2.502  13.228  -7.845
  788   2HH2  ARG  97          2HH2      ARG  97  -4.065  12.814  -8.466
  789    H    LYS  98           H        LYS  98   2.766   6.033  -8.731
  790    HA   LYS  98           HA       LYS  98   1.319   4.022 -10.139
  791   1HB   LYS  98          1HB       LYS  98   4.289   4.308  -9.664
  792   2HB   LYS  98          2HB       LYS  98   3.546   3.203 -10.813
  793   1HG   LYS  98          1HG       LYS  98   2.646   5.090 -12.064
  794   2HG   LYS  98          2HG       LYS  98   3.361   6.208 -10.902
  795   1HD   LYS  98          1HD       LYS  98   4.872   6.177 -12.691
  796   2HD   LYS  98          2HD       LYS  98   5.595   5.111 -11.485
  797   1HE   LYS  98          1HE       LYS  98   3.916   4.161 -13.800
  798   2HE   LYS  98          2HE       LYS  98   5.677   4.231 -13.818
  799   1HZ   LYS  98          1HZ       LYS  98   5.660   2.727 -11.874
  800   2HZ   LYS  98          2HZ       LYS  98   5.002   2.029 -13.265
  801   3HZ   LYS  98          3HZ       LYS  98   3.982   2.575 -12.032
  802    H    ILE  99           H        ILE  99   3.347   4.040  -7.251
  803    HA   ILE  99           HA       ILE  99   3.659   1.261  -7.057
  804    HB   ILE  99           HB       ILE  99   4.871   3.264  -5.811
  805   1HG1  ILE  99          1HG1      ILE  99   5.346   0.721  -5.880
  806   2HG1  ILE  99          2HG1      ILE  99   6.032   1.664  -4.559
  807   1HG2  ILE  99          1HG2      ILE  99   4.287   3.246  -3.399
  808   2HG2  ILE  99          2HG2      ILE  99   2.806   2.382  -3.818
  809   3HG2  ILE  99          3HG2      ILE  99   3.082   4.010  -4.437
  810   1HD1  ILE  99          1HD1      ILE  99   3.546  -0.023  -4.416
  811   2HD1  ILE  99          2HD1      ILE  99   4.235   0.916  -3.093
  812   3HD1  ILE  99          3HD1      ILE  99   5.131  -0.444  -3.769
  813    H    TYR 100           H        TYR 100   1.165   3.399  -5.830
  814    HA   TYR 100           HA       TYR 100  -0.124   1.285  -4.353
  815   1HB   TYR 100          2HB       TYR 100  -0.877   4.140  -4.955
  816   2HB   TYR 100          1HB       TYR 100  -1.959   3.038  -4.106
  817    HD1  TYR 100           1HD      TYR 100  -1.393   5.316  -2.604
  818    HD2  TYR 100           2HD      TYR 100   1.105   1.916  -3.156
  819    HE1  TYR 100           1HE      TYR 100  -0.251   5.816  -0.483
  820    HE2  TYR 100           2HE      TYR 100   2.242   2.400  -1.046
  821    HH   TYR 100           HH       TYR 100   2.658   4.329   0.433
  822    H    THR 101           H        THR 101  -0.509   2.898  -7.464
  823    HA   THR 101           HA       THR 101  -2.925   1.742  -8.274
  824    HB   THR 101           HB       THR 101  -0.510   2.462  -9.948
  825    HG1  THR 101           1HG      THR 101  -1.698   4.370 -10.314
  826   1HG2  THR 101          1HG2      THR 101  -2.055   2.492 -11.851
  827   2HG2  THR 101          2HG2      THR 101  -3.350   1.900 -10.811
  828   3HG2  THR 101          3HG2      THR 101  -1.948   0.881 -11.139
  829    H    MET 102           H        MET 102   0.334   0.442  -8.157
  830    HA   MET 102           HA       MET 102  -0.279  -1.992  -9.525
  831   1HB   MET 102          2HB       MET 102   1.920  -1.507  -7.510
  832   2HB   MET 102          1HB       MET 102   1.849  -2.793  -8.706
  833   1HG   MET 102          2HG       MET 102   1.924  -1.058 -10.481
  834   2HG   MET 102          1HG       MET 102   2.164   0.144  -9.214
  835   1HE   MET 102          1HE       MET 102   3.918  -0.994  -7.161
  836   2HE   MET 102          2HE       MET 102   4.525   0.486  -7.901
  837   3HE   MET 102          3HE       MET 102   5.594  -0.902  -7.698
  838    H    ILE 103           H        ILE 103  -0.087  -1.034  -6.110
  839    HA   ILE 103           HA       ILE 103  -0.475  -3.521  -4.967
  840    HB   ILE 103           HB       ILE 103  -1.505  -0.876  -3.930
  841   1HG1  ILE 103          1HG1      ILE 103   1.082  -2.357  -3.401
  842   2HG1  ILE 103          2HG1      ILE 103   0.914  -0.876  -4.337
  843   1HG2  ILE 103          1HG2      ILE 103  -1.485  -1.951  -1.730
  844   2HG2  ILE 103          2HG2      ILE 103  -1.014  -3.476  -2.478
  845   3HG2  ILE 103          3HG2      ILE 103  -2.589  -2.769  -2.836
  846   1HD1  ILE 103          1HD1      ILE 103   1.766  -0.415  -2.119
  847   2HD1  ILE 103          2HD1      ILE 103   0.351  -1.182  -1.400
  848   3HD1  ILE 103          3HD1      ILE 103   0.170   0.303  -2.334
  849    H    TYR 104           H        TYR 104  -2.826  -1.307  -6.348
  850    HA   TYR 104           HA       TYR 104  -4.997  -3.145  -5.582
  851   1HB   TYR 104          2HB       TYR 104  -5.132  -0.202  -6.274
  852   2HB   TYR 104          1HB       TYR 104  -6.510  -1.212  -5.851
  853    HD1  TYR 104           1HD      TYR 104  -7.050  -1.660  -3.587
  854    HD2  TYR 104           2HD      TYR 104  -3.383   0.267  -4.550
  855    HE1  TYR 104           1HE      TYR 104  -6.712  -1.127  -1.210
  856    HE2  TYR 104           2HE      TYR 104  -3.032   0.802  -2.178
  857    HH   TYR 104           HH       TYR 104  -4.406   1.094  -0.139
  858    H    ARG 105           H        ARG 105  -6.947  -2.139  -7.302
  859    HA   ARG 105           HA       ARG 105  -7.811  -2.354  -9.388
  860   1HB   ARG 105          1HB       ARG 105  -6.157  -0.575  -9.895
  861   2HB   ARG 105          2HB       ARG 105  -4.982  -1.815 -10.311
  862   1HG   ARG 105          1HG       ARG 105  -5.954  -0.913 -12.316
  863   2HG   ARG 105          2HG       ARG 105  -6.471  -2.588 -12.113
  864   1HD   ARG 105          2HD       ARG 105  -8.603  -1.818 -11.194
  865   2HD   ARG 105          1HD       ARG 105  -8.086  -0.145 -11.395
  866    HE   ARG 105           HE       ARG 105  -7.888  -1.383 -13.877
  867   1HH1  ARG 105          2HH1      ARG 105 -10.365  -0.533 -11.579
  868   2HH1  ARG 105          1HH1      ARG 105 -11.595  -0.341 -12.783
  869   1HH2  ARG 105          1HH2      ARG 105  -9.500  -1.131 -15.469
  870   2HH2  ARG 105          2HH2      ARG 105 -11.105  -0.680 -14.992
  871    H    ASN 106           H        ASN 106  -8.129  -4.617  -8.834
  872    HA   ASN 106           HA       ASN 106  -6.909  -6.282 -10.883
  873   1HB   ASN 106          1HB       ASN 106  -6.921  -7.069  -7.960
  874   2HB   ASN 106          2HB       ASN 106  -6.508  -8.145  -9.291
  875   1HD2  ASN 106          2HD2      ASN 106  -4.575  -7.853 -10.394
  876   2HD2  ASN 106          1HD2      ASN 106  -3.288  -6.896  -9.752
  877    H    LEU 107           H        LEU 107  -8.728  -7.383  -8.071
  878    HA   LEU 107           HA       LEU 107 -11.180  -7.535  -9.654
  879   1HB   LEU 107          1HB       LEU 107  -9.978  -9.910  -8.227
  880   2HB   LEU 107          2HB       LEU 107 -11.552  -9.877  -8.995
  881    HG   LEU 107           HG       LEU 107 -10.151  -9.248 -11.135
  882   1HD1  LEU 107          1HD1      LEU 107  -7.976 -10.356 -11.169
  883   2HD1  LEU 107          2HD1      LEU 107  -8.137 -10.733  -9.454
  884   3HD1  LEU 107          3HD1      LEU 107  -8.012  -9.054  -9.978
  885   1HD2  LEU 107          1HD2      LEU 107 -10.273 -12.037  -9.996
  886   2HD2  LEU 107          2HD2      LEU 107 -10.025 -11.625 -11.694
  887   3HD2  LEU 107          3HD2      LEU 107 -11.551 -11.225 -10.901
  888    H    VAL 108           H        VAL 108 -10.266  -5.944  -7.359
  889    HA   VAL 108           HA       VAL 108 -12.383  -6.616  -5.471
  890    HB   VAL 108           HB       VAL 108 -10.178  -7.751  -4.792
  891   1HG1  VAL 108          1HG2      VAL 108  -8.692  -5.885  -5.279
  892   2HG1  VAL 108          2HG2      VAL 108  -8.586  -6.347  -3.580
  893   3HG1  VAL 108          3HG2      VAL 108  -9.495  -4.910  -4.047
  894   1HG2  VAL 108          1HG1      VAL 108 -11.512  -5.892  -2.827
  895   2HG2  VAL 108          2HG1      VAL 108 -10.570  -7.328  -2.429
  896   3HG2  VAL 108          3HG1      VAL 108 -12.097  -7.488  -3.295
  897    H    VAL 109           H        VAL 109 -12.040  -4.851  -3.518
  898    HA   VAL 109           HA       VAL 109 -12.172  -2.668  -2.893
  899    HB   VAL 109           HB       VAL 109 -10.773  -2.025  -5.495
  900   1HG1  VAL 109          1HG1      VAL 109 -11.952  -0.111  -4.560
  901   2HG1  VAL 109          2HG1      VAL 109 -10.207   0.095  -4.408
  902   3HG1  VAL 109          3HG1      VAL 109 -11.167  -0.371  -3.003
  903   1HG2  VAL 109          1HG2      VAL 109  -8.745  -1.843  -4.104
  904   2HG2  VAL 109          2HG2      VAL 109  -9.398  -3.480  -4.140
  905   3HG2  VAL 109          3HG2      VAL 109  -9.658  -2.459  -2.727
  906    H    VAL 110           H        VAL 110 -13.823  -1.242  -2.983
  907    HA   VAL 110           HA       VAL 110 -15.793  -1.653  -5.064
  908    HB   VAL 110           HB       VAL 110 -15.906   0.137  -2.631
  909   1HG1  VAL 110          1HG2      VAL 110 -17.454   0.850  -4.369
  910   2HG1  VAL 110          2HG2      VAL 110 -18.329   0.135  -3.014
  911   3HG1  VAL 110          3HG2      VAL 110 -18.089  -0.791  -4.497
  912   1HG2  VAL 110          1HG1      VAL 110 -15.660  -2.204  -2.016
  913   2HG2  VAL 110          2HG1      VAL 110 -17.004  -2.639  -3.071
  914   3HG2  VAL 110          3HG1      VAL 110 -17.288  -1.635  -1.649
  915    H    ASN 111           H        ASN 111 -15.420  -0.610  -6.927
  916    HA   ASN 111           HA       ASN 111 -15.216   2.301  -6.834
  917   1HB   ASN 111          1HB       ASN 111 -12.899   1.525  -7.047
  918   2HB   ASN 111          2HB       ASN 111 -13.342   0.557  -8.450
  919   1HD2  ASN 111          2HD2      ASN 111 -12.797   3.761  -7.231
  920   2HD2  ASN 111          1HD2      ASN 111 -12.719   4.551  -8.767
  921    H    GLN 112           H        GLN 112 -15.443  -0.542  -8.961
  922    HA   GLN 112           HA       GLN 112 -17.250   0.981 -10.709
  923   1HB   GLN 112          2HB       GLN 112 -15.748  -1.594 -11.221
  924   2HB   GLN 112          1HB       GLN 112 -16.828  -0.812 -12.368
  925   1HG   GLN 112          2HG       GLN 112 -14.289   0.369 -11.261
  926   2HG   GLN 112          1HG       GLN 112 -14.484  -0.351 -12.858
  927   1HE2  GLN 112          2HE2      GLN 112 -15.658   0.746 -14.429
  928   2HE2  GLN 112          1HE2      GLN 112 -16.031   2.427 -14.292
  929    H    GLN 113           H        GLN 113 -16.900  -2.378  -9.546
  930    HA   GLN 113           HA       GLN 113 -19.816  -2.651  -9.631
  931   1HB   GLN 113          1HB       GLN 113 -18.494  -4.368 -10.789
  932   2HB   GLN 113          2HB       GLN 113 -17.664  -4.749  -9.287
  933   1HG   GLN 113          2HG       GLN 113 -19.775  -5.478  -8.300
  934   2HG   GLN 113          1HG       GLN 113 -20.608  -5.097  -9.809
  935   1HE2  GLN 113          2HE2      GLN 113 -18.412  -7.260  -8.210
  936   2HE2  GLN 113          1HE2      GLN 113 -18.451  -8.509  -9.403
  937    H    GLU 114           H        GLU 114 -20.685  -1.889  -7.791
  938    HA   GLU 114           HA       GLU 114 -19.424  -2.549  -5.232
  939   1HB   GLU 114          1HB       GLU 114 -20.981  -0.894  -4.274
  940   2HB   GLU 114          2HB       GLU 114 -19.991  -0.208  -5.555
  941   1HG   GLU 114          2HG       GLU 114 -21.856  -0.425  -7.116
  942   2HG   GLU 114          1HG       GLU 114 -22.848  -1.117  -5.833
  943    H    SER 115           H        SER 115 -20.979  -3.066  -3.414
  944    HA   SER 115           HA       SER 115 -23.331  -4.570  -4.258
  945   1HB   SER 115          2HB       SER 115 -21.078  -5.811  -2.660
  946   2HB   SER 115          1HB       SER 115 -22.639  -6.568  -2.978
  947    HG   SER 115           HG       SER 115 -22.142  -6.581  -5.172
  948    H    SER 116           H        SER 116 -22.258  -2.227  -2.449
  949    HA   SER 116           HA       SER 116 -23.534  -2.998   0.066
  950   1HB   SER 116          2HB       SER 116 -22.632  -0.864   0.928
  951   2HB   SER 116          1HB       SER 116 -21.367  -1.871   0.223
  952    HG   SER 116           HG       SER 116 -21.089  -0.457  -1.331
  953    H    ASP 117           H        ASP 117 -24.707  -0.929   1.083
  954    HA   ASP 117           HA       ASP 117 -26.610   0.314   1.113
  955   1HB   ASP 117          1HB       ASP 117 -25.841   0.885  -1.758
  956   2HB   ASP 117          2HB       ASP 117 -27.037   1.783  -0.827
  957    H    SER 118           H        SER 118 -28.700   0.767  -0.441
  958    HA   SER 118           HA       SER 118 -29.516  -1.760  -1.668
  959   1HB   SER 118          1HB       SER 118 -31.636  -1.761  -0.401
  960   2HB   SER 118          2HB       SER 118 -30.241  -1.933   0.663
  961    HG   SER 118           HG       SER 118 -31.714   0.442   0.166
  962    H    SER 119           H        SER 119 -30.369  -1.341  -3.585
  963    HA   SER 119           HA       SER 119 -32.034   1.046  -3.924
  964   1HB   SER 119          1HB       SER 119 -30.950   1.503  -6.115
  965   2HB   SER 119          2HB       SER 119 -29.844   1.697  -4.755
  966    HG   SER 119           HG       SER 119 -29.926  -0.300  -6.720
  Start of MODEL   11
    1   1H    MET   1          1H        MET   1 -18.476  21.726  12.412
    2   2H    MET   1          2H        MET   1 -17.779  23.261  12.542
    3   3H    MET   1          3H        MET   1 -19.201  22.906  13.387
    4    HA   MET   1           HA       MET   1 -16.560  21.647  13.846
    5   1HB   MET   1          1HB       MET   1 -16.596  22.871  15.985
    6   2HB   MET   1          2HB       MET   1 -16.592  23.960  14.605
    7   1HG   MET   1          2HG       MET   1 -18.997  24.294  14.863
    8   2HG   MET   1          1HG       MET   1 -18.998  23.203  16.249
    9   1HE   MET   1          1HE       MET   1 -17.757  23.727  18.542
   10   2HE   MET   1          2HE       MET   1 -16.808  25.187  18.827
   11   3HE   MET   1          3HE       MET   1 -16.249  23.984  17.664
   12    H    CYS   2           H        CYS   2 -19.313  20.518  13.378
   13    HA   CYS   2           HA       CYS   2 -19.447  18.971  15.873
   14   1HB   CYS   2          2HB       CYS   2 -21.919  18.888  15.644
   15   2HB   CYS   2          1HB       CYS   2 -21.313  20.514  15.938
   16    HG   CYS   2           HG       CYS   2 -22.238  19.328  12.864
   17    H    ASN   3           H        ASN   3 -17.963  17.850  14.133
   18    HA   ASN   3           HA       ASN   3 -17.599  16.010  12.857
   19   1HB   ASN   3          2HB       ASN   3 -19.057  14.899  14.510
   20   2HB   ASN   3          1HB       ASN   3 -20.466  15.323  13.541
   21   1HD2  ASN   3          2HD2      ASN   3 -17.644  13.314  13.777
   22   2HD2  ASN   3          1HD2      ASN   3 -18.083  12.202  12.530
   23    H    THR   4           H        THR   4 -21.041  16.241  12.059
   24    HA   THR   4           HA       THR   4 -20.396  16.430   9.244
   25    HB   THR   4           HB       THR   4 -22.842  16.346   8.891
   26    HG1  THR   4           1HG      THR   4 -23.838  17.215  10.595
   27   1HG2  THR   4          1HG2      THR   4 -21.803  14.263  10.817
   28   2HG2  THR   4          2HG2      THR   4 -21.584  14.258   9.067
   29   3HG2  THR   4          3HG2      THR   4 -23.197  14.077   9.754
   30    H    ASN   5           H        ASN   5 -21.586  18.040   7.876
   31    HA   ASN   5           HA       ASN   5 -22.172  20.574   9.183
   32   1HB   ASN   5          2HB       ASN   5 -19.757  20.690   8.761
   33   2HB   ASN   5          1HB       ASN   5 -20.028  20.311   7.062
   34   1HD2  ASN   5          2HD2      ASN   5 -19.090  22.213   6.367
   35   2HD2  ASN   5          1HD2      ASN   5 -19.861  23.748   6.549
   36    H    MET   6           H        MET   6 -24.204  20.778   8.447
   37    HA   MET   6           HA       MET   6 -24.811  20.168   5.661
   38   1HB   MET   6          1HB       MET   6 -26.632  20.975   7.936
   39   2HB   MET   6          2HB       MET   6 -27.162  20.490   6.331
   40   1HG   MET   6          2HG       MET   6 -26.201  18.274   6.682
   41   2HG   MET   6          1HG       MET   6 -25.670  18.760   8.290
   42   1HE   MET   6          1HE       MET   6 -28.594  16.258   9.042
   43   2HE   MET   6          2HE       MET   6 -26.898  16.642   9.334
   44   3HE   MET   6          3HE       MET   6 -27.428  16.159   7.723
   45    H    SER   7           H        SER   7 -23.502  22.000   4.907
   46    HA   SER   7           HA       SER   7 -25.163  24.253   4.350
   47   1HB   SER   7          2HB       SER   7 -23.686  25.978   5.321
   48   2HB   SER   7          1HB       SER   7 -24.382  24.940   6.567
   49    HG   SER   7           HG       SER   7 -22.310  23.705   6.266
   50    H    VAL   8           H        VAL   8 -21.731  23.297   4.490
   51    HA   VAL   8           HA       VAL   8 -21.488  24.118   1.668
   52    HB   VAL   8           HB       VAL   8 -19.310  24.074   3.763
   53   1HG1  VAL   8          1HG1      VAL   8 -19.259  25.006   0.894
   54   2HG1  VAL   8          2HG1      VAL   8 -18.469  23.565   1.534
   55   3HG1  VAL   8          3HG1      VAL   8 -17.939  25.166   2.052
   56   1HG2  VAL   8          1HG2      VAL   8 -20.874  25.884   4.162
   57   2HG2  VAL   8          2HG2      VAL   8 -20.748  26.391   2.478
   58   3HG2  VAL   8          3HG2      VAL   8 -19.351  26.523   3.545
   59    HA   PRO   9           HA       PRO   9 -21.066  19.602   1.337
   60   1HB   PRO   9          2HB       PRO   9 -20.811  20.389  -1.516
   61   2HB   PRO   9          1HB       PRO   9 -21.860  19.179  -0.771
   62   1HG   PRO   9          1HG       PRO   9 -22.851  21.502  -1.622
   63   2HG   PRO   9          2HG       PRO   9 -23.439  20.752  -0.128
   64   1HD   PRO   9          1HD       PRO   9 -21.559  23.049  -0.486
   65   2HD   PRO   9          2HD       PRO   9 -22.838  22.817   0.724
   66    H    THR  10           H        THR  10 -19.053  22.101  -0.103
   67    HA   THR  10           HA       THR  10 -16.660  20.694   0.590
   68    HB   THR  10           HB       THR  10 -17.100  19.484  -1.456
   69    HG1  THR  10           1HG      THR  10 -15.214  20.815  -2.687
   70   1HG2  THR  10          1HG2      THR  10 -17.235  22.189  -2.795
   71   2HG2  THR  10          2HG2      THR  10 -18.591  21.089  -2.540
   72   3HG2  THR  10          3HG2      THR  10 -17.274  20.631  -3.620
   73    H    ASP  11           H        ASP  11 -14.900  22.035   0.690
   74    HA   ASP  11           HA       ASP  11 -15.131  24.725  -0.440
   75   1HB   ASP  11          2HB       ASP  11 -15.988  24.900   1.849
   76   2HB   ASP  11          1HB       ASP  11 -14.518  24.154   2.468
   77    H    GLY  12           H        GLY  12 -13.439  24.615  -1.811
   78   1HA   GLY  12          2HA       GLY  12 -11.182  24.916  -2.308
   79   2HA   GLY  12          1HA       GLY  12 -10.785  24.491  -0.650
   80    H    ALA  13           H        ALA  13  -9.347  22.884  -0.818
   81    HA   ALA  13           HA       ALA  13 -10.161  20.498  -2.333
   82   1HB   ALA  13          1HB       ALA  13  -8.441  21.685  -3.604
   83   2HB   ALA  13          2HB       ALA  13  -7.852  20.129  -3.017
   84   3HB   ALA  13          3HB       ALA  13  -7.363  21.619  -2.209
   85    H    VAL  14           H        VAL  14 -10.067  18.649  -1.226
   86    HA   VAL  14           HA       VAL  14  -9.525  18.661   1.545
   87    HB   VAL  14           HB       VAL  14 -11.015  17.025   1.196
   88   1HG1  VAL  14          1HG2      VAL  14 -11.187  15.633  -0.819
   89   2HG1  VAL  14          2HG2      VAL  14  -9.708  16.366  -1.437
   90   3HG1  VAL  14          3HG2      VAL  14 -11.150  17.355  -1.204
   91   1HG2  VAL  14          1HG1      VAL  14  -8.517  15.433   0.673
   92   2HG2  VAL  14          2HG1      VAL  14 -10.073  14.768   1.170
   93   3HG2  VAL  14          3HG1      VAL  14  -9.189  15.843   2.252
   94    H    THR  15           H        THR  15  -8.034  17.273   2.669
   95    HA   THR  15           HA       THR  15  -5.384  17.422   1.401
   96    HB   THR  15           HB       THR  15  -6.064  17.280   4.345
   97    HG1  THR  15           1HG      THR  15  -4.869  19.549   3.318
   98   1HG2  THR  15          1HG2      THR  15  -3.867  16.339   3.841
   99   2HG2  THR  15          2HG2      THR  15  -3.707  17.881   4.681
  100   3HG2  THR  15          3HG2      THR  15  -3.440  17.795   2.941
  101    H    THR  16           H        THR  16  -4.982  15.495   0.466
  102    HA   THR  16           HA       THR  16  -5.721  13.020   1.802
  103    HB   THR  16           HB       THR  16  -4.320  13.418  -0.851
  104    HG1  THR  16           1HG      THR  16  -6.651  14.164  -0.446
  105   1HG2  THR  16          1HG2      THR  16  -3.948  11.198   0.114
  106   2HG2  THR  16          2HG2      THR  16  -5.001  11.107  -1.298
  107   3HG2  THR  16          3HG2      THR  16  -5.686  10.993   0.322
  108    H    SER  17           H        SER  17  -4.234  11.382   2.364
  109    HA   SER  17           HA       SER  17  -1.982  12.158   3.750
  110   1HB   SER  17          1HB       SER  17  -3.057   9.983   4.083
  111   2HB   SER  17          2HB       SER  17  -2.527   9.461   2.483
  112    HG   SER  17           HG       SER  17  -1.092   8.684   4.019
  113    H    GLN  18           H        GLN  18  -1.844  10.288   0.709
  114    HA   GLN  18           HA       GLN  18   0.227  12.065  -0.298
  115   1HB   GLN  18          2HB       GLN  18   1.454  10.281   0.922
  116   2HB   GLN  18          1HB       GLN  18   0.639   9.078  -0.073
  117   1HG   GLN  18          2HG       GLN  18   2.891   9.489  -0.869
  118   2HG   GLN  18          1HG       GLN  18   1.689   9.974  -2.066
  119   1HE2  GLN  18          1HE2      GLN  18   3.107  11.367  -3.094
  120   2HE2  GLN  18          2HE2      GLN  18   3.595  12.874  -2.400
  121    H    ILE  19           H        ILE  19  -1.875   9.276  -0.756
  122    HA   ILE  19           HA       ILE  19  -0.939   8.841  -3.378
  123    HB   ILE  19           HB       ILE  19  -2.340   6.958  -3.471
  124   1HG1  ILE  19          1HG1      ILE  19  -3.965   7.787  -1.094
  125   2HG1  ILE  19          2HG1      ILE  19  -4.382   8.401  -2.692
  126   1HG2  ILE  19          1HG2      ILE  19  -0.645   6.572  -1.896
  127   2HG2  ILE  19          2HG2      ILE  19  -2.130   5.947  -1.172
  128   3HG2  ILE  19          3HG2      ILE  19  -1.483   7.502  -0.650
  129   1HD1  ILE  19          1HD1      ILE  19  -4.432   6.009  -3.466
  130   2HD1  ILE  19          2HD1      ILE  19  -5.705   6.489  -2.342
  131   3HD1  ILE  19          3HD1      ILE  19  -4.327   5.550  -1.765
  132    HA   PRO  20           HA       PRO  20  -4.320  10.804  -5.754
  133   1HB   PRO  20          2HB       PRO  20  -5.314   8.811  -7.312
  134   2HB   PRO  20          1HB       PRO  20  -3.794   9.637  -7.665
  135   1HG   PRO  20          2HG       PRO  20  -4.259   6.978  -6.386
  136   2HG   PRO  20          1HG       PRO  20  -3.018   7.461  -7.555
  137   1HD   PRO  20          1HD       PRO  20  -2.558   7.217  -4.879
  138   2HD   PRO  20          2HD       PRO  20  -1.646   8.317  -5.922
  139    H    ALA  21           H        ALA  21  -6.626   9.033  -6.616
  140    HA   ALA  21           HA       ALA  21  -8.701   8.479  -5.847
  141   1HB   ALA  21          1HB       ALA  21  -7.109   7.401  -3.523
  142   2HB   ALA  21          2HB       ALA  21  -7.434   6.549  -5.031
  143   3HB   ALA  21          3HB       ALA  21  -8.762   6.956  -3.944
  144    H    SER  22           H        SER  22  -9.498   8.291  -3.020
  145    HA   SER  22           HA       SER  22  -9.511  11.157  -2.349
  146   1HB   SER  22          1HB       SER  22 -11.743  10.214  -2.683
  147   2HB   SER  22          2HB       SER  22 -11.416   8.969  -1.478
  148    HG   SER  22           HG       SER  22 -12.575  11.082  -0.898
  149    H    GLU  23           H        GLU  23 -10.340   8.641  -0.079
  150    HA   GLU  23           HA       GLU  23  -7.843   8.310   1.169
  151   1HB   GLU  23          2HB       GLU  23  -8.063  10.655   1.778
  152   2HB   GLU  23          1HB       GLU  23  -9.671  10.364   2.423
  153   1HG   GLU  23          1HG       GLU  23  -8.719   8.938   4.161
  154   2HG   GLU  23          2HG       GLU  23  -7.105   9.222   3.510
  155    H    GLN  24           H        GLN  24  -8.006   6.451   2.270
  156    HA   GLN  24           HA       GLN  24  -8.911   4.597   3.232
  157   1HB   GLN  24          2HB       GLN  24 -10.550   6.809   4.319
  158   2HB   GLN  24          1HB       GLN  24 -11.222   5.193   4.482
  159   1HG   GLN  24          1HG       GLN  24  -8.421   5.815   5.339
  160   2HG   GLN  24          2HG       GLN  24  -9.801   6.123   6.394
  161   1HE2  GLN  24          1HE2      GLN  24  -7.911   3.680   4.786
  162   2HE2  GLN  24          2HE2      GLN  24  -8.488   2.342   5.713
  163    H    GLU  25           H        GLU  25 -12.057   6.134   2.666
  164    HA   GLU  25           HA       GLU  25 -13.533   6.070   0.951
  165   1HB   GLU  25          2HB       GLU  25 -12.666   6.203  -1.207
  166   2HB   GLU  25          1HB       GLU  25 -11.330   6.733  -0.199
  167   1HG   GLU  25          2HG       GLU  25 -10.386   4.444  -0.333
  168   2HG   GLU  25          1HG       GLU  25 -11.675   4.024  -1.458
  169    H    THR  26           H        THR  26 -12.283   3.297   2.152
  170    HA   THR  26           HA       THR  26 -14.055   1.584   0.599
  171    HB   THR  26           HB       THR  26 -11.802   1.656  -0.560
  172    HG1  THR  26           1HG      THR  26 -12.891  -0.112  -1.133
  173   1HG2  THR  26          1HG2      THR  26 -10.972   0.089   1.874
  174   2HG2  THR  26          2HG2      THR  26 -10.411   1.707   1.451
  175   3HG2  THR  26          3HG2      THR  26 -10.007   0.335   0.419
  176    H    LEU  27           H        LEU  27 -13.821  -0.791   1.481
  177    HA   LEU  27           HA       LEU  27 -12.036  -0.910   3.747
  178   1HB   LEU  27          1HB       LEU  27 -14.665  -0.950   4.348
  179   2HB   LEU  27          2HB       LEU  27 -14.418  -2.653   4.008
  180    HG   LEU  27           HG       LEU  27 -14.091  -2.472   6.323
  181   1HD1  LEU  27          1HD1      LEU  27 -11.397  -2.297   4.981
  182   2HD1  LEU  27          2HD1      LEU  27 -12.326  -3.765   5.318
  183   3HD1  LEU  27          3HD1      LEU  27 -11.653  -2.820   6.650
  184   1HD2  LEU  27          1HD2      LEU  27 -14.010  -0.016   6.401
  185   2HD2  LEU  27          2HD2      LEU  27 -12.345  -0.066   5.819
  186   3HD2  LEU  27          3HD2      LEU  27 -12.750  -0.755   7.390
  187    H    VAL  28           H        VAL  28 -10.546  -1.882   2.412
  188    HA   VAL  28           HA       VAL  28 -11.576  -3.308   0.182
  189    HB   VAL  28           HB       VAL  28  -8.962  -2.185   0.955
  190   1HG1  VAL  28          1HG2      VAL  28  -9.165  -4.383  -1.100
  191   2HG1  VAL  28          2HG2      VAL  28  -8.281  -4.466   0.424
  192   3HG1  VAL  28          3HG2      VAL  28  -7.762  -3.347  -0.837
  193   1HG2  VAL  28          1HG1      VAL  28  -9.106  -1.239  -1.243
  194   2HG2  VAL  28          2HG1      VAL  28 -10.671  -1.066  -0.441
  195   3HG2  VAL  28          3HG1      VAL  28 -10.433  -2.325  -1.657
  196    H    ARG  29           H        ARG  29 -11.140  -5.348  -0.527
  197    HA   ARG  29           HA       ARG  29  -9.715  -7.119   1.283
  198   1HB   ARG  29          1HB       ARG  29 -12.265  -8.048  -0.011
  199   2HB   ARG  29          2HB       ARG  29 -11.399  -8.766   1.339
  200   1HG   ARG  29          2HG       ARG  29 -12.067  -6.942   2.783
  201   2HG   ARG  29          1HG       ARG  29 -12.858  -6.127   1.430
  202   1HD   ARG  29          2HD       ARG  29 -14.477  -7.302   2.833
  203   2HD   ARG  29          1HD       ARG  29 -14.416  -7.988   1.210
  204    HE   ARG  29           HE       ARG  29 -12.668  -9.410   2.892
  205   1HH1  ARG  29          2HH1      ARG  29 -16.073  -8.916   2.341
  206   2HH1  ARG  29          1HH1      ARG  29 -16.527 -10.478   2.936
  207   1HH2  ARG  29          1HH2      ARG  29 -13.256 -11.468   3.677
  208   2HH2  ARG  29          2HH2      ARG  29 -14.925 -11.928   3.694
  209    HA   PRO  30           HA       PRO  30  -8.338  -7.454  -3.008
  210   1HB   PRO  30          2HB       PRO  30  -5.641  -7.761  -2.148
  211   2HB   PRO  30          1HB       PRO  30  -6.415  -6.297  -2.751
  212   1HG   PRO  30          1HG       PRO  30  -5.502  -6.680  -0.155
  213   2HG   PRO  30          2HG       PRO  30  -6.665  -5.444  -0.663
  214   1HD   PRO  30          1HD       PRO  30  -7.152  -8.087   0.635
  215   2HD   PRO  30          2HD       PRO  30  -7.994  -6.542   0.869
  216    H    LYS  31           H        LYS  31  -7.101  -9.028  -4.293
  217    HA   LYS  31           HA       LYS  31  -7.431 -11.722  -3.661
  218   1HB   LYS  31          2HB       LYS  31  -5.696 -12.132  -5.419
  219   2HB   LYS  31          1HB       LYS  31  -7.004 -11.077  -5.933
  220   1HG   LYS  31          1HG       LYS  31  -5.576  -9.128  -5.571
  221   2HG   LYS  31          2HG       LYS  31  -4.262 -10.189  -5.056
  222   1HD   LYS  31          2HD       LYS  31  -5.578 -10.274  -7.769
  223   2HD   LYS  31          1HD       LYS  31  -4.060  -9.448  -7.414
  224   1HE   LYS  31          1HE       LYS  31  -3.067 -11.575  -6.719
  225   2HE   LYS  31          2HE       LYS  31  -4.584 -12.401  -7.076
  226   1HZ   LYS  31          1HZ       LYS  31  -4.348 -11.756  -9.393
  227   2HZ   LYS  31          2HZ       LYS  31  -3.003 -12.645  -8.881
  228   3HZ   LYS  31          3HZ       LYS  31  -2.892 -10.967  -9.051
  229    HA   PRO  32           HA       PRO  32  -4.853 -11.981  -0.125
  230   1HB   PRO  32          2HB       PRO  32  -4.655 -14.851  -0.928
  231   2HB   PRO  32          1HB       PRO  32  -5.078 -14.146   0.637
  232   1HG   PRO  32          1HG       PRO  32  -6.963 -15.157  -0.944
  233   2HG   PRO  32          2HG       PRO  32  -7.255 -13.671  -0.020
  234   1HD   PRO  32          1HD       PRO  32  -6.706 -14.020  -2.930
  235   2HD   PRO  32          2HD       PRO  32  -7.736 -12.831  -2.107
  236    H    LEU  33           H        LEU  33  -3.090 -10.791  -1.110
  237    HA   LEU  33           HA       LEU  33  -0.942 -12.055  -2.438
  238   1HB   LEU  33          1HB       LEU  33  -0.960  -9.657  -0.612
  239   2HB   LEU  33          2HB       LEU  33   0.410 -10.155  -1.585
  240    HG   LEU  33           HG       LEU  33  -2.255  -9.144  -2.576
  241   1HD1  LEU  33          1HD1      LEU  33  -0.881  -7.364  -3.557
  242   2HD1  LEU  33          2HD1      LEU  33   0.551  -8.068  -2.803
  243   3HD1  LEU  33          3HD1      LEU  33  -0.744  -7.413  -1.799
  244   1HD2  LEU  33          1HD2      LEU  33  -1.492 -10.964  -4.010
  245   2HD2  LEU  33          2HD2      LEU  33   0.084 -10.188  -4.171
  246   3HD2  LEU  33          3HD2      LEU  33  -1.353  -9.408  -4.831
  247    H    LEU  34           H        LEU  34  -0.752 -10.852   0.902
  248    HA   LEU  34           HA       LEU  34  -0.380 -13.586   1.806
  249   1HB   LEU  34          1HB       LEU  34   1.542 -11.370   2.517
  250   2HB   LEU  34          2HB       LEU  34   1.505 -12.948   3.280
  251    HG   LEU  34           HG       LEU  34   1.827 -13.764   0.771
  252   1HD1  LEU  34          1HD1      LEU  34   1.729 -11.531  -0.196
  253   2HD1  LEU  34          2HD1      LEU  34   3.314 -12.261  -0.450
  254   3HD1  LEU  34          3HD1      LEU  34   3.099 -11.032   0.796
  255   1HD2  LEU  34          1HD2      LEU  34   4.230 -13.855   1.197
  256   2HD2  LEU  34          2HD2      LEU  34   3.303 -14.285   2.634
  257   3HD2  LEU  34          3HD2      LEU  34   4.043 -12.688   2.506
  258    H    LEU  35           H        LEU  35  -0.274 -10.234   2.986
  259    HA   LEU  35           HA       LEU  35  -1.315  -9.182   4.705
  260   1HB   LEU  35          2HB       LEU  35  -3.298 -11.450   4.437
  261   2HB   LEU  35          1HB       LEU  35  -3.537 -10.029   5.433
  262    HG   LEU  35           HG       LEU  35  -3.247  -8.686   3.252
  263   1HD1  LEU  35          1HD2      LEU  35  -3.890  -9.915   1.224
  264   2HD1  LEU  35          2HD2      LEU  35  -3.822 -11.424   2.135
  265   3HD1  LEU  35          3HD2      LEU  35  -2.355 -10.478   1.884
  266   1HD2  LEU  35          1HD1      LEU  35  -5.694 -10.426   3.406
  267   2HD2  LEU  35          2HD1      LEU  35  -5.570  -8.761   2.833
  268   3HD2  LEU  35          3HD1      LEU  35  -5.373  -9.121   4.548
  269    H    LYS  36           H        LYS  36  -0.495 -12.579   5.045
  270    HA   LYS  36           HA       LYS  36   0.365 -12.181   7.755
  271   1HB   LYS  36          1HB       LYS  36   0.249 -14.414   6.555
  272   2HB   LYS  36          2HB       LYS  36   1.658 -13.909   5.638
  273   1HG   LYS  36          2HG       LYS  36   2.362 -15.319   7.440
  274   2HG   LYS  36          1HG       LYS  36   2.909 -13.671   7.757
  275   1HD   LYS  36          1HD       LYS  36   1.022 -13.332   9.275
  276   2HD   LYS  36          2HD       LYS  36   0.466 -14.976   8.956
  277   1HE   LYS  36          1HE       LYS  36   3.099 -14.206  10.211
  278   2HE   LYS  36          2HE       LYS  36   1.694 -14.847  11.063
  279   1HZ   LYS  36          1HZ       LYS  36   3.242 -16.272   8.966
  280   2HZ   LYS  36          2HZ       LYS  36   1.894 -16.887   9.783
  281   3HZ   LYS  36          3HZ       LYS  36   3.324 -16.571  10.629
  282    H    LEU  37           H        LEU  37   1.010 -10.782   4.815
  283    HA   LEU  37           HA       LEU  37   3.733  -9.984   5.359
  284   1HB   LEU  37          1HB       LEU  37   3.084 -10.333   3.067
  285   2HB   LEU  37          2HB       LEU  37   1.710  -9.258   3.240
  286    HG   LEU  37           HG       LEU  37   4.364  -8.044   3.715
  287   1HD1  LEU  37          1HD2      LEU  37   4.734  -7.757   1.292
  288   2HD1  LEU  37          2HD2      LEU  37   3.431  -8.905   0.979
  289   3HD1  LEU  37          3HD2      LEU  37   4.894  -9.435   1.809
  290   1HD2  LEU  37          1HD1      LEU  37   1.761  -7.208   3.370
  291   2HD2  LEU  37          2HD1      LEU  37   2.535  -6.832   1.825
  292   3HD2  LEU  37          3HD1      LEU  37   3.202  -6.189   3.328
  293    H    LEU  38           H        LEU  38   0.688  -9.121   6.430
  294    HA   LEU  38           HA       LEU  38   1.655  -6.482   7.287
  295   1HB   LEU  38          1HB       LEU  38  -1.138  -7.088   6.330
  296   2HB   LEU  38          2HB       LEU  38  -0.584  -5.551   6.964
  297    HG   LEU  38           HG       LEU  38   0.300  -6.862   4.394
  298   1HD1  LEU  38          1HD2      LEU  38  -1.942  -5.797   4.404
  299   2HD1  LEU  38          2HD2      LEU  38  -0.791  -5.031   3.311
  300   3HD1  LEU  38          3HD2      LEU  38  -1.169  -4.275   4.863
  301   1HD2  LEU  38          1HD1      LEU  38   2.158  -5.725   5.467
  302   2HD2  LEU  38          2HD1      LEU  38   1.182  -4.267   5.639
  303   3HD2  LEU  38          3HD1      LEU  38   1.623  -4.850   4.034
  304    H    LYS  39           H        LYS  39  -1.008  -8.809   7.806
  305    HA   LYS  39           HA       LYS  39  -1.680  -8.176  10.399
  306   1HB   LYS  39          2HB       LYS  39  -1.554 -10.874   9.056
  307   2HB   LYS  39          1HB       LYS  39  -2.221 -10.641  10.666
  308   1HG   LYS  39          2HG       LYS  39  -3.909  -9.140   9.774
  309   2HG   LYS  39          1HG       LYS  39  -3.223  -9.309   8.158
  310   1HD   LYS  39          1HD       LYS  39  -4.241 -11.647   9.756
  311   2HD   LYS  39          2HD       LYS  39  -5.261 -10.721   8.652
  312   1HE   LYS  39          2HE       LYS  39  -3.787 -11.267   6.795
  313   2HE   LYS  39          1HE       LYS  39  -2.712 -12.141   7.887
  314   1HZ   LYS  39          1HZ       LYS  39  -4.173 -13.643   6.688
  315   2HZ   LYS  39          2HZ       LYS  39  -5.535 -12.857   7.309
  316   3HZ   LYS  39          3HZ       LYS  39  -4.499 -13.698   8.348
  317    H    SER  40           H        SER  40   1.262  -9.535   9.251
  318    HA   SER  40           HA       SER  40   2.164 -10.475  11.820
  319   1HB   SER  40          1HB       SER  40   3.619  -9.951   9.224
  320   2HB   SER  40          2HB       SER  40   4.405 -10.579  10.672
  321    HG   SER  40           HG       SER  40   3.831 -12.368   9.592
  322    H    VAL  41           H        VAL  41   2.857  -7.626   9.792
  323    HA   VAL  41           HA       VAL  41   4.650  -6.478  11.671
  324    HB   VAL  41           HB       VAL  41   4.939  -5.853   9.397
  325   1HG1  VAL  41          1HG1      VAL  41   2.745  -6.256   8.521
  326   2HG1  VAL  41          2HG1      VAL  41   3.207  -4.595   8.142
  327   3HG1  VAL  41          3HG1      VAL  41   2.075  -4.919   9.458
  328   1HG2  VAL  41          1HG2      VAL  41   3.703  -3.446  10.713
  329   2HG2  VAL  41          2HG2      VAL  41   4.985  -3.477   9.497
  330   3HG2  VAL  41          3HG2      VAL  41   5.298  -4.084  11.124
  331    H    GLY  42           H        GLY  42   1.214  -6.499  11.402
  332   1HA   GLY  42          1HA       GLY  42   0.891  -5.201  13.894
  333   2HA   GLY  42          2HA       GLY  42   0.540  -4.070  12.599
  334    H    ALA  43           H        ALA  43  -0.776  -5.627  10.762
  335    HA   ALA  43           HA       ALA  43  -3.343  -5.227  11.707
  336   1HB   ALA  43          1HB       ALA  43  -2.543  -7.035   9.428
  337   2HB   ALA  43          2HB       ALA  43  -2.774  -5.291   9.325
  338   3HB   ALA  43          3HB       ALA  43  -4.141  -6.342   9.694
  339    H    GLN  44           H        GLN  44  -5.132  -6.816  11.837
  340    HA   GLN  44           HA       GLN  44  -4.492  -9.531  12.548
  341   1HB   GLN  44          1HB       GLN  44  -5.441  -9.406  14.822
  342   2HB   GLN  44          2HB       GLN  44  -3.976  -8.446  14.660
  343   1HG   GLN  44          2HG       GLN  44  -5.326  -6.422  14.443
  344   2HG   GLN  44          1HG       GLN  44  -6.792  -7.384  14.611
  345   1HE2  GLN  44          2HE2      GLN  44  -3.873  -8.032  16.405
  346   2HE2  GLN  44          1HE2      GLN  44  -4.483  -7.562  17.950
  347    H    LYS  45           H        LYS  45  -6.425  -7.311  11.196
  348    HA   LYS  45           HA       LYS  45  -9.009  -8.403  11.834
  349   1HB   LYS  45          2HB       LYS  45  -8.223  -6.540   9.585
  350   2HB   LYS  45          1HB       LYS  45  -9.859  -6.863  10.142
  351   1HG   LYS  45          1HG       LYS  45  -9.385  -4.837  11.129
  352   2HG   LYS  45          2HG       LYS  45  -9.004  -5.981  12.417
  353   1HD   LYS  45          1HD       LYS  45  -7.260  -4.318  12.282
  354   2HD   LYS  45          2HD       LYS  45  -6.624  -5.877  11.755
  355   1HE   LYS  45          2HE       LYS  45  -6.868  -5.219   9.429
  356   2HE   LYS  45          1HE       LYS  45  -7.580  -3.682   9.921
  357   1HZ   LYS  45          1HZ       LYS  45  -4.818  -4.573  10.550
  358   2HZ   LYS  45          2HZ       LYS  45  -5.503  -3.090  10.984
  359   3HZ   LYS  45          3HZ       LYS  45  -5.238  -3.454   9.353
  360    H    ASP  46           H        ASP  46 -10.456  -9.003   9.880
  361    HA   ASP  46           HA       ASP  46  -9.139 -11.115   8.379
  362   1HB   ASP  46          1HB       ASP  46 -11.328 -11.555   9.421
  363   2HB   ASP  46          2HB       ASP  46 -12.049 -10.277   8.445
  364    H    THR  47           H        THR  47  -9.880  -7.858   7.984
  365    HA   THR  47           HA       THR  47  -9.421  -8.060   5.086
  366    HB   THR  47           HB       THR  47 -10.959  -6.140   4.732
  367    HG1  THR  47           1HG      THR  47 -12.264  -6.558   7.140
  368   1HG2  THR  47          1HG2      THR  47 -12.216  -8.577   5.992
  369   2HG2  THR  47          2HG2      THR  47 -11.789  -8.373   4.292
  370   3HG2  THR  47          3HG2      THR  47 -13.068  -7.388   5.004
  371    H    TYR  48           H        TYR  48  -9.171  -5.630   4.283
  372    HA   TYR  48           HA       TYR  48  -7.614  -4.061   6.201
  373   1HB   TYR  48          2HB       TYR  48  -6.720  -4.980   3.484
  374   2HB   TYR  48          1HB       TYR  48  -6.071  -3.516   4.214
  375    HD1  TYR  48           1HD      TYR  48  -4.429  -3.609   5.888
  376    HD2  TYR  48           2HD      TYR  48  -6.388  -7.169   4.640
  377    HE1  TYR  48           1HE      TYR  48  -2.773  -4.949   7.127
  378    HE2  TYR  48           2HE      TYR  48  -4.731  -8.516   5.857
  379    HH   TYR  48           HH       TYR  48  -2.312  -7.036   7.918
  380    H    THR  49           H        THR  49  -6.955  -1.917   4.835
  381    HA   THR  49           HA       THR  49  -9.212  -1.149   3.143
  382    HB   THR  49           HB       THR  49  -8.271   0.919   5.061
  383    HG1  THR  49           1HG      THR  49 -10.197  -1.065   5.759
  384   1HG2  THR  49          1HG2      THR  49  -9.876   1.492   3.312
  385   2HG2  THR  49          2HG2      THR  49 -10.610   1.638   4.911
  386   3HG2  THR  49          3HG2      THR  49 -10.972   0.239   3.900
  387    H    MET  50           H        MET  50  -8.722   1.255   2.365
  388    HA   MET  50           HA       MET  50  -6.432   1.069   0.736
  389   1HB   MET  50          1HB       MET  50  -8.523   3.108   1.278
  390   2HB   MET  50          2HB       MET  50  -7.058   3.643   0.463
  391   1HG   MET  50          1HG       MET  50  -8.842   1.401  -0.460
  392   2HG   MET  50          2HG       MET  50  -8.860   3.043  -1.097
  393   1HE   MET  50          1HE       MET  50  -8.534   0.448  -2.927
  394   2HE   MET  50          2HE       MET  50  -7.261   0.983  -4.024
  395   3HE   MET  50          3HE       MET  50  -8.550   2.094  -3.561
  396    H    LYS  51           H        LYS  51  -7.124   3.043   3.616
  397    HA   LYS  51           HA       LYS  51  -4.470   4.206   3.548
  398   1HB   LYS  51          2HB       LYS  51  -6.395   5.571   4.250
  399   2HB   LYS  51          1HB       LYS  51  -6.678   4.480   5.600
  400   1HG   LYS  51          1HG       LYS  51  -4.504   5.080   6.544
  401   2HG   LYS  51          2HG       LYS  51  -4.224   6.179   5.190
  402   1HD   LYS  51          2HD       LYS  51  -6.191   7.483   5.844
  403   2HD   LYS  51          1HD       LYS  51  -6.468   6.386   7.198
  404   1HE   LYS  51          1HE       LYS  51  -4.295   7.003   8.139
  405   2HE   LYS  51          2HE       LYS  51  -4.023   8.104   6.788
  406   1HZ   LYS  51          1HZ       LYS  51  -6.210   8.323   8.785
  407   2HZ   LYS  51          2HZ       LYS  51  -5.956   9.377   7.487
  408   3HZ   LYS  51          3HZ       LYS  51  -4.817   9.284   8.734
  409    H    GLU  52           H        GLU  52  -6.249   1.775   5.322
  410    HA   GLU  52           HA       GLU  52  -4.472   1.011   7.280
  411   1HB   GLU  52          2HB       GLU  52  -6.740  -0.034   6.373
  412   2HB   GLU  52          1HB       GLU  52  -5.632  -1.103   5.525
  413   1HG   GLU  52          2HG       GLU  52  -6.281  -2.152   7.563
  414   2HG   GLU  52          1HG       GLU  52  -4.587  -1.678   7.690
  415    H    VAL  53           H        VAL  53  -4.558  -0.538   4.074
  416    HA   VAL  53           HA       VAL  53  -2.048  -1.709   4.169
  417    HB   VAL  53           HB       VAL  53  -3.443  -0.667   1.698
  418   1HG1  VAL  53          1HG2      VAL  53  -2.166  -2.381   0.516
  419   2HG1  VAL  53          2HG2      VAL  53  -1.353  -2.817   2.019
  420   3HG1  VAL  53          3HG2      VAL  53  -1.099  -1.223   1.308
  421   1HG2  VAL  53          1HG1      VAL  53  -4.287  -3.002   1.515
  422   2HG2  VAL  53          2HG1      VAL  53  -4.936  -2.108   2.889
  423   3HG2  VAL  53          3HG1      VAL  53  -3.664  -3.305   3.138
  424    H    LEU  54           H        LEU  54  -2.947   1.587   3.376
  425    HA   LEU  54           HA       LEU  54  -0.738   2.498   2.028
  426   1HB   LEU  54          1HB       LEU  54  -2.711   3.873   2.528
  427   2HB   LEU  54          2HB       LEU  54  -2.233   3.950   4.211
  428    HG   LEU  54           HG       LEU  54  -0.200   5.186   3.578
  429   1HD1  LEU  54          1HD2      LEU  54  -1.354   5.095   0.793
  430   2HD1  LEU  54          2HD2      LEU  54   0.106   4.271   1.339
  431   3HD1  LEU  54          3HD2      LEU  54   0.050   6.034   1.300
  432   1HD2  LEU  54          1HD1      LEU  54  -1.296   7.277   2.954
  433   2HD2  LEU  54          2HD1      LEU  54  -2.215   6.412   4.186
  434   3HD2  LEU  54          3HD1      LEU  54  -2.751   6.384   2.506
  435    H    PHE  55           H        PHE  55  -1.047   3.150   5.520
  436    HA   PHE  55           HA       PHE  55   1.768   3.481   5.757
  437   1HB   PHE  55          2HB       PHE  55   1.301   3.639   8.217
  438   2HB   PHE  55          1HB       PHE  55   0.385   4.764   7.222
  439    HD1  PHE  55           1HD      PHE  55  -1.937   4.837   7.327
  440    HD2  PHE  55           2HD      PHE  55   0.139   1.528   9.015
  441    HE1  PHE  55           1HE      PHE  55  -4.028   4.056   8.358
  442    HE2  PHE  55           2HE      PHE  55  -1.952   0.739  10.047
  443    HZ   PHE  55           HZ       PHE  55  -4.037   2.005   9.721
  444    H    TYR  56           H        TYR  56  -0.396   0.787   6.215
  445    HA   TYR  56           HA       TYR  56   1.255  -0.731   7.936
  446   1HB   TYR  56          1HB       TYR  56  -1.259  -1.100   6.584
  447   2HB   TYR  56          2HB       TYR  56  -0.275  -2.555   6.468
  448    HD1  TYR  56           1HD      TYR  56   1.199  -2.183   9.119
  449    HD2  TYR  56           2HD      TYR  56  -2.920  -1.928   8.069
  450    HE1  TYR  56           1HE      TYR  56   0.585  -2.793  11.418
  451    HE2  TYR  56           2HE      TYR  56  -3.552  -2.530  10.362
  452    HH   TYR  56           HH       TYR  56  -1.347  -2.522  12.939
  453    H    LEU  57           H        LEU  57   0.569  -1.317   4.484
  454    HA   LEU  57           HA       LEU  57   2.608  -3.178   4.112
  455   1HB   LEU  57          2HB       LEU  57   0.645  -2.142   2.541
  456   2HB   LEU  57          1HB       LEU  57   2.058  -1.382   1.838
  457    HG   LEU  57           HG       LEU  57   1.717  -4.359   2.205
  458   1HD1  LEU  57          1HD2      LEU  57   1.361  -4.450  -0.193
  459   2HD1  LEU  57          2HD2      LEU  57   1.457  -2.691  -0.291
  460   3HD1  LEU  57          3HD2      LEU  57   0.127  -3.455   0.578
  461   1HD2  LEU  57          1HD1      LEU  57   4.045  -3.624   2.219
  462   2HD2  LEU  57          2HD1      LEU  57   3.787  -2.776   0.693
  463   3HD2  LEU  57          3HD1      LEU  57   3.664  -4.535   0.756
  464    H    GLY  58           H        GLY  58   2.641   0.350   3.936
  465   1HA   GLY  58          2HA       GLY  58   5.276   0.812   3.210
  466   2HA   GLY  58          1HA       GLY  58   4.387   1.776   4.382
  467    H    GLN  59           H        GLN  59   4.013  -0.043   6.430
  468    HA   GLN  59           HA       GLN  59   6.399   0.039   7.847
  469   1HB   GLN  59          1HB       GLN  59   4.247  -2.040   8.257
  470   2HB   GLN  59          2HB       GLN  59   5.399  -1.459   9.447
  471   1HG   GLN  59          2HG       GLN  59   3.139   0.109   8.234
  472   2HG   GLN  59          1HG       GLN  59   3.210  -0.548   9.863
  473   1HE2  GLN  59          1HE2      GLN  59   2.933   1.445  10.817
  474   2HE2  GLN  59          2HE2      GLN  59   4.176   2.645  10.842
  475    H    TYR  60           H        TYR  60   4.936  -2.802   6.230
  476    HA   TYR  60           HA       TYR  60   6.951  -4.524   7.175
  477   1HB   TYR  60          1HB       TYR  60   4.679  -5.276   6.547
  478   2HB   TYR  60          2HB       TYR  60   5.078  -4.998   4.856
  479    HD1  TYR  60           1HD      TYR  60   6.367  -6.564   3.620
  480    HD2  TYR  60           2HD      TYR  60   5.860  -7.057   7.813
  481    HE1  TYR  60           1HE      TYR  60   7.316  -8.824   3.463
  482    HE2  TYR  60           2HE      TYR  60   6.806  -9.320   7.668
  483    HH   TYR  60           HH       TYR  60   8.435 -10.457   4.916
  484    H    ILE  61           H        ILE  61   6.528  -2.929   4.028
  485    HA   ILE  61           HA       ILE  61   8.666  -4.012   2.631
  486    HB   ILE  61           HB       ILE  61   7.960  -1.073   2.648
  487   1HG1  ILE  61          1HG1      ILE  61   6.805  -3.090   0.747
  488   2HG1  ILE  61          2HG1      ILE  61   6.034  -2.771   2.299
  489   1HG2  ILE  61          1HG2      ILE  61   8.705  -1.216   0.269
  490   2HG2  ILE  61          2HG2      ILE  61   9.267  -2.855   0.600
  491   3HG2  ILE  61          3HG2      ILE  61   9.987  -1.487   1.451
  492   1HD1  ILE  61          1HD1      ILE  61   6.508  -0.840   0.052
  493   2HD1  ILE  61          2HD1      ILE  61   5.981  -0.356   1.665
  494   3HD1  ILE  61          3HD1      ILE  61   4.964  -1.414   0.683
  495    H    MET  62           H        MET  62   8.714  -1.066   4.621
  496    HA   MET  62           HA       MET  62  11.519  -0.781   4.622
  497   1HB   MET  62          1HB       MET  62   9.590   0.233   6.712
  498   2HB   MET  62          2HB       MET  62  11.190   0.871   6.354
  499   1HG   MET  62          1HG       MET  62  10.425   1.550   4.139
  500   2HG   MET  62          2HG       MET  62   8.823   0.908   4.496
  501   1HE   MET  62          1HE       MET  62   9.315   3.879   3.474
  502   2HE   MET  62          2HE       MET  62   8.228   4.778   4.530
  503   3HE   MET  62          3HE       MET  62   7.719   3.233   3.850
  504    H    THR  63           H        THR  63   9.430  -2.805   6.517
  505    HA   THR  63           HA       THR  63  11.053  -2.760   8.869
  506    HB   THR  63           HB       THR  63   8.486  -3.248   8.645
  507    HG1  THR  63           1HG      THR  63   8.612  -4.115  10.701
  508   1HG2  THR  63          1HG2      THR  63   7.975  -5.646   8.807
  509   2HG2  THR  63          2HG2      THR  63   9.669  -6.023   8.493
  510   3HG2  THR  63          3HG2      THR  63   8.695  -5.241   7.250
  511    H    LYS  64           H        LYS  64  10.844  -4.846   6.071
  512    HA   LYS  64           HA       LYS  64  12.511  -6.860   7.385
  513   1HB   LYS  64          1HB       LYS  64  11.003  -6.941   4.770
  514   2HB   LYS  64          2HB       LYS  64  11.991  -8.257   5.386
  515   1HG   LYS  64          2HG       LYS  64   9.729  -7.142   6.997
  516   2HG   LYS  64          1HG       LYS  64   9.453  -8.348   5.741
  517   1HD   LYS  64          1HD       LYS  64   9.695  -9.643   7.650
  518   2HD   LYS  64          2HD       LYS  64  11.311  -9.686   6.942
  519   1HE   LYS  64          2HE       LYS  64  12.034  -7.920   8.462
  520   2HE   LYS  64          1HE       LYS  64  10.416  -7.852   9.162
  521   1HZ   LYS  64          1HZ       LYS  64  12.225 -10.206   9.230
  522   2HZ   LYS  64          2HZ       LYS  64  10.680 -10.131   9.914
  523   3HZ   LYS  64          3HZ       LYS  64  11.923  -9.160  10.524
  524    H    ARG  65           H        ARG  65  13.190  -4.137   6.032
  525    HA   ARG  65           HA       ARG  65  14.952  -3.236   4.918
  526   1HB   ARG  65          2HB       ARG  65  16.289  -5.762   5.900
  527   2HB   ARG  65          1HB       ARG  65  17.125  -4.320   5.339
  528   1HG   ARG  65          1HG       ARG  65  16.212  -3.036   7.176
  529   2HG   ARG  65          2HG       ARG  65  15.286  -4.436   7.720
  530   1HD   ARG  65          1HD       ARG  65  18.293  -4.262   7.572
  531   2HD   ARG  65          2HD       ARG  65  17.325  -4.132   9.041
  532    HE   ARG  65           HE       ARG  65  16.756  -6.555   7.696
  533   1HH1  ARG  65          2HH1      ARG  65  19.205  -5.009   9.634
  534   2HH1  ARG  65          1HH1      ARG  65  19.818  -6.496  10.275
  535   1HH2  ARG  65          1HH2      ARG  65  17.556  -8.517   8.537
  536   2HH2  ARG  65          2HH2      ARG  65  18.882  -8.490   9.652
  537    H    LEU  66           H        LEU  66  13.209  -4.665   3.247
  538    HA   LEU  66           HA       LEU  66  14.921  -6.050   1.335
  539   1HB   LEU  66          2HB       LEU  66  11.990  -5.429   1.042
  540   2HB   LEU  66          1HB       LEU  66  12.919  -6.664   0.209
  541    HG   LEU  66           HG       LEU  66  12.502  -6.728   3.190
  542   1HD1  LEU  66          1HD1      LEU  66  10.638  -8.215   2.853
  543   2HD1  LEU  66          2HD1      LEU  66  10.799  -8.073   1.102
  544   3HD1  LEU  66          3HD1      LEU  66  10.318  -6.671   2.061
  545   1HD2  LEU  66          1HD2      LEU  66  13.107  -8.920   1.213
  546   2HD2  LEU  66          2HD2      LEU  66  13.055  -9.055   2.970
  547   3HD2  LEU  66          3HD2      LEU  66  14.315  -8.094   2.196
  548    H    TYR  67           H        TYR  67  14.516  -2.973   2.059
  549    HA   TYR  67           HA       TYR  67  14.106  -1.936  -0.637
  550   1HB   TYR  67          1HB       TYR  67  14.169   0.284   0.476
  551   2HB   TYR  67          2HB       TYR  67  12.932  -0.782   1.134
  552    HD1  TYR  67           1HD      TYR  67  13.107  -1.651   3.392
  553    HD2  TYR  67           2HD      TYR  67  16.130   0.875   1.788
  554    HE1  TYR  67           1HE      TYR  67  14.017  -1.311   5.653
  555    HE2  TYR  67           2HE      TYR  67  17.046   1.222   4.038
  556    HH   TYR  67           HH       TYR  67  16.140  -0.672   6.708
  557    H    ASP  68           H        ASP  68  15.605  -0.051  -1.241
  558    HA   ASP  68           HA       ASP  68  18.249  -1.054  -1.466
  559   1HB   ASP  68          2HB       ASP  68  17.218   0.373  -3.188
  560   2HB   ASP  68          1HB       ASP  68  17.190   1.721  -2.053
  561    H    GLU  69           H        GLU  69  20.081  -0.576  -0.367
  562    HA   GLU  69           HA       GLU  69  19.822   0.514   2.254
  563   1HB   GLU  69          1HB       GLU  69  22.410  -0.054   0.813
  564   2HB   GLU  69          2HB       GLU  69  22.117  -0.057   2.547
  565   1HG   GLU  69          1HG       GLU  69  20.694  -2.023   2.306
  566   2HG   GLU  69          2HG       GLU  69  20.982  -2.015   0.567
  567    H    LYS  70           H        LYS  70  19.951   2.030  -0.635
  568    HA   LYS  70           HA       LYS  70  21.304   4.386   0.517
  569   1HB   LYS  70          1HB       LYS  70  21.043   3.626  -2.399
  570   2HB   LYS  70          2HB       LYS  70  21.790   5.100  -1.796
  571   1HG   LYS  70          2HG       LYS  70  23.498   3.773  -0.660
  572   2HG   LYS  70          1HG       LYS  70  22.749   2.294  -1.268
  573   1HD   LYS  70          1HD       LYS  70  24.627   2.850  -2.667
  574   2HD   LYS  70          2HD       LYS  70  23.139   3.104  -3.579
  575   1HE   LYS  70          2HE       LYS  70  23.262   5.503  -3.113
  576   2HE   LYS  70          1HE       LYS  70  24.748   5.249  -2.198
  577   1HZ   LYS  70          1HZ       LYS  70  25.811   4.447  -4.213
  578   2HZ   LYS  70          2HZ       LYS  70  25.211   6.011  -4.440
  579   3HZ   LYS  70          3HZ       LYS  70  24.385   4.687  -5.092
  580    H    GLN  71           H        GLN  71  19.216   4.023  -2.325
  581    HA   GLN  71           HA       GLN  71  17.363   5.995  -1.253
  582   1HB   GLN  71          2HB       GLN  71  17.347   4.493  -3.880
  583   2HB   GLN  71          1HB       GLN  71  16.229   5.776  -3.437
  584   1HG   GLN  71          2HG       GLN  71  18.083   7.355  -3.305
  585   2HG   GLN  71          1HG       GLN  71  19.210   6.069  -3.737
  586   1HE2  GLN  71          2HE2      GLN  71  17.332   4.869  -5.631
  587   2HE2  GLN  71          1HE2      GLN  71  17.344   5.891  -7.023
  588    H    GLN  72           H        GLN  72  16.465   4.879   0.490
  589    HA   GLN  72           HA       GLN  72  15.624   2.242   0.558
  590   1HB   GLN  72          2HB       GLN  72  14.330   4.560   2.010
  591   2HB   GLN  72          1HB       GLN  72  14.279   2.866   2.482
  592   1HG   GLN  72          2HG       GLN  72  16.701   2.897   2.838
  593   2HG   GLN  72          1HG       GLN  72  16.738   4.599   2.383
  594   1HE2  GLN  72          2HE2      GLN  72  14.148   3.183   4.239
  595   2HE2  GLN  72          1HE2      GLN  72  14.510   3.985   5.725
  596    H    HIS  73           H        HIS  73  14.210   4.888  -1.092
  597    HA   HIS  73           HA       HIS  73  11.551   3.777  -1.212
  598   1HB   HIS  73          1HB       HIS  73  11.172   5.651  -2.856
  599   2HB   HIS  73          2HB       HIS  73  11.692   6.158  -1.253
  600    HD1  HIS  73           1HD      HIS  73  13.628   7.707  -1.178
  601    HD2  HIS  73           2HD      HIS  73  13.413   5.652  -4.783
  602    HE1  HIS  73           1HE      HIS  73  15.433   8.694  -2.623
  603    HE2  HIS  73           2HE      HIS  73  15.229   7.493  -4.829
  604    H    ILE  74           H        ILE  74  14.210   2.579  -2.469
  605    HA   ILE  74           HA       ILE  74  12.705   1.571  -4.794
  606    HB   ILE  74           HB       ILE  74  15.718   1.639  -4.657
  607   1HG1  ILE  74          2HG1      ILE  74  14.854   3.942  -4.734
  608   2HG1  ILE  74          1HG1      ILE  74  15.641   3.499  -6.245
  609   1HG2  ILE  74          1HG2      ILE  74  15.554   1.156  -7.057
  610   2HG2  ILE  74          2HG2      ILE  74  13.797   1.103  -6.919
  611   3HG2  ILE  74          3HG2      ILE  74  14.783  -0.094  -6.079
  612   1HD1  ILE  74          1HD1      ILE  74  12.671   3.562  -5.762
  613   2HD1  ILE  74          2HD1      ILE  74  13.465   3.127  -7.276
  614   3HD1  ILE  74          3HD1      ILE  74  13.610   4.766  -6.643
  615    H    VAL  75           H        VAL  75  11.895  -0.293  -4.007
  616    HA   VAL  75           HA       VAL  75  13.382  -1.732  -1.971
  617    HB   VAL  75           HB       VAL  75  10.687  -2.564  -2.974
  618   1HG1  VAL  75          1HG1      VAL  75  10.381  -3.222  -0.633
  619   2HG1  VAL  75          2HG1      VAL  75  11.994  -2.617  -0.260
  620   3HG1  VAL  75          3HG1      VAL  75  11.797  -3.989  -1.351
  621   1HG2  VAL  75          1HG2      VAL  75   9.678  -1.001  -1.331
  622   2HG2  VAL  75          2HG2      VAL  75  10.443  -0.202  -2.705
  623   3HG2  VAL  75          3HG2      VAL  75  11.261  -0.245  -1.141
  624    H    TYR  76           H        TYR  76  15.001  -2.814  -3.096
  625    HA   TYR  76           HA       TYR  76  14.516  -4.619  -5.225
  626   1HB   TYR  76          2HB       TYR  76  16.700  -4.899  -3.165
  627   2HB   TYR  76          1HB       TYR  76  16.721  -5.421  -4.847
  628    HD1  TYR  76           1HD      TYR  76  15.528  -2.835  -5.995
  629    HD2  TYR  76           2HD      TYR  76  18.672  -3.563  -3.218
  630    HE1  TYR  76           1HE      TYR  76  16.587  -0.710  -6.639
  631    HE2  TYR  76           2HE      TYR  76  19.736  -1.444  -3.859
  632    HH   TYR  76           HH       TYR  76  19.763   0.100  -5.778
  633    H    CYS  77           H        CYS  77  12.767  -5.936  -4.800
  634    HA   CYS  77           HA       CYS  77  12.804  -7.470  -2.300
  635   1HB   CYS  77          1HB       CYS  77  10.411  -7.879  -2.730
  636   2HB   CYS  77          2HB       CYS  77  10.785  -6.160  -2.669
  637    HG   CYS  77           HG       CYS  77   9.128  -7.696  -4.932
  638    H    SER  78           H        SER  78  12.722  -7.812  -5.783
  639    HA   SER  78           HA       SER  78  12.978  -9.592  -7.168
  640   1HB   SER  78          1HB       SER  78  15.111  -9.755  -5.941
  641   2HB   SER  78          2HB       SER  78  14.341 -10.828  -4.770
  642    HG   SER  78           HG       SER  78  14.195 -12.393  -6.275
  643    H    ASN  79           H        ASN  79  12.855 -11.681  -4.366
  644    HA   ASN  79           HA       ASN  79  10.193 -12.612  -5.201
  645   1HB   ASN  79          1HB       ASN  79  10.956 -14.947  -4.726
  646   2HB   ASN  79          2HB       ASN  79  11.754 -14.202  -6.107
  647   1HD2  ASN  79          2HD2      ASN  79  13.513 -15.567  -5.975
  648   2HD2  ASN  79          1HD2      ASN  79  14.701 -15.433  -4.728
  649    H    ASP  80           H        ASP  80  10.768 -10.825  -3.079
  650    HA   ASP  80           HA       ASP  80  10.689 -12.255  -0.590
  651   1HB   ASP  80          2HB       ASP  80  10.164  -9.365  -1.290
  652   2HB   ASP  80          1HB       ASP  80  10.118  -9.996   0.355
  653    H    LEU  81           H        LEU  81   8.753 -11.306   0.933
  654    HA   LEU  81           HA       LEU  81   6.301 -12.378   0.043
  655   1HB   LEU  81          1HB       LEU  81   6.891 -10.383   2.232
  656   2HB   LEU  81          2HB       LEU  81   5.322 -11.120   1.972
  657    HG   LEU  81           HG       LEU  81   6.571 -13.370   2.252
  658   1HD1  LEU  81          1HD1      LEU  81   8.546 -13.252   3.686
  659   2HD1  LEU  81          2HD1      LEU  81   8.534 -11.492   3.558
  660   3HD1  LEU  81          3HD1      LEU  81   8.830 -12.478   2.126
  661   1HD2  LEU  81          1HD2      LEU  81   6.322 -13.244   4.696
  662   2HD2  LEU  81          2HD2      LEU  81   4.942 -12.555   3.840
  663   3HD2  LEU  81          3HD2      LEU  81   6.146 -11.494   4.572
  664    H    LEU  82           H        LEU  82   7.584  -9.074   0.102
  665    HA   LEU  82           HA       LEU  82   5.480  -7.814  -1.269
  666   1HB   LEU  82          1HB       LEU  82   8.390  -7.312  -0.927
  667   2HB   LEU  82          2HB       LEU  82   7.583  -6.484  -2.245
  668    HG   LEU  82           HG       LEU  82   7.663  -5.055  -0.291
  669   1HD1  LEU  82          1HD2      LEU  82   5.241  -4.613  -0.024
  670   2HD1  LEU  82          2HD2      LEU  82   4.904  -6.118  -0.882
  671   3HD1  LEU  82          3HD2      LEU  82   5.736  -4.798  -1.705
  672   1HD2  LEU  82          1HD1      LEU  82   7.821  -6.757   1.434
  673   2HD2  LEU  82          2HD1      LEU  82   6.164  -7.260   1.112
  674   3HD2  LEU  82          3HD1      LEU  82   6.485  -5.657   1.772
  675    H    GLY  83           H        GLY  83   7.913 -10.057  -2.291
  676   1HA   GLY  83          1HA       GLY  83   7.873  -9.687  -5.062
  677   2HA   GLY  83          2HA       GLY  83   8.159 -11.220  -4.251
  678    H    ASP  84           H        ASP  84   5.772 -11.754  -3.044
  679    HA   ASP  84           HA       ASP  84   4.064 -12.638  -5.077
  680   1HB   ASP  84          2HB       ASP  84   3.023 -11.912  -2.343
  681   2HB   ASP  84          1HB       ASP  84   2.520 -13.224  -3.405
  682    H    LEU  85           H        LEU  85   4.111  -9.630  -3.257
  683    HA   LEU  85           HA       LEU  85   1.618  -8.613  -3.921
  684   1HB   LEU  85          1HB       LEU  85   4.188  -7.071  -3.593
  685   2HB   LEU  85          2HB       LEU  85   2.578  -6.388  -3.531
  686    HG   LEU  85           HG       LEU  85   4.137  -7.494  -1.417
  687   1HD1  LEU  85          1HD1      LEU  85   1.375  -6.307  -1.505
  688   2HD1  LEU  85          2HD1      LEU  85   2.890  -5.426  -1.307
  689   3HD1  LEU  85          3HD1      LEU  85   2.343  -6.534  -0.049
  690   1HD2  LEU  85          1HD2      LEU  85   2.457  -8.926  -0.347
  691   2HD2  LEU  85          2HD2      LEU  85   3.085  -9.633  -1.836
  692   3HD2  LEU  85          3HD2      LEU  85   1.493  -8.877  -1.822
  693    H    PHE  86           H        PHE  86   4.684  -7.723  -5.495
  694    HA   PHE  86           HA       PHE  86   3.161  -6.992  -7.903
  695   1HB   PHE  86          1HB       PHE  86   6.051  -6.299  -7.467
  696   2HB   PHE  86          2HB       PHE  86   4.848  -5.466  -8.445
  697    HD1  PHE  86           1HD      PHE  86   5.902  -6.148  -4.972
  698    HD2  PHE  86           2HD      PHE  86   3.581  -3.700  -7.568
  699    HE1  PHE  86           1HE      PHE  86   5.504  -4.574  -3.126
  700    HE2  PHE  86           2HE      PHE  86   3.181  -2.118  -5.724
  701    HZ   PHE  86           HZ       PHE  86   4.143  -2.561  -3.498
  702    H    GLY  87           H        GLY  87   6.329  -8.415  -7.068
  703   1HA   GLY  87          2HA       GLY  87   7.194 -10.372  -8.229
  704   2HA   GLY  87          1HA       GLY  87   6.215  -9.906  -9.613
  705    H    VAL  88           H        VAL  88   7.585  -7.231  -8.116
  706    HA   VAL  88           HA       VAL  88   9.249  -6.728 -10.410
  707    HB   VAL  88           HB       VAL  88   9.661  -4.547  -9.419
  708   1HG1  VAL  88          1HG2      VAL  88   7.324  -3.750  -9.216
  709   2HG1  VAL  88          2HG2      VAL  88   6.790  -5.430  -9.194
  710   3HG1  VAL  88          3HG2      VAL  88   7.593  -4.779 -10.623
  711   1HG2  VAL  88          1HG1      VAL  88   8.195  -5.605  -7.004
  712   2HG2  VAL  88          2HG1      VAL  88   8.712  -3.936  -7.242
  713   3HG2  VAL  88          3HG1      VAL  88   9.914  -5.219  -7.094
  714    HA   PRO  89           HA       PRO  89  13.223  -7.482  -8.317
  715   1HB   PRO  89          2HB       PRO  89  14.791  -5.794  -9.708
  716   2HB   PRO  89          1HB       PRO  89  14.213  -7.314 -10.401
  717   1HG   PRO  89          2HG       PRO  89  13.182  -4.532 -10.802
  718   2HG   PRO  89          1HG       PRO  89  13.422  -5.819 -11.997
  719   1HD   PRO  89          2HD       PRO  89  10.995  -5.205 -10.888
  720   2HD   PRO  89          1HD       PRO  89  11.418  -6.814 -11.507
  721    H    SER  90           H        SER  90  11.937  -4.262  -8.947
  722    HA   SER  90           HA       SER  90  12.457  -3.486  -6.212
  723   1HB   SER  90          2HB       SER  90  13.595  -1.364  -6.874
  724   2HB   SER  90          1HB       SER  90  14.555  -2.807  -7.201
  725    HG   SER  90           HG       SER  90  14.626  -2.129  -9.179
  726    H    PHE  91           H        PHE  91  10.977  -1.942  -5.488
  727    HA   PHE  91           HA       PHE  91   9.364  -0.620  -7.558
  728   1HB   PHE  91          1HB       PHE  91   7.296  -1.046  -6.426
  729   2HB   PHE  91          2HB       PHE  91   8.114  -2.581  -6.672
  730    HD1  PHE  91           1HD      PHE  91   7.109  -0.081  -4.178
  731    HD2  PHE  91           2HD      PHE  91   8.856  -3.907  -4.828
  732    HE1  PHE  91           1HE      PHE  91   6.828  -0.600  -1.800
  733    HE2  PHE  91           2HE      PHE  91   8.587  -4.434  -2.439
  734    HZ   PHE  91           HZ       PHE  91   7.571  -2.783  -0.920
  735    H    SER  92           H        SER  92   8.571   1.408  -7.072
  736    HA   SER  92           HA       SER  92  10.137   2.745  -5.012
  737   1HB   SER  92          1HB       SER  92   8.497   3.869  -7.295
  738   2HB   SER  92          2HB       SER  92   9.480   4.826  -6.189
  739    HG   SER  92           HG       SER  92  11.094   3.005  -7.051
  740    H    VAL  93           H        VAL  93   9.202   2.779  -3.074
  741    HA   VAL  93           HA       VAL  93   6.385   2.822  -2.660
  742    HB   VAL  93           HB       VAL  93   7.979   1.858  -1.025
  743   1HG1  VAL  93          1HG1      VAL  93   8.728   4.738  -0.568
  744   2HG1  VAL  93          2HG1      VAL  93   9.773   3.448  -1.164
  745   3HG1  VAL  93          3HG1      VAL  93   9.176   3.405   0.495
  746   1HG2  VAL  93          1HG2      VAL  93   5.732   2.454  -0.312
  747   2HG2  VAL  93          2HG2      VAL  93   6.264   4.098   0.042
  748   3HG2  VAL  93          3HG2      VAL  93   6.889   2.747   0.987
  749    H    LYS  94           H        LYS  94   8.880   5.268  -2.879
  750    HA   LYS  94           HA       LYS  94   7.553   7.472  -1.831
  751   1HB   LYS  94          2HB       LYS  94   8.964   8.831  -3.311
  752   2HB   LYS  94          1HB       LYS  94   9.888   7.561  -2.519
  753   1HG   LYS  94          2HG       LYS  94   9.837   6.225  -4.528
  754   2HG   LYS  94          1HG       LYS  94   8.828   7.430  -5.328
  755   1HD   LYS  94          2HD       LYS  94  10.628   9.078  -5.116
  756   2HD   LYS  94          1HD       LYS  94  11.639   7.867  -4.321
  757   1HE   LYS  94          1HE       LYS  94  11.556   6.482  -6.338
  758   2HE   LYS  94          2HE       LYS  94  10.556   7.699  -7.132
  759   1HZ   LYS  94          1HZ       LYS  94  12.871   7.904  -7.778
  760   2HZ   LYS  94          2HZ       LYS  94  13.334   8.108  -6.164
  761   3HZ   LYS  94          3HZ       LYS  94  12.376   9.276  -6.921
  762    H    GLU  95           H        GLU  95   7.269   5.928  -4.973
  763    HA   GLU  95           HA       GLU  95   5.223   7.779  -5.861
  764   1HB   GLU  95          1HB       GLU  95   6.152   5.161  -7.063
  765   2HB   GLU  95          2HB       GLU  95   5.077   6.320  -7.834
  766   1HG   GLU  95          2HG       GLU  95   7.945   6.814  -7.066
  767   2HG   GLU  95          1HG       GLU  95   7.347   6.486  -8.693
  768    H    HIS  96           H        HIS  96   4.015   7.271  -3.780
  769    HA   HIS  96           HA       HIS  96   3.000   4.743  -3.201
  770   1HB   HIS  96          2HB       HIS  96   1.800   7.447  -2.558
  771   2HB   HIS  96          1HB       HIS  96   1.335   5.927  -1.803
  772    HD1  HIS  96           1HD      HIS  96   4.121   8.432  -1.905
  773    HD2  HIS  96           2HD      HIS  96   3.058   4.993   0.170
  774    HE1  HIS  96           1HE      HIS  96   5.718   8.296   0.032
  775    HE2  HIS  96           2HE      HIS  96   4.994   6.259   1.326
  776    H    ARG  97           H        ARG  97   1.813   7.223  -5.365
  777    HA   ARG  97           HA       ARG  97  -0.755   6.282  -5.879
  778   1HB   ARG  97          1HB       ARG  97  -0.029   8.387  -6.786
  779   2HB   ARG  97          2HB       ARG  97   1.255   7.613  -7.702
  780   1HG   ARG  97          2HG       ARG  97  -0.435   6.465  -9.068
  781   2HG   ARG  97          1HG       ARG  97  -1.703   7.306  -8.174
  782   1HD   ARG  97          1HD       ARG  97  -0.819   9.454  -8.927
  783   2HD   ARG  97          2HD       ARG  97   0.466   8.623  -9.804
  784    HE   ARG  97           HE       ARG  97  -2.138   7.748 -10.595
  785   1HH1  ARG  97          2HH1      ARG  97   0.250  10.249 -11.033
  786   2HH1  ARG  97          1HH1      ARG  97  -0.302  10.679 -12.617
  787   1HH2  ARG  97          1HH2      ARG  97  -2.872   8.308 -12.681
  788   2HH2  ARG  97          2HH2      ARG  97  -2.078   9.577 -13.553
  789    H    LYS  98           H        LYS  98   2.135   5.630  -7.876
  790    HA   LYS  98           HA       LYS  98   0.805   3.644  -9.399
  791   1HB   LYS  98          1HB       LYS  98   2.665   4.992 -10.286
  792   2HB   LYS  98          2HB       LYS  98   3.763   4.208  -9.157
  793   1HG   LYS  98          2HG       LYS  98   3.345   2.058 -10.239
  794   2HG   LYS  98          1HG       LYS  98   2.246   2.844 -11.372
  795   1HD   LYS  98          2HD       LYS  98   4.083   4.229 -12.200
  796   2HD   LYS  98          1HD       LYS  98   5.183   3.455 -11.058
  797   1HE   LYS  98          1HE       LYS  98   3.689   2.075 -13.285
  798   2HE   LYS  98          2HE       LYS  98   5.399   2.502 -13.300
  799   1HZ   LYS  98          1HZ       LYS  98   4.105   0.614 -11.407
  800   2HZ   LYS  98          2HZ       LYS  98   5.746   1.027 -11.417
  801   3HZ   LYS  98          3HZ       LYS  98   5.080   0.184 -12.722
  802    H    ILE  99           H        ILE  99   2.849   3.549  -6.572
  803    HA   ILE  99           HA       ILE  99   3.594   0.836  -6.716
  804    HB   ILE  99           HB       ILE  99   4.554   2.731  -5.222
  805   1HG1  ILE  99          1HG1      ILE  99   5.085   0.172  -5.316
  806   2HG1  ILE  99          2HG1      ILE  99   5.701   1.145  -3.985
  807   1HG2  ILE  99          1HG2      ILE  99   3.761   2.591  -2.869
  808   2HG2  ILE  99          2HG2      ILE  99   2.357   1.696  -3.456
  809   3HG2  ILE  99          3HG2      ILE  99   2.625   3.357  -3.983
  810   1HD1  ILE  99          1HD1      ILE  99   3.249  -0.594  -3.902
  811   2HD1  ILE  99          2HD1      ILE  99   3.883   0.368  -2.566
  812   3HD1  ILE  99          3HD1      ILE  99   4.823  -0.980  -3.205
  813    H    TYR 100           H        TYR 100   0.749   2.437  -5.459
  814    HA   TYR 100           HA       TYR 100  -0.342  -0.120  -4.573
  815   1HB   TYR 100          2HB       TYR 100  -1.253   2.730  -4.284
  816   2HB   TYR 100          1HB       TYR 100  -2.342   1.384  -3.955
  817    HD1  TYR 100           1HD      TYR 100   0.896   0.330  -3.230
  818    HD2  TYR 100           2HD      TYR 100  -2.222   2.765  -1.669
  819    HE1  TYR 100           1HE      TYR 100   1.846   0.090  -0.989
  820    HE2  TYR 100           2HE      TYR 100  -1.271   2.539   0.587
  821    HH   TYR 100           HH       TYR 100   1.835   1.291   1.158
  822    H    THR 101           H        THR 101  -0.340   1.911  -7.318
  823    HA   THR 101           HA       THR 101  -2.756   0.984  -8.511
  824    HB   THR 101           HB       THR 101  -0.219   1.966  -9.843
  825    HG1  THR 101           1HG      THR 101  -2.637   3.317  -9.154
  826   1HG2  THR 101          1HG2      THR 101  -3.019   1.675 -10.942
  827   2HG2  THR 101          2HG2      THR 101  -1.630   0.679 -11.378
  828   3HG2  THR 101          3HG2      THR 101  -1.648   2.394 -11.788
  829    H    MET 102           H        MET 102   0.463  -0.289  -8.157
  830    HA   MET 102           HA       MET 102  -0.068  -2.577  -9.863
  831   1HB   MET 102          2HB       MET 102   2.212  -2.257  -7.914
  832   2HB   MET 102          1HB       MET 102   2.135  -3.304  -9.327
  833   1HG   MET 102          2HG       MET 102   2.151  -1.360 -10.785
  834   2HG   MET 102          1HG       MET 102   2.178  -0.303  -9.375
  835   1HE   MET 102          1HE       MET 102   4.099  -1.435  -7.371
  836   2HE   MET 102          2HE       MET 102   4.304   0.222  -7.942
  837   3HE   MET 102          3HE       MET 102   5.690  -0.866  -7.875
  838    H    ILE 103           H        ILE 103   0.098  -1.782  -6.427
  839    HA   ILE 103           HA       ILE 103  -0.235  -4.308  -5.338
  840    HB   ILE 103           HB       ILE 103  -1.181  -1.612  -4.398
  841   1HG1  ILE 103          2HG1      ILE 103   1.241  -2.089  -4.366
  842   2HG1  ILE 103          1HG1      ILE 103   0.592  -1.880  -2.744
  843   1HG2  ILE 103          1HG2      ILE 103  -1.458  -4.232  -2.928
  844   2HG2  ILE 103          2HG2      ILE 103  -2.776  -3.227  -3.533
  845   3HG2  ILE 103          3HG2      ILE 103  -1.739  -2.634  -2.236
  846   1HD1  ILE 103          1HD1      ILE 103   2.177  -3.712  -2.830
  847   2HD1  ILE 103          2HD1      ILE 103   1.209  -4.508  -4.071
  848   3HD1  ILE 103          3HD1      ILE 103   0.559  -4.300  -2.445
  849    H    TYR 104           H        TYR 104  -2.678  -2.060  -6.572
  850    HA   TYR 104           HA       TYR 104  -4.722  -4.140  -6.188
  851   1HB   TYR 104          1HB       TYR 104  -5.092  -1.163  -6.580
  852   2HB   TYR 104          2HB       TYR 104  -6.376  -2.332  -6.291
  853    HD1  TYR 104           1HD      TYR 104  -6.504  -3.490  -4.074
  854    HD2  TYR 104           2HD      TYR 104  -3.844  -0.247  -4.787
  855    HE1  TYR 104           1HE      TYR 104  -6.263  -3.163  -1.649
  856    HE2  TYR 104           2HE      TYR 104  -3.595   0.089  -2.363
  857    HH   TYR 104           HH       TYR 104  -4.653  -2.180  -0.074
  858    H    ARG 105           H        ARG 105  -6.562  -3.925  -7.858
  859    HA   ARG 105           HA       ARG 105  -5.518  -3.293 -10.525
  860   1HB   ARG 105          2HB       ARG 105  -6.946  -5.852  -9.784
  861   2HB   ARG 105          1HB       ARG 105  -6.524  -5.367 -11.420
  862   1HG   ARG 105          2HG       ARG 105  -4.555  -5.886  -9.200
  863   2HG   ARG 105          1HG       ARG 105  -4.963  -7.016 -10.492
  864   1HD   ARG 105          2HD       ARG 105  -4.147  -5.419 -12.152
  865   2HD   ARG 105          1HD       ARG 105  -3.749  -4.279 -10.866
  866    HE   ARG 105           HE       ARG 105  -2.459  -6.755 -10.418
  867   1HH1  ARG 105          2HH1      ARG 105  -2.324  -3.931 -12.454
  868   2HH1  ARG 105          1HH1      ARG 105  -0.622  -4.066 -12.748
  869   1HH2  ARG 105          1HH2      ARG 105  -0.219  -6.940 -10.798
  870   2HH2  ARG 105          2HH2      ARG 105   0.574  -5.776 -11.806
  871    H    ASN 106           H        ASN 106  -7.418  -2.015  -8.636
  872    HA   ASN 106           HA       ASN 106  -9.412  -0.928  -8.671
  873   1HB   ASN 106          1HB       ASN 106  -9.281  -1.542 -11.631
  874   2HB   ASN 106          2HB       ASN 106 -10.360  -0.371 -10.879
  875   1HD2  ASN 106          2HD2      ASN 106  -7.086  -1.092 -11.776
  876   2HD2  ASN 106          1HD2      ASN 106  -6.461   0.504 -11.563
  877    H    LEU 107           H        LEU 107 -11.782  -1.217  -9.876
  878    HA   LEU 107           HA       LEU 107 -13.704  -2.421  -9.924
  879   1HB   LEU 107          1HB       LEU 107 -12.551  -3.783 -11.593
  880   2HB   LEU 107          2HB       LEU 107 -11.838  -4.759 -10.324
  881    HG   LEU 107           HG       LEU 107 -14.128  -5.496  -9.668
  882   1HD1  LEU 107          1HD1      LEU 107 -15.977  -5.105 -11.205
  883   2HD1  LEU 107          2HD1      LEU 107 -14.949  -4.068 -12.194
  884   3HD1  LEU 107          3HD1      LEU 107 -15.368  -3.585 -10.550
  885   1HD2  LEU 107          1HD2      LEU 107 -13.342  -6.024 -12.530
  886   2HD2  LEU 107          2HD2      LEU 107 -14.437  -7.011 -11.562
  887   3HD2  LEU 107          3HD2      LEU 107 -12.737  -6.876 -11.110
  888    H    VAL 108           H        VAL 108 -11.702  -4.946  -8.443
  889    HA   VAL 108           HA       VAL 108 -13.560  -5.611  -6.479
  890    HB   VAL 108           HB       VAL 108 -10.563  -5.994  -6.388
  891   1HG1  VAL 108          1HG2      VAL 108 -11.564  -6.282  -4.192
  892   2HG1  VAL 108          2HG2      VAL 108 -11.060  -7.841  -4.847
  893   3HG1  VAL 108          3HG2      VAL 108 -12.764  -7.386  -4.865
  894   1HG2  VAL 108          1HG1      VAL 108 -11.037  -8.225  -7.280
  895   2HG2  VAL 108          2HG1      VAL 108 -11.559  -6.957  -8.390
  896   3HG2  VAL 108          3HG1      VAL 108 -12.747  -7.810  -7.403
  897    H    VAL 109           H        VAL 109 -14.344  -3.946  -5.263
  898    HA   VAL 109           HA       VAL 109 -12.515  -2.897  -3.236
  899    HB   VAL 109           HB       VAL 109 -13.511  -0.638  -3.397
  900   1HG1  VAL 109          1HG1      VAL 109 -12.293   0.072  -5.403
  901   2HG1  VAL 109          2HG1      VAL 109 -12.184  -1.608  -5.927
  902   3HG1  VAL 109          3HG1      VAL 109 -11.366  -1.090  -4.454
  903   1HG2  VAL 109          1HG2      VAL 109 -14.754  -1.691  -5.937
  904   2HG2  VAL 109          2HG2      VAL 109 -14.758  -0.008  -5.413
  905   3HG2  VAL 109          3HG2      VAL 109 -15.616  -1.227  -4.470
  906    H    VAL 110           H        VAL 110 -14.201  -1.290  -1.838
  907    HA   VAL 110           HA       VAL 110 -15.787  -3.070  -0.376
  908    HB   VAL 110           HB       VAL 110 -14.940  -0.975   0.567
  909   1HG1  VAL 110          1HG1      VAL 110 -15.226   0.456  -1.368
  910   2HG1  VAL 110          2HG1      VAL 110 -16.038   1.151   0.034
  911   3HG1  VAL 110          3HG1      VAL 110 -16.979   0.340  -1.217
  912   1HG2  VAL 110          1HG2      VAL 110 -16.958  -0.311   1.793
  913   2HG2  VAL 110          2HG2      VAL 110 -16.825  -2.064   1.654
  914   3HG2  VAL 110          3HG2      VAL 110 -17.949  -1.180   0.622
  915    H    ASN 111           H        ASN 111 -17.999  -3.427  -0.270
  916    HA   ASN 111           HA       ASN 111 -19.766  -2.111  -2.153
  917   1HB   ASN 111          1HB       ASN 111 -18.827  -3.919  -3.513
  918   2HB   ASN 111          2HB       ASN 111 -19.282  -5.095  -2.284
  919   1HD2  ASN 111          2HD2      ASN 111 -20.575  -6.246  -3.695
  920   2HD2  ASN 111          1HD2      ASN 111 -22.100  -5.654  -4.247
  921    H    GLN 112           H        GLN 112 -19.546  -4.947  -0.002
  922    HA   GLN 112           HA       GLN 112 -22.203  -4.251   1.052
  923   1HB   GLN 112          1HB       GLN 112 -20.711  -6.879   1.179
  924   2HB   GLN 112          2HB       GLN 112 -22.319  -6.585   1.829
  925   1HG   GLN 112          2HG       GLN 112 -23.146  -6.124  -0.422
  926   2HG   GLN 112          1HG       GLN 112 -21.535  -6.422  -1.073
  927   1HE2  GLN 112          2HE2      GLN 112 -24.370  -7.850   0.332
  928   2HE2  GLN 112          1HE2      GLN 112 -23.988  -9.489  -0.061
  929    H    GLN 113           H        GLN 113 -21.552  -2.709   2.556
  930    HA   GLN 113           HA       GLN 113 -19.773  -3.618   4.707
  931   1HB   GLN 113          2HB       GLN 113 -19.236  -1.452   3.673
  932   2HB   GLN 113          1HB       GLN 113 -20.832  -0.852   4.096
  933   1HG   GLN 113          1HG       GLN 113 -19.321   0.024   5.684
  934   2HG   GLN 113          2HG       GLN 113 -20.244  -1.239   6.497
  935   1HE2  GLN 113          2HE2      GLN 113 -17.633  -0.112   7.144
  936   2HE2  GLN 113          1HE2      GLN 113 -16.531  -1.443   7.164
  937    H    GLU 114           H        GLU 114 -22.861  -1.879   4.312
  938    HA   GLU 114           HA       GLU 114 -24.744  -1.805   5.584
  939   1HB   GLU 114          2HB       GLU 114 -23.835  -4.579   6.376
  940   2HB   GLU 114          1HB       GLU 114 -25.447  -3.924   6.635
  941   1HG   GLU 114          2HG       GLU 114 -25.759  -3.723   4.224
  942   2HG   GLU 114          1HG       GLU 114 -24.140  -4.370   3.959
  943    H    SER 115           H        SER 115 -23.259  -0.199   6.785
  944    HA   SER 115           HA       SER 115 -22.649   0.782   8.745
  945   1HB   SER 115          2HB       SER 115 -25.040   0.411   9.229
  946   2HB   SER 115          1HB       SER 115 -24.652  -1.171   9.905
  947    HG   SER 115           HG       SER 115 -24.836   0.436  11.524
  948    H    SER 116           H        SER 116 -20.910  -1.212   7.893
  949    HA   SER 116           HA       SER 116 -19.120  -2.420   8.598
  950   1HB   SER 116          2HB       SER 116 -18.747  -0.498  10.089
  951   2HB   SER 116          1HB       SER 116 -19.795  -1.234  11.302
  952    HG   SER 116           HG       SER 116 -17.672  -1.719  11.804
  953    H    ASP 117           H        ASP 117 -18.431  -4.136  10.317
  954    HA   ASP 117           HA       ASP 117 -20.769  -5.868  10.769
  955   1HB   ASP 117          1HB       ASP 117 -17.893  -6.649  10.247
  956   2HB   ASP 117          2HB       ASP 117 -19.214  -7.773  10.545
  957    H    SER 118           H        SER 118 -20.127  -3.975  12.688
  958    HA   SER 118           HA       SER 118 -19.202  -5.704  14.880
  959   1HB   SER 118          2HB       SER 118 -18.114  -3.750  15.934
  960   2HB   SER 118          1HB       SER 118 -17.399  -4.129  14.366
  961    HG   SER 118           HG       SER 118 -19.425  -2.421  14.017
  962    H    SER 119           H        SER 119 -20.722  -5.947  16.367
  963    HA   SER 119           HA       SER 119 -22.448  -3.702  17.068
  964   1HB   SER 119          1HB       SER 119 -23.718  -4.908  15.355
  965   2HB   SER 119          2HB       SER 119 -23.523  -6.413  16.253
  966    HG   SER 119           HG       SER 119 -24.696  -5.415  17.972
  Start of MODEL   12
    1   1H    MET   1          1H        MET   1   2.922  34.146 -24.991
    2   2H    MET   1          2H        MET   1   3.568  34.741 -23.546
    3   3H    MET   1          3H        MET   1   3.480  33.072 -23.809
    4    HA   MET   1           HA       MET   1   5.138  34.977 -25.354
    5   1HB   MET   1          2HB       MET   1   5.962  34.614 -23.064
    6   2HB   MET   1          1HB       MET   1   5.928  32.876 -23.326
    7   1HG   MET   1          2HG       MET   1   7.619  33.099 -25.067
    8   2HG   MET   1          1HG       MET   1   7.647  34.844 -24.818
    9   1HE   MET   1          1HE       MET   1   7.319  32.038 -22.074
   10   2HE   MET   1          2HE       MET   1   9.011  31.779 -21.649
   11   3HE   MET   1          3HE       MET   1   8.425  31.333 -23.252
   12    H    CYS   2           H        CYS   2   3.974  31.703 -24.864
   13    HA   CYS   2           HA       CYS   2   5.531  30.619 -27.036
   14   1HB   CYS   2          1HB       CYS   2   3.246  29.420 -25.458
   15   2HB   CYS   2          2HB       CYS   2   4.253  28.546 -26.607
   16    HG   CYS   2           HG       CYS   2   6.523  29.622 -24.807
   17    H    ASN   3           H        ASN   3   2.008  30.774 -26.484
   18    HA   ASN   3           HA       ASN   3   1.597  31.774 -29.171
   19   1HB   ASN   3          1HB       ASN   3   1.706  29.320 -29.482
   20   2HB   ASN   3          2HB       ASN   3   0.393  29.130 -28.324
   21   1HD2  ASN   3          2HD2      ASN   3  -1.689  29.692 -28.909
   22   2HD2  ASN   3          1HD2      ASN   3  -2.145  29.979 -30.551
   23    H    THR   4           H        THR   4   0.869  33.547 -27.835
   24    HA   THR   4           HA       THR   4  -0.753  34.862 -26.941
   25    HB   THR   4           HB       THR   4  -2.652  32.700 -27.870
   26    HG1  THR   4           1HG      THR   4  -2.364  33.499 -29.807
   27   1HG2  THR   4          1HG2      THR   4  -3.671  34.237 -26.264
   28   2HG2  THR   4          2HG2      THR   4  -4.322  34.499 -27.882
   29   3HG2  THR   4          3HG2      THR   4  -3.124  35.613 -27.223
   30    H    ASN   5           H        ASN   5  -2.492  31.853 -26.291
   31    HA   ASN   5           HA       ASN   5  -2.496  32.538 -23.455
   32   1HB   ASN   5          2HB       ASN   5  -4.275  30.836 -23.272
   33   2HB   ASN   5          1HB       ASN   5  -4.656  32.059 -24.482
   34   1HD2  ASN   5          2HD2      ASN   5  -3.768  28.749 -23.926
   35   2HD2  ASN   5          1HD2      ASN   5  -4.128  28.174 -25.516
   36    H    MET   6           H        MET   6  -1.807  31.155 -21.834
   37    HA   MET   6           HA       MET   6   0.163  29.173 -22.670
   38   1HB   MET   6          2HB       MET   6   0.867  29.200 -20.306
   39   2HB   MET   6          1HB       MET   6   0.878  30.807 -21.019
   40   1HG   MET   6          2HG       MET   6  -1.256  31.303 -19.943
   41   2HG   MET   6          1HG       MET   6  -1.275  29.689 -19.235
   42   1HE   MET   6          1HE       MET   6   1.830  32.065 -19.709
   43   2HE   MET   6          2HE       MET   6   1.840  32.921 -18.166
   44   3HE   MET   6          3HE       MET   6   0.520  33.175 -19.308
   45    H    SER   7           H        SER   7   0.129  27.023 -22.037
   46    HA   SER   7           HA       SER   7  -2.473  26.068 -21.036
   47   1HB   SER   7          2HB       SER   7  -0.557  24.696 -22.937
   48   2HB   SER   7          1HB       SER   7  -2.065  24.006 -22.338
   49    HG   SER   7           HG       SER   7  -2.159  25.060 -24.451
   50    H    VAL   8           H        VAL   8   0.954  26.003 -20.645
   51    HA   VAL   8           HA       VAL   8   0.639  24.130 -18.394
   52    HB   VAL   8           HB       VAL   8   3.050  24.288 -20.207
   53   1HG1  VAL   8          1HG1      VAL   8   3.804  22.300 -18.981
   54   2HG1  VAL   8          2HG1      VAL   8   2.399  22.428 -17.923
   55   3HG1  VAL   8          3HG1      VAL   8   3.624  23.696 -17.920
   56   1HG2  VAL   8          1HG2      VAL   8   2.384  22.064 -20.987
   57   2HG2  VAL   8          2HG2      VAL   8   1.156  23.275 -21.358
   58   3HG2  VAL   8          3HG2      VAL   8   0.919  22.161 -20.010
   59    HA   PRO   9           HA       PRO   9   2.196  28.080 -16.604
   60   1HB   PRO   9          2HB       PRO   9   1.263  26.644 -14.179
   61   2HB   PRO   9          1HB       PRO   9   0.944  28.303 -14.697
   62   1HG   PRO   9          2HG       PRO   9  -0.946  26.430 -14.869
   63   2HG   PRO   9          1HG       PRO   9  -0.767  27.666 -16.128
   64   1HD   PRO   9          2HD       PRO   9   0.084  24.797 -16.152
   65   2HD   PRO   9          1HD       PRO   9  -0.620  25.776 -17.456
   66    H    THR  10           H        THR  10   3.937  28.482 -15.157
   67    HA   THR  10           HA       THR  10   5.828  26.279 -15.016
   68    HB   THR  10           HB       THR  10   6.202  29.185 -14.264
   69    HG1  THR  10           1HG      THR  10   6.327  27.801 -16.670
   70   1HG2  THR  10          1HG2      THR  10   8.219  26.978 -14.697
   71   2HG2  THR  10          2HG2      THR  10   7.801  27.710 -13.148
   72   3HG2  THR  10          3HG2      THR  10   8.599  28.672 -14.392
   73    H    ASP  11           H        ASP  11   5.183  24.956 -13.356
   74    HA   ASP  11           HA       ASP  11   4.769  26.139 -10.711
   75   1HB   ASP  11          1HB       ASP  11   4.326  23.308 -11.687
   76   2HB   ASP  11          2HB       ASP  11   3.955  23.895 -10.068
   77    H    GLY  12           H        GLY  12   5.611  24.543  -8.893
   78   1HA   GLY  12          1HA       GLY  12   8.402  23.831  -9.544
   79   2HA   GLY  12          2HA       GLY  12   8.009  24.764  -8.107
   80    H    ALA  13           H        ALA  13   7.424  21.652  -9.697
   81    HA   ALA  13           HA       ALA  13   7.638  20.327  -7.118
   82   1HB   ALA  13          1HB       ALA  13   5.245  20.811  -7.309
   83   2HB   ALA  13          2HB       ALA  13   5.563  19.077  -7.381
   84   3HB   ALA  13          3HB       ALA  13   5.200  19.969  -8.859
   85    H    VAL  14           H        VAL  14   8.686  18.440  -7.283
   86    HA   VAL  14           HA       VAL  14   9.120  17.358  -9.989
   87    HB   VAL  14           HB       VAL  14  10.954  17.127  -7.597
   88   1HG1  VAL  14          1HG1      VAL  14  11.134  15.230  -9.106
   89   2HG1  VAL  14          2HG1      VAL  14  12.572  16.245  -9.218
   90   3HG1  VAL  14          3HG1      VAL  14  11.341  16.319 -10.478
   91   1HG2  VAL  14          1HG2      VAL  14  10.868  19.417  -8.419
   92   2HG2  VAL  14          2HG2      VAL  14  11.188  18.854 -10.060
   93   3HG2  VAL  14          3HG2      VAL  14  12.420  18.673  -8.810
   94    H    THR  15           H        THR  15   9.459  16.162  -6.643
   95    HA   THR  15           HA       THR  15   7.592  14.005  -7.177
   96    HB   THR  15           HB       THR  15  10.467  13.400  -6.454
   97    HG1  THR  15           1HG      THR  15  10.249  13.826  -8.669
   98   1HG2  THR  15          1HG2      THR  15   8.890  11.891  -5.355
   99   2HG2  THR  15          2HG2      THR  15   9.780  11.049  -6.624
  100   3HG2  THR  15          3HG2      THR  15   8.114  11.559  -6.902
  101    H    THR  16           H        THR  16   6.449  13.567  -5.406
  102    HA   THR  16           HA       THR  16   7.557  13.503  -2.786
  103    HB   THR  16           HB       THR  16   7.420  15.932  -2.970
  104    HG1  THR  16           1HG      THR  16   5.241  15.152  -1.338
  105   1HG2  THR  16          1HG2      THR  16   5.666  16.091  -4.664
  106   2HG2  THR  16          2HG2      THR  16   5.255  17.055  -3.246
  107   3HG2  THR  16          3HG2      THR  16   4.480  15.492  -3.505
  108    H    SER  17           H        SER  17   5.719  13.297  -1.107
  109    HA   SER  17           HA       SER  17   4.059  11.166  -1.833
  110   1HB   SER  17          2HB       SER  17   3.776  13.071   0.505
  111   2HB   SER  17          1HB       SER  17   2.972  11.508   0.357
  112    HG   SER  17           HG       SER  17   4.779  11.121   1.533
  113    H    GLN  18           H        GLN  18   1.635  11.159  -1.600
  114    HA   GLN  18           HA       GLN  18   0.312  13.623  -2.400
  115   1HB   GLN  18          2HB       GLN  18   1.054  12.566  -4.524
  116   2HB   GLN  18          1HB       GLN  18   0.178  11.111  -4.077
  117   1HG   GLN  18          1HG       GLN  18  -1.915  12.225  -4.212
  118   2HG   GLN  18          2HG       GLN  18  -1.132  13.794  -4.411
  119   1HE2  GLN  18          1HE2      GLN  18   0.900  12.737  -6.211
  120   2HE2  GLN  18          2HE2      GLN  18   0.113  12.481  -7.727
  121    H    ILE  19           H        ILE  19   0.137  10.198  -1.630
  122    HA   ILE  19           HA       ILE  19  -2.599  10.024  -2.087
  123    HB   ILE  19           HB       ILE  19  -2.497   7.773  -1.139
  124   1HG1  ILE  19          2HG1      ILE  19  -0.932   8.335   0.747
  125   2HG1  ILE  19          1HG1      ILE  19  -0.512   6.868  -0.129
  126   1HG2  ILE  19          1HG2      ILE  19  -0.420   8.718  -3.058
  127   2HG2  ILE  19          2HG2      ILE  19  -1.863   7.738  -3.341
  128   3HG2  ILE  19          3HG2      ILE  19  -0.442   7.017  -2.575
  129   1HD1  ILE  19          1HD1      ILE  19   1.479   8.097   0.353
  130   2HD1  ILE  19          2HD1      ILE  19   0.807   9.556  -0.376
  131   3HD1  ILE  19          3HD1      ILE  19   1.181   8.157  -1.385
  132    HA   PRO  20           HA       PRO  20  -3.836  11.557   1.956
  133   1HB   PRO  20          2HB       PRO  20  -6.173  12.603   1.190
  134   2HB   PRO  20          1HB       PRO  20  -4.640  13.370   0.761
  135   1HG   PRO  20          1HG       PRO  20  -6.500  11.777  -0.921
  136   2HG   PRO  20          2HG       PRO  20  -5.431  13.112  -1.379
  137   1HD   PRO  20          2HD       PRO  20  -4.941  10.339  -1.704
  138   2HD   PRO  20          1HD       PRO  20  -3.794  11.666  -1.973
  139    H    ALA  21           H        ALA  21  -5.015  10.621   3.548
  140    HA   ALA  21           HA       ALA  21  -6.367   8.162   3.075
  141   1HB   ALA  21          1HB       ALA  21  -6.342   9.874   5.558
  142   2HB   ALA  21          2HB       ALA  21  -5.167   8.621   5.161
  143   3HB   ALA  21          3HB       ALA  21  -6.851   8.188   5.460
  144    H    SER  22           H        SER  22  -8.595   7.683   3.541
  145    HA   SER  22           HA       SER  22 -10.838   7.989   3.374
  146   1HB   SER  22          2HB       SER  22 -10.196  10.838   4.172
  147   2HB   SER  22          1HB       SER  22 -11.810  10.129   4.140
  148    HG   SER  22           HG       SER  22 -11.077   9.951   6.216
  149    H    GLU  23           H        GLU  23  -8.664   9.244   1.309
  150    HA   GLU  23           HA       GLU  23 -10.572  10.471  -0.511
  151   1HB   GLU  23          1HB       GLU  23  -8.126  11.168  -0.298
  152   2HB   GLU  23          2HB       GLU  23  -7.729   9.672  -1.129
  153   1HG   GLU  23          1HG       GLU  23  -9.546  11.784  -2.261
  154   2HG   GLU  23          2HG       GLU  23  -7.816  11.692  -2.582
  155    H    GLN  24           H        GLN  24  -8.154   7.979  -1.277
  156    HA   GLN  24           HA       GLN  24 -10.250   6.261  -2.371
  157   1HB   GLN  24          2HB       GLN  24  -8.385   4.788  -3.036
  158   2HB   GLN  24          1HB       GLN  24  -8.188   6.424  -3.651
  159   1HG   GLN  24          2HG       GLN  24  -6.603   6.909  -1.856
  160   2HG   GLN  24          1HG       GLN  24  -6.805   5.270  -1.240
  161   1HE2  GLN  24          1HE2      GLN  24  -4.639   4.776  -1.509
  162   2HE2  GLN  24          2HE2      GLN  24  -3.933   4.521  -3.066
  163    H    GLU  25           H        GLU  25 -10.700   4.182  -1.545
  164    HA   GLU  25           HA       GLU  25  -9.393   2.977   0.585
  165   1HB   GLU  25          2HB       GLU  25 -10.328   4.948   1.837
  166   2HB   GLU  25          1HB       GLU  25 -11.935   4.313   1.497
  167   1HG   GLU  25          1HG       GLU  25 -10.737   2.112   2.503
  168   2HG   GLU  25          2HG       GLU  25  -9.887   3.383   3.388
  169    H    THR  26           H        THR  26  -9.714   1.167  -0.475
  170    HA   THR  26           HA       THR  26 -12.250   0.090  -1.222
  171    HB   THR  26           HB       THR  26  -9.719  -1.433  -0.649
  172    HG1  THR  26           1HG      THR  26  -8.971  -0.750  -2.524
  173   1HG2  THR  26          1HG2      THR  26 -10.657  -3.017  -2.267
  174   2HG2  THR  26          2HG2      THR  26 -12.086  -1.997  -2.438
  175   3HG2  THR  26          3HG2      THR  26 -11.744  -2.785  -0.898
  176    H    LEU  27           H        LEU  27 -13.501  -1.482  -0.072
  177    HA   LEU  27           HA       LEU  27 -12.522  -2.193   2.585
  178   1HB   LEU  27          2HB       LEU  27 -15.158  -2.253   1.297
  179   2HB   LEU  27          1HB       LEU  27 -14.780  -3.688   2.237
  180    HG   LEU  27           HG       LEU  27 -15.948  -2.065   3.626
  181   1HD1  LEU  27          1HD1      LEU  27 -14.368  -1.933   5.452
  182   2HD1  LEU  27          2HD1      LEU  27 -13.018  -2.162   4.339
  183   3HD1  LEU  27          3HD1      LEU  27 -14.164  -3.478   4.620
  184   1HD2  LEU  27          1HD2      LEU  27 -14.915   0.115   4.116
  185   2HD2  LEU  27          2HD2      LEU  27 -15.349  -0.041   2.414
  186   3HD2  LEU  27          3HD2      LEU  27 -13.665  -0.223   2.914
  187    H    VAL  28           H        VAL  28 -10.712  -2.999   1.298
  188    HA   VAL  28           HA       VAL  28 -11.172  -5.128  -0.561
  189    HB   VAL  28           HB       VAL  28  -9.442  -3.721  -1.220
  190   1HG1  VAL  28          1HG1      VAL  28  -7.571  -3.093   0.321
  191   2HG1  VAL  28          2HG1      VAL  28  -8.477  -3.870   1.626
  192   3HG1  VAL  28          3HG1      VAL  28  -9.158  -2.464   0.788
  193   1HG2  VAL  28          1HG2      VAL  28  -7.373  -5.047  -1.083
  194   2HG2  VAL  28          2HG2      VAL  28  -8.786  -6.034  -1.469
  195   3HG2  VAL  28          3HG2      VAL  28  -8.121  -6.045   0.167
  196    H    ARG  29           H        ARG  29 -10.917  -7.250  -0.255
  197    HA   ARG  29           HA       ARG  29 -10.018  -8.131   2.390
  198   1HB   ARG  29          1HB       ARG  29 -12.494  -9.269   1.113
  199   2HB   ARG  29          2HB       ARG  29 -11.989  -9.353   2.795
  200   1HG   ARG  29          2HG       ARG  29 -12.505  -7.029   3.126
  201   2HG   ARG  29          1HG       ARG  29 -12.843  -6.815   1.405
  202   1HD   ARG  29          1HD       ARG  29 -14.382  -8.582   3.310
  203   2HD   ARG  29          2HD       ARG  29 -14.906  -7.012   2.703
  204    HE   ARG  29           HE       ARG  29 -14.360  -8.659   0.513
  205   1HH1  ARG  29          2HH1      ARG  29 -16.630  -8.421   3.146
  206   2HH1  ARG  29          1HH1      ARG  29 -17.914  -9.193   2.279
  207   1HH2  ARG  29          1HH2      ARG  29 -16.047  -9.676  -0.638
  208   2HH2  ARG  29          2HH2      ARG  29 -17.583  -9.907   0.128
  209    HA   PRO  30           HA       PRO  30  -8.570 -10.588  -1.280
  210   1HB   PRO  30          1HB       PRO  30  -5.945 -10.116  -1.180
  211   2HB   PRO  30          2HB       PRO  30  -7.072  -8.890  -1.774
  212   1HG   PRO  30          1HG       PRO  30  -5.731  -9.110   0.891
  213   2HG   PRO  30          2HG       PRO  30  -6.033  -7.669  -0.097
  214   1HD   PRO  30          2HD       PRO  30  -7.583  -8.480   2.056
  215   2HD   PRO  30          1HD       PRO  30  -8.123  -7.387   0.768
  216    H    LYS  31           H        LYS  31  -7.671 -12.627  -1.448
  217    HA   LYS  31           HA       LYS  31  -7.164 -14.217   0.818
  218   1HB   LYS  31          2HB       LYS  31  -6.221 -15.839  -0.791
  219   2HB   LYS  31          1HB       LYS  31  -7.772 -15.202  -1.321
  220   1HG   LYS  31          2HG       LYS  31  -6.618 -13.665  -2.838
  221   2HG   LYS  31          1HG       LYS  31  -5.067 -14.330  -2.316
  222   1HD   LYS  31          1HD       LYS  31  -5.732 -16.533  -3.147
  223   2HD   LYS  31          2HD       LYS  31  -7.284 -15.870  -3.666
  224   1HE   LYS  31          2HE       LYS  31  -5.738 -16.051  -5.542
  225   2HE   LYS  31          1HE       LYS  31  -6.133 -14.366  -5.205
  226   1HZ   LYS  31          1HZ       LYS  31  -4.034 -14.145  -4.029
  227   2HZ   LYS  31          2HZ       LYS  31  -3.776 -14.649  -5.624
  228   3HZ   LYS  31          3HZ       LYS  31  -3.654 -15.762  -4.356
  229    HA   PRO  32           HA       PRO  32  -3.140 -13.515   2.334
  230   1HB   PRO  32          1HB       PRO  32  -1.832 -15.921   1.585
  231   2HB   PRO  32          2HB       PRO  32  -2.590 -15.552   3.136
  232   1HG   PRO  32          2HG       PRO  32  -3.659 -17.072   0.822
  233   2HG   PRO  32          1HG       PRO  32  -4.002 -17.260   2.551
  234   1HD   PRO  32          1HD       PRO  32  -5.786 -16.152   0.891
  235   2HD   PRO  32          2HD       PRO  32  -5.576 -15.552   2.550
  236    H    LEU  33           H        LEU  33  -2.479 -11.879   0.949
  237    HA   LEU  33           HA       LEU  33  -0.356 -12.589  -0.875
  238   1HB   LEU  33          2HB       LEU  33  -2.415 -12.705  -2.266
  239   2HB   LEU  33          1HB       LEU  33  -2.737 -11.026  -1.880
  240    HG   LEU  33           HG       LEU  33  -0.628 -10.385  -3.005
  241   1HD1  LEU  33          1HD2      LEU  33  -0.505 -13.303  -3.754
  242   2HD1  LEU  33          2HD2      LEU  33   0.613 -12.452  -2.687
  243   3HD1  LEU  33          3HD2      LEU  33   0.532 -12.030  -4.397
  244   1HD2  LEU  33          1HD1      LEU  33  -1.395 -10.792  -5.289
  245   2HD2  LEU  33          2HD1      LEU  33  -2.731 -10.335  -4.233
  246   3HD2  LEU  33          3HD1      LEU  33  -2.512 -12.023  -4.696
  247    H    LEU  34           H        LEU  34  -2.160 -10.302   0.984
  248    HA   LEU  34           HA       LEU  34   0.243  -8.620   1.045
  249   1HB   LEU  34          1HB       LEU  34  -2.627  -7.733   0.897
  250   2HB   LEU  34          2HB       LEU  34  -1.359  -6.691   1.515
  251    HG   LEU  34           HG       LEU  34  -0.520  -7.719  -1.005
  252   1HD1  LEU  34          1HD1      LEU  34  -2.933  -8.100  -1.378
  253   2HD1  LEU  34          2HD1      LEU  34  -2.242  -6.892  -2.463
  254   3HD1  LEU  34          3HD1      LEU  34  -3.219  -6.383  -1.086
  255   1HD2  LEU  34          1HD2      LEU  34  -0.371  -5.370  -1.549
  256   2HD2  LEU  34          2HD2      LEU  34   0.197  -5.642   0.101
  257   3HD2  LEU  34          3HD2      LEU  34  -1.405  -4.960  -0.182
  258    H    LEU  35           H        LEU  35  -2.005 -10.506   2.623
  259    HA   LEU  35           HA       LEU  35  -2.063  -8.955   5.060
  260   1HB   LEU  35          2HB       LEU  35  -3.168 -11.737   4.793
  261   2HB   LEU  35          1HB       LEU  35  -3.724 -10.431   5.818
  262    HG   LEU  35           HG       LEU  35  -5.390 -10.548   4.221
  263   1HD1  LEU  35          1HD1      LEU  35  -5.305  -8.555   2.986
  264   2HD1  LEU  35          2HD1      LEU  35  -3.549  -8.625   2.840
  265   3HD1  LEU  35          3HD1      LEU  35  -4.288  -8.277   4.402
  266   1HD2  LEU  35          1HD2      LEU  35  -3.259 -10.977   2.133
  267   2HD2  LEU  35          2HD2      LEU  35  -4.993 -10.867   1.824
  268   3HD2  LEU  35          3HD2      LEU  35  -4.352 -12.196   2.790
  269    H    LYS  36           H        LYS  36  -0.709 -12.014   3.887
  270    HA   LYS  36           HA       LYS  36   0.935 -12.560   6.110
  271   1HB   LYS  36          1HB       LYS  36   0.644 -13.997   4.053
  272   2HB   LYS  36          2HB       LYS  36   1.690 -12.873   3.200
  273   1HG   LYS  36          1HG       LYS  36   3.504 -13.367   4.757
  274   2HG   LYS  36          2HG       LYS  36   2.456 -14.495   5.620
  275   1HD   LYS  36          1HD       LYS  36   2.249 -15.851   3.589
  276   2HD   LYS  36          2HD       LYS  36   3.304 -14.725   2.732
  277   1HE   LYS  36          1HE       LYS  36   4.534 -16.698   3.472
  278   2HE   LYS  36          2HE       LYS  36   5.122 -15.241   4.271
  279   1HZ   LYS  36          1HZ       LYS  36   3.258 -17.228   5.455
  280   2HZ   LYS  36          2HZ       LYS  36   3.821 -15.829   6.221
  281   3HZ   LYS  36          3HZ       LYS  36   4.901 -17.069   5.828
  282    H    LEU  37           H        LEU  37   0.732  -9.898   4.061
  283    HA   LEU  37           HA       LEU  37   3.529  -9.120   4.443
  284   1HB   LEU  37          1HB       LEU  37   2.701  -9.093   2.151
  285   2HB   LEU  37          2HB       LEU  37   1.356  -8.066   2.619
  286    HG   LEU  37           HG       LEU  37   3.994  -6.930   3.215
  287   1HD1  LEU  37          1HD2      LEU  37   3.098  -7.333   0.363
  288   2HD1  LEU  37          2HD2      LEU  37   4.525  -8.048   1.112
  289   3HD1  LEU  37          3HD2      LEU  37   4.428  -6.302   0.890
  290   1HD2  LEU  37          1HD1      LEU  37   1.950  -5.636   1.526
  291   2HD2  LEU  37          2HD1      LEU  37   2.870  -4.996   2.891
  292   3HD2  LEU  37          3HD1      LEU  37   1.477  -6.050   3.177
  293    H    LEU  38           H        LEU  38   0.533  -8.723   5.833
  294    HA   LEU  38           HA       LEU  38   1.240  -6.079   6.918
  295   1HB   LEU  38          1HB       LEU  38  -1.496  -7.100   6.179
  296   2HB   LEU  38          2HB       LEU  38  -1.199  -5.602   7.039
  297    HG   LEU  38           HG       LEU  38  -0.548  -6.284   4.184
  298   1HD1  LEU  38          1HD2      LEU  38  -2.780  -5.358   4.806
  299   2HD1  LEU  38          2HD2      LEU  38  -1.859  -4.382   3.663
  300   3HD1  LEU  38          3HD2      LEU  38  -1.950  -3.902   5.360
  301   1HD2  LEU  38          1HD1      LEU  38   0.486  -3.961   5.787
  302   2HD2  LEU  38          2HD1      LEU  38   0.631  -4.151   4.039
  303   3HD2  LEU  38          3HD1      LEU  38   1.437  -5.286   5.122
  304    H    LYS  39           H        LYS  39  -0.870  -8.891   7.529
  305    HA   LYS  39           HA       LYS  39  -1.129  -8.647  10.277
  306   1HB   LYS  39          2HB       LYS  39  -0.801 -11.226   8.738
  307   2HB   LYS  39          1HB       LYS  39  -1.561 -11.038  10.314
  308   1HG   LYS  39          2HG       LYS  39  -3.328  -9.703   9.336
  309   2HG   LYS  39          1HG       LYS  39  -2.549  -9.790   7.758
  310   1HD   LYS  39          2HD       LYS  39  -3.664 -12.114   9.321
  311   2HD   LYS  39          1HD       LYS  39  -4.396 -11.360   7.901
  312   1HE   LYS  39          1HE       LYS  39  -2.520 -12.032   6.532
  313   2HE   LYS  39          2HE       LYS  39  -1.701 -12.710   7.939
  314   1HZ   LYS  39          1HZ       LYS  39  -4.277 -13.665   6.812
  315   2HZ   LYS  39          2HZ       LYS  39  -3.496 -14.313   8.165
  316   3HZ   LYS  39          3HZ       LYS  39  -2.778 -14.430   6.640
  317    H    SER  40           H        SER  40   1.663  -9.306   8.423
  318    HA   SER  40           HA       SER  40   3.282 -10.379  10.520
  319   1HB   SER  40          2HB       SER  40   5.181  -9.651   9.068
  320   2HB   SER  40          1HB       SER  40   3.995 -10.643   8.220
  321    HG   SER  40           HG       SER  40   4.548  -7.911   7.970
  322    H    VAL  41           H        VAL  41   3.145  -7.127   9.057
  323    HA   VAL  41           HA       VAL  41   4.660  -5.708  10.865
  324    HB   VAL  41           HB       VAL  41   2.205  -4.269  10.197
  325   1HG1  VAL  41          1HG2      VAL  41   4.043  -2.880   8.974
  326   2HG1  VAL  41          2HG2      VAL  41   5.145  -3.903   9.898
  327   3HG1  VAL  41          3HG2      VAL  41   3.958  -2.900  10.736
  328   1HG2  VAL  41          1HG1      VAL  41   1.895  -5.463   8.274
  329   2HG2  VAL  41          2HG1      VAL  41   3.618  -5.807   8.075
  330   3HG2  VAL  41          3HG1      VAL  41   2.991  -4.197   7.705
  331    H    GLY  42           H        GLY  42   1.113  -5.707  10.981
  332   1HA   GLY  42          1HA       GLY  42   1.046  -6.284  13.801
  333   2HA   GLY  42          2HA       GLY  42   0.717  -4.598  13.424
  334    H    ALA  43           H        ALA  43  -0.397  -5.795  10.771
  335    HA   ALA  43           HA       ALA  43  -3.105  -5.527  11.406
  336   1HB   ALA  43          1HB       ALA  43  -1.914  -7.023   9.075
  337   2HB   ALA  43          2HB       ALA  43  -2.204  -5.285   9.139
  338   3HB   ALA  43          3HB       ALA  43  -3.562  -6.408   9.188
  339    H    GLN  44           H        GLN  44  -4.783  -7.295  10.943
  340    HA   GLN  44           HA       GLN  44  -4.161 -10.000  11.499
  341   1HB   GLN  44          1HB       GLN  44  -3.674  -9.065  13.730
  342   2HB   GLN  44          2HB       GLN  44  -5.308  -8.424  13.811
  343   1HG   GLN  44          2HG       GLN  44  -5.128 -10.457  15.102
  344   2HG   GLN  44          1HG       GLN  44  -6.203 -10.695  13.726
  345   1HE2  GLN  44          1HE2      GLN  44  -5.929 -12.917  13.754
  346   2HE2  GLN  44          2HE2      GLN  44  -4.467 -13.675  13.234
  347    H    LYS  45           H        LYS  45  -6.369  -7.415  11.049
  348    HA   LYS  45           HA       LYS  45  -8.820  -8.637  11.567
  349   1HB   LYS  45          2HB       LYS  45  -8.296  -6.612   9.388
  350   2HB   LYS  45          1HB       LYS  45  -9.821  -6.917  10.206
  351   1HG   LYS  45          2HG       LYS  45  -8.810  -6.132  12.317
  352   2HG   LYS  45          1HG       LYS  45  -7.334  -5.742  11.430
  353   1HD   LYS  45          1HD       LYS  45 -10.064  -4.578  10.881
  354   2HD   LYS  45          2HD       LYS  45  -8.767  -3.770  11.765
  355   1HE   LYS  45          1HE       LYS  45  -7.356  -3.814   9.793
  356   2HE   LYS  45          2HE       LYS  45  -8.590  -4.705   8.902
  357   1HZ   LYS  45          1HZ       LYS  45 -10.068  -2.813   9.118
  358   2HZ   LYS  45          2HZ       LYS  45  -8.628  -2.351   8.362
  359   3HZ   LYS  45          3HZ       LYS  45  -8.894  -1.957   9.985
  360    H    ASP  46           H        ASP  46 -10.479  -9.268   9.957
  361    HA   ASP  46           HA       ASP  46  -9.381 -11.136   8.028
  362   1HB   ASP  46          1HB       ASP  46 -12.250 -10.542   8.791
  363   2HB   ASP  46          2HB       ASP  46 -11.729 -11.845   7.727
  364    H    THR  47           H        THR  47 -10.683  -7.964   8.087
  365    HA   THR  47           HA       THR  47 -10.683  -7.932   5.137
  366    HB   THR  47           HB       THR  47 -12.107  -5.855   5.344
  367    HG1  THR  47           1HG      THR  47 -11.788  -6.497   8.006
  368   1HG2  THR  47          1HG2      THR  47 -13.014  -8.122   4.790
  369   2HG2  THR  47          2HG2      THR  47 -14.172  -7.030   5.554
  370   3HG2  THR  47          3HG2      THR  47 -13.412  -8.314   6.498
  371    H    TYR  48           H        TYR  48 -10.014  -5.882   4.168
  372    HA   TYR  48           HA       TYR  48  -8.360  -4.211   5.916
  373   1HB   TYR  48          2HB       TYR  48  -7.526  -5.535   3.354
  374   2HB   TYR  48          1HB       TYR  48  -6.744  -4.066   3.922
  375    HD1  TYR  48           1HD      TYR  48  -5.128  -4.122   5.598
  376    HD2  TYR  48           2HD      TYR  48  -7.475  -7.588   4.827
  377    HE1  TYR  48           1HE      TYR  48  -3.630  -5.451   7.038
  378    HE2  TYR  48           2HE      TYR  48  -5.972  -8.926   6.254
  379    HH   TYR  48           HH       TYR  48  -3.645  -8.818   7.081
  380    H    THR  49           H        THR  49  -7.615  -2.223   4.670
  381    HA   THR  49           HA       THR  49  -9.533  -1.378   2.631
  382    HB   THR  49           HB       THR  49  -9.937   0.778   3.703
  383    HG1  THR  49           1HG      THR  49  -9.015   0.071   6.190
  384   1HG2  THR  49          1HG2      THR  49 -11.344   0.028   5.573
  385   2HG2  THR  49          2HG2      THR  49 -10.538  -1.541   5.543
  386   3HG2  THR  49          3HG2      THR  49 -11.515  -1.025   4.168
  387    H    MET  50           H        MET  50  -8.793   0.445   1.380
  388    HA   MET  50           HA       MET  50  -6.152   0.269   0.594
  389   1HB   MET  50          2HB       MET  50  -8.306   2.280   0.190
  390   2HB   MET  50          1HB       MET  50  -6.671   2.719  -0.286
  391   1HG   MET  50          1HG       MET  50  -6.638   0.582  -1.637
  392   2HG   MET  50          2HG       MET  50  -8.369   0.472  -1.322
  393   1HE   MET  50          1HE       MET  50  -7.045   0.565  -4.254
  394   2HE   MET  50          2HE       MET  50  -8.161   1.652  -5.081
  395   3HE   MET  50          3HE       MET  50  -8.782   0.418  -3.986
  396    H    LYS  51           H        LYS  51  -7.509   2.043   3.238
  397    HA   LYS  51           HA       LYS  51  -5.154   3.733   3.526
  398   1HB   LYS  51          1HB       LYS  51  -6.350   4.747   5.404
  399   2HB   LYS  51          2HB       LYS  51  -7.357   4.714   3.965
  400   1HG   LYS  51          2HG       LYS  51  -8.574   2.804   4.824
  401   2HG   LYS  51          1HG       LYS  51  -7.528   2.754   6.244
  402   1HD   LYS  51          2HD       LYS  51  -8.299   5.010   6.863
  403   2HD   LYS  51          1HD       LYS  51  -9.382   5.004   5.471
  404   1HE   LYS  51          2HE       LYS  51 -10.543   3.051   6.386
  405   2HE   LYS  51          1HE       LYS  51  -9.465   3.068   7.782
  406   1HZ   LYS  51          1HZ       LYS  51 -11.345   5.239   7.027
  407   2HZ   LYS  51          2HZ       LYS  51 -10.312   5.254   8.365
  408   3HZ   LYS  51          3HZ       LYS  51 -11.572   4.129   8.284
  409    H    GLU  52           H        GLU  52  -6.761   1.048   5.149
  410    HA   GLU  52           HA       GLU  52  -5.051   0.704   7.321
  411   1HB   GLU  52          2HB       GLU  52  -7.211  -0.624   6.332
  412   2HB   GLU  52          1HB       GLU  52  -5.924  -1.759   5.950
  413   1HG   GLU  52          1HG       GLU  52  -6.916  -2.291   8.085
  414   2HG   GLU  52          2HG       GLU  52  -5.242  -1.783   8.293
  415    H    VAL  53           H        VAL  53  -4.861  -0.697   4.063
  416    HA   VAL  53           HA       VAL  53  -2.272  -1.831   4.473
  417    HB   VAL  53           HB       VAL  53  -3.621  -1.259   1.833
  418   1HG1  VAL  53          1HG2      VAL  53  -1.526  -3.276   2.629
  419   2HG1  VAL  53          2HG2      VAL  53  -1.262  -1.828   1.659
  420   3HG1  VAL  53          3HG2      VAL  53  -2.265  -3.138   1.035
  421   1HG2  VAL  53          1HG1      VAL  53  -5.145  -2.515   3.243
  422   2HG2  VAL  53          2HG1      VAL  53  -3.876  -3.684   3.607
  423   3HG2  VAL  53          3HG1      VAL  53  -4.505  -3.547   1.966
  424    H    LEU  54           H        LEU  54  -3.485   1.253   3.427
  425    HA   LEU  54           HA       LEU  54  -1.385   2.327   2.015
  426   1HB   LEU  54          2HB       LEU  54  -3.419   3.572   2.419
  427   2HB   LEU  54          1HB       LEU  54  -3.084   3.632   4.138
  428    HG   LEU  54           HG       LEU  54  -1.113   5.052   3.695
  429   1HD1  LEU  54          1HD2      LEU  54  -0.595   4.266   1.446
  430   2HD1  LEU  54          2HD2      LEU  54  -0.797   6.018   1.474
  431   3HD1  LEU  54          3HD2      LEU  54  -2.084   4.993   0.841
  432   1HD2  LEU  54          1HD1      LEU  54  -3.260   6.076   4.220
  433   2HD2  LEU  54          2HD1      LEU  54  -3.689   6.078   2.509
  434   3HD2  LEU  54          3HD1      LEU  54  -2.348   7.069   3.082
  435    H    PHE  55           H        PHE  55  -1.761   2.896   5.519
  436    HA   PHE  55           HA       PHE  55   0.962   3.661   5.782
  437   1HB   PHE  55          1HB       PHE  55   0.520   3.970   8.095
  438   2HB   PHE  55          2HB       PHE  55  -0.955   4.426   7.254
  439    HD1  PHE  55           1HD      PHE  55  -2.889   2.850   7.238
  440    HD2  PHE  55           2HD      PHE  55   0.541   2.224   9.674
  441    HE1  PHE  55           1HE      PHE  55  -4.175   1.294   8.641
  442    HE2  PHE  55           2HE      PHE  55  -0.737   0.663  11.081
  443    HZ   PHE  55           HZ       PHE  55  -3.099   0.196  10.566
  444    H    TYR  56           H        TYR  56  -0.798   0.668   6.355
  445    HA   TYR  56           HA       TYR  56   1.149  -0.639   7.889
  446   1HB   TYR  56          1HB       TYR  56  -1.316  -1.369   6.547
  447   2HB   TYR  56          2HB       TYR  56  -0.121  -2.660   6.477
  448    HD1  TYR  56           1HD      TYR  56  -2.844  -2.433   8.033
  449    HD2  TYR  56           2HD      TYR  56   1.240  -1.970   9.135
  450    HE1  TYR  56           1HE      TYR  56  -3.403  -3.072  10.336
  451    HE2  TYR  56           2HE      TYR  56   0.701  -2.615  11.444
  452    HH   TYR  56           HH       TYR  56  -1.261  -2.640  12.936
  453    H    LEU  57           H        LEU  57   0.400  -1.263   4.457
  454    HA   LEU  57           HA       LEU  57   2.647  -2.778   3.890
  455   1HB   LEU  57          2HB       LEU  57   0.679  -2.427   2.386
  456   2HB   LEU  57          1HB       LEU  57   1.308  -0.837   2.005
  457    HG   LEU  57           HG       LEU  57   3.070  -3.201   1.549
  458   1HD1  LEU  57          1HD1      LEU  57   0.937  -3.893   0.598
  459   2HD1  LEU  57          2HD1      LEU  57   2.108  -3.533  -0.670
  460   3HD1  LEU  57          3HD1      LEU  57   0.832  -2.374  -0.292
  461   1HD2  LEU  57          1HD2      LEU  57   2.633  -0.603   0.085
  462   2HD2  LEU  57          2HD2      LEU  57   3.842  -1.822  -0.317
  463   3HD2  LEU  57          3HD2      LEU  57   3.943  -0.954   1.214
  464    H    GLY  58           H        GLY  58   2.252   0.727   3.970
  465   1HA   GLY  58          2HA       GLY  58   4.771   1.543   3.124
  466   2HA   GLY  58          1HA       GLY  58   3.825   2.352   4.364
  467    H    GLN  59           H        GLN  59   3.775   0.501   6.382
  468    HA   GLN  59           HA       GLN  59   6.262   0.764   7.632
  469   1HB   GLN  59          2HB       GLN  59   4.294  -1.437   8.247
  470   2HB   GLN  59          1HB       GLN  59   5.430  -0.668   9.345
  471   1HG   GLN  59          2HG       GLN  59   2.908   0.484   8.195
  472   2HG   GLN  59          1HG       GLN  59   3.275   0.133   9.881
  473   1HE2  GLN  59          1HE2      GLN  59   2.439   2.632   8.616
  474   2HE2  GLN  59          2HE2      GLN  59   3.659   3.792   9.005
  475    H    TYR  60           H        TYR  60   4.812  -2.054   6.016
  476    HA   TYR  60           HA       TYR  60   6.842  -3.866   6.553
  477   1HB   TYR  60          1HB       TYR  60   4.670  -4.555   5.713
  478   2HB   TYR  60          2HB       TYR  60   4.983  -3.758   4.175
  479    HD1  TYR  60           1HD      TYR  60   6.097  -4.876   2.451
  480    HD2  TYR  60           2HD      TYR  60   6.134  -6.511   6.374
  481    HE1  TYR  60           1HE      TYR  60   7.109  -6.937   1.575
  482    HE2  TYR  60           2HE      TYR  60   7.143  -8.578   5.511
  483    HH   TYR  60           HH       TYR  60   8.449  -8.818   2.378
  484    H    ILE  61           H        ILE  61   6.595  -1.526   3.892
  485    HA   ILE  61           HA       ILE  61   8.905  -2.351   2.480
  486    HB   ILE  61           HB       ILE  61   8.105   0.540   2.727
  487   1HG1  ILE  61          2HG1      ILE  61   6.006  -0.431   2.292
  488   2HG1  ILE  61          1HG1      ILE  61   6.611   0.015   0.699
  489   1HG2  ILE  61          1HG2      ILE  61   8.840   0.600   0.371
  490   2HG2  ILE  61          2HG2      ILE  61   9.273  -1.106   0.488
  491   3HG2  ILE  61          3HG2      ILE  61  10.120   0.088   1.473
  492   1HD1  ILE  61          1HD1      ILE  61   5.542  -2.229   0.842
  493   2HD1  ILE  61          2HD1      ILE  61   6.888  -2.726   1.871
  494   3HD1  ILE  61          3HD1      ILE  61   7.188  -2.226   0.203
  495    H    MET  62           H        MET  62   8.380  -0.245   5.206
  496    HA   MET  62           HA       MET  62  11.039   0.722   5.435
  497   1HB   MET  62          2HB       MET  62   8.874   0.494   7.534
  498   2HB   MET  62          1HB       MET  62  10.368   1.403   7.722
  499   1HG   MET  62          1HG       MET  62   9.722   2.857   5.874
  500   2HG   MET  62          2HG       MET  62   8.227   1.943   5.676
  501   1HE   MET  62          1HE       MET  62   6.985   5.351   7.165
  502   2HE   MET  62          2HE       MET  62   6.827   4.199   5.838
  503   3HE   MET  62          3HE       MET  62   8.322   5.114   6.040
  504    H    THR  63           H        THR  63   9.442  -1.321   7.870
  505    HA   THR  63           HA       THR  63  11.819  -2.506   8.803
  506    HB   THR  63           HB       THR  63  10.367  -4.164   9.907
  507    HG1  THR  63           1HG      THR  63   8.102  -4.026   9.542
  508   1HG2  THR  63          1HG2      THR  63  10.669  -1.972  10.947
  509   2HG2  THR  63          2HG2      THR  63   9.050  -2.596  11.257
  510   3HG2  THR  63          3HG2      THR  63   9.294  -1.343  10.041
  511    H    LYS  64           H        LYS  64  12.085  -4.995   8.776
  512    HA   LYS  64           HA       LYS  64  12.772  -6.794   7.570
  513   1HB   LYS  64          2HB       LYS  64  10.360  -6.113   5.871
  514   2HB   LYS  64          1HB       LYS  64  11.249  -7.630   5.815
  515   1HG   LYS  64          2HG       LYS  64   9.949  -6.643   8.334
  516   2HG   LYS  64          1HG       LYS  64   9.074  -7.591   7.129
  517   1HD   LYS  64          1HD       LYS  64   9.808  -9.231   8.579
  518   2HD   LYS  64          2HD       LYS  64  11.081  -9.234   7.357
  519   1HE   LYS  64          2HE       LYS  64  12.458  -7.806   8.786
  520   2HE   LYS  64          1HE       LYS  64  11.184  -7.795  10.005
  521   1HZ   LYS  64          1HZ       LYS  64  11.439 -10.187  10.240
  522   2HZ   LYS  64          2HZ       LYS  64  12.905  -9.400  10.541
  523   3HZ   LYS  64          3HZ       LYS  64  12.660 -10.197   9.069
  524    H    ARG  65           H        ARG  65  14.623  -5.453   7.028
  525    HA   ARG  65           HA       ARG  65  14.797  -3.587   5.044
  526   1HB   ARG  65          2HB       ARG  65  16.952  -5.523   5.902
  527   2HB   ARG  65          1HB       ARG  65  17.229  -4.040   4.998
  528   1HG   ARG  65          1HG       ARG  65  16.324  -2.743   6.876
  529   2HG   ARG  65          2HG       ARG  65  16.103  -4.240   7.784
  530   1HD   ARG  65          2HD       ARG  65  18.728  -3.155   6.769
  531   2HD   ARG  65          1HD       ARG  65  18.161  -3.095   8.438
  532    HE   ARG  65           HE       ARG  65  18.154  -5.763   7.554
  533   1HH1  ARG  65          2HH1      ARG  65  20.378  -3.211   8.383
  534   2HH1  ARG  65          1HH1      ARG  65  21.632  -4.292   8.887
  535   1HH2  ARG  65          1HH2      ARG  65  19.800  -7.194   8.219
  536   2HH2  ARG  65          2HH2      ARG  65  21.304  -6.556   8.795
  537    H    LEU  66           H        LEU  66  13.658  -4.150   3.189
  538    HA   LEU  66           HA       LEU  66  15.186  -5.924   1.399
  539   1HB   LEU  66          1HB       LEU  66  12.300  -5.244   1.558
  540   2HB   LEU  66          2HB       LEU  66  12.981  -5.429  -0.044
  541    HG   LEU  66           HG       LEU  66  11.975  -7.507   0.649
  542   1HD1  LEU  66          1HD1      LEU  66  14.980  -7.699   0.761
  543   2HD1  LEU  66          2HD1      LEU  66  14.000  -7.645  -0.704
  544   3HD1  LEU  66          3HD1      LEU  66  13.866  -9.017   0.396
  545   1HD2  LEU  66          1HD2      LEU  66  12.122  -7.139   3.077
  546   2HD2  LEU  66          2HD2      LEU  66  13.853  -7.473   3.005
  547   3HD2  LEU  66          3HD2      LEU  66  12.690  -8.737   2.595
  548    H    TYR  67           H        TYR  67  14.381  -2.721   2.174
  549    HA   TYR  67           HA       TYR  67  14.518  -1.470  -0.339
  550   1HB   TYR  67          1HB       TYR  67  14.833   0.585   0.859
  551   2HB   TYR  67          2HB       TYR  67  13.712  -0.409   1.782
  552    HD1  TYR  67           1HD      TYR  67  14.718  -1.793   3.728
  553    HD2  TYR  67           2HD      TYR  67  16.700   1.498   1.900
  554    HE1  TYR  67           1HE      TYR  67  16.133  -1.545   5.723
  555    HE2  TYR  67           2HE      TYR  67  18.123   1.753   3.888
  556    HH   TYR  67           HH       TYR  67  18.067   1.189   6.277
  557    H    ASP  68           H        ASP  68  16.308  -0.003  -1.051
  558    HA   ASP  68           HA       ASP  68  18.351  -1.588  -1.924
  559   1HB   ASP  68          1HB       ASP  68  17.602   1.010  -2.376
  560   2HB   ASP  68          2HB       ASP  68  19.171   1.214  -1.614
  561    H    GLU  69           H        GLU  69  18.210   0.241   1.046
  562    HA   GLU  69           HA       GLU  69  19.697   0.675   2.711
  563   1HB   GLU  69          1HB       GLU  69  20.198  -1.711   2.767
  564   2HB   GLU  69          2HB       GLU  69  21.314  -1.534   1.421
  565   1HG   GLU  69          1HG       GLU  69  22.749  -0.122   2.797
  566   2HG   GLU  69          2HG       GLU  69  21.635  -0.311   4.150
  567    H    LYS  70           H        LYS  70  20.175   1.154  -0.503
  568    HA   LYS  70           HA       LYS  70  22.742   2.522  -0.234
  569   1HB   LYS  70          1HB       LYS  70  20.995   2.076  -2.661
  570   2HB   LYS  70          2HB       LYS  70  22.581   2.834  -2.679
  571   1HG   LYS  70          1HG       LYS  70  22.029   0.001  -1.819
  572   2HG   LYS  70          2HG       LYS  70  22.636   0.486  -3.403
  573   1HD   LYS  70          2HD       LYS  70  24.025   1.049  -0.785
  574   2HD   LYS  70          1HD       LYS  70  24.417  -0.292  -1.863
  575   1HE   LYS  70          1HE       LYS  70  24.578   2.641  -2.550
  576   2HE   LYS  70          2HE       LYS  70  25.944   1.586  -2.189
  577   1HZ   LYS  70          1HZ       LYS  70  25.387   0.258  -4.129
  578   2HZ   LYS  70          2HZ       LYS  70  25.655   1.870  -4.567
  579   3HZ   LYS  70          3HZ       LYS  70  24.076   1.270  -4.476
  580    H    GLN  71           H        GLN  71  19.516   3.293  -1.560
  581    HA   GLN  71           HA       GLN  71  19.780   5.971  -0.398
  582   1HB   GLN  71          2HB       GLN  71  18.784   5.418  -3.197
  583   2HB   GLN  71          1HB       GLN  71  18.849   6.992  -2.417
  584   1HG   GLN  71          2HG       GLN  71  21.278   6.858  -2.321
  585   2HG   GLN  71          1HG       GLN  71  21.224   5.264  -3.075
  586   1HE2  GLN  71          1HE2      GLN  71  22.517   7.719  -3.975
  587   2HE2  GLN  71          2HE2      GLN  71  21.868   8.058  -5.539
  588    H    GLN  72           H        GLN  72  18.165   3.274  -0.194
  589    HA   GLN  72           HA       GLN  72  16.178   2.680   0.703
  590   1HB   GLN  72          2HB       GLN  72  15.859   5.658   1.123
  591   2HB   GLN  72          1HB       GLN  72  14.845   4.417   1.847
  592   1HG   GLN  72          1HG       GLN  72  16.777   3.524   3.038
  593   2HG   GLN  72          2HG       GLN  72  17.799   4.762   2.309
  594   1HE2  GLN  72          1HE2      GLN  72  15.302   4.102   4.629
  595   2HE2  GLN  72          2HE2      GLN  72  15.392   5.613   5.463
  596    H    HIS  73           H        HIS  73  13.904   2.662   0.329
  597    HA   HIS  73           HA       HIS  73  11.941   2.940  -0.804
  598   1HB   HIS  73          1HB       HIS  73  13.408   5.112  -2.319
  599   2HB   HIS  73          2HB       HIS  73  11.681   4.785  -2.427
  600    HD1  HIS  73           1HD      HIS  73  14.230   6.450  -0.319
  601    HD2  HIS  73           2HD      HIS  73  10.184   5.520  -0.129
  602    HE1  HIS  73           1HE      HIS  73  13.312   7.826   1.577
  603    HE2  HIS  73           2HE      HIS  73  10.880   7.181   1.729
  604    H    ILE  74           H        ILE  74  14.951   2.438  -2.452
  605    HA   ILE  74           HA       ILE  74  13.647   1.023  -4.632
  606    HB   ILE  74           HB       ILE  74  16.544   0.668  -3.966
  607   1HG1  ILE  74          1HG1      ILE  74  16.264   3.067  -3.859
  608   2HG1  ILE  74          2HG1      ILE  74  17.049   2.650  -5.378
  609   1HG2  ILE  74          1HG2      ILE  74  16.747   0.410  -6.370
  610   2HG2  ILE  74          2HG2      ILE  74  15.046   0.827  -6.579
  611   3HG2  ILE  74          3HG2      ILE  74  15.492  -0.663  -5.746
  612   1HD1  ILE  74          1HD1      ILE  74  15.301   4.403  -5.570
  613   2HD1  ILE  74          2HD1      ILE  74  14.105   3.193  -5.102
  614   3HD1  ILE  74          3HD1      ILE  74  15.024   2.994  -6.594
  615    H    VAL  75           H        VAL  75  12.381  -0.360  -3.261
  616    HA   VAL  75           HA       VAL  75  13.875  -2.201  -1.555
  617    HB   VAL  75           HB       VAL  75  12.115  -1.324  -0.324
  618   1HG1  VAL  75          1HG2      VAL  75   9.814  -1.097  -1.153
  619   2HG1  VAL  75          2HG2      VAL  75  10.338  -1.703  -2.724
  620   3HG1  VAL  75          3HG2      VAL  75  10.972  -0.175  -2.111
  621   1HG2  VAL  75          1HG1      VAL  75  10.502  -3.134   0.023
  622   2HG2  VAL  75          2HG1      VAL  75  12.150  -3.744  -0.130
  623   3HG2  VAL  75          3HG1      VAL  75  11.027  -3.885  -1.484
  624    H    TYR  76           H        TYR  76  14.674  -3.810  -2.719
  625    HA   TYR  76           HA       TYR  76  13.419  -4.761  -5.092
  626   1HB   TYR  76          1HB       TYR  76  15.794  -5.827  -3.554
  627   2HB   TYR  76          2HB       TYR  76  15.324  -6.332  -5.176
  628    HD1  TYR  76           1HD      TYR  76  15.766  -4.952  -7.080
  629    HD2  TYR  76           2HD      TYR  76  16.689  -3.562  -3.170
  630    HE1  TYR  76           1HE      TYR  76  17.103  -3.129  -8.051
  631    HE2  TYR  76           2HE      TYR  76  18.013  -1.722  -4.126
  632    HH   TYR  76           HH       TYR  76  19.221  -1.224  -6.218
  633    H    CYS  77           H        CYS  77  12.267  -6.570  -5.464
  634    HA   CYS  77           HA       CYS  77  11.722  -8.342  -3.182
  635   1HB   CYS  77          2HB       CYS  77   9.314  -8.344  -3.832
  636   2HB   CYS  77          1HB       CYS  77   9.882  -6.785  -3.245
  637    HG   CYS  77           HG       CYS  77  10.363  -6.192  -6.199
  638    H    SER  78           H        SER  78  13.411  -9.453  -4.652
  639    HA   SER  78           HA       SER  78  12.296 -10.832  -6.933
  640   1HB   SER  78          1HB       SER  78  14.895 -11.273  -5.440
  641   2HB   SER  78          2HB       SER  78  14.450 -12.042  -6.964
  642    HG   SER  78           HG       SER  78  15.612 -10.308  -7.569
  643    H    ASN  79           H        ASN  79  12.051 -11.150  -3.630
  644    HA   ASN  79           HA       ASN  79  10.696 -13.664  -3.872
  645   1HB   ASN  79          2HB       ASN  79  12.108 -14.702  -1.992
  646   2HB   ASN  79          1HB       ASN  79  12.797 -14.689  -3.613
  647   1HD2  ASN  79          1HD2      ASN  79  12.591 -11.832  -1.612
  648   2HD2  ASN  79          2HD2      ASN  79  14.287 -11.679  -1.324
  649    H    ASP  80           H        ASP  80  10.600 -10.749  -2.859
  650    HA   ASP  80           HA       ASP  80   9.992 -11.052  -0.051
  651   1HB   ASP  80          2HB       ASP  80  11.061  -9.002  -0.947
  652   2HB   ASP  80          1HB       ASP  80   9.597  -8.663  -1.864
  653    H    LEU  81           H        LEU  81   7.886 -10.263   0.823
  654    HA   LEU  81           HA       LEU  81   5.735 -11.704  -0.267
  655   1HB   LEU  81          2HB       LEU  81   5.724  -9.446   1.735
  656   2HB   LEU  81          1HB       LEU  81   4.352 -10.482   1.392
  657    HG   LEU  81           HG       LEU  81   6.990 -11.483   2.464
  658   1HD1  LEU  81          1HD2      LEU  81   4.429 -10.878   3.931
  659   2HD1  LEU  81          2HD2      LEU  81   5.953 -10.004   4.086
  660   3HD1  LEU  81          3HD2      LEU  81   5.842 -11.682   4.615
  661   1HD2  LEU  81          1HD1      LEU  81   5.723 -13.507   2.966
  662   2HD2  LEU  81          2HD1      LEU  81   5.701 -13.150   1.239
  663   3HD2  LEU  81          3HD1      LEU  81   4.286 -12.796   2.230
  664    H    LEU  82           H        LEU  82   6.380  -8.195  -0.247
  665    HA   LEU  82           HA       LEU  82   4.300  -7.346  -1.871
  666   1HB   LEU  82          2HB       LEU  82   6.441  -6.121  -0.787
  667   2HB   LEU  82          1HB       LEU  82   6.988  -6.229  -2.446
  668    HG   LEU  82           HG       LEU  82   5.928  -4.080  -2.013
  669   1HD1  LEU  82          1HD2      LEU  82   5.763  -5.023  -4.250
  670   2HD1  LEU  82          2HD2      LEU  82   4.329  -4.075  -3.853
  671   3HD1  LEU  82          3HD2      LEU  82   4.261  -5.839  -3.806
  672   1HD2  LEU  82          1HD1      LEU  82   4.426  -4.730  -0.227
  673   2HD2  LEU  82          2HD1      LEU  82   3.471  -5.690  -1.357
  674   3HD2  LEU  82          3HD1      LEU  82   3.535  -3.937  -1.526
  675    H    GLY  83           H        GLY  83   7.241  -9.078  -2.655
  676   1HA   GLY  83          2HA       GLY  83   7.171  -8.909  -5.454
  677   2HA   GLY  83          1HA       GLY  83   7.860 -10.238  -4.533
  678    H    ASP  84           H        ASP  84   5.513 -11.123  -3.233
  679    HA   ASP  84           HA       ASP  84   4.266 -12.795  -5.058
  680   1HB   ASP  84          2HB       ASP  84   3.046 -11.642  -2.533
  681   2HB   ASP  84          1HB       ASP  84   2.474 -13.066  -3.396
  682    H    LEU  85           H        LEU  85   3.498  -9.480  -4.163
  683    HA   LEU  85           HA       LEU  85   1.140  -9.263  -5.740
  684   1HB   LEU  85          1HB       LEU  85   3.094  -7.115  -4.931
  685   2HB   LEU  85          2HB       LEU  85   1.494  -6.840  -5.587
  686    HG   LEU  85           HG       LEU  85   2.090  -8.189  -2.956
  687   1HD1  LEU  85          1HD2      LEU  85   0.947  -5.459  -3.520
  688   2HD1  LEU  85          2HD2      LEU  85   2.597  -5.779  -2.989
  689   3HD1  LEU  85          3HD2      LEU  85   1.240  -6.173  -1.934
  690   1HD2  LEU  85          1HD1      LEU  85  -0.546  -7.329  -4.139
  691   2HD2  LEU  85          2HD1      LEU  85  -0.293  -8.108  -2.577
  692   3HD2  LEU  85          3HD1      LEU  85   0.036  -8.991  -4.067
  693    H    PHE  86           H        PHE  86   4.179  -7.558  -6.390
  694    HA   PHE  86           HA       PHE  86   3.503  -7.591  -9.221
  695   1HB   PHE  86          2HB       PHE  86   5.663  -6.097  -7.719
  696   2HB   PHE  86          1HB       PHE  86   5.321  -5.917  -9.435
  697    HD1  PHE  86           1HD      PHE  86   5.327  -3.667  -7.466
  698    HD2  PHE  86           2HD      PHE  86   2.198  -6.240  -8.777
  699    HE1  PHE  86           1HE      PHE  86   3.675  -1.910  -6.952
  700    HE2  PHE  86           2HE      PHE  86   0.544  -4.495  -8.265
  701    HZ   PHE  86           HZ       PHE  86   1.282  -2.332  -7.352
  702    H    GLY  87           H        GLY  87   6.501  -8.091  -7.343
  703   1HA   GLY  87          2HA       GLY  87   7.833 -10.068  -7.558
  704   2HA   GLY  87          1HA       GLY  87   7.163 -10.303  -9.165
  705    H    VAL  88           H        VAL  88   7.724  -7.138  -9.157
  706    HA   VAL  88           HA       VAL  88   9.767  -7.013 -10.927
  707    HB   VAL  88           HB       VAL  88   9.779  -4.905  -8.835
  708   1HG1  VAL  88          1HG1      VAL  88  11.080  -4.717 -10.882
  709   2HG1  VAL  88          2HG1      VAL  88   9.841  -3.462 -10.786
  710   3HG1  VAL  88          3HG1      VAL  88   9.601  -4.863 -11.832
  711   1HG2  VAL  88          1HG2      VAL  88   7.417  -5.528  -8.911
  712   2HG2  VAL  88          2HG2      VAL  88   7.421  -5.335 -10.664
  713   3HG2  VAL  88          3HG2      VAL  88   7.689  -3.938  -9.622
  714    HA   PRO  89           HA       PRO  89  13.802  -7.623  -8.878
  715   1HB   PRO  89          1HB       PRO  89  14.788  -5.255 -10.072
  716   2HB   PRO  89          2HB       PRO  89  15.056  -6.911 -10.620
  717   1HG   PRO  89          2HG       PRO  89  13.088  -4.898 -11.567
  718   2HG   PRO  89          1HG       PRO  89  13.902  -6.191 -12.467
  719   1HD   PRO  89          2HD       PRO  89  11.322  -6.387 -11.774
  720   2HD   PRO  89          1HD       PRO  89  12.393  -7.805 -11.756
  721    H    SER  90           H        SER  90  12.277  -4.425  -9.233
  722    HA   SER  90           HA       SER  90  12.721  -3.922  -6.385
  723   1HB   SER  90          2HB       SER  90  13.650  -1.697  -6.813
  724   2HB   SER  90          1HB       SER  90  14.662  -2.941  -7.544
  725    HG   SER  90           HG       SER  90  13.329  -2.475  -9.509
  726    H    PHE  91           H        PHE  91  11.283  -2.233  -5.522
  727    HA   PHE  91           HA       PHE  91   9.688  -0.833  -7.515
  728   1HB   PHE  91          1HB       PHE  91   7.591  -1.123  -6.397
  729   2HB   PHE  91          2HB       PHE  91   8.281  -2.710  -6.697
  730    HD1  PHE  91           1HD      PHE  91   7.414  -0.253  -4.113
  731    HD2  PHE  91           2HD      PHE  91   8.954  -4.142  -4.899
  732    HE1  PHE  91           1HE      PHE  91   7.073  -0.852  -1.762
  733    HE2  PHE  91           2HE      PHE  91   8.617  -4.750  -2.539
  734    HZ   PHE  91           HZ       PHE  91   7.680  -3.103  -0.967
  735    H    SER  92           H        SER  92   9.127   1.242  -6.989
  736    HA   SER  92           HA       SER  92  10.674   2.351  -4.778
  737   1HB   SER  92          2HB       SER  92  10.268   4.533  -5.910
  738   2HB   SER  92          1HB       SER  92  11.066   3.356  -6.953
  739    HG   SER  92           HG       SER  92   8.378   4.218  -6.999
  740    H    VAL  93           H        VAL  93   9.420   2.016  -2.981
  741    HA   VAL  93           HA       VAL  93   6.669   2.414  -2.750
  742    HB   VAL  93           HB       VAL  93   8.188   1.338  -1.040
  743   1HG1  VAL  93          1HG1      VAL  93   9.883   3.074  -0.926
  744   2HG1  VAL  93          2HG1      VAL  93   9.178   2.784   0.664
  745   3HG1  VAL  93          3HG1      VAL  93   8.699   4.203  -0.267
  746   1HG2  VAL  93          1HG2      VAL  93   6.259   3.435  -0.053
  747   2HG2  VAL  93          2HG2      VAL  93   6.828   2.045   0.870
  748   3HG2  VAL  93          3HG2      VAL  93   5.843   1.803  -0.573
  749    H    LYS  94           H        LYS  94   9.336   4.676  -2.678
  750    HA   LYS  94           HA       LYS  94   8.177   6.923  -1.572
  751   1HB   LYS  94          2HB       LYS  94  10.541   6.756  -2.284
  752   2HB   LYS  94          1HB       LYS  94  10.026   6.834  -3.963
  753   1HG   LYS  94          2HG       LYS  94   9.100   9.074  -3.555
  754   2HG   LYS  94          1HG       LYS  94   9.685   8.992  -1.892
  755   1HD   LYS  94          2HD       LYS  94  11.435   8.790  -4.340
  756   2HD   LYS  94          1HD       LYS  94  11.187  10.264  -3.402
  757   1HE   LYS  94          1HE       LYS  94  12.105   9.156  -1.422
  758   2HE   LYS  94          2HE       LYS  94  12.359   7.687  -2.361
  759   1HZ   LYS  94          1HZ       LYS  94  13.894   8.899  -3.779
  760   2HZ   LYS  94          2HZ       LYS  94  14.391   8.975  -2.163
  761   3HZ   LYS  94          3HZ       LYS  94  13.647  10.313  -2.882
  762    H    GLU  95           H        GLU  95   7.689   5.498  -4.722
  763    HA   GLU  95           HA       GLU  95   5.930   7.647  -5.579
  764   1HB   GLU  95          1HB       GLU  95   6.556   4.991  -6.886
  765   2HB   GLU  95          2HB       GLU  95   5.647   6.307  -7.618
  766   1HG   GLU  95          1HG       GLU  95   8.539   6.411  -6.787
  767   2HG   GLU  95          2HG       GLU  95   7.939   6.227  -8.436
  768    H    HIS  96           H        HIS  96   4.798   6.971  -3.374
  769    HA   HIS  96           HA       HIS  96   3.310   4.636  -3.155
  770   1HB   HIS  96          1HB       HIS  96   2.636   7.381  -2.083
  771   2HB   HIS  96          2HB       HIS  96   1.903   5.875  -1.544
  772    HD1  HIS  96           1HD      HIS  96   4.987   7.932  -1.226
  773    HD2  HIS  96           2HD      HIS  96   3.539   4.266   0.090
  774    HE1  HIS  96           1HE      HIS  96   6.557   7.205   0.597
  775    HE2  HIS  96           2HE      HIS  96   5.619   5.020   1.430
  776    H    ARG  97           H        ARG  97   2.623   7.566  -4.925
  777    HA   ARG  97           HA       ARG  97  -0.106   7.265  -5.359
  778   1HB   ARG  97          2HB       ARG  97   1.128   9.272  -6.019
  779   2HB   ARG  97          1HB       ARG  97   1.990   8.357  -7.247
  780   1HG   ARG  97          2HG       ARG  97  -0.151   7.933  -8.394
  781   2HG   ARG  97          1HG       ARG  97  -0.963   8.938  -7.192
  782   1HD   ARG  97          1HD       ARG  97   0.433  10.842  -7.855
  783   2HD   ARG  97          2HD       ARG  97   1.218   9.835  -9.072
  784    HE   ARG  97           HE       ARG  97  -1.473   9.690  -9.616
  785   1HH1  ARG  97          2HH1      ARG  97   0.916  12.215  -9.390
  786   2HH1  ARG  97          1HH1      ARG  97   0.139  13.232 -10.556
  787   1HH2  ARG  97          1HH2      ARG  97  -2.504  11.022 -11.152
  788   2HH2  ARG  97          2HH2      ARG  97  -1.805  12.554 -11.557
  789    H    LYS  98           H        LYS  98   2.491   6.299  -7.612
  790    HA   LYS  98           HA       LYS  98   0.690   4.784  -9.223
  791   1HB   LYS  98          1HB       LYS  98   2.648   5.884 -10.190
  792   2HB   LYS  98          2HB       LYS  98   3.710   4.878  -9.216
  793   1HG   LYS  98          2HG       LYS  98   3.646   4.042 -11.469
  794   2HG   LYS  98          1HG       LYS  98   2.858   2.885 -10.393
  795   1HD   LYS  98          1HD       LYS  98   0.670   3.757 -11.065
  796   2HD   LYS  98          2HD       LYS  98   1.461   4.904 -12.148
  797   1HE   LYS  98          1HE       LYS  98   1.599   1.897 -12.335
  798   2HE   LYS  98          2HE       LYS  98   0.645   2.958 -13.370
  799   1HZ   LYS  98          1HZ       LYS  98   2.689   3.976 -14.154
  800   2HZ   LYS  98          2HZ       LYS  98   2.712   2.309 -14.434
  801   3HZ   LYS  98          3HZ       LYS  98   3.607   2.963 -13.157
  802    H    ILE  99           H        ILE  99   3.185   3.960  -6.871
  803    HA   ILE  99           HA       ILE  99   3.349   1.233  -7.310
  804    HB   ILE  99           HB       ILE  99   4.574   2.928  -5.595
  805   1HG1  ILE  99          2HG1      ILE  99   5.325   0.699  -6.524
  806   2HG1  ILE  99          1HG1      ILE  99   5.879   1.063  -4.893
  807   1HG2  ILE  99          1HG2      ILE  99   2.802   2.987  -3.974
  808   2HG2  ILE  99          2HG2      ILE  99   4.190   2.131  -3.296
  809   3HG2  ILE  99          3HG2      ILE  99   2.788   1.226  -3.872
  810   1HD1  ILE  99          1HD1      ILE  99   4.178  -0.390  -3.969
  811   2HD1  ILE  99          2HD1      ILE  99   5.173  -1.260  -5.138
  812   3HD1  ILE  99          3HD1      ILE  99   3.556  -0.719  -5.587
  813    H    TYR 100           H        TYR 100   0.954   3.041  -5.494
  814    HA   TYR 100           HA       TYR 100  -0.359   0.597  -4.631
  815   1HB   TYR 100          2HB       TYR 100  -0.765   3.512  -4.088
  816   2HB   TYR 100          1HB       TYR 100  -2.080   2.380  -3.777
  817    HD1  TYR 100           1HD      TYR 100  -1.725   3.317  -1.385
  818    HD2  TYR 100           2HD      TYR 100   1.098   0.849  -3.398
  819    HE1  TYR 100           1HE      TYR 100  -0.714   2.717   0.775
  820    HE2  TYR 100           2HE      TYR 100   2.107   0.242  -1.252
  821    HH   TYR 100           HH       TYR 100   0.636   0.893   1.733
  822    H    THR 101           H        THR 101  -0.662   3.033  -7.107
  823    HA   THR 101           HA       THR 101  -3.309   2.479  -7.913
  824    HB   THR 101           HB       THR 101  -0.975   3.511  -9.538
  825    HG1  THR 101           1HG      THR 101  -1.947   5.523  -9.116
  826   1HG2  THR 101          1HG2      THR 101  -2.682   2.559 -11.007
  827   2HG2  THR 101          2HG2      THR 101  -2.666   4.319 -11.124
  828   3HG2  THR 101          3HG2      THR 101  -3.925   3.509 -10.191
  829    H    MET 102           H        MET 102  -0.297   0.819  -8.432
  830    HA   MET 102           HA       MET 102  -1.556  -0.940 -10.402
  831   1HB   MET 102          2HB       MET 102   0.798  -1.932 -10.533
  832   2HB   MET 102          1HB       MET 102   0.560  -0.313 -11.175
  833   1HG   MET 102          2HG       MET 102   1.577   0.674  -9.263
  834   2HG   MET 102          1HG       MET 102   1.627  -0.874  -8.422
  835   1HE   MET 102          1HE       MET 102   4.316   1.023  -8.787
  836   2HE   MET 102          2HE       MET 102   5.405  -0.353  -8.971
  837   3HE   MET 102          3HE       MET 102   4.059  -0.436  -7.831
  838    H    ILE 103           H        ILE 103  -0.484  -0.889  -7.077
  839    HA   ILE 103           HA       ILE 103  -0.811  -3.654  -6.550
  840    HB   ILE 103           HB       ILE 103  -1.140  -1.220  -4.808
  841   1HG1  ILE 103          2HG1      ILE 103   0.852  -3.499  -4.842
  842   2HG1  ILE 103          1HG1      ILE 103   1.145  -1.863  -5.422
  843   1HG2  ILE 103          1HG2      ILE 103  -1.402  -2.717  -2.883
  844   2HG2  ILE 103          2HG2      ILE 103  -1.480  -4.101  -3.975
  845   3HG2  ILE 103          3HG2      ILE 103  -2.744  -2.872  -4.017
  846   1HD1  ILE 103          1HD1      ILE 103   2.150  -2.199  -3.252
  847   2HD1  ILE 103          2HD1      ILE 103   0.588  -2.666  -2.577
  848   3HD1  ILE 103          3HD1      ILE 103   0.845  -1.015  -3.147
  849    H    TYR 104           H        TYR 104  -3.093  -0.981  -6.845
  850    HA   TYR 104           HA       TYR 104  -5.292  -2.838  -6.216
  851   1HB   TYR 104          2HB       TYR 104  -5.196   0.179  -6.025
  852   2HB   TYR 104          1HB       TYR 104  -6.613  -0.808  -5.682
  853    HD1  TYR 104           1HD      TYR 104  -6.503  -2.455  -3.766
  854    HD2  TYR 104           2HD      TYR 104  -3.552   0.546  -4.377
  855    HE1  TYR 104           1HE      TYR 104  -5.772  -2.707  -1.432
  856    HE2  TYR 104           2HE      TYR 104  -2.812   0.302  -2.047
  857    HH   TYR 104           HH       TYR 104  -3.768  -2.289  -0.077
  858    H    ARG 105           H        ARG 105  -7.349  -2.434  -7.359
  859    HA   ARG 105           HA       ARG 105  -7.045  -1.256 -10.021
  860   1HB   ARG 105          1HB       ARG 105  -7.988  -4.082  -9.505
  861   2HB   ARG 105          2HB       ARG 105  -8.091  -3.260 -11.055
  862   1HG   ARG 105          1HG       ARG 105  -5.523  -3.818  -9.587
  863   2HG   ARG 105          2HG       ARG 105  -6.183  -4.817 -10.884
  864   1HD   ARG 105          1HD       ARG 105  -5.397  -1.914 -11.107
  865   2HD   ARG 105          2HD       ARG 105  -4.472  -3.286 -11.719
  866    HE   ARG 105           HE       ARG 105  -7.087  -3.321 -12.786
  867   1HH1  ARG 105          2HH1      ARG 105  -4.063  -1.609 -13.034
  868   2HH1  ARG 105          1HH1      ARG 105  -4.314  -1.142 -14.683
  869   1HH2  ARG 105          1HH2      ARG 105  -7.427  -2.711 -14.957
  870   2HH2  ARG 105          2HH2      ARG 105  -6.225  -1.768 -15.777
  871    H    ASN 106           H        ASN 106  -9.373  -3.120  -8.056
  872    HA   ASN 106           HA       ASN 106 -11.609  -1.719  -9.183
  873   1HB   ASN 106          1HB       ASN 106 -11.621  -4.126  -8.395
  874   2HB   ASN 106          2HB       ASN 106 -11.611  -3.507  -6.746
  875   1HD2  ASN 106          2HD2      ASN 106 -13.440  -3.760  -9.702
  876   2HD2  ASN 106          1HD2      ASN 106 -14.980  -3.388  -9.012
  877    H    LEU 107           H        LEU 107 -13.337  -0.977  -7.406
  878    HA   LEU 107           HA       LEU 107 -11.973   1.132  -5.900
  879   1HB   LEU 107          2HB       LEU 107 -14.825   0.853  -6.833
  880   2HB   LEU 107          1HB       LEU 107 -14.278   2.144  -5.785
  881    HG   LEU 107           HG       LEU 107 -12.628   2.763  -7.617
  882   1HD1  LEU 107          1HD1      LEU 107 -12.698   0.666  -8.855
  883   2HD1  LEU 107          2HD1      LEU 107 -13.182   2.019  -9.878
  884   3HD1  LEU 107          3HD1      LEU 107 -14.403   0.929  -9.222
  885   1HD2  LEU 107          1HD2      LEU 107 -14.317   3.978  -8.901
  886   2HD2  LEU 107          2HD2      LEU 107 -14.646   4.049  -7.169
  887   3HD2  LEU 107          3HD2      LEU 107 -15.579   2.964  -8.202
  888    H    VAL 108           H        VAL 108 -14.984  -0.731  -5.431
  889    HA   VAL 108           HA       VAL 108 -14.907  -0.221  -2.614
  890    HB   VAL 108           HB       VAL 108 -16.971  -1.536  -2.500
  891   1HG1  VAL 108          1HG1      VAL 108 -17.096   0.814  -3.134
  892   2HG1  VAL 108          2HG1      VAL 108 -18.348  -0.122  -3.948
  893   3HG1  VAL 108          3HG1      VAL 108 -16.906   0.377  -4.832
  894   1HG2  VAL 108          1HG2      VAL 108 -16.466  -2.092  -5.422
  895   2HG2  VAL 108          2HG2      VAL 108 -17.952  -2.477  -4.551
  896   3HG2  VAL 108          3HG2      VAL 108 -16.439  -3.271  -4.110
  897    H    VAL 109           H        VAL 109 -14.012  -2.883  -4.678
  898    HA   VAL 109           HA       VAL 109 -12.833  -4.255  -2.394
  899    HB   VAL 109           HB       VAL 109 -13.781  -6.465  -3.233
  900   1HG1  VAL 109          1HG1      VAL 109 -15.667  -4.465  -1.994
  901   2HG1  VAL 109          2HG1      VAL 109 -14.484  -5.454  -1.137
  902   3HG1  VAL 109          3HG1      VAL 109 -15.852  -6.218  -1.944
  903   1HG2  VAL 109          1HG2      VAL 109 -14.628  -5.694  -5.378
  904   2HG2  VAL 109          2HG2      VAL 109 -15.750  -4.606  -4.562
  905   3HG2  VAL 109          3HG2      VAL 109 -15.939  -6.352  -4.399
  906    H    VAL 110           H        VAL 110 -11.061  -3.241  -3.739
  907    HA   VAL 110           HA       VAL 110 -10.121  -4.101  -6.150
  908    HB   VAL 110           HB       VAL 110  -8.506  -3.865  -3.607
  909   1HG1  VAL 110          1HG2      VAL 110  -6.578  -3.533  -5.082
  910   2HG1  VAL 110          2HG2      VAL 110  -7.597  -3.861  -6.484
  911   3HG1  VAL 110          3HG2      VAL 110  -7.293  -5.130  -5.299
  912   1HG2  VAL 110          1HG1      VAL 110  -9.071  -1.871  -5.797
  913   2HG2  VAL 110          2HG1      VAL 110  -7.984  -1.615  -4.431
  914   3HG2  VAL 110          3HG1      VAL 110  -9.714  -1.828  -4.155
  915    H    ASN 111           H        ASN 111 -10.352  -6.108  -6.928
  916    HA   ASN 111           HA       ASN 111  -9.348  -8.344  -5.293
  917   1HB   ASN 111          2HB       ASN 111 -11.789  -8.448  -5.513
  918   2HB   ASN 111          1HB       ASN 111 -11.642  -8.378  -7.266
  919   1HD2  ASN 111          2HD2      ASN 111  -9.470 -10.175  -5.203
  920   2HD2  ASN 111          1HD2      ASN 111  -9.969 -11.745  -5.721
  921    H    GLN 112           H        GLN 112  -8.040  -9.837  -6.268
  922    HA   GLN 112           HA       GLN 112  -7.215  -9.217  -9.028
  923   1HB   GLN 112          1HB       GLN 112  -5.611 -10.498  -6.808
  924   2HB   GLN 112          2HB       GLN 112  -5.031 -10.192  -8.440
  925   1HG   GLN 112          1HG       GLN 112  -5.295  -7.793  -8.090
  926   2HG   GLN 112          2HG       GLN 112  -5.891  -8.095  -6.458
  927   1HE2  GLN 112          2HE2      GLN 112  -4.242  -6.923  -5.507
  928   2HE2  GLN 112          1HE2      GLN 112  -2.614  -7.498  -5.440
  929    H    GLN 113           H        GLN 113  -8.356 -11.661  -6.861
  930    HA   GLN 113           HA       GLN 113  -8.920 -13.432  -9.047
  931   1HB   GLN 113          1HB       GLN 113  -6.567 -14.001  -8.628
  932   2HB   GLN 113          2HB       GLN 113  -6.940 -14.314  -6.939
  933   1HG   GLN 113          2HG       GLN 113  -6.755 -16.387  -8.168
  934   2HG   GLN 113          1HG       GLN 113  -8.408 -16.151  -7.601
  935   1HE2  GLN 113          2HE2      GLN 113 -10.034 -15.709  -9.085
  936   2HE2  GLN 113          1HE2      GLN 113  -9.833 -15.980 -10.779
  937    H    GLU 114           H        GLU 114 -11.022 -13.586  -8.496
  938    HA   GLU 114           HA       GLU 114 -11.952 -13.770  -5.817
  939   1HB   GLU 114          1HB       GLU 114 -14.148 -14.232  -6.839
  940   2HB   GLU 114          2HB       GLU 114 -13.360 -12.837  -7.563
  941   1HG   GLU 114          1HG       GLU 114 -12.667 -14.204  -9.460
  942   2HG   GLU 114          2HG       GLU 114 -13.451 -15.606  -8.735
  943    H    SER 115           H        SER 115 -12.629 -15.509  -4.629
  944    HA   SER 115           HA       SER 115 -11.735 -18.128  -5.593
  945   1HB   SER 115          2HB       SER 115 -12.457 -17.213  -2.798
  946   2HB   SER 115          1HB       SER 115 -11.853 -18.814  -3.223
  947    HG   SER 115           HG       SER 115 -10.038 -17.464  -4.205
  948    H    SER 116           H        SER 116 -13.122 -19.706  -6.086
  949    HA   SER 116           HA       SER 116 -15.955 -19.165  -5.980
  950   1HB   SER 116          2HB       SER 116 -14.443 -21.586  -6.997
  951   2HB   SER 116          1HB       SER 116 -16.170 -21.299  -7.211
  952    HG   SER 116           HG       SER 116 -15.617 -19.401  -8.381
  953    H    ASP 117           H        ASP 117 -17.427 -21.045  -5.326
  954    HA   ASP 117           HA       ASP 117 -18.327 -22.308  -3.666
  955   1HB   ASP 117          2HB       ASP 117 -15.444 -23.089  -3.181
  956   2HB   ASP 117          1HB       ASP 117 -16.847 -23.916  -2.511
  957    H    SER 118           H        SER 118 -18.084 -22.787  -1.175
  958    HA   SER 118           HA       SER 118 -16.754 -20.813   0.394
  959   1HB   SER 118          2HB       SER 118 -18.533 -19.385  -0.496
  960   2HB   SER 118          1HB       SER 118 -19.751 -20.534   0.058
  961    HG   SER 118           HG       SER 118 -19.218 -20.061   2.165
  962    H    SER 119           H        SER 119 -18.869 -23.491   0.005
  963    HA   SER 119           HA       SER 119 -19.052 -23.967   2.880
  964   1HB   SER 119          2HB       SER 119 -20.247 -25.494   0.553
  965   2HB   SER 119          1HB       SER 119 -20.547 -25.833   2.257
  966    HG   SER 119           HG       SER 119 -21.197 -23.451   0.857
  Start of MODEL   13
    1   1H    MET   1          1H        MET   1  -6.751   0.050  19.359
    2   2H    MET   1          2H        MET   1  -6.891   1.732  19.458
    3   3H    MET   1          3H        MET   1  -5.623   1.040  18.577
    4    HA   MET   1           HA       MET   1  -7.119   0.157  16.963
    5   1HB   MET   1          2HB       MET   1  -9.513   0.605  17.072
    6   2HB   MET   1          1HB       MET   1  -8.991  -0.281  18.497
    7   1HG   MET   1          1HG       MET   1  -9.345   2.702  18.449
    8   2HG   MET   1          2HG       MET   1 -10.628   1.580  18.892
    9   1HE   MET   1          1HE       MET   1 -10.917   2.828  21.224
   10   2HE   MET   1          2HE       MET   1  -9.633   3.952  20.776
   11   3HE   MET   1          3HE       MET   1  -9.584   3.133  22.336
   12    H    CYS   2           H        CYS   2  -6.537   3.127  18.489
   13    HA   CYS   2           HA       CYS   2  -6.888   4.528  15.926
   14   1HB   CYS   2          2HB       CYS   2  -7.474   5.642  18.677
   15   2HB   CYS   2          1HB       CYS   2  -7.527   6.561  17.177
   16    HG   CYS   2           HG       CYS   2 -10.134   6.223  17.529
   17    H    ASN   3           H        ASN   3  -5.677   6.762  16.109
   18    HA   ASN   3           HA       ASN   3  -3.142   6.441  17.541
   19   1HB   ASN   3          2HB       ASN   3  -2.757   5.535  15.294
   20   2HB   ASN   3          1HB       ASN   3  -3.358   7.029  14.580
   21   1HD2  ASN   3          2HD2      ASN   3  -1.376   6.928  17.451
   22   2HD2  ASN   3          1HD2      ASN   3   0.031   7.632  16.739
   23    H    THR   4           H        THR   4  -3.199   8.170  18.833
   24    HA   THR   4           HA       THR   4  -3.540  10.805  17.583
   25    HB   THR   4           HB       THR   4  -5.659  10.321  18.680
   26    HG1  THR   4           1HG      THR   4  -4.344  12.449  18.969
   27   1HG2  THR   4          1HG2      THR   4  -5.780   9.972  21.106
   28   2HG2  THR   4          2HG2      THR   4  -4.018   9.943  21.187
   29   3HG2  THR   4          3HG2      THR   4  -4.880   8.678  20.313
   30    H    ASN   5           H        ASN   5  -1.584   8.789  19.254
   31    HA   ASN   5           HA       ASN   5  -0.485  10.653  21.158
   32   1HB   ASN   5          2HB       ASN   5   0.549   7.970  20.216
   33   2HB   ASN   5          1HB       ASN   5   1.184   8.887  21.578
   34   1HD2  ASN   5          2HD2      ASN   5  -1.453   6.969  20.393
   35   2HD2  ASN   5          1HD2      ASN   5  -2.216   6.707  21.921
   36    H    MET   6           H        MET   6   1.057  12.102  20.800
   37    HA   MET   6           HA       MET   6   2.645  13.352  19.762
   38   1HB   MET   6          1HB       MET   6   4.009  11.351  20.198
   39   2HB   MET   6          2HB       MET   6   3.508  10.674  18.655
   40   1HG   MET   6          2HG       MET   6   4.595  12.523  17.488
   41   2HG   MET   6          1HG       MET   6   5.102  13.198  19.035
   42   1HE   MET   6          1HE       MET   6   8.467  11.883  17.521
   43   2HE   MET   6          2HE       MET   6   7.617  13.276  18.191
   44   3HE   MET   6          3HE       MET   6   7.119  12.603  16.639
   45    H    SER   7           H        SER   7   1.235  14.520  18.445
   46    HA   SER   7           HA       SER   7   1.196  13.665  15.625
   47   1HB   SER   7          2HB       SER   7  -0.968  14.829  15.386
   48   2HB   SER   7          1HB       SER   7  -1.057  13.536  16.583
   49    HG   SER   7           HG       SER   7  -1.130  16.308  16.937
   50    H    VAL   8           H        VAL   8   2.830  15.583  17.485
   51    HA   VAL   8           HA       VAL   8   2.517  18.056  15.950
   52    HB   VAL   8           HB       VAL   8   4.276  17.552  18.353
   53   1HG1  VAL   8          1HG1      VAL   8   3.390  20.116  17.034
   54   2HG1  VAL   8          2HG1      VAL   8   5.010  19.422  16.977
   55   3HG1  VAL   8          3HG1      VAL   8   4.351  19.994  18.508
   56   1HG2  VAL   8          1HG2      VAL   8   2.556  18.731  19.644
   57   2HG2  VAL   8          2HG2      VAL   8   1.937  17.236  18.942
   58   3HG2  VAL   8          3HG2      VAL   8   1.529  18.789  18.211
   59    HA   PRO   9           HA       PRO   9   6.000  16.489  13.524
   60   1HB   PRO   9          2HB       PRO   9   5.883  18.428  11.625
   61   2HB   PRO   9          1HB       PRO   9   4.809  17.024  11.634
   62   1HG   PRO   9          2HG       PRO   9   4.293  19.815  12.595
   63   2HG   PRO   9          1HG       PRO   9   3.241  18.744  11.651
   64   1HD   PRO   9          1HD       PRO   9   2.937  19.096  14.316
   65   2HD   PRO   9          2HD       PRO   9   2.568  17.557  13.513
   66    H    THR  10           H        THR  10   8.133  17.053  13.428
   67    HA   THR  10           HA       THR  10   8.923  19.772  14.159
   68    HB   THR  10           HB       THR  10   9.991  17.330  15.590
   69    HG1  THR  10           1HG      THR  10   8.993  18.530  17.422
   70   1HG2  THR  10          1HG2      THR  10  11.691  19.061  15.275
   71   2HG2  THR  10          2HG2      THR  10  11.211  18.953  16.969
   72   3HG2  THR  10          3HG2      THR  10  10.601  20.266  15.962
   73    H    ASP  11           H        ASP  11  10.347  16.546  13.590
   74    HA   ASP  11           HA       ASP  11  12.375  17.808  11.888
   75   1HB   ASP  11          2HB       ASP  11  12.287  15.031  13.087
   76   2HB   ASP  11          1HB       ASP  11  13.608  15.684  12.122
   77    H    GLY  12           H        GLY  12  12.060  17.778   9.769
   78   1HA   GLY  12          2HA       GLY  12  10.526  15.528   8.620
   79   2HA   GLY  12          1HA       GLY  12  10.433  17.171   8.006
   80    H    ALA  13           H        ALA  13  10.931  15.589   6.074
   81    HA   ALA  13           HA       ALA  13  13.786  15.924   5.525
   82   1HB   ALA  13          1HB       ALA  13  13.523  13.611   6.286
   83   2HB   ALA  13          2HB       ALA  13  13.982  13.686   4.586
   84   3HB   ALA  13          3HB       ALA  13  12.313  13.338   5.033
   85    H    VAL  14           H        VAL  14  14.052  15.012   3.062
   86    HA   VAL  14           HA       VAL  14  12.713  16.938   1.485
   87    HB   VAL  14           HB       VAL  14  14.248  14.512   0.540
   88   1HG1  VAL  14          1HG1      VAL  14  14.598  15.818  -1.506
   89   2HG1  VAL  14          2HG1      VAL  14  13.568  17.097  -0.861
   90   3HG1  VAL  14          3HG1      VAL  14  12.885  15.510  -1.213
   91   1HG2  VAL  14          1HG2      VAL  14  16.168  16.029   0.383
   92   2HG2  VAL  14          2HG2      VAL  14  15.595  15.868   2.044
   93   3HG2  VAL  14          3HG2      VAL  14  15.207  17.314   1.112
   94    H    THR  15           H        THR  15  12.672  13.409   0.973
   95    HA   THR  15           HA       THR  15   9.903  13.681   0.006
   96    HB   THR  15           HB       THR  15  11.925  11.538  -0.681
   97    HG1  THR  15           1HG      THR  15  11.601  12.660  -2.824
   98   1HG2  THR  15          1HG2      THR  15  10.288  10.851  -2.375
   99   2HG2  THR  15          2HG2      THR  15   9.162  12.072  -1.782
  100   3HG2  THR  15          3HG2      THR  15   9.619  10.720  -0.748
  101    H    THR  16           H        THR  16   8.567  13.164   1.630
  102    HA   THR  16           HA       THR  16   8.911  10.533   2.882
  103    HB   THR  16           HB       THR  16   8.146  11.452   5.061
  104    HG1  THR  16           1HG      THR  16   7.528  13.467   5.158
  105   1HG2  THR  16          1HG2      THR  16  10.281  12.481   5.691
  106   2HG2  THR  16          2HG2      THR  16  10.681  12.697   3.987
  107   3HG2  THR  16          3HG2      THR  16  10.530  11.073   4.659
  108    H    SER  17           H        SER  17   7.266   9.669   1.645
  109    HA   SER  17           HA       SER  17   5.137   9.042   1.162
  110   1HB   SER  17          2HB       SER  17   4.829   8.985   3.592
  111   2HB   SER  17          1HB       SER  17   4.449  10.708   3.596
  112    HG   SER  17           HG       SER  17   2.943   9.120   1.892
  113    H    GLN  18           H        GLN  18   2.984   9.863   0.435
  114    HA   GLN  18           HA       GLN  18   2.849  12.714  -0.132
  115   1HB   GLN  18          1HB       GLN  18   2.284  12.178  -2.546
  116   2HB   GLN  18          2HB       GLN  18   3.981  12.028  -2.107
  117   1HG   GLN  18          1HG       GLN  18   3.674   9.596  -1.880
  118   2HG   GLN  18          2HG       GLN  18   2.001   9.786  -2.404
  119   1HE2  GLN  18          2HE2      GLN  18   4.630  11.671  -3.708
  120   2HE2  GLN  18          1HE2      GLN  18   4.622  10.959  -5.282
  121    H    ILE  19           H        ILE  19   1.419   9.500  -0.352
  122    HA   ILE  19           HA       ILE  19  -0.908  10.575  -1.580
  123    HB   ILE  19           HB       ILE  19  -1.699   8.180  -1.569
  124   1HG1  ILE  19          1HG1      ILE  19   1.084   7.728  -0.468
  125   2HG1  ILE  19          2HG1      ILE  19  -0.425   7.417   0.386
  126   1HG2  ILE  19          1HG2      ILE  19   0.199   7.478  -3.167
  127   2HG2  ILE  19          2HG2      ILE  19   0.858   9.085  -2.844
  128   3HG2  ILE  19          3HG2      ILE  19  -0.747   8.916  -3.559
  129   1HD1  ILE  19          1HD1      ILE  19  -1.003   5.711  -1.247
  130   2HD1  ILE  19          2HD1      ILE  19   0.549   5.369  -0.480
  131   3HD1  ILE  19          3HD1      ILE  19   0.498   6.029  -2.115
  132    HA   PRO  20           HA       PRO  20  -2.664  11.118   2.505
  133   1HB   PRO  20          2HB       PRO  20  -4.461  12.996   1.887
  134   2HB   PRO  20          1HB       PRO  20  -2.729  13.348   1.874
  135   1HG   PRO  20          2HG       PRO  20  -4.569  12.778  -0.415
  136   2HG   PRO  20          1HG       PRO  20  -3.267  13.975  -0.297
  137   1HD   PRO  20          2HD       PRO  20  -3.037  11.513  -1.534
  138   2HD   PRO  20          1HD       PRO  20  -1.674  12.464  -0.916
  139    H    ALA  21           H        ALA  21  -3.638   8.967   0.631
  140    HA   ALA  21           HA       ALA  21  -5.401   7.541   0.410
  141   1HB   ALA  21          1HB       ALA  21  -5.128   7.422   2.841
  142   2HB   ALA  21          2HB       ALA  21  -6.818   7.241   2.370
  143   3HB   ALA  21          3HB       ALA  21  -6.245   8.773   3.032
  144    H    SER  22           H        SER  22  -8.085   7.748   1.142
  145    HA   SER  22           HA       SER  22 -10.095   8.667   0.596
  146   1HB   SER  22          2HB       SER  22  -8.504  11.138  -0.132
  147   2HB   SER  22          1HB       SER  22 -10.263  11.046  -0.038
  148    HG   SER  22           HG       SER  22  -9.385  11.864   1.890
  149    H    GLU  23           H        GLU  23  -7.496   9.314  -1.735
  150    HA   GLU  23           HA       GLU  23  -9.026   9.303  -4.071
  151   1HB   GLU  23          1HB       GLU  23  -6.651   9.929  -4.013
  152   2HB   GLU  23          2HB       GLU  23  -6.215   8.264  -3.653
  153   1HG   GLU  23          2HG       GLU  23  -7.105   7.563  -5.817
  154   2HG   GLU  23          1HG       GLU  23  -7.537   9.233  -6.178
  155    H    GLN  24           H        GLN  24  -7.039   6.571  -2.925
  156    HA   GLN  24           HA       GLN  24  -9.267   4.782  -3.653
  157   1HB   GLN  24          2HB       GLN  24  -6.306   4.174  -3.737
  158   2HB   GLN  24          1HB       GLN  24  -7.590   3.024  -4.081
  159   1HG   GLN  24          2HG       GLN  24  -8.292   4.371  -5.989
  160   2HG   GLN  24          1HG       GLN  24  -7.009   5.531  -5.642
  161   1HE2  GLN  24          2HE2      GLN  24  -7.765   2.361  -6.838
  162   2HE2  GLN  24          1HE2      GLN  24  -6.222   2.033  -7.542
  163    H    GLU  25           H        GLU  25 -10.228   4.043  -1.870
  164    HA   GLU  25           HA       GLU  25  -8.556   3.512   0.494
  165   1HB   GLU  25          2HB       GLU  25 -10.267   5.242   0.855
  166   2HB   GLU  25          1HB       GLU  25 -11.518   4.098   0.385
  167   1HG   GLU  25          1HG       GLU  25 -10.826   2.653   2.287
  168   2HG   GLU  25          2HG       GLU  25  -9.721   3.934   2.791
  169    H    THR  26           H        THR  26 -11.843   2.407  -0.201
  170    HA   THR  26           HA       THR  26 -12.711   0.334  -0.612
  171    HB   THR  26           HB       THR  26  -9.858  -0.600  -0.932
  172    HG1  THR  26           1HG      THR  26 -11.153   1.073  -2.440
  173   1HG2  THR  26          1HG2      THR  26 -11.422  -2.430  -0.532
  174   2HG2  THR  26          2HG2      THR  26 -10.867  -2.447  -2.207
  175   3HG2  THR  26          3HG2      THR  26 -12.473  -1.831  -1.816
  176    H    LEU  27           H        LEU  27 -13.479  -1.164   0.799
  177    HA   LEU  27           HA       LEU  27 -11.991  -1.776   3.201
  178   1HB   LEU  27          2HB       LEU  27 -14.699  -2.337   2.173
  179   2HB   LEU  27          1HB       LEU  27 -13.995  -3.599   3.171
  180    HG   LEU  27           HG       LEU  27 -15.348  -2.052   4.508
  181   1HD1  LEU  27          1HD1      LEU  27 -13.721  -1.611   6.232
  182   2HD1  LEU  27          2HD1      LEU  27 -12.403  -1.715   5.062
  183   3HD1  LEU  27          3HD1      LEU  27 -13.343  -3.158   5.465
  184   1HD2  LEU  27          1HD2      LEU  27 -15.117  -0.045   3.178
  185   2HD2  LEU  27          2HD2      LEU  27 -13.385   0.015   3.519
  186   3HD2  LEU  27          3HD2      LEU  27 -14.552   0.272   4.819
  187    H    VAL  28           H        VAL  28 -10.276  -2.316   1.515
  188    HA   VAL  28           HA       VAL  28 -10.525  -4.535  -0.173
  189    HB   VAL  28           HB       VAL  28  -8.770  -3.203  -0.813
  190   1HG1  VAL  28          1HG1      VAL  28  -8.799  -1.793   1.159
  191   2HG1  VAL  28          2HG1      VAL  28  -7.136  -2.220   0.735
  192   3HG1  VAL  28          3HG1      VAL  28  -7.946  -3.042   2.076
  193   1HG2  VAL  28          1HG2      VAL  28  -7.930  -5.477  -0.762
  194   2HG2  VAL  28          2HG2      VAL  28  -7.436  -5.278   0.921
  195   3HG2  VAL  28          3HG2      VAL  28  -6.635  -4.351  -0.350
  196    H    ARG  29           H        ARG  29 -10.243  -6.645   0.115
  197    HA   ARG  29           HA       ARG  29  -9.186  -7.719   2.572
  198   1HB   ARG  29          1HB       ARG  29 -11.469  -8.876   2.995
  199   2HB   ARG  29          2HB       ARG  29 -11.262  -7.205   3.506
  200   1HG   ARG  29          1HG       ARG  29 -12.469  -6.402   1.597
  201   2HG   ARG  29          2HG       ARG  29 -12.530  -8.024   0.900
  202   1HD   ARG  29          2HD       ARG  29 -13.945  -8.794   2.692
  203   2HD   ARG  29          1HD       ARG  29 -13.787  -7.250   3.527
  204    HE   ARG  29           HE       ARG  29 -14.881  -7.013   0.885
  205   1HH1  ARG  29          2HH1      ARG  29 -15.613  -7.637   4.234
  206   2HH1  ARG  29          1HH1      ARG  29 -17.263  -7.131   4.102
  207   1HH2  ARG  29          1HH2      ARG  29 -17.054  -6.342   0.703
  208   2HH2  ARG  29          2HH2      ARG  29 -18.082  -6.395   2.095
  209    HA   PRO  30           HA       PRO  30  -9.488 -10.351  -1.271
  210   1HB   PRO  30          1HB       PRO  30  -6.842 -10.032  -2.102
  211   2HB   PRO  30          2HB       PRO  30  -8.223  -9.092  -2.668
  212   1HG   PRO  30          2HG       PRO  30  -6.032  -8.155  -1.136
  213   2HG   PRO  30          1HG       PRO  30  -7.504  -7.265  -1.551
  214   1HD   PRO  30          1HD       PRO  30  -6.792  -8.677   0.963
  215   2HD   PRO  30          2HD       PRO  30  -7.843  -7.265   0.716
  216    H    LYS  31           H        LYS  31  -7.713 -12.047  -2.184
  217    HA   LYS  31           HA       LYS  31  -7.309 -14.062  -0.308
  218   1HB   LYS  31          2HB       LYS  31  -5.751 -13.524  -2.846
  219   2HB   LYS  31          1HB       LYS  31  -5.763 -15.045  -1.963
  220   1HG   LYS  31          1HG       LYS  31  -8.156 -15.281  -2.402
  221   2HG   LYS  31          2HG       LYS  31  -8.140 -13.757  -3.293
  222   1HD   LYS  31          1HD       LYS  31  -8.039 -15.582  -4.861
  223   2HD   LYS  31          2HD       LYS  31  -6.487 -14.742  -4.856
  224   1HE   LYS  31          2HE       LYS  31  -5.561 -16.460  -3.381
  225   2HE   LYS  31          1HE       LYS  31  -7.112 -17.299  -3.382
  226   1HZ   LYS  31          1HZ       LYS  31  -5.569 -18.298  -4.944
  227   2HZ   LYS  31          2HZ       LYS  31  -5.403 -16.828  -5.764
  228   3HZ   LYS  31          3HZ       LYS  31  -6.891 -17.632  -5.765
  229    HA   PRO  32           HA       PRO  32  -3.746 -13.075   2.099
  230   1HB   PRO  32          1HB       PRO  32  -2.176 -15.331   1.775
  231   2HB   PRO  32          2HB       PRO  32  -3.516 -15.187   2.917
  232   1HG   PRO  32          2HG       PRO  32  -3.463 -16.429   0.197
  233   2HG   PRO  32          1HG       PRO  32  -4.273 -16.990   1.673
  234   1HD   PRO  32          1HD       PRO  32  -5.637 -15.781  -0.288
  235   2HD   PRO  32          2HD       PRO  32  -6.036 -15.500   1.421
  236    H    LEU  33           H        LEU  33  -3.103 -11.389   0.603
  237    HA   LEU  33           HA       LEU  33  -0.529 -11.915  -0.621
  238   1HB   LEU  33          2HB       LEU  33  -2.897 -10.914  -2.199
  239   2HB   LEU  33          1HB       LEU  33  -1.238 -10.782  -2.749
  240    HG   LEU  33           HG       LEU  33  -2.615 -13.401  -2.148
  241   1HD1  LEU  33          1HD2      LEU  33  -3.703 -12.295  -4.021
  242   2HD1  LEU  33          2HD2      LEU  33  -2.758 -13.677  -4.576
  243   3HD1  LEU  33          3HD2      LEU  33  -2.139 -12.040  -4.795
  244   1HD2  LEU  33          1HD1      LEU  33  -0.189 -13.480  -1.941
  245   2HD2  LEU  33          2HD1      LEU  33  -0.019 -12.768  -3.546
  246   3HD2  LEU  33          3HD1      LEU  33  -0.729 -14.372  -3.363
  247    H    LEU  34           H        LEU  34  -2.799  -9.904   0.875
  248    HA   LEU  34           HA       LEU  34  -0.880  -7.681   0.822
  249   1HB   LEU  34          1HB       LEU  34  -3.843  -7.308   1.208
  250   2HB   LEU  34          2HB       LEU  34  -2.633  -6.088   0.864
  251    HG   LEU  34           HG       LEU  34  -3.702  -8.162  -1.051
  252   1HD1  LEU  34          1HD2      LEU  34  -3.897  -5.155  -1.013
  253   2HD1  LEU  34          2HD2      LEU  34  -5.201  -6.286  -0.657
  254   3HD1  LEU  34          3HD2      LEU  34  -4.517  -6.213  -2.281
  255   1HD2  LEU  34          1HD1      LEU  34  -1.329  -7.847  -1.439
  256   2HD2  LEU  34          2HD1      LEU  34  -1.547  -6.098  -1.469
  257   3HD2  LEU  34          3HD1      LEU  34  -2.269  -7.098  -2.729
  258    H    LEU  35           H        LEU  35  -2.366 -10.078   2.484
  259    HA   LEU  35           HA       LEU  35  -2.028  -8.711   5.067
  260   1HB   LEU  35          2HB       LEU  35  -3.541 -11.230   5.083
  261   2HB   LEU  35          1HB       LEU  35  -3.881  -9.717   5.891
  262    HG   LEU  35           HG       LEU  35  -5.699 -10.146   4.435
  263   1HD1  LEU  35          1HD1      LEU  35  -4.573  -7.822   4.445
  264   2HD1  LEU  35          2HD1      LEU  35  -5.815  -8.175   3.242
  265   3HD1  LEU  35          3HD1      LEU  35  -4.110  -8.225   2.791
  266   1HD2  LEU  35          1HD2      LEU  35  -3.667 -10.579   2.253
  267   2HD2  LEU  35          2HD2      LEU  35  -5.416 -10.543   2.029
  268   3HD2  LEU  35          3HD2      LEU  35  -4.679 -11.808   3.011
  269    H    LYS  36           H        LYS  36  -1.367 -11.597   3.136
  270    HA   LYS  36           HA       LYS  36   0.766 -12.472   4.813
  271   1HB   LYS  36          1HB       LYS  36   0.335 -12.571   1.825
  272   2HB   LYS  36          2HB       LYS  36   1.754 -13.246   2.610
  273   1HG   LYS  36          1HG       LYS  36  -1.079 -14.069   3.203
  274   2HG   LYS  36          2HG       LYS  36   0.010 -14.921   2.106
  275   1HD   LYS  36          1HD       LYS  36   1.562 -15.323   3.948
  276   2HD   LYS  36          2HD       LYS  36   0.496 -14.446   5.047
  277   1HE   LYS  36          2HE       LYS  36  -0.219 -16.963   3.547
  278   2HE   LYS  36          1HE       LYS  36   0.238 -16.881   5.248
  279   1HZ   LYS  36          1HZ       LYS  36  -1.696 -15.496   5.665
  280   2HZ   LYS  36          2HZ       LYS  36  -2.158 -16.971   4.978
  281   3HZ   LYS  36          3HZ       LYS  36  -2.133 -15.570   4.031
  282    H    LEU  37           H        LEU  37   0.073  -9.638   3.137
  283    HA   LEU  37           HA       LEU  37   2.836  -8.767   2.988
  284   1HB   LEU  37          1HB       LEU  37   0.811  -8.285   1.327
  285   2HB   LEU  37          2HB       LEU  37   0.553  -6.946   2.427
  286    HG   LEU  37           HG       LEU  37   1.869  -6.189   0.560
  287   1HD1  LEU  37          1HD1      LEU  37   3.334  -6.486   3.152
  288   2HD1  LEU  37          2HD1      LEU  37   2.455  -5.086   2.536
  289   3HD1  LEU  37          3HD1      LEU  37   3.993  -5.554   1.806
  290   1HD2  LEU  37          1HD2      LEU  37   2.781  -8.360  -0.119
  291   2HD2  LEU  37          2HD2      LEU  37   3.839  -8.352   1.291
  292   3HD2  LEU  37          3HD2      LEU  37   4.043  -7.137   0.029
  293    H    LEU  38           H        LEU  38  -0.211  -7.829   4.631
  294    HA   LEU  38           HA       LEU  38   1.450  -7.287   6.936
  295   1HB   LEU  38          2HB       LEU  38   0.044  -5.214   7.475
  296   2HB   LEU  38          1HB       LEU  38   1.371  -5.102   6.358
  297    HG   LEU  38           HG       LEU  38  -0.532  -3.754   5.676
  298   1HD1  LEU  38          1HD1      LEU  38   1.043  -4.565   4.032
  299   2HD1  LEU  38          2HD1      LEU  38  -0.584  -4.409   3.367
  300   3HD1  LEU  38          3HD1      LEU  38   0.050  -6.003   3.784
  301   1HD2  LEU  38          1HD2      LEU  38  -2.342  -5.062   6.528
  302   2HD2  LEU  38          2HD2      LEU  38  -1.981  -6.361   5.387
  303   3HD2  LEU  38          3HD2      LEU  38  -2.544  -4.795   4.797
  304    H    LYS  39           H        LYS  39   0.235  -9.480   7.106
  305    HA   LYS  39           HA       LYS  39  -1.376  -8.669   9.432
  306   1HB   LYS  39          2HB       LYS  39  -1.366 -11.237   7.884
  307   2HB   LYS  39          1HB       LYS  39  -1.724 -11.271   9.605
  308   1HG   LYS  39          2HG       LYS  39  -3.638  -9.906   9.326
  309   2HG   LYS  39          1HG       LYS  39  -3.200  -9.520   7.660
  310   1HD   LYS  39          1HD       LYS  39  -3.688 -11.707   6.919
  311   2HD   LYS  39          2HD       LYS  39  -3.767 -12.330   8.571
  312   1HE   LYS  39          2HE       LYS  39  -5.682 -10.353   7.340
  313   2HE   LYS  39          1HE       LYS  39  -5.993 -12.073   7.575
  314   1HZ   LYS  39          1HZ       LYS  39  -5.499 -10.082   9.722
  315   2HZ   LYS  39          2HZ       LYS  39  -5.747 -11.737   9.968
  316   3HZ   LYS  39          3HZ       LYS  39  -6.991 -10.780   9.336
  317    H    SER  40           H        SER  40   1.624  -9.250   8.365
  318    HA   SER  40           HA       SER  40   2.549 -10.866  10.607
  319   1HB   SER  40          1HB       SER  40   4.040  -9.768   8.212
  320   2HB   SER  40          2HB       SER  40   4.728 -10.839   9.434
  321    HG   SER  40           HG       SER  40   2.647 -12.111   8.716
  322    H    VAL  41           H        VAL  41   3.071  -7.634   9.218
  323    HA   VAL  41           HA       VAL  41   4.931  -6.604  10.969
  324    HB   VAL  41           HB       VAL  41   2.827  -4.654  10.608
  325   1HG1  VAL  41          1HG2      VAL  41   4.556  -3.404   9.525
  326   2HG1  VAL  41          2HG2      VAL  41   5.545  -4.851   9.327
  327   3HG1  VAL  41          3HG2      VAL  41   5.234  -4.208  10.940
  328   1HG2  VAL  41          1HG1      VAL  41   3.103  -4.612   8.060
  329   2HG2  VAL  41          2HG1      VAL  41   1.964  -5.772   8.763
  330   3HG2  VAL  41          3HG1      VAL  41   3.558  -6.313   8.226
  331    H    GLY  42           H        GLY  42   1.402  -6.318  11.352
  332   1HA   GLY  42          2HA       GLY  42   1.348  -7.297  13.965
  333   2HA   GLY  42          1HA       GLY  42   1.438  -5.545  14.060
  334    H    ALA  43           H        ALA  43  -0.091  -6.602  11.254
  335    HA   ALA  43           HA       ALA  43  -2.662  -5.691  12.236
  336   1HB   ALA  43          1HB       ALA  43  -1.868  -6.673   9.497
  337   2HB   ALA  43          2HB       ALA  43  -1.882  -4.991  10.029
  338   3HB   ALA  43          3HB       ALA  43  -3.394  -5.893   9.917
  339    H    GLN  44           H        GLN  44  -4.605  -6.904  12.126
  340    HA   GLN  44           HA       GLN  44  -4.603  -9.684  11.469
  341   1HB   GLN  44          2HB       GLN  44  -3.486  -9.725  13.690
  342   2HB   GLN  44          1HB       GLN  44  -4.907  -8.963  14.389
  343   1HG   GLN  44          1HG       GLN  44  -6.262 -10.891  13.763
  344   2HG   GLN  44          2HG       GLN  44  -4.844 -11.655  13.043
  345   1HE2  GLN  44          2HE2      GLN  44  -6.420 -10.743  15.999
  346   2HE2  GLN  44          1HE2      GLN  44  -5.437 -11.691  17.056
  347    H    LYS  45           H        LYS  45  -6.236  -8.464  10.171
  348    HA   LYS  45           HA       LYS  45  -8.831  -8.677  11.516
  349   1HB   LYS  45          2HB       LYS  45  -8.047  -6.371   9.724
  350   2HB   LYS  45          1HB       LYS  45  -9.637  -6.633  10.427
  351   1HG   LYS  45          2HG       LYS  45  -8.643  -6.408  12.674
  352   2HG   LYS  45          1HG       LYS  45  -7.090  -6.042  11.921
  353   1HD   LYS  45          1HD       LYS  45  -9.627  -4.457  11.521
  354   2HD   LYS  45          2HD       LYS  45  -8.320  -4.015  12.621
  355   1HE   LYS  45          2HE       LYS  45  -6.774  -3.866  10.741
  356   2HE   LYS  45          1HE       LYS  45  -8.063  -4.338   9.634
  357   1HZ   LYS  45          1HZ       LYS  45  -9.268  -2.331  10.244
  358   2HZ   LYS  45          2HZ       LYS  45  -7.737  -1.949   9.635
  359   3HZ   LYS  45          3HZ       LYS  45  -8.026  -1.880  11.300
  360    H    ASP  46           H        ASP  46 -10.573  -9.197  10.144
  361    HA   ASP  46           HA       ASP  46  -9.887 -10.927   8.014
  362   1HB   ASP  46          1HB       ASP  46 -12.586  -9.804   8.798
  363   2HB   ASP  46          2HB       ASP  46 -12.327 -11.148   7.690
  364    H    THR  47           H        THR  47 -10.316  -7.571   8.135
  365    HA   THR  47           HA       THR  47 -10.192  -7.445   5.209
  366    HB   THR  47           HB       THR  47 -11.803  -5.644   5.057
  367    HG1  THR  47           1HG      THR  47 -13.044  -5.591   7.343
  368   1HG2  THR  47          1HG2      THR  47 -12.985  -7.920   6.647
  369   2HG2  THR  47          2HG2      THR  47 -12.706  -7.917   4.905
  370   3HG2  THR  47          3HG2      THR  47 -13.872  -6.799   5.614
  371    H    TYR  48           H        TYR  48  -9.843  -5.054   4.557
  372    HA   TYR  48           HA       TYR  48  -8.301  -3.575   6.530
  373   1HB   TYR  48          2HB       TYR  48  -7.179  -4.691   3.976
  374   2HB   TYR  48          1HB       TYR  48  -6.479  -3.277   4.757
  375    HD1  TYR  48           1HD      TYR  48  -5.411  -3.458   6.928
  376    HD2  TYR  48           2HD      TYR  48  -6.921  -6.888   4.915
  377    HE1  TYR  48           1HE      TYR  48  -4.078  -4.906   8.412
  378    HE2  TYR  48           2HE      TYR  48  -5.567  -8.346   6.371
  379    HH   TYR  48           HH       TYR  48  -4.153  -7.268   9.224
  380    H    THR  49           H        THR  49  -7.743  -1.425   5.834
  381    HA   THR  49           HA       THR  49  -9.168  -0.512   3.425
  382    HB   THR  49           HB       THR  49  -9.679   1.615   4.441
  383    HG1  THR  49           1HG      THR  49  -8.762   0.669   6.948
  384   1HG2  THR  49          1HG2      THR  49 -11.309   0.921   6.138
  385   2HG2  THR  49          2HG2      THR  49 -10.523  -0.655   6.249
  386   3HG2  THR  49          3HG2      THR  49 -11.322  -0.170   4.752
  387    H    MET  50           H        MET  50  -8.205   1.430   2.456
  388    HA   MET  50           HA       MET  50  -5.495   0.723   2.024
  389   1HB   MET  50          1HB       MET  50  -7.546   2.188   0.683
  390   2HB   MET  50          2HB       MET  50  -6.072   3.152   0.695
  391   1HG   MET  50          2HG       MET  50  -6.030   0.274  -0.121
  392   2HG   MET  50          1HG       MET  50  -6.482   1.538  -1.260
  393   1HE   MET  50          1HE       MET  50  -4.626   3.951  -0.284
  394   2HE   MET  50          2HE       MET  50  -4.855   3.526  -1.980
  395   3HE   MET  50          3HE       MET  50  -3.226   3.734  -1.336
  396    H    LYS  51           H        LYS  51  -6.730   2.567   4.423
  397    HA   LYS  51           HA       LYS  51  -4.441   4.385   4.548
  398   1HB   LYS  51          1HB       LYS  51  -6.758   4.018   6.461
  399   2HB   LYS  51          2HB       LYS  51  -5.509   5.249   6.594
  400   1HG   LYS  51          1HG       LYS  51  -6.245   6.231   4.483
  401   2HG   LYS  51          2HG       LYS  51  -7.491   4.992   4.340
  402   1HD   LYS  51          2HD       LYS  51  -8.512   5.782   6.423
  403   2HD   LYS  51          1HD       LYS  51  -7.269   7.030   6.554
  404   1HE   LYS  51          2HE       LYS  51  -8.027   8.001   4.438
  405   2HE   LYS  51          1HE       LYS  51  -9.269   6.756   4.312
  406   1HZ   LYS  51          1HZ       LYS  51 -10.259   7.592   6.355
  407   2HZ   LYS  51          2HZ       LYS  51 -10.177   8.810   5.185
  408   3HZ   LYS  51          3HZ       LYS  51  -9.071   8.792   6.465
  409    H    GLU  52           H        GLU  52  -5.971   1.837   6.497
  410    HA   GLU  52           HA       GLU  52  -3.903   1.034   8.118
  411   1HB   GLU  52          2HB       GLU  52  -6.267   0.004   7.640
  412   2HB   GLU  52          1HB       GLU  52  -5.395  -0.989   6.485
  413   1HG   GLU  52          1HG       GLU  52  -5.575  -2.222   8.501
  414   2HG   GLU  52          2HG       GLU  52  -3.895  -1.713   8.333
  415    H    VAL  53           H        VAL  53  -4.503  -0.361   4.897
  416    HA   VAL  53           HA       VAL  53  -2.043  -1.607   4.588
  417    HB   VAL  53           HB       VAL  53  -3.686  -0.461   2.329
  418   1HG1  VAL  53          1HG2      VAL  53  -1.497  -1.291   1.666
  419   2HG1  VAL  53          2HG2      VAL  53  -2.770  -2.354   1.066
  420   3HG1  VAL  53          3HG2      VAL  53  -1.818  -2.827   2.473
  421   1HG2  VAL  53          1HG1      VAL  53  -4.854  -2.630   2.313
  422   2HG2  VAL  53          2HG1      VAL  53  -5.151  -1.710   3.788
  423   3HG2  VAL  53          3HG1      VAL  53  -4.023  -3.067   3.807
  424    H    LEU  54           H        LEU  54  -2.976   1.729   3.950
  425    HA   LEU  54           HA       LEU  54  -0.914   2.677   2.425
  426   1HB   LEU  54          2HB       LEU  54  -2.787   4.033   3.358
  427   2HB   LEU  54          1HB       LEU  54  -1.978   4.025   4.911
  428    HG   LEU  54           HG       LEU  54  -1.749   6.114   3.445
  429   1HD1  LEU  54          1HD1      LEU  54   0.546   6.499   4.171
  430   2HD1  LEU  54          2HD1      LEU  54   0.742   4.775   4.485
  431   3HD1  LEU  54          3HD1      LEU  54  -0.402   5.719   5.440
  432   1HD2  LEU  54          1HD2      LEU  54   0.209   4.318   2.023
  433   2HD2  LEU  54          2HD2      LEU  54   0.051   6.059   1.796
  434   3HD2  LEU  54          3HD2      LEU  54  -1.273   4.987   1.342
  435    H    PHE  55           H        PHE  55  -0.797   2.844   5.990
  436    HA   PHE  55           HA       PHE  55   2.073   3.096   5.863
  437   1HB   PHE  55          1HB       PHE  55   1.873   3.206   8.387
  438   2HB   PHE  55          2HB       PHE  55   1.036   4.468   7.490
  439    HD1  PHE  55           1HD      PHE  55   0.412   1.117   9.001
  440    HD2  PHE  55           2HD      PHE  55  -1.141   4.959   8.026
  441    HE1  PHE  55           1HE      PHE  55  -1.673   0.573  10.187
  442    HE2  PHE  55           2HE      PHE  55  -3.228   4.419   9.209
  443    HZ   PHE  55           HZ       PHE  55  -3.496   2.224  10.292
  444    H    TYR  56           H        TYR  56  -0.095   0.502   6.073
  445    HA   TYR  56           HA       TYR  56   1.623  -1.203   7.653
  446   1HB   TYR  56          1HB       TYR  56  -1.105  -1.297   6.763
  447   2HB   TYR  56          2HB       TYR  56  -0.283  -2.800   6.379
  448    HD1  TYR  56           1HD      TYR  56   1.501  -3.346   8.470
  449    HD2  TYR  56           2HD      TYR  56  -2.327  -1.506   8.721
  450    HE1  TYR  56           1HE      TYR  56   1.325  -4.061  10.815
  451    HE2  TYR  56           2HE      TYR  56  -2.526  -2.219  11.065
  452    HH   TYR  56           HH       TYR  56   0.105  -3.404  12.854
  453    H    LEU  57           H        LEU  57   0.360  -1.488   4.321
  454    HA   LEU  57           HA       LEU  57   2.269  -3.326   3.446
  455   1HB   LEU  57          2HB       LEU  57   0.144  -2.194   2.282
  456   2HB   LEU  57          1HB       LEU  57   1.388  -1.185   1.574
  457    HG   LEU  57           HG       LEU  57   1.428  -4.195   1.413
  458   1HD1  LEU  57          1HD2      LEU  57   0.557  -3.952  -0.855
  459   2HD1  LEU  57          2HD2      LEU  57   0.353  -2.221  -0.593
  460   3HD1  LEU  57          3HD2      LEU  57  -0.598  -3.372   0.345
  461   1HD2  LEU  57          1HD1      LEU  57   2.853  -2.089  -0.204
  462   2HD2  LEU  57          2HD1      LEU  57   3.011  -3.836  -0.380
  463   3HD2  LEU  57          3HD1      LEU  57   3.576  -3.043   1.090
  464    H    GLY  58           H        GLY  58   2.365   0.196   3.674
  465   1HA   GLY  58          2HA       GLY  58   4.905   0.644   2.593
  466   2HA   GLY  58          1HA       GLY  58   4.159   1.610   3.857
  467    H    GLN  59           H        GLN  59   4.006  -0.190   5.950
  468    HA   GLN  59           HA       GLN  59   6.677   0.122   6.871
  469   1HB   GLN  59          1HB       GLN  59   5.873  -0.793   8.999
  470   2HB   GLN  59          2HB       GLN  59   4.820   0.475   8.394
  471   1HG   GLN  59          2HG       GLN  59   3.302  -1.292   7.536
  472   2HG   GLN  59          1HG       GLN  59   4.324  -2.485   8.338
  473   1HE2  GLN  59          1HE2      GLN  59   2.004   0.056   8.760
  474   2HE2  GLN  59          2HE2      GLN  59   1.693  -0.222  10.435
  475    H    TYR  60           H        TYR  60   4.750  -2.699   5.901
  476    HA   TYR  60           HA       TYR  60   6.608  -4.653   6.683
  477   1HB   TYR  60          1HB       TYR  60   4.308  -5.173   5.949
  478   2HB   TYR  60          2HB       TYR  60   4.757  -4.751   4.300
  479    HD1  TYR  60           1HD      TYR  60   5.890  -6.289   2.906
  480    HD2  TYR  60           2HD      TYR  60   5.394  -7.146   7.042
  481    HE1  TYR  60           1HE      TYR  60   6.657  -8.587   2.515
  482    HE2  TYR  60           2HE      TYR  60   6.161  -9.449   6.662
  483    HH   TYR  60           HH       TYR  60   6.308 -11.060   4.810
  484    H    ILE  61           H        ILE  61   6.376  -2.757   3.686
  485    HA   ILE  61           HA       ILE  61   8.454  -3.904   2.234
  486    HB   ILE  61           HB       ILE  61   7.867  -0.943   2.420
  487   1HG1  ILE  61          1HG1      ILE  61   6.773  -2.835   0.353
  488   2HG1  ILE  61          2HG1      ILE  61   5.914  -2.510   1.857
  489   1HG2  ILE  61          1HG2      ILE  61   8.734  -0.944   0.072
  490   2HG2  ILE  61          2HG2      ILE  61   9.264  -2.606   0.332
  491   3HG2  ILE  61          3HG2      ILE  61   9.945  -1.300   1.305
  492   1HD1  ILE  61          1HD1      ILE  61   6.045  -0.072   1.261
  493   2HD1  ILE  61          2HD1      ILE  61   5.006  -1.065   0.235
  494   3HD1  ILE  61          3HD1      ILE  61   6.605  -0.581  -0.335
  495    H    MET  62           H        MET  62   8.730  -0.963   4.207
  496    HA   MET  62           HA       MET  62  11.501  -0.807   4.207
  497   1HB   MET  62          1HB       MET  62   9.638   0.114   6.401
  498   2HB   MET  62          2HB       MET  62  11.273   0.696   6.117
  499   1HG   MET  62          1HG       MET  62  10.578   1.595   3.956
  500   2HG   MET  62          2HG       MET  62   8.940   1.012   4.243
  501   1HE   MET  62          1HE       MET  62   7.989   3.449   3.768
  502   2HE   MET  62          2HE       MET  62   9.627   4.037   3.482
  503   3HE   MET  62          3HE       MET  62   8.560   4.898   4.593
  504    H    THR  63           H        THR  63   9.387  -2.629   6.376
  505    HA   THR  63           HA       THR  63  11.283  -2.824   8.467
  506    HB   THR  63           HB       THR  63   8.794  -3.035   8.755
  507    HG1  THR  63           1HG      THR  63  10.542  -5.012   9.828
  508   1HG2  THR  63          1HG2      THR  63   7.807  -5.259   8.480
  509   2HG2  THR  63          2HG2      THR  63   9.315  -5.844   7.776
  510   3HG2  THR  63          3HG2      THR  63   8.368  -4.616   6.935
  511    H    LYS  64           H        LYS  64  10.618  -4.816   5.684
  512    HA   LYS  64           HA       LYS  64  12.008  -7.099   6.810
  513   1HB   LYS  64          2HB       LYS  64  10.712  -6.722   4.107
  514   2HB   LYS  64          1HB       LYS  64  11.366  -8.237   4.716
  515   1HG   LYS  64          2HG       LYS  64   9.247  -6.789   6.247
  516   2HG   LYS  64          1HG       LYS  64   8.823  -7.792   4.859
  517   1HD   LYS  64          1HD       LYS  64   8.621  -9.240   6.678
  518   2HD   LYS  64          2HD       LYS  64  10.207  -9.623   6.006
  519   1HE   LYS  64          2HE       LYS  64  11.265  -8.209   7.698
  520   2HE   LYS  64          1HE       LYS  64   9.681  -7.824   8.369
  521   1HZ   LYS  64          1HZ       LYS  64   9.375 -10.161   8.896
  522   2HZ   LYS  64          2HZ       LYS  64  10.777  -9.565   9.632
  523   3HZ   LYS  64          3HZ       LYS  64  10.894 -10.534   8.250
  524    H    ARG  65           H        ARG  65  13.230  -4.429   5.859
  525    HA   ARG  65           HA       ARG  65  15.204  -3.737   4.967
  526   1HB   ARG  65          1HB       ARG  65  15.978  -6.586   5.613
  527   2HB   ARG  65          2HB       ARG  65  17.104  -5.270   5.306
  528   1HG   ARG  65          2HG       ARG  65  16.289  -4.093   7.275
  529   2HG   ARG  65          1HG       ARG  65  15.127  -5.387   7.575
  530   1HD   ARG  65          1HD       ARG  65  16.967  -6.974   7.856
  531   2HD   ARG  65          2HD       ARG  65  18.129  -5.684   7.549
  532    HE   ARG  65           HE       ARG  65  16.544  -4.845   9.661
  533   1HH1  ARG  65          2HH1      ARG  65  18.773  -7.437   8.982
  534   2HH1  ARG  65          1HH1      ARG  65  19.283  -7.602  10.629
  535   1HH2  ARG  65          1HH2      ARG  65  17.209  -5.055  11.830
  536   2HH2  ARG  65          2HH2      ARG  65  18.395  -6.248  12.248
  537    H    LEU  66           H        LEU  66  13.288  -4.726   3.064
  538    HA   LEU  66           HA       LEU  66  14.939  -6.000   1.020
  539   1HB   LEU  66          2HB       LEU  66  12.037  -5.184   0.915
  540   2HB   LEU  66          1HB       LEU  66  12.881  -6.175  -0.260
  541    HG   LEU  66           HG       LEU  66  12.745  -7.080   2.587
  542   1HD1  LEU  66          1HD1      LEU  66  10.543  -7.302   0.550
  543   2HD1  LEU  66          2HD1      LEU  66  10.467  -6.546   2.143
  544   3HD1  LEU  66          3HD1      LEU  66  10.653  -8.296   2.004
  545   1HD2  LEU  66          1HD2      LEU  66  14.163  -8.312   1.072
  546   2HD2  LEU  66          2HD2      LEU  66  12.835  -8.489  -0.074
  547   3HD2  LEU  66          3HD2      LEU  66  12.757  -9.288   1.495
  548    H    TYR  67           H        TYR  67  14.181  -2.920   2.077
  549    HA   TYR  67           HA       TYR  67  13.899  -1.544  -0.384
  550   1HB   TYR  67          1HB       TYR  67  14.211   0.477   0.901
  551   2HB   TYR  67          2HB       TYR  67  13.199  -0.630   1.821
  552    HD1  TYR  67           1HD      TYR  67  16.251   1.267   1.772
  553    HD2  TYR  67           2HD      TYR  67  14.230  -1.927   3.722
  554    HE1  TYR  67           1HE      TYR  67  17.785   1.473   3.680
  555    HE2  TYR  67           2HE      TYR  67  15.759  -1.731   5.640
  556    HH   TYR  67           HH       TYR  67  17.836   0.921   6.071
  557    H    ASP  68           H        ASP  68  15.655   0.467  -0.522
  558    HA   ASP  68           HA       ASP  68  18.008  -0.862  -1.516
  559   1HB   ASP  68          2HB       ASP  68  16.969   0.961  -2.794
  560   2HB   ASP  68          1HB       ASP  68  17.296   2.081  -1.475
  561    H    GLU  69           H        GLU  69  18.274   2.282  -0.006
  562    HA   GLU  69           HA       GLU  69  19.260   1.595   2.497
  563   1HB   GLU  69          2HB       GLU  69  21.038   0.417   1.259
  564   2HB   GLU  69          1HB       GLU  69  21.459   1.917   0.445
  565   1HG   GLU  69          1HG       GLU  69  23.013   1.464   2.234
  566   2HG   GLU  69          2HG       GLU  69  22.071   2.911   2.593
  567    H    LYS  70           H        LYS  70  19.531   3.731  -0.277
  568    HA   LYS  70           HA       LYS  70  20.634   5.931   1.140
  569   1HB   LYS  70          2HB       LYS  70  19.143   5.884  -1.489
  570   2HB   LYS  70          1HB       LYS  70  20.093   7.233  -0.882
  571   1HG   LYS  70          2HG       LYS  70  22.103   5.826  -0.940
  572   2HG   LYS  70          1HG       LYS  70  21.140   4.501  -1.597
  573   1HD   LYS  70          2HD       LYS  70  22.275   5.599  -3.408
  574   2HD   LYS  70          1HD       LYS  70  20.550   5.955  -3.522
  575   1HE   LYS  70          2HE       LYS  70  20.925   8.130  -2.475
  576   2HE   LYS  70          1HE       LYS  70  22.647   7.776  -2.343
  577   1HZ   LYS  70          1HZ       LYS  70  22.770   7.663  -4.755
  578   2HZ   LYS  70          2HZ       LYS  70  22.181   9.167  -4.255
  579   3HZ   LYS  70          3HZ       LYS  70  21.118   8.009  -4.879
  580    H    GLN  71           H        GLN  71  17.452   5.843  -0.462
  581    HA   GLN  71           HA       GLN  71  16.380   7.359   1.823
  582   1HB   GLN  71          2HB       GLN  71  15.572   7.556  -1.084
  583   2HB   GLN  71          1HB       GLN  71  14.827   8.440   0.241
  584   1HG   GLN  71          2HG       GLN  71  16.934   9.586   0.672
  585   2HG   GLN  71          1HG       GLN  71  17.692   8.693  -0.646
  586   1HE2  GLN  71          2HE2      GLN  71  17.156   9.188  -2.772
  587   2HE2  GLN  71          1HE2      GLN  71  16.362  10.662  -3.199
  588    H    GLN  72           H        GLN  72  16.447   4.404   0.961
  589    HA   GLN  72           HA       GLN  72  15.093   2.575   1.102
  590   1HB   GLN  72          2HB       GLN  72  13.282   4.406   2.684
  591   2HB   GLN  72          1HB       GLN  72  13.345   2.651   2.767
  592   1HG   GLN  72          1HG       GLN  72  15.621   2.782   3.664
  593   2HG   GLN  72          2HG       GLN  72  15.532   4.543   3.604
  594   1HE2  GLN  72          2HE2      GLN  72  15.830   4.747   5.814
  595   2HE2  GLN  72          1HE2      GLN  72  14.600   4.337   6.955
  596    H    HIS  73           H        HIS  73  14.625   4.599  -1.072
  597    HA   HIS  73           HA       HIS  73  11.757   4.506  -1.510
  598   1HB   HIS  73          1HB       HIS  73  12.264   5.884  -3.508
  599   2HB   HIS  73          2HB       HIS  73  12.909   6.579  -2.025
  600    HD1  HIS  73           1HD      HIS  73  15.574   5.984  -1.637
  601    HD2  HIS  73           2HD      HIS  73  14.082   5.728  -5.506
  602    HE1  HIS  73           1HE      HIS  73  17.588   6.067  -3.140
  603    HE2  HIS  73           2HE      HIS  73  16.653   5.993  -5.480
  604    H    ILE  74           H        ILE  74  14.655   2.942  -2.701
  605    HA   ILE  74           HA       ILE  74  13.092   1.405  -4.637
  606    HB   ILE  74           HB       ILE  74  16.005   1.034  -3.936
  607   1HG1  ILE  74          2HG1      ILE  74  15.639   3.330  -4.733
  608   2HG1  ILE  74          1HG1      ILE  74  16.523   2.378  -5.922
  609   1HG2  ILE  74          1HG2      ILE  74  14.357   0.182  -6.312
  610   2HG2  ILE  74          2HG2      ILE  74  15.002  -0.864  -5.047
  611   3HG2  ILE  74          3HG2      ILE  74  16.100  -0.037  -6.153
  612   1HD1  ILE  74          1HD1      ILE  74  14.474   2.084  -7.209
  613   2HD1  ILE  74          2HD1      ILE  74  14.858   3.790  -6.980
  614   3HD1  ILE  74          3HD1      ILE  74  13.589   3.034  -6.017
  615    H    VAL  75           H        VAL  75  12.911  -0.891  -4.503
  616    HA   VAL  75           HA       VAL  75  13.543  -2.084  -1.900
  617    HB   VAL  75           HB       VAL  75  10.893  -2.728  -3.098
  618   1HG1  VAL  75          1HG1      VAL  75  11.921  -2.587  -0.268
  619   2HG1  VAL  75          2HG1      VAL  75  11.739  -4.046  -1.242
  620   3HG1  VAL  75          3HG1      VAL  75  10.314  -3.129  -0.753
  621   1HG2  VAL  75          1HG2      VAL  75  10.781  -0.349  -3.088
  622   2HG2  VAL  75          2HG2      VAL  75  11.464  -0.267  -1.462
  623   3HG2  VAL  75          3HG2      VAL  75   9.853  -0.943  -1.710
  624    H    TYR  76           H        TYR  76  15.157  -3.311  -2.958
  625    HA   TYR  76           HA       TYR  76  14.391  -5.197  -4.978
  626   1HB   TYR  76          1HB       TYR  76  16.852  -5.252  -3.250
  627   2HB   TYR  76          2HB       TYR  76  16.613  -6.058  -4.801
  628    HD1  TYR  76           1HD      TYR  76  17.839  -3.198  -3.196
  629    HD2  TYR  76           2HD      TYR  76  16.047  -4.486  -6.815
  630    HE1  TYR  76           1HE      TYR  76  18.718  -1.195  -4.321
  631    HE2  TYR  76           2HE      TYR  76  16.935  -2.498  -7.970
  632    HH   TYR  76           HH       TYR  76  17.687  -0.225  -7.403
  633    H    CYS  77           H        CYS  77  12.906  -6.669  -4.420
  634    HA   CYS  77           HA       CYS  77  12.966  -7.749  -1.695
  635   1HB   CYS  77          1HB       CYS  77  10.624  -8.397  -2.107
  636   2HB   CYS  77          2HB       CYS  77  10.881  -6.673  -2.355
  637    HG   CYS  77           HG       CYS  77   9.848  -8.998  -4.507
  638    H    SER  78           H        SER  78  13.531  -8.631  -4.945
  639    HA   SER  78           HA       SER  78  14.026 -10.582  -5.988
  640   1HB   SER  78          1HB       SER  78  15.735 -10.678  -4.209
  641   2HB   SER  78          2HB       SER  78  14.599 -11.560  -3.186
  642    HG   SER  78           HG       SER  78  14.877 -13.316  -4.358
  643    H    ASN  79           H        ASN  79  12.968 -12.233  -3.087
  644    HA   ASN  79           HA       ASN  79  10.500 -13.060  -4.438
  645   1HB   ASN  79          1HB       ASN  79  12.264 -14.802  -4.768
  646   2HB   ASN  79          2HB       ASN  79  12.354 -14.985  -3.019
  647   1HD2  ASN  79          2HD2      ASN  79  10.417 -15.498  -5.859
  648   2HD2  ASN  79          1HD2      ASN  79   9.301 -16.606  -5.142
  649    H    ASP  80           H        ASP  80  10.145 -11.201  -2.721
  650    HA   ASP  80           HA       ASP  80   9.694 -12.333  -0.061
  651   1HB   ASP  80          1HB       ASP  80  10.788 -10.079  -0.362
  652   2HB   ASP  80          2HB       ASP  80   9.239  -9.486  -0.958
  653    H    LEU  81           H        LEU  81   7.542 -11.390   0.970
  654    HA   LEU  81           HA       LEU  81   5.261 -12.268  -0.416
  655   1HB   LEU  81          1HB       LEU  81   5.635 -10.385   1.901
  656   2HB   LEU  81          2HB       LEU  81   4.047 -10.744   1.254
  657    HG   LEU  81           HG       LEU  81   4.501 -12.105   3.219
  658   1HD1  LEU  81          1HD2      LEU  81   3.103 -13.060   1.475
  659   2HD1  LEU  81          2HD2      LEU  81   4.058 -14.314   2.268
  660   3HD1  LEU  81          3HD2      LEU  81   4.530 -13.721   0.675
  661   1HD2  LEU  81          1HD1      LEU  81   6.840 -13.193   1.661
  662   2HD2  LEU  81          2HD1      LEU  81   6.267 -13.786   3.219
  663   3HD2  LEU  81          3HD1      LEU  81   6.933 -12.159   3.086
  664    H    LEU  82           H        LEU  82   6.861  -9.142  -0.239
  665    HA   LEU  82           HA       LEU  82   5.034  -7.697  -1.841
  666   1HB   LEU  82          1HB       LEU  82   7.963  -7.399  -1.254
  667   2HB   LEU  82          2HB       LEU  82   7.157  -6.340  -2.395
  668    HG   LEU  82           HG       LEU  82   6.274  -6.678   0.470
  669   1HD1  LEU  82          1HD1      LEU  82   8.531  -5.761   0.412
  670   2HD1  LEU  82          2HD1      LEU  82   7.361  -4.531   0.895
  671   3HD1  LEU  82          3HD1      LEU  82   8.012  -4.535  -0.745
  672   1HD2  LEU  82          1HD2      LEU  82   4.572  -5.897  -1.143
  673   2HD2  LEU  82          2HD2      LEU  82   5.635  -4.555  -1.574
  674   3HD2  LEU  82          3HD2      LEU  82   4.986  -4.677   0.062
  675    H    GLY  83           H        GLY  83   7.393 -10.121  -2.553
  676   1HA   GLY  83          2HA       GLY  83   7.488  -9.770  -5.374
  677   2HA   GLY  83          1HA       GLY  83   7.794 -11.268  -4.507
  678    H    ASP  84           H        ASP  84   5.305 -11.535  -3.216
  679    HA   ASP  84           HA       ASP  84   3.631 -12.615  -5.208
  680   1HB   ASP  84          2HB       ASP  84   2.924 -11.756  -2.391
  681   2HB   ASP  84          1HB       ASP  84   1.922 -12.767  -3.428
  682    H    LEU  85           H        LEU  85   4.012  -9.404  -4.010
  683    HA   LEU  85           HA       LEU  85   1.502  -8.347  -4.811
  684   1HB   LEU  85          1HB       LEU  85   4.188  -7.061  -4.399
  685   2HB   LEU  85          2HB       LEU  85   2.753  -6.155  -4.829
  686    HG   LEU  85           HG       LEU  85   3.646  -7.039  -2.246
  687   1HD1  LEU  85          1HD1      LEU  85   1.381  -5.313  -3.218
  688   2HD1  LEU  85          2HD1      LEU  85   2.999  -4.781  -2.759
  689   3HD1  LEU  85          3HD1      LEU  85   1.906  -5.431  -1.537
  690   1HD2  LEU  85          1HD2      LEU  85   0.836  -7.839  -2.995
  691   2HD2  LEU  85          2HD2      LEU  85   1.500  -7.817  -1.362
  692   3HD2  LEU  85          3HD2      LEU  85   2.147  -8.935  -2.563
  693    H    PHE  86           H        PHE  86   4.591  -7.424  -6.242
  694    HA   PHE  86           HA       PHE  86   3.182  -6.854  -8.719
  695   1HB   PHE  86          2HB       PHE  86   6.104  -6.321  -8.314
  696   2HB   PHE  86          1HB       PHE  86   4.932  -5.416  -9.262
  697    HD1  PHE  86           1HD      PHE  86   3.773  -3.589  -8.346
  698    HD2  PHE  86           2HD      PHE  86   6.044  -6.156  -5.822
  699    HE1  PHE  86           1HE      PHE  86   3.521  -1.986  -6.494
  700    HE2  PHE  86           2HE      PHE  86   5.789  -4.566  -3.965
  701    HZ   PHE  86           HZ       PHE  86   4.528  -2.481  -4.300
  702    H    GLY  87           H        GLY  87   5.905  -8.806  -7.581
  703   1HA   GLY  87          2HA       GLY  87   6.751 -10.736  -8.732
  704   2HA   GLY  87          1HA       GLY  87   6.054 -10.103 -10.219
  705    H    VAL  88           H        VAL  88   7.531  -7.711  -8.353
  706    HA   VAL  88           HA       VAL  88   9.541  -7.334 -10.392
  707    HB   VAL  88           HB       VAL  88  10.075  -5.253  -9.208
  708   1HG1  VAL  88          1HG2      VAL  88   8.316  -5.123 -10.817
  709   2HG1  VAL  88          2HG2      VAL  88   7.842  -4.162  -9.414
  710   3HG1  VAL  88          3HG2      VAL  88   7.145  -5.762  -9.665
  711   1HG2  VAL  88          1HG1      VAL  88   8.769  -4.576  -7.243
  712   2HG2  VAL  88          2HG1      VAL  88   9.752  -6.005  -6.923
  713   3HG2  VAL  88          3HG1      VAL  88   8.019  -6.173  -7.204
  714    HA   PRO  89           HA       PRO  89  13.052  -8.447  -7.690
  715   1HB   PRO  89          1HB       PRO  89  14.996  -7.227  -9.071
  716   2HB   PRO  89          2HB       PRO  89  14.272  -8.734  -9.645
  717   1HG   PRO  89          1HG       PRO  89  13.735  -5.919 -10.515
  718   2HG   PRO  89          2HG       PRO  89  13.914  -7.379 -11.504
  719   1HD   PRO  89          1HD       PRO  89  11.496  -6.284 -10.788
  720   2HD   PRO  89          2HD       PRO  89  11.732  -7.995 -11.191
  721    H    SER  90           H        SER  90  12.008  -5.320  -8.796
  722    HA   SER  90           HA       SER  90  12.772  -4.112  -6.263
  723   1HB   SER  90          2HB       SER  90  13.858  -2.183  -7.384
  724   2HB   SER  90          1HB       SER  90  14.739  -3.691  -7.616
  725    HG   SER  90           HG       SER  90  13.837  -2.055  -9.471
  726    H    PHE  91           H        PHE  91  11.403  -2.354  -5.699
  727    HA   PHE  91           HA       PHE  91   9.912  -1.107  -7.866
  728   1HB   PHE  91          1HB       PHE  91   7.775  -1.208  -6.772
  729   2HB   PHE  91          2HB       PHE  91   8.407  -2.840  -6.934
  730    HD1  PHE  91           1HD      PHE  91   7.530  -0.177  -4.584
  731    HD2  PHE  91           2HD      PHE  91   9.062  -4.126  -5.006
  732    HE1  PHE  91           1HE      PHE  91   7.139  -0.572  -2.197
  733    HE2  PHE  91           2HE      PHE  91   8.680  -4.529  -2.609
  734    HZ   PHE  91           HZ       PHE  91   7.716  -2.753  -1.201
  735    H    SER  92           H        SER  92   9.040   0.983  -7.339
  736    HA   SER  92           HA       SER  92  10.809   2.301  -5.400
  737   1HB   SER  92          2HB       SER  92  10.422   4.341  -6.817
  738   2HB   SER  92          1HB       SER  92  11.232   3.020  -7.659
  739    HG   SER  92           HG       SER  92   9.528   2.749  -8.900
  740    H    VAL  93           H        VAL  93   9.681   2.467  -3.538
  741    HA   VAL  93           HA       VAL  93   6.950   3.218  -3.355
  742    HB   VAL  93           HB       VAL  93   7.727   3.934  -0.961
  743   1HG1  VAL  93          1HG2      VAL  93   6.387   1.961  -1.448
  744   2HG1  VAL  93          2HG2      VAL  93   7.611   1.595  -0.232
  745   3HG1  VAL  93          3HG2      VAL  93   7.839   1.069  -1.900
  746   1HG2  VAL  93          1HG1      VAL  93  10.088   2.318  -1.897
  747   2HG2  VAL  93          2HG1      VAL  93   9.764   2.799  -0.231
  748   3HG2  VAL  93          3HG1      VAL  93  10.100   4.026  -1.452
  749    H    LYS  94           H        LYS  94   9.797   4.971  -4.035
  750    HA   LYS  94           HA       LYS  94   9.284   7.503  -3.041
  751   1HB   LYS  94          2HB       LYS  94  11.345   6.907  -4.231
  752   2HB   LYS  94          1HB       LYS  94  10.447   6.775  -5.737
  753   1HG   LYS  94          1HG       LYS  94   9.911   9.155  -5.629
  754   2HG   LYS  94          2HG       LYS  94  10.812   9.287  -4.118
  755   1HD   LYS  94          1HD       LYS  94  12.855   8.604  -5.274
  756   2HD   LYS  94          2HD       LYS  94  11.954   8.460  -6.785
  757   1HE   LYS  94          2HE       LYS  94  13.171  10.572  -6.688
  758   2HE   LYS  94          1HE       LYS  94  11.429  10.842  -6.708
  759   1HZ   LYS  94          1HZ       LYS  94  11.490  11.168  -4.314
  760   2HZ   LYS  94          2HZ       LYS  94  12.519  12.261  -5.093
  761   3HZ   LYS  94          3HZ       LYS  94  13.164  10.914  -4.298
  762    H    GLU  95           H        GLU  95   7.918   5.877  -5.844
  763    HA   GLU  95           HA       GLU  95   6.055   8.121  -6.208
  764   1HB   GLU  95          2HB       GLU  95   5.441   6.817  -8.330
  765   2HB   GLU  95          1HB       GLU  95   7.008   7.613  -8.292
  766   1HG   GLU  95          1HG       GLU  95   8.088   5.501  -7.761
  767   2HG   GLU  95          2HG       GLU  95   6.524   4.691  -7.752
  768    H    HIS  96           H        HIS  96   4.801   7.604  -4.360
  769    HA   HIS  96           HA       HIS  96   3.853   5.020  -3.786
  770   1HB   HIS  96          1HB       HIS  96   2.772   7.709  -2.920
  771   2HB   HIS  96          2HB       HIS  96   2.304   6.163  -2.220
  772    HD1  HIS  96           1HD      HIS  96   5.028   8.691  -2.222
  773    HD2  HIS  96           2HD      HIS  96   4.256   4.958  -0.571
  774    HE1  HIS  96           1HE      HIS  96   6.778   8.367  -0.446
  775    HE2  HIS  96           2HE      HIS  96   6.347   6.064   0.476
  776    H    ARG  97           H        ARG  97   2.613   7.557  -5.823
  777    HA   ARG  97           HA       ARG  97  -0.056   6.799  -6.028
  778   1HB   ARG  97          1HB       ARG  97   1.752   7.979  -8.144
  779   2HB   ARG  97          2HB       ARG  97   0.000   7.890  -8.263
  780   1HG   ARG  97          2HG       ARG  97  -0.195   9.310  -6.272
  781   2HG   ARG  97          1HG       ARG  97   1.564   9.422  -6.195
  782   1HD   ARG  97          2HD       ARG  97   1.594  10.466  -8.407
  783   2HD   ARG  97          1HD       ARG  97  -0.163  10.352  -8.485
  784    HE   ARG  97           HE       ARG  97   0.636  11.755  -6.161
  785   1HH1  ARG  97          2HH1      ARG  97   0.355  12.105  -9.617
  786   2HH1  ARG  97          1HH1      ARG  97   0.144  13.824  -9.556
  787   1HH2  ARG  97          1HH2      ARG  97   0.359  14.017  -6.071
  788   2HH2  ARG  97          2HH2      ARG  97   0.148  14.909  -7.539
  789    H    LYS  98           H        LYS  98   2.593   5.920  -8.255
  790    HA   LYS  98           HA       LYS  98   0.972   4.055  -9.662
  791   1HB   LYS  98          1HB       LYS  98   2.859   5.242 -10.715
  792   2HB   LYS  98          2HB       LYS  98   3.978   4.370  -9.676
  793   1HG   LYS  98          1HG       LYS  98   3.309   2.264 -10.696
  794   2HG   LYS  98          2HG       LYS  98   2.156   3.119 -11.721
  795   1HD   LYS  98          2HD       LYS  98   5.085   3.783 -11.730
  796   2HD   LYS  98          1HD       LYS  98   4.415   2.506 -12.745
  797   1HE   LYS  98          1HE       LYS  98   4.530   4.500 -14.053
  798   2HE   LYS  98          2HE       LYS  98   2.834   4.184 -13.693
  799   1HZ   LYS  98          1HZ       LYS  98   3.484   6.535 -13.431
  800   2HZ   LYS  98          2HZ       LYS  98   4.531   6.091 -12.180
  801   3HZ   LYS  98          3HZ       LYS  98   2.864   5.859 -12.009
  802    H    ILE  99           H        ILE  99   3.328   3.781  -7.072
  803    HA   ILE  99           HA       ILE  99   3.848   1.045  -7.274
  804    HB   ILE  99           HB       ILE  99   5.039   2.829  -5.835
  805   1HG1  ILE  99          2HG1      ILE  99   5.429   0.275  -5.971
  806   2HG1  ILE  99          1HG1      ILE  99   6.116   1.157  -4.611
  807   1HG2  ILE  99          1HG2      ILE  99   3.273   3.611  -4.467
  808   2HG2  ILE  99          2HG2      ILE  99   4.389   2.722  -3.425
  809   3HG2  ILE  99          3HG2      ILE  99   2.874   1.976  -3.938
  810   1HD1  ILE  99          1HD1      ILE  99   3.577  -0.455  -4.562
  811   2HD1  ILE  99          2HD1      ILE  99   4.267   0.427  -3.200
  812   3HD1  ILE  99          3HD1      ILE  99   5.137  -0.941  -3.896
  813    H    TYR 100           H        TYR 100   1.239   2.761  -5.648
  814    HA   TYR 100           HA       TYR 100   0.222   0.313  -4.480
  815   1HB   TYR 100          2HB       TYR 100  -0.511   3.202  -4.311
  816   2HB   TYR 100          1HB       TYR 100  -1.717   1.995  -3.873
  817    HD1  TYR 100           1HD      TYR 100  -1.551   3.169  -1.597
  818    HD2  TYR 100           2HD      TYR 100   1.634   0.915  -3.297
  819    HE1  TYR 100           1HE      TYR 100  -0.531   2.939   0.630
  820    HE2  TYR 100           2HE      TYR 100   2.657   0.679  -1.084
  821    HH   TYR 100           HH       TYR 100   2.645   1.832   1.090
  822    H    THR 101           H        THR 101  -0.467   2.387  -7.224
  823    HA   THR 101           HA       THR 101  -2.998   1.290  -7.869
  824    HB   THR 101           HB       THR 101  -2.543   2.160 -10.180
  825    HG1  THR 101           1HG      THR 101  -0.511   2.460 -10.649
  826   1HG2  THR 101          1HG2      THR 101  -2.547   4.530  -9.523
  827   2HG2  THR 101          2HG2      THR 101  -2.048   4.070  -7.894
  828   3HG2  THR 101          3HG2      THR 101  -3.623   3.566  -8.510
  829    H    MET 102           H        MET 102   0.265   0.200  -8.386
  830    HA   MET 102           HA       MET 102  -0.479  -1.923 -10.189
  831   1HB   MET 102          1HB       MET 102   2.007  -1.716  -8.486
  832   2HB   MET 102          2HB       MET 102   1.775  -2.736  -9.900
  833   1HG   MET 102          2HG       MET 102   1.614  -0.760 -11.309
  834   2HG   MET 102          1HG       MET 102   1.811   0.265  -9.890
  835   1HE   MET 102          1HE       MET 102   3.945  -1.374  -8.222
  836   2HE   MET 102          2HE       MET 102   4.064   0.371  -8.438
  837   3HE   MET 102          3HE       MET 102   5.462  -0.656  -8.763
  838    H    ILE 103           H        ILE 103   0.282  -1.628  -6.735
  839    HA   ILE 103           HA       ILE 103   0.173  -4.291  -6.037
  840    HB   ILE 103           HB       ILE 103  -0.665  -1.880  -4.431
  841   1HG1  ILE 103          2HG1      ILE 103   1.842  -3.574  -4.378
  842   2HG1  ILE 103          1HG1      ILE 103   1.703  -1.992  -5.136
  843   1HG2  ILE 103          1HG2      ILE 103  -0.226  -4.707  -3.475
  844   2HG2  ILE 103          2HG2      ILE 103  -1.771  -3.858  -3.533
  845   3HG2  ILE 103          3HG2      ILE 103  -0.498  -3.301  -2.444
  846   1HD1  ILE 103          1HD1      ILE 103   2.786  -1.788  -3.003
  847   2HD1  ILE 103          2HD1      ILE 103   1.441  -2.603  -2.205
  848   3HD1  ILE 103          3HD1      ILE 103   1.202  -1.016  -2.935
  849    H    TYR 104           H        TYR 104  -2.477  -2.045  -6.582
  850    HA   TYR 104           HA       TYR 104  -4.409  -4.116  -5.816
  851   1HB   TYR 104          1HB       TYR 104  -4.706  -1.139  -6.224
  852   2HB   TYR 104          2HB       TYR 104  -6.074  -2.219  -5.968
  853    HD1  TYR 104           1HD      TYR 104  -6.635  -2.996  -3.797
  854    HD2  TYR 104           2HD      TYR 104  -3.010  -0.859  -4.416
  855    HE1  TYR 104           1HE      TYR 104  -6.346  -2.798  -1.365
  856    HE2  TYR 104           2HE      TYR 104  -2.708  -0.656  -1.984
  857    HH   TYR 104           HH       TYR 104  -4.076  -0.706   0.050
  858    H    ARG 105           H        ARG 105  -5.824  -4.995  -7.224
  859    HA   ARG 105           HA       ARG 105  -6.120  -3.811  -9.882
  860   1HB   ARG 105          1HB       ARG 105  -5.469  -6.723  -9.387
  861   2HB   ARG 105          2HB       ARG 105  -5.951  -6.052 -10.939
  862   1HG   ARG 105          2HG       ARG 105  -3.953  -4.603 -10.895
  863   2HG   ARG 105          1HG       ARG 105  -3.457  -5.382  -9.392
  864   1HD   ARG 105          2HD       ARG 105  -3.850  -6.738 -12.057
  865   2HD   ARG 105          1HD       ARG 105  -2.303  -6.358 -11.302
  866    HE   ARG 105           HE       ARG 105  -3.633  -7.893  -9.463
  867   1HH1  ARG 105          2HH1      ARG 105  -2.650  -8.281 -12.783
  868   2HH1  ARG 105          1HH1      ARG 105  -2.460  -9.998 -12.660
  869   1HH2  ARG 105          1HH2      ARG 105  -3.385 -10.153  -9.292
  870   2HH2  ARG 105          2HH2      ARG 105  -2.878 -11.062 -10.677
  871    H    ASN 106           H        ASN 106  -8.113  -4.195 -10.853
  872    HA   ASN 106           HA       ASN 106 -10.306  -4.467  -9.153
  873   1HB   ASN 106          2HB       ASN 106 -10.207  -4.856 -12.153
  874   2HB   ASN 106          1HB       ASN 106 -11.665  -4.583 -11.207
  875   1HD2  ASN 106          2HD2      ASN 106 -10.341  -2.682  -9.428
  876   2HD2  ASN 106          1HD2      ASN 106 -10.171  -1.222 -10.336
  877    H    LEU 107           H        LEU 107 -10.450  -6.299  -7.956
  878    HA   LEU 107           HA       LEU 107 -11.089  -8.762  -9.369
  879   1HB   LEU 107          2HB       LEU 107  -8.674  -8.896  -9.023
  880   2HB   LEU 107          1HB       LEU 107  -8.887  -8.590  -7.310
  881    HG   LEU 107           HG       LEU 107 -10.100 -10.726  -7.087
  882   1HD1  LEU 107          1HD2      LEU 107 -11.019 -10.882  -9.332
  883   2HD1  LEU 107          2HD2      LEU 107 -10.081 -12.325  -8.942
  884   3HD1  LEU 107          3HD2      LEU 107  -9.398 -11.089  -9.997
  885   1HD2  LEU 107          1HD1      LEU 107  -8.173 -12.196  -7.394
  886   2HD2  LEU 107          2HD1      LEU 107  -7.698 -10.651  -6.689
  887   3HD2  LEU 107          3HD1      LEU 107  -7.395 -10.971  -8.396
  888    H    VAL 108           H        VAL 108 -10.307  -7.775  -6.027
  889    HA   VAL 108           HA       VAL 108 -12.826  -9.027  -5.169
  890    HB   VAL 108           HB       VAL 108 -10.370  -8.369  -3.535
  891   1HG1  VAL 108          1HG2      VAL 108 -12.903  -9.815  -2.765
  892   2HG1  VAL 108          2HG2      VAL 108 -12.397  -8.225  -2.199
  893   3HG1  VAL 108          3HG2      VAL 108 -11.467  -9.656  -1.756
  894   1HG2  VAL 108          1HG1      VAL 108 -11.436 -11.018  -4.507
  895   2HG2  VAL 108          2HG1      VAL 108 -10.061 -10.799  -3.424
  896   3HG2  VAL 108          3HG1      VAL 108  -9.981 -10.205  -5.084
  897    H    VAL 109           H        VAL 109 -10.775  -6.490  -3.759
  898    HA   VAL 109           HA       VAL 109 -11.350  -4.639  -2.548
  899    HB   VAL 109           HB       VAL 109 -12.363  -2.883  -3.831
  900   1HG1  VAL 109          1HG1      VAL 109 -10.103  -3.514  -4.455
  901   2HG1  VAL 109          2HG1      VAL 109 -11.004  -2.967  -5.869
  902   3HG1  VAL 109          3HG1      VAL 109 -10.732  -4.690  -5.609
  903   1HG2  VAL 109          1HG2      VAL 109 -13.441  -3.275  -5.993
  904   2HG2  VAL 109          2HG2      VAL 109 -14.313  -4.064  -4.679
  905   3HG2  VAL 109          3HG2      VAL 109 -13.285  -5.016  -5.751
  906    H    VAL 110           H        VAL 110 -13.683  -3.047  -2.576
  907    HA   VAL 110           HA       VAL 110 -15.229  -4.191  -0.584
  908    HB   VAL 110           HB       VAL 110 -15.248  -1.794  -1.034
  909   1HG1  VAL 110          1HG1      VAL 110 -15.172  -1.868  -3.460
  910   2HG1  VAL 110          2HG1      VAL 110 -16.529  -0.884  -2.912
  911   3HG1  VAL 110          3HG1      VAL 110 -16.808  -2.521  -3.506
  912   1HG2  VAL 110          1HG2      VAL 110 -17.107  -2.747   0.219
  913   2HG2  VAL 110          2HG2      VAL 110 -17.982  -3.045  -1.283
  914   3HG2  VAL 110          3HG2      VAL 110 -17.650  -1.390  -0.769
  915    H    ASN 111           H        ASN 111 -17.106  -5.354  -0.508
  916    HA   ASN 111           HA       ASN 111 -17.783  -6.786  -2.955
  917   1HB   ASN 111          1HB       ASN 111 -17.335  -8.104  -0.940
  918   2HB   ASN 111          2HB       ASN 111 -18.629  -7.265  -0.089
  919   1HD2  ASN 111          2HD2      ASN 111 -17.845  -9.617  -2.514
  920   2HD2  ASN 111          1HD2      ASN 111 -19.427 -10.295  -2.661
  921    H    GLN 112           H        GLN 112 -19.768  -6.782  -3.916
  922    HA   GLN 112           HA       GLN 112 -21.999  -5.393  -2.696
  923   1HB   GLN 112          2HB       GLN 112 -22.309  -3.864  -4.609
  924   2HB   GLN 112          1HB       GLN 112 -20.820  -3.540  -3.732
  925   1HG   GLN 112          1HG       GLN 112 -19.550  -4.734  -5.440
  926   2HG   GLN 112          2HG       GLN 112 -21.042  -5.064  -6.319
  927   1HE2  GLN 112          2HE2      GLN 112 -20.340  -3.975  -8.146
  928   2HE2  GLN 112          1HE2      GLN 112 -20.226  -2.253  -8.211
  929    H    GLN 113           H        GLN 113 -21.127  -8.066  -3.879
  930    HA   GLN 113           HA       GLN 113 -23.162  -8.371  -5.967
  931   1HB   GLN 113          1HB       GLN 113 -20.906  -9.198  -6.482
  932   2HB   GLN 113          2HB       GLN 113 -20.973 -10.263  -5.085
  933   1HG   GLN 113          2HG       GLN 113 -22.838 -11.473  -6.094
  934   2HG   GLN 113          1HG       GLN 113 -22.771 -10.406  -7.496
  935   1HE2  GLN 113          2HE2      GLN 113 -22.437 -13.301  -7.322
  936   2HE2  GLN 113          1HE2      GLN 113 -20.882 -13.643  -7.993
  937    H    GLU 114           H        GLU 114 -22.325  -9.369  -2.731
  938    HA   GLU 114           HA       GLU 114 -24.108 -11.539  -2.487
  939   1HB   GLU 114          2HB       GLU 114 -22.268 -11.146  -0.913
  940   2HB   GLU 114          1HB       GLU 114 -23.055  -9.676  -0.351
  941   1HG   GLU 114          1HG       GLU 114 -24.932 -10.997   0.480
  942   2HG   GLU 114          2HG       GLU 114 -24.145 -12.470  -0.083
  943    H    SER 115           H        SER 115 -26.245 -11.626  -2.245
  944    HA   SER 115           HA       SER 115 -27.730  -9.518  -0.975
  945   1HB   SER 115          1HB       SER 115 -27.519  -8.571  -3.226
  946   2HB   SER 115          2HB       SER 115 -28.166 -10.055  -3.924
  947    HG   SER 115           HG       SER 115 -29.986  -9.467  -2.290
  948    H    SER 116           H        SER 116 -28.042 -11.465   0.333
  949    HA   SER 116           HA       SER 116 -29.330 -13.163   1.120
  950   1HB   SER 116          1HB       SER 116 -31.185 -11.639   0.589
  951   2HB   SER 116          2HB       SER 116 -31.242 -12.277  -1.056
  952    HG   SER 116           HG       SER 116 -31.699 -13.754   1.327
  953    H    ASP 117           H        ASP 117 -30.571 -15.234   0.368
  954    HA   ASP 117           HA       ASP 117 -29.683 -16.299  -2.168
  955   1HB   ASP 117          2HB       ASP 117 -27.707 -16.682  -0.775
  956   2HB   ASP 117          1HB       ASP 117 -28.698 -17.494   0.431
  957    H    SER 118           H        SER 118 -31.657 -16.929  -2.816
  958    HA   SER 118           HA       SER 118 -32.930 -19.100  -1.373
  959   1HB   SER 118          1HB       SER 118 -33.998 -17.129  -0.380
  960   2HB   SER 118          2HB       SER 118 -34.414 -16.531  -1.986
  961    HG   SER 118           HG       SER 118 -35.302 -19.029  -1.757
  962    H    SER 119           H        SER 119 -32.527 -17.132  -4.196
  963    HA   SER 119           HA       SER 119 -34.247 -18.856  -5.803
  964   1HB   SER 119          2HB       SER 119 -32.678 -16.381  -6.567
  965   2HB   SER 119          1HB       SER 119 -33.791 -17.251  -7.623
  966    HG   SER 119           HG       SER 119 -34.479 -15.299  -6.197
  Start of MODEL   14
    1   1H    MET   1          1H        MET   1  30.445  17.258   6.827
    2   2H    MET   1          2H        MET   1  29.718  18.104   5.556
    3   3H    MET   1          3H        MET   1  30.160  16.484   5.349
    4    HA   MET   1           HA       MET   1  27.783  16.692   5.656
    5   1HB   MET   1          2HB       MET   1  28.945  14.674   6.456
    6   2HB   MET   1          1HB       MET   1  29.203  15.439   8.016
    7   1HG   MET   1          2HG       MET   1  27.359  13.876   8.112
    8   2HG   MET   1          1HG       MET   1  26.797  15.524   8.386
    9   1HE   MET   1          1HE       MET   1  24.850  13.085   7.691
   10   2HE   MET   1          2HE       MET   1  23.766  13.861   6.538
   11   3HE   MET   1          3HE       MET   1  24.296  14.733   7.977
   12    H    CYS   2           H        CYS   2  26.993  18.767   6.008
   13    HA   CYS   2           HA       CYS   2  26.135  19.289   8.696
   14   1HB   CYS   2          1HB       CYS   2  28.365  20.296   8.785
   15   2HB   CYS   2          2HB       CYS   2  28.004  21.253   7.352
   16    HG   CYS   2           HG       CYS   2  27.969  22.706   9.884
   17    H    ASN   3           H        ASN   3  26.669  21.216   5.738
   18    HA   ASN   3           HA       ASN   3  23.815  21.919   5.792
   19   1HB   ASN   3          1HB       ASN   3  24.490  23.811   4.297
   20   2HB   ASN   3          2HB       ASN   3  25.230  23.863   5.894
   21   1HD2  ASN   3          1HD2      ASN   3  26.928  25.132   5.206
   22   2HD2  ASN   3          2HD2      ASN   3  28.200  24.520   4.209
   23    H    THR   4           H        THR   4  25.569  19.619   4.477
   24    HA   THR   4           HA       THR   4  24.750  19.885   1.706
   25    HB   THR   4           HB       THR   4  25.866  17.715   1.372
   26    HG1  THR   4           1HG      THR   4  25.384  16.988   3.601
   27   1HG2  THR   4          1HG2      THR   4  27.192  19.765   1.231
   28   2HG2  THR   4          2HG2      THR   4  28.152  18.441   1.894
   29   3HG2  THR   4          3HG2      THR   4  27.510  19.688   2.965
   30    H    ASN   5           H        ASN   5  23.615  18.428   4.611
   31    HA   ASN   5           HA       ASN   5  21.758  16.691   3.158
   32   1HB   ASN   5          1HB       ASN   5  22.971  15.691   5.041
   33   2HB   ASN   5          2HB       ASN   5  22.318  16.919   6.123
   34   1HD2  ASN   5          1HD2      ASN   5  21.629  14.065   4.273
   35   2HD2  ASN   5          2HD2      ASN   5  20.103  13.712   5.005
   36    H    MET   6           H        MET   6  20.151  17.968   2.381
   37    HA   MET   6           HA       MET   6  18.927  19.983   4.078
   38   1HB   MET   6          1HB       MET   6  19.331  20.483   1.708
   39   2HB   MET   6          2HB       MET   6  18.289  19.144   1.244
   40   1HG   MET   6          2HG       MET   6  16.385  20.261   2.287
   41   2HG   MET   6          1HG       MET   6  17.430  21.604   2.752
   42   1HE   MET   6          1HE       MET   6  16.456  20.512  -1.627
   43   2HE   MET   6          2HE       MET   6  15.789  19.655  -0.237
   44   3HE   MET   6          3HE       MET   6  17.511  19.543  -0.597
   45    H    SER   7           H        SER   7  17.414  19.414   5.483
   46    HA   SER   7           HA       SER   7  15.714  17.093   4.893
   47   1HB   SER   7          2HB       SER   7  16.225  18.515   7.517
   48   2HB   SER   7          1HB       SER   7  15.199  17.096   7.310
   49    HG   SER   7           HG       SER   7  17.997  17.314   7.098
   50    H    VAL   8           H        VAL   8  13.767  17.504   4.106
   51    HA   VAL   8           HA       VAL   8  12.550  20.124   4.554
   52    HB   VAL   8           HB       VAL   8  12.623  19.381   2.247
   53   1HG1  VAL   8          1HG2      VAL   8  12.678  16.977   2.606
   54   2HG1  VAL   8          2HG2      VAL   8  11.382  17.407   1.491
   55   3HG1  VAL   8          3HG2      VAL   8  11.005  17.008   3.168
   56   1HG2  VAL   8          1HG1      VAL   8   9.824  19.300   3.364
   57   2HG2  VAL   8          2HG1      VAL   8  10.244  19.579   1.675
   58   3HG2  VAL   8          3HG1      VAL   8  10.730  20.744   2.908
   59    HA   PRO   9           HA       PRO   9  10.069  18.442   7.811
   60   1HB   PRO   9          2HB       PRO   9   8.356  20.804   7.390
   61   2HB   PRO   9          1HB       PRO   9   9.270  20.320   8.820
   62   1HG   PRO   9          1HG       PRO   9  10.031  22.400   7.308
   63   2HG   PRO   9          2HG       PRO   9  11.215  21.326   8.078
   64   1HD   PRO   9          2HD       PRO   9  10.282  21.388   5.232
   65   2HD   PRO   9          1HD       PRO   9  11.923  21.164   5.876
   66    H    THR  10           H        THR  10   8.371  19.894   5.033
   67    HA   THR  10           HA       THR  10   6.176  17.986   5.444
   68    HB   THR  10           HB       THR  10   5.441  20.291   5.391
   69    HG1  THR  10           1HG      THR  10   4.053  18.793   4.384
   70   1HG2  THR  10          1HG2      THR  10   5.737  21.690   3.398
   71   2HG2  THR  10          2HG2      THR  10   6.723  20.428   2.659
   72   3HG2  THR  10          3HG2      THR  10   7.290  21.252   4.111
   73    H    ASP  11           H        ASP  11   5.463  16.640   3.820
   74    HA   ASP  11           HA       ASP  11   7.014  16.617   1.322
   75   1HB   ASP  11          2HB       ASP  11   6.334  14.188   2.996
   76   2HB   ASP  11          1HB       ASP  11   7.110  14.154   1.415
   77    H    GLY  12           H        GLY  12   4.281  17.535   2.091
   78   1HA   GLY  12          2HA       GLY  12   2.876  16.872  -0.181
   79   2HA   GLY  12          1HA       GLY  12   2.406  15.669   1.010
   80    H    ALA  13           H        ALA  13   0.575  16.140   2.002
   81    HA   ALA  13           HA       ALA  13  -0.384  18.882   2.067
   82   1HB   ALA  13          1HB       ALA  13  -1.910  17.091   1.395
   83   2HB   ALA  13          2HB       ALA  13  -2.486  17.922   2.841
   84   3HB   ALA  13          3HB       ALA  13  -1.723  16.337   2.979
   85    H    VAL  14           H        VAL  14  -1.807  19.189   4.263
   86    HA   VAL  14           HA       VAL  14   0.090  19.790   6.250
   87    HB   VAL  14           HB       VAL  14  -2.907  19.568   6.585
   88   1HG1  VAL  14          1HG1      VAL  14  -0.834  21.074   8.177
   89   2HG1  VAL  14          2HG1      VAL  14  -1.734  19.654   8.709
   90   3HG1  VAL  14          3HG1      VAL  14  -2.579  21.173   8.416
   91   1HG2  VAL  14          1HG2      VAL  14  -2.946  21.974   6.118
   92   2HG2  VAL  14          2HG2      VAL  14  -2.344  21.051   4.741
   93   3HG2  VAL  14          3HG2      VAL  14  -1.217  21.931   5.775
   94    H    THR  15           H        THR  15  -2.679  17.561   6.597
   95    HA   THR  15           HA       THR  15  -0.972  15.605   7.909
   96    HB   THR  15           HB       THR  15  -3.357  16.790   9.344
   97    HG1  THR  15           1HG      THR  15  -0.653  16.876  10.195
   98   1HG2  THR  15          1HG2      THR  15  -1.384  14.665  10.194
   99   2HG2  THR  15          2HG2      THR  15  -3.081  14.405   9.788
  100   3HG2  THR  15          3HG2      THR  15  -2.651  15.357  11.210
  101    H    THR  16           H        THR  16  -1.485  14.178   6.261
  102    HA   THR  16           HA       THR  16  -4.017  12.823   6.598
  103    HB   THR  16           HB       THR  16  -3.252  13.900   3.876
  104    HG1  THR  16           1HG      THR  16  -4.443  15.543   4.453
  105   1HG2  THR  16          1HG2      THR  16  -5.625  12.251   4.756
  106   2HG2  THR  16          2HG2      THR  16  -4.292  11.695   3.744
  107   3HG2  THR  16          3HG2      THR  16  -5.394  12.938   3.148
  108    H    SER  17           H        SER  17  -1.761  12.806   3.863
  109    HA   SER  17           HA       SER  17  -0.182  10.657   4.809
  110   1HB   SER  17          1HB       SER  17  -2.205   9.340   4.388
  111   2HB   SER  17          2HB       SER  17  -2.271   9.946   2.733
  112    HG   SER  17           HG       SER  17  -1.066   7.806   3.507
  113    H    GLN  18           H        GLN  18  -1.324  10.860   1.483
  114    HA   GLN  18           HA       GLN  18   0.510  12.794   0.572
  115   1HB   GLN  18          1HB       GLN  18   1.936  11.251  -0.786
  116   2HB   GLN  18          2HB       GLN  18   2.245  11.177   0.947
  117   1HG   GLN  18          1HG       GLN  18   0.764   9.167   1.023
  118   2HG   GLN  18          2HG       GLN  18   0.735   9.214  -0.742
  119   1HE2  GLN  18          2HE2      GLN  18   2.643   8.576   2.085
  120   2HE2  GLN  18          1HE2      GLN  18   3.967   7.818   1.275
  121    H    ILE  19           H        ILE  19  -1.401   9.912  -0.141
  122    HA   ILE  19           HA       ILE  19  -1.234  10.667  -2.958
  123    HB   ILE  19           HB       ILE  19   0.375   8.947  -2.395
  124   1HG1  ILE  19          2HG1      ILE  19  -0.298   7.210  -4.033
  125   2HG1  ILE  19          1HG1      ILE  19  -1.930   7.868  -4.037
  126   1HG2  ILE  19          1HG2      ILE  19  -2.040   7.499  -1.364
  127   2HG2  ILE  19          2HG2      ILE  19  -0.577   7.966  -0.491
  128   3HG2  ILE  19          3HG2      ILE  19  -0.506   6.687  -1.713
  129   1HD1  ILE  19          1HD1      ILE  19   0.555   9.310  -4.927
  130   2HD1  ILE  19          2HD1      ILE  19  -1.080   9.973  -4.929
  131   3HD1  ILE  19          3HD1      ILE  19  -0.680   8.610  -5.975
  132    HA   PRO  20           HA       PRO  20  -5.756   9.508  -1.565
  133   1HB   PRO  20          2HB       PRO  20  -6.681  11.978  -2.473
  134   2HB   PRO  20          1HB       PRO  20  -6.445  11.525  -0.782
  135   1HG   PRO  20          2HG       PRO  20  -4.642  13.062  -2.605
  136   2HG   PRO  20          1HG       PRO  20  -4.982  13.319  -0.883
  137   1HD   PRO  20          2HD       PRO  20  -2.707  12.157  -1.656
  138   2HD   PRO  20          1HD       PRO  20  -3.578  11.576  -0.223
  139    H    ALA  21           H        ALA  21  -5.531   8.048  -3.356
  140    HA   ALA  21           HA       ALA  21  -5.845   8.984  -6.039
  141   1HB   ALA  21          1HB       ALA  21  -4.843   6.801  -5.569
  142   2HB   ALA  21          2HB       ALA  21  -6.261   6.647  -6.606
  143   3HB   ALA  21          3HB       ALA  21  -6.374   6.248  -4.892
  144    H    SER  22           H        SER  22  -7.850   8.677  -3.393
  145    HA   SER  22           HA       SER  22 -10.031   9.792  -4.883
  146   1HB   SER  22          2HB       SER  22 -10.415   7.129  -3.487
  147   2HB   SER  22          1HB       SER  22 -11.718   8.134  -4.125
  148    HG   SER  22           HG       SER  22 -11.336   6.838  -5.786
  149    H    GLU  23           H        GLU  23  -8.106  10.015  -2.459
  150    HA   GLU  23           HA       GLU  23  -8.087  10.722  -0.298
  151   1HB   GLU  23          1HB       GLU  23  -9.174  12.661  -1.418
  152   2HB   GLU  23          2HB       GLU  23 -10.742  11.962  -1.041
  153   1HG   GLU  23          1HG       GLU  23 -10.191  13.698   0.542
  154   2HG   GLU  23          2HG       GLU  23 -10.240  12.129   1.347
  155    H    GLN  24           H        GLN  24  -8.341   8.485   0.401
  156    HA   GLN  24           HA       GLN  24  -9.321   6.734   1.465
  157   1HB   GLN  24          2HB       GLN  24 -10.996   9.025   2.420
  158   2HB   GLN  24          1HB       GLN  24 -11.403   7.379   2.883
  159   1HG   GLN  24          2HG       GLN  24 -10.084   8.429   4.605
  160   2HG   GLN  24          1HG       GLN  24  -9.168   7.119   3.860
  161   1HE2  GLN  24          1HE2      GLN  24  -7.398   7.606   2.562
  162   2HE2  GLN  24          2HE2      GLN  24  -6.641   9.158   2.586
  163    H    GLU  25           H        GLU  25 -10.460   5.108   0.576
  164    HA   GLU  25           HA       GLU  25 -12.556   5.832  -1.352
  165   1HB   GLU  25          1HB       GLU  25 -11.320   4.365  -3.015
  166   2HB   GLU  25          2HB       GLU  25 -10.595   5.928  -2.662
  167   1HG   GLU  25          2HG       GLU  25  -8.971   4.914  -1.217
  168   2HG   GLU  25          1HG       GLU  25  -9.757   3.341  -1.364
  169    H    THR  26           H        THR  26 -10.854   3.186   0.328
  170    HA   THR  26           HA       THR  26 -12.859   1.317  -0.731
  171    HB   THR  26           HB       THR  26  -9.869   0.997  -0.985
  172    HG1  THR  26           1HG      THR  26 -11.256   1.029  -3.312
  173   1HG2  THR  26          1HG2      THR  26 -10.429  -0.962  -2.351
  174   2HG2  THR  26          2HG2      THR  26 -12.144  -0.699  -2.034
  175   3HG2  THR  26          3HG2      THR  26 -11.060  -1.131  -0.712
  176    H    LEU  27           H        LEU  27 -13.665   0.241   0.984
  177    HA   LEU  27           HA       LEU  27 -11.964  -0.642   3.135
  178   1HB   LEU  27          1HB       LEU  27 -14.678  -0.343   2.898
  179   2HB   LEU  27          2HB       LEU  27 -14.490  -2.079   2.723
  180    HG   LEU  27           HG       LEU  27 -14.836  -1.773   5.020
  181   1HD1  LEU  27          1HD1      LEU  27 -12.920  -3.214   4.601
  182   2HD1  LEU  27          2HD1      LEU  27 -12.677  -2.285   6.082
  183   3HD1  LEU  27          3HD1      LEU  27 -11.848  -1.809   4.597
  184   1HD2  LEU  27          1HD2      LEU  27 -12.891   0.523   4.870
  185   2HD2  LEU  27          2HD2      LEU  27 -13.652  -0.074   6.347
  186   3HD2  LEU  27          3HD2      LEU  27 -14.640   0.643   5.074
  187    H    VAL  28           H        VAL  28 -10.338  -1.638   1.899
  188    HA   VAL  28           HA       VAL  28 -11.146  -3.494  -0.172
  189    HB   VAL  28           HB       VAL  28  -9.448  -2.199  -1.007
  190   1HG1  VAL  28          1HG1      VAL  28  -8.207  -2.335   1.726
  191   2HG1  VAL  28          2HG1      VAL  28  -8.948  -0.933   0.937
  192   3HG1  VAL  28          3HG1      VAL  28  -7.422  -1.587   0.332
  193   1HG2  VAL  28          1HG2      VAL  28  -8.798  -4.519  -1.313
  194   2HG2  VAL  28          2HG2      VAL  28  -7.964  -4.511   0.242
  195   3HG2  VAL  28          3HG2      VAL  28  -7.368  -3.512  -1.084
  196    H    ARG  29           H        ARG  29 -10.776  -5.640  -0.224
  197    HA   ARG  29           HA       ARG  29  -9.712  -6.863   2.213
  198   1HB   ARG  29          1HB       ARG  29 -12.305  -7.787   0.987
  199   2HB   ARG  29          2HB       ARG  29 -11.656  -8.158   2.580
  200   1HG   ARG  29          2HG       ARG  29 -12.056  -5.880   3.306
  201   2HG   ARG  29          1HG       ARG  29 -12.629  -5.442   1.693
  202   1HD   ARG  29          2HD       ARG  29 -14.467  -7.046   1.918
  203   2HD   ARG  29          1HD       ARG  29 -13.895  -7.477   3.529
  204    HE   ARG  29           HE       ARG  29 -14.330  -4.701   3.401
  205   1HH1  ARG  29          2HH1      ARG  29 -16.088  -7.709   3.448
  206   2HH1  ARG  29          1HH1      ARG  29 -17.499  -7.022   4.181
  207   1HH2  ARG  29          1HH2      ARG  29 -16.183  -3.788   4.369
  208   2HH2  ARG  29          2HH2      ARG  29 -17.553  -4.794   4.705
  209    HA   PRO  30           HA       PRO  30  -8.410  -8.720  -1.811
  210   1HB   PRO  30          2HB       PRO  30  -5.750  -8.667  -1.465
  211   2HB   PRO  30          1HB       PRO  30  -6.662  -7.209  -1.876
  212   1HG   PRO  30          2HG       PRO  30  -5.625  -8.112   0.783
  213   2HG   PRO  30          1HG       PRO  30  -5.609  -6.490   0.069
  214   1HD   PRO  30          2HD       PRO  30  -7.456  -7.338   1.916
  215   2HD   PRO  30          1HD       PRO  30  -7.755  -6.048   0.734
  216    H    LYS  31           H        LYS  31  -7.599 -10.752  -2.414
  217    HA   LYS  31           HA       LYS  31  -7.706 -12.896  -0.626
  218   1HB   LYS  31          1HB       LYS  31  -6.590 -14.192  -2.397
  219   2HB   LYS  31          2HB       LYS  31  -7.888 -13.196  -3.041
  220   1HG   LYS  31          2HG       LYS  31  -6.226 -11.539  -3.774
  221   2HG   LYS  31          1HG       LYS  31  -4.941 -12.590  -3.177
  222   1HD   LYS  31          2HD       LYS  31  -6.958 -13.536  -5.192
  223   2HD   LYS  31          1HD       LYS  31  -5.485 -12.693  -5.673
  224   1HE   LYS  31          2HE       LYS  31  -5.062 -15.036  -5.818
  225   2HE   LYS  31          1HE       LYS  31  -4.180 -14.415  -4.425
  226   1HZ   LYS  31          1HZ       LYS  31  -5.336 -16.532  -3.995
  227   2HZ   LYS  31          2HZ       LYS  31  -6.819 -15.764  -4.266
  228   3HZ   LYS  31          3HZ       LYS  31  -5.845 -15.289  -2.969
  229    HA   PRO  32           HA       PRO  32  -4.072 -12.984   1.782
  230   1HB   PRO  32          1HB       PRO  32  -3.482 -15.696   0.695
  231   2HB   PRO  32          2HB       PRO  32  -3.612 -15.159   2.373
  232   1HG   PRO  32          1HG       PRO  32  -5.575 -16.557   1.249
  233   2HG   PRO  32          2HG       PRO  32  -5.934 -15.212   2.348
  234   1HD   PRO  32          2HD       PRO  32  -6.107 -15.327  -0.631
  235   2HD   PRO  32          1HD       PRO  32  -7.152 -14.484   0.529
  236    H    LEU  33           H        LEU  33  -3.067 -11.379   0.365
  237    HA   LEU  33           HA       LEU  33  -0.562 -12.401  -0.684
  238   1HB   LEU  33          1HB       LEU  33  -2.489 -10.778  -2.344
  239   2HB   LEU  33          2HB       LEU  33  -0.793 -10.963  -2.743
  240    HG   LEU  33           HG       LEU  33  -2.763 -13.243  -2.539
  241   1HD1  LEU  33          1HD1      LEU  33  -2.644 -13.310  -4.978
  242   2HD1  LEU  33          2HD1      LEU  33  -1.630 -11.865  -4.970
  243   3HD1  LEU  33          3HD1      LEU  33  -3.300 -11.774  -4.408
  244   1HD2  LEU  33          1HD2      LEU  33  -0.994 -14.541  -3.621
  245   2HD2  LEU  33          2HD2      LEU  33  -0.470 -13.908  -2.061
  246   3HD2  LEU  33          3HD2      LEU  33   0.076 -13.140  -3.551
  247    H    LEU  34           H        LEU  34  -2.596  -9.754   0.319
  248    HA   LEU  34           HA       LEU  34  -0.256  -8.030   0.689
  249   1HB   LEU  34          1HB       LEU  34  -3.221  -7.555   0.731
  250   2HB   LEU  34          2HB       LEU  34  -2.130  -6.415   1.492
  251    HG   LEU  34           HG       LEU  34  -2.724  -5.666  -0.737
  252   1HD1  LEU  34          1HD2      LEU  34  -0.552  -5.027  -0.002
  253   2HD1  LEU  34          2HD2      LEU  34  -0.420  -5.496  -1.697
  254   3HD1  LEU  34          3HD2      LEU  34   0.121  -6.600  -0.430
  255   1HD2  LEU  34          1HD1      LEU  34  -1.527  -8.263  -1.689
  256   2HD2  LEU  34          2HD1      LEU  34  -2.051  -6.932  -2.721
  257   3HD2  LEU  34          3HD1      LEU  34  -3.230  -7.814  -1.753
  258    H    LEU  35           H        LEU  35  -2.440 -10.093   2.335
  259    HA   LEU  35           HA       LEU  35  -2.084  -8.650   4.850
  260   1HB   LEU  35          2HB       LEU  35  -4.054 -10.828   4.738
  261   2HB   LEU  35          1HB       LEU  35  -4.207  -9.206   5.383
  262    HG   LEU  35           HG       LEU  35  -4.208  -8.541   2.826
  263   1HD1  LEU  35          1HD2      LEU  35  -5.395 -10.245   1.492
  264   2HD1  LEU  35          2HD2      LEU  35  -5.170 -11.395   2.810
  265   3HD1  LEU  35          3HD2      LEU  35  -3.768 -10.746   1.955
  266   1HD2  LEU  35          1HD1      LEU  35  -6.012  -8.048   4.345
  267   2HD2  LEU  35          2HD1      LEU  35  -6.569  -9.721   4.280
  268   3HD2  LEU  35          3HD1      LEU  35  -6.667  -8.699   2.845
  269    H    LYS  36           H        LYS  36  -1.613 -11.799   3.360
  270    HA   LYS  36           HA       LYS  36  -0.251 -12.961   5.571
  271   1HB   LYS  36          1HB       LYS  36  -0.865 -14.120   3.404
  272   2HB   LYS  36          2HB       LYS  36   0.457 -13.247   2.646
  273   1HG   LYS  36          1HG       LYS  36   1.193 -15.459   3.198
  274   2HG   LYS  36          2HG       LYS  36   2.022 -14.302   4.241
  275   1HD   LYS  36          2HD       LYS  36   0.425 -14.795   6.041
  276   2HD   LYS  36          1HD       LYS  36  -0.379 -15.970   4.996
  277   1HE   LYS  36          1HE       LYS  36   2.482 -16.094   5.949
  278   2HE   LYS  36          2HE       LYS  36   1.143 -17.075   6.547
  279   1HZ   LYS  36          1HZ       LYS  36   0.916 -18.044   4.344
  280   2HZ   LYS  36          2HZ       LYS  36   2.479 -18.289   4.947
  281   3HZ   LYS  36          3HZ       LYS  36   2.202 -17.105   3.771
  282    H    LEU  37           H        LEU  37   0.238 -10.209   3.736
  283    HA   LEU  37           HA       LEU  37   3.130 -10.122   4.211
  284   1HB   LEU  37          2HB       LEU  37   2.385  -9.730   1.918
  285   2HB   LEU  37          1HB       LEU  37   1.330  -8.438   2.459
  286    HG   LEU  37           HG       LEU  37   4.227  -8.163   3.059
  287   1HD1  LEU  37          1HD2      LEU  37   3.076  -7.690   0.314
  288   2HD1  LEU  37          2HD2      LEU  37   4.193  -8.986   0.740
  289   3HD1  LEU  37          3HD2      LEU  37   4.711  -7.303   0.850
  290   1HD2  LEU  37          1HD1      LEU  37   2.657  -6.483   3.808
  291   2HD2  LEU  37          2HD1      LEU  37   2.044  -6.290   2.165
  292   3HD2  LEU  37          3HD1      LEU  37   3.699  -5.815   2.548
  293    H    LEU  38           H        LEU  38   0.151  -8.883   5.346
  294    HA   LEU  38           HA       LEU  38   1.492  -6.578   6.593
  295   1HB   LEU  38          1HB       LEU  38  -1.351  -6.957   5.697
  296   2HB   LEU  38          2HB       LEU  38  -0.863  -5.642   6.749
  297    HG   LEU  38           HG       LEU  38   0.156  -6.131   3.948
  298   1HD1  LEU  38          1HD2      LEU  38  -1.138  -4.236   3.301
  299   2HD1  LEU  38          2HD2      LEU  38  -1.617  -3.926   4.970
  300   3HD1  LEU  38          3HD2      LEU  38  -2.209  -5.364   4.134
  301   1HD2  LEU  38          1HD1      LEU  38   1.847  -5.118   5.369
  302   2HD2  LEU  38          2HD1      LEU  38   0.699  -3.877   5.869
  303   3HD2  LEU  38          3HD1      LEU  38   1.235  -3.956   4.191
  304    H    LYS  39           H        LYS  39  -0.988  -9.064   7.155
  305    HA   LYS  39           HA       LYS  39  -1.378  -8.553   9.887
  306   1HB   LYS  39          2HB       LYS  39  -1.561 -11.177   8.395
  307   2HB   LYS  39          1HB       LYS  39  -2.180 -10.894  10.015
  308   1HG   LYS  39          2HG       LYS  39  -3.704  -9.185   9.113
  309   2HG   LYS  39          1HG       LYS  39  -3.114  -9.544   7.490
  310   1HD   LYS  39          2HD       LYS  39  -4.422 -11.548   9.326
  311   2HD   LYS  39          1HD       LYS  39  -5.249 -10.679   8.032
  312   1HE   LYS  39          2HE       LYS  39  -3.759 -11.681   6.387
  313   2HE   LYS  39          1HE       LYS  39  -2.891 -12.523   7.670
  314   1HZ   LYS  39          1HZ       LYS  39  -5.748 -12.922   6.961
  315   2HZ   LYS  39          2HZ       LYS  39  -4.923 -13.725   8.199
  316   3HZ   LYS  39          3HZ       LYS  39  -4.479 -13.977   6.587
  317    H    SER  40           H        SER  40   1.362  -9.611   8.269
  318    HA   SER  40           HA       SER  40   2.463 -11.102  10.509
  319   1HB   SER  40          1HB       SER  40   3.711 -10.293   7.872
  320   2HB   SER  40          2HB       SER  40   4.454 -11.352   9.069
  321    HG   SER  40           HG       SER  40   3.485 -12.817   7.881
  322    H    VAL  41           H        VAL  41   2.860  -7.959   8.940
  323    HA   VAL  41           HA       VAL  41   5.160  -7.253  10.490
  324    HB   VAL  41           HB       VAL  41   5.137  -6.191   8.420
  325   1HG1  VAL  41          1HG1      VAL  41   3.217  -4.894   7.553
  326   2HG1  VAL  41          2HG1      VAL  41   2.268  -5.430   8.942
  327   3HG1  VAL  41          3HG1      VAL  41   2.862  -6.607   7.769
  328   1HG2  VAL  41          1HG2      VAL  41   3.968  -4.066  10.202
  329   2HG2  VAL  41          2HG2      VAL  41   5.087  -3.850   8.854
  330   3HG2  VAL  41          3HG2      VAL  41   5.627  -4.653  10.329
  331    H    GLY  42           H        GLY  42   1.695  -6.670  10.752
  332   1HA   GLY  42          1HA       GLY  42   2.043  -5.826  13.492
  333   2HA   GLY  42          2HA       GLY  42   1.512  -4.540  12.421
  334    H    ALA  43           H        ALA  43  -0.257  -5.875  10.769
  335    HA   ALA  43           HA       ALA  43  -2.507  -5.546  12.455
  336   1HB   ALA  43          1HB       ALA  43  -3.838  -5.939  10.453
  337   2HB   ALA  43          2HB       ALA  43  -2.407  -6.523   9.605
  338   3HB   ALA  43          3HB       ALA  43  -2.501  -4.838  10.118
  339    H    GLN  44           H        GLN  44  -4.367  -7.066  12.515
  340    HA   GLN  44           HA       GLN  44  -3.707  -9.889  12.227
  341   1HB   GLN  44          2HB       GLN  44  -4.647  -8.665  14.828
  342   2HB   GLN  44          1HB       GLN  44  -4.634 -10.392  14.496
  343   1HG   GLN  44          2HG       GLN  44  -2.214  -8.602  14.526
  344   2HG   GLN  44          1HG       GLN  44  -2.711  -9.683  15.827
  345   1HE2  GLN  44          1HE2      GLN  44  -3.599 -11.752  13.959
  346   2HE2  GLN  44          2HE2      GLN  44  -2.161 -12.492  13.354
  347    H    LYS  45           H        LYS  45  -5.515  -7.795  11.042
  348    HA   LYS  45           HA       LYS  45  -8.169  -8.695  11.851
  349   1HB   LYS  45          2HB       LYS  45  -7.338  -6.521   9.921
  350   2HB   LYS  45          1HB       LYS  45  -8.983  -6.844  10.451
  351   1HG   LYS  45          1HG       LYS  45  -8.505  -6.157  12.664
  352   2HG   LYS  45          2HG       LYS  45  -6.769  -6.127  12.352
  353   1HD   LYS  45          1HD       LYS  45  -8.763  -4.342  10.966
  354   2HD   LYS  45          2HD       LYS  45  -7.849  -3.875  12.403
  355   1HE   LYS  45          1HE       LYS  45  -6.668  -4.695   9.750
  356   2HE   LYS  45          2HE       LYS  45  -6.801  -3.043  10.352
  357   1HZ   LYS  45          1HZ       LYS  45  -5.230  -5.221  11.620
  358   2HZ   LYS  45          2HZ       LYS  45  -5.352  -3.634  12.191
  359   3HZ   LYS  45          3HZ       LYS  45  -4.590  -3.944  10.714
  360    H    ASP  46           H        ASP  46  -9.705  -8.526   9.700
  361    HA   ASP  46           HA       ASP  46  -8.634 -10.601   7.908
  362   1HB   ASP  46          2HB       ASP  46 -11.507  -9.996   8.641
  363   2HB   ASP  46          1HB       ASP  46 -10.985 -11.256   7.527
  364    H    THR  47           H        THR  47  -9.550  -7.372   8.050
  365    HA   THR  47           HA       THR  47  -9.604  -7.236   5.114
  366    HB   THR  47           HB       THR  47 -11.289  -5.436   5.195
  367    HG1  THR  47           1HG      THR  47 -11.242  -4.604   7.206
  368   1HG2  THR  47          1HG2      THR  47 -12.284  -7.938   6.556
  369   2HG2  THR  47          2HG2      THR  47 -11.978  -7.789   4.825
  370   3HG2  THR  47          3HG2      THR  47 -13.232  -6.807   5.587
  371    H    TYR  48           H        TYR  48  -9.208  -4.991   4.321
  372    HA   TYR  48           HA       TYR  48  -7.767  -3.314   6.245
  373   1HB   TYR  48          2HB       TYR  48  -6.769  -4.206   3.548
  374   2HB   TYR  48          1HB       TYR  48  -6.143  -2.775   4.365
  375    HD1  TYR  48           1HD      TYR  48  -6.569  -6.439   4.711
  376    HD2  TYR  48           2HD      TYR  48  -4.536  -2.948   6.032
  377    HE1  TYR  48           1HE      TYR  48  -4.997  -7.850   5.969
  378    HE2  TYR  48           2HE      TYR  48  -2.951  -4.349   7.306
  379    HH   TYR  48           HH       TYR  48  -2.753  -6.531   8.234
  380    H    THR  49           H        THR  49  -7.116  -1.199   4.943
  381    HA   THR  49           HA       THR  49  -9.197  -0.356   3.118
  382    HB   THR  49           HB       THR  49  -8.980   1.499   5.399
  383    HG1  THR  49           1HG      THR  49 -10.833  -0.480   5.894
  384   1HG2  THR  49          1HG2      THR  49 -11.402   0.391   3.996
  385   2HG2  THR  49          2HG2      THR  49 -10.469   1.761   3.395
  386   3HG2  THR  49          3HG2      THR  49 -11.292   1.868   4.952
  387    H    MET  50           H        MET  50  -8.132   0.762   1.608
  388    HA   MET  50           HA       MET  50  -6.664   2.332   0.698
  389   1HB   MET  50          2HB       MET  50  -7.619   4.382   2.514
  390   2HB   MET  50          1HB       MET  50  -7.927   4.167   0.794
  391   1HG   MET  50          1HG       MET  50  -9.845   2.977   1.144
  392   2HG   MET  50          2HG       MET  50  -9.348   2.433   2.744
  393   1HE   MET  50          1HE       MET  50 -12.679   4.649   3.142
  394   2HE   MET  50          2HE       MET  50 -12.029   3.017   3.292
  395   3HE   MET  50          3HE       MET  50 -12.236   3.739   1.697
  396    H    LYS  51           H        LYS  51  -6.812   3.759   3.931
  397    HA   LYS  51           HA       LYS  51  -4.027   4.484   3.662
  398   1HB   LYS  51          2HB       LYS  51  -5.678   6.133   4.440
  399   2HB   LYS  51          1HB       LYS  51  -6.027   5.126   5.839
  400   1HG   LYS  51          1HG       LYS  51  -3.740   5.427   6.634
  401   2HG   LYS  51          2HG       LYS  51  -3.380   6.427   5.226
  402   1HD   LYS  51          1HD       LYS  51  -5.099   8.029   5.936
  403   2HD   LYS  51          2HD       LYS  51  -5.433   7.031   7.354
  404   1HE   LYS  51          2HE       LYS  51  -2.810   8.374   6.709
  405   2HE   LYS  51          1HE       LYS  51  -3.978   8.910   7.916
  406   1HZ   LYS  51          1HZ       LYS  51  -3.635   6.840   9.115
  407   2HZ   LYS  51          2HZ       LYS  51  -2.175   7.672   8.928
  408   3HZ   LYS  51          3HZ       LYS  51  -2.510   6.328   7.958
  409    H    GLU  52           H        GLU  52  -6.022   2.546   5.836
  410    HA   GLU  52           HA       GLU  52  -4.264   1.637   7.707
  411   1HB   GLU  52          2HB       GLU  52  -6.740   0.894   6.889
  412   2HB   GLU  52          1HB       GLU  52  -5.798  -0.479   6.329
  413   1HG   GLU  52          1HG       GLU  52  -4.986  -0.903   8.550
  414   2HG   GLU  52          2HG       GLU  52  -5.788   0.545   9.154
  415    H    VAL  53           H        VAL  53  -4.780   0.049   4.564
  416    HA   VAL  53           HA       VAL  53  -2.448  -1.562   4.763
  417    HB   VAL  53           HB       VAL  53  -4.262  -2.349   3.417
  418   1HG1  VAL  53          1HG1      VAL  53  -5.271  -0.243   2.809
  419   2HG1  VAL  53          2HG1      VAL  53  -4.962  -1.193   1.355
  420   3HG1  VAL  53          3HG1      VAL  53  -3.899   0.150   1.774
  421   1HG2  VAL  53          1HG2      VAL  53  -2.026  -2.982   2.663
  422   2HG2  VAL  53          2HG2      VAL  53  -1.976  -1.565   1.614
  423   3HG2  VAL  53          3HG2      VAL  53  -3.146  -2.850   1.308
  424    H    LEU  54           H        LEU  54  -3.038   1.661   3.646
  425    HA   LEU  54           HA       LEU  54  -0.969   2.035   1.835
  426   1HB   LEU  54          1HB       LEU  54  -2.796   3.667   2.503
  427   2HB   LEU  54          2HB       LEU  54  -1.801   4.079   3.886
  428    HG   LEU  54           HG       LEU  54  -0.703   4.295   1.102
  429   1HD1  LEU  54          1HD2      LEU  54  -2.789   5.542   1.085
  430   2HD1  LEU  54          2HD2      LEU  54  -1.407   6.637   1.061
  431   3HD1  LEU  54          3HD2      LEU  54  -2.311   6.390   2.554
  432   1HD2  LEU  54          1HD1      LEU  54   0.712   5.995   2.134
  433   2HD2  LEU  54          2HD1      LEU  54   0.864   4.443   2.959
  434   3HD2  LEU  54          3HD1      LEU  54  -0.097   5.735   3.680
  435    H    PHE  55           H        PHE  55  -0.793   3.091   5.246
  436    HA   PHE  55           HA       PHE  55   2.040   3.281   5.144
  437   1HB   PHE  55          2HB       PHE  55   1.895   3.700   7.582
  438   2HB   PHE  55          1HB       PHE  55   0.796   4.710   6.652
  439    HD1  PHE  55           1HD      PHE  55  -1.485   4.738   7.117
  440    HD2  PHE  55           2HD      PHE  55   0.948   1.642   8.729
  441    HE1  PHE  55           1HE      PHE  55  -3.362   4.004   8.526
  442    HE2  PHE  55           2HE      PHE  55  -0.927   0.900  10.141
  443    HZ   PHE  55           HZ       PHE  55  -3.085   2.081  10.040
  444    H    TYR  56           H        TYR  56  -0.171   0.742   6.019
  445    HA   TYR  56           HA       TYR  56   1.535  -0.791   7.640
  446   1HB   TYR  56          1HB       TYR  56  -1.054  -1.100   6.445
  447   2HB   TYR  56          2HB       TYR  56  -0.125  -2.581   6.231
  448    HD1  TYR  56           1HD      TYR  56  -2.614  -1.692   8.090
  449    HD2  TYR  56           2HD      TYR  56   1.511  -2.537   8.719
  450    HE1  TYR  56           1HE      TYR  56  -3.107  -2.328  10.411
  451    HE2  TYR  56           2HE      TYR  56   1.031  -3.183  11.042
  452    HH   TYR  56           HH       TYR  56  -0.686  -2.762  12.753
  453    H    LEU  57           H        LEU  57   0.819  -1.151   4.159
  454    HA   LEU  57           HA       LEU  57   2.786  -3.082   3.651
  455   1HB   LEU  57          2HB       LEU  57   1.112  -2.638   1.995
  456   2HB   LEU  57          1HB       LEU  57   1.589  -0.955   1.879
  457    HG   LEU  57           HG       LEU  57   3.647  -1.545   0.780
  458   1HD1  LEU  57          1HD1      LEU  57   2.841  -4.422   1.185
  459   2HD1  LEU  57          2HD1      LEU  57   4.153  -3.588   2.018
  460   3HD1  LEU  57          3HD1      LEU  57   4.243  -3.856   0.277
  461   1HD2  LEU  57          1HD2      LEU  57   2.786  -2.602  -1.253
  462   2HD2  LEU  57          2HD2      LEU  57   1.683  -1.372  -0.637
  463   3HD2  LEU  57          3HD2      LEU  57   1.330  -3.081  -0.382
  464    H    GLY  58           H        GLY  58   2.929   0.466   3.542
  465   1HA   GLY  58          2HA       GLY  58   5.554   0.922   2.912
  466   2HA   GLY  58          1HA       GLY  58   4.691   1.822   4.152
  467    H    GLN  59           H        GLN  59   4.290  -0.199   6.033
  468    HA   GLN  59           HA       GLN  59   6.710  -0.270   7.430
  469   1HB   GLN  59          1HB       GLN  59   4.478  -2.279   7.749
  470   2HB   GLN  59          2HB       GLN  59   5.650  -1.784   8.961
  471   1HG   GLN  59          2HG       GLN  59   3.358  -0.191   7.855
  472   2HG   GLN  59          1HG       GLN  59   3.597  -0.757   9.507
  473   1HE2  GLN  59          1HE2      GLN  59   3.156   1.946   8.477
  474   2HE2  GLN  59          2HE2      GLN  59   4.495   2.886   9.030
  475    H    TYR  60           H        TYR  60   5.048  -3.050   5.896
  476    HA   TYR  60           HA       TYR  60   7.005  -4.896   6.511
  477   1HB   TYR  60          2HB       TYR  60   4.780  -5.545   5.725
  478   2HB   TYR  60          1HB       TYR  60   5.153  -4.925   4.119
  479    HD1  TYR  60           1HD      TYR  60   5.641  -7.659   6.478
  480    HD2  TYR  60           2HD      TYR  60   6.730  -6.120   2.665
  481    HE1  TYR  60           1HE      TYR  60   6.562  -9.850   5.862
  482    HE2  TYR  60           2HE      TYR  60   7.650  -8.308   2.037
  483    HH   TYR  60           HH       TYR  60   8.535 -10.317   3.141
  484    H    ILE  61           H        ILE  61   6.761  -2.813   3.673
  485    HA   ILE  61           HA       ILE  61   8.858  -3.824   2.146
  486    HB   ILE  61           HB       ILE  61   8.258  -0.884   2.474
  487   1HG1  ILE  61          2HG1      ILE  61   6.965  -2.685   0.439
  488   2HG1  ILE  61          1HG1      ILE  61   6.237  -2.420   2.021
  489   1HG2  ILE  61          1HG2      ILE  61   8.958  -0.808   0.091
  490   2HG2  ILE  61          2HG2      ILE  61   9.414  -2.507   0.214
  491   3HG2  ILE  61          3HG2      ILE  61  10.245  -1.298   1.195
  492   1HD1  ILE  61          1HD1      ILE  61   6.316   0.033   1.535
  493   2HD1  ILE  61          2HD1      ILE  61   5.221  -0.907   0.517
  494   3HD1  ILE  61          3HD1      ILE  61   6.781  -0.385  -0.116
  495    H    MET  62           H        MET  62   9.042  -1.014   4.338
  496    HA   MET  62           HA       MET  62  11.911  -1.155   4.413
  497   1HB   MET  62          2HB       MET  62  11.741   0.733   5.996
  498   2HB   MET  62          1HB       MET  62  10.832   1.007   4.517
  499   1HG   MET  62          2HG       MET  62   9.421   1.775   6.182
  500   2HG   MET  62          1HG       MET  62   8.805   0.162   5.828
  501   1HE   MET  62          1HE       MET  62  10.905   2.354   8.316
  502   2HE   MET  62          2HE       MET  62  12.042   1.081   7.870
  503   3HE   MET  62          3HE       MET  62  11.401   1.157   9.511
  504    H    THR  63           H        THR  63   9.912  -3.243   5.704
  505    HA   THR  63           HA       THR  63  10.686  -3.228   8.468
  506    HB   THR  63           HB       THR  63   9.206  -5.244   6.784
  507    HG1  THR  63           1HG      THR  63   8.221  -3.968   9.092
  508   1HG2  THR  63          1HG2      THR  63  10.503  -6.471   8.463
  509   2HG2  THR  63          2HG2      THR  63   8.781  -6.509   8.839
  510   3HG2  THR  63          3HG2      THR  63   9.853  -5.430   9.731
  511    H    LYS  64           H        LYS  64  11.411  -5.449   5.749
  512    HA   LYS  64           HA       LYS  64  13.184  -6.935   7.470
  513   1HB   LYS  64          1HB       LYS  64  12.557  -7.403   4.561
  514   2HB   LYS  64          2HB       LYS  64  13.307  -8.541   5.671
  515   1HG   LYS  64          2HG       LYS  64  10.507  -7.472   5.943
  516   2HG   LYS  64          1HG       LYS  64  10.931  -9.028   5.228
  517   1HD   LYS  64          1HD       LYS  64  11.590  -8.200   8.053
  518   2HD   LYS  64          2HD       LYS  64  10.202  -9.189   7.596
  519   1HE   LYS  64          2HE       LYS  64  13.102  -9.886   7.145
  520   2HE   LYS  64          1HE       LYS  64  12.054 -10.571   8.385
  521   1HZ   LYS  64          1HZ       LYS  64  11.659 -10.828   5.452
  522   2HZ   LYS  64          2HZ       LYS  64  10.650 -11.485   6.642
  523   3HZ   LYS  64          3HZ       LYS  64  12.239 -12.040   6.482
  524    H    ARG  65           H        ARG  65  13.891  -6.576   4.137
  525    HA   ARG  65           HA       ARG  65  16.029  -4.713   4.395
  526   1HB   ARG  65          2HB       ARG  65  16.610  -7.620   4.597
  527   2HB   ARG  65          1HB       ARG  65  17.691  -6.656   3.602
  528   1HG   ARG  65          1HG       ARG  65  18.135  -5.188   5.505
  529   2HG   ARG  65          2HG       ARG  65  17.057  -6.166   6.504
  530   1HD   ARG  65          1HD       ARG  65  19.568  -7.145   5.149
  531   2HD   ARG  65          2HD       ARG  65  19.417  -6.740   6.858
  532    HE   ARG  65           HE       ARG  65  17.467  -8.641   6.250
  533   1HH1  ARG  65          2HH1      ARG  65  20.939  -8.389   6.412
  534   2HH1  ARG  65          1HH1      ARG  65  21.170 -10.058   6.810
  535   1HH2  ARG  65          1HH2      ARG  65  17.763 -10.840   6.775
  536   2HH2  ARG  65          2HH2      ARG  65  19.365 -11.452   7.016
  537    H    LEU  66           H        LEU  66  13.699  -5.415   2.706
  538    HA   LEU  66           HA       LEU  66  14.864  -6.223   0.174
  539   1HB   LEU  66          2HB       LEU  66  12.018  -5.455   0.816
  540   2HB   LEU  66          1HB       LEU  66  12.581  -6.260  -0.637
  541    HG   LEU  66           HG       LEU  66  13.037  -7.550   2.025
  542   1HD1  LEU  66          1HD1      LEU  66  10.456  -7.539   0.476
  543   2HD1  LEU  66          2HD1      LEU  66  10.718  -7.028   2.145
  544   3HD1  LEU  66          3HD1      LEU  66  10.863  -8.733   1.711
  545   1HD2  LEU  66          1HD2      LEU  66  14.099  -8.502   0.058
  546   2HD2  LEU  66          2HD2      LEU  66  12.536  -8.612  -0.751
  547   3HD2  LEU  66          3HD2      LEU  66  12.855  -9.587   0.683
  548    H    TYR  67           H        TYR  67  14.583  -3.370   1.811
  549    HA   TYR  67           HA       TYR  67  14.013  -1.748  -0.555
  550   1HB   TYR  67          1HB       TYR  67  13.887   0.145   1.014
  551   2HB   TYR  67          2HB       TYR  67  12.800  -1.158   1.476
  552    HD1  TYR  67           1HD      TYR  67  13.559  -2.740   3.335
  553    HD2  TYR  67           2HD      TYR  67  15.462   0.977   2.527
  554    HE1  TYR  67           1HE      TYR  67  14.537  -2.757   5.592
  555    HE2  TYR  67           2HE      TYR  67  16.447   0.970   4.777
  556    HH   TYR  67           HH       TYR  67  16.007  -0.030   6.978
  557    H    ASP  68           H        ASP  68  15.367   0.262  -0.812
  558    HA   ASP  68           HA       ASP  68  17.910  -0.701  -1.552
  559   1HB   ASP  68          2HB       ASP  68  16.800   0.951  -2.911
  560   2HB   ASP  68          1HB       ASP  68  16.750   2.094  -1.573
  561    H    GLU  69           H        GLU  69  16.821   0.599   1.361
  562    HA   GLU  69           HA       GLU  69  17.879   0.935   3.344
  563   1HB   GLU  69          2HB       GLU  69  20.450   0.203   1.940
  564   2HB   GLU  69          1HB       GLU  69  20.137   0.171   3.670
  565   1HG   GLU  69          1HG       GLU  69  18.522  -1.625   3.351
  566   2HG   GLU  69          2HG       GLU  69  18.822  -1.587   1.614
  567    H    LYS  70           H        LYS  70  18.632   2.603   0.530
  568    HA   LYS  70           HA       LYS  70  20.277   4.609   1.857
  569   1HB   LYS  70          2HB       LYS  70  19.291   4.427  -0.995
  570   2HB   LYS  70          1HB       LYS  70  20.365   5.674  -0.378
  571   1HG   LYS  70          1HG       LYS  70  22.035   3.958   0.154
  572   2HG   LYS  70          2HG       LYS  70  20.959   2.726  -0.509
  573   1HD   LYS  70          1HD       LYS  70  21.044   3.816  -2.693
  574   2HD   LYS  70          2HD       LYS  70  22.105   5.064  -2.035
  575   1HE   LYS  70          1HE       LYS  70  22.723   2.117  -2.204
  576   2HE   LYS  70          2HE       LYS  70  23.374   3.373  -3.257
  577   1HZ   LYS  70          1HZ       LYS  70  23.808   3.178  -0.324
  578   2HZ   LYS  70          2HZ       LYS  70  24.431   4.384  -1.332
  579   3HZ   LYS  70          3HZ       LYS  70  24.939   2.782  -1.520
  580    H    GLN  71           H        GLN  71  17.317   4.690  -0.142
  581    HA   GLN  71           HA       GLN  71  16.354   6.877   1.575
  582   1HB   GLN  71          1HB       GLN  71  15.709   6.358  -1.331
  583   2HB   GLN  71          2HB       GLN  71  15.025   7.651  -0.355
  584   1HG   GLN  71          2HG       GLN  71  17.244   8.624  -0.080
  585   2HG   GLN  71          1HG       GLN  71  17.936   7.321  -1.046
  586   1HE2  GLN  71          2HE2      GLN  71  14.851   8.788  -1.747
  587   2HE2  GLN  71          1HE2      GLN  71  15.336   9.583  -3.202
  588    H    GLN  72           H        GLN  72  16.025   3.735   1.150
  589    HA   GLN  72           HA       GLN  72  14.449   2.176   1.670
  590   1HB   GLN  72          1HB       GLN  72  13.132   4.492   3.099
  591   2HB   GLN  72          2HB       GLN  72  12.844   2.784   3.401
  592   1HG   GLN  72          1HG       GLN  72  15.164   2.529   4.134
  593   2HG   GLN  72          2HG       GLN  72  15.438   4.246   3.844
  594   1HE2  GLN  72          2HE2      GLN  72  15.970   4.634   5.986
  595   2HE2  GLN  72          1HE2      GLN  72  14.789   4.640   7.245
  596    H    HIS  73           H        HIS  73  14.018   4.049  -0.713
  597    HA   HIS  73           HA       HIS  73  11.104   3.768  -0.972
  598   1HB   HIS  73          1HB       HIS  73  13.022   5.445  -2.602
  599   2HB   HIS  73          2HB       HIS  73  11.279   5.380  -2.827
  600    HD1  HIS  73           1HD      HIS  73  10.472   5.563   0.184
  601    HD2  HIS  73           2HD      HIS  73  13.228   8.026  -1.713
  602    HE1  HIS  73           1HE      HIS  73  10.551   7.666   1.560
  603    HE2  HIS  73           2HE      HIS  73  12.168   9.173   0.350
  604    H    ILE  74           H        ILE  74  14.134   3.187  -2.758
  605    HA   ILE  74           HA       ILE  74  12.739   1.646  -4.775
  606    HB   ILE  74           HB       ILE  74  15.726   1.718  -4.442
  607   1HG1  ILE  74          1HG1      ILE  74  15.001   4.044  -4.360
  608   2HG1  ILE  74          2HG1      ILE  74  15.754   3.705  -5.916
  609   1HG2  ILE  74          1HG2      ILE  74  15.684   1.452  -6.879
  610   2HG2  ILE  74          2HG2      ILE  74  13.920   1.452  -6.843
  611   3HG2  ILE  74          3HG2      ILE  74  14.819   0.151  -6.062
  612   1HD1  ILE  74          1HD1      ILE  74  13.771   5.096  -6.153
  613   2HD1  ILE  74          2HD1      ILE  74  12.793   3.837  -5.398
  614   3HD1  ILE  74          3HD1      ILE  74  13.565   3.539  -6.955
  615    H    VAL  75           H        VAL  75  12.165  -0.403  -4.450
  616    HA   VAL  75           HA       VAL  75  13.368  -1.751  -2.135
  617    HB   VAL  75           HB       VAL  75  10.714  -2.434  -3.365
  618   1HG1  VAL  75          1HG1      VAL  75  10.240  -3.274  -1.102
  619   2HG1  VAL  75          2HG1      VAL  75  11.873  -2.828  -0.610
  620   3HG1  VAL  75          3HG1      VAL  75  11.631  -4.073  -1.834
  621   1HG2  VAL  75          1HG2      VAL  75  11.293  -0.355  -1.265
  622   2HG2  VAL  75          2HG2      VAL  75   9.688  -0.968  -1.661
  623   3HG2  VAL  75          3HG2      VAL  75  10.617  -0.084  -2.872
  624    H    TYR  76           H        TYR  76  15.058  -2.810  -3.170
  625    HA   TYR  76           HA       TYR  76  14.643  -4.641  -5.320
  626   1HB   TYR  76          2HB       TYR  76  16.877  -4.881  -3.326
  627   2HB   TYR  76          1HB       TYR  76  16.894  -5.231  -5.052
  628    HD1  TYR  76           1HD      TYR  76  15.729  -2.742  -6.153
  629    HD2  TYR  76           2HD      TYR  76  18.579  -3.309  -3.041
  630    HE1  TYR  76           1HE      TYR  76  16.655  -0.505  -6.594
  631    HE2  TYR  76           2HE      TYR  76  19.509  -1.078  -3.478
  632    HH   TYR  76           HH       TYR  76  19.618   0.543  -5.329
  633    H    CYS  77           H        CYS  77  13.055  -6.116  -4.914
  634    HA   CYS  77           HA       CYS  77  12.763  -7.242  -2.276
  635   1HB   CYS  77          2HB       CYS  77  11.202  -7.807  -4.805
  636   2HB   CYS  77          1HB       CYS  77  10.751  -8.313  -3.181
  637    HG   CYS  77           HG       CYS  77   9.058  -6.304  -3.381
  638    H    SER  78           H        SER  78  12.308  -9.144  -5.201
  639    HA   SER  78           HA       SER  78  12.972 -11.240  -5.763
  640   1HB   SER  78          1HB       SER  78  15.127 -10.073  -6.065
  641   2HB   SER  78          2HB       SER  78  15.544 -10.433  -4.389
  642    HG   SER  78           HG       SER  78  16.453 -12.052  -5.525
  643    H    ASN  79           H        ASN  79  11.778 -12.699  -4.693
  644    HA   ASN  79           HA       ASN  79  11.323 -14.421  -3.286
  645   1HB   ASN  79          2HB       ASN  79  14.120 -13.909  -2.251
  646   2HB   ASN  79          1HB       ASN  79  13.138 -15.320  -1.868
  647   1HD2  ASN  79          1HD2      ASN  79  14.988 -13.688  -4.309
  648   2HD2  ASN  79          2HD2      ASN  79  15.083 -15.016  -5.411
  649    H    ASP  80           H        ASP  80   9.751 -12.908  -2.407
  650    HA   ASP  80           HA       ASP  80   9.867 -12.870   0.433
  651   1HB   ASP  80          2HB       ASP  80   9.527 -10.325   0.568
  652   2HB   ASP  80          1HB       ASP  80  11.167 -10.921   0.327
  653    H    LEU  81           H        LEU  81   7.879 -11.691   1.350
  654    HA   LEU  81           HA       LEU  81   5.556 -12.625   0.064
  655   1HB   LEU  81          1HB       LEU  81   5.853 -10.545   2.232
  656   2HB   LEU  81          2HB       LEU  81   4.336 -11.278   1.751
  657    HG   LEU  81           HG       LEU  81   6.683 -12.784   2.914
  658   1HD1  LEU  81          1HD1      LEU  81   5.315 -12.966   4.930
  659   2HD1  LEU  81          2HD1      LEU  81   4.089 -11.931   4.193
  660   3HD1  LEU  81          3HD1      LEU  81   5.691 -11.285   4.556
  661   1HD2  LEU  81          1HD2      LEU  81   5.299 -14.142   1.433
  662   2HD2  LEU  81          2HD2      LEU  81   3.858 -13.658   2.326
  663   3HD2  LEU  81          3HD2      LEU  81   5.099 -14.630   3.116
  664    H    LEU  82           H        LEU  82   6.987  -9.384   0.284
  665    HA   LEU  82           HA       LEU  82   5.193  -7.992  -1.327
  666   1HB   LEU  82          1HB       LEU  82   8.024  -7.712  -0.568
  667   2HB   LEU  82          2HB       LEU  82   7.592  -6.942  -2.083
  668    HG   LEU  82           HG       LEU  82   6.203  -6.433   0.550
  669   1HD1  LEU  82          1HD1      LEU  82   8.519  -5.635   0.573
  670   2HD1  LEU  82          2HD1      LEU  82   7.370  -4.298   0.551
  671   3HD1  LEU  82          3HD1      LEU  82   8.225  -4.749  -0.923
  672   1HD2  LEU  82          1HD2      LEU  82   5.095  -4.642  -0.587
  673   2HD2  LEU  82          2HD2      LEU  82   4.849  -6.119  -1.523
  674   3HD2  LEU  82          3HD2      LEU  82   6.035  -4.925  -2.053
  675    H    GLY  83           H        GLY  83   7.533 -10.427  -2.118
  676   1HA   GLY  83          1HA       GLY  83   7.609 -10.026  -4.930
  677   2HA   GLY  83          2HA       GLY  83   8.002 -11.517  -4.087
  678    H    ASP  84           H        ASP  84   5.554 -12.031  -2.837
  679    HA   ASP  84           HA       ASP  84   3.966 -13.196  -4.817
  680   1HB   ASP  84          2HB       ASP  84   3.089 -12.258  -2.071
  681   2HB   ASP  84          1HB       ASP  84   2.229 -13.405  -3.093
  682    H    LEU  85           H        LEU  85   4.129  -9.939  -3.677
  683    HA   LEU  85           HA       LEU  85   1.622  -9.111  -4.808
  684   1HB   LEU  85          1HB       LEU  85   4.003  -7.529  -3.864
  685   2HB   LEU  85          2HB       LEU  85   2.503  -6.813  -4.422
  686    HG   LEU  85           HG       LEU  85   2.941  -8.485  -1.961
  687   1HD1  LEU  85          1HD2      LEU  85   1.813  -5.714  -2.325
  688   2HD1  LEU  85          2HD2      LEU  85   3.476  -6.072  -1.860
  689   3HD1  LEU  85          3HD2      LEU  85   2.145  -6.532  -0.797
  690   1HD2  LEU  85          1HD1      LEU  85   0.345  -7.581  -3.197
  691   2HD2  LEU  85          2HD1      LEU  85   0.513  -8.259  -1.577
  692   3HD2  LEU  85          3HD1      LEU  85   0.890  -9.245  -2.990
  693    H    PHE  86           H        PHE  86   4.767  -7.711  -5.586
  694    HA   PHE  86           HA       PHE  86   3.699  -7.041  -8.182
  695   1HB   PHE  86          2HB       PHE  86   6.416  -6.352  -7.050
  696   2HB   PHE  86          1HB       PHE  86   5.602  -5.571  -8.403
  697    HD1  PHE  86           1HD      PHE  86   4.091  -3.805  -8.057
  698    HD2  PHE  86           2HD      PHE  86   5.469  -6.103  -4.751
  699    HE1  PHE  86           1HE      PHE  86   3.098  -2.167  -6.510
  700    HE2  PHE  86           2HE      PHE  86   4.475  -4.475  -3.201
  701    HZ   PHE  86           HZ       PHE  86   3.287  -2.508  -4.079
  702    H    GLY  87           H        GLY  87   6.608  -8.707  -6.972
  703   1HA   GLY  87          2HA       GLY  87   7.790 -10.433  -8.064
  704   2HA   GLY  87          1HA       GLY  87   6.857 -10.118  -9.520
  705    H    VAL  88           H        VAL  88   7.679  -7.163  -8.495
  706    HA   VAL  88           HA       VAL  88   9.492  -6.635 -10.553
  707    HB   VAL  88           HB       VAL  88   9.888  -4.480  -9.473
  708   1HG1  VAL  88          1HG2      VAL  88   7.562  -3.697  -9.332
  709   2HG1  VAL  88          2HG2      VAL  88   7.015  -5.374  -9.310
  710   3HG1  VAL  88          3HG2      VAL  88   7.837  -4.733 -10.732
  711   1HG2  VAL  88          1HG1      VAL  88   8.892  -3.961  -7.295
  712   2HG2  VAL  88          2HG1      VAL  88  10.098  -5.244  -7.171
  713   3HG2  VAL  88          3HG1      VAL  88   8.379  -5.641  -7.133
  714    HA   PRO  89           HA       PRO  89  13.506  -7.342  -8.512
  715   1HB   PRO  89          1HB       PRO  89  14.991  -5.554  -9.878
  716   2HB   PRO  89          2HB       PRO  89  14.496  -7.095 -10.587
  717   1HG   PRO  89          2HG       PRO  89  13.315  -4.369 -10.958
  718   2HG   PRO  89          1HG       PRO  89  13.630  -5.626 -12.168
  719   1HD   PRO  89          2HD       PRO  89  11.168  -5.170 -11.079
  720   2HD   PRO  89          1HD       PRO  89  11.693  -6.756 -11.678
  721    H    SER  90           H        SER  90  12.195  -4.117  -9.143
  722    HA   SER  90           HA       SER  90  12.646  -3.383  -6.376
  723   1HB   SER  90          2HB       SER  90  13.744  -1.229  -6.995
  724   2HB   SER  90          1HB       SER  90  14.735  -2.645  -7.347
  725    HG   SER  90           HG       SER  90  13.174  -1.155  -9.190
  726    H    PHE  91           H        PHE  91  11.143  -1.873  -5.632
  727    HA   PHE  91           HA       PHE  91   9.608  -0.443  -7.685
  728   1HB   PHE  91          1HB       PHE  91   7.502  -0.862  -6.669
  729   2HB   PHE  91          2HB       PHE  91   8.296  -2.419  -6.849
  730    HD1  PHE  91           1HD      PHE  91   7.263   0.160  -4.434
  731    HD2  PHE  91           2HD      PHE  91   8.865  -3.748  -4.959
  732    HE1  PHE  91           1HE      PHE  91   6.843  -0.319  -2.067
  733    HE2  PHE  91           2HE      PHE  91   8.455  -4.234  -2.582
  734    HZ   PHE  91           HZ       PHE  91   7.440  -2.521  -1.134
  735    H    SER  92           H        SER  92   8.786   1.573  -7.090
  736    HA   SER  92           HA       SER  92  10.248   2.764  -4.849
  737   1HB   SER  92          1HB       SER  92  10.673   3.814  -6.990
  738   2HB   SER  92          2HB       SER  92   8.943   4.030  -7.269
  739    HG   SER  92           HG       SER  92  10.551   5.726  -6.135
  740    H    VAL  93           H        VAL  93   9.061   2.628  -3.042
  741    HA   VAL  93           HA       VAL  93   6.244   2.799  -2.905
  742    HB   VAL  93           HB       VAL  93   7.604   1.778  -1.129
  743   1HG1  VAL  93          1HG1      VAL  93   8.473   4.604  -0.552
  744   2HG1  VAL  93          2HG1      VAL  93   9.492   3.293  -1.146
  745   3HG1  VAL  93          3HG1      VAL  93   8.799   3.208   0.475
  746   1HG2  VAL  93          1HG2      VAL  93   5.955   4.121  -0.189
  747   2HG2  VAL  93          2HG2      VAL  93   6.410   2.727   0.790
  748   3HG2  VAL  93          3HG2      VAL  93   5.348   2.518  -0.602
  749    H    LYS  94           H        LYS  94   8.731   5.182  -3.114
  750    HA   LYS  94           HA       LYS  94   7.560   7.414  -1.966
  751   1HB   LYS  94          1HB       LYS  94   9.821   7.492  -2.791
  752   2HB   LYS  94          2HB       LYS  94   9.283   7.184  -4.436
  753   1HG   LYS  94          2HG       LYS  94   9.886   9.513  -4.136
  754   2HG   LYS  94          1HG       LYS  94   8.164   9.349  -4.486
  755   1HD   LYS  94          1HD       LYS  94   8.439  10.970  -2.736
  756   2HD   LYS  94          2HD       LYS  94   7.708   9.519  -2.049
  757   1HE   LYS  94          1HE       LYS  94   9.894   8.810  -1.216
  758   2HE   LYS  94          2HE       LYS  94  10.629  10.256  -1.906
  759   1HZ   LYS  94          1HZ       LYS  94  10.196  10.514   0.459
  760   2HZ   LYS  94          2HZ       LYS  94   8.547  10.226   0.212
  761   3HZ   LYS  94          3HZ       LYS  94   9.272  11.609  -0.442
  762    H    GLU  95           H        GLU  95   7.298   6.368  -5.368
  763    HA   GLU  95           HA       GLU  95   5.108   8.163  -5.876
  764   1HB   GLU  95          2HB       GLU  95   4.978   6.888  -8.060
  765   2HB   GLU  95          1HB       GLU  95   6.501   7.705  -7.739
  766   1HG   GLU  95          1HG       GLU  95   7.472   5.577  -6.999
  767   2HG   GLU  95          2HG       GLU  95   5.949   4.769  -7.369
  768    H    HIS  96           H        HIS  96   3.760   7.422  -4.095
  769    HA   HIS  96           HA       HIS  96   2.851   4.782  -3.829
  770   1HB   HIS  96          2HB       HIS  96   2.411   7.277  -2.538
  771   2HB   HIS  96          1HB       HIS  96   0.838   6.570  -2.894
  772    HD1  HIS  96           1HD      HIS  96   3.738   6.266  -0.647
  773    HD2  HIS  96           2HD      HIS  96   0.397   4.012  -1.664
  774    HE1  HIS  96           1HE      HIS  96   3.534   4.517   1.149
  775    HE2  HIS  96           2HE      HIS  96   1.562   3.108   0.462
  776    H    ARG  97           H        ARG  97   2.024   7.195  -6.092
  777    HA   ARG  97           HA       ARG  97  -0.601   6.396  -6.748
  778   1HB   ARG  97          1HB       ARG  97   0.324   8.502  -7.544
  779   2HB   ARG  97          2HB       ARG  97   1.548   7.644  -8.470
  780   1HG   ARG  97          2HG       ARG  97  -0.205   8.425  -9.931
  781   2HG   ARG  97          1HG       ARG  97  -0.216   6.661  -9.866
  782   1HD   ARG  97          2HD       ARG  97  -2.480   7.545  -9.768
  783   2HD   ARG  97          1HD       ARG  97  -2.059   6.729  -8.263
  784    HE   ARG  97           HE       ARG  97  -1.458   9.379  -7.857
  785   1HH1  ARG  97          2HH1      ARG  97  -4.298   7.545  -8.697
  786   2HH1  ARG  97          1HH1      ARG  97  -5.393   8.650  -7.935
  787   1HH2  ARG  97          1HH2      ARG  97  -2.893  10.839  -6.852
  788   2HH2  ARG  97          2HH2      ARG  97  -4.595  10.523  -6.890
  789    H    LYS  98           H        LYS  98   2.412   5.691  -8.524
  790    HA   LYS  98           HA       LYS  98   1.180   3.710 -10.131
  791   1HB   LYS  98          1HB       LYS  98   3.130   4.997 -10.880
  792   2HB   LYS  98          2HB       LYS  98   4.113   4.239  -9.635
  793   1HG   LYS  98          1HG       LYS  98   4.560   3.187 -11.741
  794   2HG   LYS  98          2HG       LYS  98   3.707   2.047 -10.700
  795   1HD   LYS  98          2HD       LYS  98   2.783   1.912 -12.916
  796   2HD   LYS  98          1HD       LYS  98   1.593   2.657 -11.848
  797   1HE   LYS  98          1HE       LYS  98   2.233   4.867 -12.665
  798   2HE   LYS  98          2HE       LYS  98   3.438   4.133 -13.721
  799   1HZ   LYS  98          1HZ       LYS  98   1.661   2.986 -14.890
  800   2HZ   LYS  98          2HZ       LYS  98   1.416   4.658 -14.926
  801   3HZ   LYS  98          3HZ       LYS  98   0.504   3.695 -13.877
  802    H    ILE  99           H        ILE  99   2.814   3.623  -7.068
  803    HA   ILE  99           HA       ILE  99   3.499   0.848  -7.180
  804    HB   ILE  99           HB       ILE  99   4.544   2.770  -5.731
  805   1HG1  ILE  99          2HG1      ILE  99   5.021   0.200  -5.859
  806   2HG1  ILE  99          1HG1      ILE  99   5.690   1.150  -4.537
  807   1HG2  ILE  99          1HG2      ILE  99   2.376   1.749  -3.915
  808   2HG2  ILE  99          2HG2      ILE  99   2.617   3.406  -4.471
  809   3HG2  ILE  99          3HG2      ILE  99   3.788   2.662  -3.376
  810   1HD1  ILE  99          1HD1      ILE  99   3.906   0.393  -3.073
  811   2HD1  ILE  99          2HD1      ILE  99   4.784  -0.972  -3.765
  812   3HD1  ILE  99          3HD1      ILE  99   3.198  -0.530  -4.400
  813    H    TYR 100           H        TYR 100   0.759   2.684  -6.018
  814    HA   TYR 100           HA       TYR 100  -0.461   0.236  -4.985
  815   1HB   TYR 100          2HB       TYR 100  -0.976   3.142  -4.587
  816   2HB   TYR 100          1HB       TYR 100  -2.333   2.030  -4.421
  817    HD1  TYR 100           1HD      TYR 100   0.974   0.802  -3.631
  818    HD2  TYR 100           2HD      TYR 100  -2.488   2.676  -2.019
  819    HE1  TYR 100           1HE      TYR 100   1.717   0.214  -1.375
  820    HE2  TYR 100           2HE      TYR 100  -1.748   2.095   0.253
  821    HH   TYR 100           HH       TYR 100  -0.294   0.450   1.352
  822    H    THR 101           H        THR 101  -0.291   1.922  -7.856
  823    HA   THR 101           HA       THR 101  -2.884   1.125  -8.847
  824    HB   THR 101           HB       THR 101  -0.390   1.955 -10.349
  825    HG1  THR 101           1HG      THR 101  -2.288   3.349  -9.021
  826   1HG2  THR 101          1HG2      THR 101  -1.855   0.569 -11.738
  827   2HG2  THR 101          2HG2      THR 101  -1.878   2.250 -12.275
  828   3HG2  THR 101          3HG2      THR 101  -3.225   1.607 -11.336
  829    H    MET 102           H        MET 102   0.368  -0.181  -8.718
  830    HA   MET 102           HA       MET 102  -0.297  -2.581 -10.159
  831   1HB   MET 102          2HB       MET 102   1.993  -2.182  -8.233
  832   2HB   MET 102          1HB       MET 102   1.875  -3.368  -9.528
  833   1HG   MET 102          2HG       MET 102   1.967  -1.594 -11.183
  834   2HG   MET 102          1HG       MET 102   2.030  -0.394  -9.895
  835   1HE   MET 102          1HE       MET 102   4.197   0.239  -8.550
  836   2HE   MET 102          2HE       MET 102   5.515  -0.913  -8.321
  837   3HE   MET 102          3HE       MET 102   3.886  -1.314  -7.776
  838    H    ILE 103           H        ILE 103  -0.151  -1.536  -6.799
  839    HA   ILE 103           HA       ILE 103  -0.525  -3.972  -5.533
  840    HB   ILE 103           HB       ILE 103  -1.316  -1.175  -4.801
  841   1HG1  ILE 103          2HG1      ILE 103   1.039  -1.897  -4.607
  842   2HG1  ILE 103          1HG1      ILE 103   0.341  -1.496  -3.042
  843   1HG2  ILE 103          1HG2      ILE 103  -3.110  -2.554  -3.915
  844   2HG2  ILE 103          2HG2      ILE 103  -2.081  -1.967  -2.609
  845   3HG2  ILE 103          3HG2      ILE 103  -1.934  -3.634  -3.167
  846   1HD1  ILE 103          1HD1      ILE 103   0.035  -3.866  -2.566
  847   2HD1  ILE 103          2HD1      ILE 103   1.722  -3.485  -2.909
  848   3HD1  ILE 103          3HD1      ILE 103   0.729  -4.270  -4.136
  849    H    TYR 104           H        TYR 104  -3.058  -1.636  -6.492
  850    HA   TYR 104           HA       TYR 104  -5.093  -3.674  -6.045
  851   1HB   TYR 104          1HB       TYR 104  -5.353  -0.761  -6.825
  852   2HB   TYR 104          2HB       TYR 104  -6.699  -1.839  -6.471
  853    HD1  TYR 104           1HD      TYR 104  -7.114  -2.598  -4.169
  854    HD2  TYR 104           2HD      TYR 104  -4.003   0.165  -5.062
  855    HE1  TYR 104           1HE      TYR 104  -6.964  -2.008  -1.788
  856    HE2  TYR 104           2HE      TYR 104  -3.844   0.762  -2.683
  857    HH   TYR 104           HH       TYR 104  -5.313  -1.053  -0.229
  858    H    ARG 105           H        ARG 105  -5.087  -5.117  -7.690
  859    HA   ARG 105           HA       ARG 105  -5.004  -4.146 -10.443
  860   1HB   ARG 105          1HB       ARG 105  -4.975  -6.969  -9.359
  861   2HB   ARG 105          2HB       ARG 105  -4.800  -6.527 -11.051
  862   1HG   ARG 105          2HG       ARG 105  -2.723  -5.379 -10.570
  863   2HG   ARG 105          1HG       ARG 105  -2.911  -5.721  -8.851
  864   1HD   ARG 105          1HD       ARG 105  -1.346  -7.273  -9.912
  865   2HD   ARG 105          2HD       ARG 105  -2.768  -8.107  -9.287
  866    HE   ARG 105           HE       ARG 105  -3.101  -7.413 -12.022
  867   1HH1  ARG 105          2HH1      ARG 105  -1.516  -9.691  -9.913
  868   2HH1  ARG 105          1HH1      ARG 105  -1.460 -10.948 -11.103
  869   1HH2  ARG 105          1HH2      ARG 105  -3.034  -9.064 -13.592
  870   2HH2  ARG 105          2HH2      ARG 105  -2.322 -10.592 -13.194
  871    H    ASN 106           H        ASN 106  -6.815  -6.890  -9.125
  872    HA   ASN 106           HA       ASN 106  -9.379  -5.750  -9.348
  873   1HB   ASN 106          2HB       ASN 106 -10.188  -6.937 -11.364
  874   2HB   ASN 106          1HB       ASN 106  -8.947  -5.746 -11.745
  875   1HD2  ASN 106          2HD2      ASN 106  -9.730  -9.116 -11.567
  876   2HD2  ASN 106          1HD2      ASN 106  -8.344  -9.694 -12.423
  877    H    LEU 107           H        LEU 107 -10.633  -6.912  -8.050
  878    HA   LEU 107           HA       LEU 107 -10.833  -9.734  -8.164
  879   1HB   LEU 107          2HB       LEU 107  -8.694  -9.618  -6.982
  880   2HB   LEU 107          1HB       LEU 107  -9.413  -8.589  -5.759
  881    HG   LEU 107           HG       LEU 107 -10.896 -10.443  -5.086
  882   1HD1  LEU 107          1HD2      LEU 107  -9.323 -12.036  -7.106
  883   2HD1  LEU 107          2HD2      LEU 107 -11.033 -11.617  -7.209
  884   3HD1  LEU 107          3HD2      LEU 107 -10.466 -12.700  -5.938
  885   1HD2  LEU 107          1HD1      LEU 107  -7.964 -11.144  -5.119
  886   2HD2  LEU 107          2HD1      LEU 107  -9.177 -11.824  -4.035
  887   3HD2  LEU 107          3HD1      LEU 107  -8.772 -10.110  -3.940
  888    H    VAL 108           H        VAL 108 -11.008  -7.512  -5.388
  889    HA   VAL 108           HA       VAL 108 -13.843  -7.192  -5.604
  890    HB   VAL 108           HB       VAL 108 -13.810  -9.465  -4.698
  891   1HG1  VAL 108          1HG1      VAL 108 -12.262  -8.268  -2.402
  892   2HG1  VAL 108          2HG1      VAL 108 -11.645  -9.414  -3.591
  893   3HG1  VAL 108          3HG1      VAL 108 -12.906  -9.909  -2.463
  894   1HG2  VAL 108          1HG2      VAL 108 -14.676  -7.392  -2.685
  895   2HG2  VAL 108          2HG2      VAL 108 -15.207  -9.073  -2.716
  896   3HG2  VAL 108          3HG2      VAL 108 -15.626  -7.992  -4.043
  897    H    VAL 109           H        VAL 109 -14.517  -5.430  -4.512
  898    HA   VAL 109           HA       VAL 109 -12.892  -4.379  -2.320
  899    HB   VAL 109           HB       VAL 109 -12.955  -2.096  -3.250
  900   1HG1  VAL 109          1HG1      VAL 109 -10.954  -3.440  -3.546
  901   2HG1  VAL 109          2HG1      VAL 109 -11.215  -2.409  -4.955
  902   3HG1  VAL 109          3HG1      VAL 109 -11.612  -4.126  -5.032
  903   1HG2  VAL 109          1HG2      VAL 109 -14.890  -2.327  -4.706
  904   2HG2  VAL 109          2HG2      VAL 109 -13.995  -3.441  -5.742
  905   3HG2  VAL 109          3HG2      VAL 109 -13.492  -1.755  -5.616
  906    H    VAL 110           H        VAL 110 -14.200  -1.954  -1.997
  907    HA   VAL 110           HA       VAL 110 -16.529  -2.749  -0.627
  908    HB   VAL 110           HB       VAL 110 -15.222  -0.804   0.064
  909   1HG1  VAL 110          1HG1      VAL 110 -16.278   0.484  -2.445
  910   2HG1  VAL 110          2HG1      VAL 110 -14.606   0.017  -2.141
  911   3HG1  VAL 110          3HG1      VAL 110 -15.353   1.295  -1.181
  912   1HG2  VAL 110          1HG2      VAL 110 -17.553  -0.951   0.762
  913   2HG2  VAL 110          2HG2      VAL 110 -18.055  -0.103  -0.701
  914   3HG2  VAL 110          3HG2      VAL 110 -17.079   0.729   0.510
  915    H    ASN 111           H        ASN 111 -15.999  -1.514  -3.849
  916    HA   ASN 111           HA       ASN 111 -18.896  -1.192  -4.229
  917   1HB   ASN 111          1HB       ASN 111 -17.560   0.808  -4.703
  918   2HB   ASN 111          2HB       ASN 111 -16.597  -0.099  -5.865
  919   1HD2  ASN 111          2HD2      ASN 111 -19.674   1.371  -5.215
  920   2HD2  ASN 111          1HD2      ASN 111 -20.266   1.328  -6.838
  921    H    GLN 112           H        GLN 112 -16.322  -1.822  -6.588
  922    HA   GLN 112           HA       GLN 112 -16.204  -3.247  -8.349
  923   1HB   GLN 112          1HB       GLN 112 -17.716  -5.007  -6.420
  924   2HB   GLN 112          2HB       GLN 112 -17.182  -5.563  -8.002
  925   1HG   GLN 112          1HG       GLN 112 -15.390  -4.533  -5.814
  926   2HG   GLN 112          2HG       GLN 112 -15.647  -6.229  -6.226
  927   1HE2  GLN 112          1HE2      GLN 112 -14.775  -7.051  -8.127
  928   2HE2  GLN 112          2HE2      GLN 112 -13.531  -6.227  -8.996
  929    H    GLN 113           H        GLN 113 -19.373  -4.420  -7.313
  930    HA   GLN 113           HA       GLN 113 -20.693  -2.929  -9.437
  931   1HB   GLN 113          2HB       GLN 113 -19.884  -4.970 -10.543
  932   2HB   GLN 113          1HB       GLN 113 -20.709  -5.951  -9.339
  933   1HG   GLN 113          2HG       GLN 113 -22.858  -5.080 -10.093
  934   2HG   GLN 113          1HG       GLN 113 -22.035  -4.088 -11.295
  935   1HE2  GLN 113          1HE2      GLN 113 -21.132  -5.062 -13.102
  936   2HE2  GLN 113          2HE2      GLN 113 -21.529  -6.674 -13.578
  937    H    GLU 114           H        GLU 114 -22.825  -2.548  -9.051
  938    HA   GLU 114           HA       GLU 114 -23.867  -3.501  -6.480
  939   1HB   GLU 114          1HB       GLU 114 -23.734  -1.034  -6.961
  940   2HB   GLU 114          2HB       GLU 114 -24.936  -1.271  -8.220
  941   1HG   GLU 114          1HG       GLU 114 -25.960  -0.432  -6.196
  942   2HG   GLU 114          2HG       GLU 114 -26.534  -2.060  -6.557
  943    H    SER 115           H        SER 115 -26.307  -3.821  -6.432
  944    HA   SER 115           HA       SER 115 -27.060  -5.975  -7.976
  945   1HB   SER 115          2HB       SER 115 -28.210  -5.352  -5.904
  946   2HB   SER 115          1HB       SER 115 -28.869  -3.916  -6.687
  947    HG   SER 115           HG       SER 115 -29.824  -6.413  -6.696
  948    H    SER 116           H        SER 116 -28.420  -6.265  -9.758
  949    HA   SER 116           HA       SER 116 -28.019  -4.466 -11.881
  950   1HB   SER 116          1HB       SER 116 -29.573  -5.919 -13.141
  951   2HB   SER 116          2HB       SER 116 -28.375  -6.859 -12.252
  952    HG   SER 116           HG       SER 116 -31.052  -6.359 -11.451
  953    H    ASP 117           H        ASP 117 -29.648  -3.348 -13.146
  954    HA   ASP 117           HA       ASP 117 -31.251  -1.752 -13.362
  955   1HB   ASP 117          2HB       ASP 117 -32.751  -3.686 -13.168
  956   2HB   ASP 117          1HB       ASP 117 -32.747  -3.521 -11.415
  957    H    SER 118           H        SER 118 -29.935  -0.157 -12.369
  958    HA   SER 118           HA       SER 118 -31.152   1.060 -10.080
  959   1HB   SER 118          2HB       SER 118 -29.127   1.077  -8.661
  960   2HB   SER 118          1HB       SER 118 -29.731  -0.559  -8.920
  961    HG   SER 118           HG       SER 118 -27.983  -1.040 -10.011
  962    H    SER 119           H        SER 119 -29.642   3.013  -9.374
  963    HA   SER 119           HA       SER 119 -29.056   4.437 -11.851
  964   1HB   SER 119          2HB       SER 119 -29.002   6.454 -10.393
  965   2HB   SER 119          1HB       SER 119 -30.524   5.570 -10.280
  966    HG   SER 119           HG       SER 119 -28.804   4.618  -8.464
  Start of MODEL   15
    1   1H    MET   1          1H        MET   1  -9.876  24.063 -10.185
    2   2H    MET   1          2H        MET   1 -11.496  24.548 -10.213
    3   3H    MET   1          3H        MET   1 -10.335  25.521  -9.462
    4    HA   MET   1           HA       MET   1 -10.960  26.427 -11.600
    5   1HB   MET   1          2HB       MET   1  -8.160  25.282 -11.537
    6   2HB   MET   1          1HB       MET   1  -8.689  26.622 -12.543
    7   1HG   MET   1          1HG       MET   1  -9.174  27.937 -10.546
    8   2HG   MET   1          2HG       MET   1  -8.649  26.592  -9.534
    9   1HE   MET   1          1HE       MET   1  -7.045  27.788 -12.931
   10   2HE   MET   1          2HE       MET   1  -5.840  28.936 -12.349
   11   3HE   MET   1          3HE       MET   1  -7.557  29.289 -12.162
   12    H    CYS   2           H        CYS   2 -10.301  23.060 -11.569
   13    HA   CYS   2           HA       CYS   2 -10.484  22.832 -14.474
   14   1HB   CYS   2          1HB       CYS   2 -10.056  20.715 -12.355
   15   2HB   CYS   2          2HB       CYS   2 -10.027  20.434 -14.093
   16    HG   CYS   2           HG       CYS   2  -7.757  22.164 -12.224
   17    H    ASN   3           H        ASN   3 -12.573  23.071 -11.941
   18    HA   ASN   3           HA       ASN   3 -14.792  22.691 -11.663
   19   1HB   ASN   3          1HB       ASN   3 -14.684  22.035 -14.615
   20   2HB   ASN   3          2HB       ASN   3 -16.165  22.254 -13.687
   21   1HD2  ASN   3          1HD2      ASN   3 -16.835  23.983 -14.927
   22   2HD2  ASN   3          2HD2      ASN   3 -16.086  25.537 -14.835
   23    H    THR   4           H        THR   4 -14.401  20.233 -14.173
   24    HA   THR   4           HA       THR   4 -14.867  18.002 -14.170
   25    HB   THR   4           HB       THR   4 -13.632  16.657 -12.536
   26    HG1  THR   4           1HG      THR   4 -13.758  17.706 -10.625
   27   1HG2  THR   4          1HG2      THR   4 -11.380  17.515 -13.002
   28   2HG2  THR   4          2HG2      THR   4 -12.074  19.057 -13.502
   29   3HG2  THR   4          3HG2      THR   4 -12.411  17.596 -14.432
   30    H    ASN   5           H        ASN   5 -17.123  19.101 -13.532
   31    HA   ASN   5           HA       ASN   5 -19.136  18.803 -12.523
   32   1HB   ASN   5          1HB       ASN   5 -17.867  16.216 -11.597
   33   2HB   ASN   5          2HB       ASN   5 -19.589  16.583 -11.537
   34   1HD2  ASN   5          2HD2      ASN   5 -18.172  14.456 -12.938
   35   2HD2  ASN   5          1HD2      ASN   5 -18.587  14.624 -14.606
   36    H    MET   6           H        MET   6 -20.030  17.870 -10.170
   37    HA   MET   6           HA       MET   6 -19.211  19.864  -8.345
   38   1HB   MET   6          2HB       MET   6 -21.484  18.932  -8.373
   39   2HB   MET   6          1HB       MET   6 -20.857  17.374  -7.852
   40   1HG   MET   6          2HG       MET   6 -21.851  18.569  -5.999
   41   2HG   MET   6          1HG       MET   6 -20.118  18.362  -5.753
   42   1HE   MET   6          1HE       MET   6 -22.064  22.335  -7.069
   43   2HE   MET   6          2HE       MET   6 -22.979  20.867  -6.724
   44   3HE   MET   6          3HE       MET   6 -21.917  20.933  -8.129
   45    H    SER   7           H        SER   7 -19.126  16.338  -7.807
   46    HA   SER   7           HA       SER   7 -16.419  16.547  -6.757
   47   1HB   SER   7          1HB       SER   7 -18.720  15.503  -5.088
   48   2HB   SER   7          2HB       SER   7 -17.017  15.420  -4.641
   49    HG   SER   7           HG       SER   7 -18.422  17.828  -5.165
   50    H    VAL   8           H        VAL   8 -18.150  15.172  -8.912
   51    HA   VAL   8           HA       VAL   8 -17.525  12.374  -8.320
   52    HB   VAL   8           HB       VAL   8 -19.062  13.558 -10.640
   53   1HG1  VAL   8          1HG2      VAL   8 -18.011  11.446 -11.233
   54   2HG1  VAL   8          2HG2      VAL   8 -19.756  11.247 -11.081
   55   3HG1  VAL   8          3HG2      VAL   8 -18.691  10.686  -9.793
   56   1HG2  VAL   8          1HG1      VAL   8 -20.224  13.860  -8.521
   57   2HG2  VAL   8          2HG1      VAL   8 -20.037  12.144  -8.160
   58   3HG2  VAL   8          3HG1      VAL   8 -21.042  12.657  -9.515
   59    HA   PRO   9           HA       PRO   9 -13.787  13.157 -10.755
   60   1HB   PRO   9          1HB       PRO   9 -12.596  10.789 -10.156
   61   2HB   PRO   9          2HB       PRO   9 -12.579  12.179  -9.065
   62   1HG   PRO   9          2HG       PRO   9 -14.347   9.761  -9.028
   63   2HG   PRO   9          1HG       PRO   9 -13.540  10.578  -7.676
   64   1HD   PRO   9          2HD       PRO   9 -16.157  10.955  -8.239
   65   2HD   PRO   9          1HD       PRO   9 -15.137  12.240  -7.562
   66    H    THR  10           H        THR  10 -14.714  13.059 -12.808
   67    HA   THR  10           HA       THR  10 -15.176  10.388 -13.940
   68    HB   THR  10           HB       THR  10 -16.288  11.551 -15.806
   69    HG1  THR  10           1HG      THR  10 -16.737  13.903 -15.233
   70   1HG2  THR  10          1HG2      THR  10 -18.250  12.350 -14.569
   71   2HG2  THR  10          2HG2      THR  10 -17.295  12.393 -13.086
   72   3HG2  THR  10          3HG2      THR  10 -17.622  10.853 -13.881
   73    H    ASP  11           H        ASP  11 -14.566  10.225 -16.330
   74    HA   ASP  11           HA       ASP  11 -12.912  10.038 -17.878
   75   1HB   ASP  11          2HB       ASP  11 -12.286  12.858 -16.978
   76   2HB   ASP  11          1HB       ASP  11 -11.679  12.101 -18.449
   77    H    GLY  12           H        GLY  12 -12.376   9.239 -15.096
   78   1HA   GLY  12          1HA       GLY  12 -10.604   8.249 -14.011
   79   2HA   GLY  12          2HA       GLY  12  -9.612   8.634 -15.409
   80    H    ALA  13           H        ALA  13  -8.275  10.386 -15.358
   81    HA   ALA  13           HA       ALA  13  -8.414  12.170 -13.037
   82   1HB   ALA  13          1HB       ALA  13  -5.911  10.701 -13.862
   83   2HB   ALA  13          2HB       ALA  13  -6.878  10.362 -12.428
   84   3HB   ALA  13          3HB       ALA  13  -6.037  11.904 -12.580
   85    H    VAL  14           H        VAL  14  -7.994  14.235 -13.520
   86    HA   VAL  14           HA       VAL  14  -7.233  14.872 -16.267
   87    HB   VAL  14           HB       VAL  14  -8.248  16.690 -14.076
   88   1HG1  VAL  14          1HG1      VAL  14  -8.625  18.298 -15.900
   89   2HG1  VAL  14          2HG1      VAL  14  -7.841  17.188 -17.025
   90   3HG1  VAL  14          3HG1      VAL  14  -6.917  17.903 -15.702
   91   1HG2  VAL  14          1HG2      VAL  14 -10.362  16.663 -15.320
   92   2HG2  VAL  14          2HG2      VAL  14  -9.925  15.058 -14.734
   93   3HG2  VAL  14          3HG2      VAL  14  -9.686  15.472 -16.431
   94    H    THR  15           H        THR  15  -6.456  16.211 -13.049
   95    HA   THR  15           HA       THR  15  -3.751  16.802 -14.054
   96    HB   THR  15           HB       THR  15  -5.257  18.149 -11.803
   97    HG1  THR  15           1HG      THR  15  -4.437  19.534 -14.080
   98   1HG2  THR  15          1HG2      THR  15  -3.390  19.746 -11.798
   99   2HG2  THR  15          2HG2      THR  15  -2.560  18.775 -13.013
  100   3HG2  THR  15          3HG2      THR  15  -2.845  18.116 -11.402
  101    H    THR  16           H        THR  16  -2.351  15.307 -13.391
  102    HA   THR  16           HA       THR  16  -2.817  13.759 -11.001
  103    HB   THR  16           HB       THR  16  -0.753  12.564 -11.610
  104    HG1  THR  16           1HG      THR  16  -0.487  13.846 -14.045
  105   1HG2  THR  16          1HG2      THR  16  -2.869  11.870 -12.622
  106   2HG2  THR  16          2HG2      THR  16  -1.528  11.634 -13.743
  107   3HG2  THR  16          3HG2      THR  16  -2.617  13.008 -13.946
  108    H    SER  17           H        SER  17  -1.912  14.023  -9.056
  109    HA   SER  17           HA       SER  17   0.565  15.482  -8.734
  110   1HB   SER  17          1HB       SER  17  -0.368  17.086  -7.104
  111   2HB   SER  17          2HB       SER  17  -1.073  17.306  -8.706
  112    HG   SER  17           HG       SER  17  -2.262  16.566  -6.355
  113    H    GLN  18           H        GLN  18  -1.060  12.867  -8.129
  114    HA   GLN  18           HA       GLN  18   0.344  12.233  -5.702
  115   1HB   GLN  18          1HB       GLN  18  -1.817  11.464  -4.582
  116   2HB   GLN  18          2HB       GLN  18  -1.472  13.186  -4.530
  117   1HG   GLN  18          2HG       GLN  18  -2.969  13.429  -6.534
  118   2HG   GLN  18          1HG       GLN  18  -3.391  11.724  -6.328
  119   1HE2  GLN  18          2HE2      GLN  18  -3.668  14.936  -5.015
  120   2HE2  GLN  18          1HE2      GLN  18  -4.942  14.592  -3.901
  121    H    ILE  19           H        ILE  19  -1.070  10.023  -4.900
  122    HA   ILE  19           HA       ILE  19  -2.152   8.766  -7.299
  123    HB   ILE  19           HB       ILE  19  -0.796   7.312  -5.808
  124   1HG1  ILE  19          1HG1      ILE  19  -2.654   5.557  -5.399
  125   2HG1  ILE  19          2HG1      ILE  19  -3.730   6.727  -6.156
  126   1HG2  ILE  19          1HG2      ILE  19  -1.734   8.682  -3.789
  127   2HG2  ILE  19          2HG2      ILE  19  -1.257   6.989  -3.591
  128   3HG2  ILE  19          3HG2      ILE  19  -2.964   7.412  -3.775
  129   1HD1  ILE  19          1HD1      ILE  19  -2.965   5.076  -7.754
  130   2HD1  ILE  19          2HD1      ILE  19  -1.288   5.503  -7.416
  131   3HD1  ILE  19          3HD1      ILE  19  -2.362   6.679  -8.174
  132    HA   PRO  20           HA       PRO  20  -6.000  10.547  -6.284
  133   1HB   PRO  20          1HB       PRO  20  -7.352   8.537  -7.905
  134   2HB   PRO  20          2HB       PRO  20  -7.076  10.243  -8.257
  135   1HG   PRO  20          1HG       PRO  20  -5.828   8.250  -9.607
  136   2HG   PRO  20          2HG       PRO  20  -5.085   9.835  -9.332
  137   1HD   PRO  20          2HD       PRO  20  -4.641   7.257  -7.862
  138   2HD   PRO  20          1HD       PRO  20  -3.452   8.463  -8.393
  139    H    ALA  21           H        ALA  21  -5.019   8.078  -4.717
  140    HA   ALA  21           HA       ALA  21  -7.528   7.753  -3.285
  141   1HB   ALA  21          1HB       ALA  21  -7.323   5.330  -3.140
  142   2HB   ALA  21          2HB       ALA  21  -5.908   5.376  -4.192
  143   3HB   ALA  21          3HB       ALA  21  -7.489   5.847  -4.818
  144    H    SER  22           H        SER  22  -6.971   8.519  -1.358
  145    HA   SER  22           HA       SER  22  -4.480   7.586  -0.118
  146   1HB   SER  22          1HB       SER  22  -4.018   9.889   0.677
  147   2HB   SER  22          2HB       SER  22  -3.980   9.773  -1.082
  148    HG   SER  22           HG       SER  22  -6.350  10.414  -0.796
  149    H    GLU  23           H        GLU  23  -5.356   6.383   1.470
  150    HA   GLU  23           HA       GLU  23  -6.594   5.740   3.257
  151   1HB   GLU  23          1HB       GLU  23  -6.145   8.653   3.704
  152   2HB   GLU  23          2HB       GLU  23  -7.169   7.762   4.824
  153   1HG   GLU  23          2HG       GLU  23  -5.316   6.221   5.262
  154   2HG   GLU  23          1HG       GLU  23  -4.300   7.137   4.151
  155    H    GLN  24           H        GLN  24  -7.917   7.097   0.723
  156    HA   GLN  24           HA       GLN  24 -10.630   6.722   1.718
  157   1HB   GLN  24          2HB       GLN  24  -9.724   9.273   0.374
  158   2HB   GLN  24          1HB       GLN  24 -11.407   8.828   0.619
  159   1HG   GLN  24          1HG       GLN  24  -9.525   8.987   2.934
  160   2HG   GLN  24          2HG       GLN  24 -10.265  10.443   2.272
  161   1HE2  GLN  24          1HE2      GLN  24 -11.890   7.352   2.301
  162   2HE2  GLN  24          2HE2      GLN  24 -13.072   7.767   3.489
  163    H    GLU  25           H        GLU  25 -11.222   5.092   0.389
  164    HA   GLU  25           HA       GLU  25 -11.471   5.381  -2.398
  165   1HB   GLU  25          2HB       GLU  25  -9.678   3.740  -3.062
  166   2HB   GLU  25          1HB       GLU  25  -9.099   5.319  -2.548
  167   1HG   GLU  25          2HG       GLU  25  -8.475   4.450  -0.397
  168   2HG   GLU  25          1HG       GLU  25  -9.192   2.885  -0.780
  169    H    THR  26           H        THR  26 -10.931   2.986   0.226
  170    HA   THR  26           HA       THR  26 -12.416   0.987  -1.287
  171    HB   THR  26           HB       THR  26  -9.445   0.726  -0.834
  172    HG1  THR  26           1HG      THR  26  -9.315   1.020  -3.102
  173   1HG2  THR  26          1HG2      THR  26 -11.402  -0.996  -2.370
  174   2HG2  THR  26          2HG2      THR  26 -10.657  -1.406  -0.825
  175   3HG2  THR  26          3HG2      THR  26  -9.659  -1.254  -2.272
  176    H    LEU  27           H        LEU  27 -13.517  -0.145   0.235
  177    HA   LEU  27           HA       LEU  27 -12.160  -0.994   2.655
  178   1HB   LEU  27          1HB       LEU  27 -14.799  -0.674   2.107
  179   2HB   LEU  27          2HB       LEU  27 -14.618  -2.391   1.797
  180    HG   LEU  27           HG       LEU  27 -15.251  -2.329   4.035
  181   1HD1  LEU  27          1HD1      LEU  27 -12.234  -2.276   4.067
  182   2HD1  LEU  27          2HD1      LEU  27 -13.253  -3.693   3.776
  183   3HD1  LEU  27          3HD1      LEU  27 -13.260  -2.908   5.357
  184   1HD2  LEU  27          1HD2      LEU  27 -14.353  -0.743   5.674
  185   2HD2  LEU  27          2HD2      LEU  27 -15.133   0.081   4.323
  186   3HD2  LEU  27          3HD2      LEU  27 -13.373  -0.003   4.407
  187    H    VAL  28           H        VAL  28 -10.407  -2.144   1.962
  188    HA   VAL  28           HA       VAL  28 -10.770  -3.869  -0.371
  189    HB   VAL  28           HB       VAL  28  -9.010  -2.482  -0.869
  190   1HG1  VAL  28          1HG1      VAL  28  -8.296  -2.644   2.039
  191   2HG1  VAL  28          2HG1      VAL  28  -8.903  -1.244   1.140
  192   3HG1  VAL  28          3HG1      VAL  28  -7.271  -1.852   0.838
  193   1HG2  VAL  28          1HG2      VAL  28  -6.886  -3.710  -0.584
  194   2HG2  VAL  28          2HG2      VAL  28  -8.204  -4.751  -1.123
  195   3HG2  VAL  28          3HG2      VAL  28  -7.687  -4.784   0.564
  196    H    ARG  29           H        ARG  29 -10.508  -6.004  -0.326
  197    HA   ARG  29           HA       ARG  29  -9.835  -7.185   2.273
  198   1HB   ARG  29          1HB       ARG  29 -12.136  -8.125   0.563
  199   2HB   ARG  29          2HB       ARG  29 -11.791  -8.541   2.236
  200   1HG   ARG  29          1HG       ARG  29 -12.307  -6.259   2.923
  201   2HG   ARG  29          2HG       ARG  29 -12.623  -5.813   1.245
  202   1HD   ARG  29          1HD       ARG  29 -14.134  -7.883   2.839
  203   2HD   ARG  29          2HD       ARG  29 -14.696  -6.253   2.470
  204    HE   ARG  29           HE       ARG  29 -14.038  -7.666   0.099
  205   1HH1  ARG  29          2HH1      ARG  29 -16.482  -7.389   2.567
  206   2HH1  ARG  29          1HH1      ARG  29 -17.764  -7.933   1.540
  207   1HH2  ARG  29          1HH2      ARG  29 -15.721  -8.384  -1.262
  208   2HH2  ARG  29          2HH2      ARG  29 -17.333  -8.500  -0.637
  209    HA   PRO  30           HA       PRO  30  -7.656  -9.024  -1.434
  210   1HB   PRO  30          2HB       PRO  30  -5.347  -9.104   0.399
  211   2HB   PRO  30          1HB       PRO  30  -5.474  -8.405  -1.217
  212   1HG   PRO  30          2HG       PRO  30  -5.315  -6.860   0.966
  213   2HG   PRO  30          1HG       PRO  30  -6.309  -6.399  -0.430
  214   1HD   PRO  30          1HD       PRO  30  -7.151  -7.601   2.183
  215   2HD   PRO  30          2HD       PRO  30  -7.917  -6.304   1.241
  216    H    LYS  31           H        LYS  31  -7.463 -11.148  -1.871
  217    HA   LYS  31           HA       LYS  31  -7.711 -13.171   0.117
  218   1HB   LYS  31          1HB       LYS  31  -6.737 -13.363  -2.742
  219   2HB   LYS  31          2HB       LYS  31  -7.174 -14.727  -1.723
  220   1HG   LYS  31          2HG       LYS  31  -9.052 -12.535  -2.576
  221   2HG   LYS  31          1HG       LYS  31  -8.940 -14.131  -3.319
  222   1HD   LYS  31          2HD       LYS  31  -9.562 -15.167  -1.190
  223   2HD   LYS  31          1HD       LYS  31  -9.671 -13.570  -0.445
  224   1HE   LYS  31          2HE       LYS  31 -11.348 -14.569  -2.744
  225   2HE   LYS  31          1HE       LYS  31 -11.877 -14.421  -1.068
  226   1HZ   LYS  31          1HZ       LYS  31 -11.515 -12.033  -1.205
  227   2HZ   LYS  31          2HZ       LYS  31 -12.613 -12.543  -2.388
  228   3HZ   LYS  31          3HZ       LYS  31 -11.018 -12.179  -2.816
  229    HA   PRO  32           HA       PRO  32  -3.842 -13.760   1.946
  230   1HB   PRO  32          1HB       PRO  32  -3.226 -16.380   1.012
  231   2HB   PRO  32          2HB       PRO  32  -3.942 -15.929   2.560
  232   1HG   PRO  32          1HG       PRO  32  -5.249 -16.886   0.078
  233   2HG   PRO  32          2HG       PRO  32  -5.766 -17.060   1.765
  234   1HD   PRO  32          1HD       PRO  32  -6.995 -15.362   0.092
  235   2HD   PRO  32          2HD       PRO  32  -6.757 -14.962   1.807
  236    H    LEU  33           H        LEU  33  -2.553 -12.313   0.854
  237    HA   LEU  33           HA       LEU  33  -0.587 -13.387  -0.944
  238   1HB   LEU  33          2HB       LEU  33  -2.567 -12.897  -2.416
  239   2HB   LEU  33          1HB       LEU  33  -2.395 -11.208  -1.982
  240    HG   LEU  33           HG       LEU  33  -0.122 -11.216  -2.980
  241   1HD1  LEU  33          1HD2      LEU  33  -0.880 -13.997  -3.863
  242   2HD1  LEU  33          2HD2      LEU  33   0.393 -13.578  -2.716
  243   3HD1  LEU  33          3HD2      LEU  33   0.535 -13.096  -4.406
  244   1HD2  LEU  33          1HD1      LEU  33  -0.861 -11.274  -5.306
  245   2HD2  LEU  33          2HD1      LEU  33  -2.044 -10.466  -4.279
  246   3HD2  LEU  33          3HD1      LEU  33  -2.332 -12.118  -4.821
  247    H    LEU  34           H        LEU  34  -2.076 -10.404   0.286
  248    HA   LEU  34           HA       LEU  34   0.640  -9.439   0.894
  249   1HB   LEU  34          2HB       LEU  34  -0.097  -7.191   0.589
  250   2HB   LEU  34          1HB       LEU  34  -0.577  -8.106  -0.827
  251    HG   LEU  34           HG       LEU  34  -2.833  -8.321   0.628
  252   1HD1  LEU  34          1HD1      LEU  34  -3.321  -6.350   1.830
  253   2HD1  LEU  34          2HD1      LEU  34  -1.853  -5.553   1.265
  254   3HD1  LEU  34          3HD1      LEU  34  -1.744  -6.894   2.406
  255   1HD2  LEU  34          1HD2      LEU  34  -2.068  -6.011  -1.151
  256   2HD2  LEU  34          2HD2      LEU  34  -3.715  -6.488  -0.737
  257   3HD2  LEU  34          3HD2      LEU  34  -2.691  -7.575  -1.676
  258    H    LEU  35           H        LEU  35  -1.926 -10.831   2.263
  259    HA   LEU  35           HA       LEU  35  -2.067  -9.143   4.635
  260   1HB   LEU  35          2HB       LEU  35  -3.389 -11.825   4.282
  261   2HB   LEU  35          1HB       LEU  35  -3.840 -10.534   5.374
  262    HG   LEU  35           HG       LEU  35  -5.482 -10.473   3.722
  263   1HD1  LEU  35          1HD1      LEU  35  -3.567  -8.507   2.531
  264   2HD1  LEU  35          2HD1      LEU  35  -4.208  -8.286   4.157
  265   3HD1  LEU  35          3HD1      LEU  35  -5.308  -8.359   2.781
  266   1HD2  LEU  35          1HD2      LEU  35  -4.974 -10.532   1.309
  267   2HD2  LEU  35          2HD2      LEU  35  -4.509 -12.005   2.158
  268   3HD2  LEU  35          3HD2      LEU  35  -3.280 -10.826   1.703
  269    H    LYS  36           H        LYS  36  -0.950 -12.384   3.691
  270    HA   LYS  36           HA       LYS  36   0.508 -12.982   6.010
  271   1HB   LYS  36          1HB       LYS  36   1.082 -13.497   3.091
  272   2HB   LYS  36          2HB       LYS  36   2.087 -14.117   4.388
  273   1HG   LYS  36          1HG       LYS  36   0.185 -15.358   5.280
  274   2HG   LYS  36          2HG       LYS  36  -0.835 -14.722   3.989
  275   1HD   LYS  36          1HD       LYS  36  -0.131 -16.950   3.407
  276   2HD   LYS  36          2HD       LYS  36   0.666 -15.797   2.335
  277   1HE   LYS  36          1HE       LYS  36   2.689 -15.924   3.708
  278   2HE   LYS  36          2HE       LYS  36   1.892 -17.079   4.775
  279   1HZ   LYS  36          1HZ       LYS  36   1.698 -18.608   2.912
  280   2HZ   LYS  36          2HZ       LYS  36   3.316 -18.193   3.180
  281   3HZ   LYS  36          3HZ       LYS  36   2.469 -17.501   1.891
  282    H    LEU  37           H        LEU  37   0.661 -10.355   3.952
  283    HA   LEU  37           HA       LEU  37   3.498  -9.822   4.411
  284   1HB   LEU  37          2HB       LEU  37   2.623  -9.661   2.116
  285   2HB   LEU  37          1HB       LEU  37   1.473  -8.444   2.639
  286    HG   LEU  37           HG       LEU  37   4.329  -7.852   3.153
  287   1HD1  LEU  37          1HD2      LEU  37   4.447  -8.839   0.929
  288   2HD1  LEU  37          2HD2      LEU  37   4.687  -7.094   0.859
  289   3HD1  LEU  37          3HD2      LEU  37   3.138  -7.791   0.385
  290   1HD2  LEU  37          1HD1      LEU  37   3.642  -5.669   2.936
  291   2HD2  LEU  37          2HD1      LEU  37   2.178  -6.440   3.564
  292   3HD2  LEU  37          3HD1      LEU  37   2.323  -6.083   1.841
  293    H    LEU  38           H        LEU  38   0.352  -8.872   5.435
  294    HA   LEU  38           HA       LEU  38   1.435  -6.448   6.707
  295   1HB   LEU  38          1HB       LEU  38  -1.391  -7.134   5.918
  296   2HB   LEU  38          2HB       LEU  38  -0.945  -5.702   6.827
  297    HG   LEU  38           HG       LEU  38  -0.215  -6.368   3.977
  298   1HD1  LEU  38          1HD2      LEU  38  -1.446  -4.361   3.449
  299   2HD1  LEU  38          2HD2      LEU  38  -1.743  -4.058   5.161
  300   3HD1  LEU  38          3HD2      LEU  38  -2.469  -5.461   4.373
  301   1HD2  LEU  38          1HD1      LEU  38   1.716  -5.388   5.081
  302   2HD2  LEU  38          2HD1      LEU  38   0.718  -4.060   5.673
  303   3HD2  LEU  38          3HD1      LEU  38   0.998  -4.249   3.942
  304    H    LYS  39           H        LYS  39  -0.900  -9.084   7.253
  305    HA   LYS  39           HA       LYS  39  -1.131  -8.854  10.024
  306   1HB   LYS  39          1HB       LYS  39  -1.064 -11.427   8.441
  307   2HB   LYS  39          2HB       LYS  39  -1.807 -11.178  10.016
  308   1HG   LYS  39          2HG       LYS  39  -3.426  -9.657   9.032
  309   2HG   LYS  39          1HG       LYS  39  -2.665  -9.848   7.454
  310   1HD   LYS  39          1HD       LYS  39  -4.000 -12.027   9.055
  311   2HD   LYS  39          2HD       LYS  39  -4.667 -11.218   7.632
  312   1HE   LYS  39          1HE       LYS  39  -2.850 -12.079   6.266
  313   2HE   LYS  39          2HE       LYS  39  -2.134 -12.854   7.679
  314   1HZ   LYS  39          1HZ       LYS  39  -3.392 -14.429   6.355
  315   2HZ   LYS  39          2HZ       LYS  39  -4.792 -13.493   6.516
  316   3HZ   LYS  39          3HZ       LYS  39  -4.111 -14.234   7.876
  317    H    SER  40           H        SER  40   1.580  -9.578   8.135
  318    HA   SER  40           HA       SER  40   3.039 -11.040  10.143
  319   1HB   SER  40          2HB       SER  40   3.577 -11.340   7.771
  320   2HB   SER  40          1HB       SER  40   3.999  -9.632   7.639
  321    HG   SER  40           HG       SER  40   5.408 -11.734   8.781
  322    H    VAL  41           H        VAL  41   3.134  -7.715   8.864
  323    HA   VAL  41           HA       VAL  41   5.097  -6.633  10.489
  324    HB   VAL  41           HB       VAL  41   2.784  -4.855  10.226
  325   1HG1  VAL  41          1HG2      VAL  41   4.364  -3.311   9.480
  326   2HG1  VAL  41          2HG2      VAL  41   5.471  -4.569   8.924
  327   3HG1  VAL  41          3HG2      VAL  41   5.240  -4.297  10.652
  328   1HG2  VAL  41          1HG1      VAL  41   3.125  -4.679   7.706
  329   2HG2  VAL  41          2HG1      VAL  41   2.160  -6.027   8.313
  330   3HG2  VAL  41          3HG1      VAL  41   3.834  -6.293   7.814
  331    H    GLY  42           H        GLY  42   1.713  -7.266  11.183
  332   1HA   GLY  42          1HA       GLY  42   1.713  -7.506  13.880
  333   2HA   GLY  42          2HA       GLY  42   1.758  -5.765  13.641
  334    H    ALA  43           H        ALA  43   0.217  -6.371  11.031
  335    HA   ALA  43           HA       ALA  43  -2.339  -5.688  11.921
  336   1HB   ALA  43          1HB       ALA  43  -1.575  -5.350   9.622
  337   2HB   ALA  43          2HB       ALA  43  -3.103  -6.230   9.671
  338   3HB   ALA  43          3HB       ALA  43  -1.598  -7.093   9.358
  339    H    GLN  44           H        GLN  44  -4.343  -6.956  11.710
  340    HA   GLN  44           HA       GLN  44  -4.341  -9.782  11.698
  341   1HB   GLN  44          2HB       GLN  44  -3.236  -9.428  13.890
  342   2HB   GLN  44          1HB       GLN  44  -4.639  -8.512  14.426
  343   1HG   GLN  44          1HG       GLN  44  -6.035 -10.499  14.169
  344   2HG   GLN  44          2HG       GLN  44  -4.629 -11.416  13.631
  345   1HE2  GLN  44          1HE2      GLN  44  -3.038 -11.976  15.119
  346   2HE2  GLN  44          2HE2      GLN  44  -3.312 -11.914  16.822
  347    H    LYS  45           H        LYS  45  -5.991  -8.998  10.203
  348    HA   LYS  45           HA       LYS  45  -8.556  -8.548  11.564
  349   1HB   LYS  45          2HB       LYS  45  -7.672  -7.082   9.072
  350   2HB   LYS  45          1HB       LYS  45  -9.202  -6.888   9.913
  351   1HG   LYS  45          2HG       LYS  45  -8.211  -5.788  11.719
  352   2HG   LYS  45          1HG       LYS  45  -6.593  -6.341  11.279
  353   1HD   LYS  45          1HD       LYS  45  -6.882  -3.979  10.745
  354   2HD   LYS  45          2HD       LYS  45  -6.655  -4.933   9.278
  355   1HE   LYS  45          2HE       LYS  45  -8.415  -3.283   8.969
  356   2HE   LYS  45          1HE       LYS  45  -9.069  -4.919   8.893
  357   1HZ   LYS  45          1HZ       LYS  45  -9.194  -3.115  11.249
  358   2HZ   LYS  45          2HZ       LYS  45  -9.821  -4.685  11.178
  359   3HZ   LYS  45          3HZ       LYS  45 -10.479  -3.468  10.206
  360    H    ASP  46           H        ASP  46 -10.428  -8.902  10.023
  361    HA   ASP  46           HA       ASP  46  -9.965 -11.248   8.374
  362   1HB   ASP  46          2HB       ASP  46 -12.516  -9.734   8.981
  363   2HB   ASP  46          1HB       ASP  46 -12.421 -11.257   8.102
  364    H    THR  47           H        THR  47 -10.426  -7.842   8.031
  365    HA   THR  47           HA       THR  47  -9.993  -8.125   5.140
  366    HB   THR  47           HB       THR  47 -11.488  -6.219   4.684
  367    HG1  THR  47           1HG      THR  47 -11.837  -6.357   7.476
  368   1HG2  THR  47          1HG2      THR  47 -12.913  -8.439   6.151
  369   2HG2  THR  47          2HG2      THR  47 -12.363  -8.510   4.475
  370   3HG2  THR  47          3HG2      THR  47 -13.613  -7.358   4.945
  371    H    TYR  48           H        TYR  48  -9.657  -5.709   4.292
  372    HA   TYR  48           HA       TYR  48  -8.124  -4.167   6.252
  373   1HB   TYR  48          2HB       TYR  48  -7.194  -5.118   3.563
  374   2HB   TYR  48          1HB       TYR  48  -6.541  -3.648   4.277
  375    HD1  TYR  48           1HD      TYR  48  -4.952  -3.724   6.000
  376    HD2  TYR  48           2HD      TYR  48  -6.897  -7.299   4.759
  377    HE1  TYR  48           1HE      TYR  48  -3.333  -5.045   7.301
  378    HE2  TYR  48           2HE      TYR  48  -5.270  -8.635   6.042
  379    HH   TYR  48           HH       TYR  48  -2.966  -8.374   6.933
  380    H    THR  49           H        THR  49  -7.470  -1.983   5.068
  381    HA   THR  49           HA       THR  49  -9.530  -1.119   3.222
  382    HB   THR  49           HB       THR  49  -9.273   0.753   5.484
  383    HG1  THR  49           1HG      THR  49  -9.464  -1.335   6.532
  384   1HG2  THR  49          1HG2      THR  49 -11.657   1.041   5.071
  385   2HG2  THR  49          2HG2      THR  49 -11.639  -0.322   3.951
  386   3HG2  THR  49          3HG2      THR  49 -10.747   1.148   3.564
  387    H    MET  50           H        MET  50  -9.005   1.704   3.961
  388    HA   MET  50           HA       MET  50  -7.032   1.887   1.869
  389   1HB   MET  50          1HB       MET  50  -8.298   4.298   3.058
  390   2HB   MET  50          2HB       MET  50  -8.005   3.898   1.367
  391   1HG   MET  50          2HG       MET  50  -9.942   2.730   1.158
  392   2HG   MET  50          1HG       MET  50  -9.982   2.273   2.857
  393   1HE   MET  50          1HE       MET  50 -13.330   4.254   2.445
  394   2HE   MET  50          2HE       MET  50 -12.587   2.742   2.964
  395   3HE   MET  50          3HE       MET  50 -12.574   3.190   1.259
  396    H    LYS  51           H        LYS  51  -7.430   3.054   5.188
  397    HA   LYS  51           HA       LYS  51  -4.895   4.447   5.138
  398   1HB   LYS  51          2HB       LYS  51  -5.398   4.952   7.507
  399   2HB   LYS  51          1HB       LYS  51  -6.715   5.406   6.432
  400   1HG   LYS  51          2HG       LYS  51  -7.926   3.380   7.053
  401   2HG   LYS  51          1HG       LYS  51  -6.603   2.920   8.128
  402   1HD   LYS  51          2HD       LYS  51  -6.967   4.955   9.443
  403   2HD   LYS  51          1HD       LYS  51  -8.293   5.408   8.370
  404   1HE   LYS  51          1HE       LYS  51  -9.504   3.381   9.008
  405   2HE   LYS  51          2HE       LYS  51  -8.178   2.924  10.076
  406   1HZ   LYS  51          1HZ       LYS  51  -9.856   5.359  10.348
  407   2HZ   LYS  51          2HZ       LYS  51  -8.582   4.925  11.372
  408   3HZ   LYS  51          3HZ       LYS  51  -9.974   3.966  11.302
  409    H    GLU  52           H        GLU  52  -6.262   1.492   6.414
  410    HA   GLU  52           HA       GLU  52  -4.125   0.500   7.882
  411   1HB   GLU  52          2HB       GLU  52  -6.537  -0.445   7.285
  412   2HB   GLU  52          1HB       GLU  52  -5.622  -1.339   6.079
  413   1HG   GLU  52          2HG       GLU  52  -5.853  -2.707   8.017
  414   2HG   GLU  52          1HG       GLU  52  -4.167  -2.207   7.882
  415    H    VAL  53           H        VAL  53  -4.870  -0.497   4.538
  416    HA   VAL  53           HA       VAL  53  -2.394  -1.623   3.978
  417    HB   VAL  53           HB       VAL  53  -4.267  -0.288   2.017
  418   1HG1  VAL  53          1HG2      VAL  53  -3.230  -1.754   0.350
  419   2HG1  VAL  53          2HG2      VAL  53  -2.103  -2.341   1.573
  420   3HG1  VAL  53          3HG2      VAL  53  -2.054  -0.652   1.067
  421   1HG2  VAL  53          1HG1      VAL  53  -5.425  -1.982   3.280
  422   2HG2  VAL  53          2HG1      VAL  53  -4.118  -3.134   3.001
  423   3HG2  VAL  53          3HG1      VAL  53  -5.115  -2.584   1.652
  424    H    LEU  54           H        LEU  54  -3.413   1.721   3.889
  425    HA   LEU  54           HA       LEU  54  -1.455   2.907   2.358
  426   1HB   LEU  54          2HB       LEU  54  -3.433   3.941   3.671
  427   2HB   LEU  54          1HB       LEU  54  -2.292   4.078   4.993
  428    HG   LEU  54           HG       LEU  54  -2.551   6.171   3.691
  429   1HD1  LEU  54          1HD1      LEU  54   0.189   4.923   3.536
  430   2HD1  LEU  54          2HD1      LEU  54  -0.496   5.758   4.930
  431   3HD1  LEU  54          3HD1      LEU  54  -0.169   6.648   3.442
  432   1HD2  LEU  54          1HD2      LEU  54  -1.294   4.574   1.465
  433   2HD2  LEU  54          2HD2      LEU  54  -1.575   6.315   1.453
  434   3HD2  LEU  54          3HD2      LEU  54  -2.941   5.202   1.496
  435    H    PHE  55           H        PHE  55  -1.216   2.929   5.913
  436    HA   PHE  55           HA       PHE  55   1.593   3.388   5.751
  437   1HB   PHE  55          2HB       PHE  55   1.564   3.632   8.094
  438   2HB   PHE  55          1HB       PHE  55  -0.004   4.229   7.565
  439    HD1  PHE  55           1HD      PHE  55  -2.022   2.800   7.859
  440    HD2  PHE  55           2HD      PHE  55   1.745   1.796   9.562
  441    HE1  PHE  55           1HE      PHE  55  -3.141   1.262   9.418
  442    HE2  PHE  55           2HE      PHE  55   0.634   0.254  11.122
  443    HZ   PHE  55           HZ       PHE  55  -1.812  -0.014  11.053
  444    H    TYR  56           H        TYR  56  -0.416   0.576   6.371
  445    HA   TYR  56           HA       TYR  56   1.538  -1.001   7.631
  446   1HB   TYR  56          1HB       TYR  56  -1.162  -1.371   6.655
  447   2HB   TYR  56          2HB       TYR  56  -0.171  -2.792   6.349
  448    HD1  TYR  56           1HD      TYR  56  -2.572  -2.214   8.351
  449    HD2  TYR  56           2HD      TYR  56   1.650  -2.542   8.753
  450    HE1  TYR  56           1HE      TYR  56  -2.859  -2.913  10.688
  451    HE2  TYR  56           2HE      TYR  56   1.385  -3.249  11.091
  452    HH   TYR  56           HH       TYR  56  -0.285  -3.044  12.898
  453    H    LEU  57           H        LEU  57   0.424  -1.073   4.235
  454    HA   LEU  57           HA       LEU  57   2.415  -2.850   3.337
  455   1HB   LEU  57          2HB       LEU  57   0.286  -1.586   2.176
  456   2HB   LEU  57          1HB       LEU  57   1.625  -0.705   1.474
  457    HG   LEU  57           HG       LEU  57   1.057  -2.451  -0.040
  458   1HD1  LEU  57          1HD1      LEU  57   3.441  -2.107   0.198
  459   2HD1  LEU  57          2HD1      LEU  57   3.101  -3.813  -0.092
  460   3HD1  LEU  57          3HD1      LEU  57   3.497  -3.257   1.534
  461   1HD2  LEU  57          1HD2      LEU  57   1.270  -4.351   2.287
  462   2HD2  LEU  57          2HD2      LEU  57   0.982  -4.805   0.608
  463   3HD2  LEU  57          3HD2      LEU  57  -0.216  -3.850   1.483
  464    H    GLY  58           H        GLY  58   2.317   0.687   3.582
  465   1HA   GLY  58          2HA       GLY  58   4.902   1.307   2.782
  466   2HA   GLY  58          1HA       GLY  58   4.022   2.149   4.051
  467    H    GLN  59           H        GLN  59   3.795  -0.223   5.751
  468    HA   GLN  59           HA       GLN  59   6.228   0.044   7.179
  469   1HB   GLN  59          1HB       GLN  59   4.046  -2.029   7.480
  470   2HB   GLN  59          2HB       GLN  59   5.354  -1.767   8.622
  471   1HG   GLN  59          2HG       GLN  59   3.078   0.071   7.979
  472   2HG   GLN  59          1HG       GLN  59   3.451  -0.706   9.505
  473   1HE2  GLN  59          1HE2      GLN  59   4.881   0.178  10.841
  474   2HE2  GLN  59          2HE2      GLN  59   5.626   1.718  10.610
  475    H    TYR  60           H        TYR  60   4.823  -2.896   5.679
  476    HA   TYR  60           HA       TYR  60   7.027  -4.487   6.238
  477   1HB   TYR  60          1HB       TYR  60   4.901  -5.469   5.630
  478   2HB   TYR  60          2HB       TYR  60   4.999  -4.773   4.016
  479    HD1  TYR  60           1HD      TYR  60   6.293  -7.387   6.243
  480    HD2  TYR  60           2HD      TYR  60   6.406  -5.739   2.323
  481    HE1  TYR  60           1HE      TYR  60   7.437  -9.406   5.434
  482    HE2  TYR  60           2HE      TYR  60   7.547  -7.754   1.502
  483    HH   TYR  60           HH       TYR  60   8.930  -9.579   2.388
  484    H    ILE  61           H        ILE  61   6.541  -2.251   3.613
  485    HA   ILE  61           HA       ILE  61   8.792  -2.995   2.054
  486    HB   ILE  61           HB       ILE  61   7.693  -0.210   2.439
  487   1HG1  ILE  61          2HG1      ILE  61   6.938  -2.131   0.246
  488   2HG1  ILE  61          1HG1      ILE  61   6.023  -2.025   1.747
  489   1HG2  ILE  61          1HG2      ILE  61   9.337  -1.472   0.252
  490   2HG2  ILE  61          2HG2      ILE  61   9.825  -0.176   1.345
  491   3HG2  ILE  61          3HG2      ILE  61   8.576   0.115   0.131
  492   1HD1  ILE  61          1HD1      ILE  61   5.774   0.434   1.268
  493   2HD1  ILE  61          2HD1      ILE  61   4.902  -0.664   0.197
  494   3HD1  ILE  61          3HD1      ILE  61   6.403   0.088  -0.344
  495    H    MET  62           H        MET  62   8.517  -0.158   4.199
  496    HA   MET  62           HA       MET  62  11.369  -0.043   4.544
  497   1HB   MET  62          1HB       MET  62  10.967   1.908   5.890
  498   2HB   MET  62          2HB       MET  62   9.911   1.976   4.487
  499   1HG   MET  62          2HG       MET  62   8.050   1.171   5.857
  500   2HG   MET  62          1HG       MET  62   9.112   1.134   7.262
  501   1HE   MET  62          1HE       MET  62   9.954   4.929   7.739
  502   2HE   MET  62          2HE       MET  62  10.873   3.744   6.812
  503   3HE   MET  62          3HE       MET  62  10.179   3.299   8.371
  504    H    THR  63           H        THR  63   9.738  -2.397   5.577
  505    HA   THR  63           HA       THR  63  11.165  -2.580   8.120
  506    HB   THR  63           HB       THR  63   8.259  -3.389   7.904
  507    HG1  THR  63           1HG      THR  63   7.995  -1.555   9.379
  508   1HG2  THR  63          1HG2      THR  63   8.424  -3.631  10.343
  509   2HG2  THR  63          2HG2      THR  63  10.135  -3.211  10.266
  510   3HG2  THR  63          3HG2      THR  63   9.556  -4.696   9.510
  511    H    LYS  64           H        LYS  64  11.386  -4.833   8.862
  512    HA   LYS  64           HA       LYS  64  11.982  -7.001   8.480
  513   1HB   LYS  64          2HB       LYS  64   9.505  -6.736   6.791
  514   2HB   LYS  64          1HB       LYS  64  10.394  -8.252   6.876
  515   1HG   LYS  64          2HG       LYS  64   9.522  -6.895   9.385
  516   2HG   LYS  64          1HG       LYS  64   8.380  -7.860   8.444
  517   1HD   LYS  64          1HD       LYS  64   9.876  -9.782   8.582
  518   2HD   LYS  64          2HD       LYS  64  11.035  -8.820   9.505
  519   1HE   LYS  64          2HE       LYS  64   9.711 -10.238  10.976
  520   2HE   LYS  64          1HE       LYS  64   9.390  -8.531  11.283
  521   1HZ   LYS  64          1HZ       LYS  64   7.356  -9.852  11.244
  522   2HZ   LYS  64          2HZ       LYS  64   7.676 -10.325   9.652
  523   3HZ   LYS  64          3HZ       LYS  64   7.363  -8.702  10.002
  524    H    ARG  65           H        ARG  65  13.550  -5.220   7.125
  525    HA   ARG  65           HA       ARG  65  14.950  -4.920   5.357
  526   1HB   ARG  65          1HB       ARG  65  15.099  -7.510   5.802
  527   2HB   ARG  65          2HB       ARG  65  14.243  -7.619   4.270
  528   1HG   ARG  65          2HG       ARG  65  16.039  -6.325   3.198
  529   2HG   ARG  65          1HG       ARG  65  16.905  -6.293   4.734
  530   1HD   ARG  65          2HD       ARG  65  16.154  -8.759   3.171
  531   2HD   ARG  65          1HD       ARG  65  17.764  -8.048   3.272
  532    HE   ARG  65           HE       ARG  65  16.888  -8.577   5.869
  533   1HH1  ARG  65          2HH1      ARG  65  17.761 -10.315   2.978
  534   2HH1  ARG  65          1HH1      ARG  65  18.309 -11.717   3.832
  535   1HH2  ARG  65          1HH2      ARG  65  17.607 -10.419   7.002
  536   2HH2  ARG  65          2HH2      ARG  65  18.221 -11.777   6.120
  537    H    LEU  66           H        LEU  66  14.611  -6.127   2.692
  538    HA   LEU  66           HA       LEU  66  13.532  -5.802   0.729
  539   1HB   LEU  66          1HB       LEU  66  11.234  -5.505   2.630
  540   2HB   LEU  66          2HB       LEU  66  11.022  -5.182   0.922
  541    HG   LEU  66           HG       LEU  66  10.298  -7.401   1.256
  542   1HD1  LEU  66          1HD1      LEU  66  11.815  -8.710  -0.088
  543   2HD1  LEU  66          2HD1      LEU  66  13.126  -7.579   0.240
  544   3HD1  LEU  66          3HD1      LEU  66  11.732  -7.062  -0.709
  545   1HD2  LEU  66          1HD2      LEU  66  11.284  -7.761   3.461
  546   2HD2  LEU  66          2HD2      LEU  66  12.877  -7.934   2.722
  547   3HD2  LEU  66          3HD2      LEU  66  11.612  -9.115   2.376
  548    H    TYR  67           H        TYR  67  14.993  -3.956   0.608
  549    HA   TYR  67           HA       TYR  67  13.746  -1.691  -0.400
  550   1HB   TYR  67          2HB       TYR  67  13.992  -0.010   1.254
  551   2HB   TYR  67          1HB       TYR  67  13.216  -1.364   2.069
  552    HD1  TYR  67           1HD      TYR  67  15.015  -3.088   3.142
  553    HD2  TYR  67           2HD      TYR  67  15.656   1.055   2.398
  554    HE1  TYR  67           1HE      TYR  67  16.785  -3.055   4.854
  555    HE2  TYR  67           2HE      TYR  67  17.424   1.098   4.098
  556    HH   TYR  67           HH       TYR  67  18.095  -0.181   6.093
  557    H    ASP  68           H        ASP  68  15.479   0.279  -0.298
  558    HA   ASP  68           HA       ASP  68  18.028  -0.932  -1.110
  559   1HB   ASP  68          2HB       ASP  68  16.927   0.458  -2.805
  560   2HB   ASP  68          1HB       ASP  68  16.903   1.822  -1.687
  561    H    GLU  69           H        GLU  69  19.854  -0.564   0.008
  562    HA   GLU  69           HA       GLU  69  19.668   0.782   2.536
  563   1HB   GLU  69          2HB       GLU  69  22.007   0.062   2.837
  564   2HB   GLU  69          1HB       GLU  69  20.965  -1.267   2.347
  565   1HG   GLU  69          2HG       GLU  69  21.773  -1.064   0.055
  566   2HG   GLU  69          1HG       GLU  69  22.815   0.275   0.541
  567    H    LYS  70           H        LYS  70  19.618   2.244  -0.182
  568    HA   LYS  70           HA       LYS  70  21.452   4.370   0.714
  569   1HB   LYS  70          2HB       LYS  70  20.763   3.664  -2.146
  570   2HB   LYS  70          1HB       LYS  70  21.735   5.041  -1.645
  571   1HG   LYS  70          1HG       LYS  70  23.400   3.511  -0.699
  572   2HG   LYS  70          2HG       LYS  70  22.430   2.139  -1.240
  573   1HD   LYS  70          2HD       LYS  70  24.194   2.517  -2.829
  574   2HD   LYS  70          1HD       LYS  70  22.656   2.964  -3.571
  575   1HE   LYS  70          1HE       LYS  70  23.105   5.317  -3.088
  576   2HE   LYS  70          2HE       LYS  70  24.640   4.874  -2.339
  577   1HZ   LYS  70          1HZ       LYS  70  23.913   4.441  -5.186
  578   2HZ   LYS  70          2HZ       LYS  70  25.382   4.004  -4.470
  579   3HZ   LYS  70          3HZ       LYS  70  24.960   5.636  -4.603
  580    H    GLN  71           H        GLN  71  18.857   4.056  -1.707
  581    HA   GLN  71           HA       GLN  71  17.341   6.095  -0.225
  582   1HB   GLN  71          2HB       GLN  71  17.053   5.217  -3.105
  583   2HB   GLN  71          1HB       GLN  71  16.057   6.427  -2.307
  584   1HG   GLN  71          2HG       GLN  71  18.022   7.836  -1.980
  585   2HG   GLN  71          1HG       GLN  71  19.024   6.620  -2.771
  586   1HE2  GLN  71          1HE2      GLN  71  15.784   7.388  -3.808
  587   2HE2  GLN  71          2HE2      GLN  71  16.228   8.143  -5.296
  588    H    GLN  72           H        GLN  72  16.145   4.986   1.222
  589    HA   GLN  72           HA       GLN  72  15.330   2.340   1.014
  590   1HB   GLN  72          1HB       GLN  72  14.019   4.561   2.595
  591   2HB   GLN  72          2HB       GLN  72  13.790   2.839   2.867
  592   1HG   GLN  72          2HG       GLN  72  16.180   2.623   3.395
  593   2HG   GLN  72          1HG       GLN  72  16.369   4.361   3.172
  594   1HE2  GLN  72          1HE2      GLN  72  13.764   4.948   4.361
  595   2HE2  GLN  72          2HE2      GLN  72  13.963   4.739   6.065
  596    H    HIS  73           H        HIS  73  14.061   5.091  -0.551
  597    HA   HIS  73           HA       HIS  73  11.395   4.396  -1.005
  598   1HB   HIS  73          1HB       HIS  73  13.271   5.647  -3.024
  599   2HB   HIS  73          2HB       HIS  73  11.517   5.780  -2.984
  600    HD1  HIS  73           1HD      HIS  73  10.597   7.016  -0.688
  601    HD2  HIS  73           2HD      HIS  73  14.531   7.711  -1.828
  602    HE1  HIS  73           1HE      HIS  73  11.284   9.112   0.517
  603    HE2  HIS  73           2HE      HIS  73  13.699   9.459  -0.110
  604    H    ILE  74           H        ILE  74  14.350   3.349  -2.696
  605    HA   ILE  74           HA       ILE  74  12.912   1.646  -4.508
  606    HB   ILE  74           HB       ILE  74  15.841   1.432  -3.826
  607   1HG1  ILE  74          2HG1      ILE  74  15.407   3.754  -4.409
  608   2HG1  ILE  74          1HG1      ILE  74  16.248   2.957  -5.735
  609   1HG2  ILE  74          1HG2      ILE  74  14.263   0.720  -6.294
  610   2HG2  ILE  74          2HG2      ILE  74  14.922  -0.410  -5.114
  611   3HG2  ILE  74          3HG2      ILE  74  16.009   0.556  -6.111
  612   1HD1  ILE  74          1HD1      ILE  74  14.493   4.418  -6.553
  613   2HD1  ILE  74          2HD1      ILE  74  13.297   3.524  -5.613
  614   3HD1  ILE  74          3HD1      ILE  74  14.145   2.733  -6.941
  615    H    VAL  75           H        VAL  75  12.686  -0.589  -4.415
  616    HA   VAL  75           HA       VAL  75  13.208  -1.785  -1.779
  617    HB   VAL  75           HB       VAL  75  10.591  -2.200  -3.186
  618   1HG1  VAL  75          1HG1      VAL  75   9.834  -2.815  -0.945
  619   2HG1  VAL  75          2HG1      VAL  75  11.439  -2.462  -0.305
  620   3HG1  VAL  75          3HG1      VAL  75  11.218  -3.788  -1.444
  621   1HG2  VAL  75          1HG2      VAL  75  11.270  -0.022  -1.222
  622   2HG2  VAL  75          2HG2      VAL  75   9.630  -0.488  -1.672
  623   3HG2  VAL  75          3HG2      VAL  75  10.724   0.173  -2.888
  624    H    TYR  76           H        TYR  76  14.844  -3.038  -2.724
  625    HA   TYR  76           HA       TYR  76  14.437  -4.777  -4.912
  626   1HB   TYR  76          1HB       TYR  76  16.359  -5.238  -2.634
  627   2HB   TYR  76          2HB       TYR  76  16.519  -5.756  -4.310
  628    HD1  TYR  76           1HD      TYR  76  15.844  -3.297  -5.769
  629    HD2  TYR  76           2HD      TYR  76  18.187  -3.830  -2.255
  630    HE1  TYR  76           1HE      TYR  76  17.091  -1.242  -6.289
  631    HE2  TYR  76           2HE      TYR  76  19.438  -1.781  -2.771
  632    HH   TYR  76           HH       TYR  76  19.980  -0.396  -4.729
  633    H    CYS  77           H        CYS  77  13.429  -6.673  -5.062
  634    HA   CYS  77           HA       CYS  77  12.789  -8.212  -2.670
  635   1HB   CYS  77          2HB       CYS  77  10.618  -7.243  -4.542
  636   2HB   CYS  77          1HB       CYS  77  10.402  -8.216  -3.090
  637    HG   CYS  77           HG       CYS  77   9.530  -5.498  -2.776
  638    H    SER  78           H        SER  78  14.261  -9.667  -3.746
  639    HA   SER  78           HA       SER  78  14.043 -10.810  -6.223
  640   1HB   SER  78          2HB       SER  78  15.835 -11.376  -4.656
  641   2HB   SER  78          1HB       SER  78  14.680 -12.229  -3.630
  642    HG   SER  78           HG       SER  78  16.058 -13.287  -5.519
  643    H    ASN  79           H        ASN  79  12.887 -12.695  -3.480
  644    HA   ASN  79           HA       ASN  79  10.419 -13.270  -4.969
  645   1HB   ASN  79          1HB       ASN  79  11.634 -14.742  -2.617
  646   2HB   ASN  79          2HB       ASN  79  10.136 -15.185  -3.432
  647   1HD2  ASN  79          2HD2      ASN  79  12.599 -16.701  -3.093
  648   2HD2  ASN  79          1HD2      ASN  79  13.136 -17.106  -4.684
  649    H    ASP  80           H        ASP  80  10.721 -13.685  -1.519
  650    HA   ASP  80           HA       ASP  80   9.886 -12.581   0.284
  651   1HB   ASP  80          1HB       ASP  80  10.009 -10.160  -1.518
  652   2HB   ASP  80          2HB       ASP  80   9.952 -10.156   0.243
  653    H    LEU  81           H        LEU  81   8.022 -11.271   1.122
  654    HA   LEU  81           HA       LEU  81   5.612 -12.282   0.043
  655   1HB   LEU  81          1HB       LEU  81   6.052 -10.103   2.084
  656   2HB   LEU  81          2HB       LEU  81   4.510 -10.864   1.744
  657    HG   LEU  81           HG       LEU  81   6.938 -12.318   2.799
  658   1HD1  LEU  81          1HD2      LEU  81   5.721 -12.391   4.927
  659   2HD1  LEU  81          2HD2      LEU  81   4.474 -11.351   4.239
  660   3HD1  LEU  81          3HD2      LEU  81   6.114 -10.739   4.447
  661   1HD2  LEU  81          1HD1      LEU  81   4.069 -13.191   2.489
  662   2HD2  LEU  81          2HD1      LEU  81   5.363 -14.134   3.229
  663   3HD2  LEU  81          3HD1      LEU  81   5.433 -13.737   1.513
  664    H    LEU  82           H        LEU  82   7.075  -9.044   0.006
  665    HA   LEU  82           HA       LEU  82   5.106  -7.687  -1.419
  666   1HB   LEU  82          1HB       LEU  82   7.682  -7.126  -0.562
  667   2HB   LEU  82          2HB       LEU  82   7.815  -7.042  -2.307
  668    HG   LEU  82           HG       LEU  82   7.362  -4.840  -1.553
  669   1HD1  LEU  82          1HD2      LEU  82   4.795  -6.053  -2.569
  670   2HD1  LEU  82          2HD2      LEU  82   6.138  -5.476  -3.556
  671   3HD1  LEU  82          3HD2      LEU  82   5.202  -4.337  -2.589
  672   1HD2  LEU  82          1HD1      LEU  82   6.536  -5.413   0.677
  673   2HD2  LEU  82          2HD1      LEU  82   5.014  -5.957  -0.029
  674   3HD2  LEU  82          3HD1      LEU  82   5.478  -4.258  -0.134
  675    H    GLY  83           H        GLY  83   7.334 -10.140  -2.414
  676   1HA   GLY  83          2HA       GLY  83   7.185  -9.653  -5.226
  677   2HA   GLY  83          1HA       GLY  83   7.778 -11.115  -4.453
  678    H    ASP  84           H        ASP  84   5.513 -11.910  -3.033
  679    HA   ASP  84           HA       ASP  84   3.888 -13.186  -4.892
  680   1HB   ASP  84          2HB       ASP  84   3.013 -12.291  -2.131
  681   2HB   ASP  84          1HB       ASP  84   2.327 -13.601  -3.085
  682    H    LEU  85           H        LEU  85   3.783  -9.931  -3.684
  683    HA   LEU  85           HA       LEU  85   1.256  -9.269  -4.885
  684   1HB   LEU  85          1HB       LEU  85   3.541  -7.568  -3.902
  685   2HB   LEU  85          2HB       LEU  85   2.062  -6.905  -4.566
  686    HG   LEU  85           HG       LEU  85   2.626  -7.678  -1.889
  687   1HD1  LEU  85          1HD1      LEU  85   0.451  -6.604  -1.493
  688   2HD1  LEU  85          2HD1      LEU  85   0.150  -6.608  -3.231
  689   3HD1  LEU  85          3HD1      LEU  85   1.480  -5.656  -2.569
  690   1HD2  LEU  85          1HD2      LEU  85   1.776  -9.896  -2.481
  691   2HD2  LEU  85          2HD2      LEU  85   0.290  -9.163  -3.084
  692   3HD2  LEU  85          3HD2      LEU  85   0.693  -9.057  -1.371
  693    H    PHE  86           H        PHE  86   4.356  -7.736  -5.607
  694    HA   PHE  86           HA       PHE  86   3.367  -7.178  -8.263
  695   1HB   PHE  86          2HB       PHE  86   5.876  -6.294  -6.825
  696   2HB   PHE  86          1HB       PHE  86   5.418  -5.755  -8.436
  697    HD1  PHE  86           1HD      PHE  86   5.790  -3.526  -7.131
  698    HD2  PHE  86           2HD      PHE  86   2.509  -6.161  -6.490
  699    HE1  PHE  86           1HE      PHE  86   4.498  -1.675  -6.148
  700    HE2  PHE  86           2HE      PHE  86   1.216  -4.317  -5.505
  701    HZ   PHE  86           HZ       PHE  86   2.211  -2.071  -5.335
  702    H    GLY  87           H        GLY  87   6.605  -8.176  -7.157
  703   1HA   GLY  87          1HA       GLY  87   7.578 -10.258  -8.074
  704   2HA   GLY  87          2HA       GLY  87   6.792  -9.844  -9.590
  705    H    VAL  88           H        VAL  88   7.717  -6.962  -8.494
  706    HA   VAL  88           HA       VAL  88   9.774  -6.602 -10.361
  707    HB   VAL  88           HB       VAL  88  10.184  -4.444  -9.290
  708   1HG1  VAL  88          1HG2      VAL  88   7.943  -3.496  -9.491
  709   2HG1  VAL  88          2HG2      VAL  88   7.249  -5.118  -9.425
  710   3HG1  VAL  88          3HG2      VAL  88   8.271  -4.650 -10.784
  711   1HG2  VAL  88          1HG1      VAL  88   8.994  -3.793  -7.259
  712   2HG2  VAL  88          2HG1      VAL  88  10.055  -5.171  -6.961
  713   3HG2  VAL  88          3HG1      VAL  88   8.317  -5.416  -7.130
  714    HA   PRO  89           HA       PRO  89  13.436  -7.578  -7.865
  715   1HB   PRO  89          2HB       PRO  89  15.279  -6.248  -9.291
  716   2HB   PRO  89          1HB       PRO  89  14.561  -7.752  -9.884
  717   1HG   PRO  89          1HG       PRO  89  13.917  -4.921 -10.617
  718   2HG   PRO  89          2HG       PRO  89  14.066  -6.342 -11.667
  719   1HD   PRO  89          2HD       PRO  89  11.671  -5.324 -10.780
  720   2HD   PRO  89          1HD       PRO  89  11.918  -7.016 -11.255
  721    H    SER  90           H        SER  90  12.042  -4.531  -8.528
  722    HA   SER  90           HA       SER  90  12.704  -3.477  -5.996
  723   1HB   SER  90          2HB       SER  90  14.053  -1.523  -6.763
  724   2HB   SER  90          1HB       SER  90  14.896  -3.062  -6.925
  725    HG   SER  90           HG       SER  90  14.058  -1.299  -8.861
  726    H    PHE  91           H        PHE  91  11.324  -1.795  -5.466
  727    HA   PHE  91           HA       PHE  91  10.091  -0.337  -7.689
  728   1HB   PHE  91          1HB       PHE  91   7.880  -0.451  -6.749
  729   2HB   PHE  91          2HB       PHE  91   8.494  -2.084  -6.957
  730    HD1  PHE  91           1HD      PHE  91   7.653   0.511  -4.489
  731    HD2  PHE  91           2HD      PHE  91   8.836  -3.532  -5.104
  732    HE1  PHE  91           1HE      PHE  91   7.074  -0.002  -2.162
  733    HE2  PHE  91           2HE      PHE  91   8.266  -4.055  -2.768
  734    HZ   PHE  91           HZ       PHE  91   7.382  -2.290  -1.293
  735    H    SER  92           H        SER  92   9.142   1.731  -7.070
  736    HA   SER  92           HA       SER  92  10.698   2.908  -4.871
  737   1HB   SER  92          2HB       SER  92  10.485   5.046  -6.150
  738   2HB   SER  92          1HB       SER  92  11.365   3.788  -7.019
  739    HG   SER  92           HG       SER  92   9.109   3.333  -7.898
  740    H    VAL  93           H        VAL  93   9.485   3.202  -3.133
  741    HA   VAL  93           HA       VAL  93   6.684   3.860  -3.233
  742    HB   VAL  93           HB       VAL  93   7.216   4.425  -0.719
  743   1HG1  VAL  93          1HG2      VAL  93   7.312   1.621  -1.821
  744   2HG1  VAL  93          2HG2      VAL  93   5.856   2.554  -1.472
  745   3HG1  VAL  93          3HG2      VAL  93   6.923   2.058  -0.158
  746   1HG2  VAL  93          1HG1      VAL  93   9.113   3.172   0.155
  747   2HG2  VAL  93          2HG1      VAL  93   9.632   4.432  -0.966
  748   3HG2  VAL  93          3HG1      VAL  93   9.591   2.748  -1.488
  749    H    LYS  94           H        LYS  94   9.247   5.629  -4.088
  750    HA   LYS  94           HA       LYS  94   8.521   8.108  -2.778
  751   1HB   LYS  94          2HB       LYS  94  10.324   9.096  -4.136
  752   2HB   LYS  94          1HB       LYS  94  10.872   7.702  -3.214
  753   1HG   LYS  94          1HG       LYS  94  10.695   6.311  -5.204
  754   2HG   LYS  94          2HG       LYS  94  10.138   7.705  -6.129
  755   1HD   LYS  94          1HD       LYS  94  12.260   8.846  -5.684
  756   2HD   LYS  94          2HD       LYS  94  12.818   7.444  -4.767
  757   1HE   LYS  94          2HE       LYS  94  13.735   7.428  -7.024
  758   2HE   LYS  94          1HE       LYS  94  12.651   6.061  -6.773
  759   1HZ   LYS  94          1HZ       LYS  94  11.949   8.586  -8.171
  760   2HZ   LYS  94          2HZ       LYS  94  10.911   7.272  -7.932
  761   3HZ   LYS  94          3HZ       LYS  94  12.276   7.102  -8.917
  762    H    GLU  95           H        GLU  95   6.933   6.442  -4.918
  763    HA   GLU  95           HA       GLU  95   6.319   8.721  -6.682
  764   1HB   GLU  95          2HB       GLU  95   5.962   5.775  -7.262
  765   2HB   GLU  95          1HB       GLU  95   5.611   7.097  -8.367
  766   1HG   GLU  95          1HG       GLU  95   8.330   6.389  -7.286
  767   2HG   GLU  95          2HG       GLU  95   7.724   5.996  -8.893
  768    H    HIS  96           H        HIS  96   4.830   5.784  -5.322
  769    HA   HIS  96           HA       HIS  96   2.814   5.416  -4.335
  770   1HB   HIS  96          2HB       HIS  96   2.530   8.421  -4.456
  771   2HB   HIS  96          1HB       HIS  96   1.412   7.340  -3.631
  772    HD1  HIS  96           1HD      HIS  96   1.989   6.667  -1.286
  773    HD2  HIS  96           2HD      HIS  96   5.158   8.495  -3.254
  774    HE1  HIS  96           1HE      HIS  96   3.750   7.031   0.471
  775    HE2  HIS  96           2HE      HIS  96   5.694   8.055  -0.762
  776    H    ARG  97           H        ARG  97   2.944   7.450  -7.175
  777    HA   ARG  97           HA       ARG  97   0.281   7.149  -8.028
  778   1HB   ARG  97          2HB       ARG  97   2.745   7.421  -9.760
  779   2HB   ARG  97          1HB       ARG  97   1.091   7.783 -10.230
  780   1HG   ARG  97          2HG       ARG  97   1.022   9.595  -8.593
  781   2HG   ARG  97          1HG       ARG  97   2.686   9.235  -8.131
  782   1HD   ARG  97          2HD       ARG  97   1.758  10.098 -10.867
  783   2HD   ARG  97          1HD       ARG  97   2.576  11.119  -9.685
  784    HE   ARG  97           HE       ARG  97   4.216   8.930 -10.106
  785   1HH1  ARG  97          2HH1      ARG  97   2.907  11.557 -11.986
  786   2HH1  ARG  97          1HH1      ARG  97   4.248  11.611 -13.081
  787   1HH2  ARG  97          1HH2      ARG  97   5.985   8.996 -11.542
  788   2HH2  ARG  97          2HH2      ARG  97   5.997  10.156 -12.829
  789    H    LYS  98           H        LYS  98   3.072   5.586  -9.574
  790    HA   LYS  98           HA       LYS  98   1.491   3.491 -10.646
  791   1HB   LYS  98          1HB       LYS  98   4.492   3.683 -10.346
  792   2HB   LYS  98          2HB       LYS  98   3.643   2.512 -11.344
  793   1HG   LYS  98          2HG       LYS  98   2.755   4.320 -12.723
  794   2HG   LYS  98          1HG       LYS  98   3.598   5.499 -11.717
  795   1HD   LYS  98          2HD       LYS  98   5.744   4.493 -12.339
  796   2HD   LYS  98          1HD       LYS  98   4.897   3.320 -13.350
  797   1HE   LYS  98          1HE       LYS  98   4.026   5.136 -14.733
  798   2HE   LYS  98          2HE       LYS  98   4.860   6.312 -13.720
  799   1HZ   LYS  98          1HZ       LYS  98   6.967   5.330 -14.373
  800   2HZ   LYS  98          2HZ       LYS  98   6.103   5.841 -15.734
  801   3HZ   LYS  98          3HZ       LYS  98   6.167   4.197 -15.344
  802    H    ILE  99           H        ILE  99   3.278   3.885  -7.689
  803    HA   ILE  99           HA       ILE  99   3.698   1.130  -7.185
  804    HB   ILE  99           HB       ILE  99   4.686   3.428  -6.075
  805   1HG1  ILE  99          1HG1      ILE  99   5.715   1.157  -6.241
  806   2HG1  ILE  99          2HG1      ILE  99   6.015   1.960  -4.701
  807   1HG2  ILE  99          1HG2      ILE  99   2.787   2.198  -4.099
  808   2HG2  ILE  99          2HG2      ILE  99   2.917   3.889  -4.590
  809   3HG2  ILE  99          3HG2      ILE  99   4.192   3.150  -3.614
  810   1HD1  ILE  99          1HD1      ILE  99   3.853  -0.082  -5.133
  811   2HD1  ILE  99          2HD1      ILE  99   4.393   0.606  -3.601
  812   3HD1  ILE  99          3HD1      ILE  99   5.464  -0.454  -4.518
  813    H    TYR 100           H        TYR 100   1.096   3.339  -6.423
  814    HA   TYR 100           HA       TYR 100  -0.210   1.380  -4.725
  815   1HB   TYR 100          2HB       TYR 100  -0.766   4.217  -5.487
  816   2HB   TYR 100          1HB       TYR 100  -2.076   3.226  -4.848
  817    HD1  TYR 100           1HD      TYR 100  -2.026   5.064  -3.031
  818    HD2  TYR 100           2HD      TYR 100   1.102   2.233  -3.607
  819    HE1  TYR 100           1HE      TYR 100  -1.238   5.478  -0.739
  820    HE2  TYR 100           2HE      TYR 100   1.892   2.637  -1.321
  821    HH   TYR 100           HH       TYR 100   1.777   4.403   0.391
  822    H    THR 101           H        THR 101  -0.404   2.576  -8.003
  823    HA   THR 101           HA       THR 101  -2.917   1.467  -8.671
  824    HB   THR 101           HB       THR 101  -0.548   1.932 -10.497
  825    HG1  THR 101           1HG      THR 101  -1.720   3.728  -9.154
  826   1HG2  THR 101          1HG2      THR 101  -2.230   2.068 -12.275
  827   2HG2  THR 101          2HG2      THR 101  -3.496   1.678 -11.109
  828   3HG2  THR 101          3HG2      THR 101  -2.253   0.486 -11.493
  829    H    MET 102           H        MET 102   0.274   0.105  -8.368
  830    HA   MET 102           HA       MET 102  -0.494  -2.426  -9.542
  831   1HB   MET 102          2HB       MET 102   1.948  -1.772  -7.890
  832   2HB   MET 102          1HB       MET 102   1.712  -3.190  -8.904
  833   1HG   MET 102          2HG       MET 102   1.703  -1.824 -10.885
  834   2HG   MET 102          1HG       MET 102   1.794  -0.366  -9.901
  835   1HE   MET 102          1HE       MET 102   3.754  -0.752  -7.744
  836   2HE   MET 102          2HE       MET 102   4.039   0.590  -8.852
  837   3HE   MET 102          3HE       MET 102   5.362  -0.495  -8.421
  838    H    ILE 103           H        ILE 103   0.004  -1.062  -6.312
  839    HA   ILE 103           HA       ILE 103  -0.293  -3.388  -4.835
  840    HB   ILE 103           HB       ILE 103  -1.037  -0.548  -4.157
  841   1HG1  ILE 103          1HG1      ILE 103   1.195  -2.369  -3.221
  842   2HG1  ILE 103          2HG1      ILE 103   1.359  -1.069  -4.396
  843   1HG2  ILE 103          1HG2      ILE 103  -1.117  -2.949  -2.330
  844   2HG2  ILE 103          2HG2      ILE 103  -2.505  -2.007  -2.877
  845   3HG2  ILE 103          3HG2      ILE 103  -1.296  -1.268  -1.826
  846   1HD1  ILE 103          1HD1      ILE 103   2.189  -0.382  -2.236
  847   2HD1  ILE 103          2HD1      ILE 103   0.632  -0.758  -1.495
  848   3HD1  ILE 103          3HD1      ILE 103   0.758   0.554  -2.668
  849    H    TYR 104           H        TYR 104  -2.737  -1.302  -6.281
  850    HA   TYR 104           HA       TYR 104  -4.838  -3.035  -5.174
  851   1HB   TYR 104          1HB       TYR 104  -4.998  -0.248  -6.337
  852   2HB   TYR 104          2HB       TYR 104  -6.391  -1.187  -5.807
  853    HD1  TYR 104           1HD      TYR 104  -6.654  -1.746  -3.393
  854    HD2  TYR 104           2HD      TYR 104  -3.615   0.895  -4.770
  855    HE1  TYR 104           1HE      TYR 104  -6.361  -0.898  -1.104
  856    HE2  TYR 104           2HE      TYR 104  -3.315   1.750  -2.485
  857    HH   TYR 104           HH       TYR 104  -4.629   0.217   0.240
  858    H    ARG 105           H        ARG 105  -5.951  -4.359  -6.445
  859    HA   ARG 105           HA       ARG 105  -5.379  -4.327  -9.312
  860   1HB   ARG 105          1HB       ARG 105  -5.037  -6.425  -8.057
  861   2HB   ARG 105          2HB       ARG 105  -6.738  -6.431  -7.616
  862   1HG   ARG 105          1HG       ARG 105  -7.324  -6.586 -10.009
  863   2HG   ARG 105          2HG       ARG 105  -5.602  -6.688 -10.392
  864   1HD   ARG 105          2HD       ARG 105  -7.167  -8.622  -8.685
  865   2HD   ARG 105          1HD       ARG 105  -6.614  -8.903 -10.337
  866    HE   ARG 105           HE       ARG 105  -4.376  -8.271  -8.824
  867   1HH1  ARG 105          2HH1      ARG 105  -6.802 -10.769  -8.941
  868   2HH1  ARG 105          1HH1      ARG 105  -5.751 -11.997  -8.317
  869   1HH2  ARG 105          1HH2      ARG 105  -2.985  -9.882  -8.003
  870   2HH2  ARG 105          2HH2      ARG 105  -3.582 -11.493  -7.784
  871    H    ASN 106           H        ASN 106  -7.071  -4.568 -10.873
  872    HA   ASN 106           HA       ASN 106  -9.545  -3.240 -10.047
  873   1HB   ASN 106          2HB       ASN 106  -8.429  -3.773 -12.810
  874   2HB   ASN 106          1HB       ASN 106  -9.912  -2.884 -12.467
  875   1HD2  ASN 106          1HD2      ASN 106  -9.789  -0.835 -11.564
  876   2HD2  ASN 106          2HD2      ASN 106  -8.326   0.083 -11.564
  877    H    LEU 107           H        LEU 107 -10.382  -5.162  -9.013
  878    HA   LEU 107           HA       LEU 107 -12.015  -6.688 -10.826
  879   1HB   LEU 107          1HB       LEU 107  -9.785  -7.907 -10.682
  880   2HB   LEU 107          2HB       LEU 107 -10.171  -8.225  -9.003
  881    HG   LEU 107           HG       LEU 107 -12.026  -9.069 -11.217
  882   1HD1  LEU 107          1HD1      LEU 107  -9.843 -10.024 -11.721
  883   2HD1  LEU 107          2HD1      LEU 107 -10.959 -11.268 -11.160
  884   3HD1  LEU 107          3HD1      LEU 107  -9.720 -10.641 -10.073
  885   1HD2  LEU 107          1HD2      LEU 107 -11.575 -10.065  -8.406
  886   2HD2  LEU 107          2HD2      LEU 107 -12.737 -10.723  -9.559
  887   3HD2  LEU 107          3HD2      LEU 107 -12.927  -9.077  -8.956
  888    H    VAL 108           H        VAL 108 -10.850  -7.345  -7.529
  889    HA   VAL 108           HA       VAL 108 -13.617  -7.171  -6.573
  890    HB   VAL 108           HB       VAL 108 -12.358  -9.215  -6.009
  891   1HG1  VAL 108          1HG1      VAL 108 -10.515  -9.119  -4.400
  892   2HG1  VAL 108          2HG1      VAL 108 -10.570  -7.357  -4.446
  893   3HG1  VAL 108          3HG1      VAL 108 -10.120  -8.263  -5.891
  894   1HG2  VAL 108          1HG2      VAL 108 -13.012  -7.477  -3.634
  895   2HG2  VAL 108          2HG2      VAL 108 -12.848  -9.232  -3.606
  896   3HG2  VAL 108          3HG2      VAL 108 -14.145  -8.482  -4.536
  897    H    VAL 109           H        VAL 109 -10.543  -5.600  -6.395
  898    HA   VAL 109           HA       VAL 109 -11.128  -4.022  -4.068
  899    HB   VAL 109           HB       VAL 109  -9.034  -3.519  -6.188
  900   1HG1  VAL 109          1HG1      VAL 109  -7.876  -2.299  -4.409
  901   2HG1  VAL 109          2HG1      VAL 109  -9.230  -2.603  -3.322
  902   3HG1  VAL 109          3HG1      VAL 109  -9.456  -1.599  -4.755
  903   1HG2  VAL 109          1HG2      VAL 109  -7.488  -4.712  -4.697
  904   2HG2  VAL 109          2HG2      VAL 109  -8.777  -5.762  -5.290
  905   3HG2  VAL 109          3HG2      VAL 109  -8.841  -5.130  -3.644
  906    H    VAL 110           H        VAL 110 -11.535  -1.769  -4.029
  907    HA   VAL 110           HA       VAL 110 -12.687   0.100  -4.589
  908    HB   VAL 110           HB       VAL 110 -11.190  -0.519  -7.101
  909   1HG1  VAL 110          1HG2      VAL 110 -12.939   1.896  -6.637
  910   2HG1  VAL 110          2HG2      VAL 110 -13.215   0.627  -7.828
  911   3HG1  VAL 110          3HG2      VAL 110 -11.817   1.689  -7.982
  912   1HG2  VAL 110          1HG1      VAL 110 -10.932   1.652  -5.031
  913   2HG2  VAL 110          2HG1      VAL 110  -9.902   1.464  -6.451
  914   3HG2  VAL 110          3HG1      VAL 110  -9.903   0.228  -5.192
  915    H    ASN 111           H        ASN 111 -14.827  -0.195  -4.470
  916    HA   ASN 111           HA       ASN 111 -16.196  -1.221  -6.870
  917   1HB   ASN 111          2HB       ASN 111 -18.014  -1.985  -5.389
  918   2HB   ASN 111          1HB       ASN 111 -16.484  -2.764  -4.998
  919   1HD2  ASN 111          2HD2      ASN 111 -18.886  -0.482  -3.970
  920   2HD2  ASN 111          1HD2      ASN 111 -18.345  -0.342  -2.335
  921    H    GLN 112           H        GLN 112 -17.690   0.060  -7.789
  922    HA   GLN 112           HA       GLN 112 -18.951   2.204  -6.318
  923   1HB   GLN 112          1HB       GLN 112 -18.187   3.934  -7.988
  924   2HB   GLN 112          2HB       GLN 112 -16.959   3.375  -6.863
  925   1HG   GLN 112          2HG       GLN 112 -15.909   3.499  -8.956
  926   2HG   GLN 112          1HG       GLN 112 -16.201   1.785  -8.668
  927   1HE2  GLN 112          2HE2      GLN 112 -16.133   1.267 -10.837
  928   2HE2  GLN 112          1HE2      GLN 112 -17.390   1.702 -11.938
  929    H    GLN 113           H        GLN 113 -18.928  -0.101  -8.697
  930    HA   GLN 113           HA       GLN 113 -20.913   1.162 -10.406
  931   1HB   GLN 113          1HB       GLN 113 -19.145  -0.250 -11.396
  932   2HB   GLN 113          2HB       GLN 113 -19.760  -1.631 -10.500
  933   1HG   GLN 113          1HG       GLN 113 -20.510  -1.709 -12.792
  934   2HG   GLN 113          2HG       GLN 113 -21.879  -1.468 -11.709
  935   1HE2  GLN 113          2HE2      GLN 113 -19.630   1.065 -12.535
  936   2HE2  GLN 113          1HE2      GLN 113 -20.729   2.003 -13.483
  937    H    GLU 114           H        GLU 114 -23.056   0.760 -10.380
  938    HA   GLU 114           HA       GLU 114 -24.035  -1.036  -8.265
  939   1HB   GLU 114          2HB       GLU 114 -26.082   0.343  -8.282
  940   2HB   GLU 114          1HB       GLU 114 -24.646   1.288  -7.911
  941   1HG   GLU 114          1HG       GLU 114 -24.587   2.111 -10.206
  942   2HG   GLU 114          2HG       GLU 114 -26.022   1.157 -10.585
  943    H    SER 115           H        SER 115 -23.296  -1.942 -10.911
  944    HA   SER 115           HA       SER 115 -25.818  -2.461 -12.263
  945   1HB   SER 115          1HB       SER 115 -24.434  -3.575 -13.964
  946   2HB   SER 115          2HB       SER 115 -23.827  -1.957 -13.615
  947    HG   SER 115           HG       SER 115 -22.611  -4.364 -13.296
  948    H    SER 116           H        SER 116 -24.727  -3.630  -9.565
  949    HA   SER 116           HA       SER 116 -25.813  -6.293 -10.052
  950   1HB   SER 116          2HB       SER 116 -23.114  -5.841  -8.754
  951   2HB   SER 116          1HB       SER 116 -23.955  -7.388  -8.842
  952    HG   SER 116           HG       SER 116 -22.902  -5.846 -10.969
  953    H    ASP 117           H        ASP 117 -26.002  -3.568  -8.391
  954    HA   ASP 117           HA       ASP 117 -27.213  -4.887  -6.088
  955   1HB   ASP 117          2HB       ASP 117 -26.138  -3.335  -4.502
  956   2HB   ASP 117          1HB       ASP 117 -24.953  -4.343  -5.326
  957    H    SER 118           H        SER 118 -28.042  -3.347  -8.528
  958    HA   SER 118           HA       SER 118 -29.026  -0.819  -7.649
  959   1HB   SER 118          2HB       SER 118 -28.610  -1.266 -10.022
  960   2HB   SER 118          1HB       SER 118 -29.852  -2.517 -10.018
  961    HG   SER 118           HG       SER 118 -30.172   0.049 -10.474
  962    H    SER 119           H        SER 119 -31.036  -0.233  -6.935
  963    HA   SER 119           HA       SER 119 -32.646  -2.360  -5.797
  964   1HB   SER 119          2HB       SER 119 -33.892  -0.498  -4.714
  965   2HB   SER 119          1HB       SER 119 -32.159  -0.438  -4.389
  966    HG   SER 119           HG       SER 119 -32.124   1.052  -6.282
  Start of MODEL   16
    1   1H    MET   1          1H        MET   1 -13.009   3.483 -39.948
    2   2H    MET   1          2H        MET   1 -13.286   3.434 -41.616
    3   3H    MET   1          3H        MET   1 -13.641   2.085 -40.661
    4    HA   MET   1           HA       MET   1 -14.985   4.718 -40.497
    5   1HB   MET   1          2HB       MET   1 -15.973   2.068 -41.571
    6   2HB   MET   1          1HB       MET   1 -16.942   3.526 -41.409
    7   1HG   MET   1          2HG       MET   1 -15.487   4.668 -43.007
    8   2HG   MET   1          1HG       MET   1 -14.526   3.200 -43.175
    9   1HE   MET   1          1HE       MET   1 -18.937   3.545 -44.489
   10   2HE   MET   1          2HE       MET   1 -18.018   4.879 -43.794
   11   3HE   MET   1          3HE       MET   1 -18.436   3.484 -42.799
   12    H    CYS   2           H        CYS   2 -15.147   1.286 -39.550
   13    HA   CYS   2           HA       CYS   2 -16.786   1.981 -37.248
   14   1HB   CYS   2          1HB       CYS   2 -15.807  -0.707 -38.231
   15   2HB   CYS   2          2HB       CYS   2 -16.931  -0.458 -36.899
   16    HG   CYS   2           HG       CYS   2 -17.743   0.794 -39.944
   17    H    ASN   3           H        ASN   3 -16.053   2.186 -35.232
   18    HA   ASN   3           HA       ASN   3 -14.622   2.345 -33.472
   19   1HB   ASN   3          2HB       ASN   3 -13.469  -0.173 -34.693
   20   2HB   ASN   3          1HB       ASN   3 -13.136   0.410 -33.064
   21   1HD2  ASN   3          1HD2      ASN   3 -15.500  -1.010 -35.176
   22   2HD2  ASN   3          2HD2      ASN   3 -16.601  -1.507 -33.940
   23    H    THR   4           H        THR   4 -13.914   3.563 -36.101
   24    HA   THR   4           HA       THR   4 -12.195   4.661 -37.122
   25    HB   THR   4           HB       THR   4 -10.657   5.845 -35.638
   26    HG1  THR   4           1HG      THR   4 -10.176   5.056 -33.735
   27   1HG2  THR   4          1HG2      THR   4 -12.938   6.696 -35.852
   28   2HG2  THR   4          2HG2      THR   4 -12.307   6.992 -34.232
   29   3HG2  THR   4          3HG2      THR   4 -13.453   5.680 -34.507
   30    H    ASN   5           H        ASN   5 -11.909   1.798 -37.056
   31    HA   ASN   5           HA       ASN   5 -10.402   0.185 -37.586
   32   1HB   ASN   5          1HB       ASN   5  -8.615   2.571 -38.096
   33   2HB   ASN   5          2HB       ASN   5  -8.245   0.919 -38.580
   34   1HD2  ASN   5          2HD2      ASN   5  -8.178   1.440 -40.749
   35   2HD2  ASN   5          1HD2      ASN   5  -9.601   1.800 -41.659
   36    H    MET   6           H        MET   6 -10.074  -0.917 -35.734
   37    HA   MET   6           HA       MET   6  -8.980  -1.753 -33.930
   38   1HB   MET   6          1HB       MET   6  -6.756   0.099 -34.807
   39   2HB   MET   6          2HB       MET   6  -6.600  -1.182 -33.611
   40   1HG   MET   6          1HG       MET   6  -7.273  -1.549 -36.522
   41   2HG   MET   6          2HG       MET   6  -5.714  -1.867 -35.764
   42   1HE   MET   6          1HE       MET   6  -6.600  -3.153 -32.988
   43   2HE   MET   6          2HE       MET   6  -5.297  -3.799 -33.987
   44   3HE   MET   6          3HE       MET   6  -6.567  -4.869 -33.394
   45    H    SER   7           H        SER   7  -9.418  -1.338 -31.874
   46    HA   SER   7           HA       SER   7  -9.922   1.411 -31.079
   47   1HB   SER   7          2HB       SER   7 -10.937   0.404 -29.064
   48   2HB   SER   7          1HB       SER   7 -11.607  -0.282 -30.545
   49    HG   SER   7           HG       SER   7  -9.496  -1.471 -29.074
   50    H    VAL   8           H        VAL   8  -7.655  -1.164 -30.440
   51    HA   VAL   8           HA       VAL   8  -6.114   0.678 -28.755
   52    HB   VAL   8           HB       VAL   8  -5.460  -1.316 -27.329
   53   1HG1  VAL   8          1HG1      VAL   8  -8.320  -0.361 -27.240
   54   2HG1  VAL   8          2HG1      VAL   8  -6.928   0.456 -26.530
   55   3HG1  VAL   8          3HG1      VAL   8  -7.444  -1.111 -25.904
   56   1HG2  VAL   8          1HG2      VAL   8  -7.922  -2.491 -28.618
   57   2HG2  VAL   8          2HG2      VAL   8  -7.080  -3.162 -27.222
   58   3HG2  VAL   8          3HG2      VAL   8  -6.270  -3.086 -28.787
   59    HA   PRO   9           HA       PRO   9  -3.543  -1.245 -32.132
   60   1HB   PRO   9          2HB       PRO   9  -2.512   1.497 -32.359
   61   2HB   PRO   9          1HB       PRO   9  -3.179   0.446 -33.609
   62   1HG   PRO   9          2HG       PRO   9  -4.513   2.601 -32.712
   63   2HG   PRO   9          1HG       PRO   9  -5.352   1.116 -33.200
   64   1HD   PRO   9          1HD       PRO   9  -4.685   2.098 -30.447
   65   2HD   PRO   9          2HD       PRO   9  -6.183   1.347 -31.041
   66    H    THR  10           H        THR  10  -2.419   1.473 -30.107
   67    HA   THR  10           HA       THR  10  -0.416  -0.245 -28.886
   68    HB   THR  10           HB       THR  10   0.804   0.570 -30.816
   69    HG1  THR  10           1HG      THR  10   1.872   0.506 -28.727
   70   1HG2  THR  10          1HG2      THR  10   1.178   2.969 -31.176
   71   2HG2  THR  10          2HG2      THR  10   0.077   3.337 -29.847
   72   3HG2  THR  10          3HG2      THR  10  -0.533   2.556 -31.307
   73    H    ASP  11           H        ASP  11   0.447   0.593 -26.944
   74    HA   ASP  11           HA       ASP  11  -0.677   3.107 -25.963
   75   1HB   ASP  11          2HB       ASP  11  -1.419   2.047 -23.866
   76   2HB   ASP  11          1HB       ASP  11  -2.277   1.398 -25.260
   77    H    GLY  12           H        GLY  12   0.588   4.164 -24.487
   78   1HA   GLY  12          1HA       GLY  12   3.144   2.845 -23.808
   79   2HA   GLY  12          2HA       GLY  12   2.990   4.565 -24.134
   80    H    ALA  13           H        ALA  13   0.340   4.375 -22.568
   81    HA   ALA  13           HA       ALA  13   1.281   3.939 -19.858
   82   1HB   ALA  13          1HB       ALA  13   0.762   6.194 -19.093
   83   2HB   ALA  13          2HB       ALA  13   0.376   6.677 -20.745
   84   3HB   ALA  13          3HB       ALA  13   2.027   6.224 -20.322
   85    H    VAL  14           H        VAL  14  -0.322   3.239 -18.581
   86    HA   VAL  14           HA       VAL  14  -3.064   3.393 -19.638
   87    HB   VAL  14           HB       VAL  14  -1.937   1.425 -17.638
   88   1HG1  VAL  14          1HG1      VAL  14  -4.599   1.507 -19.056
   89   2HG1  VAL  14          2HG1      VAL  14  -4.321   1.813 -17.341
   90   3HG1  VAL  14          3HG1      VAL  14  -4.033   0.206 -18.009
   91   1HG2  VAL  14          1HG2      VAL  14  -0.958   1.093 -19.841
   92   2HG2  VAL  14          2HG2      VAL  14  -2.565   1.069 -20.568
   93   3HG2  VAL  14          3HG2      VAL  14  -2.080  -0.212 -19.458
   94    H    THR  15           H        THR  15  -1.411   3.203 -16.477
   95    HA   THR  15           HA       THR  15  -3.072   5.384 -15.490
   96    HB   THR  15           HB       THR  15  -2.994   2.705 -14.086
   97    HG1  THR  15           1HG      THR  15  -4.411   2.804 -15.932
   98   1HG2  THR  15          1HG2      THR  15  -3.050   4.586 -12.525
   99   2HG2  THR  15          2HG2      THR  15  -4.591   3.729 -12.531
  100   3HG2  THR  15          3HG2      THR  15  -4.434   5.265 -13.381
  101    H    THR  16           H        THR  16  -1.539   6.752 -14.832
  102    HA   THR  16           HA       THR  16   0.760   5.689 -13.336
  103    HB   THR  16           HB       THR  16   1.891   7.820 -13.851
  104    HG1  THR  16           1HG      THR  16   0.866   9.225 -15.374
  105   1HG2  THR  16          1HG2      THR  16   2.210   7.435 -16.256
  106   2HG2  THR  16          2HG2      THR  16   0.775   6.410 -16.279
  107   3HG2  THR  16          3HG2      THR  16   2.195   5.919 -15.355
  108    H    SER  17           H        SER  17  -2.162   6.839 -12.672
  109    HA   SER  17           HA       SER  17  -1.343   7.840 -10.080
  110   1HB   SER  17          2HB       SER  17  -2.693   9.906 -10.251
  111   2HB   SER  17          1HB       SER  17  -1.359   9.898 -11.405
  112    HG   SER  17           HG       SER  17  -3.440  10.557 -12.269
  113    H    GLN  18           H        GLN  18  -2.899   7.574  -8.500
  114    HA   GLN  18           HA       GLN  18  -5.579   6.724  -9.271
  115   1HB   GLN  18          2HB       GLN  18  -4.222   4.645  -9.181
  116   2HB   GLN  18          1HB       GLN  18  -3.776   5.036  -7.527
  117   1HG   GLN  18          1HG       GLN  18  -5.502   3.416  -7.442
  118   2HG   GLN  18          2HG       GLN  18  -6.181   4.957  -6.918
  119   1HE2  GLN  18          2HE2      GLN  18  -7.505   2.584  -7.984
  120   2HE2  GLN  18          1HE2      GLN  18  -8.381   3.110  -9.376
  121    H    ILE  19           H        ILE  19  -3.246   7.646  -6.814
  122    HA   ILE  19           HA       ILE  19  -5.087   6.946  -4.752
  123    HB   ILE  19           HB       ILE  19  -3.165   7.748  -3.239
  124   1HG1  ILE  19          2HG1      ILE  19  -1.011   7.352  -4.881
  125   2HG1  ILE  19          1HG1      ILE  19  -2.089   8.266  -5.932
  126   1HG2  ILE  19          1HG2      ILE  19  -1.862   5.648  -3.795
  127   2HG2  ILE  19          2HG2      ILE  19  -2.989   5.429  -5.141
  128   3HG2  ILE  19          3HG2      ILE  19  -3.593   5.447  -3.481
  129   1HD1  ILE  19          1HD1      ILE  19  -2.224  10.034  -4.263
  130   2HD1  ILE  19          2HD1      ILE  19  -0.556   9.724  -4.744
  131   3HD1  ILE  19          3HD1      ILE  19  -1.157   9.117  -3.201
  132    HA   PRO  20           HA       PRO  20  -6.341  11.215  -3.975
  133   1HB   PRO  20          1HB       PRO  20  -8.596  10.633  -2.674
  134   2HB   PRO  20          2HB       PRO  20  -8.494  10.468  -4.431
  135   1HG   PRO  20          1HG       PRO  20  -8.389   8.364  -2.315
  136   2HG   PRO  20          2HG       PRO  20  -9.149   8.310  -3.914
  137   1HD   PRO  20          2HD       PRO  20  -6.656   7.239  -3.256
  138   2HD   PRO  20          1HD       PRO  20  -7.238   7.569  -4.900
  139    H    ALA  21           H        ALA  21  -4.398   9.614  -2.415
  140    HA   ALA  21           HA       ALA  21  -3.427   9.540  -0.358
  141   1HB   ALA  21          1HB       ALA  21  -5.302  11.808   0.270
  142   2HB   ALA  21          2HB       ALA  21  -3.696  11.969  -0.440
  143   3HB   ALA  21          3HB       ALA  21  -3.878  11.348   1.201
  144    H    SER  22           H        SER  22  -5.558   7.799  -0.890
  145    HA   SER  22           HA       SER  22  -6.884   6.267   0.133
  146   1HB   SER  22          1HB       SER  22  -5.040   6.069   1.744
  147   2HB   SER  22          2HB       SER  22  -5.708   7.408   2.680
  148    HG   SER  22           HG       SER  22  -7.672   5.720   2.396
  149    H    GLU  23           H        GLU  23  -8.443   8.008  -0.767
  150    HA   GLU  23           HA       GLU  23 -10.273   8.681   1.430
  151   1HB   GLU  23          1HB       GLU  23  -9.617  10.386  -0.973
  152   2HB   GLU  23          2HB       GLU  23 -10.987  10.682   0.090
  153   1HG   GLU  23          1HG       GLU  23  -9.415  10.929   1.980
  154   2HG   GLU  23          2HG       GLU  23  -8.076  10.743   0.849
  155    H    GLN  24           H        GLN  24  -9.769   7.303  -1.678
  156    HA   GLN  24           HA       GLN  24 -12.378   6.140  -1.679
  157   1HB   GLN  24          1HB       GLN  24 -12.981   8.372  -2.505
  158   2HB   GLN  24          2HB       GLN  24 -11.801   8.217  -3.799
  159   1HG   GLN  24          2HG       GLN  24 -14.039   7.801  -4.620
  160   2HG   GLN  24          1HG       GLN  24 -13.056   6.341  -4.725
  161   1HE2  GLN  24          1HE2      GLN  24 -13.497   4.610  -3.362
  162   2HE2  GLN  24          2HE2      GLN  24 -14.990   4.474  -2.503
  163    H    GLU  25           H        GLU  25 -11.710   4.134  -2.167
  164    HA   GLU  25           HA       GLU  25 -10.501   3.446  -4.625
  165   1HB   GLU  25          2HB       GLU  25  -8.264   2.806  -3.793
  166   2HB   GLU  25          1HB       GLU  25  -8.540   4.541  -3.732
  167   1HG   GLU  25          2HG       GLU  25  -8.770   2.671  -1.373
  168   2HG   GLU  25          1HG       GLU  25  -7.366   3.675  -1.749
  169    H    THR  26           H        THR  26 -10.986   2.508  -1.207
  170    HA   THR  26           HA       THR  26 -10.020  -0.137  -2.025
  171    HB   THR  26           HB       THR  26  -8.319   0.888  -0.787
  172    HG1  THR  26           1HG      THR  26  -9.445  -0.475   1.365
  173   1HG2  THR  26          1HG2      THR  26  -8.664   1.911   1.419
  174   2HG2  THR  26          2HG2      THR  26 -10.397   1.624   1.272
  175   3HG2  THR  26          3HG2      THR  26  -9.588   2.730   0.163
  176    H    LEU  27           H        LEU  27 -11.192   0.535   1.255
  177    HA   LEU  27           HA       LEU  27 -11.204  -1.399   2.456
  178   1HB   LEU  27          1HB       LEU  27 -13.686  -0.519   1.975
  179   2HB   LEU  27          2HB       LEU  27 -13.810  -2.110   1.241
  180    HG   LEU  27           HG       LEU  27 -14.549  -2.377   3.481
  181   1HD1  LEU  27          1HD2      LEU  27 -12.897  -3.866   4.463
  182   2HD1  LEU  27          2HD2      LEU  27 -11.644  -3.191   3.417
  183   3HD1  LEU  27          3HD2      LEU  27 -12.981  -4.112   2.718
  184   1HD2  LEU  27          1HD1      LEU  27 -12.943  -1.717   5.369
  185   2HD2  LEU  27          2HD1      LEU  27 -13.873  -0.434   4.586
  186   3HD2  LEU  27          3HD1      LEU  27 -12.175  -0.678   4.165
  187    H    VAL  28           H        VAL  28  -9.493  -2.267   1.137
  188    HA   VAL  28           HA       VAL  28 -10.128  -4.165  -0.926
  189    HB   VAL  28           HB       VAL  28  -8.070  -3.162  -1.309
  190   1HG1  VAL  28          1HG1      VAL  28  -6.301  -3.070   0.520
  191   2HG1  VAL  28          2HG1      VAL  28  -7.606  -3.481   1.637
  192   3HG1  VAL  28          3HG1      VAL  28  -7.689  -1.991   0.689
  193   1HG2  VAL  28          1HG2      VAL  28  -7.418  -5.720   0.148
  194   2HG2  VAL  28          2HG2      VAL  28  -6.349  -4.885  -0.984
  195   3HG2  VAL  28          3HG2      VAL  28  -7.872  -5.573  -1.552
  196    H    ARG  29           H        ARG  29 -10.259  -6.335  -0.748
  197    HA   ARG  29           HA       ARG  29  -9.977  -7.500   1.921
  198   1HB   ARG  29          1HB       ARG  29 -12.514  -7.793   0.312
  199   2HB   ARG  29          2HB       ARG  29 -12.234  -8.270   1.982
  200   1HG   ARG  29          1HG       ARG  29 -12.131  -5.969   2.678
  201   2HG   ARG  29          2HG       ARG  29 -12.231  -5.415   1.005
  202   1HD   ARG  29          1HD       ARG  29 -14.385  -5.222   2.142
  203   2HD   ARG  29          2HD       ARG  29 -14.462  -6.373   0.810
  204    HE   ARG  29           HE       ARG  29 -13.891  -7.824   3.105
  205   1HH1  ARG  29          2HH1      ARG  29 -16.473  -5.832   1.874
  206   2HH1  ARG  29          1HH1      ARG  29 -17.709  -6.672   2.750
  207   1HH2  ARG  29          1HH2      ARG  29 -15.512  -8.932   4.262
  208   2HH2  ARG  29          2HH2      ARG  29 -17.163  -8.434   4.108
  209    HA   PRO  30           HA       PRO  30  -8.924 -10.269  -1.660
  210   1HB   PRO  30          2HB       PRO  30  -6.264 -10.180  -1.632
  211   2HB   PRO  30          1HB       PRO  30  -7.210  -8.822  -2.252
  212   1HG   PRO  30          2HG       PRO  30  -5.760  -9.103   0.329
  213   2HG   PRO  30          1HG       PRO  30  -6.038  -7.655  -0.652
  214   1HD   PRO  30          1HD       PRO  30  -7.504  -8.484   1.632
  215   2HD   PRO  30          2HD       PRO  30  -7.902  -7.150   0.531
  216    H    LYS  31           H        LYS  31  -7.975 -12.382  -1.797
  217    HA   LYS  31           HA       LYS  31  -7.865 -13.934   0.569
  218   1HB   LYS  31          2HB       LYS  31  -7.157 -15.743  -0.832
  219   2HB   LYS  31          1HB       LYS  31  -8.340 -14.812  -1.736
  220   1HG   LYS  31          2HG       LYS  31  -5.374 -14.454  -2.068
  221   2HG   LYS  31          1HG       LYS  31  -6.327 -15.591  -3.024
  222   1HD   LYS  31          1HD       LYS  31  -7.732 -13.733  -3.807
  223   2HD   LYS  31          2HD       LYS  31  -6.740 -12.605  -2.879
  224   1HE   LYS  31          2HE       LYS  31  -5.792 -14.360  -5.140
  225   2HE   LYS  31          1HE       LYS  31  -6.090 -12.625  -5.230
  226   1HZ   LYS  31          1HZ       LYS  31  -4.055 -13.940  -3.511
  227   2HZ   LYS  31          2HZ       LYS  31  -4.339 -12.274  -3.604
  228   3HZ   LYS  31          3HZ       LYS  31  -3.741 -13.107  -4.950
  229    HA   PRO  32           HA       PRO  32  -3.870 -13.691   2.402
  230   1HB   PRO  32          2HB       PRO  32  -3.270 -16.358   1.167
  231   2HB   PRO  32          1HB       PRO  32  -2.967 -15.791   2.815
  232   1HG   PRO  32          1HG       PRO  32  -5.051 -17.367   2.269
  233   2HG   PRO  32          2HG       PRO  32  -5.181 -16.055   3.453
  234   1HD   PRO  32          1HD       PRO  32  -6.321 -16.255   0.728
  235   2HD   PRO  32          2HD       PRO  32  -6.881 -15.310   2.121
  236    H    LEU  33           H        LEU  33  -2.921 -12.059   1.227
  237    HA   LEU  33           HA       LEU  33  -0.751 -12.652  -0.474
  238   1HB   LEU  33          2HB       LEU  33  -2.880 -13.024  -1.931
  239   2HB   LEU  33          1HB       LEU  33  -2.971 -11.276  -1.953
  240    HG   LEU  33           HG       LEU  33  -1.870 -12.297  -3.954
  241   1HD1  LEU  33          1HD2      LEU  33  -1.485  -9.968  -3.349
  242   2HD1  LEU  33          2HD2      LEU  33  -0.037 -10.695  -4.046
  243   3HD1  LEU  33          3HD2      LEU  33  -0.151 -10.455  -2.303
  244   1HD2  LEU  33          1HD1      LEU  33   0.432 -13.094  -3.729
  245   2HD2  LEU  33          2HD1      LEU  33  -0.704 -14.119  -2.852
  246   3HD2  LEU  33          3HD1      LEU  33   0.301 -12.966  -1.974
  247    H    LEU  34           H        LEU  34  -3.197 -10.292   0.468
  248    HA   LEU  34           HA       LEU  34  -1.128  -8.216   0.613
  249   1HB   LEU  34          1HB       LEU  34  -4.114  -8.188   0.537
  250   2HB   LEU  34          2HB       LEU  34  -3.288  -6.873   1.346
  251    HG   LEU  34           HG       LEU  34  -3.890  -6.357  -0.997
  252   1HD1  LEU  34          1HD2      LEU  34  -0.944  -6.469  -0.373
  253   2HD1  LEU  34          2HD2      LEU  34  -2.065  -5.166   0.026
  254   3HD1  LEU  34          3HD2      LEU  34  -1.669  -5.503  -1.659
  255   1HD2  LEU  34          1HD1      LEU  34  -2.643  -7.413  -2.817
  256   2HD2  LEU  34          2HD1      LEU  34  -3.640  -8.582  -1.951
  257   3HD2  LEU  34          3HD1      LEU  34  -1.901  -8.523  -1.664
  258    H    LEU  35           H        LEU  35  -2.626 -10.574   2.435
  259    HA   LEU  35           HA       LEU  35  -2.525  -9.008   4.912
  260   1HB   LEU  35          2HB       LEU  35  -3.819 -11.688   4.813
  261   2HB   LEU  35          1HB       LEU  35  -4.239 -10.283   5.768
  262    HG   LEU  35           HG       LEU  35  -6.023 -10.505   4.286
  263   1HD1  LEU  35          1HD1      LEU  35  -4.874  -8.235   4.321
  264   2HD1  LEU  35          2HD1      LEU  35  -6.028  -8.549   3.024
  265   3HD1  LEU  35          3HD1      LEU  35  -4.295  -8.641   2.707
  266   1HD2  LEU  35          1HD2      LEU  35  -5.733 -10.869   1.861
  267   2HD2  LEU  35          2HD2      LEU  35  -5.113 -12.195   2.846
  268   3HD2  LEU  35          3HD2      LEU  35  -3.995 -11.038   2.124
  269    H    LYS  36           H        LYS  36  -1.638 -12.173   3.537
  270    HA   LYS  36           HA       LYS  36   0.226 -12.962   5.468
  271   1HB   LYS  36          1HB       LYS  36  -0.421 -14.228   3.386
  272   2HB   LYS  36          2HB       LYS  36   0.598 -13.127   2.472
  273   1HG   LYS  36          2HG       LYS  36   2.546 -13.858   3.749
  274   2HG   LYS  36          1HG       LYS  36   1.525 -14.965   4.672
  275   1HD   LYS  36          1HD       LYS  36   0.962 -16.162   2.614
  276   2HD   LYS  36          2HD       LYS  36   1.976 -15.054   1.689
  277   1HE   LYS  36          2HE       LYS  36   3.934 -15.788   2.959
  278   2HE   LYS  36          1HE       LYS  36   2.920 -16.896   3.882
  279   1HZ   LYS  36          1HZ       LYS  36   2.409 -18.079   1.843
  280   2HZ   LYS  36          2HZ       LYS  36   4.081 -18.031   2.095
  281   3HZ   LYS  36          3HZ       LYS  36   3.370 -17.011   0.949
  282    H    LEU  37           H        LEU  37   0.033 -10.172   3.621
  283    HA   LEU  37           HA       LEU  37   2.859  -9.529   3.714
  284   1HB   LEU  37          2HB       LEU  37   1.223  -8.942   1.821
  285   2HB   LEU  37          1HB       LEU  37   0.579  -7.727   2.910
  286    HG   LEU  37           HG       LEU  37   2.117  -6.697   1.369
  287   1HD1  LEU  37          1HD1      LEU  37   2.070  -6.225   3.950
  288   2HD1  LEU  37          2HD1      LEU  37   3.230  -5.418   2.888
  289   3HD1  LEU  37          3HD1      LEU  37   3.736  -6.804   3.852
  290   1HD2  LEU  37          1HD2      LEU  37   4.181  -8.633   2.407
  291   2HD2  LEU  37          2HD2      LEU  37   4.474  -7.308   1.280
  292   3HD2  LEU  37          3HD2      LEU  37   3.449  -8.660   0.802
  293    H    LEU  38           H        LEU  38  -0.199  -8.244   5.010
  294    HA   LEU  38           HA       LEU  38   1.273  -6.312   6.594
  295   1HB   LEU  38          1HB       LEU  38  -1.690  -6.740   6.265
  296   2HB   LEU  38          2HB       LEU  38  -0.956  -5.395   7.114
  297    HG   LEU  38           HG       LEU  38  -0.938  -5.971   4.158
  298   1HD1  LEU  38          1HD2      LEU  38  -1.942  -3.791   3.991
  299   2HD1  LEU  38          2HD2      LEU  38  -1.749  -3.529   5.724
  300   3HD1  LEU  38          3HD2      LEU  38  -2.863  -4.766   5.137
  301   1HD2  LEU  38          1HD1      LEU  38   0.563  -4.090   3.869
  302   2HD2  LEU  38          2HD1      LEU  38   1.327  -5.354   4.831
  303   3HD2  LEU  38          3HD1      LEU  38   0.697  -3.908   5.618
  304    H    LYS  39           H        LYS  39  -0.935  -9.032   7.148
  305    HA   LYS  39           HA       LYS  39  -1.043  -8.872   9.942
  306   1HB   LYS  39          2HB       LYS  39  -1.106 -11.389   8.271
  307   2HB   LYS  39          1HB       LYS  39  -1.741 -11.195   9.901
  308   1HG   LYS  39          2HG       LYS  39  -3.364  -9.550   9.041
  309   2HG   LYS  39          1HG       LYS  39  -2.762  -9.849   7.408
  310   1HD   LYS  39          2HD       LYS  39  -4.032 -11.891   9.230
  311   2HD   LYS  39          1HD       LYS  39  -4.802 -11.114   7.845
  312   1HE   LYS  39          2HE       LYS  39  -3.205 -12.125   6.341
  313   2HE   LYS  39          1HE       LYS  39  -2.328 -12.831   7.699
  314   1HZ   LYS  39          1HZ       LYS  39  -4.290 -14.148   8.228
  315   2HZ   LYS  39          2HZ       LYS  39  -3.765 -14.454   6.648
  316   3HZ   LYS  39          3HZ       LYS  39  -5.119 -13.477   6.913
  317    H    SER  40           H        SER  40   1.565  -9.543   7.911
  318    HA   SER  40           HA       SER  40   3.099 -11.132   9.740
  319   1HB   SER  40          2HB       SER  40   3.575 -11.193   7.339
  320   2HB   SER  40          1HB       SER  40   3.978  -9.476   7.364
  321    HG   SER  40           HG       SER  40   5.797  -9.901   8.482
  322    H    VAL  41           H        VAL  41   3.052  -7.692   8.835
  323    HA   VAL  41           HA       VAL  41   5.085  -6.851  10.594
  324    HB   VAL  41           HB       VAL  41   3.054  -4.818  10.346
  325   1HG1  VAL  41          1HG2      VAL  41   5.710  -4.961   8.944
  326   2HG1  VAL  41          2HG2      VAL  41   5.549  -4.591  10.661
  327   3HG1  VAL  41          3HG2      VAL  41   4.816  -3.530   9.459
  328   1HG2  VAL  41          1HG1      VAL  41   3.775  -6.299   7.833
  329   2HG2  VAL  41          2HG1      VAL  41   3.225  -4.623   7.833
  330   3HG2  VAL  41          3HG1      VAL  41   2.170  -5.897   8.448
  331    H    GLY  42           H        GLY  42   1.561  -6.984  10.982
  332   1HA   GLY  42          1HA       GLY  42   1.502  -7.569  13.686
  333   2HA   GLY  42          2HA       GLY  42   1.562  -5.817  13.571
  334    H    ALA  43           H        ALA  43   0.083  -6.253  10.886
  335    HA   ALA  43           HA       ALA  43  -2.438  -5.464  11.712
  336   1HB   ALA  43          1HB       ALA  43  -3.193  -5.971   9.452
  337   2HB   ALA  43          2HB       ALA  43  -1.743  -6.935   9.173
  338   3HB   ALA  43          3HB       ALA  43  -1.610  -5.194   9.428
  339    H    GLN  44           H        GLN  44  -4.408  -6.488  12.019
  340    HA   GLN  44           HA       GLN  44  -4.505  -9.400  11.988
  341   1HB   GLN  44          1HB       GLN  44  -4.974  -7.769  14.487
  342   2HB   GLN  44          2HB       GLN  44  -5.380  -9.469  14.319
  343   1HG   GLN  44          2HG       GLN  44  -3.027 -10.002  13.959
  344   2HG   GLN  44          1HG       GLN  44  -2.617  -8.294  14.122
  345   1HE2  GLN  44          2HE2      GLN  44  -2.704  -7.323  16.144
  346   2HE2  GLN  44          1HE2      GLN  44  -2.770  -8.243  17.605
  347    H    LYS  45           H        LYS  45  -5.877  -8.196  10.179
  348    HA   LYS  45           HA       LYS  45  -8.636  -8.390  11.142
  349   1HB   LYS  45          2HB       LYS  45  -7.716  -6.215   9.254
  350   2HB   LYS  45          1HB       LYS  45  -9.349  -6.463   9.856
  351   1HG   LYS  45          2HG       LYS  45  -8.551  -5.994  12.140
  352   2HG   LYS  45          1HG       LYS  45  -6.948  -5.659  11.484
  353   1HD   LYS  45          2HD       LYS  45  -9.469  -4.188  10.721
  354   2HD   LYS  45          1HD       LYS  45  -8.275  -3.611  11.884
  355   1HE   LYS  45          1HE       LYS  45  -6.571  -3.591  10.142
  356   2HE   LYS  45          2HE       LYS  45  -7.743  -4.205   8.976
  357   1HZ   LYS  45          1HZ       LYS  45  -7.465  -1.817   8.776
  358   2HZ   LYS  45          2HZ       LYS  45  -7.918  -1.600  10.392
  359   3HZ   LYS  45          3HZ       LYS  45  -9.039  -2.190   9.270
  360    H    ASP  46           H        ASP  46 -10.194  -8.723   9.363
  361    HA   ASP  46           HA       ASP  46  -9.019 -10.396   7.273
  362   1HB   ASP  46          2HB       ASP  46 -11.339 -11.171   6.900
  363   2HB   ASP  46          1HB       ASP  46 -10.825 -11.393   8.569
  364    H    THR  47           H        THR  47 -10.134  -7.262   7.704
  365    HA   THR  47           HA       THR  47 -10.257  -6.895   4.791
  366    HB   THR  47           HB       THR  47 -11.977  -5.096   5.134
  367    HG1  THR  47           1HG      THR  47 -13.176  -5.449   7.221
  368   1HG2  THR  47          1HG2      THR  47 -12.663  -7.291   4.335
  369   2HG2  THR  47          2HG2      THR  47 -13.880  -6.645   5.437
  370   3HG2  THR  47          3HG2      THR  47 -12.756  -7.888   5.992
  371    H    TYR  48           H        TYR  48  -9.377  -5.011   4.007
  372    HA   TYR  48           HA       TYR  48  -7.990  -3.337   5.983
  373   1HB   TYR  48          2HB       TYR  48  -6.852  -4.646   3.525
  374   2HB   TYR  48          1HB       TYR  48  -6.070  -3.288   4.324
  375    HD1  TYR  48           1HD      TYR  48  -5.004  -3.534   6.437
  376    HD2  TYR  48           2HD      TYR  48  -6.981  -6.839   4.626
  377    HE1  TYR  48           1HE      TYR  48  -3.884  -5.060   8.015
  378    HE2  TYR  48           2HE      TYR  48  -5.852  -8.378   6.182
  379    HH   TYR  48           HH       TYR  48  -4.229  -7.301   8.963
  380    H    THR  49           H        THR  49  -6.927  -1.425   4.795
  381    HA   THR  49           HA       THR  49  -8.368  -0.572   2.418
  382    HB   THR  49           HB       THR  49  -8.608   1.766   3.525
  383    HG1  THR  49           1HG      THR  49  -9.244   1.324   5.842
  384   1HG2  THR  49          1HG2      THR  49 -10.447  -0.534   4.139
  385   2HG2  THR  49          2HG2      THR  49 -10.499   0.534   2.734
  386   3HG2  THR  49          3HG2      THR  49 -10.873   1.167   4.338
  387    H    MET  50           H        MET  50  -7.416   1.494   1.546
  388    HA   MET  50           HA       MET  50  -4.638   1.007   1.277
  389   1HB   MET  50          1HB       MET  50  -6.472   3.122   0.174
  390   2HB   MET  50          2HB       MET  50  -4.748   3.102  -0.182
  391   1HG   MET  50          2HG       MET  50  -5.132   0.697  -0.960
  392   2HG   MET  50          1HG       MET  50  -6.845   1.105  -0.947
  393   1HE   MET  50          1HE       MET  50  -3.325   2.061  -2.425
  394   2HE   MET  50          2HE       MET  50  -3.935   3.593  -1.799
  395   3HE   MET  50          3HE       MET  50  -3.762   3.357  -3.538
  396    H    LYS  51           H        LYS  51  -6.198   2.563   3.710
  397    HA   LYS  51           HA       LYS  51  -4.094   4.544   4.144
  398   1HB   LYS  51          1HB       LYS  51  -5.404   5.053   6.238
  399   2HB   LYS  51          2HB       LYS  51  -6.262   5.343   4.732
  400   1HG   LYS  51          1HG       LYS  51  -7.442   3.215   4.997
  401   2HG   LYS  51          2HG       LYS  51  -6.588   2.940   6.517
  402   1HD   LYS  51          1HD       LYS  51  -7.592   4.960   7.455
  403   2HD   LYS  51          2HD       LYS  51  -8.435   5.254   5.932
  404   1HE   LYS  51          1HE       LYS  51  -9.635   3.137   6.193
  405   2HE   LYS  51          2HE       LYS  51  -8.799   2.852   7.720
  406   1HZ   LYS  51          1HZ       LYS  51 -11.004   3.754   8.083
  407   2HZ   LYS  51          2HZ       LYS  51 -10.634   5.116   7.151
  408   3HZ   LYS  51          3HZ       LYS  51  -9.827   4.849   8.611
  409    H    GLU  52           H        GLU  52  -5.541   1.800   5.904
  410    HA   GLU  52           HA       GLU  52  -3.471   1.123   7.596
  411   1HB   GLU  52          2HB       GLU  52  -5.793  -0.057   6.870
  412   2HB   GLU  52          1HB       GLU  52  -4.654  -1.091   6.021
  413   1HG   GLU  52          1HG       GLU  52  -5.131  -2.062   8.145
  414   2HG   GLU  52          2HG       GLU  52  -3.469  -1.473   8.157
  415    H    VAL  53           H        VAL  53  -3.925  -0.396   4.417
  416    HA   VAL  53           HA       VAL  53  -1.452  -1.486   4.056
  417    HB   VAL  53           HB       VAL  53  -3.105  -0.186   1.886
  418   1HG1  VAL  53          1HG2      VAL  53  -0.841  -0.724   1.157
  419   2HG1  VAL  53          2HG2      VAL  53  -2.017  -1.799   0.399
  420   3HG1  VAL  53          3HG2      VAL  53  -1.034  -2.376   1.744
  421   1HG2  VAL  53          1HG1      VAL  53  -4.429  -1.754   3.191
  422   2HG2  VAL  53          2HG1      VAL  53  -3.190  -2.992   2.991
  423   3HG2  VAL  53          3HG1      VAL  53  -4.092  -2.413   1.590
  424    H    LEU  54           H        LEU  54  -2.385   1.889   3.486
  425    HA   LEU  54           HA       LEU  54  -0.208   2.882   2.159
  426   1HB   LEU  54          1HB       LEU  54  -2.243   4.136   3.065
  427   2HB   LEU  54          2HB       LEU  54  -1.357   4.274   4.570
  428    HG   LEU  54           HG       LEU  54  -0.218   5.283   1.973
  429   1HD1  LEU  54          1HD1      LEU  54  -1.944   6.795   3.929
  430   2HD1  LEU  54          2HD1      LEU  54  -2.378   6.363   2.275
  431   3HD1  LEU  54          3HD1      LEU  54  -1.063   7.500   2.575
  432   1HD2  LEU  54          1HD2      LEU  54   0.301   5.977   4.862
  433   2HD2  LEU  54          2HD2      LEU  54   1.083   6.723   3.468
  434   3HD2  LEU  54          3HD2      LEU  54   1.346   5.014   3.817
  435    H    PHE  55           H        PHE  55  -0.398   3.141   5.714
  436    HA   PHE  55           HA       PHE  55   2.466   3.453   5.796
  437   1HB   PHE  55          2HB       PHE  55   2.072   3.723   8.278
  438   2HB   PHE  55          1HB       PHE  55   1.260   4.893   7.245
  439    HD1  PHE  55           1HD      PHE  55  -0.975   5.315   7.563
  440    HD2  PHE  55           2HD      PHE  55   0.652   1.637   8.952
  441    HE1  PHE  55           1HE      PHE  55  -3.125   4.771   8.630
  442    HE2  PHE  55           2HE      PHE  55  -1.494   1.085  10.018
  443    HZ   PHE  55           HZ       PHE  55  -3.387   2.653   9.858
  444    H    TYR  56           H        TYR  56   0.323   0.836   6.039
  445    HA   TYR  56           HA       TYR  56   1.925  -0.713   7.872
  446   1HB   TYR  56          1HB       TYR  56  -0.730  -0.835   6.953
  447   2HB   TYR  56          2HB       TYR  56   0.047  -2.319   6.406
  448    HD1  TYR  56           1HD      TYR  56  -2.168  -1.801   8.567
  449    HD2  TYR  56           2HD      TYR  56   2.019  -2.524   8.745
  450    HE1  TYR  56           1HE      TYR  56  -2.441  -2.752  10.812
  451    HE2  TYR  56           2HE      TYR  56   1.768  -3.485  10.994
  452    HH   TYR  56           HH       TYR  56  -1.274  -4.279  12.325
  453    H    LEU  57           H        LEU  57   0.888  -1.305   4.498
  454    HA   LEU  57           HA       LEU  57   2.909  -3.138   3.883
  455   1HB   LEU  57          2HB       LEU  57   1.050  -2.865   2.389
  456   2HB   LEU  57          1HB       LEU  57   1.427  -1.173   2.138
  457    HG   LEU  57           HG       LEU  57   3.320  -1.691   0.796
  458   1HD1  LEU  57          1HD1      LEU  57   2.937  -4.576   1.584
  459   2HD1  LEU  57          2HD1      LEU  57   4.227  -3.512   2.146
  460   3HD1  LEU  57          3HD1      LEU  57   4.134  -3.962   0.443
  461   1HD2  LEU  57          1HD2      LEU  57   1.141  -1.931  -0.309
  462   2HD2  LEU  57          2HD2      LEU  57   1.139  -3.650   0.096
  463   3HD2  LEU  57          3HD2      LEU  57   2.359  -3.003  -1.002
  464    H    GLY  58           H        GLY  58   2.884   0.383   3.920
  465   1HA   GLY  58          2HA       GLY  58   5.436   0.937   2.985
  466   2HA   GLY  58          1HA       GLY  58   4.652   1.798   4.302
  467    H    GLN  59           H        GLN  59   4.483  -0.169   6.237
  468    HA   GLN  59           HA       GLN  59   7.024  -0.294   7.371
  469   1HB   GLN  59          2HB       GLN  59   4.757  -2.243   7.824
  470   2HB   GLN  59          1HB       GLN  59   6.128  -1.983   8.891
  471   1HG   GLN  59          2HG       GLN  59   3.872  -0.094   8.296
  472   2HG   GLN  59          1HG       GLN  59   4.271  -0.863   9.830
  473   1HE2  GLN  59          1HE2      GLN  59   3.965   1.967   9.162
  474   2HE2  GLN  59          2HE2      GLN  59   5.453   2.723   9.609
  475    H    TYR  60           H        TYR  60   5.247  -3.074   5.968
  476    HA   TYR  60           HA       TYR  60   7.212  -4.916   6.436
  477   1HB   TYR  60          2HB       TYR  60   4.869  -5.382   5.644
  478   2HB   TYR  60          1HB       TYR  60   5.413  -5.009   4.013
  479    HD1  TYR  60           1HD      TYR  60   5.214  -7.506   6.578
  480    HD2  TYR  60           2HD      TYR  60   7.242  -6.433   2.999
  481    HE1  TYR  60           1HE      TYR  60   5.971  -9.827   6.321
  482    HE2  TYR  60           2HE      TYR  60   8.003  -8.755   2.728
  483    HH   TYR  60           HH       TYR  60   8.390 -10.738   4.121
  484    H    ILE  61           H        ILE  61   6.910  -2.804   3.619
  485    HA   ILE  61           HA       ILE  61   9.069  -3.803   2.125
  486    HB   ILE  61           HB       ILE  61   8.325  -0.887   2.316
  487   1HG1  ILE  61          2HG1      ILE  61   7.089  -2.856   0.403
  488   2HG1  ILE  61          1HG1      ILE  61   6.359  -2.500   1.967
  489   1HG2  ILE  61          1HG2      ILE  61   8.991  -0.916  -0.089
  490   2HG2  ILE  61          2HG2      ILE  61   9.543  -2.577   0.139
  491   3HG2  ILE  61          3HG2      ILE  61  10.310  -1.263   1.032
  492   1HD1  ILE  61          1HD1      ILE  61   5.301  -1.140   0.337
  493   2HD1  ILE  61          2HD1      ILE  61   6.854  -0.592  -0.293
  494   3HD1  ILE  61          3HD1      ILE  61   6.334  -0.100   1.321
  495    H    MET  62           H        MET  62   9.055  -0.910   4.222
  496    HA   MET  62           HA       MET  62  11.950  -1.204   4.545
  497   1HB   MET  62          1HB       MET  62  11.883   1.082   5.458
  498   2HB   MET  62          2HB       MET  62  11.183   0.988   3.849
  499   1HG   MET  62          1HG       MET  62   8.947   1.005   4.812
  500   2HG   MET  62          2HG       MET  62   9.640   1.082   6.431
  501   1HE   MET  62          1HE       MET  62  12.088   3.061   6.044
  502   2HE   MET  62          2HE       MET  62  10.952   3.159   7.390
  503   3HE   MET  62          3HE       MET  62  11.332   4.602   6.450
  504    H    THR  63           H        THR  63  10.332  -3.075   5.937
  505    HA   THR  63           HA       THR  63  11.501  -2.554   8.557
  506    HB   THR  63           HB       THR  63   8.950  -2.080   8.565
  507    HG1  THR  63           1HG      THR  63   9.482  -2.227  10.604
  508   1HG2  THR  63          1HG2      THR  63   8.946  -5.097   8.678
  509   2HG2  THR  63          2HG2      THR  63   8.305  -4.123   7.356
  510   3HG2  THR  63          3HG2      THR  63   7.559  -4.044   8.952
  511    H    LYS  64           H        LYS  64  10.465  -4.695   6.072
  512    HA   LYS  64           HA       LYS  64  11.670  -6.975   7.492
  513   1HB   LYS  64          2HB       LYS  64   9.542  -6.835   5.365
  514   2HB   LYS  64          1HB       LYS  64  10.401  -8.327   5.721
  515   1HG   LYS  64          2HG       LYS  64   8.937  -6.756   7.818
  516   2HG   LYS  64          1HG       LYS  64   8.171  -8.021   6.852
  517   1HD   LYS  64          2HD       LYS  64   9.831  -9.635   7.649
  518   2HD   LYS  64          1HD       LYS  64  10.591  -8.371   8.620
  519   1HE   LYS  64          2HE       LYS  64   8.527  -8.108   9.901
  520   2HE   LYS  64          1HE       LYS  64   7.759  -9.362   8.928
  521   1HZ   LYS  64          1HZ       LYS  64  10.131  -9.751  10.674
  522   2HZ   LYS  64          2HZ       LYS  64   9.373 -10.952   9.753
  523   3HZ   LYS  64          3HZ       LYS  64   8.549 -10.229  11.041
  524    H    ARG  65           H        ARG  65  13.261  -5.024   6.190
  525    HA   ARG  65           HA       ARG  65  15.008  -4.839   4.747
  526   1HB   ARG  65          1HB       ARG  65  14.656  -7.832   4.487
  527   2HB   ARG  65          2HB       ARG  65  16.064  -6.921   3.958
  528   1HG   ARG  65          2HG       ARG  65  16.543  -6.284   6.251
  529   2HG   ARG  65          1HG       ARG  65  15.100  -7.139   6.802
  530   1HD   ARG  65          2HD       ARG  65  16.036  -9.243   5.972
  531   2HD   ARG  65          1HD       ARG  65  17.478  -8.386   5.431
  532    HE   ARG  65           HE       ARG  65  17.241  -7.814   8.109
  533   1HH1  ARG  65          2HH1      ARG  65  17.566 -10.689   6.168
  534   2HH1  ARG  65          1HH1      ARG  65  18.398 -11.581   7.397
  535   1HH2  ARG  65          1HH2      ARG  65  18.338  -8.980   9.734
  536   2HH2  ARG  65          2HH2      ARG  65  18.838 -10.609   9.424
  537    H    LEU  66           H        LEU  66  15.571  -6.319   2.387
  538    HA   LEU  66           HA       LEU  66  15.041  -6.521   0.185
  539   1HB   LEU  66          1HB       LEU  66  12.251  -6.153   1.243
  540   2HB   LEU  66          2HB       LEU  66  12.582  -6.237  -0.473
  541    HG   LEU  66           HG       LEU  66  11.875  -8.400   0.204
  542   1HD1  LEU  66          1HD1      LEU  66  14.881  -8.465   0.026
  543   2HD1  LEU  66          2HD1      LEU  66  13.778  -8.353  -1.345
  544   3HD1  LEU  66          3HD1      LEU  66  13.776  -9.794  -0.327
  545   1HD2  LEU  66          1HD2      LEU  66  12.885  -9.655   2.014
  546   2HD2  LEU  66          2HD2      LEU  66  12.229  -8.130   2.611
  547   3HD2  LEU  66          3HD2      LEU  66  13.968  -8.309   2.370
  548    H    TYR  67           H        TYR  67  14.432  -3.806   2.082
  549    HA   TYR  67           HA       TYR  67  13.464  -1.970   0.175
  550   1HB   TYR  67          2HB       TYR  67  13.930  -0.290   1.777
  551   2HB   TYR  67          1HB       TYR  67  13.474  -1.721   2.694
  552    HD1  TYR  67           1HD      TYR  67  15.675   0.915   2.615
  553    HD2  TYR  67           2HD      TYR  67  15.645  -3.298   3.228
  554    HE1  TYR  67           1HE      TYR  67  17.768   1.096   3.880
  555    HE2  TYR  67           2HE      TYR  67  17.744  -3.128   4.504
  556    HH   TYR  67           HH       TYR  67  19.662  -1.600   4.701
  557    H    ASP  68           H        ASP  68  15.008   0.179   0.062
  558    HA   ASP  68           HA       ASP  68  17.032  -0.567  -1.839
  559   1HB   ASP  68          1HB       ASP  68  17.184   1.797  -2.294
  560   2HB   ASP  68          2HB       ASP  68  15.489   1.419  -2.055
  561    H    GLU  69           H        GLU  69  18.743   1.788  -1.122
  562    HA   GLU  69           HA       GLU  69  19.401   1.550   1.650
  563   1HB   GLU  69          1HB       GLU  69  21.787   1.003   1.349
  564   2HB   GLU  69          2HB       GLU  69  20.742  -0.310   0.823
  565   1HG   GLU  69          1HG       GLU  69  21.046   0.385  -1.502
  566   2HG   GLU  69          2HG       GLU  69  22.105   1.689  -0.968
  567    H    LYS  70           H        LYS  70  18.481   3.555  -0.227
  568    HA   LYS  70           HA       LYS  70  20.664   5.512   0.088
  569   1HB   LYS  70          2HB       LYS  70  19.709   6.732  -1.834
  570   2HB   LYS  70          1HB       LYS  70  20.246   5.116  -2.270
  571   1HG   LYS  70          2HG       LYS  70  17.942   4.317  -2.188
  572   2HG   LYS  70          1HG       LYS  70  17.397   5.935  -1.735
  573   1HD   LYS  70          1HD       LYS  70  17.033   5.618  -4.093
  574   2HD   LYS  70          2HD       LYS  70  18.330   6.794  -3.867
  575   1HE   LYS  70          2HE       LYS  70  19.990   5.050  -4.283
  576   2HE   LYS  70          1HE       LYS  70  18.700   3.866  -4.492
  577   1HZ   LYS  70          1HZ       LYS  70  19.140   6.258  -6.196
  578   2HZ   LYS  70          2HZ       LYS  70  17.905   5.120  -6.397
  579   3HZ   LYS  70          3HZ       LYS  70  19.519   4.664  -6.616
  580    H    GLN  71           H        GLN  71  17.206   4.900   0.294
  581    HA   GLN  71           HA       GLN  71  16.932   6.735   2.463
  582   1HB   GLN  71          1HB       GLN  71  15.234   8.195   1.374
  583   2HB   GLN  71          2HB       GLN  71  16.853   8.395   0.719
  584   1HG   GLN  71          1HG       GLN  71  16.260   6.994  -1.188
  585   2HG   GLN  71          2HG       GLN  71  14.638   6.782  -0.529
  586   1HE2  GLN  71          2HE2      GLN  71  15.495   7.938  -3.069
  587   2HE2  GLN  71          1HE2      GLN  71  14.853   9.543  -3.105
  588    H    GLN  72           H        GLN  72  16.356   3.941   1.436
  589    HA   GLN  72           HA       GLN  72  14.774   2.308   1.622
  590   1HB   GLN  72          1HB       GLN  72  13.584   4.120   3.727
  591   2HB   GLN  72          2HB       GLN  72  13.447   2.369   3.622
  592   1HG   GLN  72          2HG       GLN  72  15.958   2.282   3.888
  593   2HG   GLN  72          1HG       GLN  72  15.881   3.997   4.293
  594   1HE2  GLN  72          1HE2      GLN  72  13.395   1.706   5.163
  595   2HE2  GLN  72          2HE2      GLN  72  13.688   1.737   6.865
  596    H    HIS  73           H        HIS  73  14.271   4.478  -0.283
  597    HA   HIS  73           HA       HIS  73  11.331   4.416  -0.380
  598   1HB   HIS  73          1HB       HIS  73  13.370   6.289  -1.519
  599   2HB   HIS  73          2HB       HIS  73  11.800   6.139  -2.298
  600    HD1  HIS  73           1HD      HIS  73  13.458   7.470   0.764
  601    HD2  HIS  73           2HD      HIS  73   9.634   7.173  -0.835
  602    HE1  HIS  73           1HE      HIS  73  12.026   8.994   2.160
  603    HE2  HIS  73           2HE      HIS  73   9.737   8.871   1.113
  604    H    ILE  74           H        ILE  74  14.224   3.272  -1.990
  605    HA   ILE  74           HA       ILE  74  12.486   1.910  -3.930
  606    HB   ILE  74           HB       ILE  74  15.458   1.495  -3.722
  607   1HG1  ILE  74          1HG1      ILE  74  15.163   3.904  -3.927
  608   2HG1  ILE  74          2HG1      ILE  74  15.750   3.239  -5.450
  609   1HG2  ILE  74          1HG2      ILE  74  13.503   1.258  -6.003
  610   2HG2  ILE  74          2HG2      ILE  74  14.205  -0.075  -5.085
  611   3HG2  ILE  74          3HG2      ILE  74  15.235   0.938  -6.098
  612   1HD1  ILE  74          1HD1      ILE  74  13.498   3.341  -6.370
  613   2HD1  ILE  74          2HD1      ILE  74  14.043   4.925  -5.816
  614   3HD1  ILE  74          3HD1      ILE  74  12.901   3.994  -4.845
  615    H    VAL  75           H        VAL  75  12.963  -0.509  -4.150
  616    HA   VAL  75           HA       VAL  75  13.877  -1.864  -1.796
  617    HB   VAL  75           HB       VAL  75  11.834  -1.363  -0.802
  618   1HG1  VAL  75          1HG2      VAL  75   9.677  -1.474  -1.928
  619   2HG1  VAL  75          2HG2      VAL  75  10.474  -1.979  -3.416
  620   3HG1  VAL  75          3HG2      VAL  75  10.776  -0.371  -2.755
  621   1HG2  VAL  75          1HG1      VAL  75  12.280  -3.737  -0.645
  622   2HG2  VAL  75          2HG1      VAL  75  11.437  -4.021  -2.169
  623   3HG2  VAL  75          3HG1      VAL  75  10.542  -3.455  -0.758
  624    H    TYR  76           H        TYR  76  15.098  -3.212  -2.942
  625    HA   TYR  76           HA       TYR  76  14.063  -4.581  -5.276
  626   1HB   TYR  76          2HB       TYR  76  16.711  -5.123  -3.956
  627   2HB   TYR  76          1HB       TYR  76  16.275  -5.271  -5.658
  628    HD1  TYR  76           1HD      TYR  76  15.603  -3.049  -6.852
  629    HD2  TYR  76           2HD      TYR  76  17.839  -3.218  -3.234
  630    HE1  TYR  76           1HE      TYR  76  16.449  -0.775  -7.269
  631    HE2  TYR  76           2HE      TYR  76  18.687  -0.951  -3.644
  632    HH   TYR  76           HH       TYR  76  17.371   1.112  -5.988
  633    H    CYS  77           H        CYS  77  12.756  -6.271  -4.963
  634    HA   CYS  77           HA       CYS  77  13.105  -7.832  -2.490
  635   1HB   CYS  77          1HB       CYS  77  10.643  -8.138  -2.518
  636   2HB   CYS  77          2HB       CYS  77  11.119  -6.448  -2.379
  637    HG   CYS  77           HG       CYS  77   9.776  -5.605  -4.390
  638    H    SER  78           H        SER  78  14.557  -8.973  -4.225
  639    HA   SER  78           HA       SER  78  13.264 -10.801  -5.984
  640   1HB   SER  78          1HB       SER  78  16.014 -10.934  -4.721
  641   2HB   SER  78          2HB       SER  78  15.452 -11.944  -6.053
  642    HG   SER  78           HG       SER  78  14.985  -9.428  -6.713
  643    H    ASN  79           H        ASN  79  11.931 -12.344  -5.324
  644    HA   ASN  79           HA       ASN  79  11.020 -14.071  -4.164
  645   1HB   ASN  79          1HB       ASN  79  13.835 -14.406  -3.104
  646   2HB   ASN  79          2HB       ASN  79  12.543 -15.594  -2.964
  647   1HD2  ASN  79          2HD2      ASN  79  11.503 -15.008  -5.629
  648   2HD2  ASN  79          1HD2      ASN  79  12.606 -15.737  -6.740
  649    H    ASP  80           H        ASP  80   9.946 -12.206  -3.045
  650    HA   ASP  80           HA       ASP  80  10.352 -12.514  -0.159
  651   1HB   ASP  80          1HB       ASP  80  11.446 -10.395  -0.882
  652   2HB   ASP  80          2HB       ASP  80   9.891  -9.838  -1.494
  653    H    LEU  81           H        LEU  81   8.425 -11.778   1.101
  654    HA   LEU  81           HA       LEU  81   5.980 -12.668   0.004
  655   1HB   LEU  81          2HB       LEU  81   6.619 -11.031   2.451
  656   2HB   LEU  81          1HB       LEU  81   4.982 -11.491   2.030
  657    HG   LEU  81           HG       LEU  81   5.761 -13.900   2.095
  658   1HD1  LEU  81          1HD1      LEU  81   8.152 -13.496   1.886
  659   2HD1  LEU  81          2HD1      LEU  81   7.789 -14.371   3.375
  660   3HD1  LEU  81          3HD1      LEU  81   8.155 -12.647   3.433
  661   1HD2  LEU  81          1HD2      LEU  81   5.910 -12.282   4.633
  662   2HD2  LEU  81          2HD2      LEU  81   5.650 -14.024   4.536
  663   3HD2  LEU  81          3HD2      LEU  81   4.445 -12.915   3.883
  664    H    LEU  82           H        LEU  82   7.335  -9.427   0.503
  665    HA   LEU  82           HA       LEU  82   5.342  -7.864  -0.624
  666   1HB   LEU  82          1HB       LEU  82   7.969  -7.475   0.127
  667   2HB   LEU  82          2HB       LEU  82   8.025  -7.213  -1.606
  668    HG   LEU  82           HG       LEU  82   7.693  -5.088  -0.615
  669   1HD1  LEU  82          1HD2      LEU  82   5.479  -4.423  -1.446
  670   2HD1  LEU  82          2HD2      LEU  82   5.037  -6.124  -1.599
  671   3HD1  LEU  82          3HD2      LEU  82   6.336  -5.457  -2.589
  672   1HD2  LEU  82          1HD1      LEU  82   6.989  -5.838   1.593
  673   2HD2  LEU  82          2HD1      LEU  82   5.419  -6.306   0.941
  674   3HD2  LEU  82          3HD1      LEU  82   5.893  -4.608   0.961
  675    H    GLY  83           H        GLY  83   7.520 -10.155  -2.080
  676   1HA   GLY  83          1HA       GLY  83   7.114  -9.397  -4.794
  677   2HA   GLY  83          2HA       GLY  83   7.747 -10.936  -4.230
  678    H    ASP  84           H        ASP  84   5.522 -11.743  -2.659
  679    HA   ASP  84           HA       ASP  84   3.781 -12.936  -4.449
  680   1HB   ASP  84          2HB       ASP  84   2.940 -12.015  -1.693
  681   2HB   ASP  84          1HB       ASP  84   2.326 -13.388  -2.606
  682    H    LEU  85           H        LEU  85   3.710  -9.724  -3.062
  683    HA   LEU  85           HA       LEU  85   1.195  -8.931  -4.112
  684   1HB   LEU  85          2HB       LEU  85   3.639  -7.304  -3.423
  685   2HB   LEU  85          1HB       LEU  85   2.080  -6.621  -3.836
  686    HG   LEU  85           HG       LEU  85   2.675  -8.357  -1.447
  687   1HD1  LEU  85          1HD2      LEU  85   3.589  -6.120  -1.220
  688   2HD1  LEU  85          2HD2      LEU  85   2.188  -6.318  -0.167
  689   3HD1  LEU  85          3HD2      LEU  85   2.036  -5.420  -1.678
  690   1HD2  LEU  85          1HD1      LEU  85   0.126  -7.042  -2.361
  691   2HD2  LEU  85          2HD1      LEU  85   0.363  -7.800  -0.784
  692   3HD2  LEU  85          3HD1      LEU  85   0.442  -8.773  -2.254
  693    H    PHE  86           H        PHE  86   4.328  -7.663  -5.169
  694    HA   PHE  86           HA       PHE  86   3.101  -6.929  -7.672
  695   1HB   PHE  86          2HB       PHE  86   5.926  -6.454  -6.694
  696   2HB   PHE  86          1HB       PHE  86   5.182  -5.703  -8.102
  697    HD1  PHE  86           1HD      PHE  86   4.180  -3.639  -7.886
  698    HD2  PHE  86           2HD      PHE  86   4.705  -6.067  -4.432
  699    HE1  PHE  86           1HE      PHE  86   3.371  -1.791  -6.469
  700    HE2  PHE  86           2HE      PHE  86   3.895  -4.232  -3.012
  701    HZ   PHE  86           HZ       PHE  86   3.226  -2.095  -4.030
  702    H    GLY  87           H        GLY  87   6.119  -8.634  -6.817
  703   1HA   GLY  87          1HA       GLY  87   6.885 -10.587  -8.025
  704   2HA   GLY  87          2HA       GLY  87   5.964 -10.024  -9.413
  705    H    VAL  88           H        VAL  88   7.143  -7.263  -8.369
  706    HA   VAL  88           HA       VAL  88   9.100  -6.996 -10.370
  707    HB   VAL  88           HB       VAL  88   9.657  -4.848  -9.332
  708   1HG1  VAL  88          1HG2      VAL  88   7.687  -4.966 -10.752
  709   2HG1  VAL  88          2HG2      VAL  88   7.447  -3.806  -9.445
  710   3HG1  VAL  88          3HG2      VAL  88   6.693  -5.399  -9.360
  711   1HG2  VAL  88          1HG1      VAL  88   9.590  -5.537  -6.995
  712   2HG2  VAL  88          2HG1      VAL  88   7.839  -5.735  -7.094
  713   3HG2  VAL  88          3HG1      VAL  88   8.557  -4.132  -7.266
  714    HA   PRO  89           HA       PRO  89  12.860  -7.999  -8.002
  715   1HB   PRO  89          2HB       PRO  89  14.651  -6.764  -9.569
  716   2HB   PRO  89          1HB       PRO  89  13.894  -8.285 -10.060
  717   1HG   PRO  89          2HG       PRO  89  13.241  -5.486 -10.897
  718   2HG   PRO  89          1HG       PRO  89  13.342  -6.953 -11.886
  719   1HD   PRO  89          2HD       PRO  89  10.990  -5.884 -10.960
  720   2HD   PRO  89          1HD       PRO  89  11.212  -7.600 -11.352
  721    H    SER  90           H        SER  90  11.564  -4.928  -8.886
  722    HA   SER  90           HA       SER  90  12.522  -3.719  -6.456
  723   1HB   SER  90          2HB       SER  90  13.584  -1.780  -7.613
  724   2HB   SER  90          1HB       SER  90  14.465  -3.293  -7.826
  725    HG   SER  90           HG       SER  90  13.639  -3.460  -9.890
  726    H    PHE  91           H        PHE  91  11.171  -2.093  -5.778
  727    HA   PHE  91           HA       PHE  91   9.678  -0.616  -7.781
  728   1HB   PHE  91          1HB       PHE  91   7.535  -0.878  -6.790
  729   2HB   PHE  91          2HB       PHE  91   8.202  -2.490  -6.996
  730    HD1  PHE  91           1HD      PHE  91   8.743  -3.870  -5.105
  731    HD2  PHE  91           2HD      PHE  91   7.264   0.082  -4.566
  732    HE1  PHE  91           1HE      PHE  91   8.252  -4.378  -2.746
  733    HE2  PHE  91           2HE      PHE  91   6.771  -0.409  -2.215
  734    HZ   PHE  91           HZ       PHE  91   7.267  -2.644  -1.297
  735    H    SER  92           H        SER  92   8.391   1.226  -6.610
  736    HA   SER  92           HA       SER  92  10.269   2.418  -4.678
  737   1HB   SER  92          1HB       SER  92   9.099   3.706  -7.154
  738   2HB   SER  92          2HB       SER  92  10.028   4.563  -5.925
  739    HG   SER  92           HG       SER  92  11.282   3.855  -7.750
  740    H    VAL  93           H        VAL  93   9.300   3.078  -2.899
  741    HA   VAL  93           HA       VAL  93   6.449   3.548  -2.788
  742    HB   VAL  93           HB       VAL  93   7.224   4.358  -0.372
  743   1HG1  VAL  93          1HG2      VAL  93   5.740   2.483  -0.828
  744   2HG1  VAL  93          2HG2      VAL  93   6.929   2.050   0.402
  745   3HG1  VAL  93          3HG2      VAL  93   7.123   1.475  -1.254
  746   1HG2  VAL  93          1HG1      VAL  93   9.171   3.119   0.399
  747   2HG2  VAL  93          2HG1      VAL  93   9.608   4.247  -0.886
  748   3HG2  VAL  93          3HG1      VAL  93   9.451   2.525  -1.239
  749    H    LYS  94           H        LYS  94   9.081   5.369  -3.695
  750    HA   LYS  94           HA       LYS  94   8.468   7.896  -2.579
  751   1HB   LYS  94          1HB       LYS  94  10.642   7.330  -3.628
  752   2HB   LYS  94          2HB       LYS  94   9.849   7.271  -5.197
  753   1HG   LYS  94          1HG       LYS  94   9.275   9.641  -4.992
  754   2HG   LYS  94          2HG       LYS  94  10.085   9.695  -3.425
  755   1HD   LYS  94          1HD       LYS  94  12.200   9.086  -4.495
  756   2HD   LYS  94          2HD       LYS  94  11.389   9.023  -6.062
  757   1HE   LYS  94          2HE       LYS  94  12.580  11.129  -5.783
  758   2HE   LYS  94          1HE       LYS  94  10.839  11.395  -5.880
  759   1HZ   LYS  94          1HZ       LYS  94  10.772  11.588  -3.472
  760   2HZ   LYS  94          2HZ       LYS  94  11.837  12.723  -4.132
  761   3HZ   LYS  94          3HZ       LYS  94  12.442  11.334  -3.380
  762    H    GLU  95           H        GLU  95   6.840   6.008  -4.834
  763    HA   GLU  95           HA       GLU  95   5.235   8.306  -5.701
  764   1HB   GLU  95          2HB       GLU  95   5.072   7.055  -7.962
  765   2HB   GLU  95          1HB       GLU  95   6.512   8.006  -7.624
  766   1HG   GLU  95          1HG       GLU  95   7.705   5.975  -6.978
  767   2HG   GLU  95          2HG       GLU  95   6.261   5.020  -7.317
  768    H    HIS  96           H        HIS  96   3.613   7.701  -4.257
  769    HA   HIS  96           HA       HIS  96   2.628   5.018  -4.115
  770   1HB   HIS  96          2HB       HIS  96   1.359   7.559  -3.072
  771   2HB   HIS  96          1HB       HIS  96   0.967   5.914  -2.581
  772    HD1  HIS  96           1HD      HIS  96   3.050   8.729  -1.684
  773    HD2  HIS  96           2HD      HIS  96   3.248   4.603  -1.236
  774    HE1  HIS  96           1HE      HIS  96   4.744   8.331   0.130
  775    HE2  HIS  96           2HE      HIS  96   4.789   5.830   0.439
  776    H    ARG  97           H        ARG  97   2.079   7.581  -6.252
  777    HA   ARG  97           HA       ARG  97  -0.574   7.128  -7.028
  778   1HB   ARG  97          1HB       ARG  97   1.780   7.926  -8.754
  779   2HB   ARG  97          2HB       ARG  97   0.086   8.092  -9.197
  780   1HG   ARG  97          1HG       ARG  97  -0.250   9.669  -7.372
  781   2HG   ARG  97          2HG       ARG  97   1.440   9.487  -6.897
  782   1HD   ARG  97          1HD       ARG  97   2.138  10.352  -9.081
  783   2HD   ARG  97          2HD       ARG  97   0.447  10.549  -9.539
  784    HE   ARG  97           HE       ARG  97   0.801  11.957  -7.182
  785   1HH1  ARG  97          2HH1      ARG  97   2.030  12.045 -10.441
  786   2HH1  ARG  97          1HH1      ARG  97   2.307  13.755 -10.427
  787   1HH2  ARG  97          1HH2      ARG  97   1.161  14.208  -7.156
  788   2HH2  ARG  97          2HH2      ARG  97   1.814  14.984  -8.559
  789    H    LYS  98           H        LYS  98   2.320   5.964  -8.760
  790    HA   LYS  98           HA       LYS  98   0.775   3.998 -10.146
  791   1HB   LYS  98          1HB       LYS  98   2.737   5.167 -11.144
  792   2HB   LYS  98          2HB       LYS  98   3.778   4.283 -10.037
  793   1HG   LYS  98          1HG       LYS  98   3.124   2.183 -11.036
  794   2HG   LYS  98          2HG       LYS  98   1.979   3.013 -12.090
  795   1HD   LYS  98          2HD       LYS  98   3.953   2.539 -13.361
  796   2HD   LYS  98          1HD       LYS  98   3.898   4.278 -13.061
  797   1HE   LYS  98          1HE       LYS  98   6.149   3.413 -12.738
  798   2HE   LYS  98          2HE       LYS  98   5.482   4.014 -11.220
  799   1HZ   LYS  98          1HZ       LYS  98   6.616   1.904 -10.916
  800   2HZ   LYS  98          2HZ       LYS  98   5.598   1.162 -12.045
  801   3HZ   LYS  98          3HZ       LYS  98   4.964   1.741 -10.588
  802    H    ILE  99           H        ILE  99   2.976   3.976  -7.409
  803    HA   ILE  99           HA       ILE  99   3.483   1.208  -7.396
  804    HB   ILE  99           HB       ILE  99   4.618   3.204  -6.062
  805   1HG1  ILE  99          2HG1      ILE  99   5.246   0.712  -6.306
  806   2HG1  ILE  99          1HG1      ILE  99   5.896   1.596  -4.928
  807   1HG2  ILE  99          1HG2      ILE  99   2.688   2.065  -4.061
  808   2HG2  ILE  99          2HG2      ILE  99   2.817   3.743  -4.592
  809   3HG2  ILE  99          3HG2      ILE  99   4.117   3.011  -3.643
  810   1HD1  ILE  99          1HD1      ILE  99   3.483  -0.201  -4.862
  811   2HD1  ILE  99          2HD1      ILE  99   4.208   0.634  -3.487
  812   3HD1  ILE  99          3HD1      ILE  99   5.105  -0.634  -4.320
  813    H    TYR 100           H        TYR 100   0.937   3.131  -5.917
  814    HA   TYR 100           HA       TYR 100  -0.203   0.849  -4.576
  815   1HB   TYR 100          2HB       TYR 100  -1.073   3.711  -4.926
  816   2HB   TYR 100          1HB       TYR 100  -2.128   2.505  -4.191
  817    HD1  TYR 100           1HD      TYR 100  -1.713   4.563  -2.421
  818    HD2  TYR 100           2HD      TYR 100   1.043   1.464  -3.376
  819    HE1  TYR 100           1HE      TYR 100  -0.596   4.893  -0.255
  820    HE2  TYR 100           2HE      TYR 100   2.156   1.781  -1.222
  821    HH   TYR 100           HH       TYR 100   0.820   3.636   1.299
  822    H    THR 101           H        THR 101  -0.649   2.560  -7.602
  823    HA   THR 101           HA       THR 101  -3.047   1.347  -8.434
  824    HB   THR 101           HB       THR 101  -0.695   2.258 -10.107
  825    HG1  THR 101           1HG      THR 101  -3.121   3.654  -9.920
  826   1HG2  THR 101          1HG2      THR 101  -2.303   2.345 -11.964
  827   2HG2  THR 101          2HG2      THR 101  -3.538   1.635 -10.925
  828   3HG2  THR 101          3HG2      THR 101  -2.106   0.701 -11.355
  829    H    MET 102           H        MET 102   0.316   0.268  -8.590
  830    HA   MET 102           HA       MET 102  -0.172  -2.099 -10.070
  831   1HB   MET 102          1HB       MET 102   2.012  -1.624  -8.036
  832   2HB   MET 102          2HB       MET 102   2.010  -2.835  -9.311
  833   1HG   MET 102          2HG       MET 102   1.980  -1.008 -10.977
  834   2HG   MET 102          1HG       MET 102   2.118   0.141  -9.649
  835   1HE   MET 102          1HE       MET 102   3.930  -1.021  -7.637
  836   2HE   MET 102          2HE       MET 102   4.436   0.550  -8.256
  837   3HE   MET 102          3HE       MET 102   5.602  -0.768  -8.138
  838    H    ILE 103           H        ILE 103  -0.051  -1.387  -6.603
  839    HA   ILE 103           HA       ILE 103  -0.215  -3.951  -5.608
  840    HB   ILE 103           HB       ILE 103  -1.538  -1.486  -4.470
  841   1HG1  ILE 103          1HG1      ILE 103   1.152  -2.742  -3.885
  842   2HG1  ILE 103          2HG1      ILE 103   0.896  -1.266  -4.810
  843   1HG2  ILE 103          1HG2      ILE 103  -2.472  -3.515  -3.507
  844   2HG2  ILE 103          2HG2      ILE 103  -1.468  -2.675  -2.326
  845   3HG2  ILE 103          3HG2      ILE 103  -0.851  -4.110  -3.148
  846   1HD1  ILE 103          1HD1      ILE 103   1.601  -0.764  -2.552
  847   2HD1  ILE 103          2HD1      ILE 103   0.233  -1.668  -1.905
  848   3HD1  ILE 103          3HD1      ILE 103  -0.042  -0.192  -2.831
  849    H    TYR 104           H        TYR 104  -2.832  -1.845  -6.724
  850    HA   TYR 104           HA       TYR 104  -4.748  -4.009  -6.172
  851   1HB   TYR 104          2HB       TYR 104  -5.266  -1.047  -6.504
  852   2HB   TYR 104          1HB       TYR 104  -6.473  -2.268  -6.108
  853    HD1  TYR 104           1HD      TYR 104  -6.672  -3.141  -3.882
  854    HD2  TYR 104           2HD      TYR 104  -3.554  -0.415  -4.850
  855    HE1  TYR 104           1HE      TYR 104  -6.198  -2.839  -1.489
  856    HE2  TYR 104           2HE      TYR 104  -3.071  -0.109  -2.458
  857    HH   TYR 104           HH       TYR 104  -4.322  -2.144  -0.057
  858    H    ARG 105           H        ARG 105  -5.279  -5.150  -7.897
  859    HA   ARG 105           HA       ARG 105  -5.235  -3.929 -10.548
  860   1HB   ARG 105          2HB       ARG 105  -5.717  -6.801  -9.730
  861   2HB   ARG 105          1HB       ARG 105  -5.538  -6.220 -11.379
  862   1HG   ARG 105          2HG       ARG 105  -3.244  -5.556 -10.913
  863   2HG   ARG 105          1HG       ARG 105  -3.419  -6.093  -9.241
  864   1HD   ARG 105          2HD       ARG 105  -3.845  -8.376 -10.033
  865   2HD   ARG 105          1HD       ARG 105  -3.636  -7.832 -11.697
  866    HE   ARG 105           HE       ARG 105  -1.333  -7.110 -10.362
  867   1HH1  ARG 105          2HH1      ARG 105  -3.041 -10.064 -11.068
  868   2HH1  ARG 105          1HH1      ARG 105  -1.608 -11.037 -11.096
  869   1HH2  ARG 105          1HH2      ARG 105   0.558  -8.385 -10.397
  870   2HH2  ARG 105          2HH2      ARG 105   0.438 -10.083 -10.715
  871    H    ASN 106           H        ASN 106  -7.143  -5.362 -11.879
  872    HA   ASN 106           HA       ASN 106  -9.581  -4.115 -10.934
  873   1HB   ASN 106          1HB       ASN 106  -9.050  -5.757 -13.420
  874   2HB   ASN 106          2HB       ASN 106 -10.532  -4.869 -13.078
  875   1HD2  ASN 106          2HD2      ASN 106 -10.526  -2.624 -13.174
  876   2HD2  ASN 106          1HD2      ASN 106  -9.265  -1.744 -13.964
  877    H    LEU 107           H        LEU 107  -8.149  -6.730  -9.899
  878    HA   LEU 107           HA       LEU 107 -10.559  -8.420  -9.894
  879   1HB   LEU 107          1HB       LEU 107  -7.647  -9.124  -9.578
  880   2HB   LEU 107          2HB       LEU 107  -8.937 -10.243  -9.187
  881    HG   LEU 107           HG       LEU 107  -8.084 -10.761 -11.376
  882   1HD1  LEU 107          1HD2      LEU 107 -10.120 -10.571 -12.716
  883   2HD1  LEU 107          2HD2      LEU 107 -10.756  -9.382 -11.580
  884   3HD1  LEU 107          3HD2      LEU 107 -10.478 -11.043 -11.055
  885   1HD2  LEU 107          1HD1      LEU 107  -8.166  -9.162 -13.220
  886   2HD2  LEU 107          2HD1      LEU 107  -7.106  -8.604 -11.928
  887   3HD2  LEU 107          3HD1      LEU 107  -8.715  -7.907 -12.111
  888    H    VAL 108           H        VAL 108 -11.623  -8.670  -8.051
  889    HA   VAL 108           HA       VAL 108 -12.204  -8.549  -5.854
  890    HB   VAL 108           HB       VAL 108  -9.289  -9.157  -5.337
  891   1HG1  VAL 108          1HG2      VAL 108 -10.500  -8.457  -3.346
  892   2HG1  VAL 108          2HG2      VAL 108 -10.127 -10.181  -3.269
  893   3HG1  VAL 108          3HG2      VAL 108 -11.760  -9.648  -3.676
  894   1HG2  VAL 108          1HG1      VAL 108 -11.589 -11.047  -5.824
  895   2HG2  VAL 108          2HG1      VAL 108  -9.959 -11.514  -5.338
  896   3HG2  VAL 108          3HG1      VAL 108 -10.230 -10.761  -6.910
  897    H    VAL 109           H        VAL 109 -12.490  -6.210  -6.269
  898    HA   VAL 109           HA       VAL 109 -10.973  -4.717  -4.273
  899    HB   VAL 109           HB       VAL 109 -10.816  -2.732  -5.775
  900   1HG1  VAL 109          1HG1      VAL 109  -9.346  -5.194  -6.712
  901   2HG1  VAL 109          2HG1      VAL 109  -8.868  -4.136  -5.384
  902   3HG1  VAL 109          3HG1      VAL 109  -8.871  -3.526  -7.039
  903   1HG2  VAL 109          1HG2      VAL 109 -12.534  -3.340  -7.384
  904   2HG2  VAL 109          2HG2      VAL 109 -11.564  -4.712  -7.923
  905   3HG2  VAL 109          3HG2      VAL 109 -10.993  -3.066  -8.197
  906    H    VAL 110           H        VAL 110 -12.101  -2.213  -4.739
  907    HA   VAL 110           HA       VAL 110 -14.571  -2.440  -3.434
  908    HB   VAL 110           HB       VAL 110 -13.131  -0.428  -3.341
  909   1HG1  VAL 110          1HG1      VAL 110 -12.494  -0.314  -5.677
  910   2HG1  VAL 110          2HG1      VAL 110 -13.245   1.201  -5.173
  911   3HG1  VAL 110          3HG1      VAL 110 -14.160   0.039  -6.133
  912   1HG2  VAL 110          1HG2      VAL 110 -15.956   0.065  -4.275
  913   2HG2  VAL 110          2HG2      VAL 110 -14.949   1.221  -3.403
  914   3HG2  VAL 110          3HG2      VAL 110 -15.445  -0.281  -2.622
  915    H    ASN 111           H        ASN 111 -13.777  -2.733  -6.736
  916    HA   ASN 111           HA       ASN 111 -15.953  -1.639  -8.046
  917   1HB   ASN 111          2HB       ASN 111 -15.391  -3.021  -9.912
  918   2HB   ASN 111          1HB       ASN 111 -13.882  -2.614  -9.101
  919   1HD2  ASN 111          1HD2      ASN 111 -14.382  -4.492  -6.909
  920   2HD2  ASN 111          2HD2      ASN 111 -14.078  -6.063  -7.558
  921    H    GLN 112           H        GLN 112 -17.820  -2.668  -9.025
  922    HA   GLN 112           HA       GLN 112 -18.766  -5.129  -7.798
  923   1HB   GLN 112          1HB       GLN 112 -20.914  -4.113  -7.120
  924   2HB   GLN 112          2HB       GLN 112 -19.549  -3.455  -6.227
  925   1HG   GLN 112          1HG       GLN 112 -19.559  -1.478  -7.653
  926   2HG   GLN 112          2HG       GLN 112 -20.914  -2.140  -8.565
  927   1HE2  GLN 112          2HE2      GLN 112 -22.953  -2.205  -7.630
  928   2HE2  GLN 112          1HE2      GLN 112 -23.351  -1.282  -6.224
  929    H    GLN 113           H        GLN 113 -20.060  -6.292  -9.123
  930    HA   GLN 113           HA       GLN 113 -21.555  -5.115 -11.263
  931   1HB   GLN 113          1HB       GLN 113 -20.355  -6.252 -13.096
  932   2HB   GLN 113          2HB       GLN 113 -19.363  -5.038 -12.304
  933   1HG   GLN 113          1HG       GLN 113 -18.221  -6.786 -11.041
  934   2HG   GLN 113          2HG       GLN 113 -19.219  -8.007 -11.832
  935   1HE2  GLN 113          2HE2      GLN 113 -17.447  -9.043 -12.723
  936   2HE2  GLN 113          1HE2      GLN 113 -16.545  -8.372 -14.034
  937    H    GLU 114           H        GLU 114 -21.348  -7.247  -8.953
  938    HA   GLU 114           HA       GLU 114 -22.512  -9.516 -10.396
  939   1HB   GLU 114          1HB       GLU 114 -21.622  -9.278  -7.516
  940   2HB   GLU 114          2HB       GLU 114 -22.248 -10.739  -8.267
  941   1HG   GLU 114          1HG       GLU 114 -19.726  -9.294  -9.052
  942   2HG   GLU 114          2HG       GLU 114 -19.821 -10.779  -8.106
  943    H    SER 115           H        SER 115 -24.635  -9.301 -10.714
  944    HA   SER 115           HA       SER 115 -26.282  -8.094  -8.609
  945   1HB   SER 115          1HB       SER 115 -28.031  -7.928 -10.345
  946   2HB   SER 115          2HB       SER 115 -26.539  -7.133 -10.848
  947    HG   SER 115           HG       SER 115 -26.821  -9.809 -11.539
  948    H    SER 116           H        SER 116 -25.202 -10.797  -8.409
  949    HA   SER 116           HA       SER 116 -27.751 -12.219  -8.104
  950   1HB   SER 116          1HB       SER 116 -25.228 -13.420  -9.272
  951   2HB   SER 116          2HB       SER 116 -26.702 -14.312  -8.893
  952    HG   SER 116           HG       SER 116 -26.116 -12.750 -11.050
  953    H    ASP 117           H        ASP 117 -24.546 -11.527  -7.017
  954    HA   ASP 117           HA       ASP 117 -24.792 -13.403  -4.782
  955   1HB   ASP 117          2HB       ASP 117 -22.664 -13.405  -6.007
  956   2HB   ASP 117          1HB       ASP 117 -22.449 -11.694  -5.649
  957    H    SER 118           H        SER 118 -24.471 -12.701  -2.612
  958    HA   SER 118           HA       SER 118 -25.086 -11.415  -0.834
  959   1HB   SER 118          2HB       SER 118 -23.940  -9.236  -0.695
  960   2HB   SER 118          1HB       SER 118 -22.860 -10.497  -1.284
  961    HG   SER 118           HG       SER 118 -23.628  -8.207  -2.488
  962    H    SER 119           H        SER 119 -27.341 -11.519  -1.366
  963    HA   SER 119           HA       SER 119 -29.411 -10.639  -1.684
  964   1HB   SER 119          1HB       SER 119 -27.952  -8.028  -1.211
  965   2HB   SER 119          2HB       SER 119 -29.702  -8.240  -1.165
  966    HG   SER 119           HG       SER 119 -28.351  -8.372   0.887
  Start of MODEL   17
    1   1H    MET   1          1H        MET   1 -26.492  21.014  -1.470
    2   2H    MET   1          2H        MET   1 -25.285  22.075  -0.947
    3   3H    MET   1          3H        MET   1 -26.437  21.502   0.149
    4    HA   MET   1           HA       MET   1 -24.330  20.381   0.452
    5   1HB   MET   1          1HB       MET   1 -26.427  19.184   0.927
    6   2HB   MET   1          2HB       MET   1 -26.484  18.619  -0.738
    7   1HG   MET   1          2HG       MET   1 -24.415  17.375  -0.391
    8   2HG   MET   1          1HG       MET   1 -24.349  17.947   1.275
    9   1HE   MET   1          1HE       MET   1 -26.121  17.275   3.140
   10   2HE   MET   1          2HE       MET   1 -27.518  16.246   2.833
   11   3HE   MET   1          3HE       MET   1 -27.426  17.849   2.102
   12    H    CYS   2           H        CYS   2 -22.590  20.773  -0.843
   13    HA   CYS   2           HA       CYS   2 -22.322  19.027  -3.179
   14   1HB   CYS   2          1HB       CYS   2 -21.617  21.970  -3.161
   15   2HB   CYS   2          2HB       CYS   2 -21.249  20.845  -4.465
   16    HG   CYS   2           HG       CYS   2 -23.330  21.823  -5.677
   17    H    ASN   3           H        ASN   3 -20.455  17.948  -3.186
   18    HA   ASN   3           HA       ASN   3 -18.445  18.642  -1.186
   19   1HB   ASN   3          2HB       ASN   3 -18.713  16.189  -2.939
   20   2HB   ASN   3          1HB       ASN   3 -17.508  16.410  -1.673
   21   1HD2  ASN   3          2HD2      ASN   3 -19.588  14.385  -1.956
   22   2HD2  ASN   3          1HD2      ASN   3 -20.547  14.483  -0.523
   23    H    THR   4           H        THR   4 -18.951  19.840  -4.024
   24    HA   THR   4           HA       THR   4 -16.218  19.513  -5.062
   25    HB   THR   4           HB       THR   4 -18.641  20.661  -6.464
   26    HG1  THR   4           1HG      THR   4 -18.525  18.659  -7.636
   27   1HG2  THR   4          1HG2      THR   4 -17.260  20.497  -8.486
   28   2HG2  THR   4          2HG2      THR   4 -15.896  19.951  -7.508
   29   3HG2  THR   4          3HG2      THR   4 -16.535  21.581  -7.299
   30    H    ASN   5           H        ASN   5 -14.864  21.228  -5.285
   31    HA   ASN   5           HA       ASN   5 -13.953  23.274  -4.908
   32   1HB   ASN   5          1HB       ASN   5 -16.773  24.220  -5.468
   33   2HB   ASN   5          2HB       ASN   5 -15.339  25.242  -5.453
   34   1HD2  ASN   5          2HD2      ASN   5 -17.232  24.691  -7.602
   35   2HD2  ASN   5          1HD2      ASN   5 -16.297  24.064  -8.912
   36    H    MET   6           H        MET   6 -13.472  22.915  -2.728
   37    HA   MET   6           HA       MET   6 -15.353  23.520  -0.653
   38   1HB   MET   6          2HB       MET   6 -12.356  23.142  -0.533
   39   2HB   MET   6          1HB       MET   6 -13.424  23.231   0.861
   40   1HG   MET   6          2HG       MET   6 -14.571  21.210   0.118
   41   2HG   MET   6          1HG       MET   6 -13.506  21.122  -1.284
   42   1HE   MET   6          1HE       MET   6 -12.541  22.188   2.382
   43   2HE   MET   6          2HE       MET   6 -12.049  20.641   3.070
   44   3HE   MET   6          3HE       MET   6 -13.735  20.913   2.631
   45    H    SER   7           H        SER   7 -12.314  25.069  -1.695
   46    HA   SER   7           HA       SER   7 -13.447  27.648  -0.845
   47   1HB   SER   7          1HB       SER   7 -11.203  28.340  -0.078
   48   2HB   SER   7          2HB       SER   7 -11.798  26.946   0.823
   49    HG   SER   7           HG       SER   7 -10.294  25.720  -0.044
   50    H    VAL   8           H        VAL   8 -11.197  25.928  -2.942
   51    HA   VAL   8           HA       VAL   8 -11.516  28.078  -4.916
   52    HB   VAL   8           HB       VAL   8  -9.151  27.786  -5.615
   53   1HG1  VAL   8          1HG1      VAL   8  -9.553  28.658  -2.755
   54   2HG1  VAL   8          2HG1      VAL   8  -9.785  29.654  -4.192
   55   3HG1  VAL   8          3HG1      VAL   8  -8.173  29.076  -3.769
   56   1HG2  VAL   8          1HG2      VAL   8  -8.763  25.561  -4.708
   57   2HG2  VAL   8          2HG2      VAL   8  -8.925  26.186  -3.067
   58   3HG2  VAL   8          3HG2      VAL   8  -7.577  26.703  -4.080
   59    HA   PRO   9           HA       PRO   9 -12.472  24.563  -7.465
   60   1HB   PRO   9          2HB       PRO   9 -12.821  25.842  -9.801
   61   2HB   PRO   9          1HB       PRO   9 -13.969  26.014  -8.468
   62   1HG   PRO   9          1HG       PRO   9 -11.775  27.859  -9.333
   63   2HG   PRO   9          2HG       PRO   9 -13.430  28.249  -8.829
   64   1HD   PRO   9          2HD       PRO   9 -11.246  28.456  -7.187
   65   2HD   PRO   9          1HD       PRO   9 -12.898  28.171  -6.603
   66    H    THR  10           H        THR  10 -10.108  23.949  -7.056
   67    HA   THR  10           HA       THR  10  -8.816  23.641  -9.630
   68    HB   THR  10           HB       THR  10  -7.318  24.946  -7.348
   69    HG1  THR  10           1HG      THR  10  -8.224  25.957  -9.856
   70   1HG2  THR  10          1HG2      THR  10  -5.471  25.109  -8.957
   71   2HG2  THR  10          2HG2      THR  10  -6.429  24.225 -10.144
   72   3HG2  THR  10          3HG2      THR  10  -5.916  23.429  -8.656
   73    H    ASP  11           H        ASP  11  -7.911  23.330  -6.189
   74    HA   ASP  11           HA       ASP  11  -7.664  20.432  -6.569
   75   1HB   ASP  11          2HB       ASP  11  -5.502  20.427  -5.381
   76   2HB   ASP  11          1HB       ASP  11  -5.418  21.337  -6.886
   77    H    GLY  12           H        GLY  12  -8.065  19.197  -4.752
   78   1HA   GLY  12          2HA       GLY  12  -9.233  20.690  -2.497
   79   2HA   GLY  12          1HA       GLY  12  -9.671  19.053  -2.963
   80    H    ALA  13           H        ALA  13  -6.769  18.386  -3.330
   81    HA   ALA  13           HA       ALA  13  -5.574  18.662  -0.732
   82   1HB   ALA  13          1HB       ALA  13  -6.547  15.934  -1.572
   83   2HB   ALA  13          2HB       ALA  13  -7.220  16.911  -0.267
   84   3HB   ALA  13          3HB       ALA  13  -5.571  16.296  -0.148
   85    H    VAL  14           H        VAL  14  -3.420  18.525  -0.890
   86    HA   VAL  14           HA       VAL  14  -2.248  17.065  -3.153
   87    HB   VAL  14           HB       VAL  14  -1.442  19.863  -2.344
   88   1HG1  VAL  14          1HG1      VAL  14   0.059  19.754  -4.280
   89   2HG1  VAL  14          2HG1      VAL  14  -0.414  18.075  -4.546
   90   3HG1  VAL  14          3HG1      VAL  14   0.454  18.525  -3.077
   91   1HG2  VAL  14          1HG2      VAL  14  -2.266  20.526  -4.556
   92   2HG2  VAL  14          2HG2      VAL  14  -3.555  19.862  -3.550
   93   3HG2  VAL  14          3HG2      VAL  14  -2.840  18.880  -4.828
   94    H    THR  15           H        THR  15  -1.636  18.761  -0.095
   95    HA   THR  15           HA       THR  15   0.870  17.355   0.285
   96    HB   THR  15           HB       THR  15   0.787  19.673   0.978
   97    HG1  THR  15           1HG      THR  15   2.118  18.970   2.461
   98   1HG2  THR  15          1HG2      THR  15  -1.596  19.839   1.473
   99   2HG2  THR  15          2HG2      THR  15  -0.636  20.395   2.843
  100   3HG2  THR  15          3HG2      THR  15  -1.387  18.799   2.882
  101    H    THR  16           H        THR  16  -2.406  16.872   1.035
  102    HA   THR  16           HA       THR  16  -1.959  15.340   3.445
  103    HB   THR  16           HB       THR  16  -4.474  15.597   1.783
  104    HG1  THR  16           1HG      THR  16  -5.030  17.104   3.500
  105   1HG2  THR  16          1HG2      THR  16  -4.056  14.633   4.615
  106   2HG2  THR  16          2HG2      THR  16  -4.488  13.627   3.231
  107   3HG2  THR  16          3HG2      THR  16  -5.616  14.847   3.822
  108    H    SER  17           H        SER  17  -3.508  14.493   0.343
  109    HA   SER  17           HA       SER  17  -2.466  11.760   0.674
  110   1HB   SER  17          1HB       SER  17  -4.302  11.057  -0.822
  111   2HB   SER  17          2HB       SER  17  -4.909  11.883   0.613
  112    HG   SER  17           HG       SER  17  -4.391  13.395  -1.683
  113    H    GLN  18           H        GLN  18  -2.362  10.639  -1.624
  114    HA   GLN  18           HA       GLN  18  -1.224  12.420  -3.638
  115   1HB   GLN  18          2HB       GLN  18   0.679  11.722  -2.209
  116   2HB   GLN  18          1HB       GLN  18   0.259  10.038  -2.511
  117   1HG   GLN  18          2HG       GLN  18   0.719  10.309  -4.869
  118   2HG   GLN  18          1HG       GLN  18   1.087  12.017  -4.620
  119   1HE2  GLN  18          1HE2      GLN  18   3.000  12.598  -3.593
  120   2HE2  GLN  18          2HE2      GLN  18   4.314  11.492  -3.401
  121    H    ILE  19           H        ILE  19  -2.295   9.226  -2.642
  122    HA   ILE  19           HA       ILE  19  -1.456   8.046  -5.067
  123    HB   ILE  19           HB       ILE  19  -1.903   6.003  -4.114
  124   1HG1  ILE  19          1HG1      ILE  19  -3.723   6.075  -2.093
  125   2HG1  ILE  19          2HG1      ILE  19  -4.369   7.321  -3.159
  126   1HG2  ILE  19          1HG2      ILE  19  -0.404   7.081  -2.614
  127   2HG2  ILE  19          2HG2      ILE  19  -1.564   6.176  -1.637
  128   3HG2  ILE  19          3HG2      ILE  19  -1.727   7.926  -1.806
  129   1HD1  ILE  19          1HD1      ILE  19  -4.340   5.690  -5.012
  130   2HD1  ILE  19          2HD1      ILE  19  -5.392   5.216  -3.678
  131   3HD1  ILE  19          3HD1      ILE  19  -3.815   4.453  -3.871
  132    HA   PRO  20           HA       PRO  20  -5.013   8.263  -7.701
  133   1HB   PRO  20          1HB       PRO  20  -4.947   5.315  -8.010
  134   2HB   PRO  20          2HB       PRO  20  -4.841   6.579  -9.240
  135   1HG   PRO  20          2HG       PRO  20  -2.688   5.171  -8.527
  136   2HG   PRO  20          1HG       PRO  20  -2.571   6.901  -8.900
  137   1HD   PRO  20          1HD       PRO  20  -2.594   5.531  -6.240
  138   2HD   PRO  20          2HD       PRO  20  -1.636   6.923  -6.783
  139    H    ALA  21           H        ALA  21  -6.346   8.769  -5.794
  140    HA   ALA  21           HA       ALA  21  -8.670   7.212  -5.611
  141   1HB   ALA  21          1HB       ALA  21  -6.843   6.920  -3.226
  142   2HB   ALA  21          2HB       ALA  21  -7.244   5.646  -4.377
  143   3HB   ALA  21          3HB       ALA  21  -8.500   6.329  -3.344
  144    H    SER  22           H        SER  22  -9.708   7.839  -3.201
  145    HA   SER  22           HA       SER  22  -9.375  10.761  -2.998
  146   1HB   SER  22          1HB       SER  22 -11.529  10.154  -4.034
  147   2HB   SER  22          2HB       SER  22 -11.925   9.168  -2.626
  148    HG   SER  22           HG       SER  22 -12.386  10.912  -1.524
  149    H    GLU  23           H        GLU  23  -7.803   9.114  -1.470
  150    HA   GLU  23           HA       GLU  23  -7.188   8.563   0.649
  151   1HB   GLU  23          1HB       GLU  23  -7.385  11.010   0.883
  152   2HB   GLU  23          2HB       GLU  23  -9.068  10.822   1.359
  153   1HG   GLU  23          1HG       GLU  23  -8.369   9.560   3.331
  154   2HG   GLU  23          2HG       GLU  23  -6.683   9.758   2.856
  155    H    GLN  24           H        GLN  24  -8.095   6.506   0.741
  156    HA   GLN  24           HA       GLN  24  -9.432   4.826   1.497
  157   1HB   GLN  24          1HB       GLN  24  -9.195   5.967   3.674
  158   2HB   GLN  24          2HB       GLN  24 -10.599   6.957   3.300
  159   1HG   GLN  24          2HG       GLN  24 -11.992   4.947   3.229
  160   2HG   GLN  24          1HG       GLN  24 -10.583   3.964   3.627
  161   1HE2  GLN  24          2HE2      GLN  24 -12.902   6.263   4.804
  162   2HE2  GLN  24          1HE2      GLN  24 -12.551   6.068   6.484
  163    H    GLU  25           H        GLU  25 -11.590   3.948   1.304
  164    HA   GLU  25           HA       GLU  25 -13.745   5.416   0.199
  165   1HB   GLU  25          1HB       GLU  25 -13.541   4.648  -2.143
  166   2HB   GLU  25          2HB       GLU  25 -12.248   5.746  -1.681
  167   1HG   GLU  25          1HG       GLU  25 -10.723   3.889  -1.403
  168   2HG   GLU  25          2HG       GLU  25 -12.015   2.744  -1.760
  169    H    THR  26           H        THR  26 -12.402   2.706   1.480
  170    HA   THR  26           HA       THR  26 -14.477   0.885   0.458
  171    HB   THR  26           HB       THR  26 -11.590   0.061   0.698
  172    HG1  THR  26           1HG      THR  26 -11.845   0.229  -1.751
  173   1HG2  THR  26          1HG2      THR  26 -13.241  -1.739   0.701
  174   2HG2  THR  26          2HG2      THR  26 -12.321  -1.749  -0.802
  175   3HG2  THR  26          3HG2      THR  26 -13.960  -1.099  -0.777
  176    H    LEU  27           H        LEU  27 -14.592  -1.184   1.789
  177    HA   LEU  27           HA       LEU  27 -12.542  -1.233   3.866
  178   1HB   LEU  27          1HB       LEU  27 -15.131  -1.176   4.608
  179   2HB   LEU  27          2HB       LEU  27 -14.949  -2.899   4.340
  180    HG   LEU  27           HG       LEU  27 -14.515  -2.568   6.637
  181   1HD1  LEU  27          1HD1      LEU  27 -12.189  -3.204   6.898
  182   2HD1  LEU  27          2HD1      LEU  27 -11.826  -2.621   5.269
  183   3HD1  LEU  27          3HD1      LEU  27 -12.885  -4.021   5.495
  184   1HD2  LEU  27          1HD2      LEU  27 -14.251  -0.133   6.548
  185   2HD2  LEU  27          2HD2      LEU  27 -12.637  -0.340   5.862
  186   3HD2  LEU  27          3HD2      LEU  27 -12.977  -0.895   7.501
  187    H    VAL  28           H        VAL  28 -11.211  -2.252   2.343
  188    HA   VAL  28           HA       VAL  28 -12.462  -4.034   0.471
  189    HB   VAL  28           HB       VAL  28 -11.004  -2.819  -0.754
  190   1HG1  VAL  28          1HG1      VAL  28  -9.291  -2.652   1.705
  191   2HG1  VAL  28          2HG1      VAL  28 -10.300  -1.380   0.997
  192   3HG1  VAL  28          3HG1      VAL  28  -8.849  -1.934   0.154
  193   1HG2  VAL  28          1HG2      VAL  28  -9.121  -4.916   0.323
  194   2HG2  VAL  28          2HG2      VAL  28  -8.820  -3.927  -1.108
  195   3HG2  VAL  28          3HG2      VAL  28 -10.171  -5.063  -1.089
  196    H    ARG  29           H        ARG  29 -11.692  -6.120  -0.099
  197    HA   ARG  29           HA       ARG  29 -10.364  -7.507   2.110
  198   1HB   ARG  29          1HB       ARG  29 -12.805  -8.517   0.637
  199   2HB   ARG  29          2HB       ARG  29 -11.992  -9.314   1.979
  200   1HG   ARG  29          1HG       ARG  29 -12.615  -7.456   3.449
  201   2HG   ARG  29          2HG       ARG  29 -13.441  -6.673   2.098
  202   1HD   ARG  29          2HD       ARG  29 -14.124  -9.369   3.268
  203   2HD   ARG  29          1HD       ARG  29 -15.010  -7.870   3.546
  204    HE   ARG  29           HE       ARG  29 -14.841  -8.376   0.778
  205   1HH1  ARG  29          2HH1      ARG  29 -16.426  -9.539   3.656
  206   2HH1  ARG  29          1HH1      ARG  29 -17.817 -10.128   2.807
  207   1HH2  ARG  29          1HH2      ARG  29 -16.669  -9.148  -0.346
  208   2HH2  ARG  29          2HH2      ARG  29 -17.955  -9.905   0.533
  209    HA   PRO  30           HA       PRO  30  -8.422  -8.649  -1.882
  210   1HB   PRO  30          1HB       PRO  30  -5.867  -8.460  -1.110
  211   2HB   PRO  30          2HB       PRO  30  -6.831  -7.020  -1.456
  212   1HG   PRO  30          1HG       PRO  30  -6.111  -8.235   1.182
  213   2HG   PRO  30          2HG       PRO  30  -6.154  -6.527   0.712
  214   1HD   PRO  30          2HD       PRO  30  -8.156  -7.816   2.105
  215   2HD   PRO  30          1HD       PRO  30  -8.393  -6.354   1.130
  216    H    LYS  31           H        LYS  31  -7.913 -10.658  -2.558
  217    HA   LYS  31           HA       LYS  31  -7.841 -12.906  -0.902
  218   1HB   LYS  31          1HB       LYS  31  -6.926 -14.094  -2.859
  219   2HB   LYS  31          2HB       LYS  31  -8.289 -13.071  -3.290
  220   1HG   LYS  31          2HG       LYS  31  -6.764 -11.380  -4.153
  221   2HG   LYS  31          1HG       LYS  31  -5.386 -12.384  -3.700
  222   1HD   LYS  31          1HD       LYS  31  -5.823 -12.656  -6.055
  223   2HD   LYS  31          2HD       LYS  31  -6.229 -14.153  -5.214
  224   1HE   LYS  31          2HE       LYS  31  -8.594 -13.517  -5.231
  225   2HE   LYS  31          1HE       LYS  31  -8.185 -12.027  -6.082
  226   1HZ   LYS  31          1HZ       LYS  31  -8.981 -13.721  -7.604
  227   2HZ   LYS  31          2HZ       LYS  31  -7.756 -14.781  -7.112
  228   3HZ   LYS  31          3HZ       LYS  31  -7.361 -13.353  -7.927
  229    HA   PRO  32           HA       PRO  32  -4.014 -13.067   1.137
  230   1HB   PRO  32          1HB       PRO  32  -3.104 -15.616   0.424
  231   2HB   PRO  32          2HB       PRO  32  -4.162 -15.232   1.785
  232   1HG   PRO  32          1HG       PRO  32  -4.858 -16.235  -0.937
  233   2HG   PRO  32          2HG       PRO  32  -5.594 -16.626   0.629
  234   1HD   PRO  32          2HD       PRO  32  -6.802 -14.973  -1.090
  235   2HD   PRO  32          1HD       PRO  32  -6.856 -14.674   0.661
  236    H    LEU  33           H        LEU  33  -2.892 -11.501  -0.055
  237    HA   LEU  33           HA       LEU  33  -0.648 -12.517  -1.541
  238   1HB   LEU  33          2HB       LEU  33  -2.464 -12.303  -3.251
  239   2HB   LEU  33          1HB       LEU  33  -2.522 -10.586  -2.905
  240    HG   LEU  33           HG       LEU  33  -0.164 -10.387  -3.649
  241   1HD1  LEU  33          1HD2      LEU  33   0.848 -12.255  -4.877
  242   2HD1  LEU  33          2HD2      LEU  33  -0.507 -13.284  -4.409
  243   3HD1  LEU  33          3HD2      LEU  33   0.582 -12.645  -3.177
  244   1HD2  LEU  33          1HD1      LEU  33  -1.987  -9.931  -5.200
  245   2HD2  LEU  33          2HD1      LEU  33  -2.033 -11.635  -5.658
  246   3HD2  LEU  33          3HD1      LEU  33  -0.613 -10.658  -6.034
  247    H    LEU  34           H        LEU  34  -2.466  -9.806  -0.261
  248    HA   LEU  34           HA       LEU  34   0.105  -8.498   0.324
  249   1HB   LEU  34          2HB       LEU  34  -1.059  -6.386   0.448
  250   2HB   LEU  34          1HB       LEU  34  -1.368  -7.135  -1.106
  251    HG   LEU  34           HG       LEU  34  -3.539  -8.013   0.125
  252   1HD1  LEU  34          1HD1      LEU  34  -4.384  -6.589   1.799
  253   2HD1  LEU  34          2HD1      LEU  34  -3.103  -5.405   1.549
  254   3HD1  LEU  34          3HD1      LEU  34  -2.729  -6.965   2.282
  255   1HD2  LEU  34          1HD2      LEU  34  -4.731  -6.043  -0.725
  256   2HD2  LEU  34          2HD2      LEU  34  -3.532  -6.641  -1.871
  257   3HD2  LEU  34          3HD2      LEU  34  -3.191  -5.203  -0.910
  258    H    LEU  35           H        LEU  35  -1.805 -10.580   1.632
  259    HA   LEU  35           HA       LEU  35  -1.791  -9.350   4.289
  260   1HB   LEU  35          1HB       LEU  35  -3.692 -11.545   3.556
  261   2HB   LEU  35          2HB       LEU  35  -3.823 -10.352   4.833
  262    HG   LEU  35           HG       LEU  35  -4.051  -8.640   2.893
  263   1HD1  LEU  35          1HD2      LEU  35  -4.886 -11.163   1.481
  264   2HD1  LEU  35          2HD2      LEU  35  -3.400 -10.270   1.151
  265   3HD1  LEU  35          3HD2      LEU  35  -4.968  -9.517   0.853
  266   1HD2  LEU  35          1HD1      LEU  35  -6.422  -8.875   2.919
  267   2HD2  LEU  35          2HD1      LEU  35  -5.818  -9.342   4.509
  268   3HD2  LEU  35          3HD1      LEU  35  -6.305 -10.582   3.353
  269    H    LYS  36           H        LYS  36  -1.254 -10.825   6.009
  270    HA   LYS  36           HA       LYS  36   0.544 -11.938   6.847
  271   1HB   LYS  36          1HB       LYS  36  -0.405 -13.921   5.706
  272   2HB   LYS  36          2HB       LYS  36   0.500 -13.497   4.265
  273   1HG   LYS  36          1HG       LYS  36   1.649 -15.242   5.465
  274   2HG   LYS  36          2HG       LYS  36   2.597 -13.755   5.526
  275   1HD   LYS  36          1HD       LYS  36   1.749 -13.302   7.775
  276   2HD   LYS  36          2HD       LYS  36   0.793 -14.785   7.714
  277   1HE   LYS  36          2HE       LYS  36   2.852 -15.123   8.973
  278   2HE   LYS  36          1HE       LYS  36   2.836 -16.103   7.506
  279   1HZ   LYS  36          1HZ       LYS  36   4.249 -14.462   6.436
  280   2HZ   LYS  36          2HZ       LYS  36   4.981 -15.044   7.845
  281   3HZ   LYS  36          3HZ       LYS  36   4.259 -13.516   7.838
  282    H    LEU  37           H        LEU  37   0.548 -10.527   3.682
  283    HA   LEU  37           HA       LEU  37   3.219  -9.532   3.861
  284   1HB   LEU  37          2HB       LEU  37   1.735  -9.462   1.823
  285   2HB   LEU  37          1HB       LEU  37   0.766  -8.249   2.636
  286    HG   LEU  37           HG       LEU  37   2.274  -7.251   1.000
  287   1HD1  LEU  37          1HD1      LEU  37   1.630  -6.091   3.123
  288   2HD1  LEU  37          2HD1      LEU  37   3.105  -5.501   2.351
  289   3HD1  LEU  37          3HD1      LEU  37   3.207  -6.552   3.764
  290   1HD2  LEU  37          1HD2      LEU  37   4.071  -8.876   1.062
  291   2HD2  LEU  37          2HD2      LEU  37   4.484  -8.381   2.704
  292   3HD2  LEU  37          3HD2      LEU  37   4.686  -7.251   1.364
  293    H    LEU  38           H        LEU  38   0.011  -8.323   4.781
  294    HA   LEU  38           HA       LEU  38   1.208  -6.221   6.407
  295   1HB   LEU  38          1HB       LEU  38  -1.697  -6.824   5.886
  296   2HB   LEU  38          2HB       LEU  38  -1.062  -5.385   6.656
  297    HG   LEU  38           HG       LEU  38  -0.686  -6.192   3.772
  298   1HD1  LEU  38          1HD2      LEU  38  -2.038  -4.242   3.284
  299   2HD1  LEU  38          2HD2      LEU  38  -2.195  -3.896   5.007
  300   3HD1  LEU  38          3HD2      LEU  38  -2.924  -5.355   4.328
  301   1HD2  LEU  38          1HD1      LEU  38   0.338  -3.787   5.265
  302   2HD2  LEU  38          2HD1      LEU  38   0.416  -4.018   3.519
  303   3HD2  LEU  38          3HD1      LEU  38   1.306  -5.100   4.591
  304    H    LYS  39           H        LYS  39  -0.667  -9.178   6.744
  305    HA   LYS  39           HA       LYS  39  -1.040  -9.067   9.541
  306   1HB   LYS  39          2HB       LYS  39  -0.705 -11.486   7.759
  307   2HB   LYS  39          1HB       LYS  39  -1.336 -11.506   9.399
  308   1HG   LYS  39          2HG       LYS  39  -3.283 -10.320   8.763
  309   2HG   LYS  39          1HG       LYS  39  -2.611  -9.933   7.178
  310   1HD   LYS  39          2HD       LYS  39  -2.652 -12.293   6.573
  311   2HD   LYS  39          1HD       LYS  39  -3.294 -12.699   8.166
  312   1HE   LYS  39          2HE       LYS  39  -4.639 -10.986   6.084
  313   2HE   LYS  39          1HE       LYS  39  -5.066 -12.645   6.497
  314   1HZ   LYS  39          1HZ       LYS  39  -5.228 -10.312   8.325
  315   2HZ   LYS  39          2HZ       LYS  39  -5.627 -11.904   8.730
  316   3HZ   LYS  39          3HZ       LYS  39  -6.539 -11.072   7.575
  317    H    SER  40           H        SER  40   1.722  -9.513   7.592
  318    HA   SER  40           HA       SER  40   3.395 -10.841   9.471
  319   1HB   SER  40          1HB       SER  40   4.019 -10.713   7.119
  320   2HB   SER  40          2HB       SER  40   4.104  -8.954   7.213
  321    HG   SER  40           HG       SER  40   5.795  -9.236   8.767
  322    H    VAL  41           H        VAL  41   3.161  -7.389   8.583
  323    HA   VAL  41           HA       VAL  41   4.911  -6.320  10.412
  324    HB   VAL  41           HB       VAL  41   2.551  -4.653  10.327
  325   1HG1  VAL  41          1HG2      VAL  41   5.022  -4.063  10.583
  326   2HG1  VAL  41          2HG2      VAL  41   4.033  -3.029   9.550
  327   3HG1  VAL  41          3HG2      VAL  41   5.113  -4.225   8.827
  328   1HG2  VAL  41          1HG1      VAL  41   2.704  -4.312   7.791
  329   2HG2  VAL  41          2HG1      VAL  41   1.774  -5.686   8.397
  330   3HG2  VAL  41          3HG1      VAL  41   3.400  -5.933   7.757
  331    H    GLY  42           H        GLY  42   1.390  -6.309  10.936
  332   1HA   GLY  42          2HA       GLY  42   1.334  -7.641  13.356
  333   2HA   GLY  42          1HA       GLY  42   1.616  -5.950  13.746
  334    H    ALA  43           H        ALA  43  -0.162  -6.504  10.893
  335    HA   ALA  43           HA       ALA  43  -2.485  -5.218  11.840
  336   1HB   ALA  43          1HB       ALA  43  -1.856  -5.272   9.473
  337   2HB   ALA  43          2HB       ALA  43  -3.499  -5.862   9.721
  338   3HB   ALA  43          3HB       ALA  43  -2.187  -7.003   9.427
  339    H    GLN  44           H        GLN  44  -2.536  -8.509  10.512
  340    HA   GLN  44           HA       GLN  44  -3.594 -10.411  11.166
  341   1HB   GLN  44          1HB       GLN  44  -1.953 -10.172  13.026
  342   2HB   GLN  44          2HB       GLN  44  -3.179  -9.321  13.955
  343   1HG   GLN  44          2HG       GLN  44  -4.596 -11.309  13.910
  344   2HG   GLN  44          1HG       GLN  44  -3.364 -12.163  12.980
  345   1HE2  GLN  44          2HE2      GLN  44  -3.106 -13.741  14.545
  346   2HE2  GLN  44          1HE2      GLN  44  -2.312 -13.433  16.049
  347    H    LYS  45           H        LYS  45  -5.484  -9.196  10.172
  348    HA   LYS  45           HA       LYS  45  -7.661  -9.181  12.147
  349   1HB   LYS  45          2HB       LYS  45  -7.386  -7.254   9.832
  350   2HB   LYS  45          1HB       LYS  45  -8.747  -7.340  10.942
  351   1HG   LYS  45          1HG       LYS  45  -7.227  -6.755  12.798
  352   2HG   LYS  45          2HG       LYS  45  -5.916  -6.579  11.629
  353   1HD   LYS  45          1HD       LYS  45  -8.490  -5.003  11.605
  354   2HD   LYS  45          2HD       LYS  45  -6.948  -4.421  12.235
  355   1HE   LYS  45          1HE       LYS  45  -5.942  -4.653  10.029
  356   2HE   LYS  45          2HE       LYS  45  -7.463  -5.281   9.390
  357   1HZ   LYS  45          1HZ       LYS  45  -7.213  -2.950   8.863
  358   2HZ   LYS  45          2HZ       LYS  45  -7.031  -2.560  10.500
  359   3HZ   LYS  45          3HZ       LYS  45  -8.508  -3.159   9.933
  360    H    ASP  46           H        ASP  46  -9.733  -8.708  10.305
  361    HA   ASP  46           HA       ASP  46  -9.740 -11.253   8.861
  362   1HB   ASP  46          1HB       ASP  46 -12.198 -10.841   8.658
  363   2HB   ASP  46          2HB       ASP  46 -11.630 -10.931  10.323
  364    H    THR  47           H        THR  47  -9.955  -7.797   8.357
  365    HA   THR  47           HA       THR  47  -9.634  -8.216   5.473
  366    HB   THR  47           HB       THR  47 -11.295  -6.510   4.921
  367    HG1  THR  47           1HG      THR  47 -12.762  -6.194   7.004
  368   1HG2  THR  47          1HG2      THR  47 -12.408  -8.706   6.665
  369   2HG2  THR  47          2HG2      THR  47 -12.095  -8.788   4.930
  370   3HG2  THR  47          3HG2      THR  47 -13.355  -7.722   5.550
  371    H    TYR  48           H        TYR  48  -9.637  -5.734   4.545
  372    HA   TYR  48           HA       TYR  48  -7.970  -4.080   6.280
  373   1HB   TYR  48          2HB       TYR  48  -7.160  -5.177   3.600
  374   2HB   TYR  48          1HB       TYR  48  -6.447  -3.711   4.259
  375    HD1  TYR  48           1HD      TYR  48  -6.634  -7.339   4.518
  376    HD2  TYR  48           2HD      TYR  48  -5.036  -3.792   6.236
  377    HE1  TYR  48           1HE      TYR  48  -4.990  -8.689   5.759
  378    HE2  TYR  48           2HE      TYR  48  -3.400  -5.133   7.500
  379    HH   TYR  48           HH       TYR  48  -3.278  -7.571   8.347
  380    H    THR  49           H        THR  49  -7.329  -2.032   4.805
  381    HA   THR  49           HA       THR  49  -9.573  -1.309   3.091
  382    HB   THR  49           HB       THR  49  -8.750   0.653   5.203
  383    HG1  THR  49           1HG      THR  49  -9.566  -1.352   6.169
  384   1HG2  THR  49          1HG2      THR  49 -10.948   1.601   4.747
  385   2HG2  THR  49          2HG2      THR  49 -11.279   0.302   3.601
  386   3HG2  THR  49          3HG2      THR  49 -10.002   1.471   3.265
  387    H    MET  50           H        MET  50  -9.211   0.880   2.090
  388    HA   MET  50           HA       MET  50  -6.927   1.073   0.610
  389   1HB   MET  50          1HB       MET  50  -9.013   3.000   1.483
  390   2HB   MET  50          2HB       MET  50  -7.585   3.645   0.678
  391   1HG   MET  50          1HG       MET  50  -8.569   1.385  -0.774
  392   2HG   MET  50          2HG       MET  50  -9.884   2.525  -0.487
  393   1HE   MET  50          1HE       MET  50  -6.051   3.358  -0.854
  394   2HE   MET  50          2HE       MET  50  -5.931   3.654  -2.588
  395   3HE   MET  50          3HE       MET  50  -6.291   2.034  -1.995
  396    H    LYS  51           H        LYS  51  -7.568   2.723   3.707
  397    HA   LYS  51           HA       LYS  51  -5.025   4.084   3.592
  398   1HB   LYS  51          1HB       LYS  51  -7.010   5.200   4.524
  399   2HB   LYS  51          2HB       LYS  51  -7.100   3.985   5.790
  400   1HG   LYS  51          1HG       LYS  51  -4.940   4.715   6.656
  401   2HG   LYS  51          2HG       LYS  51  -4.841   5.931   5.381
  402   1HD   LYS  51          2HD       LYS  51  -6.864   7.002   6.242
  403   2HD   LYS  51          1HD       LYS  51  -6.968   5.784   7.515
  404   1HE   LYS  51          2HE       LYS  51  -4.710   7.742   7.121
  405   2HE   LYS  51          1HE       LYS  51  -5.977   7.860   8.342
  406   1HZ   LYS  51          1HZ       LYS  51  -3.978   5.673   8.134
  407   2HZ   LYS  51          2HZ       LYS  51  -5.193   5.787   9.304
  408   3HZ   LYS  51          3HZ       LYS  51  -3.950   6.933   9.263
  409    H    GLU  52           H        GLU  52  -6.473   1.412   5.321
  410    HA   GLU  52           HA       GLU  52  -4.475   0.801   7.148
  411   1HB   GLU  52          2HB       GLU  52  -6.819  -0.332   6.432
  412   2HB   GLU  52          1HB       GLU  52  -5.698  -1.462   5.688
  413   1HG   GLU  52          2HG       GLU  52  -6.248  -2.283   7.848
  414   2HG   GLU  52          1HG       GLU  52  -4.578  -1.722   7.884
  415    H    VAL  53           H        VAL  53  -4.882  -0.791   3.979
  416    HA   VAL  53           HA       VAL  53  -2.345  -1.940   3.864
  417    HB   VAL  53           HB       VAL  53  -3.951  -1.019   1.478
  418   1HG1  VAL  53          1HG2      VAL  53  -1.930  -3.233   1.809
  419   2HG1  VAL  53          2HG2      VAL  53  -1.685  -1.719   0.939
  420   3HG1  VAL  53          3HG2      VAL  53  -2.853  -2.898   0.344
  421   1HG2  VAL  53          1HG1      VAL  53  -4.919  -3.311   1.525
  422   2HG2  VAL  53          2HG1      VAL  53  -5.414  -2.292   2.877
  423   3HG2  VAL  53          3HG1      VAL  53  -4.186  -3.536   3.114
  424    H    LEU  54           H        LEU  54  -3.385   1.309   3.189
  425    HA   LEU  54           HA       LEU  54  -1.357   2.253   1.562
  426   1HB   LEU  54          1HB       LEU  54  -3.408   3.484   2.446
  427   2HB   LEU  54          2HB       LEU  54  -2.475   3.799   3.895
  428    HG   LEU  54           HG       LEU  54  -1.507   4.644   1.173
  429   1HD1  LEU  54          1HD1      LEU  54  -3.704   5.637   1.514
  430   2HD1  LEU  54          2HD1      LEU  54  -2.436   6.856   1.641
  431   3HD1  LEU  54          3HD1      LEU  54  -3.203   6.226   3.099
  432   1HD2  LEU  54          1HD2      LEU  54   0.158   4.595   2.949
  433   2HD2  LEU  54          2HD2      LEU  54  -0.880   5.595   3.964
  434   3HD2  LEU  54          3HD2      LEU  54  -0.204   6.254   2.474
  435    H    PHE  55           H        PHE  55  -1.360   2.896   5.069
  436    HA   PHE  55           HA       PHE  55   1.436   3.374   5.081
  437   1HB   PHE  55          1HB       PHE  55   1.232   3.772   7.410
  438   2HB   PHE  55          2HB       PHE  55  -0.267   4.348   6.691
  439    HD1  PHE  55           1HD      PHE  55   1.228   2.100   9.054
  440    HD2  PHE  55           2HD      PHE  55  -2.322   2.927   6.865
  441    HE1  PHE  55           1HE      PHE  55  -0.055   0.695  10.614
  442    HE2  PHE  55           2HE      PHE  55  -3.614   1.525   8.420
  443    HZ   PHE  55           HZ       PHE  55  -2.480   0.407  10.298
  444    H    TYR  56           H        TYR  56  -0.546   0.572   5.805
  445    HA   TYR  56           HA       TYR  56   1.374  -0.866   7.276
  446   1HB   TYR  56          1HB       TYR  56  -1.269  -1.365   6.200
  447   2HB   TYR  56          2HB       TYR  56  -0.238  -2.785   6.076
  448    HD1  TYR  56           1HD      TYR  56  -2.757  -2.145   7.877
  449    HD2  TYR  56           2HD      TYR  56   1.441  -2.228   8.557
  450    HE1  TYR  56           1HE      TYR  56  -3.159  -2.642  10.250
  451    HE2  TYR  56           2HE      TYR  56   1.059  -2.733  10.930
  452    HH   TYR  56           HH       TYR  56  -0.722  -2.452  12.608
  453    H    LEU  57           H        LEU  57   0.560  -0.942   3.821
  454    HA   LEU  57           HA       LEU  57   2.478  -2.866   3.086
  455   1HB   LEU  57          2HB       LEU  57   0.574  -1.686   1.705
  456   2HB   LEU  57          1HB       LEU  57   1.833  -0.533   1.317
  457    HG   LEU  57           HG       LEU  57   1.544  -2.241  -0.431
  458   1HD1  LEU  57          1HD2      LEU  57   3.717  -1.184  -0.153
  459   2HD1  LEU  57          2HD2      LEU  57   3.891  -2.860  -0.668
  460   3HD1  LEU  57          3HD2      LEU  57   4.180  -2.421   1.014
  461   1HD2  LEU  57          1HD1      LEU  57   0.835  -4.099   0.963
  462   2HD2  LEU  57          2HD1      LEU  57   2.439  -4.180   1.693
  463   3HD2  LEU  57          3HD1      LEU  57   2.230  -4.547  -0.019
  464    H    GLY  58           H        GLY  58   2.653   0.692   3.221
  465   1HA   GLY  58          2HA       GLY  58   5.370   1.033   2.737
  466   2HA   GLY  58          1HA       GLY  58   4.418   2.035   3.823
  467    H    GLN  59           H        GLN  59   3.750  -0.150   5.626
  468    HA   GLN  59           HA       GLN  59   5.950   0.061   7.382
  469   1HB   GLN  59          1HB       GLN  59   3.575  -1.809   7.446
  470   2HB   GLN  59          2HB       GLN  59   4.736  -1.638   8.755
  471   1HG   GLN  59          2HG       GLN  59   2.794   0.409   7.733
  472   2HG   GLN  59          1HG       GLN  59   2.841  -0.350   9.321
  473   1HE2  GLN  59          1HE2      GLN  59   4.264   2.040   7.244
  474   2HE2  GLN  59          2HE2      GLN  59   5.171   2.857   8.465
  475    H    TYR  60           H        TYR  60   4.650  -2.805   5.668
  476    HA   TYR  60           HA       TYR  60   6.567  -4.588   6.605
  477   1HB   TYR  60          1HB       TYR  60   4.504  -5.314   5.502
  478   2HB   TYR  60          2HB       TYR  60   5.087  -4.673   3.970
  479    HD1  TYR  60           1HD      TYR  60   6.693  -5.863   2.654
  480    HD2  TYR  60           2HD      TYR  60   5.539  -7.326   6.477
  481    HE1  TYR  60           1HE      TYR  60   7.769  -8.013   2.150
  482    HE2  TYR  60           2HE      TYR  60   6.610  -9.481   5.983
  483    HH   TYR  60           HH       TYR  60   7.290 -10.801   4.053
  484    H    ILE  61           H        ILE  61   6.653  -2.480   3.776
  485    HA   ILE  61           HA       ILE  61   8.986  -3.431   2.568
  486    HB   ILE  61           HB       ILE  61   8.209  -0.521   2.723
  487   1HG1  ILE  61          1HG1      ILE  61   7.282  -2.395   0.568
  488   2HG1  ILE  61          2HG1      ILE  61   6.354  -2.203   2.054
  489   1HG2  ILE  61          1HG2      ILE  61   9.746  -2.145   0.706
  490   2HG2  ILE  61          2HG2      ILE  61  10.355  -0.836   1.722
  491   3HG2  ILE  61          3HG2      ILE  61   9.201  -0.489   0.433
  492   1HD1  ILE  61          1HD1      ILE  61   7.047  -0.065   0.062
  493   2HD1  ILE  61          2HD1      ILE  61   6.261   0.229   1.612
  494   3HD1  ILE  61          3HD1      ILE  61   5.456  -0.752   0.386
  495    H    MET  62           H        MET  62   8.730  -0.554   4.651
  496    HA   MET  62           HA       MET  62  11.501  -0.193   4.883
  497   1HB   MET  62          1HB       MET  62   9.361   0.758   6.794
  498   2HB   MET  62          2HB       MET  62  10.980   1.424   6.625
  499   1HG   MET  62          2HG       MET  62  10.454   2.106   4.336
  500   2HG   MET  62          1HG       MET  62   8.826   1.457   4.526
  501   1HE   MET  62          1HE       MET  62   8.244   5.337   4.518
  502   2HE   MET  62          2HE       MET  62   7.822   3.801   3.762
  503   3HE   MET  62          3HE       MET  62   9.452   4.452   3.587
  504    H    THR  63           H        THR  63   9.285  -2.142   6.763
  505    HA   THR  63           HA       THR  63  10.886  -2.128   9.127
  506    HB   THR  63           HB       THR  63   8.404  -2.398   9.154
  507    HG1  THR  63           1HG      THR  63  10.106  -3.311  10.777
  508   1HG2  THR  63          1HG2      THR  63   8.193  -3.966   7.290
  509   2HG2  THR  63          2HG2      THR  63   7.475  -4.630   8.756
  510   3HG2  THR  63          3HG2      THR  63   9.056  -5.192   8.215
  511    H    LYS  64           H        LYS  64  10.583  -4.270   6.379
  512    HA   LYS  64           HA       LYS  64  12.101  -6.351   7.752
  513   1HB   LYS  64          2HB       LYS  64  10.778  -6.388   5.035
  514   2HB   LYS  64          1HB       LYS  64  11.529  -7.766   5.829
  515   1HG   LYS  64          2HG       LYS  64   9.172  -6.248   6.924
  516   2HG   LYS  64          1HG       LYS  64   9.059  -7.739   5.986
  517   1HD   LYS  64          2HD       LYS  64  10.372  -8.911   7.682
  518   2HD   LYS  64          1HD       LYS  64  10.503  -7.420   8.617
  519   1HE   LYS  64          2HE       LYS  64   8.069  -7.368   8.872
  520   2HE   LYS  64          1HE       LYS  64   7.941  -8.860   7.941
  521   1HZ   LYS  64          1HZ       LYS  64   7.836  -9.290  10.311
  522   2HZ   LYS  64          2HZ       LYS  64   9.344  -8.561  10.541
  523   3HZ   LYS  64          3HZ       LYS  64   9.224  -9.992   9.647
  524    H    ARG  65           H        ARG  65  12.999  -3.682   6.421
  525    HA   ARG  65           HA       ARG  65  14.816  -2.888   5.304
  526   1HB   ARG  65          2HB       ARG  65  16.009  -5.425   6.433
  527   2HB   ARG  65          1HB       ARG  65  16.932  -4.058   5.820
  528   1HG   ARG  65          2HG       ARG  65  15.987  -2.632   7.563
  529   2HG   ARG  65          1HG       ARG  65  15.057  -4.002   8.178
  530   1HD   ARG  65          1HD       ARG  65  18.065  -3.827   8.035
  531   2HD   ARG  65          2HD       ARG  65  17.088  -3.639   9.490
  532    HE   ARG  65           HE       ARG  65  16.499  -6.114   8.300
  533   1HH1  ARG  65          2HH1      ARG  65  19.079  -4.495   9.992
  534   2HH1  ARG  65          1HH1      ARG  65  19.729  -5.954  10.662
  535   1HH2  ARG  65          1HH2      ARG  65  17.348  -8.040   9.177
  536   2HH2  ARG  65          2HH2      ARG  65  18.746  -7.970  10.198
  537    H    LEU  66           H        LEU  66  13.083  -4.240   3.603
  538    HA   LEU  66           HA       LEU  66  14.724  -5.924   1.885
  539   1HB   LEU  66          2HB       LEU  66  11.874  -5.040   1.465
  540   2HB   LEU  66          1HB       LEU  66  12.702  -6.368   0.673
  541    HG   LEU  66           HG       LEU  66  12.253  -6.336   3.647
  542   1HD1  LEU  66          1HD1      LEU  66  10.083  -6.092   2.578
  543   2HD1  LEU  66          2HD1      LEU  66  10.269  -7.699   3.278
  544   3HD1  LEU  66          3HD1      LEU  66  10.429  -7.474   1.537
  545   1HD2  LEU  66          1HD2      LEU  66  12.501  -8.752   3.403
  546   2HD2  LEU  66          2HD2      LEU  66  13.920  -7.895   2.800
  547   3HD2  LEU  66          3HD2      LEU  66  12.741  -8.554   1.667
  548    H    TYR  67           H        TYR  67  14.158  -2.678   2.285
  549    HA   TYR  67           HA       TYR  67  14.043  -1.773  -0.399
  550   1HB   TYR  67          1HB       TYR  67  14.658   0.409   0.515
  551   2HB   TYR  67          2HB       TYR  67  13.423  -0.353   1.512
  552    HD1  TYR  67           1HD      TYR  67  16.782   0.965   1.405
  553    HD2  TYR  67           2HD      TYR  67  14.070  -1.372   3.704
  554    HE1  TYR  67           1HE      TYR  67  18.207   1.270   3.384
  555    HE2  TYR  67           2HE      TYR  67  15.489  -1.073   5.691
  556    HH   TYR  67           HH       TYR  67  17.834  -0.556   6.217
  557    H    ASP  68           H        ASP  68  15.947  -0.146  -1.052
  558    HA   ASP  68           HA       ASP  68  18.126  -1.721  -1.820
  559   1HB   ASP  68          2HB       ASP  68  17.607   0.219  -3.108
  560   2HB   ASP  68          1HB       ASP  68  17.760   1.280  -1.710
  561    H    GLU  69           H        GLU  69  18.950   1.242  -0.154
  562    HA   GLU  69           HA       GLU  69  19.741   0.310   2.326
  563   1HB   GLU  69          1HB       GLU  69  22.174   0.011   2.049
  564   2HB   GLU  69          2HB       GLU  69  21.260  -1.208   1.173
  565   1HG   GLU  69          2HG       GLU  69  21.604   0.027  -0.906
  566   2HG   GLU  69          1HG       GLU  69  22.524   1.246  -0.027
  567    H    LYS  70           H        LYS  70  20.326   2.414  -0.378
  568    HA   LYS  70           HA       LYS  70  20.856   4.609   1.510
  569   1HB   LYS  70          1HB       LYS  70  22.328   5.636  -0.223
  570   2HB   LYS  70          2HB       LYS  70  22.964   4.142   0.450
  571   1HG   LYS  70          2HG       LYS  70  22.203   2.923  -1.524
  572   2HG   LYS  70          1HG       LYS  70  21.561   4.420  -2.200
  573   1HD   LYS  70          1HD       LYS  70  23.807   5.379  -2.226
  574   2HD   LYS  70          2HD       LYS  70  24.456   3.892  -1.531
  575   1HE   LYS  70          1HE       LYS  70  23.707   2.649  -3.502
  576   2HE   LYS  70          2HE       LYS  70  23.066   4.138  -4.196
  577   1HZ   LYS  70          1HZ       LYS  70  25.920   3.619  -3.559
  578   2HZ   LYS  70          2HZ       LYS  70  25.304   5.044  -4.228
  579   3HZ   LYS  70          3HZ       LYS  70  25.235   3.601  -5.106
  580    H    GLN  71           H        GLN  71  19.882   3.820  -1.823
  581    HA   GLN  71           HA       GLN  71  17.840   5.906  -1.700
  582   1HB   GLN  71          1HB       GLN  71  18.481   3.900  -3.874
  583   2HB   GLN  71          2HB       GLN  71  17.273   5.172  -3.991
  584   1HG   GLN  71          2HG       GLN  71  19.028   6.857  -3.753
  585   2HG   GLN  71          1HG       GLN  71  20.236   5.577  -3.652
  586   1HE2  GLN  71          1HE2      GLN  71  19.959   7.749  -5.583
  587   2HE2  GLN  71          2HE2      GLN  71  19.853   6.996  -7.135
  588    H    GLN  72           H        GLN  72  16.814   4.906   0.156
  589    HA   GLN  72           HA       GLN  72  16.033   2.253   0.333
  590   1HB   GLN  72          2HB       GLN  72  14.614   4.630   1.549
  591   2HB   GLN  72          1HB       GLN  72  14.512   2.963   2.100
  592   1HG   GLN  72          1HG       GLN  72  16.098   3.559   3.548
  593   2HG   GLN  72          2HG       GLN  72  17.194   3.387   2.178
  594   1HE2  GLN  72          1HE2      GLN  72  16.011   5.769   0.864
  595   2HE2  GLN  72          2HE2      GLN  72  16.676   7.125   1.700
  596    H    HIS  73           H        HIS  73  14.755   4.707  -1.646
  597    HA   HIS  73           HA       HIS  73  12.117   3.571  -1.903
  598   1HB   HIS  73          1HB       HIS  73  11.781   5.243  -3.648
  599   2HB   HIS  73          2HB       HIS  73  12.487   5.983  -2.216
  600    HD1  HIS  73           1HD      HIS  73  12.865   5.867  -5.776
  601    HD2  HIS  73           2HD      HIS  73  15.447   6.276  -2.548
  602    HE1  HIS  73           1HE      HIS  73  14.975   6.853  -6.725
  603    HE2  HIS  73           2HE      HIS  73  16.553   7.011  -4.767
  604    H    ILE  74           H        ILE  74  14.889   2.233  -2.713
  605    HA   ILE  74           HA       ILE  74  13.714   1.047  -5.147
  606    HB   ILE  74           HB       ILE  74  16.640   0.852  -4.480
  607   1HG1  ILE  74          2HG1      ILE  74  16.152   3.235  -4.667
  608   2HG1  ILE  74          1HG1      ILE  74  17.031   2.684  -6.091
  609   1HG2  ILE  74          1HG2      ILE  74  16.832   0.373  -6.876
  610   2HG2  ILE  74          2HG2      ILE  74  15.086   0.553  -7.046
  611   3HG2  ILE  74          3HG2      ILE  74  15.745  -0.758  -6.068
  612   1HD1  ILE  74          1HD1      ILE  74  14.054   3.091  -5.956
  613   2HD1  ILE  74          2HD1      ILE  74  14.994   2.655  -7.382
  614   3HD1  ILE  74          3HD1      ILE  74  15.211   4.237  -6.632
  615    H    VAL  75           H        VAL  75  12.511  -0.474  -4.026
  616    HA   VAL  75           HA       VAL  75  13.762  -1.937  -1.853
  617    HB   VAL  75           HB       VAL  75  10.967  -2.432  -2.807
  618   1HG1  VAL  75          1HG1      VAL  75  12.259  -2.433  -0.081
  619   2HG1  VAL  75          2HG1      VAL  75  11.863  -3.854  -1.048
  620   3HG1  VAL  75          3HG1      VAL  75  10.574  -2.828  -0.422
  621   1HG2  VAL  75          1HG2      VAL  75  11.909  -0.067  -1.199
  622   2HG2  VAL  75          2HG2      VAL  75  10.228  -0.588  -1.308
  623   3HG2  VAL  75          3HG2      VAL  75  11.079  -0.049  -2.757
  624    H    TYR  76           H        TYR  76  15.137  -3.434  -2.697
  625    HA   TYR  76           HA       TYR  76  14.487  -5.184  -4.829
  626   1HB   TYR  76          1HB       TYR  76  16.477  -5.759  -2.640
  627   2HB   TYR  76          2HB       TYR  76  16.509  -6.313  -4.312
  628    HD1  TYR  76           1HD      TYR  76  15.822  -3.625  -5.590
  629    HD2  TYR  76           2HD      TYR  76  18.613  -4.717  -2.566
  630    HE1  TYR  76           1HE      TYR  76  17.233  -1.702  -6.196
  631    HE2  TYR  76           2HE      TYR  76  20.027  -2.803  -3.169
  632    HH   TYR  76           HH       TYR  76  18.957  -0.284  -5.168
  633    H    CYS  77           H        CYS  77  12.933  -6.656  -4.781
  634    HA   CYS  77           HA       CYS  77  12.580  -8.301  -2.386
  635   1HB   CYS  77          1HB       CYS  77  10.127  -7.955  -2.434
  636   2HB   CYS  77          2HB       CYS  77  11.010  -6.474  -2.072
  637    HG   CYS  77           HG       CYS  77  10.825  -5.672  -4.872
  638    H    SER  78           H        SER  78  13.644  -9.772  -3.952
  639    HA   SER  78           HA       SER  78  11.856 -10.795  -6.029
  640   1HB   SER  78          2HB       SER  78  14.185 -10.415  -6.681
  641   2HB   SER  78          1HB       SER  78  14.732 -11.492  -5.397
  642    HG   SER  78           HG       SER  78  14.009 -12.126  -7.867
  643    H    ASN  79           H        ASN  79  12.753 -11.393  -2.833
  644    HA   ASN  79           HA       ASN  79  11.422 -14.006  -2.917
  645   1HB   ASN  79          1HB       ASN  79  13.996 -13.400  -1.446
  646   2HB   ASN  79          2HB       ASN  79  13.058 -14.879  -1.260
  647   1HD2  ASN  79          1HD2      ASN  79  15.801 -14.450  -2.203
  648   2HD2  ASN  79          2HD2      ASN  79  15.876 -15.173  -3.770
  649    H    ASP  80           H        ASP  80  10.087 -11.751  -2.261
  650    HA   ASP  80           HA       ASP  80   9.835 -11.926   0.667
  651   1HB   ASP  80          1HB       ASP  80   9.646  -9.413  -1.008
  652   2HB   ASP  80          2HB       ASP  80   9.335  -9.511   0.723
  653    H    LEU  81           H        LEU  81   7.703 -11.306   1.490
  654    HA   LEU  81           HA       LEU  81   5.508 -12.301   0.052
  655   1HB   LEU  81          2HB       LEU  81   5.728 -10.475   2.431
  656   2HB   LEU  81          1HB       LEU  81   4.172 -10.910   1.753
  657    HG   LEU  81           HG       LEU  81   4.661 -12.315   3.660
  658   1HD1  LEU  81          1HD1      LEU  81   4.438 -14.519   2.627
  659   2HD1  LEU  81          2HD1      LEU  81   4.921 -13.839   1.073
  660   3HD1  LEU  81          3HD1      LEU  81   3.416 -13.321   1.831
  661   1HD2  LEU  81          1HD2      LEU  81   7.145 -13.138   2.165
  662   2HD2  LEU  81          2HD2      LEU  81   6.563 -13.852   3.668
  663   3HD2  LEU  81          3HD2      LEU  81   7.087 -12.169   3.636
  664    H    LEU  82           H        LEU  82   6.796  -9.030   0.415
  665    HA   LEU  82           HA       LEU  82   4.941  -7.626  -1.130
  666   1HB   LEU  82          1HB       LEU  82   7.341  -7.039   0.072
  667   2HB   LEU  82          2HB       LEU  82   7.745  -6.921  -1.628
  668    HG   LEU  82           HG       LEU  82   7.147  -4.738  -0.840
  669   1HD1  LEU  82          1HD2      LEU  82   4.858  -5.886  -2.436
  670   2HD1  LEU  82          2HD2      LEU  82   6.397  -5.328  -3.095
  671   3HD1  LEU  82          3HD2      LEU  82   5.300  -4.182  -2.323
  672   1HD2  LEU  82          1HD1      LEU  82   4.555  -5.966   0.089
  673   2HD2  LEU  82          2HD1      LEU  82   4.961  -4.251   0.134
  674   3HD2  LEU  82          3HD1      LEU  82   5.866  -5.396   1.123
  675    H    GLY  83           H        GLY  83   7.533  -9.802  -2.019
  676   1HA   GLY  83          2HA       GLY  83   7.636  -9.276  -4.781
  677   2HA   GLY  83          1HA       GLY  83   8.095 -10.787  -4.012
  678    H    ASP  84           H        ASP  84   5.646 -11.563  -2.924
  679    HA   ASP  84           HA       ASP  84   4.296 -12.776  -5.027
  680   1HB   ASP  84          2HB       ASP  84   3.140 -11.984  -2.340
  681   2HB   ASP  84          1HB       ASP  84   2.460 -13.174  -3.445
  682    H    LEU  85           H        LEU  85   3.814  -9.620  -3.557
  683    HA   LEU  85           HA       LEU  85   1.463  -8.914  -4.972
  684   1HB   LEU  85          2HB       LEU  85   3.673  -7.211  -3.824
  685   2HB   LEU  85          1HB       LEU  85   2.186  -6.565  -4.493
  686    HG   LEU  85           HG       LEU  85   2.327  -8.444  -2.143
  687   1HD1  LEU  85          1HD2      LEU  85   3.342  -6.294  -1.605
  688   2HD1  LEU  85          2HD2      LEU  85   1.795  -6.489  -0.780
  689   3HD1  LEU  85          3HD2      LEU  85   1.910  -5.459  -2.206
  690   1HD2  LEU  85          1HD1      LEU  85   0.058  -6.832  -3.299
  691   2HD2  LEU  85          2HD1      LEU  85  -0.018  -7.815  -1.836
  692   3HD2  LEU  85          3HD1      LEU  85   0.246  -8.582  -3.402
  693    H    PHE  86           H        PHE  86   4.610  -7.391  -5.461
  694    HA   PHE  86           HA       PHE  86   3.792  -6.714  -8.146
  695   1HB   PHE  86          2HB       PHE  86   6.225  -5.965  -6.519
  696   2HB   PHE  86          1HB       PHE  86   5.946  -5.404  -8.163
  697    HD1  PHE  86           1HD      PHE  86   2.782  -5.568  -6.860
  698    HD2  PHE  86           2HD      PHE  86   6.367  -3.306  -6.457
  699    HE1  PHE  86           1HE      PHE  86   1.482  -3.670  -5.996
  700    HE2  PHE  86           2HE      PHE  86   5.069  -1.396  -5.590
  701    HZ   PHE  86           HZ       PHE  86   2.624  -1.585  -5.360
  702    H    GLY  87           H        GLY  87   6.710  -8.207  -6.733
  703   1HA   GLY  87          2HA       GLY  87   7.767 -10.150  -7.615
  704   2HA   GLY  87          1HA       GLY  87   6.956  -9.861  -9.146
  705    H    VAL  88           H        VAL  88   7.763  -6.920  -8.782
  706    HA   VAL  88           HA       VAL  88   9.879  -6.781 -10.503
  707    HB   VAL  88           HB       VAL  88   9.657  -4.752  -8.319
  708   1HG1  VAL  88          1HG1      VAL  88  10.101  -3.217 -10.127
  709   2HG1  VAL  88          2HG1      VAL  88   9.984  -4.533 -11.296
  710   3HG1  VAL  88          3HG1      VAL  88  11.300  -4.513 -10.121
  711   1HG2  VAL  88          1HG2      VAL  88   7.748  -3.721  -9.450
  712   2HG2  VAL  88          2HG2      VAL  88   7.347  -5.320  -8.822
  713   3HG2  VAL  88          3HG2      VAL  88   7.655  -5.100 -10.545
  714    HA   PRO  89           HA       PRO  89  13.683  -7.663  -8.195
  715   1HB   PRO  89          2HB       PRO  89  15.125  -5.659  -9.496
  716   2HB   PRO  89          1HB       PRO  89  15.018  -7.347 -10.002
  717   1HG   PRO  89          2HG       PRO  89  13.501  -4.972 -10.981
  718   2HG   PRO  89          1HG       PRO  89  14.110  -6.371 -11.886
  719   1HD   PRO  89          2HD       PRO  89  11.518  -6.141 -11.257
  720   2HD   PRO  89          1HD       PRO  89  12.334  -7.719 -11.236
  721    H    SER  90           H        SER  90  12.276  -4.473  -8.728
  722    HA   SER  90           HA       SER  90  12.679  -3.730  -5.991
  723   1HB   SER  90          2HB       SER  90  14.062  -1.713  -6.487
  724   2HB   SER  90          1HB       SER  90  14.916  -3.231  -6.756
  725    HG   SER  90           HG       SER  90  13.985  -2.850  -9.040
  726    H    PHE  91           H        PHE  91  11.286  -2.080  -5.369
  727    HA   PHE  91           HA       PHE  91   9.845  -0.732  -7.560
  728   1HB   PHE  91          1HB       PHE  91   7.760  -0.869  -6.303
  729   2HB   PHE  91          2HB       PHE  91   8.406  -2.474  -6.613
  730    HD1  PHE  91           1HD      PHE  91   7.828   0.080  -4.029
  731    HD2  PHE  91           2HD      PHE  91   9.070  -3.910  -4.837
  732    HE1  PHE  91           1HE      PHE  91   7.638  -0.457  -1.639
  733    HE2  PHE  91           2HE      PHE  91   8.886  -4.454  -2.446
  734    HZ   PHE  91           HZ       PHE  91   8.167  -2.727  -0.843
  735    H    SER  92           H        SER  92   9.067   1.365  -7.159
  736    HA   SER  92           HA       SER  92  10.707   2.779  -5.206
  737   1HB   SER  92          1HB       SER  92  10.857   3.617  -7.463
  738   2HB   SER  92          2HB       SER  92   9.103   3.763  -7.573
  739    HG   SER  92           HG       SER  92  10.781   5.595  -6.783
  740    H    VAL  93           H        VAL  93   9.913   3.491  -3.367
  741    HA   VAL  93           HA       VAL  93   7.041   3.346  -2.893
  742    HB   VAL  93           HB       VAL  93   8.245   4.234  -0.548
  743   1HG1  VAL  93          1HG2      VAL  93   7.796   1.957   0.249
  744   2HG1  VAL  93          2HG2      VAL  93   7.577   1.426  -1.418
  745   3HG1  VAL  93          3HG2      VAL  93   6.460   2.593  -0.711
  746   1HG2  VAL  93          1HG1      VAL  93   9.996   2.201  -1.897
  747   2HG2  VAL  93          2HG1      VAL  93  10.097   2.672  -0.200
  748   3HG2  VAL  93          3HG1      VAL  93  10.439   3.855  -1.467
  749    H    LYS  94           H        LYS  94   9.571   5.712  -3.240
  750    HA   LYS  94           HA       LYS  94   8.428   7.884  -1.959
  751   1HB   LYS  94          1HB       LYS  94  10.228   7.691  -4.361
  752   2HB   LYS  94          2HB       LYS  94   9.681   9.248  -3.754
  753   1HG   LYS  94          2HG       LYS  94  10.669   8.703  -1.559
  754   2HG   LYS  94          1HG       LYS  94  11.287   7.199  -2.245
  755   1HD   LYS  94          1HD       LYS  94  12.632   8.430  -3.833
  756   2HD   LYS  94          2HD       LYS  94  11.948   9.957  -3.271
  757   1HE   LYS  94          1HE       LYS  94  12.923   9.570  -1.056
  758   2HE   LYS  94          2HE       LYS  94  13.618   8.055  -1.631
  759   1HZ   LYS  94          1HZ       LYS  94  14.255  10.756  -2.688
  760   2HZ   LYS  94          2HZ       LYS  94  14.927   9.301  -3.231
  761   3HZ   LYS  94          3HZ       LYS  94  15.240   9.842  -1.659
  762    H    GLU  95           H        GLU  95   7.563   6.329  -4.912
  763    HA   GLU  95           HA       GLU  95   5.598   8.433  -5.506
  764   1HB   GLU  95          1HB       GLU  95   5.338   7.183  -7.690
  765   2HB   GLU  95          2HB       GLU  95   6.895   7.958  -7.436
  766   1HG   GLU  95          1HG       GLU  95   7.857   5.809  -6.780
  767   2HG   GLU  95          2HG       GLU  95   6.295   5.033  -7.042
  768    H    HIS  96           H        HIS  96   4.277   7.731  -3.703
  769    HA   HIS  96           HA       HIS  96   3.366   5.099  -3.363
  770   1HB   HIS  96          1HB       HIS  96   1.976   7.644  -2.515
  771   2HB   HIS  96          2HB       HIS  96   1.717   6.036  -1.847
  772    HD1  HIS  96           1HD      HIS  96   3.914   8.988  -1.598
  773    HD2  HIS  96           2HD      HIS  96   3.864   5.062  -0.233
  774    HE1  HIS  96           1HE      HIS  96   5.644   8.887   0.225
  775    HE2  HIS  96           2HE      HIS  96   5.530   6.526   1.099
  776    H    ARG  97           H        ARG  97   2.553   7.381  -5.716
  777    HA   ARG  97           HA       ARG  97  -0.142   6.705  -6.219
  778   1HB   ARG  97          2HB       ARG  97   0.886   8.711  -7.154
  779   2HB   ARG  97          1HB       ARG  97   1.998   7.728  -8.098
  780   1HG   ARG  97          2HG       ARG  97   0.091   6.803  -9.343
  781   2HG   ARG  97          1HG       ARG  97  -0.992   7.852  -8.425
  782   1HD   ARG  97          1HD       ARG  97  -0.479   8.823 -10.598
  783   2HD   ARG  97          2HD       ARG  97   0.168   9.817  -9.295
  784    HE   ARG  97           HE       ARG  97   2.180   8.070 -10.101
  785   1HH1  ARG  97          2HH1      ARG  97   0.340  10.724 -11.408
  786   2HH1  ARG  97          1HH1      ARG  97   1.602  11.242 -12.475
  787   1HH2  ARG  97          1HH2      ARG  97   3.848   8.746 -11.504
  788   2HH2  ARG  97          2HH2      ARG  97   3.595  10.118 -12.530
  789    H    LYS  98           H        LYS  98   2.846   5.603  -7.839
  790    HA   LYS  98           HA       LYS  98   1.476   3.848  -9.575
  791   1HB   LYS  98          1HB       LYS  98   3.688   4.804 -10.090
  792   2HB   LYS  98          2HB       LYS  98   4.396   3.847  -8.795
  793   1HG   LYS  98          2HG       LYS  98   3.773   1.796  -9.969
  794   2HG   LYS  98          1HG       LYS  98   3.068   2.758 -11.270
  795   1HD   LYS  98          1HD       LYS  98   5.265   3.758 -11.709
  796   2HD   LYS  98          2HD       LYS  98   5.965   2.771 -10.422
  797   1HE   LYS  98          1HE       LYS  98   5.335   0.743 -11.637
  798   2HE   LYS  98          2HE       LYS  98   4.638   1.729 -12.923
  799   1HZ   LYS  98          1HZ       LYS  98   7.496   1.702 -12.118
  800   2HZ   LYS  98          2HZ       LYS  98   6.831   2.660 -13.343
  801   3HZ   LYS  98          3HZ       LYS  98   6.851   0.977 -13.505
  802    H    ILE  99           H        ILE  99   3.491   3.183  -6.724
  803    HA   ILE  99           HA       ILE  99   3.243   0.458  -6.492
  804    HB   ILE  99           HB       ILE  99   2.764   2.101  -4.045
  805   1HG1  ILE  99          1HG1      ILE  99   5.559   1.833  -4.975
  806   2HG1  ILE  99          2HG1      ILE  99   4.561   3.060  -5.763
  807   1HG2  ILE  99          1HG2      ILE  99   4.456  -0.308  -4.667
  808   2HG2  ILE  99          2HG2      ILE  99   2.980  -0.251  -3.702
  809   3HG2  ILE  99          3HG2      ILE  99   4.454   0.524  -3.112
  810   1HD1  ILE  99          1HD1      ILE  99   3.919   3.631  -3.287
  811   2HD1  ILE  99          2HD1      ILE  99   5.383   4.279  -4.037
  812   3HD1  ILE  99          3HD1      ILE  99   5.486   2.885  -2.960
  813    H    TYR 100           H        TYR 100   1.012   2.874  -5.141
  814    HA   TYR 100           HA       TYR 100  -0.392   0.842  -3.803
  815   1HB   TYR 100          2HB       TYR 100  -0.874   3.794  -4.133
  816   2HB   TYR 100          1HB       TYR 100  -1.979   2.767  -3.219
  817    HD1  TYR 100           1HD      TYR 100  -1.241   4.516  -1.401
  818    HD2  TYR 100           2HD      TYR 100   1.313   1.519  -3.016
  819    HE1  TYR 100           1HE      TYR 100   0.214   4.692   0.575
  820    HE2  TYR 100           2HE      TYR 100   2.758   1.682  -1.055
  821    HH   TYR 100           HH       TYR 100   1.857   3.332   1.781
  822    H    THR 101           H        THR 101  -0.769   2.393  -6.863
  823    HA   THR 101           HA       THR 101  -3.528   1.706  -7.252
  824    HB   THR 101           HB       THR 101  -2.383   3.634  -8.399
  825    HG1  THR 101           1HG      THR 101  -3.453   1.885 -10.345
  826   1HG2  THR 101          1HG2      THR 101  -0.312   2.548  -9.037
  827   2HG2  THR 101          2HG2      THR 101  -1.153   3.120 -10.478
  828   3HG2  THR 101          3HG2      THR 101  -1.192   1.409 -10.053
  829    H    MET 102           H        MET 102  -0.421   0.256  -8.040
  830    HA   MET 102           HA       MET 102  -1.688  -1.877  -9.550
  831   1HB   MET 102          1HB       MET 102   0.631  -2.769  -9.765
  832   2HB   MET 102          2HB       MET 102   0.435  -1.139 -10.391
  833   1HG   MET 102          1HG       MET 102   1.384  -0.265  -8.281
  834   2HG   MET 102          2HG       MET 102   1.681  -1.924  -7.769
  835   1HE   MET 102          1HE       MET 102   3.840   0.813  -8.520
  836   2HE   MET 102          2HE       MET 102   5.203  -0.293  -8.699
  837   3HE   MET 102          3HE       MET 102   4.036  -0.531  -7.397
  838    H    ILE 103           H        ILE 103  -1.180  -1.186  -6.335
  839    HA   ILE 103           HA       ILE 103  -1.114  -3.935  -5.432
  840    HB   ILE 103           HB       ILE 103  -1.779  -1.379  -3.962
  841   1HG1  ILE 103          2HG1      ILE 103   0.661  -3.163  -3.804
  842   2HG1  ILE 103          1HG1      ILE 103   0.583  -1.659  -4.717
  843   1HG2  ILE 103          1HG2      ILE 103  -1.626  -2.716  -1.913
  844   2HG2  ILE 103          2HG2      ILE 103  -1.438  -4.176  -2.885
  845   3HG2  ILE 103          3HG2      ILE 103  -2.944  -3.260  -2.951
  846   1HD1  ILE 103          1HD1      ILE 103   0.257  -1.928  -1.739
  847   2HD1  ILE 103          2HD1      ILE 103   0.192  -0.422  -2.658
  848   3HD1  ILE 103          3HD1      ILE 103   1.693  -1.346  -2.582
  849    H    TYR 104           H        TYR 104  -3.541  -1.361  -5.762
  850    HA   TYR 104           HA       TYR 104  -5.684  -3.287  -5.293
  851   1HB   TYR 104          1HB       TYR 104  -5.721  -0.299  -5.744
  852   2HB   TYR 104          2HB       TYR 104  -7.169  -1.277  -5.526
  853    HD1  TYR 104           1HD      TYR 104  -7.667  -2.294  -3.350
  854    HD2  TYR 104           2HD      TYR 104  -4.299   0.251  -3.882
  855    HE1  TYR 104           1HE      TYR 104  -7.476  -2.046  -0.912
  856    HE2  TYR 104           2HE      TYR 104  -4.098   0.505  -1.444
  857    HH   TYR 104           HH       TYR 104  -5.788  -1.471   0.753
  858    H    ARG 105           H        ARG 105  -5.820  -4.588  -7.064
  859    HA   ARG 105           HA       ARG 105  -6.924  -3.394  -9.455
  860   1HB   ARG 105          2HB       ARG 105  -4.498  -3.296  -9.880
  861   2HB   ARG 105          1HB       ARG 105  -4.384  -5.028  -9.603
  862   1HG   ARG 105          1HG       ARG 105  -5.777  -5.461 -11.536
  863   2HG   ARG 105          2HG       ARG 105  -5.990  -3.728 -11.794
  864   1HD   ARG 105          1HD       ARG 105  -3.373  -5.222 -11.907
  865   2HD   ARG 105          2HD       ARG 105  -4.300  -4.659 -13.296
  866    HE   ARG 105           HE       ARG 105  -3.735  -2.500 -11.565
  867   1HH1  ARG 105          2HH1      ARG 105  -2.208  -4.618 -13.874
  868   2HH1  ARG 105          1HH1      ARG 105  -0.993  -3.468 -14.319
  869   1HH2  ARG 105          1HH2      ARG 105  -2.138  -0.979 -12.146
  870   2HH2  ARG 105          2HH2      ARG 105  -0.951  -1.400 -13.336
  871    H    ASN 106           H        ASN 106  -5.426  -6.488  -8.484
  872    HA   ASN 106           HA       ASN 106  -7.627  -7.957  -9.660
  873   1HB   ASN 106          1HB       ASN 106  -5.345  -8.809  -9.910
  874   2HB   ASN 106          2HB       ASN 106  -5.179  -8.918  -8.160
  875   1HD2  ASN 106          2HD2      ASN 106  -6.627 -10.293 -10.995
  876   2HD2  ASN 106          1HD2      ASN 106  -7.145 -11.768 -10.266
  877    H    LEU 107           H        LEU 107  -9.436  -8.379  -8.599
  878    HA   LEU 107           HA       LEU 107 -10.957  -8.642  -6.925
  879   1HB   LEU 107          1HB       LEU 107  -9.338 -10.645  -6.632
  880   2HB   LEU 107          2HB       LEU 107  -8.749  -9.773  -5.232
  881    HG   LEU 107           HG       LEU 107 -10.432 -11.532  -4.707
  882   1HD1  LEU 107          1HD2      LEU 107 -10.064  -9.679  -3.176
  883   2HD1  LEU 107          2HD2      LEU 107 -11.759 -10.166  -3.179
  884   3HD1  LEU 107          3HD2      LEU 107 -11.257  -8.711  -4.042
  885   1HD2  LEU 107          1HD1      LEU 107 -12.783 -11.107  -5.214
  886   2HD2  LEU 107          2HD1      LEU 107 -11.830 -11.306  -6.685
  887   3HD2  LEU 107          3HD1      LEU 107 -12.324  -9.695  -6.166
  888    H    VAL 108           H        VAL 108 -11.333  -6.481  -6.454
  889    HA   VAL 108           HA       VAL 108  -9.971  -5.425  -4.079
  890    HB   VAL 108           HB       VAL 108  -8.822  -4.507  -6.058
  891   1HG1  VAL 108          1HG1      VAL 108 -10.668  -4.588  -7.642
  892   2HG1  VAL 108          2HG1      VAL 108  -9.998  -2.960  -7.551
  893   3HG1  VAL 108          3HG1      VAL 108 -11.517  -3.335  -6.738
  894   1HG2  VAL 108          1HG2      VAL 108 -10.467  -2.492  -4.532
  895   2HG2  VAL 108          2HG2      VAL 108  -9.008  -2.132  -5.457
  896   3HG2  VAL 108          3HG2      VAL 108  -8.917  -3.174  -4.036
  897    H    VAL 109           H        VAL 109 -11.138  -3.913  -2.887
  898    HA   VAL 109           HA       VAL 109 -12.859  -2.686  -2.098
  899    HB   VAL 109           HB       VAL 109 -12.533  -1.744  -4.543
  900   1HG1  VAL 109          1HG2      VAL 109 -14.702  -1.723  -5.762
  901   2HG1  VAL 109          2HG2      VAL 109 -15.286  -2.969  -4.660
  902   3HG1  VAL 109          3HG2      VAL 109 -13.924  -3.305  -5.725
  903   1HG2  VAL 109          1HG1      VAL 109 -14.273  -0.076  -4.077
  904   2HG2  VAL 109          2HG1      VAL 109 -13.315  -0.449  -2.646
  905   3HG2  VAL 109          3HG1      VAL 109 -14.933  -1.127  -2.824
  906    H    VAL 110           H        VAL 110 -15.129  -2.633  -1.609
  907    HA   VAL 110           HA       VAL 110 -16.476  -5.183  -2.223
  908    HB   VAL 110           HB       VAL 110 -15.678  -5.064   0.115
  909   1HG1  VAL 110          1HG1      VAL 110 -15.828  -2.664   0.436
  910   2HG1  VAL 110          2HG1      VAL 110 -16.761  -3.511   1.671
  911   3HG1  VAL 110          3HG1      VAL 110 -17.585  -2.742   0.314
  912   1HG2  VAL 110          1HG2      VAL 110 -18.677  -5.014  -0.205
  913   2HG2  VAL 110          2HG2      VAL 110 -17.801  -5.693   1.167
  914   3HG2  VAL 110          3HG2      VAL 110 -17.628  -6.413  -0.434
  915    H    ASN 111           H        ASN 111 -16.712  -1.744  -1.997
  916    HA   ASN 111           HA       ASN 111 -19.615  -1.782  -2.310
  917   1HB   ASN 111          1HB       ASN 111 -18.655  -0.181  -0.717
  918   2HB   ASN 111          2HB       ASN 111 -17.701   0.543  -2.009
  919   1HD2  ASN 111          2HD2      ASN 111 -18.625   2.554  -1.729
  920   2HD2  ASN 111          1HD2      ASN 111 -20.249   2.903  -2.207
  921    H    GLN 112           H        GLN 112 -20.687  -1.060  -4.115
  922    HA   GLN 112           HA       GLN 112 -19.150  -0.063  -6.383
  923   1HB   GLN 112          1HB       GLN 112 -19.138  -2.502  -6.664
  924   2HB   GLN 112          2HB       GLN 112 -20.891  -2.530  -6.548
  925   1HG   GLN 112          2HG       GLN 112 -21.048  -1.200  -8.591
  926   2HG   GLN 112          1HG       GLN 112 -19.289  -1.172  -8.705
  927   1HE2  GLN 112          1HE2      GLN 112 -18.188  -3.042  -9.282
  928   2HE2  GLN 112          2HE2      GLN 112 -18.984  -4.392 -10.010
  929    H    GLN 113           H        GLN 113 -20.191   1.586  -7.267
  930    HA   GLN 113           HA       GLN 113 -21.816   3.085  -7.800
  931   1HB   GLN 113          2HB       GLN 113 -22.591   1.229  -9.211
  932   2HB   GLN 113          1HB       GLN 113 -23.552   0.610  -7.876
  933   1HG   GLN 113          2HG       GLN 113 -24.897   2.650  -7.898
  934   2HG   GLN 113          1HG       GLN 113 -23.938   3.263  -9.244
  935   1HE2  GLN 113          2HE2      GLN 113 -23.721   0.616 -10.474
  936   2HE2  GLN 113          1HE2      GLN 113 -25.259   0.302 -11.194
  937    H    GLU 114           H        GLU 114 -21.829   4.209  -5.856
  938    HA   GLU 114           HA       GLU 114 -23.676   3.354  -3.764
  939   1HB   GLU 114          1HB       GLU 114 -21.424   4.117  -3.122
  940   2HB   GLU 114          2HB       GLU 114 -21.752   5.687  -3.844
  941   1HG   GLU 114          2HG       GLU 114 -21.990   5.786  -1.442
  942   2HG   GLU 114          1HG       GLU 114 -23.545   6.058  -2.227
  943    H    SER 115           H        SER 115 -23.291   5.845  -6.193
  944    HA   SER 115           HA       SER 115 -25.640   7.282  -5.229
  945   1HB   SER 115          2HB       SER 115 -23.702   8.611  -5.925
  946   2HB   SER 115          1HB       SER 115 -23.769   7.888  -7.532
  947    HG   SER 115           HG       SER 115 -26.170   8.893  -6.897
  948    H    SER 116           H        SER 116 -27.577   6.636  -5.868
  949    HA   SER 116           HA       SER 116 -28.060   6.059  -8.671
  950   1HB   SER 116          1HB       SER 116 -29.206   3.923  -8.201
  951   2HB   SER 116          2HB       SER 116 -27.493   3.848  -7.787
  952    HG   SER 116           HG       SER 116 -28.165   3.244  -5.898
  953    H    ASP 117           H        ASP 117 -28.826   7.869  -6.262
  954    HA   ASP 117           HA       ASP 117 -31.730   7.536  -6.321
  955   1HB   ASP 117          1HB       ASP 117 -30.695   7.900  -4.134
  956   2HB   ASP 117          2HB       ASP 117 -29.990   9.412  -4.703
  957    H    SER 118           H        SER 118 -29.503  10.316  -6.554
  958    HA   SER 118           HA       SER 118 -29.590  12.239  -7.761
  959   1HB   SER 118          1HB       SER 118 -31.027  10.460  -9.747
  960   2HB   SER 118          2HB       SER 118 -30.345  12.047 -10.107
  961    HG   SER 118           HG       SER 118 -29.087   9.879 -10.402
  962    H    SER 119           H        SER 119 -30.955  13.282  -6.249
  963    HA   SER 119           HA       SER 119 -33.821  13.282  -6.774
  964   1HB   SER 119          1HB       SER 119 -33.088  13.158  -4.441
  965   2HB   SER 119          2HB       SER 119 -32.206  14.675  -4.624
  966    HG   SER 119           HG       SER 119 -34.840  14.261  -4.133
  Start of MODEL   18
    1   1H    MET   1          1H        MET   1 -15.493  41.894 -22.246
    2   2H    MET   1          2H        MET   1 -13.978  41.703 -22.970
    3   3H    MET   1          3H        MET   1 -14.098  41.853 -21.289
    4    HA   MET   1           HA       MET   1 -15.266  39.770 -21.135
    5   1HB   MET   1          2HB       MET   1 -14.815  39.649 -24.124
    6   2HB   MET   1          1HB       MET   1 -15.459  38.342 -23.141
    7   1HG   MET   1          1HG       MET   1 -17.390  39.716 -22.568
    8   2HG   MET   1          2HG       MET   1 -16.743  41.033 -23.544
    9   1HE   MET   1          1HE       MET   1 -16.483  40.933 -26.181
   10   2HE   MET   1          2HE       MET   1 -16.894  39.520 -27.152
   11   3HE   MET   1          3HE       MET   1 -15.531  39.455 -26.035
   12    H    CYS   2           H        CYS   2 -12.509  41.077 -21.302
   13    HA   CYS   2           HA       CYS   2 -10.891  38.677 -21.799
   14   1HB   CYS   2          1HB       CYS   2 -10.044  41.559 -21.437
   15   2HB   CYS   2          2HB       CYS   2  -8.956  40.215 -21.767
   16    HG   CYS   2           HG       CYS   2  -9.262  41.718 -24.104
   17    H    ASN   3           H        ASN   3 -12.077  40.730 -19.306
   18    HA   ASN   3           HA       ASN   3 -10.111  39.940 -17.345
   19   1HB   ASN   3          1HB       ASN   3 -11.515  41.217 -15.763
   20   2HB   ASN   3          2HB       ASN   3 -11.116  42.158 -17.199
   21   1HD2  ASN   3          2HD2      ASN   3 -13.622  40.505 -15.456
   22   2HD2  ASN   3          1HD2      ASN   3 -14.952  41.169 -16.334
   23    H    THR   4           H        THR   4 -10.298  38.395 -15.804
   24    HA   THR   4           HA       THR   4 -12.841  37.037 -15.395
   25    HB   THR   4           HB       THR   4 -10.372  35.521 -16.265
   26    HG1  THR   4           1HG      THR   4 -11.397  36.452 -18.045
   27   1HG2  THR   4          1HG2      THR   4 -13.144  34.544 -15.567
   28   2HG2  THR   4          2HG2      THR   4 -11.687  34.299 -14.604
   29   3HG2  THR   4          3HG2      THR   4 -11.830  33.549 -16.195
   30    H    ASN   5           H        ASN   5 -12.990  37.373 -13.257
   31    HA   ASN   5           HA       ASN   5 -10.636  36.972 -11.566
   32   1HB   ASN   5          2HB       ASN   5 -13.368  38.092 -10.899
   33   2HB   ASN   5          1HB       ASN   5 -12.009  37.996  -9.784
   34   1HD2  ASN   5          2HD2      ASN   5 -13.494  40.314 -10.751
   35   2HD2  ASN   5          1HD2      ASN   5 -12.326  41.360 -11.475
   36    H    MET   6           H        MET   6 -10.400  34.793 -11.339
   37    HA   MET   6           HA       MET   6 -12.351  33.458  -9.662
   38   1HB   MET   6          2HB       MET   6 -13.146  32.951 -11.933
   39   2HB   MET   6          1HB       MET   6 -11.562  32.312 -12.346
   40   1HG   MET   6          1HG       MET   6 -11.833  30.557 -10.670
   41   2HG   MET   6          2HG       MET   6 -13.421  31.198 -10.258
   42   1HE   MET   6          1HE       MET   6 -12.383  29.346 -14.356
   43   2HE   MET   6          2HE       MET   6 -11.242  29.458 -13.018
   44   3HE   MET   6          3HE       MET   6 -11.789  30.923 -13.831
   45    H    SER   7           H        SER   7 -11.379  32.167  -8.218
   46    HA   SER   7           HA       SER   7  -8.811  30.949  -8.799
   47   1HB   SER   7          2HB       SER   7  -8.150  33.162  -7.982
   48   2HB   SER   7          1HB       SER   7  -9.134  32.933  -6.535
   49    HG   SER   7           HG       SER   7  -7.469  31.985  -5.702
   50    H    VAL   8           H        VAL   8 -11.726  31.186  -7.042
   51    HA   VAL   8           HA       VAL   8 -11.008  28.808  -5.454
   52    HB   VAL   8           HB       VAL   8 -13.137  30.850  -4.797
   53   1HG1  VAL   8          1HG1      VAL   8 -12.045  28.531  -3.208
   54   2HG1  VAL   8          2HG1      VAL   8 -13.640  28.623  -3.952
   55   3HG1  VAL   8          3HG1      VAL   8 -13.220  29.711  -2.629
   56   1HG2  VAL   8          1HG2      VAL   8 -10.920  31.829  -4.586
   57   2HG2  VAL   8          2HG2      VAL   8 -10.397  30.467  -3.594
   58   3HG2  VAL   8          3HG2      VAL   8 -11.637  31.569  -2.996
   59    HA   PRO   9           HA       PRO   9 -14.242  27.357  -8.384
   60   1HB   PRO   9          1HB       PRO   9 -13.218  24.886  -8.731
   61   2HB   PRO   9          2HB       PRO   9 -12.615  26.288  -9.620
   62   1HG   PRO   9          1HG       PRO   9 -11.483  24.953  -7.190
   63   2HG   PRO   9          2HG       PRO   9 -10.642  25.548  -8.633
   64   1HD   PRO   9          2HD       PRO   9 -10.745  26.934  -6.291
   65   2HD   PRO   9          1HD       PRO   9 -10.620  27.718  -7.877
   66    H    THR  10           H        THR  10 -15.106  24.800  -8.255
   67    HA   THR  10           HA       THR  10 -16.630  24.734  -5.887
   68    HB   THR  10           HB       THR  10 -17.494  23.695  -7.883
   69    HG1  THR  10           1HG      THR  10 -16.908  21.728  -5.901
   70   1HG2  THR  10          1HG2      THR  10 -15.387  22.984  -8.895
   71   2HG2  THR  10          2HG2      THR  10 -16.521  21.637  -8.804
   72   3HG2  THR  10          3HG2      THR  10 -15.192  21.751  -7.650
   73    H    ASP  11           H        ASP  11 -13.686  23.048  -6.858
   74    HA   ASP  11           HA       ASP  11 -13.154  22.410  -4.071
   75   1HB   ASP  11          1HB       ASP  11 -14.365  20.431  -4.862
   76   2HB   ASP  11          2HB       ASP  11 -13.248  20.274  -6.215
   77    H    GLY  12           H        GLY  12 -11.281  23.490  -3.899
   78   1HA   GLY  12          1HA       GLY  12  -9.261  23.118  -6.013
   79   2HA   GLY  12          2HA       GLY  12  -9.318  24.479  -4.902
   80    H    ALA  13           H        ALA  13  -9.836  22.794  -2.571
   81    HA   ALA  13           HA       ALA  13  -8.671  21.778  -0.904
   82   1HB   ALA  13          1HB       ALA  13  -8.782  19.859  -2.420
   83   2HB   ALA  13          2HB       ALA  13  -7.285  19.864  -1.488
   84   3HB   ALA  13          3HB       ALA  13  -7.273  20.371  -3.177
   85    H    VAL  14           H        VAL  14  -6.159  21.090  -0.390
   86    HA   VAL  14           HA       VAL  14  -4.637  23.563  -0.890
   87    HB   VAL  14           HB       VAL  14  -4.350  21.642   1.427
   88   1HG1  VAL  14          1HG1      VAL  14  -2.934  23.393   2.400
   89   2HG1  VAL  14          2HG1      VAL  14  -3.099  24.341   0.921
   90   3HG1  VAL  14          3HG1      VAL  14  -2.271  22.784   0.883
   91   1HG2  VAL  14          1HG2      VAL  14  -5.373  23.415   2.777
   92   2HG2  VAL  14          2HG2      VAL  14  -6.473  22.827   1.530
   93   3HG2  VAL  14          3HG2      VAL  14  -5.641  24.367   1.317
   94    H    THR  15           H        THR  15  -3.795  20.256   0.148
   95    HA   THR  15           HA       THR  15  -2.104  19.896  -2.183
   96    HB   THR  15           HB       THR  15  -0.906  19.840   0.594
   97    HG1  THR  15           1HG      THR  15  -1.095  21.966  -0.104
   98   1HG2  THR  15          1HG2      THR  15   0.350  19.370  -2.113
   99   2HG2  THR  15          2HG2      THR  15   0.050  18.141  -0.883
  100   3HG2  THR  15          3HG2      THR  15   1.212  19.432  -0.575
  101    H    THR  16           H        THR  16  -2.785  17.968  -2.854
  102    HA   THR  16           HA       THR  16  -2.435  15.640  -1.231
  103    HB   THR  16           HB       THR  16  -4.573  16.294  -0.304
  104    HG1  THR  16           1HG      THR  16  -5.307  14.276  -2.118
  105   1HG2  THR  16          1HG2      THR  16  -5.574  16.313  -3.154
  106   2HG2  THR  16          2HG2      THR  16  -5.364  17.725  -2.118
  107   3HG2  THR  16          3HG2      THR  16  -6.574  16.507  -1.714
  108    H    SER  17           H        SER  17  -2.270  13.805  -2.448
  109    HA   SER  17           HA       SER  17  -2.420  14.180  -5.346
  110   1HB   SER  17          2HB       SER  17  -0.285  13.379  -4.447
  111   2HB   SER  17          1HB       SER  17  -1.100  11.996  -3.715
  112    HG   SER  17           HG       SER  17  -0.329  12.411  -6.316
  113    H    GLN  18           H        GLN  18  -2.922  11.335  -3.256
  114    HA   GLN  18           HA       GLN  18  -5.651  11.023  -4.104
  115   1HB   GLN  18          2HB       GLN  18  -4.430  10.092  -6.051
  116   2HB   GLN  18          1HB       GLN  18  -3.597   8.981  -4.969
  117   1HG   GLN  18          1HG       GLN  18  -5.691   7.917  -4.393
  118   2HG   GLN  18          2HG       GLN  18  -6.569   9.051  -5.422
  119   1HE2  GLN  18          2HE2      GLN  18  -6.414   6.138  -5.544
  120   2HE2  GLN  18          1HE2      GLN  18  -5.830   5.757  -7.125
  121    H    ILE  19           H        ILE  19  -2.794   9.774  -2.489
  122    HA   ILE  19           HA       ILE  19  -4.188   7.452  -1.670
  123    HB   ILE  19           HB       ILE  19  -2.103   6.674  -0.701
  124   1HG1  ILE  19          1HG1      ILE  19  -1.417   9.038   0.061
  125   2HG1  ILE  19          2HG1      ILE  19  -0.146   7.969  -0.523
  126   1HG2  ILE  19          1HG2      ILE  19  -1.814   7.948  -3.413
  127   2HG2  ILE  19          2HG2      ILE  19  -2.469   6.349  -3.058
  128   3HG2  ILE  19          3HG2      ILE  19  -0.760   6.686  -2.771
  129   1HD1  ILE  19          1HD1      ILE  19   0.152  10.218  -1.364
  130   2HD1  ILE  19          2HD1      ILE  19  -1.454  10.175  -2.093
  131   3HD1  ILE  19          3HD1      ILE  19  -0.187   9.100  -2.684
  132    HA   PRO  20           HA       PRO  20  -3.568   9.993   2.675
  133   1HB   PRO  20          1HB       PRO  20  -5.387  11.980   1.367
  134   2HB   PRO  20          2HB       PRO  20  -4.229  12.215   2.682
  135   1HG   PRO  20          1HG       PRO  20  -3.652  12.965   0.184
  136   2HG   PRO  20          2HG       PRO  20  -2.414  12.280   1.251
  137   1HD   PRO  20          1HD       PRO  20  -3.760  11.066  -1.096
  138   2HD   PRO  20          2HD       PRO  20  -2.170  10.718  -0.400
  139    H    ALA  21           H        ALA  21  -5.132   9.531   4.173
  140    HA   ALA  21           HA       ALA  21  -7.173   7.749   3.430
  141   1HB   ALA  21          1HB       ALA  21  -6.087   7.718   5.626
  142   2HB   ALA  21          2HB       ALA  21  -7.842   7.807   5.766
  143   3HB   ALA  21          3HB       ALA  21  -6.864   9.250   6.028
  144    H    SER  22           H        SER  22  -9.457   7.947   3.657
  145    HA   SER  22           HA       SER  22 -11.496   8.925   3.450
  146   1HB   SER  22          2HB       SER  22 -10.911  10.083   5.537
  147   2HB   SER  22          1HB       SER  22 -10.108  11.353   4.614
  148    HG   SER  22           HG       SER  22 -11.983  12.202   4.151
  149    H    GLU  23           H        GLU  23  -9.038   9.510   1.528
  150    HA   GLU  23           HA       GLU  23 -10.350  11.567  -0.090
  151   1HB   GLU  23          2HB       GLU  23  -7.912  11.721   0.184
  152   2HB   GLU  23          1HB       GLU  23  -7.727  10.120  -0.517
  153   1HG   GLU  23          1HG       GLU  23  -7.202  11.825  -2.144
  154   2HG   GLU  23          2HG       GLU  23  -8.646  10.937  -2.627
  155    H    GLN  24           H        GLN  24  -8.625   8.699  -1.242
  156    HA   GLN  24           HA       GLN  24 -11.168   7.554  -2.155
  157   1HB   GLN  24          2HB       GLN  24  -8.660   7.855  -3.813
  158   2HB   GLN  24          1HB       GLN  24  -9.996   6.800  -4.251
  159   1HG   GLN  24          1HG       GLN  24 -10.253   9.769  -3.836
  160   2HG   GLN  24          2HG       GLN  24  -9.997   9.000  -5.402
  161   1HE2  GLN  24          1HE2      GLN  24 -11.650   7.783  -6.321
  162   2HE2  GLN  24          2HE2      GLN  24 -13.287   7.904  -5.781
  163    H    GLU  25           H        GLU  25 -11.143   6.003  -0.532
  164    HA   GLU  25           HA       GLU  25  -8.667   4.507  -0.132
  165   1HB   GLU  25          1HB       GLU  25  -9.816   5.603   1.808
  166   2HB   GLU  25          2HB       GLU  25 -11.166   4.503   1.568
  167   1HG   GLU  25          1HG       GLU  25  -9.629   2.601   1.945
  168   2HG   GLU  25          2HG       GLU  25  -8.346   3.758   2.299
  169    H    THR  26           H        THR  26 -11.715   3.136   0.787
  170    HA   THR  26           HA       THR  26 -12.343   1.227  -1.019
  171    HB   THR  26           HB       THR  26  -9.886   0.804  -1.259
  172    HG1  THR  26           1HG      THR  26 -10.415  -1.204  -1.708
  173   1HG2  THR  26          1HG2      THR  26  -9.278   1.148   1.088
  174   2HG2  THR  26          2HG2      THR  26  -8.753  -0.435   0.509
  175   3HG2  THR  26          3HG2      THR  26 -10.187  -0.298   1.528
  176    H    LEU  27           H        LEU  27 -13.023  -0.931   0.008
  177    HA   LEU  27           HA       LEU  27 -11.993  -1.227   2.676
  178   1HB   LEU  27          1HB       LEU  27 -14.628  -0.621   2.556
  179   2HB   LEU  27          2HB       LEU  27 -14.706  -2.366   2.385
  180    HG   LEU  27           HG       LEU  27 -14.908  -1.996   4.697
  181   1HD1  LEU  27          1HD1      LEU  27 -11.991  -2.519   4.130
  182   2HD1  LEU  27          2HD1      LEU  27 -13.276  -3.730   4.203
  183   3HD1  LEU  27          3HD1      LEU  27 -12.807  -2.851   5.661
  184   1HD2  LEU  27          1HD2      LEU  27 -13.457  -0.495   5.961
  185   2HD2  LEU  27          2HD2      LEU  27 -14.289   0.372   4.670
  186   3HD2  LEU  27          3HD2      LEU  27 -12.591  -0.076   4.481
  187    H    VAL  28           H        VAL  28 -10.521  -2.461   1.420
  188    HA   VAL  28           HA       VAL  28 -11.616  -4.263  -0.544
  189    HB   VAL  28           HB       VAL  28  -9.826  -3.120  -1.443
  190   1HG1  VAL  28          1HG1      VAL  28  -7.682  -2.760  -0.235
  191   2HG1  VAL  28          2HG1      VAL  28  -8.415  -3.508   1.187
  192   3HG1  VAL  28          3HG1      VAL  28  -9.080  -2.007   0.535
  193   1HG2  VAL  28          1HG2      VAL  28  -8.572  -5.633  -0.341
  194   2HG2  VAL  28          2HG2      VAL  28  -7.933  -4.672  -1.676
  195   3HG2  VAL  28          3HG2      VAL  28  -9.486  -5.490  -1.844
  196    H    ARG  29           H        ARG  29 -11.197  -6.458  -0.730
  197    HA   ARG  29           HA       ARG  29 -10.210  -7.778   1.701
  198   1HB   ARG  29          2HB       ARG  29 -12.471  -8.904   0.070
  199   2HB   ARG  29          1HB       ARG  29 -12.012  -9.287   1.724
  200   1HG   ARG  29          1HG       ARG  29 -12.771  -7.081   2.451
  201   2HG   ARG  29          2HG       ARG  29 -13.233  -6.693   0.792
  202   1HD   ARG  29          1HD       ARG  29 -14.840  -8.530   0.803
  203   2HD   ARG  29          2HD       ARG  29 -14.366  -8.947   2.450
  204    HE   ARG  29           HE       ARG  29 -15.199  -6.246   2.309
  205   1HH1  ARG  29          2HH1      ARG  29 -16.437  -9.502   2.283
  206   2HH1  ARG  29          1HH1      ARG  29 -17.976  -9.059   2.942
  207   1HH2  ARG  29          1HH2      ARG  29 -17.222  -5.654   3.178
  208   2HH2  ARG  29          2HH2      ARG  29 -18.422  -6.871   3.451
  209    HA   PRO  30           HA       PRO  30  -8.139  -8.959  -2.210
  210   1HB   PRO  30          2HB       PRO  30  -5.585  -8.751  -1.424
  211   2HB   PRO  30          1HB       PRO  30  -6.579  -7.323  -1.732
  212   1HG   PRO  30          2HG       PRO  30  -5.849  -8.602   0.874
  213   2HG   PRO  30          1HG       PRO  30  -5.916  -6.881   0.451
  214   1HD   PRO  30          2HD       PRO  30  -7.903  -8.222   1.801
  215   2HD   PRO  30          1HD       PRO  30  -8.166  -6.755   0.839
  216    H    LYS  31           H        LYS  31  -7.186 -10.801  -3.012
  217    HA   LYS  31           HA       LYS  31  -7.189 -13.239  -1.694
  218   1HB   LYS  31          2HB       LYS  31  -7.010 -13.037  -4.120
  219   2HB   LYS  31          1HB       LYS  31  -5.425 -12.296  -3.965
  220   1HG   LYS  31          2HG       LYS  31  -4.544 -14.378  -3.030
  221   2HG   LYS  31          1HG       LYS  31  -6.136 -15.121  -3.206
  222   1HD   LYS  31          1HD       LYS  31  -6.029 -14.772  -5.627
  223   2HD   LYS  31          2HD       LYS  31  -4.438 -14.031  -5.449
  224   1HE   LYS  31          1HE       LYS  31  -4.245 -16.354  -6.157
  225   2HE   LYS  31          2HE       LYS  31  -3.556 -16.122  -4.551
  226   1HZ   LYS  31          1HZ       LYS  31  -4.893 -18.130  -4.660
  227   2HZ   LYS  31          2HZ       LYS  31  -6.249 -17.233  -5.128
  228   3HZ   LYS  31          3HZ       LYS  31  -5.582 -17.016  -3.589
  229    HA   PRO  32           HA       PRO  32  -3.834 -13.290   1.230
  230   1HB   PRO  32          1HB       PRO  32  -2.814 -15.802   0.450
  231   2HB   PRO  32          2HB       PRO  32  -3.976 -15.487   1.740
  232   1HG   PRO  32          1HG       PRO  32  -4.447 -16.377  -1.060
  233   2HG   PRO  32          2HG       PRO  32  -5.346 -16.774   0.417
  234   1HD   PRO  32          2HD       PRO  32  -6.328 -15.058  -1.384
  235   2HD   PRO  32          1HD       PRO  32  -6.558 -14.791   0.358
  236    H    LEU  33           H        LEU  33  -2.625 -11.626   0.236
  237    HA   LEU  33           HA       LEU  33  -0.030 -12.327  -0.482
  238   1HB   LEU  33          1HB       LEU  33  -0.016 -11.442  -2.834
  239   2HB   LEU  33          2HB       LEU  33  -0.766 -13.011  -2.621
  240    HG   LEU  33           HG       LEU  33  -2.963 -11.508  -2.456
  241   1HD1  LEU  33          1HD1      LEU  33  -1.082  -9.911  -4.181
  242   2HD1  LEU  33          2HD1      LEU  33  -1.813  -9.391  -2.663
  243   3HD1  LEU  33          3HD1      LEU  33  -2.826  -9.671  -4.080
  244   1HD2  LEU  33          1HD2      LEU  33  -2.600 -13.338  -4.022
  245   2HD2  LEU  33          2HD2      LEU  33  -1.600 -12.291  -5.028
  246   3HD2  LEU  33          3HD2      LEU  33  -3.319 -11.949  -4.834
  247    H    LEU  34           H        LEU  34  -2.531 -10.146   0.103
  248    HA   LEU  34           HA       LEU  34  -0.558  -7.990   0.453
  249   1HB   LEU  34          1HB       LEU  34  -3.430  -8.016  -0.139
  250   2HB   LEU  34          2HB       LEU  34  -2.996  -6.925   1.162
  251    HG   LEU  34           HG       LEU  34  -3.044  -5.737  -0.948
  252   1HD1  LEU  34          1HD1      LEU  34  -0.227  -6.141   0.045
  253   2HD1  LEU  34          2HD1      LEU  34  -1.414  -5.016   0.707
  254   3HD1  LEU  34          3HD1      LEU  34  -0.793  -4.783  -0.928
  255   1HD2  LEU  34          1HD2      LEU  34  -0.968  -7.721  -1.857
  256   2HD2  LEU  34          2HD2      LEU  34  -1.470  -6.282  -2.746
  257   3HD2  LEU  34          3HD2      LEU  34  -2.621  -7.588  -2.455
  258    H    LEU  35           H        LEU  35  -2.115 -10.494   2.008
  259    HA   LEU  35           HA       LEU  35  -2.295  -9.092   4.573
  260   1HB   LEU  35          2HB       LEU  35  -3.310 -11.868   4.059
  261   2HB   LEU  35          1HB       LEU  35  -3.819 -10.730   5.288
  262    HG   LEU  35           HG       LEU  35  -5.604 -10.715   3.816
  263   1HD1  LEU  35          1HD1      LEU  35  -4.600  -8.434   4.221
  264   2HD1  LEU  35          2HD1      LEU  35  -5.681  -8.578   2.836
  265   3HD1  LEU  35          3HD1      LEU  35  -3.935  -8.541   2.593
  266   1HD2  LEU  35          1HD2      LEU  35  -5.325 -10.625   1.351
  267   2HD2  LEU  35          2HD2      LEU  35  -4.703 -12.097   2.095
  268   3HD2  LEU  35          3HD2      LEU  35  -3.589 -10.827   1.587
  269    H    LYS  36           H        LYS  36  -0.952 -12.031   3.098
  270    HA   LYS  36           HA       LYS  36   0.726 -12.767   5.242
  271   1HB   LYS  36          1HB       LYS  36   0.280 -14.029   3.060
  272   2HB   LYS  36          2HB       LYS  36   1.474 -12.968   2.328
  273   1HG   LYS  36          1HG       LYS  36   3.167 -13.766   3.880
  274   2HG   LYS  36          2HG       LYS  36   1.973 -14.805   4.662
  275   1HD   LYS  36          1HD       LYS  36   1.666 -16.025   2.559
  276   2HD   LYS  36          2HD       LYS  36   2.872 -14.992   1.787
  277   1HE   LYS  36          1HE       LYS  36   3.353 -16.831   4.127
  278   2HE   LYS  36          2HE       LYS  36   3.832 -17.137   2.457
  279   1HZ   LYS  36          1HZ       LYS  36   5.265 -15.194   2.552
  280   2HZ   LYS  36          2HZ       LYS  36   5.678 -16.298   3.764
  281   3HZ   LYS  36          3HZ       LYS  36   4.807 -14.902   4.154
  282    H    LEU  37           H        LEU  37   0.536  -9.937   3.569
  283    HA   LEU  37           HA       LEU  37   3.380  -9.292   3.715
  284   1HB   LEU  37          1HB       LEU  37   1.842  -8.816   1.699
  285   2HB   LEU  37          2HB       LEU  37   1.168  -7.527   2.681
  286    HG   LEU  37           HG       LEU  37   4.104  -7.718   2.028
  287   1HD1  LEU  37          1HD2      LEU  37   2.001  -6.082   0.621
  288   2HD1  LEU  37          2HD2      LEU  37   2.784  -7.518  -0.041
  289   3HD1  LEU  37          3HD2      LEU  37   3.736  -6.073   0.304
  290   1HD2  LEU  37          1HD1      LEU  37   3.408  -6.391   3.985
  291   2HD2  LEU  37          2HD1      LEU  37   2.401  -5.412   2.920
  292   3HD2  LEU  37          3HD1      LEU  37   4.157  -5.431   2.706
  293    H    LEU  38           H        LEU  38   0.233  -8.324   4.981
  294    HA   LEU  38           HA       LEU  38   1.481  -6.239   6.611
  295   1HB   LEU  38          1HB       LEU  38  -1.154  -6.686   5.425
  296   2HB   LEU  38          2HB       LEU  38  -1.223  -6.093   7.073
  297    HG   LEU  38           HG       LEU  38  -0.038  -4.100   6.494
  298   1HD1  LEU  38          1HD1      LEU  38   0.819  -3.676   4.248
  299   2HD1  LEU  38          2HD1      LEU  38   0.349  -5.302   3.755
  300   3HD1  LEU  38          3HD1      LEU  38   1.603  -5.079   4.975
  301   1HD2  LEU  38          1HD2      LEU  38  -1.516  -3.119   4.822
  302   2HD2  LEU  38          2HD2      LEU  38  -2.418  -4.124   5.958
  303   3HD2  LEU  38          3HD2      LEU  38  -2.050  -4.732   4.342
  304    H    LYS  39           H        LYS  39  -0.638  -9.073   6.963
  305    HA   LYS  39           HA       LYS  39  -0.749  -9.118   9.762
  306   1HB   LYS  39          2HB       LYS  39  -0.657 -11.510   7.916
  307   2HB   LYS  39          1HB       LYS  39  -1.293 -11.475   9.556
  308   1HG   LYS  39          2HG       LYS  39  -3.030  -9.888   8.818
  309   2HG   LYS  39          1HG       LYS  39  -2.419 -10.024   7.170
  310   1HD   LYS  39          2HD       LYS  39  -3.530 -12.280   8.835
  311   2HD   LYS  39          1HD       LYS  39  -4.364 -11.456   7.516
  312   1HE   LYS  39          1HE       LYS  39  -2.681 -12.227   5.942
  313   2HE   LYS  39          2HE       LYS  39  -1.792 -13.009   7.251
  314   1HZ   LYS  39          1HZ       LYS  39  -4.544 -13.710   6.374
  315   2HZ   LYS  39          2HZ       LYS  39  -3.681 -14.465   7.618
  316   3HZ   LYS  39          3HZ       LYS  39  -3.142 -14.590   6.020
  317    H    SER  40           H        SER  40   1.835  -9.682   7.597
  318    HA   SER  40           HA       SER  40   3.520 -11.221   9.284
  319   1HB   SER  40          1HB       SER  40   3.960 -10.997   6.885
  320   2HB   SER  40          2HB       SER  40   4.239  -9.267   7.084
  321    HG   SER  40           HG       SER  40   6.075  -9.702   8.240
  322    H    VAL  41           H        VAL  41   3.344  -7.713   8.664
  323    HA   VAL  41           HA       VAL  41   5.300  -6.931  10.513
  324    HB   VAL  41           HB       VAL  41   3.177  -4.983  10.449
  325   1HG1  VAL  41          1HG2      VAL  41   5.611  -4.595  10.789
  326   2HG1  VAL  41          2HG2      VAL  41   4.878  -3.559   9.564
  327   3HG1  VAL  41          3HG2      VAL  41   5.858  -4.943   9.077
  328   1HG2  VAL  41          1HG1      VAL  41   2.323  -5.947   8.472
  329   2HG2  VAL  41          2HG1      VAL  41   3.938  -6.198   7.807
  330   3HG2  VAL  41          3HG1      VAL  41   3.292  -4.564   7.965
  331    H    GLY  42           H        GLY  42   1.762  -7.059  10.888
  332   1HA   GLY  42          1HA       GLY  42   1.797  -7.944  13.555
  333   2HA   GLY  42          2HA       GLY  42   1.703  -6.188  13.551
  334    H    ALA  43           H        ALA  43   0.240  -6.571  10.853
  335    HA   ALA  43           HA       ALA  43  -2.343  -6.108  11.775
  336   1HB   ALA  43          1HB       ALA  43  -3.070  -6.429   9.474
  337   2HB   ALA  43          2HB       ALA  43  -1.536  -7.208   9.085
  338   3HB   ALA  43          3HB       ALA  43  -1.570  -5.502   9.532
  339    H    GLN  44           H        GLN  44  -4.295  -7.416  11.423
  340    HA   GLN  44           HA       GLN  44  -4.189 -10.214  11.047
  341   1HB   GLN  44          1HB       GLN  44  -3.103 -10.107  13.275
  342   2HB   GLN  44          2HB       GLN  44  -4.541  -9.324  13.916
  343   1HG   GLN  44          2HG       GLN  44  -4.537 -11.665  14.488
  344   2HG   GLN  44          1HG       GLN  44  -5.859 -11.315  13.376
  345   1HE2  GLN  44          2HE2      GLN  44  -2.527 -11.554  12.368
  346   2HE2  GLN  44          1HE2      GLN  44  -2.699 -13.022  11.473
  347    H    LYS  45           H        LYS  45  -5.867  -9.265   9.654
  348    HA   LYS  45           HA       LYS  45  -8.455  -9.423  11.006
  349   1HB   LYS  45          2HB       LYS  45  -7.769  -7.246   9.022
  350   2HB   LYS  45          1HB       LYS  45  -9.335  -7.504   9.776
  351   1HG   LYS  45          2HG       LYS  45  -8.364  -7.013  11.965
  352   2HG   LYS  45          1HG       LYS  45  -6.795  -6.745  11.204
  353   1HD   LYS  45          1HD       LYS  45  -9.302  -5.179  10.595
  354   2HD   LYS  45          2HD       LYS  45  -8.013  -4.644  11.675
  355   1HE   LYS  45          1HE       LYS  45  -6.423  -4.728   9.814
  356   2HE   LYS  45          2HE       LYS  45  -7.716  -5.253   8.737
  357   1HZ   LYS  45          1HZ       LYS  45  -8.860  -3.161   9.163
  358   2HZ   LYS  45          2HZ       LYS  45  -7.319  -2.890   8.523
  359   3HZ   LYS  45          3HZ       LYS  45  -7.601  -2.656  10.173
  360    H    ASP  46           H        ASP  46 -10.242  -9.349   9.180
  361    HA   ASP  46           HA       ASP  46  -9.489 -11.382   7.231
  362   1HB   ASP  46          2HB       ASP  46 -11.517 -11.759   8.552
  363   2HB   ASP  46          1HB       ASP  46 -12.201 -10.249   7.956
  364    H    THR  47           H        THR  47 -10.224  -8.021   7.423
  365    HA   THR  47           HA       THR  47  -9.795  -7.798   4.527
  366    HB   THR  47           HB       THR  47 -11.495  -6.073   4.301
  367    HG1  THR  47           1HG      THR  47 -11.747  -5.105   6.221
  368   1HG2  THR  47          1HG2      THR  47 -13.512  -7.403   4.565
  369   2HG2  THR  47          2HG2      THR  47 -12.663  -8.510   5.646
  370   3HG2  THR  47          3HG2      THR  47 -12.197  -8.403   3.950
  371    H    TYR  48           H        TYR  48  -9.368  -5.457   3.920
  372    HA   TYR  48           HA       TYR  48  -8.170  -3.915   6.087
  373   1HB   TYR  48          2HB       TYR  48  -6.677  -4.891   3.659
  374   2HB   TYR  48          1HB       TYR  48  -6.118  -3.558   4.663
  375    HD1  TYR  48           1HD      TYR  48  -5.322  -3.933   6.896
  376    HD2  TYR  48           2HD      TYR  48  -6.624  -7.179   4.480
  377    HE1  TYR  48           1HE      TYR  48  -4.223  -5.512   8.440
  378    HE2  TYR  48           2HE      TYR  48  -5.518  -8.769   5.995
  379    HH   TYR  48           HH       TYR  48  -4.393  -7.872   9.080
  380    H    THR  49           H        THR  49  -7.173  -1.837   5.065
  381    HA   THR  49           HA       THR  49  -8.906  -0.884   2.888
  382    HB   THR  49           HB       THR  49  -9.487   1.125   3.979
  383    HG1  THR  49           1HG      THR  49  -7.292   0.527   5.550
  384   1HG2  THR  49          1HG2      THR  49  -9.659  -1.075   6.040
  385   2HG2  THR  49          2HG2      THR  49 -10.806  -0.791   4.730
  386   3HG2  THR  49          3HG2      THR  49 -10.630   0.399   6.021
  387    H    MET  50           H        MET  50  -8.114   1.424   2.211
  388    HA   MET  50           HA       MET  50  -5.458   0.987   1.274
  389   1HB   MET  50          1HB       MET  50  -7.507   3.129   0.874
  390   2HB   MET  50          2HB       MET  50  -5.854   3.391   0.332
  391   1HG   MET  50          2HG       MET  50  -6.129   1.132  -0.872
  392   2HG   MET  50          1HG       MET  50  -7.855   1.385  -0.619
  393   1HE   MET  50          1HE       MET  50  -5.122   4.150  -1.262
  394   2HE   MET  50          2HE       MET  50  -5.170   4.270  -3.022
  395   3HE   MET  50          3HE       MET  50  -4.581   2.796  -2.254
  396    H    LYS  51           H        LYS  51  -6.821   2.752   3.912
  397    HA   LYS  51           HA       LYS  51  -4.472   4.377   4.354
  398   1HB   LYS  51          1HB       LYS  51  -6.615   5.237   5.086
  399   2HB   LYS  51          2HB       LYS  51  -6.889   3.814   6.082
  400   1HG   LYS  51          2HG       LYS  51  -6.230   5.733   7.426
  401   2HG   LYS  51          1HG       LYS  51  -5.031   4.443   7.522
  402   1HD   LYS  51          2HD       LYS  51  -3.642   5.612   5.880
  403   2HD   LYS  51          1HD       LYS  51  -4.843   6.901   5.781
  404   1HE   LYS  51          2HE       LYS  51  -4.504   7.398   8.154
  405   2HE   LYS  51          1HE       LYS  51  -3.301   6.112   8.250
  406   1HZ   LYS  51          1HZ       LYS  51  -2.253   8.266   8.003
  407   2HZ   LYS  51          2HZ       LYS  51  -3.102   8.550   6.567
  408   3HZ   LYS  51          3HZ       LYS  51  -1.951   7.312   6.638
  409    H    GLU  52           H        GLU  52  -5.947   1.511   5.848
  410    HA   GLU  52           HA       GLU  52  -4.017   0.839   7.693
  411   1HB   GLU  52          2HB       GLU  52  -6.024  -0.574   6.063
  412   2HB   GLU  52          1HB       GLU  52  -4.710  -1.568   6.652
  413   1HG   GLU  52          1HG       GLU  52  -6.454   0.163   8.382
  414   2HG   GLU  52          2HG       GLU  52  -6.686  -1.566   8.129
  415    H    VAL  53           H        VAL  53  -4.221  -0.563   4.429
  416    HA   VAL  53           HA       VAL  53  -1.664  -1.622   4.327
  417    HB   VAL  53           HB       VAL  53  -3.249  -0.542   1.990
  418   1HG1  VAL  53          1HG2      VAL  53  -1.052  -2.606   2.110
  419   2HG1  VAL  53          2HG2      VAL  53  -0.931  -0.990   1.414
  420   3HG1  VAL  53          3HG2      VAL  53  -1.990  -2.190   0.677
  421   1HG2  VAL  53          1HG1      VAL  53  -4.568  -2.110   3.310
  422   2HG2  VAL  53          2HG1      VAL  53  -3.256  -3.288   3.243
  423   3HG2  VAL  53          3HG1      VAL  53  -4.106  -2.827   1.767
  424    H    LEU  54           H        LEU  54  -2.720   1.673   3.842
  425    HA   LEU  54           HA       LEU  54  -0.624   2.734   2.387
  426   1HB   LEU  54          1HB       LEU  54  -2.584   4.040   3.004
  427   2HB   LEU  54          2HB       LEU  54  -2.113   3.993   4.690
  428    HG   LEU  54           HG       LEU  54  -0.118   5.337   4.174
  429   1HD1  LEU  54          1HD2      LEU  54  -1.244   5.415   1.376
  430   2HD1  LEU  54          2HD2      LEU  54   0.243   4.612   1.880
  431   3HD1  LEU  54          3HD2      LEU  54   0.117   6.369   1.966
  432   1HD2  LEU  54          1HD1      LEU  54  -2.177   6.452   4.850
  433   2HD2  LEU  54          2HD1      LEU  54  -2.692   6.541   3.165
  434   3HD2  LEU  54          3HD1      LEU  54  -1.271   7.437   3.700
  435    H    PHE  55           H        PHE  55  -0.818   3.066   5.937
  436    HA   PHE  55           HA       PHE  55   2.008   3.574   6.040
  437   1HB   PHE  55          2HB       PHE  55   1.628   3.737   8.513
  438   2HB   PHE  55          1HB       PHE  55   0.639   4.824   7.547
  439    HD1  PHE  55           1HD      PHE  55   0.555   1.552   9.303
  440    HD2  PHE  55           2HD      PHE  55  -1.665   4.856   7.797
  441    HE1  PHE  55           1HE      PHE  55  -1.466   0.697  10.415
  442    HE2  PHE  55           2HE      PHE  55  -3.690   4.004   8.905
  443    HZ   PHE  55           HZ       PHE  55  -3.592   1.923  10.217
  444    H    TYR  56           H        TYR  56  -0.001   0.799   6.399
  445    HA   TYR  56           HA       TYR  56   1.767  -0.681   8.088
  446   1HB   TYR  56          1HB       TYR  56  -0.858  -1.006   7.151
  447   2HB   TYR  56          2HB       TYR  56   0.043  -2.382   6.524
  448    HD1  TYR  56           1HD      TYR  56   2.036  -2.521   8.865
  449    HD2  TYR  56           2HD      TYR  56  -2.206  -2.211   8.698
  450    HE1  TYR  56           1HE      TYR  56   1.876  -3.627  11.055
  451    HE2  TYR  56           2HE      TYR  56  -2.382  -3.310  10.885
  452    HH   TYR  56           HH       TYR  56  -1.067  -4.798  12.315
  453    H    LEU  57           H        LEU  57   0.899  -1.075   4.639
  454    HA   LEU  57           HA       LEU  57   2.961  -2.804   3.933
  455   1HB   LEU  57          2HB       LEU  57   1.230  -2.320   2.351
  456   2HB   LEU  57          1HB       LEU  57   1.607  -0.609   2.369
  457    HG   LEU  57           HG       LEU  57   3.803  -1.135   1.305
  458   1HD1  LEU  57          1HD1      LEU  57   4.026  -3.444   2.027
  459   2HD1  LEU  57          2HD1      LEU  57   4.090  -3.333   0.268
  460   3HD1  LEU  57          3HD1      LEU  57   2.620  -3.897   1.063
  461   1HD2  LEU  57          1HD2      LEU  57   1.345  -2.043  -0.185
  462   2HD2  LEU  57          2HD2      LEU  57   2.876  -1.564  -0.918
  463   3HD2  LEU  57          3HD2      LEU  57   1.915  -0.381  -0.029
  464    H    GLY  58           H        GLY  58   2.931   0.747   4.084
  465   1HA   GLY  58          2HA       GLY  58   5.493   1.376   3.354
  466   2HA   GLY  58          1HA       GLY  58   4.649   2.163   4.680
  467    H    GLN  59           H        GLN  59   4.464  -0.012   6.457
  468    HA   GLN  59           HA       GLN  59   7.003  -0.135   7.651
  469   1HB   GLN  59          2HB       GLN  59   4.855  -2.226   7.985
  470   2HB   GLN  59          1HB       GLN  59   6.101  -1.771   9.137
  471   1HG   GLN  59          2HG       GLN  59   3.797  -0.040   8.272
  472   2HG   GLN  59          1HG       GLN  59   3.903  -0.940   9.781
  473   1HE2  GLN  59          1HE2      GLN  59   3.713   0.902  11.028
  474   2HE2  GLN  59          2HE2      GLN  59   4.993   2.050  11.186
  475    H    TYR  60           H        TYR  60   5.258  -2.877   6.155
  476    HA   TYR  60           HA       TYR  60   7.292  -4.691   6.422
  477   1HB   TYR  60          1HB       TYR  60   4.988  -5.268   5.760
  478   2HB   TYR  60          2HB       TYR  60   5.287  -4.598   4.161
  479    HD1  TYR  60           1HD      TYR  60   6.221  -5.911   2.467
  480    HD2  TYR  60           2HD      TYR  60   6.385  -7.262   6.497
  481    HE1  TYR  60           1HE      TYR  60   7.045  -8.094   1.698
  482    HE2  TYR  60           2HE      TYR  60   7.207  -9.449   5.739
  483    HH   TYR  60           HH       TYR  60   7.162 -10.828   3.704
  484    H    ILE  61           H        ILE  61   6.779  -2.437   3.749
  485    HA   ILE  61           HA       ILE  61   8.876  -3.154   2.074
  486    HB   ILE  61           HB       ILE  61   8.104  -0.316   2.757
  487   1HG1  ILE  61          1HG1      ILE  61   6.912  -2.043   0.586
  488   2HG1  ILE  61          2HG1      ILE  61   6.157  -1.817   2.161
  489   1HG2  ILE  61          1HG2      ILE  61   8.836   0.181   0.487
  490   2HG2  ILE  61          2HG2      ILE  61   9.263  -1.512   0.244
  491   3HG2  ILE  61          3HG2      ILE  61  10.141  -0.543   1.427
  492   1HD1  ILE  61          1HD1      ILE  61   5.103  -0.291   0.743
  493   2HD1  ILE  61          2HD1      ILE  61   6.629   0.211   0.010
  494   3HD1  ILE  61          3HD1      ILE  61   6.257   0.668   1.675
  495    H    MET  62           H        MET  62   9.031  -0.484   4.423
  496    HA   MET  62           HA       MET  62  11.930  -0.921   4.599
  497   1HB   MET  62          1HB       MET  62  12.040   1.370   5.478
  498   2HB   MET  62          2HB       MET  62  11.249   1.308   3.908
  499   1HG   MET  62          1HG       MET  62   9.069   1.442   5.008
  500   2HG   MET  62          2HG       MET  62   9.871   1.530   6.575
  501   1HE   MET  62          1HE       MET  62  11.000   3.195   3.190
  502   2HE   MET  62          2HE       MET  62  10.226   4.774   3.313
  503   3HE   MET  62          3HE       MET  62   9.241   3.321   3.149
  504    H    THR  63           H        THR  63  10.391  -2.730   6.055
  505    HA   THR  63           HA       THR  63  11.310  -2.003   8.755
  506    HB   THR  63           HB       THR  63   8.792  -3.548   8.118
  507    HG1  THR  63           1HG      THR  63   9.317  -0.978   9.204
  508   1HG2  THR  63          1HG2      THR  63  10.050  -2.908  10.788
  509   2HG2  THR  63          2HG2      THR  63   9.945  -4.506  10.051
  510   3HG2  THR  63          3HG2      THR  63   8.476  -3.666  10.547
  511    H    LYS  64           H        LYS  64  10.614  -4.597   6.456
  512    HA   LYS  64           HA       LYS  64  12.046  -6.506   8.138
  513   1HB   LYS  64          2HB       LYS  64  10.512  -6.950   5.570
  514   2HB   LYS  64          1HB       LYS  64  11.181  -8.208   6.600
  515   1HG   LYS  64          2HG       LYS  64   9.070  -6.239   7.456
  516   2HG   LYS  64          1HG       LYS  64   8.750  -7.880   6.891
  517   1HD   LYS  64          1HD       LYS  64  10.584  -7.326   9.207
  518   2HD   LYS  64          2HD       LYS  64   8.840  -7.499   9.417
  519   1HE   LYS  64          1HE       LYS  64   9.843  -9.620   9.851
  520   2HE   LYS  64          2HE       LYS  64   8.998  -9.727   8.309
  521   1HZ   LYS  64          1HZ       LYS  64  11.060  -9.535   7.147
  522   2HZ   LYS  64          2HZ       LYS  64  11.227 -10.758   8.303
  523   3HZ   LYS  64          3HZ       LYS  64  11.912  -9.236   8.578
  524    H    ARG  65           H        ARG  65  13.306  -4.304   6.516
  525    HA   ARG  65           HA       ARG  65  15.184  -3.962   5.287
  526   1HB   ARG  65          1HB       ARG  65  16.093  -5.463   7.065
  527   2HB   ARG  65          2HB       ARG  65  15.818  -6.832   5.997
  528   1HG   ARG  65          2HG       ARG  65  17.372  -5.862   4.367
  529   2HG   ARG  65          1HG       ARG  65  17.662  -4.510   5.466
  530   1HD   ARG  65          2HD       ARG  65  19.434  -6.177   5.635
  531   2HD   ARG  65          1HD       ARG  65  18.533  -6.051   7.145
  532    HE   ARG  65           HE       ARG  65  17.390  -8.091   5.620
  533   1HH1  ARG  65          2HH1      ARG  65  20.371  -7.392   7.283
  534   2HH1  ARG  65          1HH1      ARG  65  20.723  -9.053   7.620
  535   1HH2  ARG  65          1HH2      ARG  65  17.846 -10.282   6.059
  536   2HH2  ARG  65          2HH2      ARG  65  19.288 -10.696   6.924
  537    H    LEU  66           H        LEU  66  13.408  -4.071   3.537
  538    HA   LEU  66           HA       LEU  66  14.201  -6.090   1.545
  539   1HB   LEU  66          2HB       LEU  66  11.531  -4.722   1.552
  540   2HB   LEU  66          1HB       LEU  66  12.000  -6.205   0.743
  541    HG   LEU  66           HG       LEU  66  11.719  -5.893   3.734
  542   1HD1  LEU  66          1HD1      LEU  66   9.567  -5.697   2.625
  543   2HD1  LEU  66          2HD1      LEU  66   9.693  -7.228   3.488
  544   3HD1  LEU  66          3HD1      LEU  66   9.876  -7.188   1.735
  545   1HD2  LEU  66          1HD2      LEU  66  12.113  -8.355   2.040
  546   2HD2  LEU  66          2HD2      LEU  66  11.911  -8.310   3.791
  547   3HD2  LEU  66          3HD2      LEU  66  13.342  -7.594   3.051
  548    H    TYR  67           H        TYR  67  14.129  -2.825   2.345
  549    HA   TYR  67           HA       TYR  67  13.777  -1.715  -0.265
  550   1HB   TYR  67          1HB       TYR  67  14.415   0.390   0.737
  551   2HB   TYR  67          2HB       TYR  67  13.334  -0.459   1.838
  552    HD1  TYR  67           1HD      TYR  67  14.233  -1.496   3.900
  553    HD2  TYR  67           2HD      TYR  67  16.671   0.874   1.344
  554    HE1  TYR  67           1HE      TYR  67  15.891  -1.267   5.702
  555    HE2  TYR  67           2HE      TYR  67  18.333   1.111   3.137
  556    HH   TYR  67           HH       TYR  67  18.288  -0.787   5.952
  557    H    ASP  68           H        ASP  68  15.699  -0.036  -0.858
  558    HA   ASP  68           HA       ASP  68  17.784  -1.679  -1.849
  559   1HB   ASP  68          2HB       ASP  68  17.150   0.210  -3.159
  560   2HB   ASP  68          1HB       ASP  68  17.389   1.321  -1.812
  561    H    GLU  69           H        GLU  69  18.747   1.339  -0.391
  562    HA   GLU  69           HA       GLU  69  19.790   0.522   2.037
  563   1HB   GLU  69          1HB       GLU  69  21.147  -1.071   0.739
  564   2HB   GLU  69          2HB       GLU  69  21.806   0.257  -0.207
  565   1HG   GLU  69          2HG       GLU  69  23.386  -0.461   1.476
  566   2HG   GLU  69          1HG       GLU  69  22.838   1.181   1.803
  567    H    LYS  70           H        LYS  70  20.113   2.469  -0.831
  568    HA   LYS  70           HA       LYS  70  21.155   4.690   0.802
  569   1HB   LYS  70          1HB       LYS  70  21.263   4.333  -2.200
  570   2HB   LYS  70          2HB       LYS  70  21.921   5.696  -1.306
  571   1HG   LYS  70          1HG       LYS  70  23.500   4.214  -0.187
  572   2HG   LYS  70          2HG       LYS  70  22.831   2.836  -1.064
  573   1HD   LYS  70          2HD       LYS  70  23.494   3.868  -3.185
  574   2HD   LYS  70          1HD       LYS  70  24.176   5.237  -2.303
  575   1HE   LYS  70          2HE       LYS  70  25.917   3.660  -2.955
  576   2HE   LYS  70          1HE       LYS  70  25.761   3.743  -1.201
  577   1HZ   LYS  70          1HZ       LYS  70  25.987   1.464  -1.952
  578   2HZ   LYS  70          2HZ       LYS  70  24.624   1.623  -2.941
  579   3HZ   LYS  70          3HZ       LYS  70  24.461   1.704  -1.259
  580    H    GLN  71           H        GLN  71  19.342   4.506  -2.257
  581    HA   GLN  71           HA       GLN  71  17.258   6.223  -1.168
  582   1HB   GLN  71          1HB       GLN  71  17.499   4.862  -3.860
  583   2HB   GLN  71          2HB       GLN  71  16.219   5.978  -3.401
  584   1HG   GLN  71          2HG       GLN  71  17.877   7.753  -3.113
  585   2HG   GLN  71          1HG       GLN  71  19.152   6.632  -3.591
  586   1HE2  GLN  71          2HE2      GLN  71  16.429   8.507  -4.657
  587   2HE2  GLN  71          1HE2      GLN  71  16.744   8.376  -6.352
  588    H    GLN  72           H        GLN  72  16.312   5.021   0.446
  589    HA   GLN  72           HA       GLN  72  15.832   2.279   0.405
  590   1HB   GLN  72          1HB       GLN  72  14.244   4.386   1.881
  591   2HB   GLN  72          2HB       GLN  72  14.315   2.673   2.276
  592   1HG   GLN  72          1HG       GLN  72  16.709   2.892   2.755
  593   2HG   GLN  72          2HG       GLN  72  16.614   4.614   2.387
  594   1HE2  GLN  72          2HE2      GLN  72  13.968   4.874   3.606
  595   2HE2  GLN  72          1HE2      GLN  72  14.227   4.847   5.313
  596    H    HIS  73           H        HIS  73  14.292   4.722  -1.349
  597    HA   HIS  73           HA       HIS  73  11.668   3.648  -1.491
  598   1HB   HIS  73          1HB       HIS  73  13.000   5.389  -3.569
  599   2HB   HIS  73          2HB       HIS  73  11.278   5.239  -3.235
  600    HD1  HIS  73           1HD      HIS  73  10.687   6.024  -0.607
  601    HD2  HIS  73           2HD      HIS  73  14.067   7.588  -2.445
  602    HE1  HIS  73           1HE      HIS  73  11.251   8.105   0.686
  603    HE2  HIS  73           2HE      HIS  73  13.354   8.984  -0.387
  604    H    ILE  74           H        ILE  74  14.592   2.524  -2.756
  605    HA   ILE  74           HA       ILE  74  13.263   1.183  -5.004
  606    HB   ILE  74           HB       ILE  74  16.177   0.894  -4.332
  607   1HG1  ILE  74          2HG1      ILE  74  15.798   3.290  -4.471
  608   2HG1  ILE  74          1HG1      ILE  74  16.624   2.740  -5.926
  609   1HG2  ILE  74          1HG2      ILE  74  14.610   0.686  -6.899
  610   2HG2  ILE  74          2HG2      ILE  74  15.251  -0.657  -5.951
  611   3HG2  ILE  74          3HG2      ILE  74  16.354   0.467  -6.745
  612   1HD1  ILE  74          1HD1      ILE  74  14.554   2.820  -7.169
  613   2HD1  ILE  74          2HD1      ILE  74  14.868   4.377  -6.403
  614   3HD1  ILE  74          3HD1      ILE  74  13.672   3.279  -5.712
  615    H    VAL  75           H        VAL  75  12.108  -0.483  -4.191
  616    HA   VAL  75           HA       VAL  75  13.174  -1.898  -1.871
  617    HB   VAL  75           HB       VAL  75  10.424  -2.289  -2.997
  618   1HG1  VAL  75          1HG1      VAL  75  11.127  -3.803  -1.243
  619   2HG1  VAL  75          2HG1      VAL  75   9.884  -2.710  -0.633
  620   3HG1  VAL  75          3HG1      VAL  75  11.575  -2.442  -0.215
  621   1HG2  VAL  75          1HG2      VAL  75   9.672  -0.452  -1.507
  622   2HG2  VAL  75          2HG2      VAL  75  10.656   0.089  -2.865
  623   3HG2  VAL  75          3HG2      VAL  75  11.362  -0.020  -1.253
  624    H    TYR  76           H        TYR  76  14.637  -3.313  -2.814
  625    HA   TYR  76           HA       TYR  76  14.055  -5.083  -4.920
  626   1HB   TYR  76          2HB       TYR  76  15.955  -5.621  -2.636
  627   2HB   TYR  76          1HB       TYR  76  16.039  -6.254  -4.278
  628    HD1  TYR  76           1HD      TYR  76  15.336  -3.528  -5.599
  629    HD2  TYR  76           2HD      TYR  76  18.176  -4.683  -2.646
  630    HE1  TYR  76           1HE      TYR  76  16.778  -1.645  -6.250
  631    HE2  TYR  76           2HE      TYR  76  19.624  -2.807  -3.296
  632    HH   TYR  76           HH       TYR  76  18.565  -0.270  -5.286
  633    H    CYS  77           H        CYS  77  12.666  -6.708  -4.997
  634    HA   CYS  77           HA       CYS  77  11.778  -7.898  -2.449
  635   1HB   CYS  77          2HB       CYS  77  10.138  -7.402  -4.945
  636   2HB   CYS  77          1HB       CYS  77   9.551  -8.166  -3.471
  637    HG   CYS  77           HG       CYS  77   8.841  -5.314  -4.008
  638    H    SER  78           H        SER  78  13.750  -9.276  -3.195
  639    HA   SER  78           HA       SER  78  13.032 -11.256  -5.214
  640   1HB   SER  78          2HB       SER  78  15.294 -10.306  -5.285
  641   2HB   SER  78          1HB       SER  78  15.597 -10.889  -3.648
  642    HG   SER  78           HG       SER  78  16.206 -12.671  -4.556
  643    H    ASN  79           H        ASN  79  12.577 -10.858  -1.961
  644    HA   ASN  79           HA       ASN  79  12.394 -13.768  -1.548
  645   1HB   ASN  79          2HB       ASN  79  14.311 -12.916  -0.285
  646   2HB   ASN  79          1HB       ASN  79  13.286 -11.710   0.485
  647   1HD2  ASN  79          2HD2      ASN  79  14.133 -15.071   0.319
  648   2HD2  ASN  79          1HD2      ASN  79  13.335 -15.552   1.774
  649    H    ASP  80           H        ASP  80  11.403 -10.701  -0.019
  650    HA   ASP  80           HA       ASP  80   9.047 -11.592   1.154
  651   1HB   ASP  80          1HB       ASP  80   8.331  -9.120   0.815
  652   2HB   ASP  80          2HB       ASP  80   9.732  -9.465   1.825
  653    H    LEU  81           H        LEU  81   9.773 -10.980  -2.159
  654    HA   LEU  81           HA       LEU  81   8.537 -10.591  -4.029
  655   1HB   LEU  81          2HB       LEU  81   6.582 -12.402  -2.607
  656   2HB   LEU  81          1HB       LEU  81   6.535 -12.000  -4.313
  657    HG   LEU  81           HG       LEU  81   8.738 -13.538  -2.931
  658   1HD1  LEU  81          1HD1      LEU  81   7.899 -15.445  -4.204
  659   2HD1  LEU  81          2HD1      LEU  81   6.588 -14.450  -4.837
  660   3HD1  LEU  81          3HD1      LEU  81   6.667 -14.813  -3.113
  661   1HD2  LEU  81          1HD2      LEU  81   9.591 -12.221  -4.788
  662   2HD2  LEU  81          2HD2      LEU  81   8.334 -12.868  -5.842
  663   3HD2  LEU  81          3HD2      LEU  81   9.579 -13.937  -5.197
  664    H    LEU  82           H        LEU  82   8.137  -8.914  -1.560
  665    HA   LEU  82           HA       LEU  82   6.742  -7.279  -0.731
  666   1HB   LEU  82          2HB       LEU  82   7.450  -6.534  -3.069
  667   2HB   LEU  82          1HB       LEU  82   5.863  -7.051  -3.589
  668    HG   LEU  82           HG       LEU  82   6.556  -4.535  -2.711
  669   1HD1  LEU  82          1HD2      LEU  82   4.072  -4.164  -2.688
  670   2HD1  LEU  82          2HD2      LEU  82   3.904  -5.894  -3.003
  671   3HD1  LEU  82          3HD2      LEU  82   4.750  -4.862  -4.157
  672   1HD2  LEU  82          1HD1      LEU  82   5.279  -4.156  -0.664
  673   2HD2  LEU  82          2HD1      LEU  82   6.640  -5.246  -0.394
  674   3HD2  LEU  82          3HD1      LEU  82   5.004  -5.893  -0.519
  675    H    GLY  83           H        GLY  83   5.695  -9.751  -0.381
  676   1HA   GLY  83          1HA       GLY  83   3.607  -9.884   0.826
  677   2HA   GLY  83          2HA       GLY  83   2.865  -8.989  -0.496
  678    H    ASP  84           H        ASP  84   4.984 -11.294  -1.748
  679    HA   ASP  84           HA       ASP  84   4.460 -12.923  -3.290
  680   1HB   ASP  84          2HB       ASP  84   1.783 -13.021  -1.891
  681   2HB   ASP  84          1HB       ASP  84   2.338 -14.155  -3.112
  682    H    LEU  85           H        LEU  85   3.332  -9.927  -3.029
  683    HA   LEU  85           HA       LEU  85   0.904 -10.213  -4.595
  684   1HB   LEU  85          2HB       LEU  85   0.103  -8.601  -3.290
  685   2HB   LEU  85          1HB       LEU  85   1.569  -8.762  -2.346
  686    HG   LEU  85           HG       LEU  85   2.512  -7.034  -4.084
  687   1HD1  LEU  85          1HD1      LEU  85   0.817  -5.464  -4.851
  688   2HD1  LEU  85          2HD1      LEU  85  -0.451  -6.482  -4.163
  689   3HD1  LEU  85          3HD1      LEU  85   0.521  -7.074  -5.509
  690   1HD2  LEU  85          1HD2      LEU  85   2.470  -6.502  -1.791
  691   2HD2  LEU  85          2HD2      LEU  85   0.706  -6.458  -1.753
  692   3HD2  LEU  85          3HD2      LEU  85   1.601  -5.194  -2.597
  693    H    PHE  86           H        PHE  86   4.044  -8.701  -4.768
  694    HA   PHE  86           HA       PHE  86   3.360  -7.666  -7.438
  695   1HB   PHE  86          1HB       PHE  86   4.545  -6.348  -5.111
  696   2HB   PHE  86          2HB       PHE  86   5.487  -6.128  -6.580
  697    HD1  PHE  86           1HD      PHE  86   4.811  -3.684  -5.880
  698    HD2  PHE  86           2HD      PHE  86   2.122  -6.577  -7.471
  699    HE1  PHE  86           1HE      PHE  86   3.292  -1.873  -6.589
  700    HE2  PHE  86           2HE      PHE  86   0.602  -4.780  -8.178
  701    HZ   PHE  86           HZ       PHE  86   1.186  -2.431  -7.738
  702    H    GLY  87           H        GLY  87   5.657  -9.315  -5.421
  703   1HA   GLY  87          1HA       GLY  87   7.506 -10.580  -5.908
  704   2HA   GLY  87          2HA       GLY  87   6.770 -10.805  -7.487
  705    H    VAL  88           H        VAL  88   7.410  -7.560  -6.627
  706    HA   VAL  88           HA       VAL  88   8.757  -6.899  -8.872
  707    HB   VAL  88           HB       VAL  88   9.820  -5.447  -6.567
  708   1HG1  VAL  88          1HG1      VAL  88   8.944  -3.556  -7.856
  709   2HG1  VAL  88          2HG1      VAL  88   8.180  -4.697  -8.965
  710   3HG1  VAL  88          3HG1      VAL  88   9.941  -4.640  -8.831
  711   1HG2  VAL  88          1HG2      VAL  88   6.834  -5.655  -6.928
  712   2HG2  VAL  88          2HG2      VAL  88   7.643  -4.378  -6.018
  713   3HG2  VAL  88          3HG2      VAL  88   7.767  -6.058  -5.484
  714    HA   PRO  89           HA       PRO  89  13.184  -7.717  -8.041
  715   1HB   PRO  89          1HB       PRO  89  14.143  -5.937  -9.830
  716   2HB   PRO  89          2HB       PRO  89  13.614  -7.556 -10.304
  717   1HG   PRO  89          1HG       PRO  89  12.163  -4.946 -10.516
  718   2HG   PRO  89          2HG       PRO  89  12.261  -6.271 -11.691
  719   1HD   PRO  89          1HD       PRO  89  10.125  -5.883 -10.039
  720   2HD   PRO  89          2HD       PRO  89  10.607  -7.477 -10.652
  721    H    SER  90           H        SER  90  11.537  -4.627  -8.480
  722    HA   SER  90           HA       SER  90  12.203  -3.675  -5.919
  723   1HB   SER  90          2HB       SER  90  13.645  -1.753  -6.609
  724   2HB   SER  90          1HB       SER  90  14.433  -3.325  -6.756
  725    HG   SER  90           HG       SER  90  13.993  -3.267  -8.985
  726    H    PHE  91           H        PHE  91  10.809  -2.037  -5.372
  727    HA   PHE  91           HA       PHE  91   9.468  -0.683  -7.618
  728   1HB   PHE  91          1HB       PHE  91   7.361  -0.710  -6.507
  729   2HB   PHE  91          2HB       PHE  91   7.980  -2.354  -6.512
  730    HD1  PHE  91           1HD      PHE  91   7.531   0.640  -4.360
  731    HD2  PHE  91           2HD      PHE  91   8.245  -3.549  -4.533
  732    HE1  PHE  91           1HE      PHE  91   7.135   0.479  -1.944
  733    HE2  PHE  91           2HE      PHE  91   7.842  -3.717  -2.118
  734    HZ   PHE  91           HZ       PHE  91   7.296  -1.703  -0.819
  735    H    SER  92           H        SER  92   8.904   1.475  -7.365
  736    HA   SER  92           HA       SER  92  10.438   2.884  -5.329
  737   1HB   SER  92          2HB       SER  92   9.780   4.924  -6.640
  738   2HB   SER  92          1HB       SER  92  10.694   3.735  -7.568
  739    HG   SER  92           HG       SER  92   8.239   3.037  -7.919
  740    H    VAL  93           H        VAL  93   9.228   2.500  -3.475
  741    HA   VAL  93           HA       VAL  93   6.483   2.869  -3.157
  742    HB   VAL  93           HB       VAL  93   8.018   1.866  -1.455
  743   1HG1  VAL  93          1HG1      VAL  93   9.160   3.367   0.112
  744   2HG1  VAL  93          2HG1      VAL  93   8.702   4.745  -0.888
  745   3HG1  VAL  93          3HG1      VAL  93   9.796   3.517  -1.525
  746   1HG2  VAL  93          1HG2      VAL  93   6.242   4.102  -0.480
  747   2HG2  VAL  93          2HG2      VAL  93   6.806   2.740   0.488
  748   3HG2  VAL  93          3HG2      VAL  93   5.728   2.462  -0.880
  749    H    LYS  94           H        LYS  94   9.122   5.177  -3.225
  750    HA   LYS  94           HA       LYS  94   7.901   7.452  -2.222
  751   1HB   LYS  94          2HB       LYS  94  10.282   7.290  -2.898
  752   2HB   LYS  94          1HB       LYS  94   9.785   7.297  -4.585
  753   1HG   LYS  94          2HG       LYS  94   8.833   9.532  -4.287
  754   2HG   LYS  94          1HG       LYS  94   9.363   9.524  -2.604
  755   1HD   LYS  94          1HD       LYS  94  11.689   9.310  -3.338
  756   2HD   LYS  94          2HD       LYS  94  11.157   9.327  -5.021
  757   1HE   LYS  94          1HE       LYS  94  10.790  11.555  -3.022
  758   2HE   LYS  94          2HE       LYS  94  11.973  11.522  -4.329
  759   1HZ   LYS  94          1HZ       LYS  94  10.029  12.827  -4.919
  760   2HZ   LYS  94          2HZ       LYS  94   9.024  11.488  -4.675
  761   3HZ   LYS  94          3HZ       LYS  94  10.164  11.472  -5.924
  762    H    GLU  95           H        GLU  95   7.480   5.853  -5.294
  763    HA   GLU  95           HA       GLU  95   5.672   7.918  -6.265
  764   1HB   GLU  95          2HB       GLU  95   6.418   5.248  -7.476
  765   2HB   GLU  95          1HB       GLU  95   5.476   6.507  -8.264
  766   1HG   GLU  95          1HG       GLU  95   8.349   6.731  -7.394
  767   2HG   GLU  95          2HG       GLU  95   7.778   6.492  -9.045
  768    H    HIS  96           H        HIS  96   4.483   7.333  -4.101
  769    HA   HIS  96           HA       HIS  96   3.058   4.959  -3.806
  770   1HB   HIS  96          2HB       HIS  96   2.294   7.742  -2.896
  771   2HB   HIS  96          1HB       HIS  96   1.549   6.255  -2.321
  772    HD1  HIS  96           1HD      HIS  96   4.540   8.400  -1.901
  773    HD2  HIS  96           2HD      HIS  96   3.183   4.693  -0.606
  774    HE1  HIS  96           1HE      HIS  96   6.046   7.762   0.009
  775    HE2  HIS  96           2HE      HIS  96   5.149   5.558   0.835
  776    H    ARG  97           H        ARG  97   2.451   7.702  -5.844
  777    HA   ARG  97           HA       ARG  97  -0.272   7.408  -6.344
  778   1HB   ARG  97          1HB       ARG  97   1.056   9.318  -7.138
  779   2HB   ARG  97          2HB       ARG  97   1.895   8.267  -8.271
  780   1HG   ARG  97          1HG       ARG  97  -0.199   7.845  -9.446
  781   2HG   ARG  97          2HG       ARG  97  -1.053   8.882  -8.300
  782   1HD   ARG  97          1HD       ARG  97  -0.575  10.086 -10.357
  783   2HD   ARG  97          2HD       ARG  97   0.315  10.783  -9.004
  784    HE   ARG  97           HE       ARG  97   1.987   8.927 -10.218
  785   1HH1  ARG  97          2HH1      ARG  97   0.420  11.932 -11.030
  786   2HH1  ARG  97          1HH1      ARG  97   1.646  12.417 -12.152
  787   1HH2  ARG  97          1HH2      ARG  97   3.607   9.558 -11.694
  788   2HH2  ARG  97          2HH2      ARG  97   3.457  11.068 -12.529
  789    H    LYS  98           H        LYS  98   2.353   6.236  -8.463
  790    HA   LYS  98           HA       LYS  98   0.617   4.517  -9.912
  791   1HB   LYS  98          2HB       LYS  98   3.636   4.545  -9.772
  792   2HB   LYS  98          1HB       LYS  98   2.682   3.666 -10.960
  793   1HG   LYS  98          2HG       LYS  98   2.689   6.659 -10.621
  794   2HG   LYS  98          1HG       LYS  98   3.604   5.767 -11.838
  795   1HD   LYS  98          1HD       LYS  98   1.517   4.901 -12.776
  796   2HD   LYS  98          2HD       LYS  98   0.599   5.785 -11.554
  797   1HE   LYS  98          2HE       LYS  98   1.474   7.896 -12.428
  798   2HE   LYS  98          1HE       LYS  98   2.388   7.012 -13.650
  799   1HZ   LYS  98          1HZ       LYS  98   0.299   6.193 -14.558
  800   2HZ   LYS  98          2HZ       LYS  98   0.334   7.884 -14.557
  801   3HZ   LYS  98          3HZ       LYS  98  -0.571   7.057 -13.392
  802    H    ILE  99           H        ILE  99   3.044   3.958  -7.407
  803    HA   ILE  99           HA       ILE  99   3.168   1.203  -7.496
  804    HB   ILE  99           HB       ILE  99   4.423   3.046  -6.015
  805   1HG1  ILE  99          1HG1      ILE  99   5.073   0.659  -6.521
  806   2HG1  ILE  99          2HG1      ILE  99   5.593   1.261  -4.949
  807   1HG2  ILE  99          1HG2      ILE  99   3.937   2.781  -3.656
  808   2HG2  ILE  99          2HG2      ILE  99   2.577   1.725  -4.041
  809   3HG2  ILE  99          3HG2      ILE  99   2.537   3.423  -4.516
  810   1HD1  ILE  99          1HD1      ILE  99   3.204  -0.499  -5.446
  811   2HD1  ILE  99          2HD1      ILE  99   3.766   0.079  -3.876
  812   3HD1  ILE  99          3HD1      ILE  99   4.767  -1.024  -4.821
  813    H    TYR 100           H        TYR 100   0.763   3.236  -5.926
  814    HA   TYR 100           HA       TYR 100  -0.517   0.928  -4.715
  815   1HB   TYR 100          2HB       TYR 100  -0.844   3.880  -4.509
  816   2HB   TYR 100          1HB       TYR 100  -2.232   2.865  -4.120
  817    HD1  TYR 100           1HD      TYR 100   0.997   1.399  -3.519
  818    HD2  TYR 100           2HD      TYR 100  -2.044   3.831  -1.799
  819    HE1  TYR 100           1HE      TYR 100   1.918   0.967  -1.289
  820    HE2  TYR 100           2HE      TYR 100  -1.122   3.409   0.441
  821    HH   TYR 100           HH       TYR 100   0.266   1.689   1.568
  822    H    THR 101           H        THR 101  -0.941   3.043  -7.466
  823    HA   THR 101           HA       THR 101  -3.625   2.201  -8.027
  824    HB   THR 101           HB       THR 101  -3.196   3.269 -10.283
  825    HG1  THR 101           1HG      THR 101  -1.282   4.414 -10.523
  826   1HG2  THR 101          1HG2      THR 101  -4.256   4.492  -8.449
  827   2HG2  THR 101          2HG2      THR 101  -3.209   5.552  -9.391
  828   3HG2  THR 101          3HG2      THR 101  -2.670   4.944  -7.825
  829    H    MET 102           H        MET 102  -0.615   0.733  -8.398
  830    HA   MET 102           HA       MET 102  -1.694  -1.067 -10.456
  831   1HB   MET 102          2HB       MET 102   0.637  -1.896 -10.704
  832   2HB   MET 102          1HB       MET 102   0.445  -0.197 -11.110
  833   1HG   MET 102          1HG       MET 102   1.483   0.494  -9.104
  834   2HG   MET 102          2HG       MET 102   1.418  -1.132  -8.430
  835   1HE   MET 102          1HE       MET 102   5.248  -0.697  -8.842
  836   2HE   MET 102          2HE       MET 102   3.884  -0.864  -7.735
  837   3HE   MET 102          3HE       MET 102   4.185   0.676  -8.538
  838    H    ILE 103           H        ILE 103  -0.635  -0.876  -7.132
  839    HA   ILE 103           HA       ILE 103  -0.774  -3.598  -6.458
  840    HB   ILE 103           HB       ILE 103  -1.465  -1.109  -4.916
  841   1HG1  ILE 103          2HG1      ILE 103   0.701  -3.196  -4.581
  842   2HG1  ILE 103          1HG1      ILE 103   0.912  -1.632  -5.358
  843   1HG2  ILE 103          1HG2      ILE 103  -1.736  -2.498  -2.910
  844   2HG2  ILE 103          2HG2      ILE 103  -1.622  -3.949  -3.907
  845   3HG2  ILE 103          3HG2      ILE 103  -2.976  -2.839  -4.117
  846   1HD1  ILE 103          1HD1      ILE 103   0.385  -0.524  -3.244
  847   2HD1  ILE 103          2HD1      ILE 103   1.776  -1.597  -3.101
  848   3HD1  ILE 103          3HD1      ILE 103   0.206  -2.098  -2.472
  849    H    TYR 104           H        TYR 104  -3.340  -1.152  -6.723
  850    HA   TYR 104           HA       TYR 104  -5.361  -3.237  -6.380
  851   1HB   TYR 104          1HB       TYR 104  -5.605  -0.227  -6.530
  852   2HB   TYR 104          2HB       TYR 104  -6.964  -1.327  -6.323
  853    HD1  TYR 104           1HD      TYR 104  -4.073   0.216  -4.708
  854    HD2  TYR 104           2HD      TYR 104  -7.296  -2.516  -4.219
  855    HE1  TYR 104           1HE      TYR 104  -3.740   0.269  -2.272
  856    HE2  TYR 104           2HE      TYR 104  -6.975  -2.470  -1.782
  857    HH   TYR 104           HH       TYR 104  -5.185  -1.965  -0.171
  858    H    ARG 105           H        ARG 105  -5.987  -4.280  -8.139
  859    HA   ARG 105           HA       ARG 105  -5.667  -3.179 -10.774
  860   1HB   ARG 105          1HB       ARG 105  -5.390  -5.613 -10.192
  861   2HB   ARG 105          2HB       ARG 105  -7.132  -5.699  -9.971
  862   1HG   ARG 105          1HG       ARG 105  -6.193  -4.610 -12.548
  863   2HG   ARG 105          2HG       ARG 105  -5.902  -6.326 -12.259
  864   1HD   ARG 105          1HD       ARG 105  -8.276  -6.652 -11.783
  865   2HD   ARG 105          2HD       ARG 105  -8.571  -4.935 -12.055
  866    HE   ARG 105           HE       ARG 105  -7.332  -6.201 -14.298
  867   1HH1  ARG 105          2HH1      ARG 105 -10.377  -5.659 -12.693
  868   2HH1  ARG 105          1HH1      ARG 105 -11.318  -5.859 -14.133
  869   1HH2  ARG 105          1HH2      ARG 105  -8.564  -6.467 -16.199
  870   2HH2  ARG 105          2HH2      ARG 105 -10.288  -6.320 -16.126
  871    H    ASN 106           H        ASN 106  -8.006  -2.929  -8.388
  872    HA   ASN 106           HA       ASN 106 -10.075  -1.997  -8.304
  873   1HB   ASN 106          1HB       ASN 106  -8.890  -0.395  -9.960
  874   2HB   ASN 106          2HB       ASN 106  -9.829  -1.218 -11.201
  875   1HD2  ASN 106          2HD2      ASN 106 -12.098  -1.639  -9.375
  876   2HD2  ASN 106          1HD2      ASN 106 -12.877  -0.104  -9.244
  877    H    LEU 107           H        LEU 107 -10.273  -4.566  -8.459
  878    HA   LEU 107           HA       LEU 107 -12.372  -5.067 -10.464
  879   1HB   LEU 107          1HB       LEU 107 -10.350  -6.330 -11.020
  880   2HB   LEU 107          2HB       LEU 107 -10.334  -7.032  -9.415
  881    HG   LEU 107           HG       LEU 107 -12.457  -8.182  -9.898
  882   1HD1  LEU 107          1HD2      LEU 107 -13.391  -6.602 -11.494
  883   2HD1  LEU 107          2HD2      LEU 107 -13.322  -8.223 -12.188
  884   3HD1  LEU 107          3HD2      LEU 107 -12.129  -7.010 -12.657
  885   1HD2  LEU 107          1HD1      LEU 107 -11.566  -9.805 -11.493
  886   2HD2  LEU 107          2HD1      LEU 107 -10.347  -9.324 -10.314
  887   3HD2  LEU 107          3HD1      LEU 107 -10.300  -8.665 -11.948
  888    H    VAL 108           H        VAL 108 -11.064  -6.292  -7.379
  889    HA   VAL 108           HA       VAL 108 -13.822  -6.849  -6.520
  890    HB   VAL 108           HB       VAL 108 -11.271  -7.892  -5.281
  891   1HG1  VAL 108          1HG1      VAL 108 -12.760  -9.491  -4.174
  892   2HG1  VAL 108          2HG1      VAL 108 -14.154  -8.710  -4.922
  893   3HG1  VAL 108          3HG1      VAL 108 -13.168  -7.827  -3.754
  894   1HG2  VAL 108          1HG2      VAL 108 -13.139  -9.234  -7.233
  895   2HG2  VAL 108          2HG2      VAL 108 -11.809 -10.022  -6.384
  896   3HG2  VAL 108          3HG2      VAL 108 -11.476  -8.738  -7.547
  897    H    VAL 109           H        VAL 109 -14.168  -4.603  -6.013
  898    HA   VAL 109           HA       VAL 109 -13.120  -3.901  -3.368
  899    HB   VAL 109           HB       VAL 109 -12.871  -1.538  -4.043
  900   1HG1  VAL 109          1HG1      VAL 109 -10.774  -1.802  -5.284
  901   2HG1  VAL 109          2HG1      VAL 109 -11.208  -3.471  -5.655
  902   3HG1  VAL 109          3HG1      VAL 109 -10.913  -2.986  -3.985
  903   1HG2  VAL 109          1HG2      VAL 109 -12.796  -0.955  -6.424
  904   2HG2  VAL 109          2HG2      VAL 109 -14.395  -1.523  -5.941
  905   3HG2  VAL 109          3HG2      VAL 109 -13.314  -2.590  -6.836
  906    H    VAL 110           H        VAL 110 -14.376  -1.897  -2.524
  907    HA   VAL 110           HA       VAL 110 -17.220  -2.420  -2.995
  908    HB   VAL 110           HB       VAL 110 -16.453  -2.615  -0.678
  909   1HG1  VAL 110          1HG1      VAL 110 -15.756   0.304  -0.947
  910   2HG1  VAL 110          2HG1      VAL 110 -14.616  -1.029  -0.759
  911   3HG1  VAL 110          3HG1      VAL 110 -15.724  -0.625   0.552
  912   1HG2  VAL 110          1HG2      VAL 110 -18.751  -1.938  -1.091
  913   2HG2  VAL 110          2HG2      VAL 110 -18.260  -0.246  -1.151
  914   3HG2  VAL 110          3HG2      VAL 110 -18.127  -1.149   0.358
  915    H    ASN 111           H        ASN 111 -18.675  -0.803  -3.509
  916    HA   ASN 111           HA       ASN 111 -17.452   1.721  -4.413
  917   1HB   ASN 111          1HB       ASN 111 -19.797   0.238  -5.621
  918   2HB   ASN 111          2HB       ASN 111 -19.155   1.777  -6.192
  919   1HD2  ASN 111          2HD2      ASN 111 -18.626  -1.646  -5.963
  920   2HD2  ASN 111          1HD2      ASN 111 -17.334  -1.728  -7.108
  921    H    GLN 112           H        GLN 112 -20.199   0.211  -2.852
  922    HA   GLN 112           HA       GLN 112 -21.921   1.023  -1.611
  923   1HB   GLN 112          1HB       GLN 112 -19.961   3.291  -1.243
  924   2HB   GLN 112          2HB       GLN 112 -21.469   3.151  -0.351
  925   1HG   GLN 112          1HG       GLN 112 -19.235   1.135  -0.312
  926   2HG   GLN 112          2HG       GLN 112 -19.538   2.352   0.927
  927   1HE2  GLN 112          1HE2      GLN 112 -19.496  -0.549   1.151
  928   2HE2  GLN 112          2HE2      GLN 112 -21.046  -1.008   1.760
  929    H    GLN 113           H        GLN 113 -21.593   1.789  -4.527
  930    HA   GLN 113           HA       GLN 113 -23.805   3.672  -4.588
  931   1HB   GLN 113          2HB       GLN 113 -22.683   5.156  -6.210
  932   2HB   GLN 113          1HB       GLN 113 -21.887   5.163  -4.642
  933   1HG   GLN 113          1HG       GLN 113 -20.179   3.647  -5.495
  934   2HG   GLN 113          2HG       GLN 113 -20.979   3.627  -7.066
  935   1HE2  GLN 113          2HE2      GLN 113 -19.082   5.497  -4.836
  936   2HE2  GLN 113          1HE2      GLN 113 -18.630   6.740  -5.947
  937    H    GLU 114           H        GLU 114 -25.005   3.604  -6.502
  938    HA   GLU 114           HA       GLU 114 -25.042   1.143  -7.857
  939   1HB   GLU 114          1HB       GLU 114 -26.311   3.771  -8.647
  940   2HB   GLU 114          2HB       GLU 114 -26.716   2.202  -9.329
  941   1HG   GLU 114          1HG       GLU 114 -27.476   1.443  -7.137
  942   2HG   GLU 114          2HG       GLU 114 -27.071   3.017  -6.453
  943    H    SER 115           H        SER 115 -23.359   0.519  -9.068
  944    HA   SER 115           HA       SER 115 -21.625   2.215 -10.473
  945   1HB   SER 115          2HB       SER 115 -21.000  -0.064  -9.836
  946   2HB   SER 115          1HB       SER 115 -22.209  -0.719 -10.939
  947    HG   SER 115           HG       SER 115 -19.898   0.776 -11.617
  948    H    SER 116           H        SER 116 -22.302   3.551 -12.025
  949    HA   SER 116           HA       SER 116 -23.790   2.389 -14.277
  950   1HB   SER 116          1HB       SER 116 -24.318   5.092 -13.021
  951   2HB   SER 116          2HB       SER 116 -25.078   4.489 -14.493
  952    HG   SER 116           HG       SER 116 -25.635   3.920 -11.877
  953    H    ASP 117           H        ASP 117 -20.927   3.265 -13.572
  954    HA   ASP 117           HA       ASP 117 -20.517   4.901 -15.988
  955   1HB   ASP 117          1HB       ASP 117 -18.580   5.942 -14.874
  956   2HB   ASP 117          2HB       ASP 117 -20.077   6.253 -14.000
  957    H    SER 118           H        SER 118 -18.021   4.778 -16.555
  958    HA   SER 118           HA       SER 118 -16.444   3.489 -17.571
  959   1HB   SER 118          1HB       SER 118 -15.284   1.909 -16.127
  960   2HB   SER 118          2HB       SER 118 -15.714   3.349 -15.203
  961    HG   SER 118           HG       SER 118 -16.182   1.370 -14.103
  962    H    SER 119           H        SER 119 -15.860   0.786 -17.530
  963    HA   SER 119           HA       SER 119 -18.064  -0.242 -19.125
  964   1HB   SER 119          1HB       SER 119 -15.797  -0.395 -20.039
  965   2HB   SER 119          2HB       SER 119 -15.285  -1.349 -18.646
  966    HG   SER 119           HG       SER 119 -17.493  -2.305 -20.009
  Start of MODEL   19
    1   1H    MET   1          1H        MET   1 -16.756  11.766 -26.205
    2   2H    MET   1          2H        MET   1 -17.371  12.942 -25.157
    3   3H    MET   1          3H        MET   1 -18.415  12.097 -26.185
    4    HA   MET   1           HA       MET   1 -18.584  11.282 -23.928
    5   1HB   MET   1          2HB       MET   1 -17.242   9.341 -25.822
    6   2HB   MET   1          1HB       MET   1 -18.203   8.896 -24.418
    7   1HG   MET   1          2HG       MET   1 -20.166   9.936 -25.432
    8   2HG   MET   1          1HG       MET   1 -19.203  10.378 -26.839
    9   1HE   MET   1          1HE       MET   1 -20.983   9.201 -28.426
   10   2HE   MET   1          2HE       MET   1 -21.947   8.753 -27.019
   11   3HE   MET   1          3HE       MET   1 -21.523   7.534 -28.221
   12    H    CYS   2           H        CYS   2 -17.344  12.027 -22.286
   13    HA   CYS   2           HA       CYS   2 -15.533  12.332 -20.914
   14   1HB   CYS   2          2HB       CYS   2 -14.716  10.249 -19.959
   15   2HB   CYS   2          1HB       CYS   2 -16.453  10.152 -20.222
   16    HG   CYS   2           HG       CYS   2 -16.345   8.475 -22.381
   17    H    ASN   3           H        ASN   3 -14.791  12.997 -23.485
   18    HA   ASN   3           HA       ASN   3 -11.959  12.253 -23.437
   19   1HB   ASN   3          2HB       ASN   3 -12.992  10.830 -25.144
   20   2HB   ASN   3          1HB       ASN   3 -13.683  12.249 -25.926
   21   1HD2  ASN   3          2HD2      ASN   3 -10.786  10.439 -25.307
   22   2HD2  ASN   3          1HD2      ASN   3  -9.802  11.219 -26.494
   23    H    THR   4           H        THR   4 -14.488  14.460 -24.453
   24    HA   THR   4           HA       THR   4 -12.537  16.497 -25.200
   25    HB   THR   4           HB       THR   4 -14.490  17.849 -25.863
   26    HG1  THR   4           1HG      THR   4 -15.911  15.615 -24.826
   27   1HG2  THR   4          1HG2      THR   4 -14.542  15.025 -26.936
   28   2HG2  THR   4          2HG2      THR   4 -13.493  16.328 -27.494
   29   3HG2  THR   4          3HG2      THR   4 -15.235  16.438 -27.729
   30    H    ASN   5           H        ASN   5 -15.144  15.992 -22.845
   31    HA   ASN   5           HA       ASN   5 -14.589  18.472 -21.486
   32   1HB   ASN   5          2HB       ASN   5 -16.357  16.146 -20.701
   33   2HB   ASN   5          1HB       ASN   5 -16.302  17.704 -19.880
   34   1HD2  ASN   5          2HD2      ASN   5 -17.297  15.999 -22.735
   35   2HD2  ASN   5          1HD2      ASN   5 -18.332  17.234 -23.357
   36    H    MET   6           H        MET   6 -13.849  15.066 -21.049
   37    HA   MET   6           HA       MET   6 -12.464  15.615 -18.539
   38   1HB   MET   6          1HB       MET   6 -12.883  13.008 -20.016
   39   2HB   MET   6          2HB       MET   6 -12.150  13.176 -18.426
   40   1HG   MET   6          2HG       MET   6 -14.985  13.884 -19.148
   41   2HG   MET   6          1HG       MET   6 -14.463  12.444 -18.274
   42   1HE   MET   6          1HE       MET   6 -16.721  14.432 -17.208
   43   2HE   MET   6          2HE       MET   6 -16.277  14.546 -15.505
   44   3HE   MET   6          3HE       MET   6 -16.199  12.991 -16.336
   45    H    SER   7           H        SER   7 -10.934  17.018 -19.755
   46    HA   SER   7           HA       SER   7  -8.975  15.559 -21.364
   47   1HB   SER   7          1HB       SER   7  -8.087  17.796 -21.926
   48   2HB   SER   7          2HB       SER   7  -9.809  17.667 -22.288
   49    HG   SER   7           HG       SER   7 -10.088  18.630 -20.108
   50    H    VAL   8           H        VAL   8  -9.003  14.907 -18.649
   51    HA   VAL   8           HA       VAL   8  -6.909  16.374 -17.312
   52    HB   VAL   8           HB       VAL   8  -7.111  14.543 -15.587
   53   1HG1  VAL   8          1HG1      VAL   8  -9.636  16.016 -16.333
   54   2HG1  VAL   8          2HG1      VAL   8  -8.298  16.668 -15.386
   55   3HG1  VAL   8          3HG1      VAL   8  -9.265  15.337 -14.748
   56   1HG2  VAL   8          1HG2      VAL   8  -9.076  13.078 -15.731
   57   2HG2  VAL   8          2HG2      VAL   8  -7.925  12.763 -17.031
   58   3HG2  VAL   8          3HG2      VAL   8  -9.396  13.680 -17.356
   59    HA   PRO   9           HA       PRO   9  -3.787  13.846 -19.327
   60   1HB   PRO   9          2HB       PRO   9  -1.654  15.267 -18.504
   61   2HB   PRO   9          1HB       PRO   9  -2.728  15.847 -19.782
   62   1HG   PRO   9          2HG       PRO   9  -2.652  16.594 -16.882
   63   2HG   PRO   9          1HG       PRO   9  -2.843  17.641 -18.302
   64   1HD   PRO   9          2HD       PRO   9  -4.931  16.816 -16.748
   65   2HD   PRO   9          1HD       PRO   9  -5.089  17.202 -18.473
   66    H    THR  10           H        THR  10  -3.945  14.720 -15.944
   67    HA   THR  10           HA       THR  10  -3.181  13.750 -14.034
   68    HB   THR  10           HB       THR  10  -3.366  11.336 -13.873
   69    HG1  THR  10           1HG      THR  10  -4.023  10.314 -16.029
   70   1HG2  THR  10          1HG2      THR  10  -5.440  12.637 -13.912
   71   2HG2  THR  10          2HG2      THR  10  -5.668  11.051 -14.653
   72   3HG2  THR  10          3HG2      THR  10  -5.506  12.484 -15.668
   73    H    ASP  11           H        ASP  11  -1.579  11.658 -13.406
   74    HA   ASP  11           HA       ASP  11   0.611  11.132 -13.092
   75   1HB   ASP  11          2HB       ASP  11   0.737  11.636 -16.074
   76   2HB   ASP  11          1HB       ASP  11   1.980  10.818 -15.132
   77    H    GLY  12           H        GLY  12  -0.244  13.952 -12.873
   78   1HA   GLY  12          2HA       GLY  12   2.286  15.316 -13.517
   79   2HA   GLY  12          1HA       GLY  12   0.755  16.120 -13.209
   80    H    ALA  13           H        ALA  13   3.227  16.749 -11.954
   81    HA   ALA  13           HA       ALA  13   2.393  16.623  -9.208
   82   1HB   ALA  13          1HB       ALA  13   4.963  15.248  -9.982
   83   2HB   ALA  13          2HB       ALA  13   3.493  14.448  -9.423
   84   3HB   ALA  13          3HB       ALA  13   4.383  15.519  -8.339
   85    H    VAL  14           H        VAL  14   3.022  18.409  -8.171
   86    HA   VAL  14           HA       VAL  14   5.036  20.117  -9.460
   87    HB   VAL  14           HB       VAL  14   2.990  20.859  -7.362
   88   1HG1  VAL  14          1HG1      VAL  14   4.964  22.275  -7.279
   89   2HG1  VAL  14          2HG1      VAL  14   3.590  23.171  -7.927
   90   3HG1  VAL  14          3HG1      VAL  14   4.845  22.572  -9.013
   91   1HG2  VAL  14          1HG2      VAL  14   2.992  21.365 -10.335
   92   2HG2  VAL  14          2HG2      VAL  14   1.819  22.003  -9.183
   93   3HG2  VAL  14          3HG2      VAL  14   1.922  20.266  -9.467
   94    H    THR  15           H        THR  15   3.974  19.156  -6.194
   95    HA   THR  15           HA       THR  15   6.795  19.225  -5.354
   96    HB   THR  15           HB       THR  15   4.448  20.125  -3.668
   97    HG1  THR  15           1HG      THR  15   6.592  21.661  -4.751
   98   1HG2  THR  15          1HG2      THR  15   6.228  19.073  -2.355
   99   2HG2  THR  15          2HG2      THR  15   6.163  20.810  -2.055
  100   3HG2  THR  15          3HG2      THR  15   7.417  20.142  -3.100
  101    H    THR  16           H        THR  16   7.404  17.237  -4.855
  102    HA   THR  16           HA       THR  16   7.346  15.028  -4.304
  103    HB   THR  16           HB       THR  16   6.364  14.451  -2.164
  104    HG1  THR  16           1HG      THR  16   4.377  15.617  -2.431
  105   1HG2  THR  16          1HG2      THR  16   7.520  17.241  -2.125
  106   2HG2  THR  16          2HG2      THR  16   8.441  15.738  -2.128
  107   3HG2  THR  16          3HG2      THR  16   7.426  16.148  -0.746
  108    H    SER  17           H        SER  17   5.472  13.298  -3.359
  109    HA   SER  17           HA       SER  17   2.972  13.514  -4.715
  110   1HB   SER  17          2HB       SER  17   3.337  11.706  -6.356
  111   2HB   SER  17          1HB       SER  17   4.379  13.093  -6.674
  112    HG   SER  17           HG       SER  17   5.210  10.826  -5.191
  113    H    GLN  18           H        GLN  18   1.525  11.940  -4.092
  114    HA   GLN  18           HA       GLN  18   2.385   9.508  -2.813
  115   1HB   GLN  18          1HB       GLN  18   1.039  10.008  -0.747
  116   2HB   GLN  18          2HB       GLN  18   2.581  10.843  -0.870
  117   1HG   GLN  18          2HG       GLN  18   1.390  12.847  -1.661
  118   2HG   GLN  18          1HG       GLN  18  -0.137  11.972  -1.503
  119   1HE2  GLN  18          2HE2      GLN  18  -0.947  13.443  -0.017
  120   2HE2  GLN  18          1HE2      GLN  18  -0.378  13.523   1.612
  121    H    ILE  19           H        ILE  19   0.059   8.984  -1.390
  122    HA   ILE  19           HA       ILE  19  -2.156   9.924  -2.968
  123    HB   ILE  19           HB       ILE  19  -3.155   7.846  -3.423
  124   1HG1  ILE  19          1HG1      ILE  19  -2.728   6.819  -1.201
  125   2HG1  ILE  19          2HG1      ILE  19  -2.391   5.710  -2.526
  126   1HG2  ILE  19          1HG2      ILE  19  -0.198   7.836  -3.884
  127   2HG2  ILE  19          2HG2      ILE  19  -1.510   8.150  -5.028
  128   3HG2  ILE  19          3HG2      ILE  19  -1.212   6.505  -4.461
  129   1HD1  ILE  19          1HD1      ILE  19  -0.706   5.544  -0.794
  130   2HD1  ILE  19          2HD1      ILE  19  -0.343   7.261  -0.963
  131   3HD1  ILE  19          3HD1      ILE  19  -0.005   6.155  -2.293
  132    HA   PRO  20           HA       PRO  20  -4.149   9.586   1.075
  133   1HB   PRO  20          2HB       PRO  20  -6.445  10.819   0.401
  134   2HB   PRO  20          1HB       PRO  20  -4.944  11.714   0.651
  135   1HG   PRO  20          2HG       PRO  20  -6.383  11.127  -1.850
  136   2HG   PRO  20          1HG       PRO  20  -5.203  12.402  -1.505
  137   1HD   PRO  20          2HD       PRO  20  -4.777   9.871  -2.823
  138   2HD   PRO  20          1HD       PRO  20  -3.608  11.179  -2.547
  139    H    ALA  21           H        ALA  21  -4.285   7.248   0.853
  140    HA   ALA  21           HA       ALA  21  -5.227   5.219   0.441
  141   1HB   ALA  21          1HB       ALA  21  -7.776   6.786   0.044
  142   2HB   ALA  21          2HB       ALA  21  -7.193   6.139   1.577
  143   3HB   ALA  21          3HB       ALA  21  -7.652   5.040   0.275
  144    H    SER  22           H        SER  22  -7.056   4.312  -1.405
  145    HA   SER  22           HA       SER  22  -5.407   4.454  -3.740
  146   1HB   SER  22          2HB       SER  22  -6.936   2.792  -4.683
  147   2HB   SER  22          1HB       SER  22  -6.501   2.357  -3.031
  148    HG   SER  22           HG       SER  22  -8.579   3.695  -2.617
  149    H    GLU  23           H        GLU  23  -5.708   6.803  -4.088
  150    HA   GLU  23           HA       GLU  23  -6.651   8.645  -5.033
  151   1HB   GLU  23          1HB       GLU  23  -6.515   7.051  -6.996
  152   2HB   GLU  23          2HB       GLU  23  -8.213   6.691  -6.722
  153   1HG   GLU  23          2HG       GLU  23  -7.952   8.320  -8.492
  154   2HG   GLU  23          1HG       GLU  23  -8.779   9.032  -7.107
  155    H    GLN  24           H        GLN  24  -8.148   6.922  -2.924
  156    HA   GLN  24           HA       GLN  24 -10.364   8.561  -2.438
  157   1HB   GLN  24          2HB       GLN  24 -10.833   6.401  -4.357
  158   2HB   GLN  24          1HB       GLN  24 -11.924   6.344  -2.981
  159   1HG   GLN  24          1HG       GLN  24 -11.487   8.798  -4.662
  160   2HG   GLN  24          2HG       GLN  24 -12.765   7.619  -4.954
  161   1HE2  GLN  24          1HE2      GLN  24 -14.386   9.118  -4.604
  162   2HE2  GLN  24          2HE2      GLN  24 -14.770   9.719  -3.032
  163    H    GLU  25           H        GLU  25 -10.717   5.064  -2.290
  164    HA   GLU  25           HA       GLU  25  -9.126   4.667  -0.006
  165   1HB   GLU  25          1HB       GLU  25 -10.907   5.857   1.167
  166   2HB   GLU  25          2HB       GLU  25 -12.097   4.728   0.530
  167   1HG   GLU  25          1HG       GLU  25 -10.971   2.896   1.726
  168   2HG   GLU  25          2HG       GLU  25  -9.832   4.062   2.397
  169    H    THR  26           H        THR  26 -12.322   3.238  -0.651
  170    HA   THR  26           HA       THR  26 -12.910   1.059  -1.127
  171    HB   THR  26           HB       THR  26 -10.100   0.130  -1.377
  172    HG1  THR  26           1HG      THR  26  -9.731   1.287  -3.128
  173   1HG2  THR  26          1HG2      THR  26 -11.921  -1.460  -1.604
  174   2HG2  THR  26          2HG2      THR  26 -11.093  -1.261  -3.148
  175   3HG2  THR  26          3HG2      THR  26 -12.649  -0.477  -2.875
  176    H    LEU  27           H        LEU  27 -13.245  -0.685   0.252
  177    HA   LEU  27           HA       LEU  27 -11.321  -0.981   2.424
  178   1HB   LEU  27          2HB       LEU  27 -13.913  -1.095   2.707
  179   2HB   LEU  27          1HB       LEU  27 -13.708  -2.736   2.116
  180    HG   LEU  27           HG       LEU  27 -11.760  -2.152   4.142
  181   1HD1  LEU  27          1HD1      LEU  27 -13.299  -0.543   4.958
  182   2HD1  LEU  27          2HD1      LEU  27 -13.317  -1.962   6.018
  183   3HD1  LEU  27          3HD1      LEU  27 -14.627  -1.701   4.862
  184   1HD2  LEU  27          1HD2      LEU  27 -12.726  -4.131   5.184
  185   2HD2  LEU  27          2HD2      LEU  27 -12.378  -4.379   3.474
  186   3HD2  LEU  27          3HD2      LEU  27 -14.039  -4.106   4.006
  187    H    VAL  28           H        VAL  28  -9.919  -2.615   2.487
  188    HA   VAL  28           HA       VAL  28  -9.711  -3.937  -0.114
  189    HB   VAL  28           HB       VAL  28  -7.647  -2.880   1.777
  190   1HG1  VAL  28          1HG2      VAL  28  -6.849  -5.062   1.121
  191   2HG1  VAL  28          2HG2      VAL  28  -5.941  -3.822   0.255
  192   3HG1  VAL  28          3HG2      VAL  28  -7.217  -4.721  -0.570
  193   1HG2  VAL  28          1HG1      VAL  28  -7.019  -1.554  -0.118
  194   2HG2  VAL  28          2HG1      VAL  28  -8.769  -1.417   0.105
  195   3HG2  VAL  28          3HG1      VAL  28  -8.114  -2.466  -1.156
  196    H    ARG  29           H        ARG  29  -9.403  -6.014  -0.319
  197    HA   ARG  29           HA       ARG  29  -8.515  -7.666   1.783
  198   1HB   ARG  29          2HB       ARG  29 -10.788  -8.984   1.755
  199   2HB   ARG  29          1HB       ARG  29 -10.588  -7.585   2.802
  200   1HG   ARG  29          1HG       ARG  29 -11.766  -6.179   1.242
  201   2HG   ARG  29          2HG       ARG  29 -11.844  -7.493   0.065
  202   1HD   ARG  29          2HD       ARG  29 -13.156  -7.460   2.781
  203   2HD   ARG  29          1HD       ARG  29 -13.969  -7.234   1.234
  204    HE   ARG  29           HE       ARG  29 -12.635  -9.669   1.119
  205   1HH1  ARG  29          2HH1      ARG  29 -15.228  -8.206   2.927
  206   2HH1  ARG  29          1HH1      ARG  29 -16.056  -9.703   3.196
  207   1HH2  ARG  29          1HH2      ARG  29 -13.719 -11.644   1.468
  208   2HH2  ARG  29          2HH2      ARG  29 -15.199 -11.657   2.367
  209    HA   PRO  30           HA       PRO  30  -8.567  -9.093  -2.638
  210   1HB   PRO  30          1HB       PRO  30  -5.881  -8.525  -3.158
  211   2HB   PRO  30          2HB       PRO  30  -7.247  -7.459  -3.489
  212   1HG   PRO  30          1HG       PRO  30  -5.174  -7.033  -1.613
  213   2HG   PRO  30          2HG       PRO  30  -6.653  -6.079  -1.799
  214   1HD   PRO  30          1HD       PRO  30  -6.026  -8.238   0.151
  215   2HD   PRO  30          2HD       PRO  30  -7.076  -6.814   0.337
  216    H    LYS  31           H        LYS  31  -8.470 -11.049  -0.780
  217    HA   LYS  31           HA       LYS  31  -7.823 -13.208  -0.475
  218   1HB   LYS  31          1HB       LYS  31  -6.277 -12.745  -3.033
  219   2HB   LYS  31          2HB       LYS  31  -6.556 -14.314  -2.290
  220   1HG   LYS  31          2HG       LYS  31  -8.968 -14.027  -2.600
  221   2HG   LYS  31          1HG       LYS  31  -8.677 -12.463  -3.364
  222   1HD   LYS  31          1HD       LYS  31  -9.014 -14.128  -5.074
  223   2HD   LYS  31          2HD       LYS  31  -7.329 -13.607  -5.098
  224   1HE   LYS  31          1HE       LYS  31  -7.511 -16.030  -5.340
  225   2HE   LYS  31          2HE       LYS  31  -6.682 -15.595  -3.844
  226   1HZ   LYS  31          1HZ       LYS  31  -8.740 -15.974  -2.637
  227   2HZ   LYS  31          2HZ       LYS  31  -8.281 -17.364  -3.483
  228   3HZ   LYS  31          3HZ       LYS  31  -9.534 -16.393  -4.071
  229    HA   PRO  32           HA       PRO  32  -4.208 -13.187   1.977
  230   1HB   PRO  32          1HB       PRO  32  -3.582 -15.916   0.980
  231   2HB   PRO  32          2HB       PRO  32  -3.809 -15.346   2.637
  232   1HG   PRO  32          2HG       PRO  32  -5.689 -16.793   1.425
  233   2HG   PRO  32          1HG       PRO  32  -6.123 -15.444   2.493
  234   1HD   PRO  32          1HD       PRO  32  -6.112 -15.574  -0.496
  235   2HD   PRO  32          2HD       PRO  32  -7.264 -14.776   0.596
  236    H    LEU  33           H        LEU  33  -3.179 -11.617   0.538
  237    HA   LEU  33           HA       LEU  33  -0.554 -12.384  -0.068
  238   1HB   LEU  33          1HB       LEU  33  -0.634 -11.880  -2.548
  239   2HB   LEU  33          2HB       LEU  33  -1.283 -13.427  -2.045
  240    HG   LEU  33           HG       LEU  33  -3.577 -12.195  -2.080
  241   1HD1  LEU  33          1HD1      LEU  33  -1.926 -10.425  -3.874
  242   2HD1  LEU  33          2HD1      LEU  33  -2.714  -9.949  -2.367
  243   3HD1  LEU  33          3HD1      LEU  33  -3.686 -10.415  -3.764
  244   1HD2  LEU  33          1HD2      LEU  33  -3.853 -12.765  -4.442
  245   2HD2  LEU  33          2HD2      LEU  33  -2.964 -14.016  -3.572
  246   3HD2  LEU  33          3HD2      LEU  33  -2.102 -12.886  -4.617
  247    H    LEU  34           H        LEU  34  -3.050 -10.157   0.232
  248    HA   LEU  34           HA       LEU  34  -1.104  -7.956   0.117
  249   1HB   LEU  34          1HB       LEU  34  -3.999  -8.117  -0.283
  250   2HB   LEU  34          2HB       LEU  34  -3.531  -6.845   0.829
  251    HG   LEU  34           HG       LEU  34  -3.740  -5.996  -1.448
  252   1HD1  LEU  34          1HD2      LEU  34  -1.556  -4.919  -1.633
  253   2HD1  LEU  34          2HD2      LEU  34  -0.882  -6.085  -0.495
  254   3HD1  LEU  34          3HD2      LEU  34  -2.121  -4.948   0.037
  255   1HD2  LEU  34          1HD1      LEU  34  -2.194  -6.717  -3.197
  256   2HD2  LEU  34          2HD1      LEU  34  -3.231  -8.039  -2.661
  257   3HD2  LEU  34          3HD1      LEU  34  -1.555  -7.958  -2.121
  258    H    LEU  35           H        LEU  35  -2.476 -10.213   2.128
  259    HA   LEU  35           HA       LEU  35  -2.170  -8.500   4.496
  260   1HB   LEU  35          2HB       LEU  35  -3.826 -10.924   4.738
  261   2HB   LEU  35          1HB       LEU  35  -4.064  -9.326   5.419
  262    HG   LEU  35           HG       LEU  35  -4.581  -8.717   2.887
  263   1HD1  LEU  35          1HD2      LEU  35  -5.329 -11.628   3.080
  264   2HD1  LEU  35          2HD2      LEU  35  -4.066 -10.954   2.050
  265   3HD1  LEU  35          3HD2      LEU  35  -5.756 -10.531   1.766
  266   1HD2  LEU  35          1HD1      LEU  35  -6.392  -9.951   4.933
  267   2HD2  LEU  35          2HD1      LEU  35  -7.004  -9.329   3.399
  268   3HD2  LEU  35          3HD1      LEU  35  -6.180  -8.246   4.524
  269    H    LYS  36           H        LYS  36  -1.598 -11.701   3.099
  270    HA   LYS  36           HA       LYS  36   0.288 -12.571   5.006
  271   1HB   LYS  36          1HB       LYS  36   0.283 -12.812   1.989
  272   2HB   LYS  36          2HB       LYS  36   1.400 -13.656   3.050
  273   1HG   LYS  36          2HG       LYS  36  -1.594 -13.963   3.095
  274   2HG   LYS  36          1HG       LYS  36  -0.466 -15.071   2.310
  275   1HD   LYS  36          2HD       LYS  36   0.589 -15.525   4.474
  276   2HD   LYS  36          1HD       LYS  36  -0.542 -14.419   5.256
  277   1HE   LYS  36          2HE       LYS  36  -1.243 -16.737   5.538
  278   2HE   LYS  36          1HE       LYS  36  -2.410 -15.833   4.574
  279   1HZ   LYS  36          1HZ       LYS  36  -1.986 -18.009   3.627
  280   2HZ   LYS  36          2HZ       LYS  36  -0.333 -17.666   3.502
  281   3HZ   LYS  36          3HZ       LYS  36  -1.450 -16.796   2.575
  282    H    LEU  37           H        LEU  37   0.104  -9.847   3.032
  283    HA   LEU  37           HA       LEU  37   2.929  -9.231   3.008
  284   1HB   LEU  37          1HB       LEU  37   1.290  -8.637   1.184
  285   2HB   LEU  37          2HB       LEU  37   0.559  -7.501   2.296
  286    HG   LEU  37           HG       LEU  37   2.049  -6.409   0.684
  287   1HD1  LEU  37          1HD1      LEU  37   2.999  -4.934   2.190
  288   2HD1  LEU  37          2HD1      LEU  37   3.360  -6.206   3.356
  289   3HD1  LEU  37          3HD1      LEU  37   1.694  -5.674   3.124
  290   1HD2  LEU  37          1HD2      LEU  37   3.644  -8.220   0.364
  291   2HD2  LEU  37          2HD2      LEU  37   4.230  -8.004   2.014
  292   3HD2  LEU  37          3HD2      LEU  37   4.459  -6.724   0.821
  293    H    LEU  38           H        LEU  38  -0.015  -8.213   4.686
  294    HA   LEU  38           HA       LEU  38   1.472  -6.140   6.106
  295   1HB   LEU  38          1HB       LEU  38  -1.480  -6.716   5.952
  296   2HB   LEU  38          2HB       LEU  38  -0.773  -5.372   6.824
  297    HG   LEU  38           HG       LEU  38  -0.693  -5.811   3.838
  298   1HD1  LEU  38          1HD2      LEU  38  -2.868  -5.091   4.773
  299   2HD1  LEU  38          2HD2      LEU  38  -2.126  -3.883   3.722
  300   3HD1  LEU  38          3HD2      LEU  38  -2.062  -3.684   5.475
  301   1HD2  LEU  38          1HD1      LEU  38   0.367  -3.607   3.742
  302   2HD2  LEU  38          2HD1      LEU  38   1.367  -4.775   4.607
  303   3HD2  LEU  38          3HD1      LEU  38   0.443  -3.571   5.504
  304    H    LYS  39           H        LYS  39  -0.793  -8.783   6.877
  305    HA   LYS  39           HA       LYS  39  -0.841  -8.622   9.605
  306   1HB   LYS  39          1HB       LYS  39  -0.751 -11.134   7.927
  307   2HB   LYS  39          2HB       LYS  39  -1.233 -11.077   9.616
  308   1HG   LYS  39          2HG       LYS  39  -3.140  -9.712   9.078
  309   2HG   LYS  39          1HG       LYS  39  -2.625  -9.596   7.394
  310   1HD   LYS  39          1HD       LYS  39  -2.922 -11.991   7.114
  311   2HD   LYS  39          2HD       LYS  39  -3.377 -12.148   8.812
  312   1HE   LYS  39          1HE       LYS  39  -5.320 -10.717   8.423
  313   2HE   LYS  39          2HE       LYS  39  -4.864 -10.555   6.727
  314   1HZ   LYS  39          1HZ       LYS  39  -5.158 -12.938   6.458
  315   2HZ   LYS  39          2HZ       LYS  39  -6.583 -12.220   7.020
  316   3HZ   LYS  39          3HZ       LYS  39  -5.599 -13.092   8.085
  317    H    SER  40           H        SER  40   1.814  -9.541   7.609
  318    HA   SER  40           HA       SER  40   3.357 -10.909   9.556
  319   1HB   SER  40          2HB       SER  40   4.251  -9.371   7.106
  320   2HB   SER  40          1HB       SER  40   5.258 -10.477   8.039
  321    HG   SER  40           HG       SER  40   3.728 -12.132   7.513
  322    H    VAL  41           H        VAL  41   3.417  -7.516   8.433
  323    HA   VAL  41           HA       VAL  41   5.574  -6.817  10.132
  324    HB   VAL  41           HB       VAL  41   5.225  -5.573   8.098
  325   1HG1  VAL  41          1HG1      VAL  41   3.315  -4.027   7.846
  326   2HG1  VAL  41          2HG1      VAL  41   2.595  -4.727   9.298
  327   3HG1  VAL  41          3HG1      VAL  41   2.834  -5.726   7.864
  328   1HG2  VAL  41          1HG2      VAL  41   6.173  -4.451  10.150
  329   2HG2  VAL  41          2HG2      VAL  41   4.593  -3.686  10.345
  330   3HG2  VAL  41          3HG2      VAL  41   5.551  -3.381   8.896
  331    H    GLY  42           H        GLY  42   2.177  -7.061  10.674
  332   1HA   GLY  42          1HA       GLY  42   2.406  -6.964  13.412
  333   2HA   GLY  42          2HA       GLY  42   2.077  -5.307  12.937
  334    H    ALA  43           H        ALA  43   0.340  -6.046  10.708
  335    HA   ALA  43           HA       ALA  43  -2.034  -5.745  12.167
  336   1HB   ALA  43          1HB       ALA  43  -3.174  -5.834  10.024
  337   2HB   ALA  43          2HB       ALA  43  -1.730  -6.503   9.265
  338   3HB   ALA  43          3HB       ALA  43  -1.708  -4.860   9.906
  339    H    GLN  44           H        GLN  44  -4.030  -7.123  11.774
  340    HA   GLN  44           HA       GLN  44  -3.848  -9.856  11.154
  341   1HB   GLN  44          1HB       GLN  44  -2.486  -9.926  13.219
  342   2HB   GLN  44          2HB       GLN  44  -3.846  -9.272  14.122
  343   1HG   GLN  44          1HG       GLN  44  -5.164 -11.252  13.579
  344   2HG   GLN  44          2HG       GLN  44  -3.803 -11.908  12.669
  345   1HE2  GLN  44          2HE2      GLN  44  -3.662 -13.726  13.967
  346   2HE2  GLN  44          1HE2      GLN  44  -3.053 -13.665  15.583
  347    H    LYS  45           H        LYS  45  -5.749  -8.911  10.092
  348    HA   LYS  45           HA       LYS  45  -8.086  -9.521  11.739
  349   1HB   LYS  45          2HB       LYS  45  -8.069  -7.172   9.839
  350   2HB   LYS  45          1HB       LYS  45  -9.370  -7.664  10.911
  351   1HG   LYS  45          1HG       LYS  45  -7.898  -7.161  12.846
  352   2HG   LYS  45          2HG       LYS  45  -6.705  -6.523  11.713
  353   1HD   LYS  45          1HD       LYS  45  -9.534  -5.513  12.002
  354   2HD   LYS  45          2HD       LYS  45  -8.110  -4.757  12.718
  355   1HE   LYS  45          2HE       LYS  45  -7.178  -4.371  10.509
  356   2HE   LYS  45          1HE       LYS  45  -8.553  -5.187   9.767
  357   1HZ   LYS  45          1HZ       LYS  45  -8.681  -2.685  11.360
  358   2HZ   LYS  45          2HZ       LYS  45 -10.004  -3.469  10.655
  359   3HZ   LYS  45          3HZ       LYS  45  -8.803  -2.792   9.676
  360    H    ASP  46           H        ASP  46 -10.044  -9.099   9.831
  361    HA   ASP  46           HA       ASP  46  -9.347 -11.043   7.756
  362   1HB   ASP  46          1HB       ASP  46 -11.399 -11.470   9.024
  363   2HB   ASP  46          2HB       ASP  46 -12.032  -9.895   8.555
  364    H    THR  47           H        THR  47 -10.592  -7.761   8.163
  365    HA   THR  47           HA       THR  47 -10.024  -7.264   5.314
  366    HB   THR  47           HB       THR  47 -11.822  -5.415   5.558
  367    HG1  THR  47           1HG      THR  47 -11.921  -6.585   8.007
  368   1HG2  THR  47          1HG2      THR  47 -12.638  -8.324   5.664
  369   2HG2  THR  47          2HG2      THR  47 -12.091  -7.467   4.221
  370   3HG2  THR  47          3HG2      THR  47 -13.601  -6.999   5.007
  371    H    TYR  48           H        TYR  48  -9.108  -5.362   4.737
  372    HA   TYR  48           HA       TYR  48  -8.044  -3.714   6.927
  373   1HB   TYR  48          2HB       TYR  48  -7.034  -4.288   4.150
  374   2HB   TYR  48          1HB       TYR  48  -6.425  -2.944   5.112
  375    HD1  TYR  48           1HD      TYR  48  -6.800  -6.626   5.051
  376    HD2  TYR  48           2HD      TYR  48  -4.835  -3.270   6.765
  377    HE1  TYR  48           1HE      TYR  48  -5.204  -8.138   6.153
  378    HE2  TYR  48           2HE      TYR  48  -3.230  -4.771   7.893
  379    HH   TYR  48           HH       TYR  48  -3.279  -7.265   8.661
  380    H    THR  49           H        THR  49  -7.508  -1.418   5.997
  381    HA   THR  49           HA       THR  49  -9.367  -0.659   3.881
  382    HB   THR  49           HB       THR  49 -10.094   1.372   4.931
  383    HG1  THR  49           1HG      THR  49  -8.003   0.848   6.622
  384   1HG2  THR  49          1HG2      THR  49 -11.447   0.525   6.753
  385   2HG2  THR  49          2HG2      THR  49 -10.375  -0.861   6.946
  386   3HG2  THR  49          3HG2      THR  49 -11.346  -0.695   5.484
  387    H    MET  50           H        MET  50  -8.736   1.418   2.858
  388    HA   MET  50           HA       MET  50  -6.159   0.914   1.958
  389   1HB   MET  50          2HB       MET  50  -8.322   2.304   1.029
  390   2HB   MET  50          1HB       MET  50  -7.161   3.591   1.325
  391   1HG   MET  50          1HG       MET  50  -6.617   1.138  -0.332
  392   2HG   MET  50          2HG       MET  50  -7.085   2.708  -0.979
  393   1HE   MET  50          1HE       MET  50  -4.472   1.018  -1.815
  394   2HE   MET  50          2HE       MET  50  -3.267   2.301  -1.923
  395   3HE   MET  50          3HE       MET  50  -4.891   2.561  -2.560
  396    H    LYS  51           H        LYS  51  -7.136   2.816   4.607
  397    HA   LYS  51           HA       LYS  51  -4.767   4.509   4.561
  398   1HB   LYS  51          1HB       LYS  51  -6.884   5.466   5.348
  399   2HB   LYS  51          2HB       LYS  51  -6.980   4.244   6.609
  400   1HG   LYS  51          1HG       LYS  51  -6.228   6.307   7.568
  401   2HG   LYS  51          2HG       LYS  51  -4.898   5.147   7.589
  402   1HD   LYS  51          2HD       LYS  51  -3.967   6.185   5.571
  403   2HD   LYS  51          1HD       LYS  51  -5.288   7.356   5.571
  404   1HE   LYS  51          1HE       LYS  51  -3.228   7.013   7.746
  405   2HE   LYS  51          2HE       LYS  51  -3.259   8.304   6.546
  406   1HZ   LYS  51          1HZ       LYS  51  -4.188   9.035   8.649
  407   2HZ   LYS  51          2HZ       LYS  51  -5.345   7.803   8.600
  408   3HZ   LYS  51          3HZ       LYS  51  -5.380   9.038   7.446
  409    H    GLU  52           H        GLU  52  -6.125   1.819   6.361
  410    HA   GLU  52           HA       GLU  52  -4.022   1.409   8.178
  411   1HB   GLU  52          2HB       GLU  52  -6.416   0.288   7.846
  412   2HB   GLU  52          1HB       GLU  52  -5.455  -0.919   7.003
  413   1HG   GLU  52          1HG       GLU  52  -4.110  -1.292   8.973
  414   2HG   GLU  52          2HG       GLU  52  -4.971  -0.013   9.830
  415    H    VAL  53           H        VAL  53  -4.687  -0.298   5.117
  416    HA   VAL  53           HA       VAL  53  -2.168  -1.554   4.982
  417    HB   VAL  53           HB       VAL  53  -3.918  -2.525   3.721
  418   1HG1  VAL  53          1HG1      VAL  53  -5.014  -1.325   1.837
  419   2HG1  VAL  53          2HG1      VAL  53  -4.212   0.150   2.377
  420   3HG1  VAL  53          3HG1      VAL  53  -5.373  -0.659   3.431
  421   1HG2  VAL  53          1HG2      VAL  53  -2.015  -1.195   1.800
  422   2HG2  VAL  53          2HG2      VAL  53  -3.019  -2.600   1.441
  423   3HG2  VAL  53          3HG2      VAL  53  -1.747  -2.713   2.659
  424    H    LEU  54           H        LEU  54  -3.227   1.640   4.109
  425    HA   LEU  54           HA       LEU  54  -1.190   2.487   2.427
  426   1HB   LEU  54          2HB       LEU  54  -3.014   3.950   3.062
  427   2HB   LEU  54          1HB       LEU  54  -2.477   3.954   4.729
  428    HG   LEU  54           HG       LEU  54  -0.373   5.086   3.976
  429   1HD1  LEU  54          1HD1      LEU  54  -0.347   6.133   1.774
  430   2HD1  LEU  54          2HD1      LEU  54  -1.869   5.334   1.371
  431   3HD1  LEU  54          3HD1      LEU  54  -0.413   4.375   1.644
  432   1HD2  LEU  54          1HD2      LEU  54  -2.958   6.509   3.360
  433   2HD2  LEU  54          2HD2      LEU  54  -1.407   7.280   3.695
  434   3HD2  LEU  54          3HD2      LEU  54  -2.217   6.344   4.952
  435    H    PHE  55           H        PHE  55  -1.161   2.805   5.992
  436    HA   PHE  55           HA       PHE  55   1.662   3.373   5.918
  437   1HB   PHE  55          1HB       PHE  55   1.464   4.064   8.117
  438   2HB   PHE  55          2HB       PHE  55  -0.161   4.355   7.514
  439    HD1  PHE  55           1HD      PHE  55  -1.902   2.489   7.924
  440    HD2  PHE  55           2HD      PHE  55   1.785   2.803  10.024
  441    HE1  PHE  55           1HE      PHE  55  -2.823   1.110   9.740
  442    HE2  PHE  55           2HE      PHE  55   0.872   1.421  11.842
  443    HZ   PHE  55           HZ       PHE  55  -1.435   0.572  11.702
  444    H    TYR  56           H        TYR  56  -0.258   0.575   6.246
  445    HA   TYR  56           HA       TYR  56   1.625  -0.903   7.855
  446   1HB   TYR  56          1HB       TYR  56  -1.093  -1.253   6.986
  447   2HB   TYR  56          2HB       TYR  56  -0.157  -2.706   6.645
  448    HD1  TYR  56           1HD      TYR  56  -2.385  -1.706   8.848
  449    HD2  TYR  56           2HD      TYR  56   1.722  -2.834   8.869
  450    HE1  TYR  56           1HE      TYR  56  -2.592  -2.388  11.198
  451    HE2  TYR  56           2HE      TYR  56   1.529  -3.517  11.222
  452    HH   TYR  56           HH       TYR  56  -1.457  -3.889  12.792
  453    H    LEU  57           H        LEU  57   0.836  -0.598   4.455
  454    HA   LEU  57           HA       LEU  57   2.619  -2.749   3.716
  455   1HB   LEU  57          2HB       LEU  57   0.467  -1.719   2.480
  456   2HB   LEU  57          1HB       LEU  57   1.718  -0.776   1.692
  457    HG   LEU  57           HG       LEU  57   1.755  -3.788   1.794
  458   1HD1  LEU  57          1HD2      LEU  57   0.696  -2.005  -0.390
  459   2HD1  LEU  57          2HD2      LEU  57  -0.263  -3.064   0.644
  460   3HD1  LEU  57          3HD2      LEU  57   0.902  -3.755  -0.488
  461   1HD2  LEU  57          1HD1      LEU  57   3.908  -2.709   1.386
  462   2HD2  LEU  57          2HD1      LEU  57   3.203  -1.811   0.042
  463   3HD2  LEU  57          3HD1      LEU  57   3.334  -3.568  -0.044
  464    H    GLY  58           H        GLY  58   2.593   0.792   3.588
  465   1HA   GLY  58          2HA       GLY  58   5.119   1.264   2.547
  466   2HA   GLY  58          1HA       GLY  58   4.349   2.260   3.772
  467    H    GLN  59           H        GLN  59   4.224   0.362   5.861
  468    HA   GLN  59           HA       GLN  59   6.884   0.674   6.841
  469   1HB   GLN  59          2HB       GLN  59   6.063  -0.311   8.913
  470   2HB   GLN  59          1HB       GLN  59   4.967   0.932   8.333
  471   1HG   GLN  59          2HG       GLN  59   3.479  -0.802   7.458
  472   2HG   GLN  59          1HG       GLN  59   4.573  -2.039   8.073
  473   1HE2  GLN  59          1HE2      GLN  59   2.234   0.387   8.895
  474   2HE2  GLN  59          2HE2      GLN  59   2.009  -0.093  10.538
  475    H    TYR  60           H        TYR  60   4.922  -2.150   5.890
  476    HA   TYR  60           HA       TYR  60   6.778  -4.098   6.666
  477   1HB   TYR  60          1HB       TYR  60   4.448  -4.619   6.033
  478   2HB   TYR  60          2HB       TYR  60   4.836  -4.253   4.353
  479    HD1  TYR  60           1HD      TYR  60   5.910  -6.460   7.158
  480    HD2  TYR  60           2HD      TYR  60   5.538  -5.957   2.952
  481    HE1  TYR  60           1HE      TYR  60   6.648  -8.778   6.822
  482    HE2  TYR  60           2HE      TYR  60   6.274  -8.274   2.604
  483    HH   TYR  60           HH       TYR  60   7.569  -9.994   3.793
  484    H    ILE  61           H        ILE  61   6.422  -2.384   3.575
  485    HA   ILE  61           HA       ILE  61   8.487  -3.551   2.133
  486    HB   ILE  61           HB       ILE  61   7.818  -0.606   2.178
  487   1HG1  ILE  61          1HG1      ILE  61   6.714  -2.638   0.253
  488   2HG1  ILE  61          2HG1      ILE  61   5.899  -2.267   1.769
  489   1HG2  ILE  61          1HG2      ILE  61   9.879  -0.998   1.019
  490   2HG2  ILE  61          2HG2      ILE  61   8.620  -0.688  -0.178
  491   3HG2  ILE  61          3HG2      ILE  61   9.171  -2.337   0.117
  492   1HD1  ILE  61          1HD1      ILE  61   5.922   0.141   1.055
  493   2HD1  ILE  61          2HD1      ILE  61   4.885  -0.936   0.115
  494   3HD1  ILE  61          3HD1      ILE  61   6.445  -0.426  -0.533
  495    H    MET  62           H        MET  62   8.761  -0.483   3.919
  496    HA   MET  62           HA       MET  62  11.559  -0.390   3.883
  497   1HB   MET  62          2HB       MET  62  11.368   1.311   5.638
  498   2HB   MET  62          1HB       MET  62  10.195   1.574   4.354
  499   1HG   MET  62          2HG       MET  62   8.447   0.592   5.731
  500   2HG   MET  62          1HG       MET  62   9.618   0.293   7.014
  501   1HE   MET  62          1HE       MET  62  10.810   2.194   8.410
  502   2HE   MET  62          2HE       MET  62  10.585   3.918   8.111
  503   3HE   MET  62          3HE       MET  62  11.408   2.915   6.915
  504    H    THR  63           H        THR  63   9.546  -2.449   5.648
  505    HA   THR  63           HA       THR  63  11.613  -2.961   7.672
  506    HB   THR  63           HB       THR  63   8.781  -4.022   7.532
  507    HG1  THR  63           1HG      THR  63   9.750  -1.660   8.352
  508   1HG2  THR  63          1HG2      THR  63   9.168  -4.737   9.850
  509   2HG2  THR  63          2HG2      THR  63  10.844  -4.200   9.733
  510   3HG2  THR  63          3HG2      THR  63  10.275  -5.538   8.735
  511    H    LYS  64           H        LYS  64  12.090  -5.264   8.160
  512    HA   LYS  64           HA       LYS  64  12.650  -7.401   7.634
  513   1HB   LYS  64          1HB       LYS  64  10.561  -7.096   5.469
  514   2HB   LYS  64          2HB       LYS  64  11.299  -8.613   5.962
  515   1HG   LYS  64          2HG       LYS  64   9.650  -6.839   7.752
  516   2HG   LYS  64          1HG       LYS  64   9.055  -8.274   6.913
  517   1HD   LYS  64          1HD       LYS  64  11.327  -8.273   8.897
  518   2HD   LYS  64          2HD       LYS  64   9.656  -8.684   9.290
  519   1HE   LYS  64          2HE       LYS  64   9.731 -10.520   7.674
  520   2HE   LYS  64          1HE       LYS  64  11.401 -10.109   7.285
  521   1HZ   LYS  64          1HZ       LYS  64  11.279 -11.946   8.848
  522   2HZ   LYS  64          2HZ       LYS  64  10.417 -10.991   9.945
  523   3HZ   LYS  64          3HZ       LYS  64  12.019 -10.603   9.566
  524    H    ARG  65           H        ARG  65  14.101  -5.200   6.537
  525    HA   ARG  65           HA       ARG  65  15.609  -4.643   4.906
  526   1HB   ARG  65          2HB       ARG  65  17.263  -6.396   4.515
  527   2HB   ARG  65          1HB       ARG  65  16.775  -6.353   6.203
  528   1HG   ARG  65          1HG       ARG  65  15.300  -8.272   5.816
  529   2HG   ARG  65          2HG       ARG  65  15.827  -8.323   4.132
  530   1HD   ARG  65          1HD       ARG  65  18.124  -8.723   4.856
  531   2HD   ARG  65          2HD       ARG  65  17.610  -8.657   6.542
  532    HE   ARG  65           HE       ARG  65  16.117 -10.613   5.166
  533   1HH1  ARG  65          2HH1      ARG  65  19.321 -10.016   6.397
  534   2HH1  ARG  65          1HH1      ARG  65  19.681 -11.694   6.637
  535   1HH2  ARG  65          1HH2      ARG  65  16.582 -12.823   5.479
  536   2HH2  ARG  65          2HH2      ARG  65  18.123 -13.288   6.114
  537    H    LEU  66           H        LEU  66  13.094  -4.980   3.746
  538    HA   LEU  66           HA       LEU  66  13.632  -6.311   1.207
  539   1HB   LEU  66          1HB       LEU  66  11.249  -5.380   2.620
  540   2HB   LEU  66          2HB       LEU  66  11.238  -4.973   0.916
  541    HG   LEU  66           HG       LEU  66  10.111  -7.038   1.088
  542   1HD1  LEU  66          1HD1      LEU  66  11.556  -8.605  -0.117
  543   2HD1  LEU  66          2HD1      LEU  66  12.957  -7.611   0.287
  544   3HD1  LEU  66          3HD1      LEU  66  11.687  -6.966  -0.754
  545   1HD2  LEU  66          1HD2      LEU  66  11.047  -9.001   2.228
  546   2HD2  LEU  66          2HD2      LEU  66  10.766  -7.656   3.335
  547   3HD2  LEU  66          3HD2      LEU  66  12.401  -8.016   2.784
  548    H    TYR  67           H        TYR  67  13.358  -3.099   2.586
  549    HA   TYR  67           HA       TYR  67  13.186  -1.668   0.158
  550   1HB   TYR  67          2HB       TYR  67  13.561   0.294   1.445
  551   2HB   TYR  67          1HB       TYR  67  12.638  -0.800   2.471
  552    HD1  TYR  67           1HD      TYR  67  13.881  -2.121   4.247
  553    HD2  TYR  67           2HD      TYR  67  15.644   1.121   2.132
  554    HE1  TYR  67           1HE      TYR  67  15.593  -1.914   6.002
  555    HE2  TYR  67           2HE      TYR  67  17.359   1.338   3.878
  556    HH   TYR  67           HH       TYR  67  17.870  -1.027   6.257
  557    H    ASP  68           H        ASP  68  15.078   0.195  -0.010
  558    HA   ASP  68           HA       ASP  68  17.341  -1.334  -0.977
  559   1HB   ASP  68          2HB       ASP  68  16.368   0.411  -2.401
  560   2HB   ASP  68          1HB       ASP  68  16.742   1.628  -1.183
  561    H    GLU  69           H        GLU  69  17.869   1.908   0.158
  562    HA   GLU  69           HA       GLU  69  18.739   1.478   2.757
  563   1HB   GLU  69          1HB       GLU  69  20.409  -0.031   1.760
  564   2HB   GLU  69          2HB       GLU  69  20.993   1.282   0.748
  565   1HG   GLU  69          2HG       GLU  69  21.680   2.517   2.740
  566   2HG   GLU  69          1HG       GLU  69  21.096   1.198   3.754
  567    H    LYS  70           H        LYS  70  19.155   3.192  -0.262
  568    HA   LYS  70           HA       LYS  70  20.559   5.429   0.577
  569   1HB   LYS  70          2HB       LYS  70  18.350   5.293  -1.484
  570   2HB   LYS  70          1HB       LYS  70  19.511   6.604  -1.326
  571   1HG   LYS  70          2HG       LYS  70  21.331   5.081  -1.859
  572   2HG   LYS  70          1HG       LYS  70  20.190   3.740  -1.971
  573   1HD   LYS  70          1HD       LYS  70  20.702   4.522  -4.190
  574   2HD   LYS  70          2HD       LYS  70  19.030   4.938  -3.805
  575   1HE   LYS  70          2HE       LYS  70  19.729   7.219  -3.250
  576   2HE   LYS  70          1HE       LYS  70  21.398   6.802  -3.640
  577   1HZ   LYS  70          1HZ       LYS  70  20.721   6.362  -5.916
  578   2HZ   LYS  70          2HZ       LYS  70  20.320   7.943  -5.473
  579   3HZ   LYS  70          3HZ       LYS  70  19.119   6.756  -5.544
  580    H    GLN  71           H        GLN  71  17.039   5.443   0.024
  581    HA   GLN  71           HA       GLN  71  16.661   6.710   2.625
  582   1HB   GLN  71          2HB       GLN  71  15.180   8.439   1.680
  583   2HB   GLN  71          1HB       GLN  71  16.835   8.602   1.110
  584   1HG   GLN  71          1HG       GLN  71  16.225   7.544  -0.998
  585   2HG   GLN  71          2HG       GLN  71  14.567   7.360  -0.428
  586   1HE2  GLN  71          2HE2      GLN  71  15.610   8.806  -2.741
  587   2HE2  GLN  71          1HE2      GLN  71  15.079  10.440  -2.560
  588    H    GLN  72           H        GLN  72  16.103   4.098   1.341
  589    HA   GLN  72           HA       GLN  72  14.503   2.490   1.484
  590   1HB   GLN  72          1HB       GLN  72  12.952   4.505   3.118
  591   2HB   GLN  72          2HB       GLN  72  12.755   2.758   3.127
  592   1HG   GLN  72          1HG       GLN  72  14.989   2.505   4.075
  593   2HG   GLN  72          2HG       GLN  72  15.197   4.255   4.054
  594   1HE2  GLN  72          2HE2      GLN  72  12.421   4.749   4.811
  595   2HE2  GLN  72          1HE2      GLN  72  12.313   4.377   6.495
  596    H    HIS  73           H        HIS  73  14.364   4.751  -0.552
  597    HA   HIS  73           HA       HIS  73  11.530   4.869  -1.181
  598   1HB   HIS  73          1HB       HIS  73  12.186   6.325  -3.013
  599   2HB   HIS  73          2HB       HIS  73  12.987   6.843  -1.534
  600    HD1  HIS  73           1HD      HIS  73  15.503   5.370  -1.388
  601    HD2  HIS  73           2HD      HIS  73  13.934   6.566  -5.044
  602    HE1  HIS  73           1HE      HIS  73  17.452   5.404  -2.975
  603    HE2  HIS  73           2HE      HIS  73  16.494   6.208  -5.163
  604    H    ILE  74           H        ILE  74  14.438   3.242  -2.323
  605    HA   ILE  74           HA       ILE  74  12.843   1.724  -4.253
  606    HB   ILE  74           HB       ILE  74  15.769   1.327  -3.628
  607   1HG1  ILE  74          1HG1      ILE  74  15.437   3.644  -4.347
  608   2HG1  ILE  74          2HG1      ILE  74  16.257   2.715  -5.598
  609   1HG2  ILE  74          1HG2      ILE  74  14.093   0.587  -6.025
  610   2HG2  ILE  74          2HG2      ILE  74  14.673  -0.519  -4.780
  611   3HG2  ILE  74          3HG2      ILE  74  15.822   0.291  -5.844
  612   1HD1  ILE  74          1HD1      ILE  74  13.332   3.429  -5.569
  613   2HD1  ILE  74          2HD1      ILE  74  14.162   2.513  -6.826
  614   3HD1  ILE  74          3HD1      ILE  74  14.584   4.202  -6.542
  615    H    VAL  75           H        VAL  75  12.931  -0.645  -4.177
  616    HA   VAL  75           HA       VAL  75  13.716  -1.943  -1.745
  617    HB   VAL  75           HB       VAL  75  11.767  -1.198  -0.743
  618   1HG1  VAL  75          1HG2      VAL  75   9.594  -1.035  -1.854
  619   2HG1  VAL  75          2HG2      VAL  75  10.316  -1.636  -3.347
  620   3HG1  VAL  75          3HG2      VAL  75  10.827  -0.083  -2.682
  621   1HG2  VAL  75          1HG1      VAL  75  11.871  -3.597  -0.532
  622   2HG2  VAL  75          2HG1      VAL  75  11.023  -3.803  -2.064
  623   3HG2  VAL  75          3HG1      VAL  75  10.187  -3.097  -0.681
  624    H    TYR  76           H        TYR  76  14.756  -3.507  -2.821
  625    HA   TYR  76           HA       TYR  76  13.536  -4.842  -5.077
  626   1HB   TYR  76          2HB       TYR  76  16.139  -5.467  -3.678
  627   2HB   TYR  76          1HB       TYR  76  15.635  -6.028  -5.272
  628    HD1  TYR  76           1HD      TYR  76  16.846  -3.166  -3.338
  629    HD2  TYR  76           2HD      TYR  76  15.693  -4.550  -7.187
  630    HE1  TYR  76           1HE      TYR  76  17.868  -1.171  -4.349
  631    HE2  TYR  76           2HE      TYR  76  16.722  -2.566  -8.216
  632    HH   TYR  76           HH       TYR  76  18.794  -0.479  -6.523
  633    H    CYS  77           H        CYS  77  12.690  -6.873  -5.110
  634    HA   CYS  77           HA       CYS  77  12.551  -8.328  -2.568
  635   1HB   CYS  77          2HB       CYS  77  10.085  -8.597  -2.889
  636   2HB   CYS  77          1HB       CYS  77  10.586  -6.946  -2.536
  637    HG   CYS  77           HG       CYS  77   8.448  -7.162  -4.476
  638    H    SER  78           H        SER  78  14.069  -9.647  -3.889
  639    HA   SER  78           HA       SER  78  12.767 -11.404  -5.812
  640   1HB   SER  78          2HB       SER  78  15.099 -10.772  -6.223
  641   2HB   SER  78          1HB       SER  78  15.573 -11.457  -4.668
  642    HG   SER  78           HG       SER  78  14.183 -13.183  -6.297
  643    H    ASN  79           H        ASN  79  11.540 -13.012  -5.107
  644    HA   ASN  79           HA       ASN  79  10.636 -14.638  -3.802
  645   1HB   ASN  79          2HB       ASN  79  13.465 -14.886  -2.755
  646   2HB   ASN  79          1HB       ASN  79  12.177 -16.056  -2.488
  647   1HD2  ASN  79          2HD2      ASN  79  14.380 -14.691  -4.797
  648   2HD2  ASN  79          1HD2      ASN  79  14.182 -15.906  -6.011
  649    H    ASP  80           H        ASP  80   9.598 -12.656  -2.840
  650    HA   ASP  80           HA       ASP  80   9.998 -12.682   0.056
  651   1HB   ASP  80          2HB       ASP  80   9.959 -10.163  -1.614
  652   2HB   ASP  80          1HB       ASP  80   9.871 -10.205   0.145
  653    H    LEU  81           H        LEU  81   8.175 -11.636   1.218
  654    HA   LEU  81           HA       LEU  81   5.664 -12.438   0.196
  655   1HB   LEU  81          1HB       LEU  81   6.376 -10.613   2.492
  656   2HB   LEU  81          2HB       LEU  81   4.741 -11.135   2.135
  657    HG   LEU  81           HG       LEU  81   5.573 -13.520   2.416
  658   1HD1  LEU  81          1HD2      LEU  81   7.934 -12.091   3.629
  659   2HD1  LEU  81          2HD2      LEU  81   7.956 -13.082   2.171
  660   3HD1  LEU  81          3HD2      LEU  81   7.609 -13.821   3.734
  661   1HD2  LEU  81          1HD1      LEU  81   5.482 -13.406   4.866
  662   2HD2  LEU  81          2HD1      LEU  81   4.235 -12.417   4.108
  663   3HD2  LEU  81          3HD1      LEU  81   5.674 -11.655   4.781
  664    H    LEU  82           H        LEU  82   7.216  -9.263   0.506
  665    HA   LEU  82           HA       LEU  82   5.342  -7.693  -0.822
  666   1HB   LEU  82          1HB       LEU  82   8.190  -7.571  -0.240
  667   2HB   LEU  82          2HB       LEU  82   7.805  -6.835  -1.783
  668    HG   LEU  82           HG       LEU  82   6.551  -6.100   0.864
  669   1HD1  LEU  82          1HD1      LEU  82   8.886  -5.419   0.727
  670   2HD1  LEU  82          2HD1      LEU  82   7.814  -4.021   0.628
  671   3HD1  LEU  82          3HD1      LEU  82   8.580  -4.648  -0.830
  672   1HD2  LEU  82          1HD2      LEU  82   5.499  -4.291  -0.332
  673   2HD2  LEU  82          2HD2      LEU  82   5.062  -5.821  -1.095
  674   3HD2  LEU  82          3HD2      LEU  82   6.282  -4.783  -1.835
  675    H    GLY  83           H        GLY  83   7.501 -10.154  -2.008
  676   1HA   GLY  83          1HA       GLY  83   7.303  -9.607  -4.776
  677   2HA   GLY  83          2HA       GLY  83   7.673 -11.169  -4.061
  678    H    ASP  84           H        ASP  84   5.306 -11.561  -2.590
  679    HA   ASP  84           HA       ASP  84   3.523 -12.610  -4.453
  680   1HB   ASP  84          2HB       ASP  84   2.946 -11.677  -1.630
  681   2HB   ASP  84          1HB       ASP  84   1.875 -12.685  -2.600
  682    H    LEU  85           H        LEU  85   3.748  -9.379  -3.107
  683    HA   LEU  85           HA       LEU  85   1.318  -8.369  -4.135
  684   1HB   LEU  85          1HB       LEU  85   3.938  -7.006  -3.554
  685   2HB   LEU  85          2HB       LEU  85   2.501  -6.147  -4.071
  686    HG   LEU  85           HG       LEU  85   2.975  -7.597  -1.488
  687   1HD1  LEU  85          1HD2      LEU  85   3.668  -5.233  -1.705
  688   2HD1  LEU  85          2HD2      LEU  85   2.395  -5.471  -0.508
  689   3HD1  LEU  85          3HD2      LEU  85   2.001  -4.810  -2.095
  690   1HD2  LEU  85          1HD1      LEU  85   0.348  -6.655  -2.627
  691   2HD2  LEU  85          2HD1      LEU  85   0.605  -7.141  -0.950
  692   3HD2  LEU  85          3HD1      LEU  85   0.800  -8.317  -2.250
  693    H    PHE  86           H        PHE  86   4.515  -7.495  -5.363
  694    HA   PHE  86           HA       PHE  86   3.278  -6.832  -7.896
  695   1HB   PHE  86          1HB       PHE  86   6.194  -6.528  -7.175
  696   2HB   PHE  86          2HB       PHE  86   5.296  -5.665  -8.419
  697    HD1  PHE  86           1HD      PHE  86   4.204  -3.651  -7.940
  698    HD2  PHE  86           2HD      PHE  86   5.648  -6.088  -4.765
  699    HE1  PHE  86           1HE      PHE  86   3.755  -1.829  -6.345
  700    HE2  PHE  86           2HE      PHE  86   5.199  -4.276  -3.164
  701    HZ   PHE  86           HZ       PHE  86   4.253  -2.149  -3.952
  702    H    GLY  87           H        GLY  87   6.275  -8.562  -7.028
  703   1HA   GLY  87          1HA       GLY  87   6.737 -10.741  -8.124
  704   2HA   GLY  87          2HA       GLY  87   5.994 -10.056  -9.562
  705    H    VAL  88           H        VAL  88   7.186  -7.456  -9.317
  706    HA   VAL  88           HA       VAL  88   9.489  -7.642 -10.763
  707    HB   VAL  88           HB       VAL  88   9.517  -5.436  -8.822
  708   1HG1  VAL  88          1HG1      VAL  88  10.921  -5.500 -10.782
  709   2HG1  VAL  88          2HG1      VAL  88   9.789  -4.145 -10.878
  710   3HG1  VAL  88          3HG1      VAL  88   9.496  -5.611 -11.816
  711   1HG2  VAL  88          1HG2      VAL  88   7.195  -5.720 -10.725
  712   2HG2  VAL  88          2HG2      VAL  88   7.584  -4.294  -9.762
  713   3HG2  VAL  88          3HG2      VAL  88   7.104  -5.791  -8.965
  714    HA   PRO  89           HA       PRO  89  12.800  -8.447  -7.774
  715   1HB   PRO  89          2HB       PRO  89  14.832  -7.385  -9.209
  716   2HB   PRO  89          1HB       PRO  89  14.171  -8.991  -9.537
  717   1HG   PRO  89          1HG       PRO  89  13.604  -6.390 -10.911
  718   2HG   PRO  89          2HG       PRO  89  13.893  -7.989 -11.622
  719   1HD   PRO  89          2HD       PRO  89  11.409  -6.954 -11.315
  720   2HD   PRO  89          1HD       PRO  89  11.737  -8.696 -11.217
  721    H    SER  90           H        SER  90  11.499  -5.518  -8.857
  722    HA   SER  90           HA       SER  90  12.587  -4.076  -6.603
  723   1HB   SER  90          2HB       SER  90  13.518  -2.234  -7.982
  724   2HB   SER  90          1HB       SER  90  14.398  -3.749  -8.171
  725    HG   SER  90           HG       SER  90  12.559  -2.554  -9.954
  726    H    PHE  91           H        PHE  91  11.250  -2.431  -5.953
  727    HA   PHE  91           HA       PHE  91   9.687  -1.054  -7.961
  728   1HB   PHE  91          1HB       PHE  91   7.563  -1.261  -6.939
  729   2HB   PHE  91          2HB       PHE  91   8.216  -2.890  -7.038
  730    HD1  PHE  91           1HD      PHE  91   8.906  -4.084  -5.036
  731    HD2  PHE  91           2HD      PHE  91   7.180  -0.197  -4.808
  732    HE1  PHE  91           1HE      PHE  91   8.457  -4.423  -2.641
  733    HE2  PHE  91           2HE      PHE  91   6.731  -0.527  -2.420
  734    HZ   PHE  91           HZ       PHE  91   7.370  -2.645  -1.329
  735    H    SER  92           H        SER  92   8.575   0.916  -6.970
  736    HA   SER  92           HA       SER  92  10.460   2.080  -5.026
  737   1HB   SER  92          1HB       SER  92   9.362   3.343  -7.548
  738   2HB   SER  92          2HB       SER  92  10.328   4.189  -6.342
  739    HG   SER  92           HG       SER  92  11.294   3.002  -8.357
  740    H    VAL  93           H        VAL  93   9.548   2.942  -3.302
  741    HA   VAL  93           HA       VAL  93   6.697   3.422  -3.193
  742    HB   VAL  93           HB       VAL  93   7.456   4.353  -0.835
  743   1HG1  VAL  93          1HG2      VAL  93   7.456   1.425  -1.557
  744   2HG1  VAL  93          2HG2      VAL  93   6.039   2.406  -1.186
  745   3HG1  VAL  93          3HG2      VAL  93   7.239   2.082   0.065
  746   1HG2  VAL  93          1HG1      VAL  93   9.438   3.185  -0.002
  747   2HG2  VAL  93          2HG1      VAL  93   9.832   4.315  -1.298
  748   3HG2  VAL  93          3HG1      VAL  93   9.758   2.585  -1.629
  749    H    LYS  94           H        LYS  94   9.542   5.233  -3.825
  750    HA   LYS  94           HA       LYS  94   8.869   7.794  -3.006
  751   1HB   LYS  94          2HB       LYS  94  11.045   7.187  -3.987
  752   2HB   LYS  94          1HB       LYS  94  10.279   6.992  -5.559
  753   1HG   LYS  94          2HG       LYS  94   9.682   9.365  -5.559
  754   2HG   LYS  94          1HG       LYS  94  10.471   9.557  -3.991
  755   1HD   LYS  94          1HD       LYS  94  12.068  10.285  -5.537
  756   2HD   LYS  94          2HD       LYS  94  12.566   8.640  -5.137
  757   1HE   LYS  94          2HE       LYS  94  10.923   9.388  -7.552
  758   2HE   LYS  94          1HE       LYS  94  12.672   9.170  -7.566
  759   1HZ   LYS  94          1HZ       LYS  94  10.630   7.107  -6.954
  760   2HZ   LYS  94          2HZ       LYS  94  12.295   6.873  -6.773
  761   3HZ   LYS  94          3HZ       LYS  94  11.645   7.167  -8.307
  762    H    GLU  95           H        GLU  95   7.803   5.976  -5.818
  763    HA   GLU  95           HA       GLU  95   5.930   8.134  -6.497
  764   1HB   GLU  95          1HB       GLU  95   5.498   6.621  -8.531
  765   2HB   GLU  95          2HB       GLU  95   7.037   7.469  -8.454
  766   1HG   GLU  95          1HG       GLU  95   8.115   5.441  -7.623
  767   2HG   GLU  95          2HG       GLU  95   6.574   4.590  -7.706
  768    H    HIS  96           H        HIS  96   4.414   7.838  -4.862
  769    HA   HIS  96           HA       HIS  96   3.564   5.265  -4.024
  770   1HB   HIS  96          1HB       HIS  96   2.375   7.995  -3.497
  771   2HB   HIS  96          2HB       HIS  96   1.882   6.515  -2.680
  772    HD1  HIS  96           1HD      HIS  96   4.573   9.080  -2.762
  773    HD2  HIS  96           2HD      HIS  96   3.726   5.524  -0.788
  774    HE1  HIS  96           1HE      HIS  96   6.196   8.973  -0.845
  775    HE2  HIS  96           2HE      HIS  96   5.716   6.775   0.289
  776    H    ARG  97           H        ARG  97   2.200   7.668  -6.209
  777    HA   ARG  97           HA       ARG  97  -0.357   6.587  -6.484
  778   1HB   ARG  97          2HB       ARG  97   0.284   8.790  -7.363
  779   2HB   ARG  97          1HB       ARG  97   1.304   8.016  -8.569
  780   1HG   ARG  97          2HG       ARG  97  -0.641   7.002  -9.602
  781   2HG   ARG  97          1HG       ARG  97  -1.685   7.699  -8.361
  782   1HD   ARG  97          2HD       ARG  97  -0.002   9.253 -10.324
  783   2HD   ARG  97          1HD       ARG  97  -1.743   8.995 -10.442
  784    HE   ARG  97           HE       ARG  97  -1.066  10.173  -7.955
  785   1HH1  ARG  97          2HH1      ARG  97  -1.422  10.903 -11.344
  786   2HH1  ARG  97          1HH1      ARG  97  -1.801  12.571 -11.076
  787   1HH2  ARG  97          1HH2      ARG  97  -1.564  12.369  -7.594
  788   2HH2  ARG  97          2HH2      ARG  97  -1.881  13.404  -8.946
  789    H    LYS  98           H        LYS  98   2.605   5.921  -8.330
  790    HA   LYS  98           HA       LYS  98   1.271   4.010 -10.010
  791   1HB   LYS  98          1HB       LYS  98   3.177   5.460 -10.766
  792   2HB   LYS  98          2HB       LYS  98   4.239   4.494  -9.750
  793   1HG   LYS  98          2HG       LYS  98   3.786   2.527 -11.049
  794   2HG   LYS  98          1HG       LYS  98   2.571   3.386 -11.997
  795   1HD   LYS  98          1HD       LYS  98   4.314   4.893 -12.845
  796   2HD   LYS  98          2HD       LYS  98   5.523   4.003 -11.917
  797   1HE   LYS  98          1HE       LYS  98   5.524   3.291 -14.243
  798   2HE   LYS  98          2HE       LYS  98   5.011   1.977 -13.183
  799   1HZ   LYS  98          1HZ       LYS  98   3.620   2.118 -15.148
  800   2HZ   LYS  98          2HZ       LYS  98   3.209   3.717 -14.780
  801   3HZ   LYS  98          3HZ       LYS  98   2.713   2.461 -13.762
  802    H    ILE  99           H        ILE  99   3.189   3.911  -7.105
  803    HA   ILE  99           HA       ILE  99   3.917   1.169  -7.286
  804    HB   ILE  99           HB       ILE  99   5.016   2.970  -5.832
  805   1HG1  ILE  99          1HG1      ILE  99   5.307   0.377  -5.793
  806   2HG1  ILE  99          2HG1      ILE  99   5.983   1.345  -4.487
  807   1HG2  ILE  99          1HG2      ILE  99   3.154   3.847  -4.653
  808   2HG2  ILE  99          2HG2      ILE  99   4.190   3.019  -3.486
  809   3HG2  ILE  99          3HG2      ILE  99   2.707   2.249  -4.054
  810   1HD1  ILE  99          1HD1      ILE  99   3.373  -0.149  -4.393
  811   2HD1  ILE  99          2HD1      ILE  99   4.075   0.801  -3.081
  812   3HD1  ILE  99          3HD1      ILE  99   4.890  -0.657  -3.648
  813    H    TYR 100           H        TYR 100   1.170   2.871  -5.914
  814    HA   TYR 100           HA       TYR 100   0.146   0.469  -4.673
  815   1HB   TYR 100          2HB       TYR 100  -0.695   3.334  -4.748
  816   2HB   TYR 100          1HB       TYR 100  -1.877   2.109  -4.296
  817    HD1  TYR 100           1HD      TYR 100   1.444   1.170  -3.437
  818    HD2  TYR 100           2HD      TYR 100  -1.870   3.490  -2.116
  819    HE1  TYR 100           1HE      TYR 100   2.336   1.133  -1.156
  820    HE2  TYR 100           2HE      TYR 100  -0.981   3.463   0.177
  821    HH   TYR 100           HH       TYR 100   2.175   2.465   0.913
  822    H    THR 101           H        THR 101  -0.392   2.315  -7.605
  823    HA   THR 101           HA       THR 101  -2.849   1.081  -8.317
  824    HB   THR 101           HB       THR 101  -1.996   3.207  -9.336
  825    HG1  THR 101           1HG      THR 101  -2.607   2.410 -11.570
  826   1HG2  THR 101          1HG2      THR 101   0.314   2.513  -9.729
  827   2HG2  THR 101          2HG2      THR 101  -0.451   3.033 -11.231
  828   3HG2  THR 101          3HG2      THR 101  -0.239   1.314 -10.897
  829    H    MET 102           H        MET 102   0.510   0.174  -8.690
  830    HA   MET 102           HA       MET 102   0.013  -2.113 -10.335
  831   1HB   MET 102          1HB       MET 102   2.275  -1.639  -8.384
  832   2HB   MET 102          2HB       MET 102   2.237  -2.857  -9.651
  833   1HG   MET 102          2HG       MET 102   2.180  -1.103 -11.341
  834   2HG   MET 102          1HG       MET 102   2.210   0.112 -10.066
  835   1HE   MET 102          1HE       MET 102   5.730  -0.604  -8.434
  836   2HE   MET 102          2HE       MET 102   4.140  -1.214  -7.977
  837   3HE   MET 102          3HE       MET 102   4.340   0.482  -8.416
  838    H    ILE 103           H        ILE 103   0.415  -1.607  -6.839
  839    HA   ILE 103           HA       ILE 103   0.386  -4.205  -5.992
  840    HB   ILE 103           HB       ILE 103  -0.832  -1.798  -4.644
  841   1HG1  ILE 103          2HG1      ILE 103   1.786  -3.261  -4.232
  842   2HG1  ILE 103          1HG1      ILE 103   1.595  -1.710  -5.042
  843   1HG2  ILE 103          1HG2      ILE 103  -0.293  -4.529  -3.481
  844   2HG2  ILE 103          2HG2      ILE 103  -1.878  -3.805  -3.755
  845   3HG2  ILE 103          3HG2      ILE 103  -0.780  -3.101  -2.567
  846   1HD1  ILE 103          1HD1      ILE 103   2.407  -1.390  -2.800
  847   2HD1  ILE 103          2HD1      ILE 103   1.037  -2.287  -2.145
  848   3HD1  ILE 103          3HD1      ILE 103   0.776  -0.737  -2.945
  849    H    TYR 104           H        TYR 104  -2.378  -2.198  -6.872
  850    HA   TYR 104           HA       TYR 104  -4.173  -4.468  -6.373
  851   1HB   TYR 104          2HB       TYR 104  -4.773  -1.542  -6.850
  852   2HB   TYR 104          1HB       TYR 104  -5.998  -2.788  -6.634
  853    HD1  TYR 104           1HD      TYR 104  -6.407  -3.770  -4.454
  854    HD2  TYR 104           2HD      TYR 104  -3.422  -0.783  -4.973
  855    HE1  TYR 104           1HE      TYR 104  -6.298  -3.464  -2.017
  856    HE2  TYR 104           2HE      TYR 104  -3.304  -0.469  -2.536
  857    HH   TYR 104           HH       TYR 104  -4.718  -0.837  -0.562
  858    H    ARG 105           H        ARG 105  -4.505  -5.744  -8.058
  859    HA   ARG 105           HA       ARG 105  -5.042  -4.520 -10.668
  860   1HB   ARG 105          1HB       ARG 105  -2.709  -5.295 -10.701
  861   2HB   ARG 105          2HB       ARG 105  -3.234  -6.905 -10.226
  862   1HG   ARG 105          2HG       ARG 105  -4.475  -7.125 -12.314
  863   2HG   ARG 105          1HG       ARG 105  -3.964  -5.505 -12.790
  864   1HD   ARG 105          2HD       ARG 105  -2.584  -7.202 -13.861
  865   2HD   ARG 105          1HD       ARG 105  -1.630  -6.225 -12.746
  866    HE   ARG 105           HE       ARG 105  -2.549  -8.499 -11.389
  867   1HH1  ARG 105          2HH1      ARG 105  -0.341  -7.626 -13.939
  868   2HH1  ARG 105          1HH1      ARG 105   0.721  -8.964 -13.653
  869   1HH2  ARG 105          1HH2      ARG 105  -1.156 -10.262 -11.005
  870   2HH2  ARG 105          2HH2      ARG 105   0.258 -10.463 -11.985
  871    H    ASN 106           H        ASN 106  -5.527  -7.062  -8.365
  872    HA   ASN 106           HA       ASN 106  -7.293  -8.600 -10.049
  873   1HB   ASN 106          2HB       ASN 106  -6.778  -8.763  -7.071
  874   2HB   ASN 106          1HB       ASN 106  -7.697  -9.933  -8.013
  875   1HD2  ASN 106          2HD2      ASN 106  -5.911  -9.732 -10.310
  876   2HD2  ASN 106          1HD2      ASN 106  -4.478 -10.595  -9.875
  877    H    LEU 107           H        LEU 107  -9.548  -9.023  -9.445
  878    HA   LEU 107           HA       LEU 107 -10.872  -6.515  -8.753
  879   1HB   LEU 107          1HB       LEU 107 -11.880  -9.061 -10.016
  880   2HB   LEU 107          2HB       LEU 107 -12.926  -7.726  -9.582
  881    HG   LEU 107           HG       LEU 107 -12.476  -7.593 -11.929
  882   1HD1  LEU 107          1HD1      LEU 107 -12.563  -5.466 -10.755
  883   2HD1  LEU 107          2HD1      LEU 107 -11.433  -5.390 -12.105
  884   3HD1  LEU 107          3HD1      LEU 107 -10.827  -5.544 -10.457
  885   1HD2  LEU 107          1HD2      LEU 107  -9.548  -7.643 -11.217
  886   2HD2  LEU 107          2HD2      LEU 107 -10.216  -7.405 -12.832
  887   3HD2  LEU 107          3HD2      LEU 107 -10.453  -8.941 -11.998
  888    H    VAL 108           H        VAL 108  -9.789  -7.528  -6.528
  889    HA   VAL 108           HA       VAL 108 -12.113  -8.600  -5.071
  890    HB   VAL 108           HB       VAL 108  -9.242  -9.256  -4.408
  891   1HG1  VAL 108          1HG1      VAL 108 -10.246 -10.956  -2.954
  892   2HG1  VAL 108          2HG1      VAL 108 -11.854 -10.390  -3.407
  893   3HG1  VAL 108          3HG1      VAL 108 -10.766  -9.330  -2.509
  894   1HG2  VAL 108          1HG2      VAL 108  -9.702 -11.494  -5.300
  895   2HG2  VAL 108          2HG2      VAL 108  -9.818 -10.255  -6.550
  896   3HG2  VAL 108          3HG2      VAL 108 -11.284 -10.945  -5.851
  897    H    VAL 109           H        VAL 109 -12.558  -6.321  -4.673
  898    HA   VAL 109           HA       VAL 109 -11.086  -5.330  -2.345
  899    HB   VAL 109           HB       VAL 109 -11.086  -3.027  -3.250
  900   1HG1  VAL 109          1HG1      VAL 109  -9.607  -5.039  -4.942
  901   2HG1  VAL 109          2HG1      VAL 109  -9.069  -4.379  -3.397
  902   3HG1  VAL 109          3HG1      VAL 109  -9.214  -3.325  -4.804
  903   1HG2  VAL 109          1HG2      VAL 109 -11.433  -2.670  -5.653
  904   2HG2  VAL 109          2HG2      VAL 109 -12.898  -3.245  -4.857
  905   3HG2  VAL 109          3HG2      VAL 109 -11.927  -4.355  -5.824
  906    H    VAL 110           H        VAL 110 -12.381  -2.905  -2.070
  907    HA   VAL 110           HA       VAL 110 -14.174  -2.179  -0.859
  908    HB   VAL 110           HB       VAL 110 -14.753  -1.256  -2.922
  909   1HG1  VAL 110          1HG1      VAL 110 -15.862  -2.451  -4.732
  910   2HG1  VAL 110          2HG1      VAL 110 -15.814  -3.937  -3.785
  911   3HG1  VAL 110          3HG1      VAL 110 -14.312  -3.189  -4.328
  912   1HG2  VAL 110          1HG2      VAL 110 -17.181  -2.752  -1.950
  913   2HG2  VAL 110          2HG2      VAL 110 -17.197  -1.325  -2.985
  914   3HG2  VAL 110          3HG2      VAL 110 -16.587  -1.210  -1.334
  915    H    ASN 111           H        ASN 111 -16.211  -4.467  -2.620
  916    HA   ASN 111           HA       ASN 111 -17.752  -5.959  -1.865
  917   1HB   ASN 111          2HB       ASN 111 -15.674  -7.260  -1.518
  918   2HB   ASN 111          1HB       ASN 111 -15.569  -6.627   0.121
  919   1HD2  ASN 111          2HD2      ASN 111 -16.977  -7.370   1.688
  920   2HD2  ASN 111          1HD2      ASN 111 -17.942  -8.785   1.470
  921    H    GLN 112           H        GLN 112 -19.091  -4.170  -1.133
  922    HA   GLN 112           HA       GLN 112 -19.948  -4.555   1.556
  923   1HB   GLN 112          2HB       GLN 112 -19.585  -2.279   2.377
  924   2HB   GLN 112          1HB       GLN 112 -18.057  -3.062   2.004
  925   1HG   GLN 112          1HG       GLN 112 -17.950  -1.852  -0.113
  926   2HG   GLN 112          2HG       GLN 112 -19.486  -1.069   0.258
  927   1HE2  GLN 112          2HE2      GLN 112 -16.103  -1.256   1.019
  928   2HE2  GLN 112          1HE2      GLN 112 -16.021   0.201   1.942
  929    H    GLN 113           H        GLN 113 -21.772  -2.989   2.100
  930    HA   GLN 113           HA       GLN 113 -23.347  -2.567  -0.343
  931   1HB   GLN 113          1HB       GLN 113 -24.263  -2.878   2.522
  932   2HB   GLN 113          2HB       GLN 113 -25.320  -2.662   1.132
  933   1HG   GLN 113          2HG       GLN 113 -23.471  -4.992   1.601
  934   2HG   GLN 113          1HG       GLN 113 -25.221  -4.991   1.825
  935   1HE2  GLN 113          2HE2      GLN 113 -22.622  -4.970  -0.477
  936   2HE2  GLN 113          1HE2      GLN 113 -23.575  -5.354  -1.865
  937    H    GLU 114           H        GLU 114 -21.952  -0.546  -0.483
  938    HA   GLU 114           HA       GLU 114 -23.549   1.683   0.325
  939   1HB   GLU 114          1HB       GLU 114 -22.284   1.331   2.399
  940   2HB   GLU 114          2HB       GLU 114 -20.775   1.427   1.502
  941   1HG   GLU 114          1HG       GLU 114 -21.270   3.742   0.909
  942   2HG   GLU 114          2HG       GLU 114 -22.786   3.646   1.803
  943    H    SER 115           H        SER 115 -23.640   2.235  -1.819
  944    HA   SER 115           HA       SER 115 -21.324   3.593  -2.882
  945   1HB   SER 115          2HB       SER 115 -20.901   1.318  -3.667
  946   2HB   SER 115          1HB       SER 115 -22.521   1.235  -4.356
  947    HG   SER 115           HG       SER 115 -21.314   1.834  -6.043
  948    H    SER 116           H        SER 116 -24.617   2.433  -3.484
  949    HA   SER 116           HA       SER 116 -25.275   5.084  -4.558
  950   1HB   SER 116          1HB       SER 116 -26.100   2.450  -5.804
  951   2HB   SER 116          2HB       SER 116 -26.669   4.039  -6.314
  952    HG   SER 116           HG       SER 116 -23.957   3.916  -6.193
  953    H    ASP 117           H        ASP 117 -27.765   5.252  -4.803
  954    HA   ASP 117           HA       ASP 117 -29.125   3.820  -2.632
  955   1HB   ASP 117          2HB       ASP 117 -30.146   5.926  -1.852
  956   2HB   ASP 117          1HB       ASP 117 -28.393   5.948  -1.683
  957    H    SER 118           H        SER 118 -31.284   3.430  -2.959
  958    HA   SER 118           HA       SER 118 -32.393   4.340  -5.534
  959   1HB   SER 118          2HB       SER 118 -33.609   2.192  -5.653
  960   2HB   SER 118          1HB       SER 118 -31.862   1.951  -5.615
  961    HG   SER 118           HG       SER 118 -33.352   1.919  -3.229
  962    H    SER 119           H        SER 119 -32.610   5.242  -2.600
  963    HA   SER 119           HA       SER 119 -35.484   4.930  -2.179
  964   1HB   SER 119          2HB       SER 119 -34.028   4.592  -0.238
  965   2HB   SER 119          1HB       SER 119 -33.366   6.213  -0.436
  966    HG   SER 119           HG       SER 119 -34.987   6.244   1.124
  Start of MODEL   20
    1   1H    MET   1          1H        MET   1  15.497   6.617  28.973
    2   2H    MET   1          2H        MET   1  16.987   7.411  29.060
    3   3H    MET   1          3H        MET   1  15.681   8.148  28.277
    4    HA   MET   1           HA       MET   1  14.472   8.315  30.335
    5   1HB   MET   1          2HB       MET   1  16.972   7.113  31.544
    6   2HB   MET   1          1HB       MET   1  15.611   7.750  32.454
    7   1HG   MET   1          1HG       MET   1  15.532   5.402  30.573
    8   2HG   MET   1          2HG       MET   1  15.548   5.324  32.333
    9   1HE   MET   1          1HE       MET   1  13.654   7.773  33.092
   10   2HE   MET   1          2HE       MET   1  13.556   6.194  33.870
   11   3HE   MET   1          3HE       MET   1  12.098   6.957  33.235
   12    H    CYS   2           H        CYS   2  15.423  10.174  28.809
   13    HA   CYS   2           HA       CYS   2  17.055  11.880  30.572
   14   1HB   CYS   2          2HB       CYS   2  17.098  11.810  27.548
   15   2HB   CYS   2          1HB       CYS   2  17.995  12.943  28.553
   16    HG   CYS   2           HG       CYS   2  19.249  10.558  29.852
   17    H    ASN   3           H        ASN   3  14.255  11.742  30.663
   18    HA   ASN   3           HA       ASN   3  12.382  13.028  30.634
   19   1HB   ASN   3          1HB       ASN   3  13.842  14.616  31.807
   20   2HB   ASN   3          2HB       ASN   3  14.388  15.266  30.263
   21   1HD2  ASN   3          1HD2      ASN   3  13.666  17.325  30.745
   22   2HD2  ASN   3          2HD2      ASN   3  11.989  17.737  30.766
   23    H    THR   4           H        THR   4  11.706  12.048  28.651
   24    HA   THR   4           HA       THR   4  11.645  13.961  26.423
   25    HB   THR   4           HB       THR   4  13.337  12.321  25.817
   26    HG1  THR   4           1HG      THR   4  11.188  11.437  24.274
   27   1HG2  THR   4          1HG2      THR   4  11.171  10.258  26.236
   28   2HG2  THR   4          2HG2      THR   4  12.607  10.471  27.236
   29   3HG2  THR   4          3HG2      THR   4  12.771   9.947  25.561
   30    H    ASN   5           H        ASN   5   9.928  13.403  24.814
   31    HA   ASN   5           HA       ASN   5   7.725  13.117  24.334
   32   1HB   ASN   5          2HB       ASN   5   8.338  10.744  24.427
   33   2HB   ASN   5          1HB       ASN   5   8.029  10.724  26.161
   34   1HD2  ASN   5          2HD2      ASN   5   6.608  10.865  22.997
   35   2HD2  ASN   5          1HD2      ASN   5   4.989  10.514  23.485
   36    H    MET   6           H        MET   6   7.099  15.045  25.385
   37    HA   MET   6           HA       MET   6   5.496  14.568  27.797
   38   1HB   MET   6          1HB       MET   6   6.211  16.743  28.716
   39   2HB   MET   6          2HB       MET   6   7.549  15.612  28.567
   40   1HG   MET   6          2HG       MET   6   8.262  16.726  26.513
   41   2HG   MET   6          1HG       MET   6   6.922  17.861  26.669
   42   1HE   MET   6          1HE       MET   6  10.068  20.061  27.493
   43   2HE   MET   6          2HE       MET   6   8.639  19.894  26.473
   44   3HE   MET   6          3HE       MET   6   9.970  18.747  26.321
   45    H    SER   7           H        SER   7   5.863  15.954  24.715
   46    HA   SER   7           HA       SER   7   3.115  16.822  24.712
   47   1HB   SER   7          1HB       SER   7   3.608  19.123  23.953
   48   2HB   SER   7          2HB       SER   7   4.196  18.832  25.590
   49    HG   SER   7           HG       SER   7   6.205  18.988  24.916
   50    H    VAL   8           H        VAL   8   4.920  14.904  23.350
   51    HA   VAL   8           HA       VAL   8   4.745  15.885  20.583
   52    HB   VAL   8           HB       VAL   8   6.303  13.519  21.633
   53   1HG1  VAL   8          1HG1      VAL   8   7.391  13.559  19.436
   54   2HG1  VAL   8          2HG1      VAL   8   6.315  14.863  18.933
   55   3HG1  VAL   8          3HG1      VAL   8   5.656  13.268  19.301
   56   1HG2  VAL   8          1HG2      VAL   8   7.208  15.605  22.498
   57   2HG2  VAL   8          2HG2      VAL   8   7.255  16.278  20.868
   58   3HG2  VAL   8          3HG2      VAL   8   8.291  14.914  21.289
   59    HA   PRO   9           HA       PRO   9   1.049  13.207  20.584
   60   1HB   PRO   9          2HB       PRO   9   1.020  14.272  17.807
   61   2HB   PRO   9          1HB       PRO   9  -0.284  14.194  18.996
   62   1HG   PRO   9          1HG       PRO   9   0.917  16.507  18.445
   63   2HG   PRO   9          2HG       PRO   9   0.435  16.101  20.104
   64   1HD   PRO   9          2HD       PRO   9   3.146  16.042  18.846
   65   2HD   PRO   9          1HD       PRO   9   2.675  16.525  20.488
   66    H    THR  10           H        THR  10   0.927  11.125  19.991
   67    HA   THR  10           HA       THR  10   3.042  10.018  18.343
   68    HB   THR  10           HB       THR  10   2.486   8.832  20.386
   69    HG1  THR  10           1HG      THR  10   3.148   7.370  18.920
   70   1HG2  THR  10          1HG2      THR  10  -0.263   8.480  19.183
   71   2HG2  THR  10          2HG2      THR  10   0.136   9.482  20.577
   72   3HG2  THR  10          3HG2      THR  10   0.313   7.731  20.672
   73    H    ASP  11           H        ASP  11  -0.239  10.953  18.004
   74    HA   ASP  11           HA       ASP  11  -0.219  10.209  15.221
   75   1HB   ASP  11          2HB       ASP  11  -1.007   8.121  16.232
   76   2HB   ASP  11          1HB       ASP  11  -2.275   8.998  17.083
   77    H    GLY  12           H        GLY  12  -1.129  11.816  14.125
   78   1HA   GLY  12          2HA       GLY  12  -3.582  12.970  14.468
   79   2HA   GLY  12          1HA       GLY  12  -2.525  13.914  15.507
   80    H    ALA  13           H        ALA  13  -0.198  13.791  13.875
   81    HA   ALA  13           HA       ALA  13  -0.894  15.851  11.971
   82   1HB   ALA  13          1HB       ALA  13   1.512  16.101  11.667
   83   2HB   ALA  13          2HB       ALA  13   1.795  14.653  12.633
   84   3HB   ALA  13          3HB       ALA  13   1.093  16.089  13.380
   85    H    VAL  14           H        VAL  14   0.763  15.608   9.898
   86    HA   VAL  14           HA       VAL  14  -0.499  13.584   8.318
   87    HB   VAL  14           HB       VAL  14   0.279  15.917   7.567
   88   1HG1  VAL  14          1HG2      VAL  14   2.579  15.781   8.323
   89   2HG1  VAL  14          2HG2      VAL  14   2.507  16.039   6.579
   90   3HG1  VAL  14          3HG2      VAL  14   2.871  14.436   7.219
   91   1HG2  VAL  14          1HG1      VAL  14   0.626  15.171   5.261
   92   2HG2  VAL  14          2HG1      VAL  14  -0.710  14.330   6.047
   93   3HG2  VAL  14          3HG1      VAL  14   0.843  13.521   5.846
   94    H    THR  15           H        THR  15   1.766  12.996   6.618
   95    HA   THR  15           HA       THR  15   3.511  11.340   8.246
   96    HB   THR  15           HB       THR  15   1.802   9.985   6.164
   97    HG1  THR  15           1HG      THR  15   0.484  10.785   7.910
   98   1HG2  THR  15          1HG2      THR  15   3.895   8.867   6.762
   99   2HG2  THR  15          2HG2      THR  15   2.507   7.950   7.341
  100   3HG2  THR  15          3HG2      THR  15   3.450   8.929   8.466
  101    H    THR  16           H        THR  16   3.624  13.539   6.210
  102    HA   THR  16           HA       THR  16   4.987  14.207   4.520
  103    HB   THR  16           HB       THR  16   6.382  11.554   4.930
  104    HG1  THR  16           1HG      THR  16   7.411  12.502   6.547
  105   1HG2  THR  16          1HG2      THR  16   6.942  12.598   2.791
  106   2HG2  THR  16          2HG2      THR  16   8.310  12.672   3.902
  107   3HG2  THR  16          3HG2      THR  16   7.326  14.108   3.619
  108    H    SER  17           H        SER  17   5.227  10.756   3.764
  109    HA   SER  17           HA       SER  17   4.317  11.270   1.072
  110   1HB   SER  17          2HB       SER  17   4.836   8.886   0.687
  111   2HB   SER  17          1HB       SER  17   6.188   9.736   1.437
  112    HG   SER  17           HG       SER  17   4.609   8.766   3.355
  113    H    GLN  18           H        GLN  18   2.586  10.105   0.046
  114    HA   GLN  18           HA       GLN  18   0.648   8.709   1.672
  115   1HB   GLN  18          1HB       GLN  18  -1.192  10.251   0.887
  116   2HB   GLN  18          2HB       GLN  18  -0.169  10.865   2.180
  117   1HG   GLN  18          2HG       GLN  18   1.109  12.138   0.488
  118   2HG   GLN  18          1HG       GLN  18   0.007  11.530  -0.751
  119   1HE2  GLN  18          2HE2      GLN  18  -2.311  11.703   1.020
  120   2HE2  GLN  18          1HE2      GLN  18  -2.710  13.380   1.124
  121    H    ILE  19           H        ILE  19  -1.527   9.261  -0.096
  122    HA   ILE  19           HA       ILE  19  -0.489   8.966  -2.759
  123    HB   ILE  19           HB       ILE  19  -1.286   6.918  -3.252
  124   1HG1  ILE  19          2HG1      ILE  19  -3.662   7.314  -1.416
  125   2HG1  ILE  19          1HG1      ILE  19  -3.642   7.800  -3.108
  126   1HG2  ILE  19          1HG2      ILE  19  -0.178   6.049  -1.483
  127   2HG2  ILE  19          2HG2      ILE  19  -1.812   5.596  -0.988
  128   3HG2  ILE  19          3HG2      ILE  19  -1.050   7.040  -0.308
  129   1HD1  ILE  19          1HD1      ILE  19  -3.332   4.997  -2.067
  130   2HD1  ILE  19          2HD1      ILE  19  -3.275   5.475  -3.763
  131   3HD1  ILE  19          3HD1      ILE  19  -4.764   5.679  -2.839
  132    HA   PRO  20           HA       PRO  20  -3.751  11.675  -3.976
  133   1HB   PRO  20          2HB       PRO  20  -4.475   9.860  -6.194
  134   2HB   PRO  20          1HB       PRO  20  -3.904  11.530  -6.250
  135   1HG   PRO  20          2HG       PRO  20  -2.325   9.496  -6.985
  136   2HG   PRO  20          1HG       PRO  20  -1.676  10.912  -6.134
  137   1HD   PRO  20          1HD       PRO  20  -2.320   8.186  -5.067
  138   2HD   PRO  20          2HD       PRO  20  -0.936   9.237  -4.705
  139    H    ALA  21           H        ALA  21  -5.008  11.048  -2.069
  140    HA   ALA  21           HA       ALA  21  -7.570   9.909  -2.788
  141   1HB   ALA  21          1HB       ALA  21  -6.265   7.913  -2.228
  142   2HB   ALA  21          2HB       ALA  21  -7.553   8.195  -1.055
  143   3HB   ALA  21          3HB       ALA  21  -5.886   8.604  -0.651
  144    H    SER  22           H        SER  22  -8.721   9.591  -0.367
  145    HA   SER  22           HA       SER  22  -8.548  12.309   0.743
  146   1HB   SER  22          2HB       SER  22 -10.700  11.732  -0.328
  147   2HB   SER  22          1HB       SER  22 -10.883  10.382   0.793
  148    HG   SER  22           HG       SER  22 -10.746  13.136   1.473
  149    H    GLU  23           H        GLU  23  -6.854  10.094   1.567
  150    HA   GLU  23           HA       GLU  23  -6.058   9.075   3.436
  151   1HB   GLU  23          1HB       GLU  23  -6.032  11.421   4.204
  152   2HB   GLU  23          2HB       GLU  23  -7.661  11.225   4.834
  153   1HG   GLU  23          1HG       GLU  23  -6.858   9.528   6.394
  154   2HG   GLU  23          2HG       GLU  23  -5.223   9.724   5.764
  155    H    GLN  24           H        GLN  24  -6.988   7.074   3.392
  156    HA   GLN  24           HA       GLN  24  -8.339   5.335   3.967
  157   1HB   GLN  24          1HB       GLN  24  -8.072   6.152   6.268
  158   2HB   GLN  24          2HB       GLN  24  -9.424   7.253   6.040
  159   1HG   GLN  24          1HG       GLN  24 -10.921   5.348   5.720
  160   2HG   GLN  24          2HG       GLN  24  -9.564   4.247   5.958
  161   1HE2  GLN  24          2HE2      GLN  24 -10.514   3.277   7.737
  162   2HE2  GLN  24          1HE2      GLN  24 -10.639   4.070   9.268
  163    H    GLU  25           H        GLU  25 -10.420   4.508   3.491
  164    HA   GLU  25           HA       GLU  25 -12.547   6.120   2.532
  165   1HB   GLU  25          1HB       GLU  25 -12.074   5.711   0.076
  166   2HB   GLU  25          2HB       GLU  25 -11.059   6.913   0.863
  167   1HG   GLU  25          2HG       GLU  25  -9.236   5.376   1.012
  168   2HG   GLU  25          1HG       GLU  25 -10.246   4.043   0.450
  169    H    THR  26           H        THR  26 -10.730   3.211   1.570
  170    HA   THR  26           HA       THR  26 -13.303   1.846   1.133
  171    HB   THR  26           HB       THR  26 -10.653   1.342  -0.221
  172    HG1  THR  26           1HG      THR  26 -11.454   3.246  -1.029
  173   1HG2  THR  26          1HG2      THR  26 -12.053  -0.656  -0.090
  174   2HG2  THR  26          2HG2      THR  26 -11.965  -0.063  -1.749
  175   3HG2  THR  26          3HG2      THR  26 -13.408   0.235  -0.781
  176    H    LEU  27           H        LEU  27 -13.720   0.252   2.551
  177    HA   LEU  27           HA       LEU  27 -11.627  -1.120   3.944
  178   1HB   LEU  27          1HB       LEU  27 -14.151  -0.796   4.612
  179   2HB   LEU  27          2HB       LEU  27 -14.378  -2.251   3.659
  180    HG   LEU  27           HG       LEU  27 -14.139  -2.864   5.982
  181   1HD1  LEU  27          1HD2      LEU  27 -12.270  -4.395   5.850
  182   2HD1  LEU  27          2HD2      LEU  27 -11.576  -3.471   4.518
  183   3HD1  LEU  27          3HD2      LEU  27 -13.101  -4.333   4.295
  184   1HD2  LEU  27          1HD1      LEU  27 -11.863  -2.406   7.061
  185   2HD2  LEU  27          2HD1      LEU  27 -13.022  -1.076   6.988
  186   3HD2  LEU  27          3HD1      LEU  27 -11.685  -1.146   5.836
  187    H    VAL  28           H        VAL  28 -10.453  -1.518   1.942
  188    HA   VAL  28           HA       VAL  28 -11.540  -3.378   0.040
  189    HB   VAL  28           HB       VAL  28 -10.056  -2.030  -1.068
  190   1HG1  VAL  28          1HG1      VAL  28  -8.334  -2.103   1.398
  191   2HG1  VAL  28          2HG1      VAL  28  -9.320  -0.752   0.822
  192   3HG1  VAL  28          3HG1      VAL  28  -7.900  -1.265  -0.095
  193   1HG2  VAL  28          1HG2      VAL  28  -9.327  -4.273  -1.535
  194   2HG2  VAL  28          2HG2      VAL  28  -8.336  -4.299  -0.074
  195   3HG2  VAL  28          3HG2      VAL  28  -7.903  -3.236  -1.417
  196    H    ARG  29           H        ARG  29 -11.020  -5.507  -0.201
  197    HA   ARG  29           HA       ARG  29  -9.654  -6.699   2.103
  198   1HB   ARG  29          2HB       ARG  29 -12.179  -7.804   0.870
  199   2HB   ARG  29          1HB       ARG  29 -11.415  -8.295   2.376
  200   1HG   ARG  29          2HG       ARG  29 -11.985  -6.174   3.399
  201   2HG   ARG  29          1HG       ARG  29 -12.666  -5.592   1.879
  202   1HD   ARG  29          2HD       ARG  29 -13.669  -7.941   3.488
  203   2HD   ARG  29          1HD       ARG  29 -14.414  -6.345   3.413
  204    HE   ARG  29           HE       ARG  29 -14.179  -7.354   0.808
  205   1HH1  ARG  29          2HH1      ARG  29 -15.938  -7.959   3.754
  206   2HH1  ARG  29          1HH1      ARG  29 -17.319  -8.620   2.945
  207   1HH2  ARG  29          1HH2      ARG  29 -15.993  -8.222  -0.265
  208   2HH2  ARG  29          2HH2      ARG  29 -17.350  -8.770   0.661
  209    HA   PRO  30           HA       PRO  30  -7.982  -7.872  -2.034
  210   1HB   PRO  30          1HB       PRO  30  -5.509  -8.320  -0.462
  211   2HB   PRO  30          2HB       PRO  30  -5.757  -7.356  -1.921
  212   1HG   PRO  30          2HG       PRO  30  -5.398  -6.185   0.447
  213   2HG   PRO  30          1HG       PRO  30  -6.543  -5.524  -0.736
  214   1HD   PRO  30          1HD       PRO  30  -7.081  -7.156   1.717
  215   2HD   PRO  30          2HD       PRO  30  -7.964  -5.751   1.084
  216    H    LYS  31           H        LYS  31  -7.668  -9.826  -2.991
  217    HA   LYS  31           HA       LYS  31  -8.067 -12.286  -1.771
  218   1HB   LYS  31          2HB       LYS  31  -8.030 -11.806  -4.243
  219   2HB   LYS  31          1HB       LYS  31  -6.275 -11.774  -4.152
  220   1HG   LYS  31          2HG       LYS  31  -6.867 -13.912  -4.942
  221   2HG   LYS  31          1HG       LYS  31  -6.386 -14.122  -3.257
  222   1HD   LYS  31          2HD       LYS  31  -8.373 -15.417  -3.670
  223   2HD   LYS  31          1HD       LYS  31  -8.782 -14.062  -2.616
  224   1HE   LYS  31          2HE       LYS  31  -9.643 -12.825  -4.543
  225   2HE   LYS  31          1HE       LYS  31  -9.237 -14.181  -5.596
  226   1HZ   LYS  31          1HZ       LYS  31 -11.185 -14.252  -3.353
  227   2HZ   LYS  31          2HZ       LYS  31 -10.792 -15.557  -4.354
  228   3HZ   LYS  31          3HZ       LYS  31 -11.573 -14.203  -5.000
  229    HA   PRO  32           HA       PRO  32  -4.835 -12.912   1.083
  230   1HB   PRO  32          2HB       PRO  32  -4.628 -15.587  -0.257
  231   2HB   PRO  32          1HB       PRO  32  -4.653 -15.196   1.468
  232   1HG   PRO  32          2HG       PRO  32  -6.844 -16.091   0.234
  233   2HG   PRO  32          1HG       PRO  32  -6.944 -14.842   1.487
  234   1HD   PRO  32          1HD       PRO  32  -7.302 -14.609  -1.442
  235   2HD   PRO  32          2HD       PRO  32  -7.948 -13.593  -0.139
  236    H    LEU  33           H        LEU  33  -3.354 -11.437   0.144
  237    HA   LEU  33           HA       LEU  33  -1.010 -12.754  -0.952
  238   1HB   LEU  33          2HB       LEU  33  -2.510 -10.574  -2.377
  239   2HB   LEU  33          1HB       LEU  33  -0.795 -10.821  -2.642
  240    HG   LEU  33           HG       LEU  33  -2.978 -12.844  -3.180
  241   1HD1  LEU  33          1HD1      LEU  33  -2.978 -11.000  -4.771
  242   2HD1  LEU  33          2HD1      LEU  33  -2.405 -12.487  -5.528
  243   3HD1  LEU  33          3HD1      LEU  33  -1.254 -11.236  -5.058
  244   1HD2  LEU  33          1HD2      LEU  33  -0.008 -12.995  -3.682
  245   2HD2  LEU  33          2HD2      LEU  33  -1.206 -14.182  -4.197
  246   3HD2  LEU  33          3HD2      LEU  33  -0.905 -13.920  -2.480
  247    H    LEU  34           H        LEU  34  -2.475  -9.680   0.049
  248    HA   LEU  34           HA       LEU  34   0.136  -8.581   0.676
  249   1HB   LEU  34          1HB       LEU  34  -2.660  -7.465   0.676
  250   2HB   LEU  34          2HB       LEU  34  -1.320  -6.579   1.375
  251    HG   LEU  34           HG       LEU  34  -1.741  -5.775  -0.859
  252   1HD1  LEU  34          1HD1      LEU  34   0.758  -7.452  -0.720
  253   2HD1  LEU  34          2HD1      LEU  34   0.566  -5.797  -0.139
  254   3HD1  LEU  34          3HD1      LEU  34   0.469  -6.141  -1.865
  255   1HD2  LEU  34          1HD2      LEU  34  -2.835  -7.746  -1.777
  256   2HD2  LEU  34          2HD2      LEU  34  -1.302  -8.617  -1.763
  257   3HD2  LEU  34          3HD2      LEU  34  -1.513  -7.220  -2.817
  258    H    LEU  35           H        LEU  35  -2.458 -10.179   2.187
  259    HA   LEU  35           HA       LEU  35  -1.961  -8.969   4.772
  260   1HB   LEU  35          1HB       LEU  35  -3.944 -11.143   4.532
  261   2HB   LEU  35          2HB       LEU  35  -4.061  -9.604   5.364
  262    HG   LEU  35           HG       LEU  35  -4.154  -8.652   2.899
  263   1HD1  LEU  35          1HD2      LEU  35  -5.209 -11.455   2.586
  264   2HD1  LEU  35          2HD2      LEU  35  -3.752 -10.808   1.830
  265   3HD1  LEU  35          3HD2      LEU  35  -5.336 -10.160   1.394
  266   1HD2  LEU  35          1HD1      LEU  35  -6.576 -10.032   4.025
  267   2HD2  LEU  35          2HD1      LEU  35  -6.505  -8.548   3.071
  268   3HD2  LEU  35          3HD1      LEU  35  -5.893  -8.565   4.724
  269    H    LYS  36           H        LYS  36  -1.325 -11.904   3.045
  270    HA   LYS  36           HA       LYS  36  -0.124 -13.253   5.270
  271   1HB   LYS  36          1HB       LYS  36   0.106 -13.483   2.284
  272   2HB   LYS  36          2HB       LYS  36   1.234 -14.331   3.329
  273   1HG   LYS  36          1HG       LYS  36  -0.526 -15.828   2.722
  274   2HG   LYS  36          2HG       LYS  36  -0.692 -15.434   4.434
  275   1HD   LYS  36          2HD       LYS  36  -2.413 -13.771   3.868
  276   2HD   LYS  36          1HD       LYS  36  -2.267 -14.218   2.165
  277   1HE   LYS  36          1HE       LYS  36  -4.182 -15.320   3.194
  278   2HE   LYS  36          2HE       LYS  36  -2.965 -16.498   2.702
  279   1HZ   LYS  36          1HZ       LYS  36  -3.838 -16.999   4.893
  280   2HZ   LYS  36          2HZ       LYS  36  -3.368 -15.476   5.462
  281   3HZ   LYS  36          3HZ       LYS  36  -2.195 -16.603   4.992
  282    H    LEU  37           H        LEU  37   0.500 -10.396   3.711
  283    HA   LEU  37           HA       LEU  37   3.350 -10.458   4.448
  284   1HB   LEU  37          2HB       LEU  37   3.035 -10.069   2.074
  285   2HB   LEU  37          1HB       LEU  37   1.897  -8.773   2.401
  286    HG   LEU  37           HG       LEU  37   4.417  -8.239   3.695
  287   1HD1  LEU  37          1HD2      LEU  37   5.525  -9.500   2.033
  288   2HD1  LEU  37          2HD2      LEU  37   5.646  -7.811   1.534
  289   3HD1  LEU  37          3HD2      LEU  37   4.476  -8.877   0.760
  290   1HD2  LEU  37          1HD1      LEU  37   3.287  -6.731   1.387
  291   2HD2  LEU  37          2HD1      LEU  37   4.071  -6.131   2.849
  292   3HD2  LEU  37          3HD1      LEU  37   2.421  -6.764   2.928
  293    H    LEU  38           H        LEU  38   0.319  -9.234   5.251
  294    HA   LEU  38           HA       LEU  38   1.465  -6.838   6.518
  295   1HB   LEU  38          1HB       LEU  38  -1.223  -7.399   5.331
  296   2HB   LEU  38          2HB       LEU  38  -1.027  -6.119   6.514
  297    HG   LEU  38           HG       LEU  38   0.337  -6.319   3.826
  298   1HD1  LEU  38          1HD2      LEU  38  -1.570  -4.211   4.791
  299   2HD1  LEU  38          2HD2      LEU  38  -2.117  -5.671   3.957
  300   3HD1  LEU  38          3HD2      LEU  38  -1.032  -4.540   3.144
  301   1HD2  LEU  38          1HD1      LEU  38   1.829  -5.337   5.479
  302   2HD2  LEU  38          2HD1      LEU  38   0.568  -4.200   5.955
  303   3HD2  LEU  38          3HD1      LEU  38   1.263  -4.119   4.337
  304    H    LYS  39           H        LYS  39  -0.586  -9.647   7.016
  305    HA   LYS  39           HA       LYS  39  -0.984  -9.107   9.812
  306   1HB   LYS  39          1HB       LYS  39  -1.233 -11.676   8.234
  307   2HB   LYS  39          2HB       LYS  39  -1.701 -11.486   9.918
  308   1HG   LYS  39          2HG       LYS  39  -3.341  -9.771   9.236
  309   2HG   LYS  39          1HG       LYS  39  -2.911 -10.070   7.550
  310   1HD   LYS  39          1HD       LYS  39  -3.985 -12.158   9.445
  311   2HD   LYS  39          2HD       LYS  39  -4.960 -11.268   8.272
  312   1HE   LYS  39          2HE       LYS  39  -3.592 -12.173   6.454
  313   2HE   LYS  39          1HE       LYS  39  -2.626 -13.068   7.627
  314   1HZ   LYS  39          1HZ       LYS  39  -4.305 -14.473   6.607
  315   2HZ   LYS  39          2HZ       LYS  39  -5.534 -13.439   7.144
  316   3HZ   LYS  39          3HZ       LYS  39  -4.604 -14.300   8.264
  317    H    SER  40           H        SER  40   1.652  -9.903   7.968
  318    HA   SER  40           HA       SER  40   3.040 -11.534   9.896
  319   1HB   SER  40          2HB       SER  40   3.587 -11.720   7.517
  320   2HB   SER  40          1HB       SER  40   4.073 -10.025   7.481
  321    HG   SER  40           HG       SER  40   5.668 -11.940   7.892
  322    H    VAL  41           H        VAL  41   3.105  -8.128   8.900
  323    HA   VAL  41           HA       VAL  41   5.135  -7.155  10.508
  324    HB   VAL  41           HB       VAL  41   2.775  -5.423  10.557
  325   1HG1  VAL  41          1HG2      VAL  41   5.170  -4.763  10.915
  326   2HG1  VAL  41          2HG2      VAL  41   4.277  -3.786   9.750
  327   3HG1  VAL  41          3HG2      VAL  41   5.420  -5.008   9.185
  328   1HG2  VAL  41          1HG1      VAL  41   2.862  -5.004   8.079
  329   2HG2  VAL  41          2HG1      VAL  41   2.089  -6.511   8.579
  330   3HG2  VAL  41          3HG1      VAL  41   3.731  -6.532   7.933
  331    H    GLY  42           H        GLY  42   1.802  -6.465  11.421
  332   1HA   GLY  42          2HA       GLY  42   1.990  -8.011  13.847
  333   2HA   GLY  42          1HA       GLY  42   1.955  -6.274  14.114
  334    H    ALA  43           H        ALA  43   0.313  -7.206  11.323
  335    HA   ALA  43           HA       ALA  43  -2.247  -6.605  12.550
  336   1HB   ALA  43          1HB       ALA  43  -1.587  -7.265   9.681
  337   2HB   ALA  43          2HB       ALA  43  -1.676  -5.643  10.372
  338   3HB   ALA  43          3HB       ALA  43  -3.126  -6.643  10.279
  339    H    GLN  44           H        GLN  44  -4.152  -7.997  11.637
  340    HA   GLN  44           HA       GLN  44  -3.591 -10.814  11.383
  341   1HB   GLN  44          1HB       GLN  44  -3.482 -10.455  13.835
  342   2HB   GLN  44          2HB       GLN  44  -5.119  -9.817  13.796
  343   1HG   GLN  44          1HG       GLN  44  -5.947 -11.973  13.012
  344   2HG   GLN  44          2HG       GLN  44  -4.305 -12.614  13.037
  345   1HE2  GLN  44          2HE2      GLN  44  -3.620 -11.156  15.478
  346   2HE2  GLN  44          1HE2      GLN  44  -4.398 -11.999  16.769
  347    H    LYS  45           H        LYS  45  -5.550  -8.082  11.089
  348    HA   LYS  45           HA       LYS  45  -8.094  -9.234  10.713
  349   1HB   LYS  45          2HB       LYS  45  -7.003  -6.731   9.418
  350   2HB   LYS  45          1HB       LYS  45  -8.697  -7.141   9.647
  351   1HG   LYS  45          1HG       LYS  45  -8.449  -6.967  12.049
  352   2HG   LYS  45          2HG       LYS  45  -6.723  -6.645  11.866
  353   1HD   LYS  45          2HD       LYS  45  -8.934  -4.915  10.758
  354   2HD   LYS  45          1HD       LYS  45  -8.048  -4.594  12.251
  355   1HE   LYS  45          2HE       LYS  45  -6.853  -4.766   9.485
  356   2HE   LYS  45          1HE       LYS  45  -7.162  -3.281  10.388
  357   1HZ   LYS  45          1HZ       LYS  45  -5.301  -5.445  11.208
  358   2HZ   LYS  45          2HZ       LYS  45  -5.597  -4.023  12.073
  359   3HZ   LYS  45          3HZ       LYS  45  -4.851  -3.949  10.557
  360    H    ASP  46           H        ASP  46  -9.139  -9.999   8.916
  361    HA   ASP  46           HA       ASP  46  -7.525 -10.653   6.589
  362   1HB   ASP  46          2HB       ASP  46  -9.516 -11.893   5.832
  363   2HB   ASP  46          1HB       ASP  46  -9.045 -12.358   7.465
  364    H    THR  47           H        THR  47  -9.043  -7.975   7.582
  365    HA   THR  47           HA       THR  47  -9.747  -7.160   4.843
  366    HB   THR  47           HB       THR  47 -11.467  -5.631   5.881
  367    HG1  THR  47           1HG      THR  47 -10.585  -5.843   8.054
  368   1HG2  THR  47          1HG2      THR  47 -12.136  -7.699   4.773
  369   2HG2  THR  47          2HG2      THR  47 -13.152  -7.401   6.183
  370   3HG2  THR  47          3HG2      THR  47 -11.863  -8.603   6.263
  371    H    TYR  48           H        TYR  48  -9.184  -5.089   4.222
  372    HA   TYR  48           HA       TYR  48  -7.685  -3.497   6.180
  373   1HB   TYR  48          2HB       TYR  48  -6.722  -4.487   3.513
  374   2HB   TYR  48          1HB       TYR  48  -6.039  -3.048   4.263
  375    HD1  TYR  48           1HD      TYR  48  -6.585  -6.676   4.752
  376    HD2  TYR  48           2HD      TYR  48  -4.436  -3.210   5.954
  377    HE1  TYR  48           1HE      TYR  48  -5.049  -8.090   6.054
  378    HE2  TYR  48           2HE      TYR  48  -2.895  -4.611   7.270
  379    HH   TYR  48           HH       TYR  48  -2.885  -6.829   8.337
  380    H    THR  49           H        THR  49  -6.910  -1.400   4.929
  381    HA   THR  49           HA       THR  49  -8.971  -0.540   3.039
  382    HB   THR  49           HB       THR  49  -8.911   1.754   4.108
  383    HG1  THR  49           1HG      THR  49  -8.242   0.550   6.532
  384   1HG2  THR  49          1HG2      THR  49 -10.151  -0.580   5.524
  385   2HG2  THR  49          2HG2      THR  49 -10.887   0.498   4.334
  386   3HG2  THR  49          3HG2      THR  49 -10.496   1.098   5.945
  387    H    MET  50           H        MET  50  -8.274   1.755   2.171
  388    HA   MET  50           HA       MET  50  -5.884   1.250   0.740
  389   1HB   MET  50          1HB       MET  50  -7.566   3.755   0.908
  390   2HB   MET  50          2HB       MET  50  -6.302   3.466  -0.279
  391   1HG   MET  50          1HG       MET  50  -8.770   1.777   0.044
  392   2HG   MET  50          2HG       MET  50  -8.586   3.072  -1.135
  393   1HE   MET  50          1HE       MET  50  -9.429   0.114  -1.921
  394   2HE   MET  50          2HE       MET  50  -8.430  -0.155  -3.350
  395   3HE   MET  50          3HE       MET  50  -9.218   1.402  -3.108
  396    H    LYS  51           H        LYS  51  -6.641   3.190   3.553
  397    HA   LYS  51           HA       LYS  51  -4.074   4.544   3.504
  398   1HB   LYS  51          2HB       LYS  51  -6.042   5.765   4.296
  399   2HB   LYS  51          1HB       LYS  51  -6.295   4.568   5.559
  400   1HG   LYS  51          1HG       LYS  51  -4.135   5.194   6.555
  401   2HG   LYS  51          2HG       LYS  51  -3.943   6.433   5.313
  402   1HD   LYS  51          1HD       LYS  51  -5.973   7.541   6.091
  403   2HD   LYS  51          2HD       LYS  51  -6.191   6.294   7.320
  404   1HE   LYS  51          1HE       LYS  51  -3.862   8.198   7.119
  405   2HE   LYS  51          2HE       LYS  51  -5.192   8.307   8.272
  406   1HZ   LYS  51          1HZ       LYS  51  -3.237   6.078   8.097
  407   2HZ   LYS  51          2HZ       LYS  51  -4.511   6.185   9.204
  408   3HZ   LYS  51          3HZ       LYS  51  -3.240   7.300   9.268
  409    H    GLU  52           H        GLU  52  -5.729   2.037   5.335
  410    HA   GLU  52           HA       GLU  52  -3.806   1.361   7.197
  411   1HB   GLU  52          2HB       GLU  52  -6.168   0.318   6.531
  412   2HB   GLU  52          1HB       GLU  52  -5.138  -0.841   5.703
  413   1HG   GLU  52          1HG       GLU  52  -5.689  -1.676   7.883
  414   2HG   GLU  52          2HG       GLU  52  -3.969  -1.292   7.815
  415    H    VAL  53           H        VAL  53  -4.168  -0.186   3.992
  416    HA   VAL  53           HA       VAL  53  -1.767  -1.543   3.984
  417    HB   VAL  53           HB       VAL  53  -2.044  -1.720   1.596
  418   1HG1  VAL  53          1HG1      VAL  53  -4.712  -1.810   2.971
  419   2HG1  VAL  53          2HG1      VAL  53  -3.480  -3.070   3.053
  420   3HG1  VAL  53          3HG1      VAL  53  -4.256  -2.694   1.515
  421   1HG2  VAL  53          1HG2      VAL  53  -2.597   0.622   1.143
  422   2HG2  VAL  53          2HG2      VAL  53  -4.190   0.365   1.852
  423   3HG2  VAL  53          3HG2      VAL  53  -3.732  -0.487   0.378
  424    H    LEU  54           H        LEU  54  -2.472   1.802   3.142
  425    HA   LEU  54           HA       LEU  54  -0.204   2.564   1.798
  426   1HB   LEU  54          1HB       LEU  54  -1.952   4.146   2.220
  427   2HB   LEU  54          2HB       LEU  54  -1.718   4.028   3.952
  428    HG   LEU  54           HG       LEU  54   0.485   5.102   3.728
  429   1HD1  LEU  54          1HD1      LEU  54   1.119   6.130   1.593
  430   2HD1  LEU  54          2HD1      LEU  54  -0.256   5.346   0.816
  431   3HD1  LEU  54          3HD1      LEU  54   1.053   4.371   1.485
  432   1HD2  LEU  54          1HD2      LEU  54  -0.322   7.341   3.166
  433   2HD2  LEU  54          2HD2      LEU  54  -1.473   6.472   4.182
  434   3HD2  LEU  54          3HD2      LEU  54  -1.773   6.637   2.452
  435    H    PHE  55           H        PHE  55  -0.514   2.921   5.344
  436    HA   PHE  55           HA       PHE  55   2.340   3.141   5.580
  437   1HB   PHE  55          1HB       PHE  55   1.889   3.321   8.024
  438   2HB   PHE  55          2HB       PHE  55   1.003   4.488   7.051
  439    HD1  PHE  55           1HD      PHE  55  -1.295   4.688   7.255
  440    HD2  PHE  55           2HD      PHE  55   0.641   1.207   8.756
  441    HE1  PHE  55           1HE      PHE  55  -3.400   3.976   8.312
  442    HE2  PHE  55           2HE      PHE  55  -1.462   0.489   9.813
  443    HZ   PHE  55           HZ       PHE  55  -3.486   1.874   9.591
  444    H    TYR  56           H        TYR  56   0.033   0.576   5.829
  445    HA   TYR  56           HA       TYR  56   1.542  -1.049   7.626
  446   1HB   TYR  56          1HB       TYR  56  -1.049  -1.126   6.508
  447   2HB   TYR  56          2HB       TYR  56  -0.254  -2.634   6.067
  448    HD1  TYR  56           1HD      TYR  56  -2.616  -1.972   8.069
  449    HD2  TYR  56           2HD      TYR  56   1.524  -2.850   8.531
  450    HE1  TYR  56           1HE      TYR  56  -3.062  -2.846  10.318
  451    HE2  TYR  56           2HE      TYR  56   1.096  -3.733  10.783
  452    HH   TYR  56           HH       TYR  56  -2.031  -4.405  11.930
  453    H    LEU  57           H        LEU  57   0.973  -1.218   4.110
  454    HA   LEU  57           HA       LEU  57   2.874  -3.249   3.639
  455   1HB   LEU  57          2HB       LEU  57   1.129  -1.724   2.095
  456   2HB   LEU  57          1HB       LEU  57   2.716  -1.250   1.530
  457    HG   LEU  57           HG       LEU  57   1.923  -3.029   0.135
  458   1HD1  LEU  57          1HD1      LEU  57   4.275  -3.149   0.557
  459   2HD1  LEU  57          2HD1      LEU  57   3.632  -4.792   0.559
  460   3HD1  LEU  57          3HD1      LEU  57   4.010  -3.991   2.083
  461   1HD2  LEU  57          1HD2      LEU  57   1.312  -5.222   1.032
  462   2HD2  LEU  57          2HD2      LEU  57   0.246  -3.951   1.629
  463   3HD2  LEU  57          3HD2      LEU  57   1.510  -4.603   2.672
  464    H    GLY  58           H        GLY  58   3.097   0.302   3.590
  465   1HA   GLY  58          2HA       GLY  58   5.791   0.683   3.218
  466   2HA   GLY  58          1HA       GLY  58   4.821   1.631   4.336
  467    H    GLN  59           H        GLN  59   4.183  -0.619   6.074
  468    HA   GLN  59           HA       GLN  59   6.448  -0.665   7.756
  469   1HB   GLN  59          1HB       GLN  59   4.081  -2.544   7.703
  470   2HB   GLN  59          2HB       GLN  59   5.270  -2.456   8.993
  471   1HG   GLN  59          2HG       GLN  59   3.279  -0.359   8.187
  472   2HG   GLN  59          1HG       GLN  59   3.343  -1.268   9.693
  473   1HE2  GLN  59          1HE2      GLN  59   4.736   1.323   7.850
  474   2HE2  GLN  59          2HE2      GLN  59   5.638   2.031   9.144
  475    H    TYR  60           H        TYR  60   4.994  -3.498   6.094
  476    HA   TYR  60           HA       TYR  60   7.068  -5.191   6.808
  477   1HB   TYR  60          2HB       TYR  60   4.846  -5.927   5.955
  478   2HB   TYR  60          1HB       TYR  60   5.356  -5.473   4.333
  479    HD1  TYR  60           1HD      TYR  60   7.229  -6.717   3.247
  480    HD2  TYR  60           2HD      TYR  60   5.524  -7.972   6.935
  481    HE1  TYR  60           1HE      TYR  60   8.234  -8.941   2.950
  482    HE2  TYR  60           2HE      TYR  60   6.522 -10.196   6.648
  483    HH   TYR  60           HH       TYR  60   7.347 -11.625   4.821
  484    H    ILE  61           H        ILE  61   6.747  -3.166   3.942
  485    HA   ILE  61           HA       ILE  61   8.936  -4.118   2.476
  486    HB   ILE  61           HB       ILE  61   8.015  -1.245   2.617
  487   1HG1  ILE  61          2HG1      ILE  61   7.041  -3.257   0.612
  488   2HG1  ILE  61          1HG1      ILE  61   6.243  -3.087   2.173
  489   1HG2  ILE  61          1HG2      ILE  61   9.485  -2.821   0.513
  490   2HG2  ILE  61          2HG2      ILE  61  10.073  -1.427   1.422
  491   3HG2  ILE  61          3HG2      ILE  61   8.780  -1.228   0.235
  492   1HD1  ILE  61          1HD1      ILE  61   5.991  -0.648   1.652
  493   2HD1  ILE  61          2HD1      ILE  61   5.047  -1.750   0.648
  494   3HD1  ILE  61          3HD1      ILE  61   6.527  -1.026   0.014
  495    H    MET  62           H        MET  62   8.844  -1.168   4.480
  496    HA   MET  62           HA       MET  62  11.628  -0.806   4.570
  497   1HB   MET  62          1HB       MET  62   9.514   0.119   6.519
  498   2HB   MET  62          2HB       MET  62  11.168   0.711   6.478
  499   1HG   MET  62          2HG       MET  62  10.803   1.561   4.215
  500   2HG   MET  62          1HG       MET  62   9.140   0.979   4.270
  501   1HE   MET  62          1HE       MET  62  11.745   3.499   5.781
  502   2HE   MET  62          2HE       MET  62  11.198   2.609   7.203
  503   3HE   MET  62          3HE       MET  62  10.778   4.311   7.013
  504    H    THR  63           H        THR  63   9.489  -2.058   7.132
  505    HA   THR  63           HA       THR  63  11.185  -2.564   9.145
  506    HB   THR  63           HB       THR  63   9.823  -4.554   9.759
  507    HG1  THR  63           1HG      THR  63   9.073  -4.285   7.105
  508   1HG2  THR  63          1HG2      THR  63   9.095  -2.309  10.386
  509   2HG2  THR  63          2HG2      THR  63   7.710  -3.333  10.013
  510   3HG2  THR  63          3HG2      THR  63   8.263  -2.136   8.841
  511    H    LYS  64           H        LYS  64  10.635  -4.879   6.483
  512    HA   LYS  64           HA       LYS  64  12.519  -6.718   7.652
  513   1HB   LYS  64          2HB       LYS  64  10.994  -6.880   5.046
  514   2HB   LYS  64          1HB       LYS  64  11.889  -8.198   5.795
  515   1HG   LYS  64          2HG       LYS  64   9.550  -6.804   7.078
  516   2HG   LYS  64          1HG       LYS  64   9.430  -8.296   6.144
  517   1HD   LYS  64          1HD       LYS  64  11.127  -7.938   8.613
  518   2HD   LYS  64          2HD       LYS  64   9.527  -8.682   8.589
  519   1HE   LYS  64          1HE       LYS  64  10.354 -10.407   7.064
  520   2HE   LYS  64          2HE       LYS  64  11.952  -9.661   7.083
  521   1HZ   LYS  64          1HZ       LYS  64  12.090 -10.105   9.454
  522   2HZ   LYS  64          2HZ       LYS  64  11.840 -11.539   8.592
  523   3HZ   LYS  64          3HZ       LYS  64  10.559 -10.824   9.434
  524    H    ARG  65           H        ARG  65  13.377  -4.070   6.480
  525    HA   ARG  65           HA       ARG  65  15.106  -3.205   5.284
  526   1HB   ARG  65          2HB       ARG  65  16.280  -5.938   5.829
  527   2HB   ARG  65          1HB       ARG  65  17.190  -4.508   5.360
  528   1HG   ARG  65          1HG       ARG  65  15.588  -4.798   7.894
  529   2HG   ARG  65          2HG       ARG  65  17.341  -4.966   7.761
  530   1HD   ARG  65          2HD       ARG  65  17.504  -2.652   6.989
  531   2HD   ARG  65          1HD       ARG  65  15.754  -2.482   7.118
  532    HE   ARG  65           HE       ARG  65  16.844  -3.314   9.590
  533   1HH1  ARG  65          2HH1      ARG  65  16.589  -0.527   7.514
  534   2HH1  ARG  65          1HH1      ARG  65  16.708   0.612   8.814
  535   1HH2  ARG  65          1HH2      ARG  65  17.000  -1.822  11.306
  536   2HH2  ARG  65          2HH2      ARG  65  16.941  -0.123  10.968
  537    H    LEU  66           H        LEU  66  13.121  -4.083   3.629
  538    HA   LEU  66           HA       LEU  66  14.354  -5.674   1.519
  539   1HB   LEU  66          2HB       LEU  66  11.567  -4.528   1.600
  540   2HB   LEU  66          1HB       LEU  66  12.162  -5.809   0.560
  541    HG   LEU  66           HG       LEU  66  12.079  -6.106   3.554
  542   1HD1  LEU  66          1HD1      LEU  66   9.826  -5.585   2.841
  543   2HD1  LEU  66          2HD1      LEU  66   9.954  -7.294   3.265
  544   3HD1  LEU  66          3HD1      LEU  66   9.922  -6.806   1.571
  545   1HD2  LEU  66          1HD2      LEU  66  13.489  -7.674   2.350
  546   2HD2  LEU  66          2HD2      LEU  66  12.143  -8.091   1.288
  547   3HD2  LEU  66          3HD2      LEU  66  12.068  -8.490   3.004
  548    H    TYR  67           H        TYR  67  13.942  -2.443   2.372
  549    HA   TYR  67           HA       TYR  67  13.403  -1.185  -0.064
  550   1HB   TYR  67          1HB       TYR  67  14.207   0.830   0.960
  551   2HB   TYR  67          2HB       TYR  67  13.368  -0.105   2.192
  552    HD1  TYR  67           1HD      TYR  67  16.396   1.544   1.305
  553    HD2  TYR  67           2HD      TYR  67  14.800  -1.527   3.781
  554    HE1  TYR  67           1HE      TYR  67  18.387   1.674   2.734
  555    HE2  TYR  67           2HE      TYR  67  16.791  -1.405   5.222
  556    HH   TYR  67           HH       TYR  67  19.135  -0.673   5.068
  557    H    ASP  68           H        ASP  68  15.236   0.514  -0.849
  558    HA   ASP  68           HA       ASP  68  16.906  -1.123  -2.434
  559   1HB   ASP  68          2HB       ASP  68  16.056   0.953  -3.325
  560   2HB   ASP  68          1HB       ASP  68  16.847   1.884  -2.057
  561    H    GLU  69           H        GLU  69  18.328   1.696  -0.901
  562    HA   GLU  69           HA       GLU  69  19.749   0.543   1.169
  563   1HB   GLU  69          1HB       GLU  69  20.825  -0.857  -0.545
  564   2HB   GLU  69          2HB       GLU  69  21.351   0.586  -1.399
  565   1HG   GLU  69          2HG       GLU  69  22.732   1.218   0.513
  566   2HG   GLU  69          1HG       GLU  69  22.202  -0.228   1.372
  567    H    LYS  70           H        LYS  70  19.734   2.860  -1.447
  568    HA   LYS  70           HA       LYS  70  20.759   4.888   0.424
  569   1HB   LYS  70          1HB       LYS  70  21.847   6.016  -1.514
  570   2HB   LYS  70          2HB       LYS  70  22.549   4.451  -1.129
  571   1HG   LYS  70          2HG       LYS  70  21.323   3.432  -2.968
  572   2HG   LYS  70          1HG       LYS  70  20.579   4.988  -3.344
  573   1HD   LYS  70          1HD       LYS  70  22.416   4.608  -4.855
  574   2HD   LYS  70          2HD       LYS  70  22.839   5.919  -3.751
  575   1HE   LYS  70          1HE       LYS  70  24.135   4.354  -2.389
  576   2HE   LYS  70          2HE       LYS  70  23.711   3.044  -3.491
  577   1HZ   LYS  70          1HZ       LYS  70  25.911   3.916  -3.962
  578   2HZ   LYS  70          2HZ       LYS  70  25.274   5.465  -4.210
  579   3HZ   LYS  70          3HZ       LYS  70  24.868   4.206  -5.264
  580    H    GLN  71           H        GLN  71  19.027   4.387  -2.644
  581    HA   GLN  71           HA       GLN  71  17.165   6.521  -1.940
  582   1HB   GLN  71          2HB       GLN  71  17.203   4.634  -4.305
  583   2HB   GLN  71          1HB       GLN  71  16.063   5.952  -4.078
  584   1HG   GLN  71          2HG       GLN  71  17.899   7.561  -4.163
  585   2HG   GLN  71          1HG       GLN  71  19.043   6.238  -4.393
  586   1HE2  GLN  71          2HE2      GLN  71  16.513   8.129  -5.839
  587   2HE2  GLN  71          1HE2      GLN  71  16.782   7.618  -7.468
  588    H    GLN  72           H        GLN  72  16.464   5.494   0.030
  589    HA   GLN  72           HA       GLN  72  15.629   2.828   0.207
  590   1HB   GLN  72          2HB       GLN  72  14.733   5.160   1.911
  591   2HB   GLN  72          1HB       GLN  72  14.640   3.459   2.347
  592   1HG   GLN  72          1HG       GLN  72  17.090   3.320   2.268
  593   2HG   GLN  72          2HG       GLN  72  17.160   5.038   1.880
  594   1HE2  GLN  72          1HE2      GLN  72  14.839   3.677   4.099
  595   2HE2  GLN  72          2HE2      GLN  72  15.499   4.383   5.532
  596    H    HIS  73           H        HIS  73  14.076   5.495  -1.226
  597    HA   HIS  73           HA       HIS  73  11.377   4.588  -0.951
  598   1HB   HIS  73          1HB       HIS  73  10.953   6.156  -2.878
  599   2HB   HIS  73          2HB       HIS  73  11.702   6.898  -1.469
  600    HD1  HIS  73           1HD      HIS  73  13.729   8.251  -1.912
  601    HD2  HIS  73           2HD      HIS  73  12.939   5.576  -4.991
  602    HE1  HIS  73           1HE      HIS  73  15.401   8.786  -3.713
  603    HE2  HIS  73           2HE      HIS  73  14.952   7.105  -5.535
  604    H    ILE  74           H        ILE  74  13.939   3.191  -2.460
  605    HA   ILE  74           HA       ILE  74  12.111   1.725  -4.247
  606    HB   ILE  74           HB       ILE  74  15.119   1.477  -4.220
  607   1HG1  ILE  74          1HG1      ILE  74  14.542   3.792  -4.780
  608   2HG1  ILE  74          2HG1      ILE  74  15.152   2.938  -6.195
  609   1HG2  ILE  74          1HG2      ILE  74  13.034   0.698  -6.253
  610   2HG2  ILE  74          2HG2      ILE  74  13.927  -0.397  -5.199
  611   3HG2  ILE  74          3HG2      ILE  74  14.776   0.511  -6.449
  612   1HD1  ILE  74          1HD1      ILE  74  12.259   3.499  -5.589
  613   2HD1  ILE  74          2HD1      ILE  74  12.872   2.646  -7.007
  614   3HD1  ILE  74          3HD1      ILE  74  13.264   4.348  -6.765
  615    H    VAL  75           H        VAL  75  12.499  -0.687  -4.244
  616    HA   VAL  75           HA       VAL  75  13.709  -1.830  -1.905
  617    HB   VAL  75           HB       VAL  75  11.889  -1.400  -0.617
  618   1HG1  VAL  75          1HG2      VAL  75  10.702  -0.112  -2.290
  619   2HG1  VAL  75          2HG2      VAL  75   9.591  -1.183  -1.436
  620   3HG1  VAL  75          3HG2      VAL  75  10.140  -1.595  -3.060
  621   1HG2  VAL  75          1HG1      VAL  75  10.990  -3.867  -2.100
  622   2HG2  VAL  75          2HG1      VAL  75  10.364  -3.331  -0.541
  623   3HG2  VAL  75          3HG1      VAL  75  12.052  -3.812  -0.693
  624    H    TYR  76           H        TYR  76  14.678  -3.500  -2.765
  625    HA   TYR  76           HA       TYR  76  13.634  -4.939  -5.018
  626   1HB   TYR  76          2HB       TYR  76  16.029  -5.430  -3.248
  627   2HB   TYR  76          1HB       TYR  76  15.650  -6.366  -4.690
  628    HD1  TYR  76           1HD      TYR  76  17.624  -5.833  -5.902
  629    HD2  TYR  76           2HD      TYR  76  15.132  -2.721  -4.435
  630    HE1  TYR  76           1HE      TYR  76  18.857  -4.208  -7.280
  631    HE2  TYR  76           2HE      TYR  76  16.353  -1.086  -5.797
  632    HH   TYR  76           HH       TYR  76  18.492  -1.988  -8.274
  633    H    CYS  77           H        CYS  77  13.333  -7.285  -5.014
  634    HA   CYS  77           HA       CYS  77  11.568  -7.976  -2.825
  635   1HB   CYS  77          2HB       CYS  77  10.898  -9.867  -4.233
  636   2HB   CYS  77          1HB       CYS  77  10.839  -8.355  -5.132
  637    HG   CYS  77           HG       CYS  77  11.767 -10.122  -6.968
  638    H    SER  78           H        SER  78  14.051  -7.922  -1.798
  639    HA   SER  78           HA       SER  78  15.338 -10.461  -1.771
  640   1HB   SER  78          2HB       SER  78  16.531  -8.429  -1.111
  641   2HB   SER  78          1HB       SER  78  15.430  -8.205   0.249
  642    HG   SER  78           HG       SER  78  17.410  -9.223   0.845
  643    H    ASN  79           H        ASN  79  13.549 -11.902  -1.488
  644    HA   ASN  79           HA       ASN  79  12.310 -13.360  -0.268
  645   1HB   ASN  79          2HB       ASN  79  14.358 -13.471   1.136
  646   2HB   ASN  79          1HB       ASN  79  13.721 -12.161   2.127
  647   1HD2  ASN  79          2HD2      ASN  79  12.032 -12.556   3.532
  648   2HD2  ASN  79          1HD2      ASN  79  11.525 -14.154   3.949
  649    H    ASP  80           H        ASP  80  10.533 -11.958  -0.987
  650    HA   ASP  80           HA       ASP  80   8.771 -11.394   1.158
  651   1HB   ASP  80          2HB       ASP  80   8.472  -8.935   0.597
  652   2HB   ASP  80          1HB       ASP  80   9.940  -9.353   1.478
  653    H    LEU  81           H        LEU  81   9.571 -11.646  -2.140
  654    HA   LEU  81           HA       LEU  81   8.425 -11.410  -4.112
  655   1HB   LEU  81          1HB       LEU  81   6.274 -12.688  -2.418
  656   2HB   LEU  81          2HB       LEU  81   6.297 -12.650  -4.169
  657    HG   LEU  81           HG       LEU  81   8.321 -14.062  -2.426
  658   1HD1  LEU  81          1HD1      LEU  81   6.141 -15.146  -2.371
  659   2HD1  LEU  81          2HD1      LEU  81   7.302 -16.112  -3.281
  660   3HD1  LEU  81          3HD1      LEU  81   6.090 -15.155  -4.134
  661   1HD2  LEU  81          1HD2      LEU  81   9.300 -13.270  -4.509
  662   2HD2  LEU  81          2HD2      LEU  81   7.989 -14.014  -5.423
  663   3HD2  LEU  81          3HD2      LEU  81   9.125 -15.025  -4.529
  664    H    LEU  82           H        LEU  82   8.451  -9.049  -2.746
  665    HA   LEU  82           HA       LEU  82   6.932  -7.849  -1.238
  666   1HB   LEU  82          2HB       LEU  82   6.803  -5.793  -2.382
  667   2HB   LEU  82          1HB       LEU  82   8.282  -6.591  -2.850
  668    HG   LEU  82           HG       LEU  82   7.587  -5.704  -4.845
  669   1HD1  LEU  82          1HD1      LEU  82   6.247  -8.398  -4.825
  670   2HD1  LEU  82          2HD1      LEU  82   7.943  -8.073  -5.184
  671   3HD1  LEU  82          3HD1      LEU  82   6.683  -7.474  -6.263
  672   1HD2  LEU  82          1HD2      LEU  82   5.450  -4.867  -3.924
  673   2HD2  LEU  82          2HD2      LEU  82   4.730  -6.443  -4.264
  674   3HD2  LEU  82          3HD2      LEU  82   5.336  -5.444  -5.586
  675    H    GLY  83           H        GLY  83   5.101  -7.957  -0.441
  676   1HA   GLY  83          2HA       GLY  83   2.830  -8.136  -0.188
  677   2HA   GLY  83          1HA       GLY  83   2.675  -7.668  -1.874
  678    H    ASP  84           H        ASP  84   4.717 -10.381  -1.559
  679    HA   ASP  84           HA       ASP  84   4.488 -12.341  -2.746
  680   1HB   ASP  84          2HB       ASP  84   1.701 -12.253  -1.599
  681   2HB   ASP  84          1HB       ASP  84   2.480 -13.679  -2.279
  682    H    LEU  85           H        LEU  85   3.579  -9.679  -3.829
  683    HA   LEU  85           HA       LEU  85   0.966 -10.310  -4.967
  684   1HB   LEU  85          2HB       LEU  85   0.227  -8.399  -4.086
  685   2HB   LEU  85          1HB       LEU  85   1.668  -8.486  -3.101
  686    HG   LEU  85           HG       LEU  85   2.560  -7.179  -5.350
  687   1HD1  LEU  85          1HD1      LEU  85   0.146  -7.097  -6.042
  688   2HD1  LEU  85          2HD1      LEU  85   0.965  -5.534  -5.948
  689   3HD1  LEU  85          3HD1      LEU  85  -0.133  -6.037  -4.660
  690   1HD2  LEU  85          1HD2      LEU  85   3.101  -6.641  -3.030
  691   2HD2  LEU  85          2HD2      LEU  85   1.476  -5.993  -2.799
  692   3HD2  LEU  85          3HD2      LEU  85   2.589  -5.204  -3.918
  693    H    PHE  86           H        PHE  86   3.962  -8.567  -5.692
  694    HA   PHE  86           HA       PHE  86   2.975  -8.081  -8.415
  695   1HB   PHE  86          1HB       PHE  86   4.963  -6.722  -6.654
  696   2HB   PHE  86          2HB       PHE  86   5.202  -6.638  -8.395
  697    HD1  PHE  86           1HD      PHE  86   1.968  -6.738  -8.669
  698    HD2  PHE  86           2HD      PHE  86   4.819  -4.243  -6.726
  699    HE1  PHE  86           1HE      PHE  86   0.401  -4.849  -8.801
  700    HE2  PHE  86           2HE      PHE  86   3.254  -2.339  -6.856
  701    HZ   PHE  86           HZ       PHE  86   1.043  -2.652  -7.893
  702    H    GLY  87           H        GLY  87   5.909  -9.152  -6.705
  703   1HA   GLY  87          1HA       GLY  87   7.397 -10.837  -7.428
  704   2HA   GLY  87          2HA       GLY  87   6.642 -10.788  -9.015
  705    H    VAL  88           H        VAL  88   7.317  -7.719  -7.720
  706    HA   VAL  88           HA       VAL  88   8.996  -6.966  -9.821
  707    HB   VAL  88           HB       VAL  88   9.271  -4.894  -8.762
  708   1HG1  VAL  88          1HG2      VAL  88   6.898  -5.475  -9.222
  709   2HG1  VAL  88          2HG2      VAL  88   7.104  -4.276  -7.946
  710   3HG1  VAL  88          3HG2      VAL  88   6.731  -5.950  -7.530
  711   1HG2  VAL  88          1HG1      VAL  88   9.032  -4.533  -6.343
  712   2HG2  VAL  88          2HG1      VAL  88  10.328  -5.669  -6.718
  713   3HG2  VAL  88          3HG1      VAL  88   8.779  -6.264  -6.120
  714    HA   PRO  89           HA       PRO  89  13.102  -7.876  -8.045
  715   1HB   PRO  89          2HB       PRO  89  14.581  -6.287  -9.612
  716   2HB   PRO  89          1HB       PRO  89  13.897  -7.798 -10.225
  717   1HG   PRO  89          2HG       PRO  89  12.942  -4.987 -10.604
  718   2HG   PRO  89          1HG       PRO  89  13.014  -6.312 -11.778
  719   1HD   PRO  89          2HD       PRO  89  10.737  -5.550 -10.422
  720   2HD   PRO  89          1HD       PRO  89  11.000  -7.160 -11.117
  721    H    SER  90           H        SER  90  11.526  -4.827  -8.479
  722    HA   SER  90           HA       SER  90  12.349  -3.746  -5.989
  723   1HB   SER  90          2HB       SER  90  13.626  -1.803  -6.906
  724   2HB   SER  90          1HB       SER  90  14.469  -3.342  -7.072
  725    HG   SER  90           HG       SER  90  13.206  -3.220  -9.261
  726    H    PHE  91           H        PHE  91  10.950  -2.086  -5.426
  727    HA   PHE  91           HA       PHE  91   9.462  -0.790  -7.588
  728   1HB   PHE  91          1HB       PHE  91   7.341  -1.015  -6.456
  729   2HB   PHE  91          2HB       PHE  91   8.038  -2.603  -6.728
  730    HD1  PHE  91           1HD      PHE  91   7.091  -0.125  -4.211
  731    HD2  PHE  91           2HD      PHE  91   8.779  -3.973  -4.875
  732    HE1  PHE  91           1HE      PHE  91   6.736  -0.683  -1.847
  733    HE2  PHE  91           2HE      PHE  91   8.428  -4.534  -2.510
  734    HZ   PHE  91           HZ       PHE  91   7.405  -2.891  -0.992
  735    H    SER  92           H        SER  92   8.314   1.167  -6.917
  736    HA   SER  92           HA       SER  92  10.024   2.667  -5.077
  737   1HB   SER  92          1HB       SER  92   8.136   3.603  -7.252
  738   2HB   SER  92          2HB       SER  92   9.097   4.672  -6.231
  739    HG   SER  92           HG       SER  92   9.965   2.842  -8.193
  740    H    VAL  93           H        VAL  93   9.068   2.095  -3.124
  741    HA   VAL  93           HA       VAL  93   6.440   2.192  -2.338
  742    HB   VAL  93           HB       VAL  93   7.561   3.290  -0.158
  743   1HG1  VAL  93          1HG2      VAL  93   8.058   1.022   0.600
  744   2HG1  VAL  93          2HG2      VAL  93   7.985   0.447  -1.065
  745   3HG1  VAL  93          3HG2      VAL  93   6.536   1.080  -0.288
  746   1HG2  VAL  93          1HG1      VAL  93   9.896   2.552   0.013
  747   2HG2  VAL  93          2HG1      VAL  93   9.667   3.785  -1.226
  748   3HG2  VAL  93          3HG1      VAL  93   9.857   2.095  -1.689
  749    H    LYS  94           H        LYS  94   8.673   4.928  -1.803
  750    HA   LYS  94           HA       LYS  94   6.825   6.754  -0.950
  751   1HB   LYS  94          2HB       LYS  94   9.263   7.109  -0.891
  752   2HB   LYS  94          1HB       LYS  94   9.265   7.353  -2.631
  753   1HG   LYS  94          1HG       LYS  94   7.858   9.329  -2.362
  754   2HG   LYS  94          2HG       LYS  94   7.845   9.083  -0.615
  755   1HD   LYS  94          2HD       LYS  94  10.281   9.354  -0.564
  756   2HD   LYS  94          1HD       LYS  94  10.283   9.620  -2.308
  757   1HE   LYS  94          2HE       LYS  94  10.394  11.735  -1.107
  758   2HE   LYS  94          1HE       LYS  94   8.888  11.602  -2.014
  759   1HZ   LYS  94          1HZ       LYS  94   9.202  11.103   0.896
  760   2HZ   LYS  94          2HZ       LYS  94   7.757  10.976   0.026
  761   3HZ   LYS  94          3HZ       LYS  94   8.508  12.480   0.200
  762    H    GLU  95           H        GLU  95   7.505   5.785  -4.234
  763    HA   GLU  95           HA       GLU  95   5.687   7.704  -5.393
  764   1HB   GLU  95          1HB       GLU  95   7.078   5.253  -6.471
  765   2HB   GLU  95          2HB       GLU  95   5.930   6.181  -7.424
  766   1HG   GLU  95          1HG       GLU  95   8.223   6.805  -7.933
  767   2HG   GLU  95          2HG       GLU  95   7.331   8.153  -7.233
  768    H    HIS  96           H        HIS  96   4.271   6.715  -3.411
  769    HA   HIS  96           HA       HIS  96   3.019   4.250  -3.685
  770   1HB   HIS  96          1HB       HIS  96   1.897   6.781  -2.465
  771   2HB   HIS  96          2HB       HIS  96   1.249   5.163  -2.221
  772    HD1  HIS  96           1HD      HIS  96   2.268   3.786  -0.390
  773    HD2  HIS  96           2HD      HIS  96   4.507   7.162  -1.293
  774    HE1  HIS  96           1HE      HIS  96   4.034   3.916   1.396
  775    HE2  HIS  96           2HE      HIS  96   5.318   6.023   0.884
  776    H    ARG  97           H        ARG  97   2.439   7.253  -5.320
  777    HA   ARG  97           HA       ARG  97  -0.175   7.020  -6.151
  778   1HB   ARG  97          1HB       ARG  97   1.253   8.970  -6.621
  779   2HB   ARG  97          2HB       ARG  97   2.164   8.021  -7.786
  780   1HG   ARG  97          2HG       ARG  97   0.174   7.782  -9.169
  781   2HG   ARG  97          1HG       ARG  97  -0.761   8.706  -7.991
  782   1HD   ARG  97          2HD       ARG  97   0.694  10.641  -8.362
  783   2HD   ARG  97          1HD       ARG  97   1.618   9.716  -9.546
  784    HE   ARG  97           HE       ARG  97  -1.034   9.655 -10.359
  785   1HH1  ARG  97          2HH1      ARG  97   1.467  12.030  -9.866
  786   2HH1  ARG  97          1HH1      ARG  97   0.866  13.105 -11.084
  787   1HH2  ARG  97          1HH2      ARG  97  -1.833  11.063 -11.964
  788   2HH2  ARG  97          2HH2      ARG  97  -1.011  12.555 -12.276
  789    H    LYS  98           H        LYS  98   2.666   5.906  -8.006
  790    HA   LYS  98           HA       LYS  98   1.047   4.361  -9.790
  791   1HB   LYS  98          1HB       LYS  98   4.041   4.355  -9.377
  792   2HB   LYS  98          2HB       LYS  98   3.197   3.587 -10.713
  793   1HG   LYS  98          1HG       LYS  98   2.400   5.763 -11.473
  794   2HG   LYS  98          2HG       LYS  98   3.230   6.540 -10.122
  795   1HD   LYS  98          2HD       LYS  98   5.375   5.721 -10.973
  796   2HD   LYS  98          1HD       LYS  98   4.543   4.949 -12.325
  797   1HE   LYS  98          2HE       LYS  98   3.754   7.131 -13.090
  798   2HE   LYS  98          1HE       LYS  98   4.571   7.906 -11.732
  799   1HZ   LYS  98          1HZ       LYS  98   5.876   8.059 -13.758
  800   2HZ   LYS  98          2HZ       LYS  98   5.903   6.374 -13.901
  801   3HZ   LYS  98          3HZ       LYS  98   6.684   7.125 -12.601
  802    H    ILE  99           H        ILE  99   3.360   3.545  -7.233
  803    HA   ILE  99           HA       ILE  99   3.404   0.811  -7.547
  804    HB   ILE  99           HB       ILE  99   4.667   2.475  -5.890
  805   1HG1  ILE  99          1HG1      ILE  99   5.156   0.052  -6.568
  806   2HG1  ILE  99          2HG1      ILE  99   5.786   0.597  -5.017
  807   1HG2  ILE  99          1HG2      ILE  99   2.722   1.088  -4.065
  808   2HG2  ILE  99          2HG2      ILE  99   2.755   2.817  -4.417
  809   3HG2  ILE  99          3HG2      ILE  99   4.111   2.062  -3.573
  810   1HD1  ILE  99          1HD1      ILE  99   4.042  -0.545  -3.844
  811   2HD1  ILE  99          2HD1      ILE  99   4.821  -1.671  -4.958
  812   3HD1  ILE  99          3HD1      ILE  99   3.249  -0.977  -5.360
  813    H    TYR 100           H        TYR 100   0.953   2.763  -5.976
  814    HA   TYR 100           HA       TYR 100  -0.425   0.405  -4.990
  815   1HB   TYR 100          2HB       TYR 100  -0.838   3.354  -4.681
  816   2HB   TYR 100          1HB       TYR 100  -2.150   2.238  -4.306
  817    HD1  TYR 100           1HD      TYR 100  -1.772   3.452  -2.002
  818    HD2  TYR 100           2HD      TYR 100   0.958   0.686  -3.738
  819    HE1  TYR 100           1HE      TYR 100  -0.791   3.030   0.216
  820    HE2  TYR 100           2HE      TYR 100   1.936   0.257  -1.534
  821    HH   TYR 100           HH       TYR 100   2.143   1.380   0.646
  822    H    THR 101           H        THR 101  -0.846   2.874  -7.496
  823    HA   THR 101           HA       THR 101  -3.400   2.041  -8.360
  824    HB   THR 101           HB       THR 101  -2.701   3.088 -10.582
  825    HG1  THR 101           1HG      THR 101  -0.363   3.478  -9.037
  826   1HG2  THR 101          1HG2      THR 101  -3.969   4.313  -8.892
  827   2HG2  THR 101          2HG2      THR 101  -2.798   5.369  -9.680
  828   3HG2  THR 101          3HG2      THR 101  -2.472   4.741  -8.065
  829    H    MET 102           H        MET 102  -0.304   0.612  -8.697
  830    HA   MET 102           HA       MET 102  -1.174  -1.190 -10.810
  831   1HB   MET 102          1HB       MET 102   1.297  -1.476  -9.108
  832   2HB   MET 102          2HB       MET 102   0.990  -2.174 -10.691
  833   1HG   MET 102          2HG       MET 102   1.058   0.050 -11.688
  834   2HG   MET 102          1HG       MET 102   1.361   0.743 -10.098
  835   1HE   MET 102          1HE       MET 102   4.868  -0.847  -9.232
  836   2HE   MET 102          2HE       MET 102   3.329  -1.660  -8.945
  837   3HE   MET 102          3HE       MET 102   3.487   0.063  -8.615
  838    H    ILE 103           H        ILE 103  -0.473  -1.274  -7.329
  839    HA   ILE 103           HA       ILE 103  -0.896  -3.955  -6.836
  840    HB   ILE 103           HB       ILE 103  -1.493  -1.555  -5.120
  841   1HG1  ILE 103          1HG1      ILE 103   0.647  -3.693  -4.994
  842   2HG1  ILE 103          2HG1      ILE 103   0.869  -2.059  -5.609
  843   1HG2  ILE 103          1HG2      ILE 103  -3.027  -3.310  -4.433
  844   2HG2  ILE 103          2HG2      ILE 103  -1.764  -3.088  -3.221
  845   3HG2  ILE 103          3HG2      ILE 103  -1.692  -4.459  -4.328
  846   1HD1  ILE 103          1HD1      ILE 103   1.753  -2.262  -3.370
  847   2HD1  ILE 103          2HD1      ILE 103   0.182  -2.807  -2.778
  848   3HD1  ILE 103          3HD1      ILE 103   0.374  -1.163  -3.389
  849    H    TYR 104           H        TYR 104  -3.276  -1.395  -7.279
  850    HA   TYR 104           HA       TYR 104  -5.434  -3.329  -6.794
  851   1HB   TYR 104          2HB       TYR 104  -5.452  -0.306  -6.828
  852   2HB   TYR 104          1HB       TYR 104  -6.893  -1.300  -6.639
  853    HD1  TYR 104           1HD      TYR 104  -7.384  -2.394  -4.560
  854    HD2  TYR 104           2HD      TYR 104  -3.749  -0.238  -5.051
  855    HE1  TYR 104           1HE      TYR 104  -7.001  -2.498  -2.137
  856    HE2  TYR 104           2HE      TYR 104  -3.358  -0.337  -2.626
  857    HH   TYR 104           HH       TYR 104  -4.758  -0.601  -0.548
  858    H    ARG 105           H        ARG 105  -6.490  -4.148  -8.456
  859    HA   ARG 105           HA       ARG 105  -6.887  -2.487 -10.845
  860   1HB   ARG 105          2HB       ARG 105  -6.166  -5.425 -10.850
  861   2HB   ARG 105          1HB       ARG 105  -6.630  -4.498 -12.268
  862   1HG   ARG 105          2HG       ARG 105  -4.671  -3.054 -11.952
  863   2HG   ARG 105          1HG       ARG 105  -4.195  -4.031 -10.561
  864   1HD   ARG 105          1HD       ARG 105  -2.959  -4.686 -12.557
  865   2HD   ARG 105          2HD       ARG 105  -3.998  -5.994 -11.993
  866    HE   ARG 105           HE       ARG 105  -5.412  -4.533 -13.904
  867   1HH1  ARG 105          2HH1      ARG 105  -2.598  -6.578 -13.708
  868   2HH1  ARG 105          1HH1      ARG 105  -2.739  -7.147 -15.338
  869   1HH2  ARG 105          1HH2      ARG 105  -5.606  -5.277 -16.051
  870   2HH2  ARG 105          2HH2      ARG 105  -4.448  -6.407 -16.670
  871    H    ASN 106           H        ASN 106  -8.710  -3.329 -12.213
  872    HA   ASN 106           HA       ASN 106 -10.931  -3.779 -12.423
  873   1HB   ASN 106          1HB       ASN 106 -10.336  -5.868 -10.315
  874   2HB   ASN 106          2HB       ASN 106 -11.780  -5.813 -11.320
  875   1HD2  ASN 106          2HD2      ASN 106  -8.373  -6.455 -11.229
  876   2HD2  ASN 106          1HD2      ASN 106  -8.274  -7.246 -12.762
  877    H    LEU 107           H        LEU 107 -12.971  -4.369 -10.784
  878    HA   LEU 107           HA       LEU 107 -12.942  -2.119  -8.894
  879   1HB   LEU 107          1HB       LEU 107 -15.278  -3.522 -10.194
  880   2HB   LEU 107          2HB       LEU 107 -15.398  -2.165  -9.091
  881    HG   LEU 107           HG       LEU 107 -14.096  -2.102 -11.817
  882   1HD1  LEU 107          1HD1      LEU 107 -15.993  -0.695 -12.441
  883   2HD1  LEU 107          2HD1      LEU 107 -16.697  -0.930 -10.842
  884   3HD1  LEU 107          3HD1      LEU 107 -16.522  -2.299 -11.940
  885   1HD2  LEU 107          1HD2      LEU 107 -13.969   0.315 -11.461
  886   2HD2  LEU 107          2HD2      LEU 107 -13.020  -0.568 -10.267
  887   3HD2  LEU 107          3HD2      LEU 107 -14.587   0.104  -9.823
  888    H    VAL 108           H        VAL 108 -12.038  -3.213  -7.134
  889    HA   VAL 108           HA       VAL 108 -13.874  -5.122  -5.845
  890    HB   VAL 108           HB       VAL 108 -10.855  -5.210  -5.719
  891   1HG1  VAL 108          1HG2      VAL 108 -11.867  -5.875  -3.611
  892   2HG1  VAL 108          2HG2      VAL 108 -11.187  -7.277  -4.436
  893   3HG1  VAL 108          3HG2      VAL 108 -12.929  -7.001  -4.457
  894   1HG2  VAL 108          1HG1      VAL 108 -11.076  -7.346  -6.898
  895   2HG2  VAL 108          2HG1      VAL 108 -11.706  -6.007  -7.858
  896   3HG2  VAL 108          3HG1      VAL 108 -12.817  -7.093  -7.024
  897    H    VAL 109           H        VAL 109 -14.834  -3.607  -4.527
  898    HA   VAL 109           HA       VAL 109 -13.137  -2.520  -2.398
  899    HB   VAL 109           HB       VAL 109 -14.357  -0.375  -2.455
  900   1HG1  VAL 109          1HG1      VAL 109 -12.192  -0.551  -3.557
  901   2HG1  VAL 109          2HG1      VAL 109 -13.250   0.553  -4.436
  902   3HG1  VAL 109          3HG1      VAL 109 -12.978  -1.080  -5.045
  903   1HG2  VAL 109          1HG2      VAL 109 -16.405  -1.131  -3.533
  904   2HG2  VAL 109          2HG2      VAL 109 -15.523  -1.431  -5.030
  905   3HG2  VAL 109          3HG2      VAL 109 -15.695   0.216  -4.423
  906    H    VAL 110           H        VAL 110 -15.066  -1.135  -0.997
  907    HA   VAL 110           HA       VAL 110 -16.352  -3.064   0.508
  908    HB   VAL 110           HB       VAL 110 -17.246  -0.204   0.112
  909   1HG1  VAL 110          1HG2      VAL 110 -18.269  -0.444   2.328
  910   2HG1  VAL 110          2HG2      VAL 110 -17.809  -2.147   2.350
  911   3HG1  VAL 110          3HG2      VAL 110 -18.972  -1.562   1.160
  912   1HG2  VAL 110          1HG1      VAL 110 -15.360  -1.404   2.136
  913   2HG2  VAL 110          2HG1      VAL 110 -15.915   0.269   2.115
  914   3HG2  VAL 110          3HG1      VAL 110 -14.915  -0.344   0.799
  915    H    ASN 111           H        ASN 111 -17.773  -1.021  -2.044
  916    HA   ASN 111           HA       ASN 111 -20.329  -2.233  -1.941
  917   1HB   ASN 111          2HB       ASN 111 -19.013  -0.681  -4.181
  918   2HB   ASN 111          1HB       ASN 111 -20.727  -1.077  -4.091
  919   1HD2  ASN 111          2HD2      ASN 111 -19.409   1.520  -4.191
  920   2HD2  ASN 111          1HD2      ASN 111 -19.928   2.373  -2.783
  921    H    GLN 112           H        GLN 112 -20.924  -4.174  -2.611
  922    HA   GLN 112           HA       GLN 112 -19.177  -5.677  -4.401
  923   1HB   GLN 112          2HB       GLN 112 -19.932  -6.756  -2.327
  924   2HB   GLN 112          1HB       GLN 112 -21.604  -6.559  -2.828
  925   1HG   GLN 112          2HG       GLN 112 -21.012  -8.801  -3.264
  926   2HG   GLN 112          1HG       GLN 112 -21.081  -7.978  -4.822
  927   1HE2  GLN 112          2HE2      GLN 112 -19.675 -10.413  -4.047
  928   2HE2  GLN 112          1HE2      GLN 112 -18.008 -10.140  -4.411
  929    H    GLN 113           H        GLN 113 -22.653  -4.936  -4.107
  930    HA   GLN 113           HA       GLN 113 -22.977  -5.520  -6.959
  931   1HB   GLN 113          2HB       GLN 113 -25.398  -5.477  -6.487
  932   2HB   GLN 113          1HB       GLN 113 -24.545  -6.643  -5.482
  933   1HG   GLN 113          1HG       GLN 113 -24.586  -5.071  -3.616
  934   2HG   GLN 113          2HG       GLN 113 -25.439  -3.901  -4.621
  935   1HE2  GLN 113          2HE2      GLN 113 -27.590  -4.267  -5.162
  936   2HE2  GLN 113          1HE2      GLN 113 -28.568  -5.412  -4.313
  937    H    GLU 114           H        GLU 114 -23.774  -4.026  -8.411
  938    HA   GLU 114           HA       GLU 114 -24.115  -1.272  -7.437
  939   1HB   GLU 114          2HB       GLU 114 -21.845  -1.548  -8.383
  940   2HB   GLU 114          1HB       GLU 114 -22.556  -2.078  -9.900
  941   1HG   GLU 114          1HG       GLU 114 -21.884   0.230 -10.057
  942   2HG   GLU 114          2HG       GLU 114 -23.640   0.106 -10.143
  943    H    SER 115           H        SER 115 -24.310  -3.136 -10.475
  944    HA   SER 115           HA       SER 115 -25.907  -3.260 -12.087
  945   1HB   SER 115          2HB       SER 115 -27.196  -4.308 -10.291
  946   2HB   SER 115          1HB       SER 115 -27.743  -2.725  -9.740
  947    HG   SER 115           HG       SER 115 -28.315  -2.869 -12.301
  948    H    SER 116           H        SER 116 -24.911  -1.218 -12.867
  949    HA   SER 116           HA       SER 116 -25.111   0.809 -13.867
  950   1HB   SER 116          1HB       SER 116 -27.146  -0.137 -14.835
  951   2HB   SER 116          2HB       SER 116 -28.067   0.345 -13.410
  952    HG   SER 116           HG       SER 116 -28.368   2.137 -14.454
  953    H    ASP 117           H        ASP 117 -27.955   1.307 -11.841
  954    HA   ASP 117           HA       ASP 117 -28.454   2.881 -10.279
  955   1HB   ASP 117          2HB       ASP 117 -26.879   1.580  -8.921
  956   2HB   ASP 117          1HB       ASP 117 -25.538   2.530  -9.550
  957    H    SER 118           H        SER 118 -28.890   4.545 -11.741
  958    HA   SER 118           HA       SER 118 -26.850   6.261 -12.760
  959   1HB   SER 118          1HB       SER 118 -29.846   6.666 -12.606
  960   2HB   SER 118          2HB       SER 118 -28.730   7.659 -13.543
  961    HG   SER 118           HG       SER 118 -28.297   5.121 -14.178
  962    H    SER 119           H        SER 119 -27.177   8.732 -12.414
  963    HA   SER 119           HA       SER 119 -26.837  10.507 -11.035
  964   1HB   SER 119          2HB       SER 119 -28.861   9.057  -9.311
  965   2HB   SER 119          1HB       SER 119 -28.373  10.740  -9.111
  966    HG   SER 119           HG       SER 119 -29.214  11.165 -11.177
  Start of MODEL   21
    1   1H    MET   1          1H        MET   1   5.563  22.871 -14.664
    2   2H    MET   1          2H        MET   1   7.227  22.566 -14.681
    3   3H    MET   1          3H        MET   1   6.635  24.055 -15.224
    4    HA   MET   1           HA       MET   1   6.461  23.036 -12.450
    5   1HB   MET   1          1HB       MET   1   8.164  25.239 -13.633
    6   2HB   MET   1          2HB       MET   1   8.069  24.827 -11.926
    7   1HG   MET   1          1HG       MET   1   8.991  22.617 -12.408
    8   2HG   MET   1          2HG       MET   1   9.088  23.034 -14.119
    9   1HE   MET   1          1HE       MET   1  11.747  25.913 -14.095
   10   2HE   MET   1          2HE       MET   1   9.997  26.091 -13.974
   11   3HE   MET   1          3HE       MET   1  10.690  24.918 -15.093
   12    H    CYS   2           H        CYS   2   5.107  24.099 -11.132
   13    HA   CYS   2           HA       CYS   2   4.008  26.676 -11.991
   14   1HB   CYS   2          2HB       CYS   2   1.722  25.937 -11.412
   15   2HB   CYS   2          1HB       CYS   2   2.395  25.019 -12.754
   16    HG   CYS   2           HG       CYS   2   2.433  23.835  -9.552
   17    H    ASN   3           H        ASN   3   3.951  28.113 -10.389
   18    HA   ASN   3           HA       ASN   3   3.407  27.383  -7.673
   19   1HB   ASN   3          2HB       ASN   3   5.772  26.752  -7.783
   20   2HB   ASN   3          1HB       ASN   3   6.184  28.358  -8.374
   21   1HD2  ASN   3          2HD2      ASN   3   6.120  30.108  -6.967
   22   2HD2  ASN   3          1HD2      ASN   3   6.089  29.904  -5.252
   23    H    THR   4           H        THR   4   2.633  29.083  -6.529
   24    HA   THR   4           HA       THR   4   2.393  31.622  -7.942
   25    HB   THR   4           HB       THR   4   1.097  30.735  -5.356
   26    HG1  THR   4           1HG      THR   4  -0.376  31.045  -7.701
   27   1HG2  THR   4          1HG2      THR   4  -0.430  32.618  -5.744
   28   2HG2  THR   4          2HG2      THR   4   0.508  33.083  -7.163
   29   3HG2  THR   4          3HG2      THR   4   1.236  33.167  -5.559
   30    H    ASN   5           H        ASN   5   4.284  32.727  -7.702
   31    HA   ASN   5           HA       ASN   5   5.585  32.890  -5.120
   32   1HB   ASN   5          2HB       ASN   5   6.951  32.707  -7.145
   33   2HB   ASN   5          1HB       ASN   5   6.263  34.208  -7.759
   34   1HD2  ASN   5          2HD2      ASN   5   8.254  35.208  -7.882
   35   2HD2  ASN   5          1HD2      ASN   5   9.120  35.725  -6.479
   36    H    MET   6           H        MET   6   4.143  34.014  -3.816
   37    HA   MET   6           HA       MET   6   4.010  36.892  -4.375
   38   1HB   MET   6          2HB       MET   6   1.723  35.196  -3.355
   39   2HB   MET   6          1HB       MET   6   1.715  36.952  -3.435
   40   1HG   MET   6          2HG       MET   6   1.955  36.838  -5.866
   41   2HG   MET   6          1HG       MET   6   1.947  35.078  -5.778
   42   1HE   MET   6          1HE       MET   6  -0.027  35.010  -7.566
   43   2HE   MET   6          2HE       MET   6  -0.020  36.771  -7.643
   44   3HE   MET   6          3HE       MET   6  -1.536  35.906  -7.387
   45    H    SER   7           H        SER   7   3.059  34.593  -1.814
   46    HA   SER   7           HA       SER   7   4.988  35.712   0.013
   47   1HB   SER   7          1HB       SER   7   3.146  37.342   0.204
   48   2HB   SER   7          2HB       SER   7   2.032  36.032   0.594
   49    HG   SER   7           HG       SER   7   2.921  37.196   2.432
   50    H    VAL   8           H        VAL   8   3.796  33.136  -1.236
   51    HA   VAL   8           HA       VAL   8   3.879  31.592   1.262
   52    HB   VAL   8           HB       VAL   8   2.206  30.006   0.195
   53   1HG1  VAL   8          1HG1      VAL   8   1.281  32.778   0.939
   54   2HG1  VAL   8          2HG1      VAL   8   1.623  31.458   2.057
   55   3HG1  VAL   8          3HG1      VAL   8   0.276  31.329   0.928
   56   1HG2  VAL   8          1HG2      VAL   8   2.339  30.844  -2.088
   57   2HG2  VAL   8          2HG2      VAL   8   1.705  32.405  -1.565
   58   3HG2  VAL   8          3HG2      VAL   8   0.690  30.966  -1.475
   59    HA   PRO   9           HA       PRO   9   6.916  29.977  -1.884
   60   1HB   PRO   9          1HB       PRO   9   8.969  29.700  -0.126
   61   2HB   PRO   9          2HB       PRO   9   8.641  31.204  -0.992
   62   1HG   PRO   9          2HG       PRO   9   7.913  30.431   1.808
   63   2HG   PRO   9          1HG       PRO   9   8.560  31.969   1.205
   64   1HD   PRO   9          2HD       PRO   9   5.934  31.613   1.745
   65   2HD   PRO   9          1HD       PRO   9   6.500  32.681   0.444
   66    H    THR  10           H        THR  10   7.172  27.853  -2.275
   67    HA   THR  10           HA       THR  10   6.175  25.972  -0.293
   68    HB   THR  10           HB       THR  10   6.294  24.305  -2.109
   69    HG1  THR  10           1HG      THR  10   7.121  26.467  -3.769
   70   1HG2  THR  10          1HG2      THR  10   4.951  26.890  -2.911
   71   2HG2  THR  10          2HG2      THR  10   4.267  25.650  -1.860
   72   3HG2  THR  10          3HG2      THR  10   4.576  25.293  -3.558
   73    H    ASP  11           H        ASP  11   7.450  24.828   0.996
   74    HA   ASP  11           HA       ASP  11  10.022  23.866   0.105
   75   1HB   ASP  11          1HB       ASP  11  11.289  24.882   1.958
   76   2HB   ASP  11          2HB       ASP  11  10.623  26.107   0.882
   77    H    GLY  12           H        GLY  12  10.731  22.092   1.256
   78   1HA   GLY  12          1HA       GLY  12  10.768  20.555   3.030
   79   2HA   GLY  12          2HA       GLY  12   9.384  21.375   3.741
   80    H    ALA  13           H        ALA  13   8.086  19.622   4.058
   81    HA   ALA  13           HA       ALA  13   6.831  18.519   1.683
   82   1HB   ALA  13          1HB       ALA  13   8.124  16.711   3.722
   83   2HB   ALA  13          2HB       ALA  13   8.694  16.981   2.075
   84   3HB   ALA  13          3HB       ALA  13   7.140  16.197   2.351
   85    H    VAL  14           H        VAL  14   4.709  18.233   1.983
   86    HA   VAL  14           HA       VAL  14   3.676  18.449   4.729
   87    HB   VAL  14           HB       VAL  14   2.219  18.985   2.136
   88   1HG1  VAL  14          1HG1      VAL  14   0.735  18.282   3.933
   89   2HG1  VAL  14          2HG1      VAL  14   0.509  19.994   3.574
   90   3HG1  VAL  14          3HG1      VAL  14   1.426  19.505   4.999
   91   1HG2  VAL  14          1HG2      VAL  14   3.978  20.624   2.494
   92   2HG2  VAL  14          2HG2      VAL  14   3.395  20.917   4.132
   93   3HG2  VAL  14          3HG2      VAL  14   2.394  21.355   2.748
   94    H    THR  15           H        THR  15   2.736  16.943   1.631
   95    HA   THR  15           HA       THR  15   1.494  14.752   3.127
   96    HB   THR  15           HB       THR  15   0.074  15.801   1.445
   97    HG1  THR  15           1HG      THR  15   0.270  13.585   0.015
   98   1HG2  THR  15          1HG2      THR  15   1.815  16.595  -0.071
   99   2HG2  THR  15          2HG2      THR  15   0.620  15.634  -0.939
  100   3HG2  THR  15          3HG2      THR  15   2.186  14.934  -0.530
  101    H    THR  16           H        THR  16   1.662  12.561   1.907
  102    HA   THR  16           HA       THR  16   4.284  11.650   2.089
  103    HB   THR  16           HB       THR  16   3.499   9.594   0.956
  104    HG1  THR  16           1HG      THR  16   1.231  11.227   0.457
  105   1HG2  THR  16          1HG2      THR  16   1.762   9.003   2.587
  106   2HG2  THR  16          2HG2      THR  16   1.568  10.708   2.997
  107   3HG2  THR  16          3HG2      THR  16   3.087   9.883   3.347
  108    H    SER  17           H        SER  17   2.374  11.968  -0.913
  109    HA   SER  17           HA       SER  17   4.550  13.173  -2.321
  110   1HB   SER  17          1HB       SER  17   5.346  10.858  -2.358
  111   2HB   SER  17          2HB       SER  17   3.809  10.327  -3.036
  112    HG   SER  17           HG       SER  17   4.282  11.732  -4.840
  113    H    GLN  18           H        GLN  18   1.546  11.300  -2.691
  114    HA   GLN  18           HA       GLN  18   0.436  13.473  -4.288
  115   1HB   GLN  18          2HB       GLN  18   1.400  11.841  -5.907
  116   2HB   GLN  18          1HB       GLN  18   0.385  10.591  -5.198
  117   1HG   GLN  18          1HG       GLN  18  -0.582  11.421  -7.253
  118   2HG   GLN  18          2HG       GLN  18  -1.612  11.797  -5.871
  119   1HE2  GLN  18          2HE2      GLN  18   1.325  13.535  -6.597
  120   2HE2  GLN  18          1HE2      GLN  18   0.568  15.020  -7.053
  121    H    ILE  19           H        ILE  19   0.003  10.399  -2.614
  122    HA   ILE  19           HA       ILE  19  -2.733  10.318  -3.337
  123    HB   ILE  19           HB       ILE  19  -2.787   8.219  -1.956
  124   1HG1  ILE  19          2HG1      ILE  19   0.183   8.758  -1.733
  125   2HG1  ILE  19          1HG1      ILE  19  -0.966   8.862  -0.400
  126   1HG2  ILE  19          1HG2      ILE  19  -1.162   7.031  -3.535
  127   2HG2  ILE  19          2HG2      ILE  19  -0.849   8.633  -4.209
  128   3HG2  ILE  19          3HG2      ILE  19  -2.479   7.958  -4.258
  129   1HD1  ILE  19          1HD1      ILE  19   0.284   6.766  -0.386
  130   2HD1  ILE  19          2HD1      ILE  19  -0.358   6.381  -1.986
  131   3HD1  ILE  19          3HD1      ILE  19  -1.447   6.501  -0.603
  132    HA   PRO  20           HA       PRO  20  -3.999  12.449   0.413
  133   1HB   PRO  20          2HB       PRO  20  -6.431  13.176  -0.425
  134   2HB   PRO  20          1HB       PRO  20  -4.975  13.952  -1.055
  135   1HG   PRO  20          1HG       PRO  20  -6.701  11.856  -2.300
  136   2HG   PRO  20          2HG       PRO  20  -5.908  13.249  -3.055
  137   1HD   PRO  20          1HD       PRO  20  -4.952  10.644  -3.105
  138   2HD   PRO  20          2HD       PRO  20  -3.974  12.096  -3.394
  139    H    ALA  21           H        ALA  21  -4.536  11.269   2.137
  140    HA   ALA  21           HA       ALA  21  -5.926   8.823   2.021
  141   1HB   ALA  21          1HB       ALA  21  -4.321   9.371   3.788
  142   2HB   ALA  21          2HB       ALA  21  -5.879   8.881   4.454
  143   3HB   ALA  21          3HB       ALA  21  -5.433  10.587   4.418
  144    H    SER  22           H        SER  22  -7.981   8.247   2.834
  145    HA   SER  22           HA       SER  22 -10.227   8.439   3.115
  146   1HB   SER  22          1HB       SER  22  -9.570   9.722   5.115
  147   2HB   SER  22          2HB       SER  22  -9.538  11.199   4.150
  148    HG   SER  22           HG       SER  22 -11.686  11.199   4.037
  149    H    GLU  23           H        GLU  23  -8.798   9.545   0.654
  150    HA   GLU  23           HA       GLU  23 -11.067  11.121  -0.370
  151   1HB   GLU  23          1HB       GLU  23  -8.207  10.998  -1.338
  152   2HB   GLU  23          2HB       GLU  23  -9.498  11.851  -2.173
  153   1HG   GLU  23          2HG       GLU  23  -8.507  12.440   0.608
  154   2HG   GLU  23          1HG       GLU  23  -8.129  13.364  -0.845
  155    H    GLN  24           H        GLN  24  -8.564   9.135  -1.957
  156    HA   GLN  24           HA       GLN  24 -10.741   7.516  -3.117
  157   1HB   GLN  24          1HB       GLN  24  -9.491   8.810  -4.802
  158   2HB   GLN  24          2HB       GLN  24  -7.994   8.063  -4.263
  159   1HG   GLN  24          2HG       GLN  24  -8.835   5.876  -4.950
  160   2HG   GLN  24          1HG       GLN  24 -10.334   6.626  -5.495
  161   1HE2  GLN  24          2HE2      GLN  24 -10.325   7.901  -7.348
  162   2HE2  GLN  24          1HE2      GLN  24  -9.033   7.843  -8.494
  163    H    GLU  25           H        GLU  25 -10.781   6.009  -1.419
  164    HA   GLU  25           HA       GLU  25  -8.260   4.600  -0.886
  165   1HB   GLU  25          1HB       GLU  25  -9.354   5.771   1.031
  166   2HB   GLU  25          2HB       GLU  25 -10.742   4.709   0.837
  167   1HG   GLU  25          1HG       GLU  25  -9.188   2.774   1.208
  168   2HG   GLU  25          2HG       GLU  25  -7.950   3.952   1.643
  169    H    THR  26           H        THR  26 -11.259   3.250   0.171
  170    HA   THR  26           HA       THR  26 -11.912   1.276  -1.574
  171    HB   THR  26           HB       THR  26  -9.435   0.896  -1.805
  172    HG1  THR  26           1HG      THR  26 -10.229  -1.510  -0.805
  173   1HG2  THR  26          1HG2      THR  26  -8.845   1.275   0.537
  174   2HG2  THR  26          2HG2      THR  26  -8.310  -0.315  -0.012
  175   3HG2  THR  26          3HG2      THR  26  -9.753  -0.167   0.994
  176    H    LEU  27           H        LEU  27 -12.604  -0.824  -0.457
  177    HA   LEU  27           HA       LEU  27 -11.483  -1.029   2.189
  178   1HB   LEU  27          1HB       LEU  27 -14.092  -0.434   2.188
  179   2HB   LEU  27          2HB       LEU  27 -14.220  -2.168   1.943
  180    HG   LEU  27           HG       LEU  27 -14.357  -1.886   4.274
  181   1HD1  LEU  27          1HD1      LEU  27 -12.208  -2.803   5.142
  182   2HD1  LEU  27          2HD1      LEU  27 -11.500  -2.519   3.549
  183   3HD1  LEU  27          3HD1      LEU  27 -12.832  -3.666   3.735
  184   1HD2  LEU  27          1HD2      LEU  27 -11.980  -0.039   4.089
  185   2HD2  LEU  27          2HD2      LEU  27 -12.833  -0.491   5.568
  186   3HD2  LEU  27          3HD2      LEU  27 -13.656   0.460   4.331
  187    H    VAL  28           H        VAL  28 -10.022  -2.286   0.961
  188    HA   VAL  28           HA       VAL  28 -11.097  -4.108  -0.979
  189    HB   VAL  28           HB       VAL  28  -9.251  -3.055  -1.850
  190   1HG1  VAL  28          1HG1      VAL  28  -7.154  -2.680  -0.568
  191   2HG1  VAL  28          2HG1      VAL  28  -7.957  -3.366   0.848
  192   3HG1  VAL  28          3HG1      VAL  28  -8.571  -1.880   0.114
  193   1HG2  VAL  28          1HG2      VAL  28  -8.940  -5.453  -2.134
  194   2HG2  VAL  28          2HG2      VAL  28  -8.069  -5.533  -0.602
  195   3HG2  VAL  28          3HG2      VAL  28  -7.383  -4.641  -1.961
  196    H    ARG  29           H        ARG  29 -10.853  -6.300  -1.074
  197    HA   ARG  29           HA       ARG  29  -9.896  -7.627   1.357
  198   1HB   ARG  29          2HB       ARG  29 -12.416  -8.510  -0.033
  199   2HB   ARG  29          1HB       ARG  29 -11.860  -8.910   1.587
  200   1HG   ARG  29          1HG       ARG  29 -12.314  -6.652   2.336
  201   2HG   ARG  29          2HG       ARG  29 -12.785  -6.177   0.701
  202   1HD   ARG  29          1HD       ARG  29 -14.741  -6.610   2.098
  203   2HD   ARG  29          2HD       ARG  29 -14.639  -7.761   0.766
  204    HE   ARG  29           HE       ARG  29 -13.380  -8.892   2.987
  205   1HH1  ARG  29          2HH1      ARG  29 -16.568  -7.919   1.971
  206   2HH1  ARG  29          1HH1      ARG  29 -17.378  -9.099   2.945
  207   1HH2  ARG  29          1HH2      ARG  29 -14.440 -10.448   4.273
  208   2HH2  ARG  29          2HH2      ARG  29 -16.170 -10.536   4.255
  209    HA   PRO  30           HA       PRO  30  -8.321  -9.170  -2.648
  210   1HB   PRO  30          2HB       PRO  30  -5.681  -9.401  -1.531
  211   2HB   PRO  30          1HB       PRO  30  -6.282  -8.202  -2.675
  212   1HG   PRO  30          1HG       PRO  30  -5.540  -7.646  -0.085
  213   2HG   PRO  30          2HG       PRO  30  -6.654  -6.659  -1.045
  214   1HD   PRO  30          1HD       PRO  30  -7.254  -8.680   1.073
  215   2HD   PRO  30          2HD       PRO  30  -8.056  -7.132   0.729
  216    H    LYS  31           H        LYS  31  -7.851 -11.188  -3.453
  217    HA   LYS  31           HA       LYS  31  -7.817 -13.532  -1.934
  218   1HB   LYS  31          2HB       LYS  31  -8.117 -13.495  -4.379
  219   2HB   LYS  31          1HB       LYS  31  -6.444 -12.989  -4.576
  220   1HG   LYS  31          2HG       LYS  31  -5.687 -15.095  -3.602
  221   2HG   LYS  31          1HG       LYS  31  -7.365 -15.603  -3.395
  222   1HD   LYS  31          1HD       LYS  31  -6.082 -14.937  -6.043
  223   2HD   LYS  31          2HD       LYS  31  -6.291 -16.571  -5.409
  224   1HE   LYS  31          2HE       LYS  31  -8.500 -14.609  -6.023
  225   2HE   LYS  31          1HE       LYS  31  -8.055 -16.008  -7.000
  226   1HZ   LYS  31          1HZ       LYS  31  -8.649 -17.443  -5.149
  227   2HZ   LYS  31          2HZ       LYS  31  -9.963 -16.479  -5.599
  228   3HZ   LYS  31          3HZ       LYS  31  -9.074 -16.101  -4.211
  229    HA   PRO  32           HA       PRO  32  -4.361 -12.609   0.569
  230   1HB   PRO  32          2HB       PRO  32  -3.678 -15.312   1.079
  231   2HB   PRO  32          1HB       PRO  32  -4.689 -14.261   2.073
  232   1HG   PRO  32          2HG       PRO  32  -5.477 -16.310   0.074
  233   2HG   PRO  32          1HG       PRO  32  -6.317 -15.789   1.546
  234   1HD   PRO  32          2HD       PRO  32  -7.181 -15.062  -0.881
  235   2HD   PRO  32          1HD       PRO  32  -7.266 -13.945   0.500
  236    H    LEU  33           H        LEU  33  -2.721 -11.786  -0.640
  237    HA   LEU  33           HA       LEU  33  -1.015 -13.691  -2.080
  238   1HB   LEU  33          2HB       LEU  33  -1.261 -10.699  -2.292
  239   2HB   LEU  33          1HB       LEU  33   0.024 -11.609  -3.060
  240    HG   LEU  33           HG       LEU  33  -2.930 -11.812  -3.650
  241   1HD1  LEU  33          1HD2      LEU  33  -1.860  -9.842  -4.588
  242   2HD1  LEU  33          2HD2      LEU  33  -2.250 -10.998  -5.862
  243   3HD1  LEU  33          3HD2      LEU  33  -0.589 -10.846  -5.287
  244   1HD2  LEU  33          1HD1      LEU  33  -0.629 -13.365  -4.833
  245   2HD2  LEU  33          2HD1      LEU  33  -2.302 -13.411  -5.390
  246   3HD2  LEU  33          3HD1      LEU  33  -1.889 -14.016  -3.785
  247    H    LEU  34           H        LEU  34  -1.037 -11.214   0.390
  248    HA   LEU  34           HA       LEU  34   0.680 -12.648   1.991
  249   1HB   LEU  34          1HB       LEU  34   2.091 -11.217   0.067
  250   2HB   LEU  34          2HB       LEU  34   2.201 -10.228   1.511
  251    HG   LEU  34           HG       LEU  34   4.103 -11.768   1.329
  252   1HD1  LEU  34          1HD1      LEU  34   2.176 -12.374   3.564
  253   2HD1  LEU  34          2HD1      LEU  34   3.425 -11.128   3.545
  254   3HD1  LEU  34          3HD1      LEU  34   3.881 -12.832   3.561
  255   1HD2  LEU  34          1HD2      LEU  34   3.409 -14.246   1.860
  256   2HD2  LEU  34          2HD2      LEU  34   3.431 -13.647   0.201
  257   3HD2  LEU  34          3HD2      LEU  34   1.901 -13.755   1.077
  258    H    LEU  35           H        LEU  35  -0.693 -12.241   3.579
  259    HA   LEU  35           HA       LEU  35  -1.040  -9.426   4.397
  260   1HB   LEU  35          2HB       LEU  35  -2.830 -11.814   4.909
  261   2HB   LEU  35          1HB       LEU  35  -3.079 -10.215   5.577
  262    HG   LEU  35           HG       LEU  35  -4.574 -10.464   3.737
  263   1HD1  LEU  35          1HD1      LEU  35  -3.114  -8.329   3.995
  264   2HD1  LEU  35          2HD1      LEU  35  -4.116  -8.533   2.558
  265   3HD1  LEU  35          3HD1      LEU  35  -2.384  -8.865   2.481
  266   1HD2  LEU  35          1HD2      LEU  35  -3.853 -11.045   1.488
  267   2HD2  LEU  35          2HD2      LEU  35  -3.438 -12.325   2.626
  268   3HD2  LEU  35          3HD2      LEU  35  -2.190 -11.222   2.050
  269    H    LYS  36           H        LYS  36   0.297 -12.498   5.175
  270    HA   LYS  36           HA       LYS  36   1.201 -11.686   7.768
  271   1HB   LYS  36          1HB       LYS  36   2.349 -13.502   5.647
  272   2HB   LYS  36          2HB       LYS  36   3.197 -13.158   7.147
  273   1HG   LYS  36          1HG       LYS  36   2.074 -15.221   7.433
  274   2HG   LYS  36          2HG       LYS  36   1.190 -14.018   8.376
  275   1HD   LYS  36          2HD       LYS  36  -0.446 -13.808   6.558
  276   2HD   LYS  36          1HD       LYS  36   0.432 -15.031   5.636
  277   1HE   LYS  36          2HE       LYS  36  -1.493 -16.010   6.758
  278   2HE   LYS  36          1HE       LYS  36   0.010 -16.667   7.406
  279   1HZ   LYS  36          1HZ       LYS  36  -1.553 -16.141   9.167
  280   2HZ   LYS  36          2HZ       LYS  36  -1.622 -14.528   8.664
  281   3HZ   LYS  36          3HZ       LYS  36  -0.180 -15.158   9.284
  282    H    LEU  37           H        LEU  37   1.522 -10.492   4.667
  283    HA   LEU  37           HA       LEU  37   4.010  -9.121   4.892
  284   1HB   LEU  37          2HB       LEU  37   2.710  -9.683   2.792
  285   2HB   LEU  37          1HB       LEU  37   1.578  -8.427   3.242
  286    HG   LEU  37           HG       LEU  37   3.218  -7.793   1.480
  287   1HD1  LEU  37          1HD1      LEU  37   2.009  -6.278   3.165
  288   2HD1  LEU  37          2HD1      LEU  37   3.325  -5.612   2.188
  289   3HD1  LEU  37          3HD1      LEU  37   3.614  -6.067   3.872
  290   1HD2  LEU  37          1HD2      LEU  37   5.157  -8.076   3.753
  291   2HD2  LEU  37          2HD2      LEU  37   5.479  -7.104   2.314
  292   3HD2  LEU  37          3HD2      LEU  37   5.215  -8.845   2.165
  293    H    LEU  38           H        LEU  38   0.808  -8.692   6.098
  294    HA   LEU  38           HA       LEU  38   1.517  -6.014   7.093
  295   1HB   LEU  38          1HB       LEU  38  -1.194  -6.969   6.191
  296   2HB   LEU  38          2HB       LEU  38  -0.866  -5.404   6.909
  297    HG   LEU  38           HG       LEU  38  -0.102  -6.431   4.192
  298   1HD1  LEU  38          1HD2      LEU  38  -2.260  -5.238   4.586
  299   2HD1  LEU  38          2HD2      LEU  38  -1.191  -4.468   3.414
  300   3HD1  LEU  38          3HD2      LEU  38  -1.319  -3.818   5.051
  301   1HD2  LEU  38          1HD1      LEU  38   1.237  -4.360   3.937
  302   2HD2  LEU  38          2HD1      LEU  38   1.932  -5.545   5.041
  303   3HD2  LEU  38          3HD1      LEU  38   1.113  -4.120   5.680
  304    H    LYS  39           H        LYS  39  -0.907  -8.582   7.628
  305    HA   LYS  39           HA       LYS  39  -1.610  -8.179  10.217
  306   1HB   LYS  39          1HB       LYS  39  -0.945 -10.819   8.911
  307   2HB   LYS  39          2HB       LYS  39  -1.745 -10.678  10.469
  308   1HG   LYS  39          2HG       LYS  39  -3.703  -9.903   9.548
  309   2HG   LYS  39          1HG       LYS  39  -2.902  -9.288   8.102
  310   1HD   LYS  39          1HD       LYS  39  -2.566 -11.522   7.275
  311   2HD   LYS  39          2HD       LYS  39  -3.220 -12.210   8.765
  312   1HE   LYS  39          2HE       LYS  39  -5.377 -11.060   8.255
  313   2HE   LYS  39          1HE       LYS  39  -4.695 -10.585   6.700
  314   1HZ   LYS  39          1HZ       LYS  39  -6.038 -12.577   6.499
  315   2HZ   LYS  39          2HZ       LYS  39  -5.077 -13.376   7.638
  316   3HZ   LYS  39          3HZ       LYS  39  -4.418 -12.921   6.148
  317    H    SER  40           H        SER  40   1.453  -9.538   9.112
  318    HA   SER  40           HA       SER  40   2.332 -10.283  11.729
  319   1HB   SER  40          2HB       SER  40   3.179 -11.446   9.754
  320   2HB   SER  40          1HB       SER  40   3.898  -9.949   9.161
  321    HG   SER  40           HG       SER  40   4.563 -11.099  11.661
  322    H    VAL  41           H        VAL  41   3.120  -7.600   9.528
  323    HA   VAL  41           HA       VAL  41   4.984  -6.409  11.312
  324    HB   VAL  41           HB       VAL  41   5.052  -6.050   8.870
  325   1HG1  VAL  41          1HG1      VAL  41   2.542  -4.453   9.350
  326   2HG1  VAL  41          2HG1      VAL  41   2.717  -5.893   8.346
  327   3HG1  VAL  41          3HG1      VAL  41   3.505  -4.385   7.871
  328   1HG2  VAL  41          1HG2      VAL  41   5.672  -3.743   8.929
  329   2HG2  VAL  41          2HG2      VAL  41   6.108  -4.472  10.476
  330   3HG2  VAL  41          3HG2      VAL  41   4.663  -3.459  10.352
  331    H    GLY  42           H        GLY  42   1.698  -6.677  11.555
  332   1HA   GLY  42          1HA       GLY  42   1.452  -5.501  13.945
  333   2HA   GLY  42          2HA       GLY  42   1.267  -4.123  12.875
  334    H    ALA  43           H        ALA  43  -0.134  -5.594  10.799
  335    HA   ALA  43           HA       ALA  43  -2.690  -4.849  11.645
  336   1HB   ALA  43          1HB       ALA  43  -3.480  -5.732   9.524
  337   2HB   ALA  43          2HB       ALA  43  -1.960  -6.601   9.304
  338   3HB   ALA  43          3HB       ALA  43  -1.977  -4.838   9.304
  339    H    GLN  44           H        GLN  44  -4.656  -6.336  11.399
  340    HA   GLN  44           HA       GLN  44  -4.205  -9.025  12.432
  341   1HB   GLN  44          2HB       GLN  44  -5.787  -6.922  13.916
  342   2HB   GLN  44          1HB       GLN  44  -5.837  -8.639  14.289
  343   1HG   GLN  44          2HG       GLN  44  -3.391  -6.888  14.416
  344   2HG   GLN  44          1HG       GLN  44  -4.360  -7.408  15.794
  345   1HE2  GLN  44          2HE2      GLN  44  -1.537  -7.870  15.192
  346   2HE2  GLN  44          1HE2      GLN  44  -1.326  -9.585  15.192
  347    H    LYS  45           H        LYS  45  -6.296  -6.606  11.054
  348    HA   LYS  45           HA       LYS  45  -8.704  -8.059  11.037
  349   1HB   LYS  45          2HB       LYS  45  -7.819  -5.950   9.060
  350   2HB   LYS  45          1HB       LYS  45  -9.473  -6.449   9.386
  351   1HG   LYS  45          1HG       LYS  45  -9.277  -5.599  11.673
  352   2HG   LYS  45          2HG       LYS  45  -7.624  -5.082  11.331
  353   1HD   LYS  45          1HD       LYS  45 -10.074  -4.113   9.860
  354   2HD   LYS  45          2HD       LYS  45  -9.273  -3.242  11.168
  355   1HE   LYS  45          1HE       LYS  45  -7.221  -3.137   9.844
  356   2HE   LYS  45          2HE       LYS  45  -8.016  -4.015   8.537
  357   1HZ   LYS  45          1HZ       LYS  45  -7.996  -1.639   8.119
  358   2HZ   LYS  45          2HZ       LYS  45  -8.822  -1.348   9.567
  359   3HZ   LYS  45          3HZ       LYS  45  -9.584  -2.190   8.313
  360    H    ASP  46           H        ASP  46  -9.773  -9.143   9.330
  361    HA   ASP  46           HA       ASP  46  -8.043 -10.764   7.695
  362   1HB   ASP  46          1HB       ASP  46 -10.131 -11.861   6.975
  363   2HB   ASP  46          2HB       ASP  46 -10.022 -11.756   8.731
  364    H    THR  47           H        THR  47  -9.542  -7.766   7.351
  365    HA   THR  47           HA       THR  47  -9.075  -7.860   4.439
  366    HB   THR  47           HB       THR  47 -10.741  -5.998   4.235
  367    HG1  THR  47           1HG      THR  47 -12.041  -5.516   5.966
  368   1HG2  THR  47          1HG2      THR  47 -11.340  -8.348   3.735
  369   2HG2  THR  47          2HG2      THR  47 -12.705  -7.392   4.314
  370   3HG2  THR  47          3HG2      THR  47 -11.900  -8.530   5.398
  371    H    TYR  48           H        TYR  48  -8.924  -5.440   3.643
  372    HA   TYR  48           HA       TYR  48  -7.341  -3.832   5.480
  373   1HB   TYR  48          2HB       TYR  48  -6.268  -5.119   2.988
  374   2HB   TYR  48          1HB       TYR  48  -5.561  -3.649   3.644
  375    HD1  TYR  48           1HD      TYR  48  -4.521  -3.663   5.865
  376    HD2  TYR  48           2HD      TYR  48  -5.887  -7.243   4.022
  377    HE1  TYR  48           1HE      TYR  48  -3.143  -4.976   7.418
  378    HE2  TYR  48           2HE      TYR  48  -4.486  -8.571   5.559
  379    HH   TYR  48           HH       TYR  48  -3.222  -7.395   8.347
  380    H    THR  49           H        THR  49  -6.555  -1.800   4.320
  381    HA   THR  49           HA       THR  49  -8.344  -1.045   2.133
  382    HB   THR  49           HB       THR  49  -9.007   1.006   3.081
  383    HG1  THR  49           1HG      THR  49  -7.750   0.904   5.500
  384   1HG2  THR  49          1HG2      THR  49 -10.060   0.410   5.213
  385   2HG2  THR  49          2HG2      THR  49  -9.026  -1.016   5.323
  386   3HG2  THR  49          3HG2      THR  49 -10.220  -0.889   4.031
  387    H    MET  50           H        MET  50  -7.570   1.504   1.648
  388    HA   MET  50           HA       MET  50  -4.990   1.020   0.484
  389   1HB   MET  50          2HB       MET  50  -6.984   3.252   0.305
  390   2HB   MET  50          1HB       MET  50  -5.363   3.454  -0.347
  391   1HG   MET  50          2HG       MET  50  -5.848   1.242  -1.589
  392   2HG   MET  50          1HG       MET  50  -7.533   1.600  -1.222
  393   1HE   MET  50          1HE       MET  50  -4.806   4.375  -3.707
  394   2HE   MET  50          2HE       MET  50  -4.281   2.828  -3.040
  395   3HE   MET  50          3HE       MET  50  -4.647   4.175  -1.963
  396    H    LYS  51           H        LYS  51  -6.261   3.118   3.031
  397    HA   LYS  51           HA       LYS  51  -3.720   4.389   3.498
  398   1HB   LYS  51          2HB       LYS  51  -4.792   5.389   5.444
  399   2HB   LYS  51          1HB       LYS  51  -5.836   5.531   4.037
  400   1HG   LYS  51          2HG       LYS  51  -7.201   3.693   4.820
  401   2HG   LYS  51          1HG       LYS  51  -6.119   3.447   6.192
  402   1HD   LYS  51          1HD       LYS  51  -6.661   5.682   7.026
  403   2HD   LYS  51          2HD       LYS  51  -7.739   5.934   5.652
  404   1HE   LYS  51          1HE       LYS  51  -9.128   4.065   6.390
  405   2HE   LYS  51          2HE       LYS  51  -8.045   3.795   7.755
  406   1HZ   LYS  51          1HZ       LYS  51 -10.009   5.051   8.399
  407   2HZ   LYS  51          2HZ       LYS  51  -9.630   6.262   7.281
  408   3HZ   LYS  51          3HZ       LYS  51  -8.609   5.981   8.599
  409    H    GLU  52           H        GLU  52  -5.578   1.751   4.893
  410    HA   GLU  52           HA       GLU  52  -3.960   1.034   7.025
  411   1HB   GLU  52          2HB       GLU  52  -6.108  -0.066   5.548
  412   2HB   GLU  52          1HB       GLU  52  -4.857  -1.292   5.615
  413   1HG   GLU  52          1HG       GLU  52  -6.061   0.118   7.983
  414   2HG   GLU  52          2HG       GLU  52  -6.455  -1.513   7.445
  415    H    VAL  53           H        VAL  53  -3.849  -0.233   3.695
  416    HA   VAL  53           HA       VAL  53  -1.340  -1.528   4.041
  417    HB   VAL  53           HB       VAL  53  -2.725  -0.737   1.472
  418   1HG1  VAL  53          1HG2      VAL  53  -0.363  -1.214   1.133
  419   2HG1  VAL  53          2HG2      VAL  53  -1.360  -2.497   0.448
  420   3HG1  VAL  53          3HG2      VAL  53  -0.535  -2.746   1.987
  421   1HG2  VAL  53          1HG1      VAL  53  -2.818  -3.309   3.043
  422   2HG2  VAL  53          2HG1      VAL  53  -3.521  -3.063   1.445
  423   3HG2  VAL  53          3HG1      VAL  53  -4.138  -2.160   2.828
  424    H    LEU  54           H        LEU  54  -2.267   1.713   3.310
  425    HA   LEU  54           HA       LEU  54  -0.081   2.684   1.919
  426   1HB   LEU  54          1HB       LEU  54  -1.870   4.171   2.316
  427   2HB   LEU  54          2HB       LEU  54  -1.796   3.929   4.049
  428    HG   LEU  54           HG       LEU  54   0.307   5.175   4.156
  429   1HD1  LEU  54          1HD2      LEU  54   1.201   4.604   1.966
  430   2HD1  LEU  54          2HD2      LEU  54   1.156   6.354   2.190
  431   3HD1  LEU  54          3HD2      LEU  54  -0.060   5.560   1.189
  432   1HD2  LEU  54          1HD1      LEU  54  -1.783   6.389   4.408
  433   2HD2  LEU  54          2HD1      LEU  54  -1.869   6.632   2.663
  434   3HD2  LEU  54          3HD1      LEU  54  -0.577   7.386   3.597
  435    H    PHE  55           H        PHE  55  -0.397   3.096   5.450
  436    HA   PHE  55           HA       PHE  55   2.409   3.524   5.686
  437   1HB   PHE  55          1HB       PHE  55   1.945   3.524   8.160
  438   2HB   PHE  55          2HB       PHE  55   1.016   4.689   7.225
  439    HD1  PHE  55           1HD      PHE  55   0.807   1.343   8.809
  440    HD2  PHE  55           2HD      PHE  55  -1.301   4.734   7.343
  441    HE1  PHE  55           1HE      PHE  55  -1.274   0.466   9.787
  442    HE2  PHE  55           2HE      PHE  55  -3.386   3.864   8.315
  443    HZ   PHE  55           HZ       PHE  55  -3.375   1.728   9.540
  444    H    TYR  56           H        TYR  56   0.385   0.716   5.886
  445    HA   TYR  56           HA       TYR  56   2.138  -0.795   7.559
  446   1HB   TYR  56          1HB       TYR  56  -0.439  -1.215   6.289
  447   2HB   TYR  56          2HB       TYR  56   0.579  -2.653   6.234
  448    HD1  TYR  56           1HD      TYR  56   2.086  -2.289   8.789
  449    HD2  TYR  56           2HD      TYR  56  -2.046  -1.816   7.893
  450    HE1  TYR  56           1HE      TYR  56   1.535  -2.783  11.130
  451    HE2  TYR  56           2HE      TYR  56  -2.618  -2.301  10.231
  452    HH   TYR  56           HH       TYR  56  -0.299  -2.359  12.716
  453    H    LEU  57           H        LEU  57   1.446  -0.913   4.060
  454    HA   LEU  57           HA       LEU  57   3.432  -2.786   3.419
  455   1HB   LEU  57          2HB       LEU  57   1.587  -1.416   1.976
  456   2HB   LEU  57          1HB       LEU  57   3.041  -0.552   1.522
  457    HG   LEU  57           HG       LEU  57   2.837  -2.169  -0.139
  458   1HD1  LEU  57          1HD1      LEU  57   5.066  -2.181   1.118
  459   2HD1  LEU  57          2HD1      LEU  57   4.714  -3.545   0.056
  460   3HD1  LEU  57          3HD1      LEU  57   4.527  -3.718   1.801
  461   1HD2  LEU  57          1HD2      LEU  57   2.129  -4.169   2.001
  462   2HD2  LEU  57          2HD2      LEU  57   2.270  -4.512   0.276
  463   3HD2  LEU  57          3HD2      LEU  57   1.012  -3.421   0.859
  464    H    GLY  58           H        GLY  58   3.550   0.735   3.787
  465   1HA   GLY  58          2HA       GLY  58   6.295   1.112   3.355
  466   2HA   GLY  58          1HA       GLY  58   5.297   2.078   4.433
  467    H    GLN  59           H        GLN  59   4.549  -0.036   6.210
  468    HA   GLN  59           HA       GLN  59   6.717  -0.013   7.997
  469   1HB   GLN  59          2HB       GLN  59   4.262  -1.770   7.911
  470   2HB   GLN  59          1HB       GLN  59   5.422  -1.792   9.229
  471   1HG   GLN  59          2HG       GLN  59   3.557   0.404   8.420
  472   2HG   GLN  59          1HG       GLN  59   3.668  -0.439   9.960
  473   1HE2  GLN  59          1HE2      GLN  59   5.041   2.026   7.940
  474   2HE2  GLN  59          2HE2      GLN  59   6.038   2.750   9.152
  475    H    TYR  60           H        TYR  60   5.435  -2.675   5.980
  476    HA   TYR  60           HA       TYR  60   7.203  -4.591   6.985
  477   1HB   TYR  60          2HB       TYR  60   5.088  -5.028   5.668
  478   2HB   TYR  60          1HB       TYR  60   6.018  -4.670   4.216
  479    HD1  TYR  60           1HD      TYR  60   8.068  -6.103   3.727
  480    HD2  TYR  60           2HD      TYR  60   5.160  -7.147   6.645
  481    HE1  TYR  60           1HE      TYR  60   8.860  -8.428   3.677
  482    HE2  TYR  60           2HE      TYR  60   5.944  -9.472   6.607
  483    HH   TYR  60           HH       TYR  60   8.853 -10.409   5.127
  484    H    ILE  61           H        ILE  61   7.491  -2.530   4.085
  485    HA   ILE  61           HA       ILE  61   9.839  -3.777   3.143
  486    HB   ILE  61           HB       ILE  61  10.217  -1.556   1.923
  487   1HG1  ILE  61          2HG1      ILE  61   7.456  -1.074   3.056
  488   2HG1  ILE  61          1HG1      ILE  61   8.896  -0.105   3.353
  489   1HG2  ILE  61          1HG2      ILE  61   8.485  -2.093   0.288
  490   2HG2  ILE  61          2HG2      ILE  61   7.683  -3.121   1.477
  491   3HG2  ILE  61          3HG2      ILE  61   9.291  -3.543   0.888
  492   1HD1  ILE  61          1HD1      ILE  61   7.613  -0.462   0.654
  493   2HD1  ILE  61          2HD1      ILE  61   8.943   0.621   1.068
  494   3HD1  ILE  61          3HD1      ILE  61   7.336   0.909   1.732
  495    H    MET  62           H        MET  62   9.404  -0.794   5.056
  496    HA   MET  62           HA       MET  62  12.159  -0.341   5.472
  497   1HB   MET  62          1HB       MET  62  11.514   1.192   7.193
  498   2HB   MET  62          2HB       MET  62  10.344   1.331   5.889
  499   1HG   MET  62          2HG       MET  62   8.787  -0.078   7.150
  500   2HG   MET  62          1HG       MET  62   9.957  -0.172   8.466
  501   1HE   MET  62          1HE       MET  62  11.160   2.789   8.417
  502   2HE   MET  62          2HE       MET  62  10.732   1.943   9.904
  503   3HE   MET  62          3HE       MET  62  10.140   3.579   9.620
  504    H    THR  63           H        THR  63  10.050  -2.717   6.700
  505    HA   THR  63           HA       THR  63  12.045  -3.480   8.725
  506    HB   THR  63           HB       THR  63  10.364  -5.027   9.626
  507    HG1  THR  63           1HG      THR  63   8.121  -4.247   8.614
  508   1HG2  THR  63          1HG2      THR  63   9.353  -2.196   9.326
  509   2HG2  THR  63          2HG2      THR  63  10.496  -2.766  10.542
  510   3HG2  THR  63          3HG2      THR  63   8.832  -3.349  10.554
  511    H    LYS  64           H        LYS  64  11.973  -6.066   8.938
  512    HA   LYS  64           HA       LYS  64  12.594  -8.064   8.045
  513   1HB   LYS  64          2HB       LYS  64  10.645  -7.235   5.890
  514   2HB   LYS  64          1HB       LYS  64  11.226  -8.870   6.163
  515   1HG   LYS  64          2HG       LYS  64   9.810  -7.359   8.325
  516   2HG   LYS  64          1HG       LYS  64   8.916  -8.213   7.067
  517   1HD   LYS  64          1HD       LYS  64   9.055  -9.785   8.772
  518   2HD   LYS  64          2HD       LYS  64  10.384 -10.236   7.703
  519   1HE   LYS  64          1HE       LYS  64  11.073 -10.289  10.044
  520   2HE   LYS  64          2HE       LYS  64  11.959  -9.061   9.142
  521   1HZ   LYS  64          1HZ       LYS  64   9.625  -8.557  10.908
  522   2HZ   LYS  64          2HZ       LYS  64  10.479  -7.378  10.045
  523   3HZ   LYS  64          3HZ       LYS  64  11.241  -8.231  11.290
  524    H    ARG  65           H        ARG  65  13.827  -5.427   6.972
  525    HA   ARG  65           HA       ARG  65  15.468  -4.836   5.490
  526   1HB   ARG  65          2HB       ARG  65  16.256  -7.668   6.177
  527   2HB   ARG  65          1HB       ARG  65  17.331  -6.468   5.471
  528   1HG   ARG  65          1HG       ARG  65  17.094  -5.067   7.444
  529   2HG   ARG  65          2HG       ARG  65  15.979  -6.237   8.151
  530   1HD   ARG  65          1HD       ARG  65  18.856  -6.772   7.426
  531   2HD   ARG  65          2HD       ARG  65  18.252  -6.462   9.053
  532    HE   ARG  65           HE       ARG  65  16.926  -8.656   7.778
  533   1HH1  ARG  65          2HH1      ARG  65  19.768  -7.716   9.563
  534   2HH1  ARG  65          1HH1      ARG  65  20.061  -9.306  10.184
  535   1HH2  ARG  65          1HH2      ARG  65  17.304 -10.751   8.595
  536   2HH2  ARG  65          2HH2      ARG  65  18.660 -11.031   9.633
  537    H    LEU  66           H        LEU  66  13.589  -5.035   3.807
  538    HA   LEU  66           HA       LEU  66  14.812  -6.516   1.575
  539   1HB   LEU  66          2HB       LEU  66  11.924  -5.699   1.604
  540   2HB   LEU  66          1HB       LEU  66  12.717  -6.895   0.593
  541    HG   LEU  66           HG       LEU  66  12.305  -7.216   3.566
  542   1HD1  LEU  66          1HD1      LEU  66  10.486  -8.704   3.028
  543   2HD1  LEU  66          2HD1      LEU  66  10.710  -8.402   1.305
  544   3HD1  LEU  66          3HD1      LEU  66  10.169  -7.101   2.368
  545   1HD2  LEU  66          1HD2      LEU  66  12.877  -9.525   3.172
  546   2HD2  LEU  66          2HD2      LEU  66  14.173  -8.482   2.586
  547   3HD2  LEU  66          3HD2      LEU  66  13.049  -9.220   1.443
  548    H    TYR  67           H        TYR  67  13.924  -3.540   2.917
  549    HA   TYR  67           HA       TYR  67  13.413  -2.095   0.503
  550   1HB   TYR  67          1HB       TYR  67  13.192  -0.182   1.882
  551   2HB   TYR  67          2HB       TYR  67  12.556  -1.525   2.822
  552    HD1  TYR  67           1HD      TYR  67  13.927  -2.505   4.667
  553    HD2  TYR  67           2HD      TYR  67  15.065   1.065   2.655
  554    HE1  TYR  67           1HE      TYR  67  15.455  -1.958   6.514
  555    HE2  TYR  67           2HE      TYR  67  16.596   1.622   4.494
  556    HH   TYR  67           HH       TYR  67  16.874   1.101   6.881
  557    H    ASP  68           H        ASP  68  14.735  -0.758  -0.657
  558    HA   ASP  68           HA       ASP  68  17.462  -1.262  -0.836
  559   1HB   ASP  68          2HB       ASP  68  15.955  -0.077  -2.527
  560   2HB   ASP  68          1HB       ASP  68  16.206   1.383  -1.572
  561    H    GLU  69           H        GLU  69  19.230  -0.508   0.202
  562    HA   GLU  69           HA       GLU  69  18.848   0.932   2.654
  563   1HB   GLU  69          1HB       GLU  69  21.492   0.247   1.376
  564   2HB   GLU  69          2HB       GLU  69  21.147   0.496   3.084
  565   1HG   GLU  69          2HG       GLU  69  19.813  -1.539   3.120
  566   2HG   GLU  69          1HG       GLU  69  20.128  -1.781   1.403
  567    H    LYS  70           H        LYS  70  18.981   1.987  -0.431
  568    HA   LYS  70           HA       LYS  70  20.809   4.152  -0.274
  569   1HB   LYS  70          2HB       LYS  70  18.436   3.662  -2.076
  570   2HB   LYS  70          1HB       LYS  70  19.522   5.032  -2.255
  571   1HG   LYS  70          1HG       LYS  70  20.335   2.136  -2.416
  572   2HG   LYS  70          2HG       LYS  70  20.057   3.201  -3.794
  573   1HD   LYS  70          1HD       LYS  70  22.115   3.681  -1.641
  574   2HD   LYS  70          2HD       LYS  70  22.456   2.949  -3.211
  575   1HE   LYS  70          2HE       LYS  70  21.349   5.717  -2.753
  576   2HE   LYS  70          1HE       LYS  70  23.015   5.332  -3.185
  577   1HZ   LYS  70          1HZ       LYS  70  21.737   6.003  -5.117
  578   2HZ   LYS  70          2HZ       LYS  70  20.622   4.761  -4.849
  579   3HZ   LYS  70          3HZ       LYS  70  22.218   4.388  -5.262
  580    H    GLN  71           H        GLN  71  17.311   4.566  -0.716
  581    HA   GLN  71           HA       GLN  71  17.281   6.419   1.555
  582   1HB   GLN  71          2HB       GLN  71  16.089   7.037  -1.152
  583   2HB   GLN  71          1HB       GLN  71  15.992   8.058   0.275
  584   1HG   GLN  71          2HG       GLN  71  18.404   8.360   0.243
  585   2HG   GLN  71          1HG       GLN  71  18.525   7.302  -1.164
  586   1HE2  GLN  71          1HE2      GLN  71  17.819   8.037  -3.166
  587   2HE2  GLN  71          2HE2      GLN  71  17.538   9.712  -3.484
  588    H    GLN  72           H        GLN  72  16.212   3.658   0.707
  589    HA   GLN  72           HA       GLN  72  14.455   2.360   1.352
  590   1HB   GLN  72          2HB       GLN  72  13.352   4.779   2.780
  591   2HB   GLN  72          1HB       GLN  72  13.088   3.083   3.163
  592   1HG   GLN  72          2HG       GLN  72  15.484   2.886   3.746
  593   2HG   GLN  72          1HG       GLN  72  15.657   4.618   3.466
  594   1HE2  GLN  72          2HE2      GLN  72  12.806   3.196   4.881
  595   2HE2  GLN  72          1HE2      GLN  72  13.034   3.836   6.470
  596    H    HIS  73           H        HIS  73  14.154   4.965  -0.644
  597    HA   HIS  73           HA       HIS  73  11.320   4.962  -1.082
  598   1HB   HIS  73          1HB       HIS  73  11.832   6.319  -3.051
  599   2HB   HIS  73          2HB       HIS  73  12.729   6.906  -1.654
  600    HD1  HIS  73           1HD      HIS  73  15.290   5.668  -1.578
  601    HD2  HIS  73           2HD      HIS  73  13.401   6.237  -5.235
  602    HE1  HIS  73           1HE      HIS  73  17.119   5.572  -3.301
  603    HE2  HIS  73           2HE      HIS  73  15.940   5.833  -5.514
  604    H    ILE  74           H        ILE  74  14.103   3.328  -2.516
  605    HA   ILE  74           HA       ILE  74  12.321   1.654  -4.115
  606    HB   ILE  74           HB       ILE  74  15.293   1.285  -3.755
  607   1HG1  ILE  74          2HG1      ILE  74  14.925   3.538  -4.619
  608   2HG1  ILE  74          1HG1      ILE  74  15.579   2.498  -5.880
  609   1HG2  ILE  74          1HG2      ILE  74  15.113   0.095  -5.894
  610   2HG2  ILE  74          2HG2      ILE  74  13.371   0.370  -5.889
  611   3HG2  ILE  74          3HG2      ILE  74  14.109  -0.636  -4.641
  612   1HD1  ILE  74          1HD1      ILE  74  13.350   2.254  -6.838
  613   2HD1  ILE  74          2HD1      ILE  74  13.837   3.947  -6.746
  614   3HD1  ILE  74          3HD1      ILE  74  12.692   3.292  -5.573
  615    H    VAL  75           H        VAL  75  12.126  -0.593  -3.764
  616    HA   VAL  75           HA       VAL  75  13.640  -1.824  -1.643
  617    HB   VAL  75           HB       VAL  75  11.903  -1.197  -0.212
  618   1HG1  VAL  75          1HG2      VAL  75   9.959  -1.964  -2.382
  619   2HG1  VAL  75          2HG2      VAL  75  10.365  -0.325  -1.865
  620   3HG1  VAL  75          3HG2      VAL  75   9.520  -1.415  -0.765
  621   1HG2  VAL  75          1HG1      VAL  75  10.785  -3.255   0.382
  622   2HG2  VAL  75          2HG1      VAL  75  12.438  -3.604  -0.121
  623   3HG2  VAL  75          3HG1      VAL  75  11.097  -3.922  -1.220
  624    H    TYR  76           H        TYR  76  14.374  -3.612  -2.516
  625    HA   TYR  76           HA       TYR  76  13.125  -4.605  -4.919
  626   1HB   TYR  76          2HB       TYR  76  15.672  -5.511  -3.582
  627   2HB   TYR  76          1HB       TYR  76  15.167  -5.857  -5.235
  628    HD1  TYR  76           1HD      TYR  76  16.573  -3.361  -2.983
  629    HD2  TYR  76           2HD      TYR  76  15.184  -4.092  -6.935
  630    HE1  TYR  76           1HE      TYR  76  17.672  -1.300  -3.743
  631    HE2  TYR  76           2HE      TYR  76  16.293  -2.034  -7.710
  632    HH   TYR  76           HH       TYR  76  17.074   0.097  -6.776
  633    H    CYS  77           H        CYS  77  11.794  -6.269  -5.018
  634    HA   CYS  77           HA       CYS  77  11.980  -8.445  -3.094
  635   1HB   CYS  77          2HB       CYS  77   9.481  -6.773  -3.420
  636   2HB   CYS  77          1HB       CYS  77   9.569  -8.286  -2.526
  637    HG   CYS  77           HG       CYS  77   9.542  -5.792  -0.953
  638    H    SER  78           H        SER  78  12.652  -9.456  -5.127
  639    HA   SER  78           HA       SER  78  10.479  -9.951  -7.024
  640   1HB   SER  78          1HB       SER  78  12.625  -9.278  -7.990
  641   2HB   SER  78          2HB       SER  78  13.424 -10.634  -7.194
  642    HG   SER  78           HG       SER  78  12.139 -10.592  -9.538
  643    H    ASN  79           H        ASN  79  11.870 -11.323  -4.312
  644    HA   ASN  79           HA       ASN  79  10.491 -13.842  -4.833
  645   1HB   ASN  79          1HB       ASN  79  13.374 -13.690  -3.919
  646   2HB   ASN  79          2HB       ASN  79  12.404 -15.160  -3.969
  647   1HD2  ASN  79          1HD2      ASN  79  11.870 -16.066  -5.958
  648   2HD2  ASN  79          2HD2      ASN  79  12.706 -15.644  -7.409
  649    H    ASP  80           H        ASP  80  10.235 -11.386  -3.110
  650    HA   ASP  80           HA       ASP  80  10.491 -12.567  -0.436
  651   1HB   ASP  80          2HB       ASP  80  10.044  -9.704  -1.297
  652   2HB   ASP  80          1HB       ASP  80  10.145 -10.247   0.377
  653    H    LEU  81           H        LEU  81   8.677 -11.483   1.073
  654    HA   LEU  81           HA       LEU  81   6.239 -12.705   0.459
  655   1HB   LEU  81          1HB       LEU  81   6.942 -10.506   2.397
  656   2HB   LEU  81          2HB       LEU  81   5.337 -11.204   2.301
  657    HG   LEU  81           HG       LEU  81   6.496 -12.231   4.128
  658   1HD1  LEU  81          1HD1      LEU  81   6.419 -14.115   1.775
  659   2HD1  LEU  81          2HD1      LEU  81   5.066 -13.709   2.833
  660   3HD1  LEU  81          3HD1      LEU  81   6.454 -14.588   3.475
  661   1HD2  LEU  81          1HD2      LEU  81   8.597 -13.446   3.840
  662   2HD2  LEU  81          2HD2      LEU  81   8.779 -11.735   3.460
  663   3HD2  LEU  81          3HD2      LEU  81   8.672 -12.921   2.159
  664    H    LEU  82           H        LEU  82   7.110  -9.248   0.369
  665    HA   LEU  82           HA       LEU  82   4.811  -8.341  -0.958
  666   1HB   LEU  82          1HB       LEU  82   6.984  -7.127   0.057
  667   2HB   LEU  82          2HB       LEU  82   7.416  -7.096  -1.640
  668    HG   LEU  82           HG       LEU  82   6.263  -5.032  -0.793
  669   1HD1  LEU  82          1HD2      LEU  82   4.854  -6.533  -2.995
  670   2HD1  LEU  82          2HD2      LEU  82   6.336  -5.593  -3.171
  671   3HD1  LEU  82          3HD2      LEU  82   4.828  -4.788  -2.740
  672   1HD2  LEU  82          1HD1      LEU  82   4.675  -6.099   0.708
  673   2HD2  LEU  82          2HD1      LEU  82   3.885  -6.880  -0.660
  674   3HD2  LEU  82          3HD1      LEU  82   3.835  -5.126  -0.499
  675    H    GLY  83           H        GLY  83   7.506 -10.193  -2.031
  676   1HA   GLY  83          2HA       GLY  83   7.427  -9.795  -4.794
  677   2HA   GLY  83          1HA       GLY  83   7.861 -11.305  -4.006
  678    H    ASP  84           H        ASP  84   5.526 -12.072  -2.806
  679    HA   ASP  84           HA       ASP  84   3.990 -13.143  -4.887
  680   1HB   ASP  84          2HB       ASP  84   2.835 -12.644  -2.149
  681   2HB   ASP  84          1HB       ASP  84   2.517 -13.975  -3.256
  682    H    LEU  85           H        LEU  85   3.613 -10.164  -3.038
  683    HA   LEU  85           HA       LEU  85   1.103  -9.366  -4.012
  684   1HB   LEU  85          2HB       LEU  85   3.524  -7.782  -3.179
  685   2HB   LEU  85          1HB       LEU  85   2.033  -7.015  -3.678
  686    HG   LEU  85           HG       LEU  85   2.766  -7.861  -1.109
  687   1HD1  LEU  85          1HD1      LEU  85   1.470  -5.895  -1.627
  688   2HD1  LEU  85          2HD1      LEU  85   0.559  -6.927  -0.522
  689   3HD1  LEU  85          3HD1      LEU  85   0.149  -6.889  -2.239
  690   1HD2  LEU  85          1HD2      LEU  85   0.431  -9.459  -2.146
  691   2HD2  LEU  85          2HD2      LEU  85   0.943  -9.340  -0.461
  692   3HD2  LEU  85          3HD2      LEU  85   1.993 -10.112  -1.649
  693    H    PHE  86           H        PHE  86   4.113  -7.839  -5.033
  694    HA   PHE  86           HA       PHE  86   2.880  -7.152  -7.563
  695   1HB   PHE  86          2HB       PHE  86   5.510  -6.399  -6.288
  696   2HB   PHE  86          1HB       PHE  86   5.057  -5.890  -7.909
  697    HD1  PHE  86           1HD      PHE  86   4.419  -3.702  -8.003
  698    HD2  PHE  86           2HD      PHE  86   3.326  -6.014  -4.602
  699    HE1  PHE  86           1HE      PHE  86   3.242  -1.754  -7.061
  700    HE2  PHE  86           2HE      PHE  86   2.146  -4.075  -3.657
  701    HZ   PHE  86           HZ       PHE  86   2.105  -1.944  -4.888
  702    H    GLY  87           H        GLY  87   6.072  -8.488  -6.692
  703   1HA   GLY  87          1HA       GLY  87   6.894 -10.517  -7.778
  704   2HA   GLY  87          2HA       GLY  87   5.994 -10.033  -9.208
  705    H    VAL  88           H        VAL  88   6.841  -7.197  -8.811
  706    HA   VAL  88           HA       VAL  88   8.906  -7.007 -10.576
  707    HB   VAL  88           HB       VAL  88   8.944  -4.974  -8.435
  708   1HG1  VAL  88          1HG1      VAL  88   8.623  -4.863 -11.416
  709   2HG1  VAL  88          2HG1      VAL  88  10.146  -4.738 -10.532
  710   3HG1  VAL  88          3HG1      VAL  88   8.912  -3.485 -10.355
  711   1HG2  VAL  88          1HG2      VAL  88   6.599  -5.517  -8.351
  712   2HG2  VAL  88          2HG2      VAL  88   6.483  -5.452 -10.110
  713   3HG2  VAL  88          3HG2      VAL  88   6.809  -3.982  -9.191
  714    HA   PRO  89           HA       PRO  89  12.797  -7.730  -8.342
  715   1HB   PRO  89          2HB       PRO  89  14.198  -5.786  -9.721
  716   2HB   PRO  89          1HB       PRO  89  14.035  -7.468 -10.235
  717   1HG   PRO  89          1HG       PRO  89  12.499  -5.057 -11.112
  718   2HG   PRO  89          2HG       PRO  89  13.097  -6.421 -12.077
  719   1HD   PRO  89          1HD       PRO  89  10.521  -6.242 -11.360
  720   2HD   PRO  89          2HD       PRO  89  11.356  -7.809 -11.418
  721    H    SER  90           H        SER  90  11.348  -4.577  -8.997
  722    HA   SER  90           HA       SER  90  12.036  -3.707  -6.299
  723   1HB   SER  90          2HB       SER  90  12.940  -1.549  -7.127
  724   2HB   SER  90          1HB       SER  90  13.931  -2.925  -7.604
  725    HG   SER  90           HG       SER  90  13.220  -1.188  -9.227
  726    H    PHE  91           H        PHE  91  10.561  -2.201  -5.452
  727    HA   PHE  91           HA       PHE  91   8.909  -0.777  -7.397
  728   1HB   PHE  91          1HB       PHE  91   6.868  -1.100  -6.282
  729   2HB   PHE  91          2HB       PHE  91   7.606  -2.693  -6.350
  730    HD1  PHE  91           1HD      PHE  91   6.754   0.125  -4.137
  731    HD2  PHE  91           2HD      PHE  91   8.209  -3.866  -4.370
  732    HE1  PHE  91           1HE      PHE  91   6.394  -0.133  -1.729
  733    HE2  PHE  91           2HE      PHE  91   7.861  -4.131  -1.950
  734    HZ   PHE  91           HZ       PHE  91   6.949  -2.264  -0.628
  735    H    SER  92           H        SER  92   8.177   1.271  -6.759
  736    HA   SER  92           HA       SER  92   9.927   2.450  -4.712
  737   1HB   SER  92          1HB       SER  92   8.697   3.726  -7.167
  738   2HB   SER  92          2HB       SER  92   9.756   4.539  -6.014
  739    HG   SER  92           HG       SER  92  10.371   2.472  -7.834
  740    H    VAL  93           H        VAL  93   9.015   3.234  -2.956
  741    HA   VAL  93           HA       VAL  93   6.187   3.420  -2.633
  742    HB   VAL  93           HB       VAL  93   7.201   4.844  -0.521
  743   1HG1  VAL  93          1HG2      VAL  93   6.974   2.754   0.744
  744   2HG1  VAL  93          2HG2      VAL  93   6.932   1.850  -0.771
  745   3HG1  VAL  93          3HG2      VAL  93   5.638   2.985  -0.384
  746   1HG2  VAL  93          1HG1      VAL  93   9.200   3.643   0.235
  747   2HG2  VAL  93          2HG1      VAL  93   9.485   4.567  -1.242
  748   3HG2  VAL  93          3HG1      VAL  93   9.273   2.816  -1.323
  749    H    LYS  94           H        LYS  94   8.789   5.819  -2.951
  750    HA   LYS  94           HA       LYS  94   7.393   8.122  -2.413
  751   1HB   LYS  94          1HB       LYS  94   9.593   7.650  -4.425
  752   2HB   LYS  94          2HB       LYS  94   8.995   9.250  -4.007
  753   1HG   LYS  94          1HG       LYS  94  10.207   7.297  -2.063
  754   2HG   LYS  94          2HG       LYS  94  11.051   8.658  -2.805
  755   1HD   LYS  94          1HD       LYS  94   9.480  10.211  -1.761
  756   2HD   LYS  94          2HD       LYS  94   8.613   8.856  -1.036
  757   1HE   LYS  94          1HE       LYS  94  10.117   9.902   0.574
  758   2HE   LYS  94          2HE       LYS  94  10.606   8.244   0.228
  759   1HZ   LYS  94          1HZ       LYS  94  11.825  10.685  -0.947
  760   2HZ   LYS  94          2HZ       LYS  94  12.293   9.093  -1.276
  761   3HZ   LYS  94          3HZ       LYS  94  12.504   9.732   0.276
  762    H    GLU  95           H        GLU  95   7.348   6.185  -5.331
  763    HA   GLU  95           HA       GLU  95   5.487   7.987  -6.648
  764   1HB   GLU  95          2HB       GLU  95   6.378   5.200  -7.420
  765   2HB   GLU  95          1HB       GLU  95   5.441   6.297  -8.425
  766   1HG   GLU  95          1HG       GLU  95   8.251   6.775  -7.455
  767   2HG   GLU  95          2HG       GLU  95   7.795   6.235  -9.070
  768    H    HIS  96           H        HIS  96   4.156   7.749  -4.556
  769    HA   HIS  96           HA       HIS  96   3.007   5.306  -3.827
  770   1HB   HIS  96          2HB       HIS  96   2.118   8.147  -3.322
  771   2HB   HIS  96          1HB       HIS  96   1.322   6.750  -2.607
  772    HD1  HIS  96           1HD      HIS  96   4.406   8.822  -2.377
  773    HD2  HIS  96           2HD      HIS  96   2.771   5.458  -0.572
  774    HE1  HIS  96           1HE      HIS  96   5.801   8.418  -0.324
  775    HE2  HIS  96           2HE      HIS  96   4.859   6.313   0.692
  776    H    ARG  97           H        ARG  97   1.682   7.932  -5.821
  777    HA   ARG  97           HA       ARG  97  -0.869   6.932  -6.174
  778   1HB   ARG  97          1HB       ARG  97  -0.869   8.214  -8.330
  779   2HB   ARG  97          2HB       ARG  97  -0.368   9.141  -6.922
  780   1HG   ARG  97          2HG       ARG  97   1.967   8.838  -7.553
  781   2HG   ARG  97          1HG       ARG  97   1.462   7.914  -8.968
  782   1HD   ARG  97          1HD       ARG  97   0.264   9.868  -9.819
  783   2HD   ARG  97          2HD       ARG  97   0.759  10.791  -8.401
  784    HE   ARG  97           HE       ARG  97   3.074   9.831  -9.584
  785   1HH1  ARG  97          2HH1      ARG  97   0.444  11.960 -10.414
  786   2HH1  ARG  97          1HH1      ARG  97   1.403  12.942 -11.470
  787   1HH2  ARG  97          1HH2      ARG  97   4.344  11.119 -10.972
  788   2HH2  ARG  97          2HH2      ARG  97   3.620  12.464 -11.787
  789    H    LYS  98           H        LYS  98   2.058   6.245  -8.047
  790    HA   LYS  98           HA       LYS  98   0.692   4.500  -9.868
  791   1HB   LYS  98          2HB       LYS  98   3.651   4.895  -9.400
  792   2HB   LYS  98          1HB       LYS  98   2.940   4.015 -10.744
  793   1HG   LYS  98          2HG       LYS  98   1.857   6.076 -11.512
  794   2HG   LYS  98          1HG       LYS  98   2.609   6.954 -10.177
  795   1HD   LYS  98          1HD       LYS  98   4.823   6.394 -11.045
  796   2HD   LYS  98          2HD       LYS  98   4.081   5.491 -12.369
  797   1HE   LYS  98          2HE       LYS  98   4.781   7.706 -13.107
  798   2HE   LYS  98          1HE       LYS  98   3.027   7.541 -13.179
  799   1HZ   LYS  98          1HZ       LYS  98   3.676   9.669 -12.247
  800   2HZ   LYS  98          2HZ       LYS  98   4.549   8.898 -11.019
  801   3HZ   LYS  98          3HZ       LYS  98   2.865   8.741 -11.087
  802    H    ILE  99           H        ILE  99   2.512   4.135  -6.915
  803    HA   ILE  99           HA       ILE  99   3.133   1.380  -7.311
  804    HB   ILE  99           HB       ILE  99   4.380   3.108  -5.849
  805   1HG1  ILE  99          2HG1      ILE  99   4.760   0.571  -6.059
  806   2HG1  ILE  99          1HG1      ILE  99   5.441   1.387  -4.657
  807   1HG2  ILE  99          1HG2      ILE  99   2.308   2.198  -3.875
  808   2HG2  ILE  99          2HG2      ILE  99   2.573   3.842  -4.457
  809   3HG2  ILE  99          3HG2      ILE  99   3.799   3.048  -3.463
  810   1HD1  ILE  99          1HD1      ILE  99   2.877  -0.183  -4.683
  811   2HD1  ILE  99          2HD1      ILE  99   3.609   0.598  -3.281
  812   3HD1  ILE  99          3HD1      ILE  99   4.430  -0.749  -4.071
  813    H    TYR 100           H        TYR 100   0.577   3.115  -5.638
  814    HA   TYR 100           HA       TYR 100  -0.526   0.672  -4.553
  815   1HB   TYR 100          2HB       TYR 100  -1.381   3.558  -4.428
  816   2HB   TYR 100          1HB       TYR 100  -2.378   2.252  -3.788
  817    HD1  TYR 100           1HD      TYR 100   0.804   1.092  -3.357
  818    HD2  TYR 100           2HD      TYR 100  -1.786   4.089  -1.808
  819    HE1  TYR 100           1HE      TYR 100   2.090   1.114  -1.280
  820    HE2  TYR 100           2HE      TYR 100  -0.494   4.126   0.285
  821    HH   TYR 100           HH       TYR 100   2.546   2.647   0.590
  822    H    THR 101           H        THR 101  -1.159   2.891  -7.214
  823    HA   THR 101           HA       THR 101  -3.677   1.840  -7.948
  824    HB   THR 101           HB       THR 101  -2.688   4.014  -8.786
  825    HG1  THR 101           1HG      THR 101  -4.523   2.739  -9.752
  826   1HG2  THR 101          1HG2      THR 101  -1.252   2.142 -10.671
  827   2HG2  THR 101          2HG2      THR 101  -0.494   3.165  -9.451
  828   3HG2  THR 101          3HG2      THR 101  -1.325   3.899 -10.823
  829    H    MET 102           H        MET 102  -0.431   0.704  -8.406
  830    HA   MET 102           HA       MET 102  -1.333  -1.299 -10.332
  831   1HB   MET 102          1HB       MET 102   1.005  -1.922 -10.564
  832   2HB   MET 102          2HB       MET 102   0.804  -0.191 -10.785
  833   1HG   MET 102          1HG       MET 102   1.658   0.233  -8.572
  834   2HG   MET 102          2HG       MET 102   1.755  -1.497  -8.248
  835   1HE   MET 102          1HE       MET 102   4.219  -0.691  -7.437
  836   2HE   MET 102          2HE       MET 102   4.219   0.906  -8.183
  837   3HE   MET 102          3HE       MET 102   5.508  -0.239  -8.551
  838    H    ILE 103           H        ILE 103  -0.661  -0.990  -6.932
  839    HA   ILE 103           HA       ILE 103  -0.690  -3.665  -6.156
  840    HB   ILE 103           HB       ILE 103  -2.213  -1.341  -4.970
  841   1HG1  ILE 103          1HG1      ILE 103   0.399  -2.694  -4.276
  842   2HG1  ILE 103          2HG1      ILE 103   0.163  -1.030  -4.804
  843   1HG2  ILE 103          1HG2      ILE 103  -3.313  -3.442  -4.387
  844   2HG2  ILE 103          2HG2      ILE 103  -2.525  -2.726  -2.981
  845   3HG2  ILE 103          3HG2      ILE 103  -1.780  -4.093  -3.810
  846   1HD1  ILE 103          1HD1      ILE 103  -1.023  -0.549  -2.719
  847   2HD1  ILE 103          2HD1      ILE 103   0.621  -1.121  -2.434
  848   3HD1  ILE 103          3HD1      ILE 103  -0.746  -2.208  -2.190
  849    H    TYR 104           H        TYR 104  -3.505  -1.595  -6.881
  850    HA   TYR 104           HA       TYR 104  -5.229  -3.941  -6.836
  851   1HB   TYR 104          2HB       TYR 104  -5.970  -1.034  -7.233
  852   2HB   TYR 104          1HB       TYR 104  -7.074  -2.363  -6.881
  853    HD1  TYR 104           1HD      TYR 104  -6.984  -3.472  -4.642
  854    HD2  TYR 104           2HD      TYR 104  -4.800   0.078  -5.497
  855    HE1  TYR 104           1HE      TYR 104  -6.714  -3.063  -2.232
  856    HE2  TYR 104           2HE      TYR 104  -4.524   0.495  -3.089
  857    HH   TYR 104           HH       TYR 104  -5.195  -1.844  -0.729
  858    H    ARG 105           H        ARG 105  -6.140  -4.868  -8.572
  859    HA   ARG 105           HA       ARG 105  -6.619  -3.517 -11.022
  860   1HB   ARG 105          2HB       ARG 105  -5.088  -4.786 -12.458
  861   2HB   ARG 105          1HB       ARG 105  -4.209  -3.794 -11.303
  862   1HG   ARG 105          1HG       ARG 105  -3.795  -5.741  -9.911
  863   2HG   ARG 105          2HG       ARG 105  -4.724  -6.748 -11.023
  864   1HD   ARG 105          1HD       ARG 105  -3.125  -6.232 -12.811
  865   2HD   ARG 105          2HD       ARG 105  -2.190  -5.250 -11.683
  866    HE   ARG 105           HE       ARG 105  -2.365  -7.717 -10.503
  867   1HH1  ARG 105          2HH1      ARG 105  -1.191  -6.489 -13.546
  868   2HH1  ARG 105          1HH1      ARG 105   0.022  -7.714 -13.718
  869   1HH2  ARG 105          1HH2      ARG 105  -0.772  -9.332 -10.723
  870   2HH2  ARG 105          2HH2      ARG 105   0.260  -9.330 -12.115
  871    H    ASN 106           H        ASN 106  -7.643  -5.493  -8.903
  872    HA   ASN 106           HA       ASN 106  -8.698  -7.492 -10.794
  873   1HB   ASN 106          2HB       ASN 106  -7.177  -8.531  -9.176
  874   2HB   ASN 106          1HB       ASN 106  -8.113  -7.853  -7.846
  875   1HD2  ASN 106          1HD2      ASN 106  -9.547  -9.119 -10.767
  876   2HD2  ASN 106          2HD2      ASN 106 -10.281 -10.502 -10.038
  877    H    LEU 107           H        LEU 107 -10.530  -6.259 -11.270
  878    HA   LEU 107           HA       LEU 107 -12.696  -5.604 -11.055
  879   1HB   LEU 107          2HB       LEU 107 -12.643  -7.499  -8.706
  880   2HB   LEU 107          1HB       LEU 107 -14.090  -6.857  -9.458
  881    HG   LEU 107           HG       LEU 107 -12.075  -8.602 -10.877
  882   1HD1  LEU 107          1HD2      LEU 107 -13.732 -10.387 -10.654
  883   2HD1  LEU 107          2HD2      LEU 107 -14.736  -9.330  -9.662
  884   3HD1  LEU 107          3HD2      LEU 107 -13.151  -9.841  -9.080
  885   1HD2  LEU 107          1HD1      LEU 107 -14.851  -7.715 -11.647
  886   2HD2  LEU 107          2HD1      LEU 107 -13.829  -8.822 -12.562
  887   3HD2  LEU 107          3HD1      LEU 107 -13.344  -7.139 -12.358
  888    H    VAL 108           H        VAL 108 -14.362  -5.100  -8.949
  889    HA   VAL 108           HA       VAL 108 -13.501  -2.587  -8.048
  890    HB   VAL 108           HB       VAL 108 -15.468  -2.594  -6.592
  891   1HG1  VAL 108          1HG1      VAL 108 -17.176  -2.923  -8.317
  892   2HG1  VAL 108          2HG1      VAL 108 -16.004  -3.794  -9.307
  893   3HG1  VAL 108          3HG1      VAL 108 -15.761  -2.082  -8.954
  894   1HG2  VAL 108          1HG2      VAL 108 -15.733  -5.491  -7.390
  895   2HG2  VAL 108          2HG2      VAL 108 -16.936  -4.563  -6.493
  896   3HG2  VAL 108          3HG2      VAL 108 -15.354  -4.880  -5.779
  897    H    VAL 109           H        VAL 109 -13.233  -1.883  -5.804
  898    HA   VAL 109           HA       VAL 109 -12.207  -3.930  -3.980
  899    HB   VAL 109           HB       VAL 109 -10.222  -2.551  -3.453
  900   1HG1  VAL 109          1HG1      VAL 109  -8.929  -3.131  -5.451
  901   2HG1  VAL 109          2HG1      VAL 109 -10.429  -3.389  -6.343
  902   3HG1  VAL 109          3HG1      VAL 109 -10.019  -4.436  -4.984
  903   1HG2  VAL 109          1HG2      VAL 109 -11.066  -0.947  -5.864
  904   2HG2  VAL 109          2HG2      VAL 109  -9.534  -0.780  -5.004
  905   3HG2  VAL 109          3HG2      VAL 109 -11.049  -0.388  -4.191
  906    H    VAL 110           H        VAL 110 -13.562  -0.793  -4.558
  907    HA   VAL 110           HA       VAL 110 -13.491  -0.008  -1.775
  908    HB   VAL 110           HB       VAL 110 -13.223   1.705  -3.494
  909   1HG1  VAL 110          1HG1      VAL 110 -14.589   0.705  -5.234
  910   2HG1  VAL 110          2HG1      VAL 110 -15.114   2.357  -4.908
  911   3HG1  VAL 110          3HG1      VAL 110 -16.043   0.994  -4.281
  912   1HG2  VAL 110          1HG2      VAL 110 -15.785   2.001  -1.929
  913   2HG2  VAL 110          2HG2      VAL 110 -14.861   3.320  -2.648
  914   3HG2  VAL 110          3HG2      VAL 110 -14.160   2.360  -1.346
  915    H    ASN 111           H        ASN 111 -15.777  -1.355  -4.053
  916    HA   ASN 111           HA       ASN 111 -17.570  -2.015  -1.878
  917   1HB   ASN 111          2HB       ASN 111 -18.369   0.212  -2.506
  918   2HB   ASN 111          1HB       ASN 111 -18.498  -0.292  -4.188
  919   1HD2  ASN 111          2HD2      ASN 111 -20.155  -1.671  -4.809
  920   2HD2  ASN 111          1HD2      ASN 111 -21.541  -1.947  -3.816
  921    H    GLN 112           H        GLN 112 -18.105  -4.066  -2.170
  922    HA   GLN 112           HA       GLN 112 -17.685  -5.391  -4.671
  923   1HB   GLN 112          2HB       GLN 112 -17.265  -6.513  -2.528
  924   2HB   GLN 112          1HB       GLN 112 -18.972  -6.393  -2.124
  925   1HG   GLN 112          1HG       GLN 112 -18.428  -8.620  -2.887
  926   2HG   GLN 112          2HG       GLN 112 -19.525  -7.830  -4.016
  927   1HE2  GLN 112          2HE2      GLN 112 -18.774  -7.219  -6.044
  928   2HE2  GLN 112          1HE2      GLN 112 -17.304  -7.841  -6.706
  929    H    GLN 113           H        GLN 113 -19.056  -5.370  -6.312
  930    HA   GLN 113           HA       GLN 113 -21.910  -5.684  -5.815
  931   1HB   GLN 113          1HB       GLN 113 -22.488  -3.843  -7.360
  932   2HB   GLN 113          2HB       GLN 113 -21.665  -3.275  -5.913
  933   1HG   GLN 113          2HG       GLN 113 -19.576  -3.103  -7.167
  934   2HG   GLN 113          1HG       GLN 113 -20.403  -3.673  -8.618
  935   1HE2  GLN 113          2HE2      GLN 113 -19.010  -1.156  -8.114
  936   2HE2  GLN 113          1HE2      GLN 113 -20.162   0.095  -8.419
  937    H    GLU 114           H        GLU 114 -22.979  -6.775  -7.414
  938    HA   GLU 114           HA       GLU 114 -21.307  -7.759  -9.624
  939   1HB   GLU 114          1HB       GLU 114 -22.843  -9.697  -9.690
  940   2HB   GLU 114          2HB       GLU 114 -22.033  -9.530  -8.138
  941   1HG   GLU 114          2HG       GLU 114 -24.042  -8.499  -7.201
  942   2HG   GLU 114          1HG       GLU 114 -24.856  -8.682  -8.755
  943    H    SER 115           H        SER 115 -21.970  -7.580 -11.705
  944    HA   SER 115           HA       SER 115 -24.386  -5.975 -12.162
  945   1HB   SER 115          1HB       SER 115 -23.369  -5.407 -14.341
  946   2HB   SER 115          2HB       SER 115 -22.309  -4.984 -12.997
  947    HG   SER 115           HG       SER 115 -21.988  -6.882 -14.981
  948    H    SER 116           H        SER 116 -22.751  -8.938 -13.108
  949    HA   SER 116           HA       SER 116 -25.229 -10.133 -13.897
  950   1HB   SER 116          2HB       SER 116 -24.549 -10.641 -16.231
  951   2HB   SER 116          1HB       SER 116 -24.773  -8.915 -15.957
  952    HG   SER 116           HG       SER 116 -22.787  -8.654 -16.549
  953    H    ASP 117           H        ASP 117 -21.754 -10.525 -14.623
  954    HA   ASP 117           HA       ASP 117 -21.558 -12.842 -12.940
  955   1HB   ASP 117          2HB       ASP 117 -20.955 -14.426 -14.732
  956   2HB   ASP 117          1HB       ASP 117 -22.617 -13.866 -14.891
  957    H    SER 118           H        SER 118 -20.290 -10.176 -13.608
  958    HA   SER 118           HA       SER 118 -17.611 -10.915 -14.437
  959   1HB   SER 118          2HB       SER 118 -17.120  -8.506 -14.202
  960   2HB   SER 118          1HB       SER 118 -18.539  -8.787 -15.211
  961    HG   SER 118           HG       SER 118 -19.527  -8.567 -12.854
  962    H    SER 119           H        SER 119 -19.378 -10.468 -11.520
  963    HA   SER 119           HA       SER 119 -16.959 -10.202  -9.909
  964   1HB   SER 119          1HB       SER 119 -19.876 -10.230  -9.094
  965   2HB   SER 119          2HB       SER 119 -18.517  -9.935  -8.009
  966    HG   SER 119           HG       SER 119 -19.121  -8.365 -10.294
  Start of MODEL   22
    1   1H    MET   1          1H        MET   1   3.190  43.082 -30.473
    2   2H    MET   1          2H        MET   1   4.071  41.693 -30.871
    3   3H    MET   1          3H        MET   1   2.392  41.604 -30.683
    4    HA   MET   1           HA       MET   1   2.051  43.007 -32.592
    5   1HB   MET   1          1HB       MET   1   5.069  42.916 -32.799
    6   2HB   MET   1          2HB       MET   1   3.991  43.590 -34.015
    7   1HG   MET   1          2HG       MET   1   3.226  45.263 -32.412
    8   2HG   MET   1          1HG       MET   1   4.307  44.589 -31.194
    9   1HE   MET   1          1HE       MET   1   5.327  47.029 -30.809
   10   2HE   MET   1          2HE       MET   1   4.254  47.678 -32.051
   11   3HE   MET   1          3HE       MET   1   5.984  48.024 -32.109
   12    H    CYS   2           H        CYS   2   2.496  40.146 -31.672
   13    HA   CYS   2           HA       CYS   2   2.570  38.990 -34.371
   14   1HB   CYS   2          2HB       CYS   2   3.950  37.831 -31.940
   15   2HB   CYS   2          1HB       CYS   2   3.815  37.040 -33.507
   16    HG   CYS   2           HG       CYS   2   6.226  37.842 -34.000
   17    H    ASN   3           H        ASN   3   0.852  39.500 -31.640
   18    HA   ASN   3           HA       ASN   3  -1.037  38.626 -30.727
   19   1HB   ASN   3          1HB       ASN   3  -1.618  38.770 -33.234
   20   2HB   ASN   3          2HB       ASN   3  -1.385  37.025 -33.255
   21   1HD2  ASN   3          2HD2      ASN   3  -3.789  38.553 -33.761
   22   2HD2  ASN   3          1HD2      ASN   3  -4.962  38.015 -32.613
   23    H    THR   4           H        THR   4   1.440  37.250 -30.236
   24    HA   THR   4           HA       THR   4   0.704  34.422 -30.195
   25    HB   THR   4           HB       THR   4   2.963  34.898 -30.930
   26    HG1  THR   4           1HG      THR   4   4.060  33.757 -29.027
   27   1HG2  THR   4          1HG2      THR   4   3.350  36.199 -28.231
   28   2HG2  THR   4          2HG2      THR   4   3.299  37.032 -29.784
   29   3HG2  THR   4          3HG2      THR   4   4.614  35.912 -29.426
   30    H    ASN   5           H        ASN   5   0.509  33.214 -28.320
   31    HA   ASN   5           HA       ASN   5   0.799  34.507 -25.737
   32   1HB   ASN   5          2HB       ASN   5  -1.489  35.113 -26.386
   33   2HB   ASN   5          1HB       ASN   5  -1.866  33.416 -26.671
   34   1HD2  ASN   5          2HD2      ASN   5  -2.104  32.024 -24.924
   35   2HD2  ASN   5          1HD2      ASN   5  -2.349  32.606 -23.316
   36    H    MET   6           H        MET   6  -0.114  31.642 -27.584
   37    HA   MET   6           HA       MET   6   0.644  29.934 -25.325
   38   1HB   MET   6          2HB       MET   6  -1.523  29.473 -26.387
   39   2HB   MET   6          1HB       MET   6  -0.718  29.232 -27.931
   40   1HG   MET   6          1HG       MET   6  -1.277  27.111 -26.912
   41   2HG   MET   6          2HG       MET   6   0.471  27.309 -27.024
   42   1HE   MET   6          1HE       MET   6  -1.926  27.818 -23.112
   43   2HE   MET   6          2HE       MET   6  -2.655  27.369 -24.655
   44   3HE   MET   6          3HE       MET   6  -1.980  28.983 -24.434
   45    H    SER   7           H        SER   7   2.835  29.821 -25.329
   46    HA   SER   7           HA       SER   7   4.086  28.720 -27.755
   47   1HB   SER   7          2HB       SER   7   5.291  30.754 -25.861
   48   2HB   SER   7          1HB       SER   7   6.133  29.997 -27.214
   49    HG   SER   7           HG       SER   7   4.477  32.118 -27.219
   50    H    VAL   8           H        VAL   8   3.595  28.545 -24.382
   51    HA   VAL   8           HA       VAL   8   5.667  26.465 -24.135
   52    HB   VAL   8           HB       VAL   8   4.342  28.035 -21.917
   53   1HG1  VAL   8          1HG1      VAL   8   6.056  27.021 -20.484
   54   2HG1  VAL   8          2HG1      VAL   8   6.632  26.071 -21.855
   55   3HG1  VAL   8          3HG1      VAL   8   5.010  25.802 -21.215
   56   1HG2  VAL   8          1HG2      VAL   8   6.517  29.138 -21.664
   57   2HG2  VAL   8          2HG2      VAL   8   5.805  29.452 -23.247
   58   3HG2  VAL   8          3HG2      VAL   8   7.113  28.279 -23.085
   59    HA   PRO   9           HA       PRO   9   1.786  24.035 -24.053
   60   1HB   PRO   9          2HB       PRO   9   2.922  21.735 -24.928
   61   2HB   PRO   9          1HB       PRO   9   2.418  23.028 -26.022
   62   1HG   PRO   9          2HG       PRO   9   5.148  22.395 -24.962
   63   2HG   PRO   9          1HG       PRO   9   4.663  22.839 -26.609
   64   1HD   PRO   9          2HD       PRO   9   5.759  24.615 -24.882
   65   2HD   PRO   9          1HD       PRO   9   4.568  25.088 -26.110
   66    H    THR  10           H        THR  10   4.976  23.283 -22.767
   67    HA   THR  10           HA       THR  10   3.676  21.839 -20.552
   68    HB   THR  10           HB       THR  10   6.379  21.198 -21.750
   69    HG1  THR  10           1HG      THR  10   4.962  19.113 -22.004
   70   1HG2  THR  10          1HG2      THR  10   6.348  19.272 -20.234
   71   2HG2  THR  10          2HG2      THR  10   4.821  19.832 -19.551
   72   3HG2  THR  10          3HG2      THR  10   6.286  20.790 -19.337
   73    H    ASP  11           H        ASP  11   3.826  23.044 -18.783
   74    HA   ASP  11           HA       ASP  11   6.008  24.938 -18.465
   75   1HB   ASP  11          2HB       ASP  11   3.590  24.407 -16.724
   76   2HB   ASP  11          1HB       ASP  11   4.744  25.717 -16.492
   77    H    GLY  12           H        GLY  12   6.653  25.119 -15.953
   78   1HA   GLY  12          2HA       GLY  12   8.300  22.891 -15.428
   79   2HA   GLY  12          1HA       GLY  12   7.984  24.213 -14.316
   80    H    ALA  13           H        ALA  13   7.612  20.944 -14.841
   81    HA   ALA  13           HA       ALA  13   5.168  20.652 -13.296
   82   1HB   ALA  13          1HB       ALA  13   7.001  18.543 -14.433
   83   2HB   ALA  13          2HB       ALA  13   5.560  19.188 -15.219
   84   3HB   ALA  13          3HB       ALA  13   5.411  18.268 -13.722
   85    H    VAL  14           H        VAL  14   5.056  20.173 -11.190
   86    HA   VAL  14           HA       VAL  14   7.584  19.728  -9.748
   87    HB   VAL  14           HB       VAL  14   5.022  20.503  -8.393
   88   1HG1  VAL  14          1HG1      VAL  14   6.559  21.553  -6.798
   89   2HG1  VAL  14          2HG1      VAL  14   7.927  21.037  -7.783
   90   3HG1  VAL  14          3HG1      VAL  14   6.899  19.835  -7.001
   91   1HG2  VAL  14          1HG2      VAL  14   5.623  22.870  -8.649
   92   2HG2  VAL  14          2HG2      VAL  14   5.263  22.109 -10.198
   93   3HG2  VAL  14          3HG2      VAL  14   6.938  22.410  -9.732
   94    H    THR  15           H        THR  15   7.130  18.490  -7.578
   95    HA   THR  15           HA       THR  15   6.516  15.847  -8.152
   96    HB   THR  15           HB       THR  15   6.344  17.198  -5.451
   97    HG1  THR  15           1HG      THR  15   8.404  17.472  -6.239
   98   1HG2  THR  15          1HG2      THR  15   5.281  14.992  -5.472
   99   2HG2  THR  15          2HG2      THR  15   6.782  14.964  -4.545
  100   3HG2  THR  15          3HG2      THR  15   6.738  14.292  -6.176
  101    H    THR  16           H        THR  16   4.596  15.327  -9.047
  102    HA   THR  16           HA       THR  16   2.140  16.368  -7.816
  103    HB   THR  16           HB       THR  16   2.500  15.036 -10.510
  104    HG1  THR  16           1HG      THR  16   2.221  17.171 -11.298
  105   1HG2  THR  16          1HG2      THR  16   0.220  15.834 -10.952
  106   2HG2  THR  16          2HG2      THR  16   0.113  16.440  -9.299
  107   3HG2  THR  16          3HG2      THR  16   0.258  14.708  -9.595
  108    H    SER  17           H        SER  17   0.914  15.079  -6.620
  109    HA   SER  17           HA       SER  17   1.414  12.198  -6.636
  110   1HB   SER  17          1HB       SER  17   0.057  12.173  -4.570
  111   2HB   SER  17          2HB       SER  17   1.399  13.311  -4.454
  112    HG   SER  17           HG       SER  17   0.029  14.974  -4.566
  113    H    GLN  18           H        GLN  18  -0.894  11.072  -5.920
  114    HA   GLN  18           HA       GLN  18  -2.967  11.959  -7.789
  115   1HB   GLN  18          2HB       GLN  18  -1.594  10.248  -8.955
  116   2HB   GLN  18          1HB       GLN  18  -1.918   9.127  -7.642
  117   1HG   GLN  18          1HG       GLN  18  -4.285   9.164  -8.152
  118   2HG   GLN  18          2HG       GLN  18  -4.004  10.335  -9.441
  119   1HE2  GLN  18          2HE2      GLN  18  -4.848   8.980 -11.012
  120   2HE2  GLN  18          1HE2      GLN  18  -4.008   7.579 -11.575
  121    H    ILE  19           H        ILE  19  -1.963   9.950  -5.084
  122    HA   ILE  19           HA       ILE  19  -4.379   8.502  -5.100
  123    HB   ILE  19           HB       ILE  19  -3.478   7.438  -3.010
  124   1HG1  ILE  19          1HG1      ILE  19  -1.065   9.157  -3.629
  125   2HG1  ILE  19          2HG1      ILE  19  -2.157   9.422  -2.273
  126   1HG2  ILE  19          1HG2      ILE  19  -1.461   6.465  -4.273
  127   2HG2  ILE  19          2HG2      ILE  19  -1.950   7.540  -5.588
  128   3HG2  ILE  19          3HG2      ILE  19  -3.064   6.300  -5.000
  129   1HD1  ILE  19          1HD1      ILE  19  -0.451   6.991  -2.728
  130   2HD1  ILE  19          2HD1      ILE  19  -1.565   7.229  -1.380
  131   3HD1  ILE  19          3HD1      ILE  19  -0.156   8.276  -1.556
  132    HA   PRO  20           HA       PRO  20  -6.372  11.396  -2.284
  133   1HB   PRO  20          1HB       PRO  20  -8.865  11.063  -3.301
  134   2HB   PRO  20          2HB       PRO  20  -7.645  12.088  -4.059
  135   1HG   PRO  20          1HG       PRO  20  -8.725   9.528  -4.957
  136   2HG   PRO  20          2HG       PRO  20  -7.781  10.719  -5.860
  137   1HD   PRO  20          1HD       PRO  20  -6.891   8.253  -4.609
  138   2HD   PRO  20          2HD       PRO  20  -5.998   9.342  -5.688
  139    H    ALA  21           H        ALA  21  -7.043  10.936  -0.284
  140    HA   ALA  21           HA       ALA  21  -7.632   8.294   0.546
  141   1HB   ALA  21          1HB       ALA  21  -6.588   9.942   2.024
  142   2HB   ALA  21          2HB       ALA  21  -8.055   9.274   2.737
  143   3HB   ALA  21          3HB       ALA  21  -8.077  10.887   2.023
  144    H    SER  22           H        SER  22  -9.558   7.378   1.263
  145    HA   SER  22           HA       SER  22 -11.780   6.907   1.263
  146   1HB   SER  22          1HB       SER  22 -11.899   8.890   2.728
  147   2HB   SER  22          2HB       SER  22 -12.094   9.918   1.308
  148    HG   SER  22           HG       SER  22 -13.870   7.951   2.301
  149    H    GLU  23           H        GLU  23 -10.242   7.724  -1.297
  150    HA   GLU  23           HA       GLU  23 -12.581   8.127  -3.024
  151   1HB   GLU  23          1HB       GLU  23 -10.686   9.647  -3.400
  152   2HB   GLU  23          2HB       GLU  23  -9.637   8.266  -3.696
  153   1HG   GLU  23          2HG       GLU  23 -10.308   9.304  -5.777
  154   2HG   GLU  23          1HG       GLU  23 -10.965   7.672  -5.655
  155    H    GLN  24           H        GLN  24  -9.540   6.386  -3.651
  156    HA   GLN  24           HA       GLN  24 -11.064   4.063  -4.538
  157   1HB   GLN  24          2HB       GLN  24  -8.078   4.553  -4.486
  158   2HB   GLN  24          1HB       GLN  24  -8.871   3.162  -5.212
  159   1HG   GLN  24          1HG       GLN  24  -9.993   4.627  -6.808
  160   2HG   GLN  24          2HG       GLN  24  -9.207   6.025  -6.075
  161   1HE2  GLN  24          2HE2      GLN  24  -9.067   5.013  -8.809
  162   2HE2  GLN  24          1HE2      GLN  24  -7.394   4.722  -9.125
  163    H    GLU  25           H        GLU  25 -11.859   3.892  -2.217
  164    HA   GLU  25           HA       GLU  25  -9.909   3.154  -0.231
  165   1HB   GLU  25          2HB       GLU  25 -11.876   4.524   0.348
  166   2HB   GLU  25          1HB       GLU  25 -12.927   3.174  -0.064
  167   1HG   GLU  25          1HG       GLU  25 -11.861   1.842   1.714
  168   2HG   GLU  25          2HG       GLU  25 -10.892   3.248   2.153
  169    H    THR  26           H        THR  26 -12.988   1.487  -0.721
  170    HA   THR  26           HA       THR  26 -13.491  -0.721  -1.083
  171    HB   THR  26           HB       THR  26 -10.515  -1.129  -1.449
  172    HG1  THR  26           1HG      THR  26 -11.492  -1.412  -3.735
  173   1HG2  THR  26          1HG2      THR  26 -12.843  -2.946  -2.083
  174   2HG2  THR  26          2HG2      THR  26 -11.655  -3.187  -0.801
  175   3HG2  THR  26          3HG2      THR  26 -11.156  -3.257  -2.491
  176    H    LEU  27           H        LEU  27 -14.114  -1.945   0.588
  177    HA   LEU  27           HA       LEU  27 -12.636  -1.911   3.041
  178   1HB   LEU  27          1HB       LEU  27 -15.268  -2.345   2.427
  179   2HB   LEU  27          2HB       LEU  27 -14.699  -3.976   2.744
  180    HG   LEU  27           HG       LEU  27 -15.488  -3.211   4.823
  181   1HD1  LEU  27          1HD1      LEU  27 -13.332  -4.262   5.052
  182   2HD1  LEU  27          2HD1      LEU  27 -13.430  -2.912   6.187
  183   3HD1  LEU  27          3HD1      LEU  27 -12.515  -2.738   4.685
  184   1HD2  LEU  27          1HD2      LEU  27 -14.915  -1.033   5.768
  185   2HD2  LEU  27          2HD2      LEU  27 -15.722  -0.853   4.210
  186   3HD2  LEU  27          3HD2      LEU  27 -13.973  -0.652   4.327
  187    H    VAL  28           H        VAL  28 -10.629  -2.764   2.392
  188    HA   VAL  28           HA       VAL  28 -10.485  -4.671   0.379
  189    HB   VAL  28           HB       VAL  28  -8.416  -3.685   2.319
  190   1HG1  VAL  28          1HG2      VAL  28  -7.765  -5.941   1.752
  191   2HG1  VAL  28          2HG2      VAL  28  -6.731  -4.797   0.895
  192   3HG1  VAL  28          3HG2      VAL  28  -8.037  -5.619   0.038
  193   1HG2  VAL  28          1HG1      VAL  28  -9.257  -2.138   0.613
  194   2HG2  VAL  28          2HG1      VAL  28  -8.805  -3.300  -0.636
  195   3HG2  VAL  28          3HG1      VAL  28  -7.559  -2.544   0.355
  196    H    ARG  29           H        ARG  29 -10.216  -6.798   0.299
  197    HA   ARG  29           HA       ARG  29  -9.295  -8.350   2.435
  198   1HB   ARG  29          2HB       ARG  29 -11.525  -9.664   2.675
  199   2HB   ARG  29          1HB       ARG  29 -11.324  -8.157   3.562
  200   1HG   ARG  29          2HG       ARG  29 -12.601  -6.962   1.878
  201   2HG   ARG  29          1HG       ARG  29 -12.753  -8.441   0.926
  202   1HD   ARG  29          2HD       ARG  29 -13.983  -9.494   2.767
  203   2HD   ARG  29          1HD       ARG  29 -13.840  -8.009   3.707
  204    HE   ARG  29           HE       ARG  29 -15.037  -7.351   1.282
  205   1HH1  ARG  29          2HH1      ARG  29 -15.738  -9.271   4.106
  206   2HH1  ARG  29          1HH1      ARG  29 -17.453  -9.067   3.976
  207   1HH2  ARG  29          1HH2      ARG  29 -17.292  -7.077   1.104
  208   2HH2  ARG  29          2HH2      ARG  29 -18.336  -7.821   2.270
  209    HA   PRO  30           HA       PRO  30  -9.450 -10.254  -1.765
  210   1HB   PRO  30          2HB       PRO  30  -6.912  -9.802  -2.544
  211   2HB   PRO  30          1HB       PRO  30  -8.156  -8.552  -2.622
  212   1HG   PRO  30          1HG       PRO  30  -5.857  -8.790  -0.807
  213   2HG   PRO  30          2HG       PRO  30  -6.821  -7.363  -1.215
  214   1HD   PRO  30          1HD       PRO  30  -7.022  -9.076   1.109
  215   2HD   PRO  30          2HD       PRO  30  -7.901  -7.573   0.766
  216    H    LYS  31           H        LYS  31  -7.481 -11.709  -2.830
  217    HA   LYS  31           HA       LYS  31  -7.255 -14.040  -1.280
  218   1HB   LYS  31          1HB       LYS  31  -5.593 -13.129  -3.637
  219   2HB   LYS  31          2HB       LYS  31  -5.600 -14.761  -2.982
  220   1HG   LYS  31          2HG       LYS  31  -7.990 -13.356  -4.157
  221   2HG   LYS  31          1HG       LYS  31  -6.986 -14.540  -4.995
  222   1HD   LYS  31          1HD       LYS  31  -7.581 -16.229  -3.330
  223   2HD   LYS  31          2HD       LYS  31  -8.575 -15.046  -2.479
  224   1HE   LYS  31          2HE       LYS  31  -9.950 -16.491  -3.875
  225   2HE   LYS  31          1HE       LYS  31 -10.005 -14.823  -4.447
  226   1HZ   LYS  31          1HZ       LYS  31  -8.394 -15.397  -6.155
  227   2HZ   LYS  31          2HZ       LYS  31  -9.770 -16.371  -6.279
  228   3HZ   LYS  31          3HZ       LYS  31  -8.349 -16.999  -5.609
  229    HA   PRO  32           HA       PRO  32  -4.042 -13.246   1.533
  230   1HB   PRO  32          1HB       PRO  32  -2.928 -15.936   1.103
  231   2HB   PRO  32          2HB       PRO  32  -3.688 -15.253   2.542
  232   1HG   PRO  32          1HG       PRO  32  -4.914 -17.119   1.049
  233   2HG   PRO  32          2HG       PRO  32  -5.817 -15.818   1.849
  234   1HD   PRO  32          1HD       PRO  32  -4.988 -16.063  -1.021
  235   2HD   PRO  32          2HD       PRO  32  -6.527 -15.496  -0.337
  236    H    LEU  33           H        LEU  33  -3.035 -11.799  -0.201
  237    HA   LEU  33           HA       LEU  33  -0.249 -12.421   0.008
  238   1HB   LEU  33          1HB       LEU  33   0.182 -11.718  -2.419
  239   2HB   LEU  33          2HB       LEU  33  -0.339 -13.358  -2.110
  240    HG   LEU  33           HG       LEU  33  -1.362 -12.190  -4.111
  241   1HD1  LEU  33          1HD2      LEU  33  -3.550 -13.179  -3.759
  242   2HD1  LEU  33          2HD2      LEU  33  -3.241 -13.279  -2.027
  243   3HD1  LEU  33          3HD2      LEU  33  -2.276 -14.236  -3.152
  244   1HD2  LEU  33          1HD1      LEU  33  -1.757 -10.017  -3.093
  245   2HD2  LEU  33          2HD1      LEU  33  -2.911 -10.741  -1.973
  246   3HD2  LEU  33          3HD1      LEU  33  -3.256 -10.717  -3.704
  247    H    LEU  34           H        LEU  34  -2.683 -10.387   0.388
  248    HA   LEU  34           HA       LEU  34  -0.804  -8.133   0.503
  249   1HB   LEU  34          1HB       LEU  34  -3.795  -8.130   0.125
  250   2HB   LEU  34          2HB       LEU  34  -2.897  -6.706   0.619
  251    HG   LEU  34           HG       LEU  34  -1.826  -7.985  -1.784
  252   1HD1  LEU  34          1HD1      LEU  34  -4.563  -6.733  -1.890
  253   2HD1  LEU  34          2HD1      LEU  34  -4.220  -8.453  -2.079
  254   3HD1  LEU  34          3HD1      LEU  34  -3.605  -7.296  -3.261
  255   1HD2  LEU  34          1HD2      LEU  34  -2.737  -5.180  -1.165
  256   2HD2  LEU  34          2HD2      LEU  34  -1.760  -5.684  -2.545
  257   3HD2  LEU  34          3HD2      LEU  34  -1.108  -5.812  -0.909
  258    H    LEU  35           H        LEU  35  -2.412 -10.504   2.098
  259    HA   LEU  35           HA       LEU  35  -2.229  -9.024   4.615
  260   1HB   LEU  35          2HB       LEU  35  -3.607 -11.676   4.398
  261   2HB   LEU  35          1HB       LEU  35  -3.856 -10.402   5.572
  262    HG   LEU  35           HG       LEU  35  -5.797 -10.409   4.254
  263   1HD1  LEU  35          1HD1      LEU  35  -4.539  -8.186   4.572
  264   2HD1  LEU  35          2HD1      LEU  35  -5.892  -8.246   3.440
  265   3HD1  LEU  35          3HD1      LEU  35  -4.234  -8.292   2.839
  266   1HD2  LEU  35          1HD2      LEU  35  -5.203 -11.785   2.444
  267   2HD2  LEU  35          2HD2      LEU  35  -3.935 -10.679   1.913
  268   3HD2  LEU  35          3HD2      LEU  35  -5.633 -10.229   1.736
  269    H    LYS  36           H        LYS  36  -1.512 -12.123   3.021
  270    HA   LYS  36           HA       LYS  36   0.631 -12.901   4.664
  271   1HB   LYS  36          1HB       LYS  36  -0.265 -14.154   2.667
  272   2HB   LYS  36          2HB       LYS  36   0.562 -12.991   1.643
  273   1HG   LYS  36          1HG       LYS  36   2.705 -13.660   2.611
  274   2HG   LYS  36          2HG       LYS  36   1.872 -14.834   3.631
  275   1HD   LYS  36          1HD       LYS  36   1.816 -14.837   0.616
  276   2HD   LYS  36          2HD       LYS  36   2.885 -15.836   1.601
  277   1HE   LYS  36          2HE       LYS  36   0.935 -16.891   2.641
  278   2HE   LYS  36          1HE       LYS  36  -0.129 -15.899   1.645
  279   1HZ   LYS  36          1HZ       LYS  36   0.141 -18.105   0.713
  280   2HZ   LYS  36          2HZ       LYS  36   1.818 -17.898   0.630
  281   3HZ   LYS  36          3HZ       LYS  36   0.800 -16.944  -0.326
  282    H    LEU  37           H        LEU  37   0.060 -10.098   2.883
  283    HA   LEU  37           HA       LEU  37   2.833  -9.293   2.667
  284   1HB   LEU  37          2HB       LEU  37   0.973  -8.658   1.043
  285   2HB   LEU  37          1HB       LEU  37   0.358  -7.602   2.298
  286    HG   LEU  37           HG       LEU  37   1.687  -6.405   0.605
  287   1HD1  LEU  37          1HD1      LEU  37   3.444  -6.114   2.904
  288   2HD1  LEU  37          2HD1      LEU  37   1.730  -6.130   3.327
  289   3HD1  LEU  37          3HD1      LEU  37   2.343  -4.951   2.160
  290   1HD2  LEU  37          1HD2      LEU  37   3.256  -8.215   0.075
  291   2HD2  LEU  37          2HD2      LEU  37   4.001  -8.021   1.661
  292   3HD2  LEU  37          3HD2      LEU  37   4.087  -6.714   0.482
  293    H    LEU  38           H        LEU  38  -0.042  -8.453   4.563
  294    HA   LEU  38           HA       LEU  38   1.472  -6.496   6.088
  295   1HB   LEU  38          1HB       LEU  38  -1.434  -7.259   6.271
  296   2HB   LEU  38          2HB       LEU  38  -0.687  -5.879   7.045
  297    HG   LEU  38           HG       LEU  38  -1.183  -6.309   4.107
  298   1HD1  LEU  38          1HD2      LEU  38  -2.500  -4.304   4.286
  299   2HD1  LEU  38          2HD2      LEU  38  -2.041  -4.112   5.978
  300   3HD1  LEU  38          3HD2      LEU  38  -3.050  -5.474   5.486
  301   1HD2  LEU  38          1HD1      LEU  38   1.050  -5.386   4.410
  302   2HD2  LEU  38          2HD1      LEU  38   0.381  -4.095   5.408
  303   3HD2  LEU  38          3HD1      LEU  38  -0.053  -4.207   3.702
  304    H    LYS  39           H        LYS  39  -0.618  -9.283   6.834
  305    HA   LYS  39           HA       LYS  39  -0.327  -9.310   9.564
  306   1HB   LYS  39          1HB       LYS  39  -0.521 -11.756   7.806
  307   2HB   LYS  39          2HB       LYS  39  -0.991 -11.639   9.497
  308   1HG   LYS  39          2HG       LYS  39  -2.734 -10.037   8.914
  309   2HG   LYS  39          1HG       LYS  39  -2.255 -10.128   7.219
  310   1HD   LYS  39          1HD       LYS  39  -3.286 -12.428   8.873
  311   2HD   LYS  39          2HD       LYS  39  -4.224 -11.507   7.694
  312   1HE   LYS  39          1HE       LYS  39  -2.761 -12.232   5.911
  313   2HE   LYS  39          2HE       LYS  39  -1.732 -13.083   7.063
  314   1HZ   LYS  39          1HZ       LYS  39  -3.232 -14.599   5.936
  315   2HZ   LYS  39          2HZ       LYS  39  -4.574 -13.725   6.480
  316   3HZ   LYS  39          3HZ       LYS  39  -3.589 -14.541   7.589
  317    H    SER  40           H        SER  40   2.086 -10.004   7.234
  318    HA   SER  40           HA       SER  40   3.914 -11.355   8.951
  319   1HB   SER  40          1HB       SER  40   4.243 -11.265   6.513
  320   2HB   SER  40          2HB       SER  40   4.469  -9.518   6.606
  321    HG   SER  40           HG       SER  40   6.174 -10.347   8.287
  322    H    VAL  41           H        VAL  41   4.197  -7.971   7.815
  323    HA   VAL  41           HA       VAL  41   5.363  -6.902  10.121
  324    HB   VAL  41           HB       VAL  41   5.095  -5.725   7.919
  325   1HG1  VAL  41          1HG1      VAL  41   2.834  -6.155   7.371
  326   2HG1  VAL  41          2HG1      VAL  41   2.982  -4.415   7.620
  327   3HG1  VAL  41          3HG1      VAL  41   2.261  -5.428   8.873
  328   1HG2  VAL  41          1HG2      VAL  41   5.649  -4.608  10.141
  329   2HG2  VAL  41          2HG2      VAL  41   3.981  -4.018  10.117
  330   3HG2  VAL  41          3HG2      VAL  41   5.095  -3.578   8.820
  331    H    GLY  42           H        GLY  42   3.992  -5.152  11.465
  332   1HA   GLY  42          2HA       GLY  42   2.406  -6.875  13.101
  333   2HA   GLY  42          1HA       GLY  42   2.786  -5.192  13.429
  334    H    ALA  43           H        ALA  43   0.806  -7.090  11.132
  335    HA   ALA  43           HA       ALA  43  -1.298  -5.055  11.388
  336   1HB   ALA  43          1HB       ALA  43  -0.548  -5.517   9.107
  337   2HB   ALA  43          2HB       ALA  43  -2.234  -5.983   9.335
  338   3HB   ALA  43          3HB       ALA  43  -0.973  -7.216   9.308
  339    H    GLN  44           H        GLN  44  -3.578  -6.091  11.071
  340    HA   GLN  44           HA       GLN  44  -3.989  -8.598  12.422
  341   1HB   GLN  44          1HB       GLN  44  -4.557  -5.975  13.799
  342   2HB   GLN  44          2HB       GLN  44  -5.390  -7.461  14.236
  343   1HG   GLN  44          1HG       GLN  44  -2.416  -7.011  14.357
  344   2HG   GLN  44          2HG       GLN  44  -3.524  -6.997  15.729
  345   1HE2  GLN  44          2HE2      GLN  44  -1.211  -8.697  15.204
  346   2HE2  GLN  44          1HE2      GLN  44  -1.795 -10.322  15.245
  347    H    LYS  45           H        LYS  45  -4.995  -8.797  10.298
  348    HA   LYS  45           HA       LYS  45  -6.561  -7.179   8.923
  349   1HB   LYS  45          1HB       LYS  45  -8.034  -9.483   8.605
  350   2HB   LYS  45          2HB       LYS  45  -6.592  -9.048   7.707
  351   1HG   LYS  45          1HG       LYS  45  -5.213 -10.384   9.081
  352   2HG   LYS  45          2HG       LYS  45  -6.488 -10.582  10.286
  353   1HD   LYS  45          2HD       LYS  45  -6.194 -12.601   8.914
  354   2HD   LYS  45          1HD       LYS  45  -7.801 -11.898   8.721
  355   1HE   LYS  45          1HE       LYS  45  -7.085 -10.838   6.634
  356   2HE   LYS  45          2HE       LYS  45  -5.480 -11.539   6.828
  357   1HZ   LYS  45          1HZ       LYS  45  -6.461 -13.741   6.684
  358   2HZ   LYS  45          2HZ       LYS  45  -6.831 -12.834   5.305
  359   3HZ   LYS  45          3HZ       LYS  45  -8.004 -13.069   6.502
  360    H    ASP  46           H        ASP  46  -8.610  -9.638  10.454
  361    HA   ASP  46           HA       ASP  46 -10.881  -9.523  10.334
  362   1HB   ASP  46          1HB       ASP  46 -10.427  -6.835  11.661
  363   2HB   ASP  46          2HB       ASP  46 -11.968  -7.684  11.575
  364    H    THR  47           H        THR  47  -9.735  -9.028   7.987
  365    HA   THR  47           HA       THR  47  -9.708  -7.942   5.994
  366    HB   THR  47           HB       THR  47 -11.523  -6.633   5.241
  367    HG1  THR  47           1HG      THR  47 -13.136  -5.982   6.997
  368   1HG2  THR  47          1HG2      THR  47 -12.148  -8.949   5.587
  369   2HG2  THR  47          2HG2      THR  47 -13.519  -7.891   5.926
  370   3HG2  THR  47          3HG2      THR  47 -12.603  -8.601   7.257
  371    H    TYR  48           H        TYR  48  -9.947  -5.448   5.163
  372    HA   TYR  48           HA       TYR  48  -8.401  -3.785   7.004
  373   1HB   TYR  48          2HB       TYR  48  -7.502  -4.743   4.297
  374   2HB   TYR  48          1HB       TYR  48  -6.844  -3.287   5.035
  375    HD1  TYR  48           1HD      TYR  48  -5.537  -3.426   7.093
  376    HD2  TYR  48           2HD      TYR  48  -6.872  -6.918   5.069
  377    HE1  TYR  48           1HE      TYR  48  -3.898  -4.774   8.353
  378    HE2  TYR  48           2HE      TYR  48  -5.233  -8.277   6.297
  379    HH   TYR  48           HH       TYR  48  -3.575  -7.117   9.029
  380    H    THR  49           H        THR  49  -8.009  -1.590   6.043
  381    HA   THR  49           HA       THR  49  -9.875  -0.950   3.875
  382    HB   THR  49           HB       THR  49 -10.479   1.175   4.830
  383    HG1  THR  49           1HG      THR  49  -8.540   0.471   6.750
  384   1HG2  THR  49          1HG2      THR  49 -11.858  -0.731   5.486
  385   2HG2  THR  49          2HG2      THR  49 -11.767   0.450   6.792
  386   3HG2  THR  49          3HG2      THR  49 -10.807  -1.029   6.870
  387    H    MET  50           H        MET  50  -9.256   0.931   2.632
  388    HA   MET  50           HA       MET  50  -6.747   0.337   1.653
  389   1HB   MET  50          1HB       MET  50  -8.915   1.674   0.730
  390   2HB   MET  50          2HB       MET  50  -7.785   3.002   0.950
  391   1HG   MET  50          2HG       MET  50  -6.939   0.539  -0.505
  392   2HG   MET  50          1HG       MET  50  -7.900   1.765  -1.321
  393   1HE   MET  50          1HE       MET  50  -5.295   1.128  -2.682
  394   2HE   MET  50          2HE       MET  50  -4.518   2.699  -2.876
  395   3HE   MET  50          3HE       MET  50  -6.255   2.537  -3.135
  396    H    LYS  51           H        LYS  51  -7.591   2.539   4.147
  397    HA   LYS  51           HA       LYS  51  -5.129   4.073   3.902
  398   1HB   LYS  51          2HB       LYS  51  -7.200   5.227   4.561
  399   2HB   LYS  51          1HB       LYS  51  -7.326   4.194   5.979
  400   1HG   LYS  51          2HG       LYS  51  -5.242   5.123   6.848
  401   2HG   LYS  51          1HG       LYS  51  -5.110   6.155   5.423
  402   1HD   LYS  51          2HD       LYS  51  -7.398   6.216   7.387
  403   2HD   LYS  51          1HD       LYS  51  -6.029   7.330   7.400
  404   1HE   LYS  51          1HE       LYS  51  -6.629   8.093   5.155
  405   2HE   LYS  51          2HE       LYS  51  -7.995   6.977   5.139
  406   1HZ   LYS  51          1HZ       LYS  51  -8.689   9.217   5.710
  407   2HZ   LYS  51          2HZ       LYS  51  -7.634   9.239   7.032
  408   3HZ   LYS  51          3HZ       LYS  51  -8.944   8.169   7.014
  409    H    GLU  52           H        GLU  52  -6.663   1.808   6.141
  410    HA   GLU  52           HA       GLU  52  -4.654   1.447   8.002
  411   1HB   GLU  52          2HB       GLU  52  -7.035   0.300   7.584
  412   2HB   GLU  52          1HB       GLU  52  -6.010  -0.977   6.940
  413   1HG   GLU  52          1HG       GLU  52  -4.822  -1.132   9.044
  414   2HG   GLU  52          2HG       GLU  52  -5.776   0.195   9.703
  415    H    VAL  53           H        VAL  53  -5.128  -0.403   5.001
  416    HA   VAL  53           HA       VAL  53  -2.573  -1.669   5.184
  417    HB   VAL  53           HB       VAL  53  -4.289  -2.908   4.111
  418   1HG1  VAL  53          1HG1      VAL  53  -5.778  -1.145   3.467
  419   2HG1  VAL  53          2HG1      VAL  53  -5.401  -2.112   2.042
  420   3HG1  VAL  53          3HG1      VAL  53  -4.626  -0.544   2.275
  421   1HG2  VAL  53          1HG2      VAL  53  -2.395  -1.899   1.994
  422   2HG2  VAL  53          2HG2      VAL  53  -3.346  -3.381   1.900
  423   3HG2  VAL  53          3HG2      VAL  53  -2.090  -3.216   3.127
  424    H    LEU  54           H        LEU  54  -3.703   1.322   3.887
  425    HA   LEU  54           HA       LEU  54  -1.788   1.954   1.991
  426   1HB   LEU  54          1HB       LEU  54  -3.741   3.358   3.075
  427   2HB   LEU  54          2HB       LEU  54  -2.459   3.954   4.108
  428    HG   LEU  54           HG       LEU  54  -2.916   5.445   2.201
  429   1HD1  LEU  54          1HD2      LEU  54  -0.698   5.427   3.199
  430   2HD1  LEU  54          2HD2      LEU  54  -0.604   5.722   1.463
  431   3HD1  LEU  54          3HD2      LEU  54  -0.205   4.129   2.111
  432   1HD2  LEU  54          1HD1      LEU  54  -3.606   3.773   0.574
  433   2HD2  LEU  54          2HD1      LEU  54  -1.966   3.127   0.524
  434   3HD2  LEU  54          3HD1      LEU  54  -2.289   4.760  -0.060
  435    H    PHE  55           H        PHE  55  -1.510   2.941   5.410
  436    HA   PHE  55           HA       PHE  55   1.287   3.390   5.138
  437   1HB   PHE  55          2HB       PHE  55   1.230   3.786   7.601
  438   2HB   PHE  55          1HB       PHE  55   0.059   4.742   6.700
  439    HD1  PHE  55           1HD      PHE  55   0.385   1.637   8.717
  440    HD2  PHE  55           2HD      PHE  55  -2.177   4.723   7.299
  441    HE1  PHE  55           1HE      PHE  55  -1.410   0.816  10.187
  442    HE2  PHE  55           2HE      PHE  55  -3.978   3.907   8.764
  443    HZ   PHE  55           HZ       PHE  55  -3.595   1.952  10.211
  444    H    TYR  56           H        TYR  56  -0.624   0.652   6.011
  445    HA   TYR  56           HA       TYR  56   1.446  -0.729   7.430
  446   1HB   TYR  56          1HB       TYR  56  -1.326  -1.258   6.668
  447   2HB   TYR  56          2HB       TYR  56  -0.299  -2.686   6.595
  448    HD1  TYR  56           1HD      TYR  56  -2.642  -1.620   8.563
  449    HD2  TYR  56           2HD      TYR  56   1.576  -2.133   8.828
  450    HE1  TYR  56           1HE      TYR  56  -2.834  -1.874  10.998
  451    HE2  TYR  56           2HE      TYR  56   1.399  -2.397  11.264
  452    HH   TYR  56           HH       TYR  56  -1.563  -2.879  12.853
  453    H    LEU  57           H        LEU  57   0.534  -0.407   4.102
  454    HA   LEU  57           HA       LEU  57   2.223  -2.525   3.162
  455   1HB   LEU  57          2HB       LEU  57   0.322  -0.928   1.995
  456   2HB   LEU  57          1HB       LEU  57   1.804  -0.225   1.377
  457    HG   LEU  57           HG       LEU  57   1.024  -1.829  -0.217
  458   1HD1  LEU  57          1HD1      LEU  57   3.427  -1.778   0.064
  459   2HD1  LEU  57          2HD1      LEU  57   2.894  -3.424  -0.288
  460   3HD1  LEU  57          3HD1      LEU  57   3.325  -2.971   1.361
  461   1HD2  LEU  57          1HD2      LEU  57   0.975  -3.820   2.044
  462   2HD2  LEU  57          2HD2      LEU  57   0.657  -4.178   0.347
  463   3HD2  LEU  57          3HD2      LEU  57  -0.431  -3.119   1.243
  464    H    GLY  58           H        GLY  58   2.535   1.014   3.413
  465   1HA   GLY  58          2HA       GLY  58   5.257   1.264   2.888
  466   2HA   GLY  58          1HA       GLY  58   4.362   2.264   4.024
  467    H    GLN  59           H        GLN  59   3.618   0.078   5.769
  468    HA   GLN  59           HA       GLN  59   5.812  -0.003   7.505
  469   1HB   GLN  59          2HB       GLN  59   3.352  -1.737   7.320
  470   2HB   GLN  59          1HB       GLN  59   4.558  -1.947   8.581
  471   1HG   GLN  59          2HG       GLN  59   2.975   0.562   8.082
  472   2HG   GLN  59          1HG       GLN  59   2.635  -0.636   9.324
  473   1HE2  GLN  59          1HE2      GLN  59   2.865   0.841  10.982
  474   2HE2  GLN  59          2HE2      GLN  59   4.403   1.460  11.466
  475    H    TYR  60           H        TYR  60   4.486  -2.667   5.513
  476    HA   TYR  60           HA       TYR  60   6.464  -4.460   6.422
  477   1HB   TYR  60          1HB       TYR  60   4.290  -5.248   5.656
  478   2HB   TYR  60          2HB       TYR  60   4.637  -4.681   4.026
  479    HD1  TYR  60           1HD      TYR  60   5.943  -6.987   6.638
  480    HD2  TYR  60           2HD      TYR  60   5.587  -6.132   2.489
  481    HE1  TYR  60           1HE      TYR  60   6.990  -9.147   6.110
  482    HE2  TYR  60           2HE      TYR  60   6.629  -8.290   1.946
  483    HH   TYR  60           HH       TYR  60   8.110  -9.933   2.998
  484    H    ILE  61           H        ILE  61   6.177  -2.598   3.413
  485    HA   ILE  61           HA       ILE  61   8.400  -3.515   2.035
  486    HB   ILE  61           HB       ILE  61   7.605  -0.610   2.274
  487   1HG1  ILE  61          2HG1      ILE  61   6.623  -2.571   0.205
  488   2HG1  ILE  61          1HG1      ILE  61   5.725  -2.214   1.679
  489   1HG2  ILE  61          1HG2      ILE  61   8.503  -0.494  -0.046
  490   2HG2  ILE  61          2HG2      ILE  61   9.091  -2.145   0.150
  491   3HG2  ILE  61          3HG2      ILE  61   9.720  -0.858   1.179
  492   1HD1  ILE  61          1HD1      ILE  61   4.840  -0.870  -0.067
  493   2HD1  ILE  61          2HD1      ILE  61   6.449  -0.312  -0.527
  494   3HD1  ILE  61          3HD1      ILE  61   5.752   0.183   1.017
  495    H    MET  62           H        MET  62   8.364  -0.612   4.090
  496    HA   MET  62           HA       MET  62  11.068  -0.227   4.393
  497   1HB   MET  62          2HB       MET  62   8.874   0.195   6.427
  498   2HB   MET  62          1HB       MET  62  10.512   0.811   6.607
  499   1HG   MET  62          1HG       MET  62   8.591   1.521   4.401
  500   2HG   MET  62          2HG       MET  62   9.000   2.527   5.790
  501   1HE   MET  62          1HE       MET  62   9.592   4.549   4.170
  502   2HE   MET  62          2HE       MET  62   9.174   3.550   2.778
  503   3HE   MET  62          3HE       MET  62  10.710   4.417   2.812
  504    H    THR  63           H        THR  63   9.103  -1.867   6.892
  505    HA   THR  63           HA       THR  63  11.295  -2.877   8.305
  506    HB   THR  63           HB       THR  63   8.939  -2.691   9.178
  507    HG1  THR  63           1HG      THR  63  10.649  -3.941  10.211
  508   1HG2  THR  63          1HG2      THR  63   8.607  -5.300   7.693
  509   2HG2  THR  63          2HG2      THR  63   7.797  -3.782   7.305
  510   3HG2  THR  63          3HG2      THR  63   7.450  -4.600   8.828
  511    H    LYS  64           H        LYS  64  11.409  -5.385   8.734
  512    HA   LYS  64           HA       LYS  64  12.113  -7.412   7.987
  513   1HB   LYS  64          2HB       LYS  64  10.218  -6.869   5.695
  514   2HB   LYS  64          1HB       LYS  64  10.885  -8.436   6.129
  515   1HG   LYS  64          2HG       LYS  64   9.092  -6.777   7.891
  516   2HG   LYS  64          1HG       LYS  64   8.564  -8.130   6.887
  517   1HD   LYS  64          1HD       LYS  64  10.028  -9.636   8.131
  518   2HD   LYS  64          2HD       LYS  64  10.581  -8.287   9.127
  519   1HE   LYS  64          2HE       LYS  64   8.297  -7.961   9.946
  520   2HE   LYS  64          1HE       LYS  64   7.748  -9.310   8.952
  521   1HZ   LYS  64          1HZ       LYS  64   9.720  -9.490  11.165
  522   2HZ   LYS  64          2HZ       LYS  64   9.189 -10.783  10.212
  523   3HZ   LYS  64          3HZ       LYS  64   8.104  -9.989  11.240
  524    H    ARG  65           H        ARG  65  13.247  -4.780   6.918
  525    HA   ARG  65           HA       ARG  65  14.811  -4.078   5.382
  526   1HB   ARG  65          1HB       ARG  65  16.837  -5.524   5.468
  527   2HB   ARG  65          2HB       ARG  65  16.158  -5.149   7.046
  528   1HG   ARG  65          1HG       ARG  65  15.147  -7.348   7.165
  529   2HG   ARG  65          2HG       ARG  65  15.746  -7.729   5.549
  530   1HD   ARG  65          1HD       ARG  65  17.440  -7.113   7.968
  531   2HD   ARG  65          2HD       ARG  65  17.162  -8.713   7.283
  532    HE   ARG  65           HE       ARG  65  18.190  -7.060   5.274
  533   1HH1  ARG  65          2HH1      ARG  65  19.189  -8.523   8.274
  534   2HH1  ARG  65          1HH1      ARG  65  20.856  -8.622   7.820
  535   1HH2  ARG  65          1HH2      ARG  65  20.384  -7.186   4.668
  536   2HH2  ARG  65          2HH2      ARG  65  21.536  -7.861   5.769
  537    H    LEU  66           H        LEU  66  13.101  -4.456   3.630
  538    HA   LEU  66           HA       LEU  66  14.299  -6.240   1.616
  539   1HB   LEU  66          1HB       LEU  66  11.534  -5.374   2.137
  540   2HB   LEU  66          2HB       LEU  66  12.007  -5.340   0.451
  541    HG   LEU  66           HG       LEU  66  10.961  -7.441   0.866
  542   1HD1  LEU  66          1HD1      LEU  66  12.760  -9.027   0.349
  543   2HD1  LEU  66          2HD1      LEU  66  13.951  -7.800   0.781
  544   3HD1  LEU  66          3HD1      LEU  66  12.886  -7.547  -0.600
  545   1HD2  LEU  66          1HD2      LEU  66  12.912  -7.832   3.128
  546   2HD2  LEU  66          2HD2      LEU  66  11.707  -8.997   2.575
  547   3HD2  LEU  66          3HD2      LEU  66  11.193  -7.472   3.298
  548    H    TYR  67           H        TYR  67  13.711  -2.977   2.528
  549    HA   TYR  67           HA       TYR  67  13.852  -1.764  -0.022
  550   1HB   TYR  67          1HB       TYR  67  14.184   0.329   1.183
  551   2HB   TYR  67          2HB       TYR  67  12.913  -0.622   1.942
  552    HD1  TYR  67           1HD      TYR  67  15.754   1.313   2.546
  553    HD2  TYR  67           2HD      TYR  67  13.777  -2.195   3.916
  554    HE1  TYR  67           1HE      TYR  67  16.905   1.516   4.707
  555    HE2  TYR  67           2HE      TYR  67  14.925  -2.003   6.083
  556    HH   TYR  67           HH       TYR  67  16.596   0.792   7.036
  557    H    ASP  68           H        ASP  68  15.650  -0.106  -0.516
  558    HA   ASP  68           HA       ASP  68  17.879  -1.493  -1.311
  559   1HB   ASP  68          1HB       ASP  68  16.996   0.998  -1.787
  560   2HB   ASP  68          2HB       ASP  68  18.298   1.377  -0.672
  561    H    GLU  69           H        GLU  69  17.238  -0.085   1.771
  562    HA   GLU  69           HA       GLU  69  18.470   0.344   3.619
  563   1HB   GLU  69          2HB       GLU  69  20.685  -1.330   2.449
  564   2HB   GLU  69          1HB       GLU  69  20.379  -0.979   4.146
  565   1HG   GLU  69          1HG       GLU  69  18.340  -2.304   4.063
  566   2HG   GLU  69          2HG       GLU  69  18.621  -2.634   2.355
  567    H    LYS  70           H        LYS  70  19.054   1.398   0.649
  568    HA   LYS  70           HA       LYS  70  21.446   2.956   1.343
  569   1HB   LYS  70          1HB       LYS  70  20.020   2.557  -1.290
  570   2HB   LYS  70          2HB       LYS  70  21.390   3.635  -1.069
  571   1HG   LYS  70          1HG       LYS  70  21.429   0.665  -0.581
  572   2HG   LYS  70          2HG       LYS  70  22.029   1.470  -2.032
  573   1HD   LYS  70          1HD       LYS  70  23.656   2.699  -0.677
  574   2HD   LYS  70          2HD       LYS  70  23.058   1.891   0.774
  575   1HE   LYS  70          2HE       LYS  70  23.721  -0.271  -0.160
  576   2HE   LYS  70          1HE       LYS  70  24.317   0.536  -1.610
  577   1HZ   LYS  70          1HZ       LYS  70  26.110   0.034  -0.073
  578   2HZ   LYS  70          2HZ       LYS  70  25.360   0.940   1.142
  579   3HZ   LYS  70          3HZ       LYS  70  25.934   1.707  -0.253
  580    H    GLN  71           H        GLN  71  18.370   3.603  -0.358
  581    HA   GLN  71           HA       GLN  71  18.196   6.129   1.137
  582   1HB   GLN  71          2HB       GLN  71  17.280   7.208  -0.893
  583   2HB   GLN  71          1HB       GLN  71  18.939   6.668  -1.105
  584   1HG   GLN  71          1HG       GLN  71  18.144   4.694  -2.304
  585   2HG   GLN  71          2HG       GLN  71  16.481   5.237  -2.092
  586   1HE2  GLN  71          2HE2      GLN  71  17.201   8.046  -2.483
  587   2HE2  GLN  71          1HE2      GLN  71  17.469   8.235  -4.179
  588    H    GLN  72           H        GLN  72  16.897   3.305   1.055
  589    HA   GLN  72           HA       GLN  72  14.867   2.393   1.541
  590   1HB   GLN  72          2HB       GLN  72  14.192   5.205   2.424
  591   2HB   GLN  72          1HB       GLN  72  13.375   3.730   2.922
  592   1HG   GLN  72          2HG       GLN  72  15.413   2.967   4.025
  593   2HG   GLN  72          1HG       GLN  72  16.238   4.442   3.520
  594   1HE2  GLN  72          2HE2      GLN  72  13.856   3.068   5.641
  595   2HE2  GLN  72          1HE2      GLN  72  13.710   4.430   6.692
  596    H    HIS  73           H        HIS  73  15.301   3.963  -1.082
  597    HA   HIS  73           HA       HIS  73  12.495   4.503  -1.761
  598   1HB   HIS  73          2HB       HIS  73  14.113   6.284  -2.274
  599   2HB   HIS  73          1HB       HIS  73  15.030   5.168  -3.280
  600    HD1  HIS  73           1HD      HIS  73  14.418   5.114  -5.686
  601    HD2  HIS  73           2HD      HIS  73  11.410   6.767  -3.346
  602    HE1  HIS  73           1HE      HIS  73  12.687   5.947  -7.308
  603    HE2  HIS  73           2HE      HIS  73  10.921   7.027  -5.872
  604    H    ILE  74           H        ILE  74  15.337   3.006  -3.353
  605    HA   ILE  74           HA       ILE  74  13.638   1.301  -4.943
  606    HB   ILE  74           HB       ILE  74  16.611   0.974  -4.571
  607   1HG1  ILE  74          2HG1      ILE  74  16.214   3.294  -5.210
  608   2HG1  ILE  74          1HG1      ILE  74  16.892   2.398  -6.567
  609   1HG2  ILE  74          1HG2      ILE  74  16.484  -0.001  -6.818
  610   2HG2  ILE  74          2HG2      ILE  74  14.739   0.253  -6.821
  611   3HG2  ILE  74          3HG2      ILE  74  15.466  -0.865  -5.668
  612   1HD1  ILE  74          1HD1      ILE  74  14.687   2.228  -7.572
  613   2HD1  ILE  74          2HD1      ILE  74  15.121   3.911  -7.275
  614   3HD1  ILE  74          3HD1      ILE  74  13.986   3.090  -6.202
  615    H    VAL  75           H        VAL  75  12.503  -0.117  -3.720
  616    HA   VAL  75           HA       VAL  75  13.928  -1.617  -1.645
  617    HB   VAL  75           HB       VAL  75  12.018  -0.735  -0.670
  618   1HG1  VAL  75          1HG2      VAL  75  10.964   0.160  -2.641
  619   2HG1  VAL  75          2HG2      VAL  75   9.782  -0.767  -1.718
  620   3HG1  VAL  75          3HG2      VAL  75  10.502  -1.457  -3.172
  621   1HG2  VAL  75          1HG1      VAL  75  11.249  -3.485  -1.634
  622   2HG2  VAL  75          2HG1      VAL  75  10.449  -2.617  -0.323
  623   3HG2  VAL  75          3HG1      VAL  75  12.144  -3.083  -0.165
  624    H    TYR  76           H        TYR  76  14.891  -3.336  -2.495
  625    HA   TYR  76           HA       TYR  76  13.918  -4.740  -4.766
  626   1HB   TYR  76          2HB       TYR  76  15.949  -5.787  -2.801
  627   2HB   TYR  76          1HB       TYR  76  15.829  -6.119  -4.527
  628    HD1  TYR  76           1HD      TYR  76  15.837  -3.779  -5.955
  629    HD2  TYR  76           2HD      TYR  76  17.720  -4.446  -2.199
  630    HE1  TYR  76           1HE      TYR  76  17.411  -1.943  -6.421
  631    HE2  TYR  76           2HE      TYR  76  19.294  -2.619  -2.656
  632    HH   TYR  76           HH       TYR  76  18.854  -0.396  -5.179
  633    H    CYS  77           H        CYS  77  13.075  -6.833  -4.909
  634    HA   CYS  77           HA       CYS  77  12.450  -8.374  -2.579
  635   1HB   CYS  77          2HB       CYS  77   9.975  -8.280  -2.880
  636   2HB   CYS  77          1HB       CYS  77  10.672  -6.762  -2.325
  637    HG   CYS  77           HG       CYS  77  10.749  -5.955  -5.217
  638    H    SER  78           H        SER  78  13.909  -9.298  -4.508
  639    HA   SER  78           HA       SER  78  12.448 -10.503  -6.657
  640   1HB   SER  78          2HB       SER  78  14.828  -9.963  -6.903
  641   2HB   SER  78          1HB       SER  78  15.228 -11.089  -5.606
  642    HG   SER  78           HG       SER  78  14.004 -11.766  -8.078
  643    H    ASN  79           H        ASN  79  12.629 -11.166  -3.408
  644    HA   ASN  79           HA       ASN  79  11.271 -13.670  -3.723
  645   1HB   ASN  79          1HB       ASN  79  13.608 -14.426  -3.919
  646   2HB   ASN  79          2HB       ASN  79  13.978 -13.673  -2.370
  647   1HD2  ASN  79          2HD2      ASN  79  14.604 -15.603  -1.441
  648   2HD2  ASN  79          1HD2      ASN  79  13.472 -16.837  -1.013
  649    H    ASP  80           H        ASP  80   9.843 -12.018  -2.681
  650    HA   ASP  80           HA       ASP  80  10.006 -12.269   0.222
  651   1HB   ASP  80          2HB       ASP  80  11.134 -10.123  -0.403
  652   2HB   ASP  80          1HB       ASP  80   9.615  -9.583  -1.112
  653    H    LEU  81           H        LEU  81   7.953 -11.387   1.258
  654    HA   LEU  81           HA       LEU  81   5.634 -12.372  -0.033
  655   1HB   LEU  81          1HB       LEU  81   5.833 -10.471   2.305
  656   2HB   LEU  81          2HB       LEU  81   4.407 -11.378   1.836
  657    HG   LEU  81           HG       LEU  81   7.001 -12.645   2.724
  658   1HD1  LEU  81          1HD2      LEU  81   5.903 -13.087   4.840
  659   2HD1  LEU  81          2HD2      LEU  81   4.467 -12.219   4.297
  660   3HD1  LEU  81          3HD2      LEU  81   5.983 -11.352   4.539
  661   1HD2  LEU  81          1HD1      LEU  81   4.246 -13.790   2.302
  662   2HD2  LEU  81          2HD1      LEU  81   5.638 -14.666   2.942
  663   3HD2  LEU  81          3HD1      LEU  81   5.659 -14.067   1.283
  664    H    LEU  82           H        LEU  82   6.962  -9.114   0.408
  665    HA   LEU  82           HA       LEU  82   5.130  -7.622  -1.051
  666   1HB   LEU  82          1HB       LEU  82   7.635  -7.172  -0.021
  667   2HB   LEU  82          2HB       LEU  82   7.943  -7.112  -1.744
  668    HG   LEU  82           HG       LEU  82   7.543  -4.884  -1.125
  669   1HD1  LEU  82          1HD2      LEU  82   4.915  -5.955  -2.146
  670   2HD1  LEU  82          2HD2      LEU  82   6.316  -5.537  -3.132
  671   3HD1  LEU  82          3HD2      LEU  82   5.461  -4.279  -2.238
  672   1HD2  LEU  82          1HD1      LEU  82   5.114  -5.825   0.388
  673   2HD2  LEU  82          2HD1      LEU  82   5.651  -4.155   0.225
  674   3HD2  LEU  82          3HD1      LEU  82   6.645  -5.319   1.100
  675    H    GLY  83           H        GLY  83   7.455 -10.013  -2.077
  676   1HA   GLY  83          2HA       GLY  83   7.376  -9.507  -4.861
  677   2HA   GLY  83          1HA       GLY  83   7.845 -11.020  -4.102
  678    H    ASP  84           H        ASP  84   5.450 -11.656  -2.781
  679    HA   ASP  84           HA       ASP  84   3.853 -12.872  -4.681
  680   1HB   ASP  84          2HB       ASP  84   3.053 -11.820  -1.955
  681   2HB   ASP  84          1HB       ASP  84   2.052 -12.884  -2.939
  682    H    LEU  85           H        LEU  85   3.793  -9.571  -3.521
  683    HA   LEU  85           HA       LEU  85   1.446  -8.816  -4.987
  684   1HB   LEU  85          1HB       LEU  85   3.714  -7.167  -3.874
  685   2HB   LEU  85          2HB       LEU  85   2.270  -6.495  -4.603
  686    HG   LEU  85           HG       LEU  85   2.379  -8.163  -2.098
  687   1HD1  LEU  85          1HD2      LEU  85   1.780  -5.239  -2.529
  688   2HD1  LEU  85          2HD2      LEU  85   3.232  -5.904  -1.782
  689   3HD1  LEU  85          3HD2      LEU  85   1.667  -6.096  -0.991
  690   1HD2  LEU  85          1HD1      LEU  85  -0.015  -7.621  -1.917
  691   2HD2  LEU  85          2HD1      LEU  85   0.349  -8.607  -3.332
  692   3HD2  LEU  85          3HD1      LEU  85   0.053  -6.879  -3.517
  693    H    PHE  86           H        PHE  86   4.646  -7.409  -5.459
  694    HA   PHE  86           HA       PHE  86   3.905  -6.795  -8.163
  695   1HB   PHE  86          2HB       PHE  86   6.468  -6.233  -6.655
  696   2HB   PHE  86          1HB       PHE  86   6.061  -5.576  -8.236
  697    HD1  PHE  86           1HD      PHE  86   4.579  -5.803  -4.820
  698    HD2  PHE  86           2HD      PHE  86   5.220  -3.445  -8.303
  699    HE1  PHE  86           1HE      PHE  86   3.469  -3.901  -3.730
  700    HE2  PHE  86           2HE      PHE  86   4.111  -1.530  -7.215
  701    HZ   PHE  86           HZ       PHE  86   3.235  -1.764  -4.928
  702    H    GLY  87           H        GLY  87   6.723  -8.454  -6.734
  703   1HA   GLY  87          2HA       GLY  87   7.643 -10.479  -7.624
  704   2HA   GLY  87          1HA       GLY  87   6.911 -10.089  -9.172
  705    H    VAL  88           H        VAL  88   7.834  -7.257  -8.913
  706    HA   VAL  88           HA       VAL  88  10.095  -7.313 -10.453
  707    HB   VAL  88           HB       VAL  88   9.819  -5.078  -8.507
  708   1HG1  VAL  88          1HG1      VAL  88  11.486  -5.067 -10.292
  709   2HG1  VAL  88          2HG1      VAL  88  10.314  -3.756 -10.469
  710   3HG1  VAL  88          3HG1      VAL  88  10.190  -5.195 -11.483
  711   1HG2  VAL  88          1HG2      VAL  88   7.837  -5.575 -10.724
  712   2HG2  VAL  88          2HG2      VAL  88   7.942  -4.126  -9.725
  713   3HG2  VAL  88          3HG2      VAL  88   7.497  -5.668  -8.996
  714    HA   PRO  89           HA       PRO  89  13.582  -8.045  -7.670
  715   1HB   PRO  89          1HB       PRO  89  15.393  -6.551  -9.097
  716   2HB   PRO  89          2HB       PRO  89  15.002  -8.237  -9.443
  717   1HG   PRO  89          1HG       PRO  89  13.968  -5.745 -10.738
  718   2HG   PRO  89          2HG       PRO  89  14.451  -7.280 -11.486
  719   1HD   PRO  89          1HD       PRO  89  11.870  -6.657 -11.097
  720   2HD   PRO  89          2HD       PRO  89  12.458  -8.324 -10.922
  721    H    SER  90           H        SER  90  12.155  -5.046  -8.578
  722    HA   SER  90           HA       SER  90  12.713  -3.859  -6.058
  723   1HB   SER  90          2HB       SER  90  14.044  -1.931  -6.893
  724   2HB   SER  90          1HB       SER  90  14.912  -3.461  -6.995
  725    HG   SER  90           HG       SER  90  15.146  -3.007  -9.024
  726    H    PHE  91           H        PHE  91  11.310  -2.187  -5.632
  727    HA   PHE  91           HA       PHE  91   9.997  -0.911  -7.919
  728   1HB   PHE  91          1HB       PHE  91   7.820  -0.993  -6.848
  729   2HB   PHE  91          2HB       PHE  91   8.448  -2.621  -7.079
  730    HD1  PHE  91           1HD      PHE  91   7.370  -0.133  -4.702
  731    HD2  PHE  91           2HD      PHE  91   9.260  -3.917  -5.122
  732    HE1  PHE  91           1HE      PHE  91   6.934  -0.590  -2.338
  733    HE2  PHE  91           2HE      PHE  91   8.837  -4.394  -2.744
  734    HZ   PHE  91           HZ       PHE  91   7.671  -2.731  -1.346
  735    H    SER  92           H        SER  92   8.787   1.088  -7.257
  736    HA   SER  92           HA       SER  92  10.566   2.653  -5.575
  737   1HB   SER  92          1HB       SER  92   9.884   3.437  -7.851
  738   2HB   SER  92          2HB       SER  92   8.229   3.586  -7.258
  739    HG   SER  92           HG       SER  92   9.269   5.575  -7.111
  740    H    VAL  93           H        VAL  93   8.905   4.661  -4.698
  741    HA   VAL  93           HA       VAL  93   6.964   3.463  -2.911
  742    HB   VAL  93           HB       VAL  93   8.410   4.477  -0.943
  743   1HG1  VAL  93          1HG2      VAL  93   9.327   2.242  -0.526
  744   2HG1  VAL  93          2HG2      VAL  93   8.963   1.787  -2.191
  745   3HG1  VAL  93          3HG2      VAL  93   7.652   2.166  -1.074
  746   1HG2  VAL  93          1HG1      VAL  93  10.500   3.682  -2.956
  747   2HG2  VAL  93          2HG1      VAL  93  10.794   4.102  -1.268
  748   3HG2  VAL  93          3HG1      VAL  93  10.177   5.320  -2.385
  749    H    LYS  94           H        LYS  94   8.770   6.222  -4.053
  750    HA   LYS  94           HA       LYS  94   7.148   8.123  -2.586
  751   1HB   LYS  94          1HB       LYS  94   9.273   8.533  -4.698
  752   2HB   LYS  94          2HB       LYS  94   8.478   9.826  -3.810
  753   1HG   LYS  94          2HG       LYS  94  10.153   7.648  -2.573
  754   2HG   LYS  94          1HG       LYS  94  10.700   9.291  -2.917
  755   1HD   LYS  94          2HD       LYS  94   8.990  10.176  -1.403
  756   2HD   LYS  94          1HD       LYS  94   8.449   8.531  -1.056
  757   1HE   LYS  94          1HE       LYS  94   9.905   9.359   0.713
  758   2HE   LYS  94          2HE       LYS  94  10.646   7.999  -0.132
  759   1HZ   LYS  94          1HZ       LYS  94  12.240   9.765   0.259
  760   2HZ   LYS  94          2HZ       LYS  94  11.274  10.866  -0.587
  761   3HZ   LYS  94          3HZ       LYS  94  11.983   9.563  -1.401
  762    H    GLU  95           H        GLU  95   7.217   6.632  -5.713
  763    HA   GLU  95           HA       GLU  95   5.314   8.483  -6.868
  764   1HB   GLU  95          2HB       GLU  95   5.314   6.913  -8.784
  765   2HB   GLU  95          1HB       GLU  95   6.929   7.450  -8.349
  766   1HG   GLU  95          1HG       GLU  95   7.355   5.350  -7.218
  767   2HG   GLU  95          2HG       GLU  95   5.712   4.813  -7.559
  768    H    HIS  96           H        HIS  96   4.224   7.691  -4.578
  769    HA   HIS  96           HA       HIS  96   2.911   5.256  -4.437
  770   1HB   HIS  96          1HB       HIS  96   1.321   6.493  -2.868
  771   2HB   HIS  96          2HB       HIS  96   3.032   6.522  -2.454
  772    HD1  HIS  96           1HD      HIS  96   2.837   8.710  -1.126
  773    HD2  HIS  96           2HD      HIS  96   1.647   9.043  -5.092
  774    HE1  HIS  96           1HE      HIS  96   2.618  11.178  -1.556
  775    HE2  HIS  96           2HE      HIS  96   1.995  11.358  -3.990
  776    H    ARG  97           H        ARG  97   2.149   7.984  -6.383
  777    HA   ARG  97           HA       ARG  97  -0.530   7.523  -6.963
  778   1HB   ARG  97          2HB       ARG  97   0.183   8.312  -9.334
  779   2HB   ARG  97          1HB       ARG  97   0.332   9.423  -7.978
  780   1HG   ARG  97          1HG       ARG  97   2.703   8.889  -7.797
  781   2HG   ARG  97          2HG       ARG  97   2.555   7.777  -9.157
  782   1HD   ARG  97          2HD       ARG  97   1.879   9.632 -10.602
  783   2HD   ARG  97          1HD       ARG  97   2.024  10.744  -9.241
  784    HE   ARG  97           HE       ARG  97   4.468   9.454  -9.511
  785   1HH1  ARG  97          2HH1      ARG  97   2.455  11.616 -11.361
  786   2HH1  ARG  97          1HH1      ARG  97   3.786  12.359 -12.181
  787   1HH2  ARG  97          1HH2      ARG  97   6.227  10.428 -10.587
  788   2HH2  ARG  97          2HH2      ARG  97   5.931  11.684 -11.742
  789    H    LYS  98           H        LYS  98   2.169   6.380  -8.990
  790    HA   LYS  98           HA       LYS  98   0.603   4.339 -10.196
  791   1HB   LYS  98          1HB       LYS  98   3.603   4.700 -10.145
  792   2HB   LYS  98          2HB       LYS  98   2.727   3.605 -11.206
  793   1HG   LYS  98          2HG       LYS  98   2.433   6.603 -11.184
  794   2HG   LYS  98          1HG       LYS  98   3.404   5.678 -12.332
  795   1HD   LYS  98          1HD       LYS  98   1.396   4.520 -13.105
  796   2HD   LYS  98          2HD       LYS  98   0.421   5.427 -11.948
  797   1HE   LYS  98          1HE       LYS  98   1.051   7.515 -13.060
  798   2HE   LYS  98          2HE       LYS  98   2.021   6.605 -14.219
  799   1HZ   LYS  98          1HZ       LYS  98   0.012   5.493 -14.971
  800   2HZ   LYS  98          2HZ       LYS  98  -0.140   7.171 -15.130
  801   3HZ   LYS  98          3HZ       LYS  98  -0.919   6.368 -13.861
  802    H    ILE  99           H        ILE  99   3.259   4.256  -7.848
  803    HA   ILE  99           HA       ILE  99   3.583   1.531  -7.738
  804    HB   ILE  99           HB       ILE  99   4.810   3.607  -6.514
  805   1HG1  ILE  99          2HG1      ILE  99   5.619   1.269  -7.109
  806   2HG1  ILE  99          1HG1      ILE  99   6.340   1.998  -5.675
  807   1HG2  ILE  99          1HG2      ILE  99   4.730   3.235  -4.085
  808   2HG2  ILE  99          2HG2      ILE  99   3.375   2.128  -4.319
  809   3HG2  ILE  99          3HG2      ILE  99   3.200   3.835  -4.733
  810   1HD1  ILE  99          1HD1      ILE  99   5.754  -0.387  -5.414
  811   2HD1  ILE  99          2HD1      ILE  99   4.057   0.045  -5.622
  812   3HD1  ILE  99          3HD1      ILE  99   4.963   0.667  -4.244
  813    H    TYR 100           H        TYR 100   1.115   3.458  -6.194
  814    HA   TYR 100           HA       TYR 100   0.201   1.224  -4.590
  815   1HB   TYR 100          2HB       TYR 100  -0.754   4.051  -4.947
  816   2HB   TYR 100          1HB       TYR 100  -1.727   2.857  -4.091
  817    HD1  TYR 100           1HD      TYR 100  -1.260   4.875  -2.359
  818    HD2  TYR 100           2HD      TYR 100   1.588   1.965  -3.594
  819    HE1  TYR 100           1HE      TYR 100   0.033   5.277  -0.306
  820    HE2  TYR 100           2HE      TYR 100   2.879   2.352  -1.551
  821    HH   TYR 100           HH       TYR 100   3.197   4.128   0.128
  822    H    THR 101           H        THR 101  -0.877   3.001  -7.481
  823    HA   THR 101           HA       THR 101  -3.244   1.485  -7.853
  824    HB   THR 101           HB       THR 101  -2.707   3.700  -8.976
  825    HG1  THR 101           1HG      THR 101  -3.861   3.039 -10.891
  826   1HG2  THR 101          1HG2      THR 101  -1.170   1.874 -10.823
  827   2HG2  THR 101          2HG2      THR 101  -0.496   3.166  -9.831
  828   3HG2  THR 101          3HG2      THR 101  -1.581   3.554 -11.165
  829    H    MET 102           H        MET 102  -0.014   0.606  -8.101
  830    HA   MET 102           HA       MET 102  -0.576  -1.635  -9.893
  831   1HB   MET 102          1HB       MET 102   1.977  -1.135  -8.363
  832   2HB   MET 102          2HB       MET 102   1.747  -2.169  -9.767
  833   1HG   MET 102          2HG       MET 102   1.230  -0.140 -11.100
  834   2HG   MET 102          1HG       MET 102   1.642   0.825  -9.686
  835   1HE   MET 102          1HE       MET 102   4.415  -1.176  -8.711
  836   2HE   MET 102          2HE       MET 102   3.795   0.441  -8.383
  837   3HE   MET 102          3HE       MET 102   5.367   0.238  -9.161
  838    H    ILE 103           H        ILE 103   0.194  -0.957  -6.501
  839    HA   ILE 103           HA       ILE 103   0.360  -3.480  -5.456
  840    HB   ILE 103           HB       ILE 103  -1.041  -1.086  -4.266
  841   1HG1  ILE 103          1HG1      ILE 103   1.711  -2.269  -3.834
  842   2HG1  ILE 103          2HG1      ILE 103   1.347  -0.769  -4.681
  843   1HG2  ILE 103          1HG2      ILE 103  -1.896  -3.102  -3.216
  844   2HG2  ILE 103          2HG2      ILE 103  -0.844  -2.230  -2.101
  845   3HG2  ILE 103          3HG2      ILE 103  -0.251  -3.670  -2.928
  846   1HD1  ILE 103          1HD1      ILE 103   0.516   0.207  -2.613
  847   2HD1  ILE 103          2HD1      ILE 103   2.183  -0.344  -2.444
  848   3HD1  ILE 103          3HD1      ILE 103   0.865  -1.296  -1.760
  849    H    TYR 104           H        TYR 104  -2.574  -1.702  -6.313
  850    HA   TYR 104           HA       TYR 104  -4.191  -4.036  -5.574
  851   1HB   TYR 104          1HB       TYR 104  -5.008  -1.181  -6.150
  852   2HB   TYR 104          2HB       TYR 104  -6.117  -2.478  -5.714
  853    HD1  TYR 104           1HD      TYR 104  -6.527  -2.990  -3.462
  854    HD2  TYR 104           2HD      TYR 104  -3.199  -0.542  -4.474
  855    HE1  TYR 104           1HE      TYR 104  -6.167  -2.503  -1.079
  856    HE2  TYR 104           2HE      TYR 104  -2.830  -0.048  -2.094
  857    HH   TYR 104           HH       TYR 104  -4.116  -0.030   0.002
  858    H    ARG 105           H        ARG 105  -4.040  -5.388  -7.301
  859    HA   ARG 105           HA       ARG 105  -5.395  -4.489  -9.733
  860   1HB   ARG 105          2HB       ARG 105  -2.999  -4.313 -10.219
  861   2HB   ARG 105          1HB       ARG 105  -2.764  -5.981  -9.715
  862   1HG   ARG 105          1HG       ARG 105  -4.234  -6.713 -11.554
  863   2HG   ARG 105          2HG       ARG 105  -4.365  -5.035 -12.082
  864   1HD   ARG 105          2HD       ARG 105  -2.690  -6.235 -13.385
  865   2HD   ARG 105          1HD       ARG 105  -1.951  -4.949 -12.433
  866    HE   ARG 105           HE       ARG 105  -1.813  -7.291 -10.933
  867   1HH1  ARG 105          2HH1      ARG 105  -0.545  -6.023 -13.921
  868   2HH1  ARG 105          1HH1      ARG 105   0.909  -6.960 -13.851
  869   1HH2  ARG 105          1HH2      ARG 105   0.099  -8.527 -10.833
  870   2HH2  ARG 105          2HH2      ARG 105   1.275  -8.386 -12.095
  871    H    ASN 106           H        ASN 106  -6.867  -5.920 -10.428
  872    HA   ASN 106           HA       ASN 106  -8.206  -7.760 -10.475
  873   1HB   ASN 106          2HB       ASN 106  -5.585  -9.205 -10.015
  874   2HB   ASN 106          1HB       ASN 106  -7.082  -9.957 -10.559
  875   1HD2  ASN 106          2HD2      ASN 106  -7.809  -7.684 -12.234
  876   2HD2  ASN 106          1HD2      ASN 106  -6.784  -7.767 -13.621
  877    H    LEU 107           H        LEU 107  -7.715 -10.257  -8.985
  878    HA   LEU 107           HA       LEU 107  -8.073 -11.217  -6.957
  879   1HB   LEU 107          1HB       LEU 107  -7.150  -8.574  -5.829
  880   2HB   LEU 107          2HB       LEU 107  -7.297 -10.076  -4.940
  881    HG   LEU 107           HG       LEU 107  -5.389  -9.617  -7.236
  882   1HD1  LEU 107          1HD1      LEU 107  -4.880  -9.698  -4.267
  883   2HD1  LEU 107          2HD1      LEU 107  -4.788  -8.271  -5.298
  884   3HD1  LEU 107          3HD1      LEU 107  -3.648  -9.596  -5.523
  885   1HD2  LEU 107          1HD2      LEU 107  -6.072 -11.944  -7.010
  886   2HD2  LEU 107          2HD2      LEU 107  -5.655 -11.910  -5.297
  887   3HD2  LEU 107          3HD2      LEU 107  -4.393 -11.729  -6.517
  888    H    VAL 108           H        VAL 108  -9.299 -10.754  -4.757
  889    HA   VAL 108           HA       VAL 108 -11.904  -9.770  -5.631
  890    HB   VAL 108           HB       VAL 108 -11.167 -11.417  -3.207
  891   1HG1  VAL 108          1HG2      VAL 108 -13.872 -10.694  -4.330
  892   2HG1  VAL 108          2HG2      VAL 108 -13.177 -10.101  -2.821
  893   3HG1  VAL 108          3HG2      VAL 108 -13.579 -11.809  -2.996
  894   1HG2  VAL 108          1HG1      VAL 108 -12.440 -12.221  -5.820
  895   2HG2  VAL 108          2HG1      VAL 108 -12.201 -13.275  -4.425
  896   3HG2  VAL 108          3HG1      VAL 108 -10.807 -12.625  -5.288
  897    H    VAL 109           H        VAL 109 -11.878  -7.578  -5.342
  898    HA   VAL 109           HA       VAL 109 -11.165  -6.447  -2.760
  899    HB   VAL 109           HB       VAL 109 -11.820  -4.287  -3.770
  900   1HG1  VAL 109          1HG1      VAL 109 -10.028  -4.186  -5.440
  901   2HG1  VAL 109          2HG1      VAL 109  -9.966  -5.948  -5.473
  902   3HG1  VAL 109          3HG1      VAL 109  -9.530  -5.077  -4.003
  903   1HG2  VAL 109          1HG2      VAL 109 -12.390  -4.183  -6.154
  904   2HG2  VAL 109          2HG2      VAL 109 -13.601  -5.070  -5.230
  905   3HG2  VAL 109          3HG2      VAL 109 -12.428  -5.945  -6.215
  906    H    VAL 110           H        VAL 110 -13.153  -4.399  -2.693
  907    HA   VAL 110           HA       VAL 110 -15.150  -5.682  -1.180
  908    HB   VAL 110           HB       VAL 110 -14.485  -3.336  -0.819
  909   1HG1  VAL 110          1HG1      VAL 110 -14.240  -2.656  -3.136
  910   2HG1  VAL 110          2HG1      VAL 110 -15.363  -1.588  -2.295
  911   3HG1  VAL 110          3HG1      VAL 110 -15.976  -2.829  -3.387
  912   1HG2  VAL 110          1HG2      VAL 110 -16.607  -4.125   0.071
  913   2HG2  VAL 110          2HG2      VAL 110 -17.413  -3.714  -1.444
  914   3HG2  VAL 110          3HG2      VAL 110 -16.735  -2.440  -0.431
  915    H    ASN 111           H        ASN 111 -14.918  -4.878  -4.543
  916    HA   ASN 111           HA       ASN 111 -16.242  -5.307  -6.336
  917   1HB   ASN 111          2HB       ASN 111 -16.373  -7.579  -5.419
  918   2HB   ASN 111          1HB       ASN 111 -17.732  -7.101  -4.406
  919   1HD2  ASN 111          1HD2      ASN 111 -19.087  -8.622  -5.324
  920   2HD2  ASN 111          2HD2      ASN 111 -19.725  -8.449  -6.922
  921    H    GLN 112           H        GLN 112 -18.834  -5.678  -3.958
  922    HA   GLN 112           HA       GLN 112 -20.736  -4.506  -3.560
  923   1HB   GLN 112          1HB       GLN 112 -19.186  -2.700  -2.948
  924   2HB   GLN 112          2HB       GLN 112 -19.143  -2.166  -4.622
  925   1HG   GLN 112          2HG       GLN 112 -20.605  -0.757  -3.307
  926   2HG   GLN 112          1HG       GLN 112 -21.523  -1.644  -4.525
  927   1HE2  GLN 112          2HE2      GLN 112 -23.445  -1.431  -3.400
  928   2HE2  GLN 112          1HE2      GLN 112 -23.774  -2.313  -1.952
  929    H    GLN 113           H        GLN 113 -19.754  -2.528  -6.326
  930    HA   GLN 113           HA       GLN 113 -22.241  -2.636  -7.587
  931   1HB   GLN 113          2HB       GLN 113 -21.082  -1.734  -9.564
  932   2HB   GLN 113          1HB       GLN 113 -20.610  -0.902  -8.089
  933   1HG   GLN 113          2HG       GLN 113 -18.551  -2.213  -8.008
  934   2HG   GLN 113          1HG       GLN 113 -19.024  -3.042  -9.491
  935   1HE2  GLN 113          1HE2      GLN 113 -20.179  -0.616 -10.646
  936   2HE2  GLN 113          2HE2      GLN 113 -18.840   0.355 -11.144
  937    H    GLU 114           H        GLU 114 -23.012  -3.773  -9.376
  938    HA   GLU 114           HA       GLU 114 -23.443  -5.654 -10.577
  939   1HB   GLU 114          2HB       GLU 114 -21.454  -4.887 -11.814
  940   2HB   GLU 114          1HB       GLU 114 -20.427  -5.811 -10.726
  941   1HG   GLU 114          1HG       GLU 114 -21.469  -7.880 -11.489
  942   2HG   GLU 114          2HG       GLU 114 -22.507  -6.957 -12.574
  943    H    SER 115           H        SER 115 -24.340  -6.724  -8.754
  944    HA   SER 115           HA       SER 115 -22.929  -9.157  -8.070
  945   1HB   SER 115          2HB       SER 115 -23.790  -7.212  -5.913
  946   2HB   SER 115          1HB       SER 115 -23.197  -8.849  -5.632
  947    HG   SER 115           HG       SER 115 -21.526  -7.335  -5.400
  948    H    SER 116           H        SER 116 -25.202  -8.746  -9.618
  949    HA   SER 116           HA       SER 116 -27.337  -9.463  -9.919
  950   1HB   SER 116          1HB       SER 116 -26.395 -11.601  -9.158
  951   2HB   SER 116          2HB       SER 116 -26.719 -11.154  -7.483
  952    HG   SER 116           HG       SER 116 -28.514 -11.856  -9.522
  953    H    ASP 117           H        ASP 117 -27.452  -7.072  -8.935
  954    HA   ASP 117           HA       ASP 117 -28.705  -5.560  -7.788
  955   1HB   ASP 117          2HB       ASP 117 -30.554  -6.812  -8.804
  956   2HB   ASP 117          1HB       ASP 117 -30.552  -7.932  -7.445
  957    H    SER 118           H        SER 118 -27.180  -5.288  -6.125
  958    HA   SER 118           HA       SER 118 -26.504  -5.133  -3.962
  959   1HB   SER 118          1HB       SER 118 -28.843  -4.444  -3.589
  960   2HB   SER 118          2HB       SER 118 -29.298  -6.132  -3.352
  961    HG   SER 118           HG       SER 118 -28.241  -4.396  -1.589
  962    H    SER 119           H        SER 119 -26.441  -6.490  -1.791
  963    HA   SER 119           HA       SER 119 -25.453  -9.110  -2.578
  964   1HB   SER 119          2HB       SER 119 -24.515  -9.177  -0.276
  965   2HB   SER 119          1HB       SER 119 -24.005  -7.746  -1.174
  966    HG   SER 119           HG       SER 119 -25.555  -6.548  -0.045
  Start of MODEL   23
    1   1H    MET   1          1H        MET   1  -6.570  25.607  17.357
    2   2H    MET   1          2H        MET   1  -8.205  25.830  16.985
    3   3H    MET   1          3H        MET   1  -7.219  24.926  15.951
    4    HA   MET   1           HA       MET   1  -6.916  23.245  17.632
    5   1HB   MET   1          1HB       MET   1  -7.123  24.739  19.575
    6   2HB   MET   1          2HB       MET   1  -8.835  24.945  19.237
    7   1HG   MET   1          2HG       MET   1  -8.492  23.373  21.045
    8   2HG   MET   1          1HG       MET   1  -9.212  22.574  19.649
    9   1HE   MET   1          1HE       MET   1  -8.594  20.204  20.681
   10   2HE   MET   1          2HE       MET   1  -7.875  21.001  22.081
   11   3HE   MET   1          3HE       MET   1  -6.971  19.763  21.209
   12    H    CYS   2           H        CYS   2 -10.099  24.859  17.504
   13    HA   CYS   2           HA       CYS   2 -11.110  22.625  15.906
   14   1HB   CYS   2          2HB       CYS   2 -12.443  23.653  18.421
   15   2HB   CYS   2          1HB       CYS   2 -13.145  22.487  17.303
   16    HG   CYS   2           HG       CYS   2 -12.384  20.928  19.372
   17    H    ASN   3           H        ASN   3 -11.291  23.925  14.108
   18    HA   ASN   3           HA       ASN   3 -13.182  26.175  14.319
   19   1HB   ASN   3          1HB       ASN   3 -10.938  26.902  13.658
   20   2HB   ASN   3          2HB       ASN   3 -10.951  25.760  12.318
   21   1HD2  ASN   3          2HD2      ASN   3 -12.212  28.750  13.550
   22   2HD2  ASN   3          1HD2      ASN   3 -12.881  29.316  12.061
   23    H    THR   4           H        THR   4 -15.120  25.419  13.728
   24    HA   THR   4           HA       THR   4 -15.360  23.443  11.610
   25    HB   THR   4           HB       THR   4 -17.765  23.443  12.151
   26    HG1  THR   4           1HG      THR   4 -18.300  24.704  14.132
   27   1HG2  THR   4          1HG2      THR   4 -17.583  22.537  14.425
   28   2HG2  THR   4          2HG2      THR   4 -15.974  23.242  14.575
   29   3HG2  THR   4          3HG2      THR   4 -16.271  21.964  13.395
   30    H    ASN   5           H        ASN   5 -16.123  23.809   9.595
   31    HA   ASN   5           HA       ASN   5 -16.534  26.601   8.823
   32   1HB   ASN   5          1HB       ASN   5 -16.071  24.142   7.121
   33   2HB   ASN   5          2HB       ASN   5 -16.215  25.789   6.512
   34   1HD2  ASN   5          2HD2      ASN   5 -14.551  27.251   6.869
   35   2HD2  ASN   5          1HD2      ASN   5 -12.972  26.745   7.352
   36    H    MET   6           H        MET   6 -18.608  25.257  10.241
   37    HA   MET   6           HA       MET   6 -20.853  24.904  10.196
   38   1HB   MET   6          2HB       MET   6 -20.658  26.500   7.635
   39   2HB   MET   6          1HB       MET   6 -22.148  26.151   8.499
   40   1HG   MET   6          2HG       MET   6 -21.340  27.406  10.422
   41   2HG   MET   6          1HG       MET   6 -19.830  27.740   9.576
   42   1HE   MET   6          1HE       MET   6 -23.450  27.660   8.040
   43   2HE   MET   6          2HE       MET   6 -23.933  29.348   8.205
   44   3HE   MET   6          3HE       MET   6 -23.710  28.350   9.641
   45    H    SER   7           H        SER   7 -20.450  22.630   9.895
   46    HA   SER   7           HA       SER   7 -20.778  20.606   8.914
   47   1HB   SER   7          2HB       SER   7 -23.070  21.425   8.661
   48   2HB   SER   7          1HB       SER   7 -22.639  22.211   7.142
   49    HG   SER   7           HG       SER   7 -23.663  20.043   7.050
   50    H    VAL   8           H        VAL   8 -18.681  20.341   8.140
   51    HA   VAL   8           HA       VAL   8 -17.612  21.435   5.810
   52    HB   VAL   8           HB       VAL   8 -16.976  18.756   7.057
   53   1HG1  VAL   8          1HG2      VAL   8 -14.803  18.983   5.936
   54   2HG1  VAL   8          2HG2      VAL   8 -15.375  20.450   5.141
   55   3HG1  VAL   8          3HG2      VAL   8 -16.133  18.900   4.780
   56   1HG2  VAL   8          1HG1      VAL   8 -15.150  19.955   8.171
   57   2HG2  VAL   8          2HG1      VAL   8 -16.728  20.589   8.636
   58   3HG2  VAL   8          3HG1      VAL   8 -15.731  21.470   7.480
   59    HA   PRO   9           HA       PRO   9 -20.283  19.272   2.881
   60   1HB   PRO   9          2HB       PRO   9 -18.668  20.760   0.915
   61   2HB   PRO   9          1HB       PRO   9 -20.414  20.776   1.173
   62   1HG   PRO   9          2HG       PRO   9 -18.876  22.865   1.851
   63   2HG   PRO   9          1HG       PRO   9 -20.289  22.397   2.815
   64   1HD   PRO   9          1HD       PRO   9 -17.383  21.873   3.331
   65   2HD   PRO   9          2HD       PRO   9 -18.661  22.352   4.468
   66    H    THR  10           H        THR  10 -16.860  19.861   2.056
   67    HA   THR  10           HA       THR  10 -16.267  17.077   1.886
   68    HB   THR  10           HB       THR  10 -17.438  17.225  -0.235
   69    HG1  THR  10           1HG      THR  10 -15.352  16.939  -1.607
   70   1HG2  THR  10          1HG2      THR  10 -16.666  18.720  -2.020
   71   2HG2  THR  10          2HG2      THR  10 -15.499  19.441  -0.913
   72   3HG2  THR  10          3HG2      THR  10 -17.228  19.631  -0.620
   73    H    ASP  11           H        ASP  11 -15.422  20.410   1.408
   74    HA   ASP  11           HA       ASP  11 -12.571  19.775   1.262
   75   1HB   ASP  11          2HB       ASP  11 -13.425  21.437  -0.324
   76   2HB   ASP  11          1HB       ASP  11 -14.011  22.425   1.013
   77    H    GLY  12           H        GLY  12 -11.160  20.144   2.886
   78   1HA   GLY  12          2HA       GLY  12 -12.200  21.487   5.304
   79   2HA   GLY  12          1HA       GLY  12 -11.304  19.978   5.404
   80    H    ALA  13           H        ALA  13  -9.066  19.976   5.013
   81    HA   ALA  13           HA       ALA  13  -7.800  22.616   4.767
   82   1HB   ALA  13          1HB       ALA  13  -6.210  22.067   6.529
   83   2HB   ALA  13          2HB       ALA  13  -7.024  20.526   6.799
   84   3HB   ALA  13          3HB       ALA  13  -7.863  22.039   7.144
   85    H    VAL  14           H        VAL  14  -5.216  22.055   4.785
   86    HA   VAL  14           HA       VAL  14  -4.904  20.413   2.398
   87    HB   VAL  14           HB       VAL  14  -3.989  22.746   2.538
   88   1HG1  VAL  14          1HG2      VAL  14  -3.183  22.721   4.821
   89   2HG1  VAL  14          2HG2      VAL  14  -1.879  23.121   3.704
   90   3HG1  VAL  14          3HG2      VAL  14  -1.981  21.503   4.396
   91   1HG2  VAL  14          1HG1      VAL  14  -1.881  22.231   1.408
   92   2HG2  VAL  14          2HG1      VAL  14  -3.209  21.221   0.839
   93   3HG2  VAL  14          3HG1      VAL  14  -2.014  20.558   1.953
   94    H    THR  15           H        THR  15  -1.926  20.269   3.304
   95    HA   THR  15           HA       THR  15  -0.680  18.389   3.743
   96    HB   THR  15           HB       THR  15  -0.450  19.628   5.785
   97    HG1  THR  15           1HG      THR  15   0.412  17.959   6.776
   98   1HG2  THR  15          1HG2      THR  15  -2.808  19.940   6.336
   99   2HG2  THR  15          2HG2      THR  15  -1.929  19.272   7.710
  100   3HG2  THR  15          3HG2      THR  15  -2.952  18.227   6.726
  101    H    THR  16           H        THR  16  -2.401  17.223   2.321
  102    HA   THR  16           HA       THR  16  -3.754  15.126   3.854
  103    HB   THR  16           HB       THR  16  -4.791  14.485   1.703
  104    HG1  THR  16           1HG      THR  16  -4.274  15.508  -0.141
  105   1HG2  THR  16          1HG2      THR  16  -5.049  17.421   2.366
  106   2HG2  THR  16          2HG2      THR  16  -5.921  16.102   3.148
  107   3HG2  THR  16          3HG2      THR  16  -6.213  16.467   1.447
  108    H    SER  17           H        SER  17  -1.370  14.519   4.328
  109    HA   SER  17           HA       SER  17   0.437  13.170   4.045
  110   1HB   SER  17          2HB       SER  17  -0.090  10.910   3.108
  111   2HB   SER  17          1HB       SER  17  -1.211  11.443   4.359
  112    HG   SER  17           HG       SER  17  -2.710  11.930   2.774
  113    H    GLN  18           H        GLN  18  -0.906  12.050   0.988
  114    HA   GLN  18           HA       GLN  18   0.759  13.787  -0.599
  115   1HB   GLN  18          2HB       GLN  18   2.277  11.887   0.161
  116   2HB   GLN  18          1HB       GLN  18   1.219  10.812  -0.744
  117   1HG   GLN  18          2HG       GLN  18   1.723  11.940  -2.799
  118   2HG   GLN  18          1HG       GLN  18   2.703  13.133  -1.945
  119   1HE2  GLN  18          2HE2      GLN  18   3.835  11.137  -0.138
  120   2HE2  GLN  18          1HE2      GLN  18   4.993  10.255  -1.067
  121    H    ILE  19           H        ILE  19  -0.966  10.673  -0.620
  122    HA   ILE  19           HA       ILE  19  -1.342  11.198  -3.457
  123    HB   ILE  19           HB       ILE  19   0.383   9.527  -2.897
  124   1HG1  ILE  19          1HG1      ILE  19  -1.157   9.450  -4.994
  125   2HG1  ILE  19          2HG1      ILE  19  -0.137   8.065  -4.631
  126   1HG2  ILE  19          1HG2      ILE  19  -1.941   8.011  -1.747
  127   2HG2  ILE  19          2HG2      ILE  19  -0.532   8.633  -0.881
  128   3HG2  ILE  19          3HG2      ILE  19  -0.342   7.322  -2.051
  129   1HD1  ILE  19          1HD1      ILE  19  -3.067   8.301  -4.000
  130   2HD1  ILE  19          2HD1      ILE  19  -2.041   6.911  -3.646
  131   3HD1  ILE  19          3HD1      ILE  19  -2.356   7.373  -5.319
  132    HA   PRO  20           HA       PRO  20  -5.606  10.547  -2.642
  133   1HB   PRO  20          1HB       PRO  20  -6.461  11.206  -5.131
  134   2HB   PRO  20          2HB       PRO  20  -5.778  12.382  -4.007
  135   1HG   PRO  20          2HG       PRO  20  -4.644  11.325  -6.478
  136   2HG   PRO  20          1HG       PRO  20  -4.121  12.716  -5.516
  137   1HD   PRO  20          2HD       PRO  20  -3.050  10.001  -5.556
  138   2HD   PRO  20          1HD       PRO  20  -2.364  11.459  -4.814
  139    H    ALA  21           H        ALA  21  -4.670   8.032  -2.750
  140    HA   ALA  21           HA       ALA  21  -6.776   6.606  -4.051
  141   1HB   ALA  21          1HB       ALA  21  -3.983   6.143  -5.075
  142   2HB   ALA  21          2HB       ALA  21  -5.276   6.946  -5.965
  143   3HB   ALA  21          3HB       ALA  21  -5.427   5.242  -5.535
  144    H    SER  22           H        SER  22  -5.243   7.030  -1.478
  145    HA   SER  22           HA       SER  22  -5.357   4.255  -0.635
  146   1HB   SER  22          1HB       SER  22  -2.995   4.566  -1.287
  147   2HB   SER  22          2HB       SER  22  -2.876   5.929  -0.174
  148    HG   SER  22           HG       SER  22  -2.111   3.924   0.707
  149    H    GLU  23           H        GLU  23  -5.219   7.656   0.065
  150    HA   GLU  23           HA       GLU  23  -5.443   7.604   2.855
  151   1HB   GLU  23          1HB       GLU  23  -6.331   9.561   0.754
  152   2HB   GLU  23          2HB       GLU  23  -6.699   9.832   2.453
  153   1HG   GLU  23          2HG       GLU  23  -3.921   9.411   1.380
  154   2HG   GLU  23          1HG       GLU  23  -4.661  10.992   1.633
  155    H    GLN  24           H        GLN  24  -8.118   8.284   0.602
  156    HA   GLN  24           HA       GLN  24  -9.881   6.606   2.235
  157   1HB   GLN  24          2HB       GLN  24 -10.462   9.489   1.530
  158   2HB   GLN  24          1HB       GLN  24 -11.623   8.376   2.238
  159   1HG   GLN  24          1HG       GLN  24 -10.885   9.561   4.066
  160   2HG   GLN  24          2HG       GLN  24  -9.877   8.115   4.120
  161   1HE2  GLN  24          2HE2      GLN  24  -8.254   9.122   5.275
  162   2HE2  GLN  24          1HE2      GLN  24  -7.209  10.305   4.574
  163    H    GLU  25           H        GLU  25 -11.362   5.495   1.078
  164    HA   GLU  25           HA       GLU  25 -12.502   6.255  -1.361
  165   1HB   GLU  25          1HB       GLU  25 -11.271   4.705  -2.887
  166   2HB   GLU  25          2HB       GLU  25 -10.322   6.083  -2.347
  167   1HG   GLU  25          2HG       GLU  25  -9.037   4.768  -0.891
  168   2HG   GLU  25          1HG       GLU  25 -10.168   3.416  -0.974
  169    H    THR  26           H        THR  26 -11.290   3.519   0.532
  170    HA   THR  26           HA       THR  26 -13.631   1.920  -0.209
  171    HB   THR  26           HB       THR  26 -10.801   0.932  -0.590
  172    HG1  THR  26           1HG      THR  26 -12.566   2.249  -2.316
  173   1HG2  THR  26          1HG2      THR  26 -12.416  -0.831  -0.114
  174   2HG2  THR  26          2HG2      THR  26 -11.903  -0.911  -1.800
  175   3HG2  THR  26          3HG2      THR  26 -13.475  -0.227  -1.388
  176    H    LEU  27           H        LEU  27 -13.797  -0.086   1.155
  177    HA   LEU  27           HA       LEU  27 -11.447  -0.439   2.838
  178   1HB   LEU  27          1HB       LEU  27 -13.741   0.087   4.070
  179   2HB   LEU  27          2HB       LEU  27 -14.002  -1.625   3.791
  180    HG   LEU  27           HG       LEU  27 -11.747  -0.357   5.348
  181   1HD1  LEU  27          1HD2      LEU  27 -13.884  -2.296   6.175
  182   2HD1  LEU  27          2HD2      LEU  27 -13.897  -0.562   6.505
  183   3HD1  LEU  27          3HD2      LEU  27 -12.642  -1.585   7.204
  184   1HD2  LEU  27          1HD1      LEU  27 -12.161  -3.286   4.786
  185   2HD2  LEU  27          2HD1      LEU  27 -10.839  -2.539   5.689
  186   3HD2  LEU  27          3HD1      LEU  27 -10.987  -2.264   3.952
  187    H    VAL  28           H        VAL  28 -10.498  -2.363   2.576
  188    HA   VAL  28           HA       VAL  28 -11.551  -3.621   0.152
  189    HB   VAL  28           HB       VAL  28  -8.840  -2.780   1.002
  190   1HG1  VAL  28          1HG2      VAL  28  -9.297  -5.075  -0.904
  191   2HG1  VAL  28          2HG2      VAL  28  -8.505  -5.176   0.668
  192   3HG1  VAL  28          3HG2      VAL  28  -7.762  -4.250  -0.635
  193   1HG2  VAL  28          1HG1      VAL  28 -10.206  -1.477  -0.539
  194   2HG2  VAL  28          2HG1      VAL  28 -10.300  -2.870  -1.619
  195   3HG2  VAL  28          3HG1      VAL  28  -8.748  -2.084  -1.330
  196    H    ARG  29           H        ARG  29 -11.286  -5.793  -0.261
  197    HA   ARG  29           HA       ARG  29 -10.701  -7.415   2.074
  198   1HB   ARG  29          1HB       ARG  29 -13.187  -7.891   0.451
  199   2HB   ARG  29          2HB       ARG  29 -12.782  -8.544   2.032
  200   1HG   ARG  29          1HG       ARG  29 -13.033  -6.327   3.022
  201   2HG   ARG  29          2HG       ARG  29 -13.416  -5.651   1.436
  202   1HD   ARG  29          2HD       ARG  29 -15.380  -7.123   1.302
  203   2HD   ARG  29          1HD       ARG  29 -15.004  -7.759   2.904
  204    HE   ARG  29           HE       ARG  29 -15.187  -5.028   3.205
  205   1HH1  ARG  29          2HH1      ARG  29 -17.278  -7.601   2.132
  206   2HH1  ARG  29          1HH1      ARG  29 -18.729  -6.814   2.656
  207   1HH2  ARG  29          1HH2      ARG  29 -17.093  -3.985   3.898
  208   2HH2  ARG  29          2HH2      ARG  29 -18.624  -4.759   3.660
  209    HA   PRO  30           HA       PRO  30  -9.007  -9.165  -1.775
  210   1HB   PRO  30          1HB       PRO  30  -6.423  -9.147  -1.116
  211   2HB   PRO  30          2HB       PRO  30  -7.281  -7.644  -1.473
  212   1HG   PRO  30          1HG       PRO  30  -6.392  -8.744   1.136
  213   2HG   PRO  30          2HG       PRO  30  -6.591  -7.057   0.636
  214   1HD   PRO  30          1HD       PRO  30  -8.418  -8.655   2.135
  215   2HD   PRO  30          2HD       PRO  30  -8.663  -7.002   1.541
  216    H    LYS  31           H        LYS  31  -7.395 -11.010  -2.194
  217    HA   LYS  31           HA       LYS  31  -7.888 -13.211  -0.339
  218   1HB   LYS  31          2HB       LYS  31  -6.600 -13.195  -3.077
  219   2HB   LYS  31          1HB       LYS  31  -6.953 -14.631  -2.126
  220   1HG   LYS  31          1HG       LYS  31  -9.340 -14.129  -2.251
  221   2HG   LYS  31          2HG       LYS  31  -8.984 -12.689  -3.209
  222   1HD   LYS  31          2HD       LYS  31  -7.988 -14.095  -4.948
  223   2HD   LYS  31          1HD       LYS  31  -8.347 -15.534  -3.990
  224   1HE   LYS  31          2HE       LYS  31 -10.737 -15.022  -4.127
  225   2HE   LYS  31          1HE       LYS  31 -10.374 -13.594  -5.094
  226   1HZ   LYS  31          1HZ       LYS  31 -11.040 -15.450  -6.481
  227   2HZ   LYS  31          2HZ       LYS  31  -9.782 -16.400  -5.868
  228   3HZ   LYS  31          3HZ       LYS  31  -9.431 -15.029  -6.795
  229    HA   PRO  32           HA       PRO  32  -3.964 -13.474   1.645
  230   1HB   PRO  32          1HB       PRO  32  -3.020 -15.938   0.640
  231   2HB   PRO  32          2HB       PRO  32  -3.924 -15.682   2.134
  232   1HG   PRO  32          1HG       PRO  32  -4.888 -16.560  -0.539
  233   2HG   PRO  32          2HG       PRO  32  -5.475 -17.006   1.073
  234   1HD   PRO  32          2HD       PRO  32  -6.843 -15.312  -0.481
  235   2HD   PRO  32          1HD       PRO  32  -6.748 -15.070   1.277
  236    H    LEU  33           H        LEU  33  -2.815 -11.843   0.665
  237    HA   LEU  33           HA       LEU  33  -0.678 -12.490  -1.080
  238   1HB   LEU  33          2HB       LEU  33  -2.613 -12.575  -2.667
  239   2HB   LEU  33          1HB       LEU  33  -2.910 -10.882  -2.323
  240    HG   LEU  33           HG       LEU  33  -0.584 -10.402  -3.175
  241   1HD1  LEU  33          1HD1      LEU  33   0.334 -12.647  -2.924
  242   2HD1  LEU  33          2HD1      LEU  33   0.465 -12.086  -4.591
  243   3HD1  LEU  33          3HD1      LEU  33  -0.786 -13.247  -4.147
  244   1HD2  LEU  33          1HD2      LEU  33  -2.567  -9.981  -4.523
  245   2HD2  LEU  33          2HD2      LEU  33  -2.543 -11.649  -5.095
  246   3HD2  LEU  33          3HD2      LEU  33  -1.232 -10.552  -5.526
  247    H    LEU  34           H        LEU  34  -2.573 -10.323   0.753
  248    HA   LEU  34           HA       LEU  34  -0.353  -8.398   0.756
  249   1HB   LEU  34          1HB       LEU  34  -3.296  -7.881   0.533
  250   2HB   LEU  34          2HB       LEU  34  -2.281  -6.718   1.361
  251    HG   LEU  34           HG       LEU  34  -2.610  -6.007  -0.914
  252   1HD1  LEU  34          1HD2      LEU  34  -0.429  -5.562   0.074
  253   2HD1  LEU  34          2HD2      LEU  34  -0.295  -5.831  -1.663
  254   3HD1  LEU  34          3HD2      LEU  34   0.170  -7.105  -0.535
  255   1HD2  LEU  34          1HD1      LEU  34  -3.129  -8.209  -1.873
  256   2HD2  LEU  34          2HD1      LEU  34  -1.423  -8.640  -1.765
  257   3HD2  LEU  34          3HD1      LEU  34  -1.934  -7.325  -2.822
  258    H    LEU  35           H        LEU  35  -2.093 -10.630   2.378
  259    HA   LEU  35           HA       LEU  35  -2.215  -9.158   4.891
  260   1HB   LEU  35          2HB       LEU  35  -3.323 -11.911   4.450
  261   2HB   LEU  35          1HB       LEU  35  -3.796 -10.726   5.650
  262    HG   LEU  35           HG       LEU  35  -5.573 -10.703   4.155
  263   1HD1  LEU  35          1HD1      LEU  35  -5.612  -8.558   3.220
  264   2HD1  LEU  35          2HD1      LEU  35  -3.877  -8.573   2.898
  265   3HD1  LEU  35          3HD1      LEU  35  -4.465  -8.441   4.554
  266   1HD2  LEU  35          1HD2      LEU  35  -3.542 -10.850   1.941
  267   2HD2  LEU  35          2HD2      LEU  35  -5.278 -10.650   1.702
  268   3HD2  LEU  35          3HD2      LEU  35  -4.654 -12.117   2.458
  269    H    LYS  36           H        LYS  36  -1.003 -12.211   3.539
  270    HA   LYS  36           HA       LYS  36   0.719 -12.903   5.651
  271   1HB   LYS  36          1HB       LYS  36   0.866 -13.285   2.669
  272   2HB   LYS  36          2HB       LYS  36   2.139 -13.850   3.734
  273   1HG   LYS  36          1HG       LYS  36  -0.753 -14.670   3.907
  274   2HG   LYS  36          2HG       LYS  36   0.530 -15.612   3.144
  275   1HD   LYS  36          2HD       LYS  36   0.701 -14.737   6.012
  276   2HD   LYS  36          1HD       LYS  36  -0.126 -16.223   5.540
  277   1HE   LYS  36          1HE       LYS  36   2.113 -16.787   6.161
  278   2HE   LYS  36          2HE       LYS  36   1.968 -16.956   4.413
  279   1HZ   LYS  36          1HZ       LYS  36   3.084 -14.879   4.107
  280   2HZ   LYS  36          2HZ       LYS  36   4.028 -15.839   5.129
  281   3HZ   LYS  36          3HZ       LYS  36   3.106 -14.576   5.771
  282    H    LEU  37           H        LEU  37   0.557 -10.104   3.909
  283    HA   LEU  37           HA       LEU  37   3.434  -9.561   4.029
  284   1HB   LEU  37          2HB       LEU  37   2.096  -9.351   1.870
  285   2HB   LEU  37          1HB       LEU  37   1.310  -7.967   2.606
  286    HG   LEU  37           HG       LEU  37   4.282  -7.976   2.508
  287   1HD1  LEU  37          1HD2      LEU  37   3.658  -8.732   0.272
  288   2HD1  LEU  37          2HD2      LEU  37   4.263  -7.074   0.242
  289   3HD1  LEU  37          3HD2      LEU  37   2.529  -7.383   0.127
  290   1HD2  LEU  37          1HD1      LEU  37   3.670  -6.026   3.431
  291   2HD2  LEU  37          2HD1      LEU  37   2.047  -6.096   2.747
  292   3HD2  LEU  37          3HD1      LEU  37   3.400  -5.540   1.755
  293    H    LEU  38           H        LEU  38   0.420  -8.828   5.461
  294    HA   LEU  38           HA       LEU  38   1.516  -6.404   6.728
  295   1HB   LEU  38          1HB       LEU  38  -1.092  -7.027   5.550
  296   2HB   LEU  38          2HB       LEU  38  -1.193  -6.276   7.133
  297    HG   LEU  38           HG       LEU  38  -0.028  -4.330   6.372
  298   1HD1  LEU  38          1HD1      LEU  38   1.659  -5.321   4.991
  299   2HD1  LEU  38          2HD1      LEU  38   0.760  -4.150   4.025
  300   3HD1  LEU  38          3HD1      LEU  38   0.448  -5.877   3.835
  301   1HD2  LEU  38          1HD2      LEU  38  -2.427  -4.516   5.802
  302   2HD2  LEU  38          2HD2      LEU  38  -1.967  -5.140   4.216
  303   3HD2  LEU  38          3HD2      LEU  38  -1.520  -3.498   4.683
  304    H    LYS  39           H        LYS  39  -0.685  -9.144   7.308
  305    HA   LYS  39           HA       LYS  39  -0.818  -9.033  10.076
  306   1HB   LYS  39          2HB       LYS  39  -0.605 -11.544   8.409
  307   2HB   LYS  39          1HB       LYS  39  -1.308 -11.408  10.016
  308   1HG   LYS  39          2HG       LYS  39  -3.068  -9.968   9.131
  309   2HG   LYS  39          1HG       LYS  39  -2.358 -10.088   7.520
  310   1HD   LYS  39          2HD       LYS  39  -3.425 -12.399   9.137
  311   2HD   LYS  39          1HD       LYS  39  -4.270 -11.599   7.808
  312   1HE   LYS  39          2HE       LYS  39  -2.539 -12.269   6.258
  313   2HE   LYS  39          1HE       LYS  39  -1.608 -12.993   7.569
  314   1HZ   LYS  39          1HZ       LYS  39  -4.296 -13.877   6.660
  315   2HZ   LYS  39          2HZ       LYS  39  -3.407 -14.573   7.919
  316   3HZ   LYS  39          3HZ       LYS  39  -2.834 -14.663   6.331
  317    H    SER  40           H        SER  40   1.850  -9.728   8.032
  318    HA   SER  40           HA       SER  40   3.496 -11.033   9.965
  319   1HB   SER  40          1HB       SER  40   4.218  -9.485   7.467
  320   2HB   SER  40          2HB       SER  40   5.358 -10.429   8.423
  321    HG   SER  40           HG       SER  40   4.676 -11.778   6.840
  322    H    VAL  41           H        VAL  41   3.405  -7.674   8.753
  323    HA   VAL  41           HA       VAL  41   5.308  -6.551  10.424
  324    HB   VAL  41           HB       VAL  41   3.004  -4.790  10.176
  325   1HG1  VAL  41          1HG2      VAL  41   4.563  -3.261   9.447
  326   2HG1  VAL  41          2HG2      VAL  41   5.578  -4.492   8.691
  327   3HG1  VAL  41          3HG2      VAL  41   5.544  -4.333  10.448
  328   1HG2  VAL  41          1HG1      VAL  41   3.899  -6.305   7.757
  329   2HG2  VAL  41          2HG1      VAL  41   3.299  -4.650   7.621
  330   3HG2  VAL  41          3HG1      VAL  41   2.261  -5.916   8.293
  331    H    GLY  42           H        GLY  42   1.931  -7.287  11.055
  332   1HA   GLY  42          2HA       GLY  42   1.673  -7.799  13.581
  333   2HA   GLY  42          1HA       GLY  42   2.147  -6.114  13.738
  334    H    ALA  43           H        ALA  43   0.361  -6.824  10.940
  335    HA   ALA  43           HA       ALA  43  -1.812  -5.178  11.592
  336   1HB   ALA  43          1HB       ALA  43  -2.860  -6.045   9.577
  337   2HB   ALA  43          2HB       ALA  43  -1.703  -7.374   9.529
  338   3HB   ALA  43          3HB       ALA  43  -1.152  -5.715   9.297
  339    H    GLN  44           H        GLN  44  -4.065  -6.667  10.779
  340    HA   GLN  44           HA       GLN  44  -4.701  -8.799  12.481
  341   1HB   GLN  44          2HB       GLN  44  -4.205  -7.158  14.265
  342   2HB   GLN  44          1HB       GLN  44  -5.413  -6.073  13.592
  343   1HG   GLN  44          1HG       GLN  44  -6.293  -7.245  15.514
  344   2HG   GLN  44          2HG       GLN  44  -7.154  -7.722  14.050
  345   1HE2  GLN  44          2HE2      GLN  44  -4.925  -8.719  16.521
  346   2HE2  GLN  44          1HE2      GLN  44  -4.989 -10.411  16.182
  347    H    LYS  45           H        LYS  45  -5.779  -9.318  10.551
  348    HA   LYS  45           HA       LYS  45  -6.795  -7.715   8.714
  349   1HB   LYS  45          2HB       LYS  45  -8.326 -10.216   9.378
  350   2HB   LYS  45          1HB       LYS  45  -8.063  -9.488   7.802
  351   1HG   LYS  45          2HG       LYS  45  -5.698 -10.055   7.917
  352   2HG   LYS  45          1HG       LYS  45  -5.945 -10.776   9.509
  353   1HD   LYS  45          1HD       LYS  45  -5.911 -12.526   7.858
  354   2HD   LYS  45          2HD       LYS  45  -7.551 -12.366   8.487
  355   1HE   LYS  45          2HE       LYS  45  -8.171 -11.040   6.524
  356   2HE   LYS  45          1HE       LYS  45  -6.533 -11.212   5.894
  357   1HZ   LYS  45          1HZ       LYS  45  -8.439 -13.436   6.389
  358   2HZ   LYS  45          2HZ       LYS  45  -6.867 -13.606   5.791
  359   3HZ   LYS  45          3HZ       LYS  45  -8.036 -12.797   4.874
  360    H    ASP  46           H        ASP  46  -9.515  -9.407  10.184
  361    HA   ASP  46           HA       ASP  46 -11.676  -8.789   9.802
  362   1HB   ASP  46          1HB       ASP  46 -10.706  -6.177  10.995
  363   2HB   ASP  46          2HB       ASP  46 -12.395  -6.642  10.798
  364    H    THR  47           H        THR  47 -10.363  -8.815   7.534
  365    HA   THR  47           HA       THR  47  -9.826  -7.925   5.509
  366    HB   THR  47           HB       THR  47 -11.271  -6.397   4.452
  367    HG1  THR  47           1HG      THR  47 -11.203  -4.714   5.980
  368   1HG2  THR  47          1HG2      THR  47 -12.858  -7.882   6.541
  369   2HG2  THR  47          2HG2      THR  47 -12.468  -8.421   4.906
  370   3HG2  THR  47          3HG2      THR  47 -13.569  -7.064   5.149
  371    H    TYR  48           H        TYR  48  -9.638  -5.378   4.556
  372    HA   TYR  48           HA       TYR  48  -7.919  -3.912   6.386
  373   1HB   TYR  48          2HB       TYR  48  -6.953  -5.378   3.950
  374   2HB   TYR  48          1HB       TYR  48  -6.107  -3.962   4.565
  375    HD1  TYR  48           1HD      TYR  48  -5.292  -3.992   6.940
  376    HD2  TYR  48           2HD      TYR  48  -6.626  -7.477   4.907
  377    HE1  TYR  48           1HE      TYR  48  -4.060  -5.401   8.555
  378    HE2  TYR  48           2HE      TYR  48  -5.392  -8.899   6.483
  379    HH   TYR  48           HH       TYR  48  -4.135  -7.710   9.411
  380    H    THR  49           H        THR  49  -7.656  -1.791   5.839
  381    HA   THR  49           HA       THR  49  -9.419  -0.920   3.672
  382    HB   THR  49           HB       THR  49  -8.096   1.130   5.351
  383    HG1  THR  49           1HG      THR  49  -9.712  -0.912   6.376
  384   1HG2  THR  49          1HG2      THR  49 -10.964   0.714   4.506
  385   2HG2  THR  49          2HG2      THR  49  -9.773   1.672   3.620
  386   3HG2  THR  49          3HG2      THR  49 -10.287   2.169   5.236
  387    H    MET  50           H        MET  50  -8.480   1.434   2.898
  388    HA   MET  50           HA       MET  50  -6.073   0.775   1.437
  389   1HB   MET  50          1HB       MET  50  -7.997   3.084   1.384
  390   2HB   MET  50          2HB       MET  50  -6.523   3.070   0.420
  391   1HG   MET  50          2HG       MET  50  -8.796   1.104   0.263
  392   2HG   MET  50          1HG       MET  50  -8.399   2.352  -0.914
  393   1HE   MET  50          1HE       MET  50  -6.196   2.328  -2.408
  394   2HE   MET  50          2HE       MET  50  -4.964   1.068  -2.309
  395   3HE   MET  50          3HE       MET  50  -5.209   2.173  -0.955
  396    H    LYS  51           H        LYS  51  -7.001   2.630   4.204
  397    HA   LYS  51           HA       LYS  51  -4.497   4.105   4.281
  398   1HB   LYS  51          1HB       LYS  51  -5.370   5.012   6.413
  399   2HB   LYS  51          2HB       LYS  51  -6.484   5.248   5.074
  400   1HG   LYS  51          2HG       LYS  51  -7.805   3.335   5.838
  401   2HG   LYS  51          1HG       LYS  51  -6.690   3.112   7.187
  402   1HD   LYS  51          2HD       LYS  51  -8.126   5.712   6.738
  403   2HD   LYS  51          1HD       LYS  51  -8.864   4.387   7.639
  404   1HE   LYS  51          2HE       LYS  51  -7.832   5.877   9.202
  405   2HE   LYS  51          1HE       LYS  51  -6.888   4.389   9.147
  406   1HZ   LYS  51          1HZ       LYS  51  -6.198   6.864   7.659
  407   2HZ   LYS  51          2HZ       LYS  51  -5.261   5.461   7.781
  408   3HZ   LYS  51          3HZ       LYS  51  -5.523   6.422   9.146
  409    H    GLU  52           H        GLU  52  -6.081   1.411   5.890
  410    HA   GLU  52           HA       GLU  52  -4.134   0.753   7.773
  411   1HB   GLU  52          2HB       GLU  52  -6.493  -0.338   6.999
  412   2HB   GLU  52          1HB       GLU  52  -5.367  -1.493   6.302
  413   1HG   GLU  52          2HG       GLU  52  -6.009  -2.265   8.463
  414   2HG   GLU  52          1HG       GLU  52  -4.321  -1.759   8.524
  415    H    VAL  53           H        VAL  53  -4.483  -0.476   4.432
  416    HA   VAL  53           HA       VAL  53  -1.965  -1.734   4.370
  417    HB   VAL  53           HB       VAL  53  -2.331  -1.932   1.995
  418   1HG1  VAL  53          1HG1      VAL  53  -4.477  -3.104   2.008
  419   2HG1  VAL  53          2HG1      VAL  53  -4.871  -2.337   3.546
  420   3HG1  VAL  53          3HG1      VAL  53  -3.522  -3.468   3.445
  421   1HG2  VAL  53          1HG2      VAL  53  -3.142   0.298   1.516
  422   2HG2  VAL  53          2HG2      VAL  53  -4.635  -0.046   2.387
  423   3HG2  VAL  53          3HG2      VAL  53  -4.265  -0.911   0.896
  424    H    LEU  54           H        LEU  54  -3.006   1.543   3.852
  425    HA   LEU  54           HA       LEU  54  -0.992   2.558   2.253
  426   1HB   LEU  54          1HB       LEU  54  -2.836   3.940   2.928
  427   2HB   LEU  54          2HB       LEU  54  -2.384   3.808   4.616
  428    HG   LEU  54           HG       LEU  54  -0.350   5.113   4.185
  429   1HD1  LEU  54          1HD2      LEU  54  -1.406   5.334   1.369
  430   2HD1  LEU  54          2HD2      LEU  54   0.036   4.453   1.872
  431   3HD1  LEU  54          3HD2      LEU  54  -0.023   6.208   2.025
  432   1HD2  LEU  54          1HD1      LEU  54  -2.386   6.269   4.856
  433   2HD2  LEU  54          2HD1      LEU  54  -2.864   6.428   3.166
  434   3HD2  LEU  54          3HD1      LEU  54  -1.428   7.263   3.758
  435    H    PHE  55           H        PHE  55  -0.950   2.866   5.813
  436    HA   PHE  55           HA       PHE  55   1.835   3.454   5.797
  437   1HB   PHE  55          2HB       PHE  55   1.678   3.640   8.165
  438   2HB   PHE  55          1HB       PHE  55   0.173   4.275   7.511
  439    HD1  PHE  55           1HD      PHE  55   1.690   1.837   9.666
  440    HD2  PHE  55           2HD      PHE  55  -1.882   2.845   7.587
  441    HE1  PHE  55           1HE      PHE  55   0.419   0.311  11.118
  442    HE2  PHE  55           2HE      PHE  55  -3.160   1.322   9.036
  443    HZ   PHE  55           HZ       PHE  55  -2.011   0.052  10.805
  444    H    TYR  56           H        TYR  56  -0.054   0.557   6.419
  445    HA   TYR  56           HA       TYR  56   1.978  -0.968   7.620
  446   1HB   TYR  56          1HB       TYR  56  -0.689  -1.460   6.545
  447   2HB   TYR  56          2HB       TYR  56   0.398  -2.831   6.350
  448    HD1  TYR  56           1HD      TYR  56  -2.142  -2.251   8.216
  449    HD2  TYR  56           2HD      TYR  56   2.063  -2.458   8.810
  450    HE1  TYR  56           1HE      TYR  56  -2.515  -2.875  10.562
  451    HE2  TYR  56           2HE      TYR  56   1.713  -3.090  11.159
  452    HH   TYR  56           HH       TYR  56  -0.024  -2.879  12.882
  453    H    LEU  57           H        LEU  57   0.850  -0.978   4.238
  454    HA   LEU  57           HA       LEU  57   2.771  -2.667   3.173
  455   1HB   LEU  57          2HB       LEU  57   0.757  -1.362   2.080
  456   2HB   LEU  57          1HB       LEU  57   1.988  -0.173   1.708
  457    HG   LEU  57           HG       LEU  57   1.515  -1.727  -0.160
  458   1HD1  LEU  57          1HD2      LEU  57   4.296  -1.912   0.982
  459   2HD1  LEU  57          2HD2      LEU  57   3.667  -0.615  -0.035
  460   3HD1  LEU  57          3HD2      LEU  57   3.847  -2.243  -0.691
  461   1HD2  LEU  57          1HD1      LEU  57   1.012  -3.726   1.123
  462   2HD2  LEU  57          2HD1      LEU  57   2.685  -3.808   1.676
  463   3HD2  LEU  57          3HD1      LEU  57   2.308  -4.034  -0.032
  464    H    GLY  58           H        GLY  58   2.932   0.871   3.585
  465   1HA   GLY  58          2HA       GLY  58   5.560   1.341   2.901
  466   2HA   GLY  58          1HA       GLY  58   4.719   2.185   4.192
  467    H    GLN  59           H        GLN  59   4.323  -0.017   5.932
  468    HA   GLN  59           HA       GLN  59   6.759  -0.053   7.328
  469   1HB   GLN  59          1HB       GLN  59   4.455  -1.995   7.575
  470   2HB   GLN  59          2HB       GLN  59   5.735  -1.760   8.756
  471   1HG   GLN  59          2HG       GLN  59   3.538   0.137   8.002
  472   2HG   GLN  59          1HG       GLN  59   3.848  -0.617   9.565
  473   1HE2  GLN  59          1HE2      GLN  59   4.801   1.882   7.350
  474   2HE2  GLN  59          2HE2      GLN  59   5.783   2.772   8.459
  475    H    TYR  60           H        TYR  60   5.139  -2.766   5.644
  476    HA   TYR  60           HA       TYR  60   7.171  -4.605   6.092
  477   1HB   TYR  60          1HB       TYR  60   4.905  -5.208   5.354
  478   2HB   TYR  60          2HB       TYR  60   5.245  -4.529   3.766
  479    HD1  TYR  60           1HD      TYR  60   6.153  -7.237   6.112
  480    HD2  TYR  60           2HD      TYR  60   6.415  -5.765   2.129
  481    HE1  TYR  60           1HE      TYR  60   7.033  -9.409   5.375
  482    HE2  TYR  60           2HE      TYR  60   7.295  -7.934   1.381
  483    HH   TYR  60           HH       TYR  60   7.194 -10.726   3.312
  484    H    ILE  61           H        ILE  61   6.788  -2.305   3.431
  485    HA   ILE  61           HA       ILE  61   8.924  -3.110   1.816
  486    HB   ILE  61           HB       ILE  61   8.141  -0.242   2.362
  487   1HG1  ILE  61          1HG1      ILE  61   6.103  -1.118   1.708
  488   2HG1  ILE  61          2HG1      ILE  61   6.803  -0.702   0.148
  489   1HG2  ILE  61          1HG2      ILE  61  10.216  -0.464   1.134
  490   2HG2  ILE  61          2HG2      ILE  61   8.944   0.134   0.067
  491   3HG2  ILE  61          3HG2      ILE  61   9.444  -1.554  -0.018
  492   1HD1  ILE  61          1HD1      ILE  61   5.708  -2.932   0.251
  493   2HD1  ILE  61          2HD1      ILE  61   6.979  -3.430   1.371
  494   3HD1  ILE  61          3HD1      ILE  61   7.389  -2.956  -0.280
  495    H    MET  62           H        MET  62   8.834  -1.050   4.651
  496    HA   MET  62           HA       MET  62  11.751  -0.795   4.612
  497   1HB   MET  62          1HB       MET  62  11.484   0.907   6.316
  498   2HB   MET  62          2HB       MET  62  10.408   1.243   4.967
  499   1HG   MET  62          1HG       MET  62   8.538   0.302   6.230
  500   2HG   MET  62          2HG       MET  62   9.619  -0.019   7.584
  501   1HE   MET  62          1HE       MET  62   9.634   3.114   5.198
  502   2HE   MET  62          2HE       MET  62   8.578   4.218   6.079
  503   3HE   MET  62          3HE       MET  62   7.921   2.741   5.375
  504    H    THR  63           H        THR  63   9.891  -3.150   5.526
  505    HA   THR  63           HA       THR  63  11.450  -3.707   7.966
  506    HB   THR  63           HB       THR  63   8.667  -4.759   7.418
  507    HG1  THR  63           1HG      THR  63   9.425  -2.335   8.279
  508   1HG2  THR  63          1HG2      THR  63  10.004  -6.177   8.889
  509   2HG2  THR  63          2HG2      THR  63   8.724  -5.374   9.798
  510   3HG2  THR  63          3HG2      THR  63  10.383  -4.787   9.905
  511    H    LYS  64           H        LYS  64  11.684  -6.093   8.382
  512    HA   LYS  64           HA       LYS  64  12.270  -8.205   7.781
  513   1HB   LYS  64          2HB       LYS  64  10.732  -7.670   5.234
  514   2HB   LYS  64          1HB       LYS  64  11.224  -9.243   5.841
  515   1HG   LYS  64          2HG       LYS  64   9.318  -7.382   7.243
  516   2HG   LYS  64          1HG       LYS  64   8.842  -8.748   6.233
  517   1HD   LYS  64          1HD       LYS  64  10.017 -10.274   7.741
  518   2HD   LYS  64          2HD       LYS  64  10.497  -8.908   8.751
  519   1HE   LYS  64          2HE       LYS  64   7.670  -9.801   8.199
  520   2HE   LYS  64          1HE       LYS  64   8.567 -10.069   9.692
  521   1HZ   LYS  64          1HZ       LYS  64   7.074  -8.183   9.884
  522   2HZ   LYS  64          2HZ       LYS  64   7.826  -7.418   8.577
  523   3HZ   LYS  64          3HZ       LYS  64   8.685  -7.678  10.011
  524    H    ARG  65           H        ARG  65  13.797  -5.772   6.987
  525    HA   ARG  65           HA       ARG  65  15.722  -5.251   5.908
  526   1HB   ARG  65          2HB       ARG  65  15.893  -8.245   5.530
  527   2HB   ARG  65          1HB       ARG  65  17.220  -7.114   5.301
  528   1HG   ARG  65          1HG       ARG  65  17.106  -6.501   7.665
  529   2HG   ARG  65          2HG       ARG  65  15.782  -7.645   7.893
  530   1HD   ARG  65          1HD       ARG  65  18.585  -8.323   7.013
  531   2HD   ARG  65          2HD       ARG  65  17.904  -8.605   8.614
  532    HE   ARG  65           HE       ARG  65  16.244  -9.886   6.805
  533   1HH1  ARG  65          2HH1      ARG  65  19.569 -10.082   7.832
  534   2HH1  ARG  65          1HH1      ARG  65  19.703 -11.778   7.507
  535   1HH2  ARG  65          1HH2      ARG  65  16.413 -12.118   6.374
  536   2HH2  ARG  65          2HH2      ARG  65  17.910 -12.935   6.677
  537    H    LEU  66           H        LEU  66  14.050  -4.383   4.333
  538    HA   LEU  66           HA       LEU  66  14.442  -5.632   1.694
  539   1HB   LEU  66          1HB       LEU  66  12.021  -4.598   3.041
  540   2HB   LEU  66          2HB       LEU  66  12.184  -4.189   1.345
  541    HG   LEU  66           HG       LEU  66  11.995  -6.406   0.654
  542   1HD1  LEU  66          1HD2      LEU  66  12.564  -7.290   3.479
  543   2HD1  LEU  66          2HD2      LEU  66  13.687  -7.370   2.123
  544   3HD1  LEU  66          3HD2      LEU  66  12.219  -8.349   2.110
  545   1HD2  LEU  66          1HD1      LEU  66   9.889  -5.566   1.520
  546   2HD2  LEU  66          2HD1      LEU  66  10.292  -6.173   3.127
  547   3HD2  LEU  66          3HD1      LEU  66  10.026  -7.303   1.798
  548    H    TYR  67           H        TYR  67  12.996  -3.335   0.491
  549    HA   TYR  67           HA       TYR  67  13.559  -1.437  -0.615
  550   1HB   TYR  67          1HB       TYR  67  13.800   0.495   0.748
  551   2HB   TYR  67          2HB       TYR  67  12.761  -0.623   1.620
  552    HD1  TYR  67           1HD      TYR  67  13.383  -1.472   3.758
  553    HD2  TYR  67           2HD      TYR  67  16.150   0.824   1.486
  554    HE1  TYR  67           1HE      TYR  67  14.833  -1.274   5.735
  555    HE2  TYR  67           2HE      TYR  67  17.606   1.028   3.450
  556    HH   TYR  67           HH       TYR  67  17.421   0.910   5.904
  557    H    ASP  68           H        ASP  68  15.382   0.425  -0.672
  558    HA   ASP  68           HA       ASP  68  17.678  -0.896  -1.676
  559   1HB   ASP  68          2HB       ASP  68  16.821   1.250  -2.574
  560   2HB   ASP  68          1HB       ASP  68  17.299   2.055  -1.086
  561    H    GLU  69           H        GLU  69  18.474   1.874   0.220
  562    HA   GLU  69           HA       GLU  69  19.049   0.795   2.700
  563   1HB   GLU  69          1HB       GLU  69  20.569  -0.730   1.492
  564   2HB   GLU  69          2HB       GLU  69  21.434   0.656   0.840
  565   1HG   GLU  69          1HG       GLU  69  22.100   1.308   3.094
  566   2HG   GLU  69          2HG       GLU  69  21.222  -0.070   3.754
  567    H    LYS  70           H        LYS  70  20.033   2.976   0.141
  568    HA   LYS  70           HA       LYS  70  21.171   4.867   2.045
  569   1HB   LYS  70          1HB       LYS  70  21.628   6.238   0.001
  570   2HB   LYS  70          2HB       LYS  70  22.379   4.647  -0.015
  571   1HG   LYS  70          2HG       LYS  70  20.598   3.821  -1.476
  572   2HG   LYS  70          1HG       LYS  70  19.855   5.422  -1.465
  573   1HD   LYS  70          1HD       LYS  70  22.643   4.826  -2.452
  574   2HD   LYS  70          2HD       LYS  70  21.222   4.990  -3.486
  575   1HE   LYS  70          2HE       LYS  70  20.916   7.287  -2.697
  576   2HE   LYS  70          1HE       LYS  70  22.338   7.123  -1.668
  577   1HZ   LYS  70          1HZ       LYS  70  22.868   8.265  -3.725
  578   2HZ   LYS  70          2HZ       LYS  70  22.321   6.948  -4.632
  579   3HZ   LYS  70          3HZ       LYS  70  23.684   6.784  -3.647
  580    H    GLN  71           H        GLN  71  18.593   4.853  -0.410
  581    HA   GLN  71           HA       GLN  71  16.964   6.306   1.555
  582   1HB   GLN  71          2HB       GLN  71  16.812   6.635  -1.449
  583   2HB   GLN  71          1HB       GLN  71  15.742   7.396  -0.279
  584   1HG   GLN  71          2HG       GLN  71  17.641   8.619   0.658
  585   2HG   GLN  71          1HG       GLN  71  18.705   7.863  -0.527
  586   1HE2  GLN  71          2HE2      GLN  71  16.181  10.191  -0.006
  587   2HE2  GLN  71          1HE2      GLN  71  16.315  10.984  -1.535
  588    H    GLN  72           H        GLN  72  15.104   5.308   2.066
  589    HA   GLN  72           HA       GLN  72  14.818   2.608   1.120
  590   1HB   GLN  72          1HB       GLN  72  13.051   4.104   3.065
  591   2HB   GLN  72          2HB       GLN  72  13.176   2.361   2.875
  592   1HG   GLN  72          1HG       GLN  72  14.403   2.832   4.797
  593   2HG   GLN  72          2HG       GLN  72  15.621   2.629   3.537
  594   1HE2  GLN  72          2HE2      GLN  72  13.614   5.470   3.817
  595   2HE2  GLN  72          1HE2      GLN  72  14.872   6.551   4.295
  596    H    HIS  73           H        HIS  73  14.335   3.680  -1.127
  597    HA   HIS  73           HA       HIS  73  11.416   3.718  -1.432
  598   1HB   HIS  73          1HB       HIS  73  11.471   5.608  -2.912
  599   2HB   HIS  73          2HB       HIS  73  12.296   6.063  -1.426
  600    HD1  HIS  73           1HD      HIS  73  15.104   5.382  -1.768
  601    HD2  HIS  73           2HD      HIS  73  12.811   6.634  -4.998
  602    HE1  HIS  73           1HE      HIS  73  16.748   6.225  -3.474
  603    HE2  HIS  73           2HE      HIS  73  15.343   6.895  -5.455
  604    H    ILE  74           H        ILE  74  14.536   2.793  -2.593
  605    HA   ILE  74           HA       ILE  74  13.265   1.535  -4.937
  606    HB   ILE  74           HB       ILE  74  16.216   1.500  -4.336
  607   1HG1  ILE  74          2HG1      ILE  74  15.509   3.845  -4.478
  608   2HG1  ILE  74          1HG1      ILE  74  16.460   3.386  -5.886
  609   1HG2  ILE  74          1HG2      ILE  74  14.633   1.128  -6.875
  610   2HG2  ILE  74          2HG2      ILE  74  15.402  -0.147  -5.932
  611   3HG2  ILE  74          3HG2      ILE  74  16.392   1.069  -6.740
  612   1HD1  ILE  74          1HD1      ILE  74  14.564   4.778  -6.499
  613   2HD1  ILE  74          2HD1      ILE  74  13.461   3.597  -5.791
  614   3HD1  ILE  74          3HD1      ILE  74  14.429   3.167  -7.202
  615    H    VAL  75           H        VAL  75  12.356  -0.347  -4.354
  616    HA   VAL  75           HA       VAL  75  13.444  -1.687  -2.001
  617    HB   VAL  75           HB       VAL  75  10.832  -2.430  -3.240
  618   1HG1  VAL  75          1HG1      VAL  75  11.812  -2.259  -0.392
  619   2HG1  VAL  75          2HG1      VAL  75  11.666  -3.728  -1.358
  620   3HG1  VAL  75          3HG1      VAL  75  10.221  -2.826  -0.902
  621   1HG2  VAL  75          1HG2      VAL  75  10.733  -0.034  -3.235
  622   2HG2  VAL  75          2HG2      VAL  75  11.345   0.032  -1.580
  623   3HG2  VAL  75          3HG2      VAL  75   9.747  -0.644  -1.905
  624    H    TYR  76           H        TYR  76  15.076  -2.956  -2.819
  625    HA   TYR  76           HA       TYR  76  14.696  -4.830  -4.928
  626   1HB   TYR  76          1HB       TYR  76  16.708  -5.136  -2.712
  627   2HB   TYR  76          2HB       TYR  76  16.845  -5.631  -4.397
  628    HD1  TYR  76           1HD      TYR  76  15.919  -3.085  -5.709
  629    HD2  TYR  76           2HD      TYR  76  18.601  -3.756  -2.470
  630    HE1  TYR  76           1HE      TYR  76  17.076  -0.974  -6.227
  631    HE2  TYR  76           2HE      TYR  76  19.761  -1.653  -2.985
  632    HH   TYR  76           HH       TYR  76  18.491   0.681  -5.088
  633    H    CYS  77           H        CYS  77  12.826  -5.999  -4.534
  634    HA   CYS  77           HA       CYS  77  12.556  -7.284  -1.914
  635   1HB   CYS  77          1HB       CYS  77  10.178  -7.511  -2.466
  636   2HB   CYS  77          2HB       CYS  77  10.706  -5.841  -2.637
  637    HG   CYS  77           HG       CYS  77  11.072  -6.291  -5.519
  638    H    SER  78           H        SER  78  14.402  -8.553  -3.422
  639    HA   SER  78           HA       SER  78  13.383 -10.704  -4.962
  640   1HB   SER  78          2HB       SER  78  15.614 -11.717  -4.628
  641   2HB   SER  78          1HB       SER  78  15.733 -10.023  -5.103
  642    HG   SER  78           HG       SER  78  16.966  -9.912  -3.398
  643    H    ASN  79           H        ASN  79  12.392 -12.515  -4.346
  644    HA   ASN  79           HA       ASN  79  11.321 -14.012  -3.011
  645   1HB   ASN  79          2HB       ASN  79  13.635 -14.806  -2.643
  646   2HB   ASN  79          1HB       ASN  79  13.784 -13.707  -1.275
  647   1HD2  ASN  79          2HD2      ASN  79  10.862 -15.458  -2.043
  648   2HD2  ASN  79          1HD2      ASN  79  10.903 -16.511  -0.675
  649    H    ASP  80           H        ASP  80   9.927 -12.011  -2.685
  650    HA   ASP  80           HA       ASP  80   9.764 -11.369   0.180
  651   1HB   ASP  80          2HB       ASP  80  10.900  -9.544  -1.169
  652   2HB   ASP  80          1HB       ASP  80   9.361  -9.314  -1.994
  653    H    LEU  81           H        LEU  81   7.648 -10.710   0.902
  654    HA   LEU  81           HA       LEU  81   5.472 -12.015  -0.330
  655   1HB   LEU  81          2HB       LEU  81   5.882 -10.968   2.122
  656   2HB   LEU  81          1HB       LEU  81   4.906  -9.694   1.419
  657    HG   LEU  81           HG       LEU  81   3.480 -11.210   2.635
  658   1HD1  LEU  81          1HD1      LEU  81   2.557 -10.255   0.596
  659   2HD1  LEU  81          2HD1      LEU  81   1.922 -11.877   0.874
  660   3HD1  LEU  81          3HD1      LEU  81   3.178 -11.617  -0.338
  661   1HD2  LEU  81          1HD2      LEU  81   3.284 -13.571   2.028
  662   2HD2  LEU  81          2HD2      LEU  81   4.906 -13.178   2.600
  663   3HD2  LEU  81          3HD2      LEU  81   4.605 -13.381   0.874
  664    H    LEU  82           H        LEU  82   6.504  -8.619  -0.294
  665    HA   LEU  82           HA       LEU  82   4.588  -7.562  -2.023
  666   1HB   LEU  82          1HB       LEU  82   6.808  -6.586  -0.792
  667   2HB   LEU  82          2HB       LEU  82   7.365  -6.664  -2.449
  668    HG   LEU  82           HG       LEU  82   6.461  -4.450  -1.857
  669   1HD1  LEU  82          1HD2      LEU  82   4.832  -5.943  -3.904
  670   2HD1  LEU  82          2HD2      LEU  82   6.400  -5.182  -4.173
  671   3HD1  LEU  82          3HD2      LEU  82   4.992  -4.190  -3.792
  672   1HD2  LEU  82          1HD1      LEU  82   4.059  -4.163  -1.519
  673   2HD2  LEU  82          2HD1      LEU  82   4.779  -5.145  -0.243
  674   3HD2  LEU  82          3HD1      LEU  82   3.848  -5.914  -1.527
  675    H    GLY  83           H        GLY  83   7.201  -9.755  -2.573
  676   1HA   GLY  83          1HA       GLY  83   7.350  -9.543  -5.404
  677   2HA   GLY  83          2HA       GLY  83   7.849 -10.927  -4.440
  678    H    ASP  84           H        ASP  84   5.409 -11.580  -3.231
  679    HA   ASP  84           HA       ASP  84   4.023 -13.058  -5.139
  680   1HB   ASP  84          2HB       ASP  84   2.940 -11.920  -2.544
  681   2HB   ASP  84          1HB       ASP  84   2.189 -13.201  -3.489
  682    H    LEU  85           H        LEU  85   3.743  -9.696  -4.266
  683    HA   LEU  85           HA       LEU  85   1.362  -9.168  -5.755
  684   1HB   LEU  85          1HB       LEU  85   3.626  -7.405  -4.845
  685   2HB   LEU  85          2HB       LEU  85   2.261  -6.795  -5.754
  686    HG   LEU  85           HG       LEU  85   2.513  -7.166  -2.948
  687   1HD1  LEU  85          1HD1      LEU  85   0.260  -6.210  -4.702
  688   2HD1  LEU  85          2HD1      LEU  85   1.559  -5.229  -4.022
  689   3HD1  LEU  85          3HD1      LEU  85   0.362  -5.966  -2.958
  690   1HD2  LEU  85          1HD2      LEU  85   0.430  -8.351  -2.458
  691   2HD2  LEU  85          2HD2      LEU  85   1.602  -9.404  -3.251
  692   3HD2  LEU  85          3HD2      LEU  85   0.250  -8.741  -4.169
  693    H    PHE  86           H        PHE  86   4.526  -7.791  -6.501
  694    HA   PHE  86           HA       PHE  86   3.698  -7.776  -9.300
  695   1HB   PHE  86          2HB       PHE  86   5.966  -6.277  -7.969
  696   2HB   PHE  86          1HB       PHE  86   5.369  -6.025  -9.606
  697    HD1  PHE  86           1HD      PHE  86   5.614  -3.770  -7.820
  698    HD2  PHE  86           2HD      PHE  86   2.408  -6.539  -8.242
  699    HE1  PHE  86           1HE      PHE  86   4.040  -2.068  -6.981
  700    HE2  PHE  86           2HE      PHE  86   0.835  -4.849  -7.401
  701    HZ   PHE  86           HZ       PHE  86   1.650  -2.616  -6.770
  702    H    GLY  87           H        GLY  87   6.484  -8.681  -7.304
  703   1HA   GLY  87          2HA       GLY  87   7.936 -10.484  -7.729
  704   2HA   GLY  87          1HA       GLY  87   7.320 -10.566  -9.372
  705    H    VAL  88           H        VAL  88   7.958  -7.390  -8.621
  706    HA   VAL  88           HA       VAL  88   9.981  -7.067 -10.503
  707    HB   VAL  88           HB       VAL  88  10.368  -4.850  -9.529
  708   1HG1  VAL  88          1HG2      VAL  88   8.459  -5.153 -11.001
  709   2HG1  VAL  88          2HG2      VAL  88   8.097  -3.971  -9.744
  710   3HG1  VAL  88          3HG2      VAL  88   7.453  -5.608  -9.626
  711   1HG2  VAL  88          1HG1      VAL  88   8.545  -5.779  -7.312
  712   2HG2  VAL  88          2HG1      VAL  88   9.161  -4.140  -7.523
  713   3HG2  VAL  88          3HG1      VAL  88  10.276  -5.462  -7.172
  714    HA   PRO  89           HA       PRO  89  13.776  -7.693  -8.052
  715   1HB   PRO  89          1HB       PRO  89  15.409  -5.985  -9.352
  716   2HB   PRO  89          2HB       PRO  89  14.971  -7.559 -10.025
  717   1HG   PRO  89          2HG       PRO  89  13.863  -4.850 -10.655
  718   2HG   PRO  89          1HG       PRO  89  14.282  -6.170 -11.760
  719   1HD   PRO  89          1HD       PRO  89  11.731  -5.644 -10.949
  720   2HD   PRO  89          2HD       PRO  89  12.295  -7.264 -11.404
  721    H    SER  90           H        SER  90  12.680  -4.455  -9.012
  722    HA   SER  90           HA       SER  90  12.846  -3.589  -6.242
  723   1HB   SER  90          2HB       SER  90  14.041  -1.493  -6.869
  724   2HB   SER  90          1HB       SER  90  15.030  -2.941  -7.052
  725    HG   SER  90           HG       SER  90  13.750  -2.530  -9.338
  726    H    PHE  91           H        PHE  91  11.306  -2.055  -5.718
  727    HA   PHE  91           HA       PHE  91   9.851  -0.826  -7.957
  728   1HB   PHE  91          1HB       PHE  91   7.717  -1.145  -6.802
  729   2HB   PHE  91          2HB       PHE  91   8.492  -2.685  -7.147
  730    HD1  PHE  91           1HD      PHE  91   7.454  -0.364  -4.518
  731    HD2  PHE  91           2HD      PHE  91   9.345  -4.078  -5.371
  732    HE1  PHE  91           1HE      PHE  91   7.201  -1.017  -2.175
  733    HE2  PHE  91           2HE      PHE  91   9.105  -4.741  -3.018
  734    HZ   PHE  91           HZ       PHE  91   8.032  -3.212  -1.417
  735    H    SER  92           H        SER  92   8.546   1.076  -7.298
  736    HA   SER  92           HA       SER  92  10.204   2.664  -5.473
  737   1HB   SER  92          1HB       SER  92  10.122   3.436  -7.803
  738   2HB   SER  92          2HB       SER  92   8.367   3.561  -7.706
  739    HG   SER  92           HG       SER  92   9.575   4.906  -5.688
  740    H    VAL  93           H        VAL  93   9.296   2.534  -3.490
  741    HA   VAL  93           HA       VAL  93   6.461   2.876  -3.069
  742    HB   VAL  93           HB       VAL  93   7.400   3.280  -0.619
  743   1HG1  VAL  93          1HG2      VAL  93   7.299   0.853  -0.259
  744   2HG1  VAL  93          2HG2      VAL  93   7.366   0.603  -2.004
  745   3HG1  VAL  93          3HG2      VAL  93   5.983   1.426  -1.284
  746   1HG2  VAL  93          1HG1      VAL  93   9.651   1.818  -1.982
  747   2HG2  VAL  93          2HG1      VAL  93   9.463   2.016  -0.240
  748   3HG2  VAL  93          3HG1      VAL  93   9.730   3.427  -1.264
  749    H    LYS  94           H        LYS  94   8.777   4.955  -4.038
  750    HA   LYS  94           HA       LYS  94   8.143   7.192  -2.324
  751   1HB   LYS  94          1HB       LYS  94  10.406   6.940  -3.228
  752   2HB   LYS  94          2HB       LYS  94   9.775   7.053  -4.865
  753   1HG   LYS  94          1HG       LYS  94   9.039   9.341  -4.426
  754   2HG   LYS  94          2HG       LYS  94   9.674   9.228  -2.783
  755   1HD   LYS  94          1HD       LYS  94  11.922   8.869  -3.679
  756   2HD   LYS  94          2HD       LYS  94  11.287   8.983  -5.321
  757   1HE   LYS  94          2HE       LYS  94  12.307  11.087  -4.636
  758   2HE   LYS  94          1HE       LYS  94  10.573  11.278  -4.890
  759   1HZ   LYS  94          1HZ       LYS  94  11.299  12.401  -2.882
  760   2HZ   LYS  94          2HZ       LYS  94  11.904  10.951  -2.256
  761   3HZ   LYS  94          3HZ       LYS  94  10.241  11.136  -2.502
  762    H    GLU  95           H        GLU  95   7.175   5.954  -5.436
  763    HA   GLU  95           HA       GLU  95   5.925   8.375  -6.321
  764   1HB   GLU  95          1HB       GLU  95   4.955   6.911  -8.101
  765   2HB   GLU  95          2HB       GLU  95   6.709   6.847  -7.992
  766   1HG   GLU  95          1HG       GLU  95   6.495   4.756  -6.677
  767   2HG   GLU  95          2HG       GLU  95   4.758   4.803  -6.962
  768    H    HIS  96           H        HIS  96   4.778   5.325  -4.927
  769    HA   HIS  96           HA       HIS  96   2.968   4.858  -3.636
  770   1HB   HIS  96          2HB       HIS  96   2.575   7.850  -3.707
  771   2HB   HIS  96          1HB       HIS  96   1.593   6.751  -2.746
  772    HD1  HIS  96           1HD      HIS  96   4.601   8.746  -2.592
  773    HD2  HIS  96           2HD      HIS  96   3.217   5.281  -0.765
  774    HE1  HIS  96           1HE      HIS  96   6.031   8.448  -0.544
  775    HE2  HIS  96           2HE      HIS  96   5.240   6.291   0.490
  776    H    ARG  97           H        ARG  97   1.792   7.534  -5.687
  777    HA   ARG  97           HA       ARG  97  -0.741   6.626  -6.142
  778   1HB   ARG  97          1HB       ARG  97   0.086   8.812  -6.895
  779   2HB   ARG  97          2HB       ARG  97   1.042   8.025  -8.143
  780   1HG   ARG  97          2HG       ARG  97  -1.007   7.207  -9.196
  781   2HG   ARG  97          1HG       ARG  97  -1.963   8.008  -7.947
  782   1HD   ARG  97          2HD       ARG  97  -1.066  10.171  -8.647
  783   2HD   ARG  97          1HD       ARG  97  -0.100   9.374  -9.887
  784    HE   ARG  97           HE       ARG  97  -2.780   8.672 -10.269
  785   1HH1  ARG  97          2HH1      ARG  97  -0.716  11.472 -10.469
  786   2HH1  ARG  97          1HH1      ARG  97  -1.658  12.238 -11.704
  787   1HH2  ARG  97          1HH2      ARG  97  -4.029   9.674 -11.893
  788   2HH2  ARG  97          2HH2      ARG  97  -3.542  11.218 -12.512
  789    H    LYS  98           H        LYS  98   2.111   5.896  -8.148
  790    HA   LYS  98           HA       LYS  98   0.609   4.152  -9.852
  791   1HB   LYS  98          2HB       LYS  98   3.574   4.677  -9.633
  792   2HB   LYS  98          1HB       LYS  98   2.846   3.642 -10.854
  793   1HG   LYS  98          2HG       LYS  98   1.554   5.558 -11.686
  794   2HG   LYS  98          1HG       LYS  98   2.335   6.588 -10.484
  795   1HD   LYS  98          2HD       LYS  98   3.810   5.032 -12.605
  796   2HD   LYS  98          1HD       LYS  98   3.348   6.728 -12.755
  797   1HE   LYS  98          2HE       LYS  98   5.152   5.561 -10.638
  798   2HE   LYS  98          1HE       LYS  98   5.670   6.500 -12.038
  799   1HZ   LYS  98          1HZ       LYS  98   5.563   7.861 -10.046
  800   2HZ   LYS  98          2HZ       LYS  98   3.924   7.492  -9.850
  801   3HZ   LYS  98          3HZ       LYS  98   4.435   8.391 -11.189
  802    H    ILE  99           H        ILE  99   2.827   3.744  -7.159
  803    HA   ILE  99           HA       ILE  99   3.301   0.988  -7.528
  804    HB   ILE  99           HB       ILE  99   4.337   2.918  -5.871
  805   1HG1  ILE  99          1HG1      ILE  99   5.334   0.785  -6.858
  806   2HG1  ILE  99          2HG1      ILE  99   5.931   1.276  -5.277
  807   1HG2  ILE  99          1HG2      ILE  99   4.141   1.924  -3.576
  808   2HG2  ILE  99          2HG2      ILE  99   2.760   1.005  -4.175
  809   3HG2  ILE  99          3HG2      ILE  99   2.708   2.769  -4.167
  810   1HD1  ILE  99          1HD1      ILE  99   4.561  -0.380  -4.199
  811   2HD1  ILE  99          2HD1      ILE  99   5.538  -1.140  -5.456
  812   3HD1  ILE  99          3HD1      ILE  99   3.827  -0.821  -5.743
  813    H    TYR 100           H        TYR 100   0.793   2.734  -5.800
  814    HA   TYR 100           HA       TYR 100  -0.239   0.316  -4.599
  815   1HB   TYR 100          2HB       TYR 100  -0.927   3.218  -4.445
  816   2HB   TYR 100          1HB       TYR 100  -2.136   2.031  -3.962
  817    HD1  TYR 100           1HD      TYR 100  -1.875   3.279  -1.720
  818    HD2  TYR 100           2HD      TYR 100   1.186   0.874  -3.441
  819    HE1  TYR 100           1HE      TYR 100  -0.807   3.069   0.486
  820    HE2  TYR 100           2HE      TYR 100   2.254   0.657  -1.246
  821    HH   TYR 100           HH       TYR 100   2.338   1.864   0.897
  822    H    THR 101           H        THR 101  -1.046   2.457  -7.277
  823    HA   THR 101           HA       THR 101  -3.636   1.425  -7.752
  824    HB   THR 101           HB       THR 101  -2.825   3.595  -8.668
  825    HG1  THR 101           1HG      THR 101  -4.275   3.387 -10.218
  826   1HG2  THR 101          1HG2      THR 101  -0.607   2.893  -9.393
  827   2HG2  THR 101          2HG2      THR 101  -1.515   3.568 -10.747
  828   3HG2  THR 101          3HG2      THR 101  -1.325   1.820 -10.595
  829    H    MET 102           H        MET 102  -0.464   0.278  -8.563
  830    HA   MET 102           HA       MET 102  -1.572  -1.711 -10.391
  831   1HB   MET 102          1HB       MET 102   0.785  -2.390 -10.748
  832   2HB   MET 102          2HB       MET 102   0.485  -0.701 -11.128
  833   1HG   MET 102          2HG       MET 102   1.498  -0.008  -9.061
  834   2HG   MET 102          1HG       MET 102   1.690  -1.682  -8.556
  835   1HE   MET 102          1HE       MET 102   4.092  -0.759  -7.993
  836   2HE   MET 102          2HE       MET 102   4.137   0.738  -8.924
  837   3HE   MET 102          3HE       MET 102   5.362  -0.503  -9.192
  838    H    ILE 103           H        ILE 103  -0.421  -1.420  -7.102
  839    HA   ILE 103           HA       ILE 103  -0.301  -4.094  -6.349
  840    HB   ILE 103           HB       ILE 103  -1.371  -1.676  -4.923
  841   1HG1  ILE 103          1HG1      ILE 103   1.008  -3.497  -4.491
  842   2HG1  ILE 103          2HG1      ILE 103   1.048  -1.866  -5.154
  843   1HG2  ILE 103          1HG2      ILE 103  -2.736  -3.536  -4.154
  844   2HG2  ILE 103          2HG2      ILE 103  -1.615  -3.033  -2.891
  845   3HG2  ILE 103          3HG2      ILE 103  -1.288  -4.489  -3.832
  846   1HD1  ILE 103          1HD1      ILE 103   1.784  -1.867  -2.857
  847   2HD1  ILE 103          2HD1      ILE 103   0.276  -2.629  -2.349
  848   3HD1  ILE 103          3HD1      ILE 103   0.261  -0.992  -3.005
  849    H    TYR 104           H        TYR 104  -3.159  -2.050  -6.872
  850    HA   TYR 104           HA       TYR 104  -4.876  -4.401  -6.544
  851   1HB   TYR 104          1HB       TYR 104  -5.509  -1.450  -6.699
  852   2HB   TYR 104          2HB       TYR 104  -6.740  -2.709  -6.639
  853    HD1  TYR 104           1HD      TYR 104  -7.285  -3.810  -4.595
  854    HD2  TYR 104           2HD      TYR 104  -4.025  -1.080  -4.746
  855    HE1  TYR 104           1HE      TYR 104  -7.178  -3.811  -2.138
  856    HE2  TYR 104           2HE      TYR 104  -3.908  -1.073  -2.289
  857    HH   TYR 104           HH       TYR 104  -5.543  -3.341  -0.366
  858    H    ARG 105           H        ARG 105  -5.550  -5.486  -8.258
  859    HA   ARG 105           HA       ARG 105  -6.036  -4.064 -10.769
  860   1HB   ARG 105          1HB       ARG 105  -4.904  -5.838 -12.055
  861   2HB   ARG 105          2HB       ARG 105  -3.792  -4.967 -11.008
  862   1HG   ARG 105          1HG       ARG 105  -3.885  -6.794  -9.386
  863   2HG   ARG 105          2HG       ARG 105  -4.994  -7.669 -10.443
  864   1HD   ARG 105          2HD       ARG 105  -2.174  -6.854 -11.135
  865   2HD   ARG 105          1HD       ARG 105  -2.692  -8.474 -10.674
  866    HE   ARG 105           HE       ARG 105  -4.215  -7.615 -12.871
  867   1HH1  ARG 105          2HH1      ARG 105  -0.960  -8.569 -12.073
  868   2HH1  ARG 105          1HH1      ARG 105  -0.610  -9.171 -13.660
  869   1HH2  ARG 105          1HH2      ARG 105  -3.763  -8.405 -14.962
  870   2HH2  ARG 105          2HH2      ARG 105  -2.204  -9.077 -15.302
  871    H    ASN 106           H        ASN 106  -6.633  -6.723  -8.626
  872    HA   ASN 106           HA       ASN 106  -8.646  -7.889 -10.375
  873   1HB   ASN 106          1HB       ASN 106  -7.776  -8.664  -7.582
  874   2HB   ASN 106          2HB       ASN 106  -8.900  -9.572  -8.587
  875   1HD2  ASN 106          2HD2      ASN 106  -5.591  -8.643  -8.103
  876   2HD2  ASN 106          1HD2      ASN 106  -4.896  -9.795  -9.185
  877    H    LEU 107           H        LEU 107 -10.797  -8.450  -9.322
  878    HA   LEU 107           HA       LEU 107 -11.995  -5.976  -8.479
  879   1HB   LEU 107          2HB       LEU 107 -13.098  -7.497 -10.075
  880   2HB   LEU 107          1HB       LEU 107 -13.221  -8.715  -8.820
  881    HG   LEU 107           HG       LEU 107 -14.667  -7.151  -7.518
  882   1HD1  LEU 107          1HD1      LEU 107 -15.634  -5.225  -8.658
  883   2HD1  LEU 107          2HD1      LEU 107 -14.589  -5.516 -10.049
  884   3HD1  LEU 107          3HD1      LEU 107 -13.887  -5.057  -8.498
  885   1HD2  LEU 107          1HD2      LEU 107 -16.652  -7.462  -8.915
  886   2HD2  LEU 107          2HD2      LEU 107 -15.644  -8.909  -8.882
  887   3HD2  LEU 107          3HD2      LEU 107 -15.621  -7.848 -10.291
  888    H    VAL 108           H        VAL 108 -10.914  -5.721  -6.440
  889    HA   VAL 108           HA       VAL 108 -12.330  -7.138  -4.298
  890    HB   VAL 108           HB       VAL 108 -10.245  -7.166  -2.937
  891   1HG1  VAL 108          1HG2      VAL 108 -11.027  -9.183  -4.052
  892   2HG1  VAL 108          2HG2      VAL 108  -9.265  -9.127  -4.027
  893   3HG1  VAL 108          3HG2      VAL 108 -10.138  -8.738  -5.509
  894   1HG2  VAL 108          1HG1      VAL 108  -8.919  -6.473  -5.556
  895   2HG2  VAL 108          2HG1      VAL 108  -8.085  -6.957  -4.080
  896   3HG2  VAL 108          3HG1      VAL 108  -8.997  -5.448  -4.122
  897    H    VAL 109           H        VAL 109 -12.545  -4.475  -5.575
  898    HA   VAL 109           HA       VAL 109 -12.172  -2.834  -3.160
  899    HB   VAL 109           HB       VAL 109 -10.415  -2.238  -4.760
  900   1HG1  VAL 109          1HG2      VAL 109 -10.987  -1.245  -6.931
  901   2HG1  VAL 109          2HG2      VAL 109 -12.686  -1.625  -6.647
  902   3HG1  VAL 109          3HG2      VAL 109 -11.508  -2.927  -6.817
  903   1HG2  VAL 109          1HG1      VAL 109 -10.873   0.167  -4.926
  904   2HG2  VAL 109          2HG1      VAL 109 -11.315  -0.480  -3.346
  905   3HG2  VAL 109          3HG1      VAL 109 -12.567  -0.137  -4.539
  906    H    VAL 110           H        VAL 110 -13.680  -1.095  -2.917
  907    HA   VAL 110           HA       VAL 110 -16.315  -1.749  -3.468
  908    HB   VAL 110           HB       VAL 110 -15.691  -0.204  -1.683
  909   1HG1  VAL 110          1HG1      VAL 110 -15.095   1.730  -3.915
  910   2HG1  VAL 110          2HG1      VAL 110 -13.918   0.996  -2.827
  911   3HG1  VAL 110          3HG1      VAL 110 -15.118   2.123  -2.196
  912   1HG2  VAL 110          1HG2      VAL 110 -17.562   1.019  -3.711
  913   2HG2  VAL 110          2HG2      VAL 110 -17.480   1.449  -2.003
  914   3HG2  VAL 110          3HG2      VAL 110 -17.987  -0.171  -2.481
  915    H    ASN 111           H        ASN 111 -17.777  -1.227  -5.024
  916    HA   ASN 111           HA       ASN 111 -16.671  -0.196  -7.517
  917   1HB   ASN 111          1HB       ASN 111 -18.855  -0.992  -8.480
  918   2HB   ASN 111          2HB       ASN 111 -17.877  -2.255  -7.740
  919   1HD2  ASN 111          2HD2      ASN 111 -19.637  -3.588  -7.413
  920   2HD2  ASN 111          1HD2      ASN 111 -20.832  -3.269  -6.206
  921    H    GLN 112           H        GLN 112 -17.759   1.413  -8.767
  922    HA   GLN 112           HA       GLN 112 -18.716   3.596  -7.173
  923   1HB   GLN 112          1HB       GLN 112 -18.506   3.310 -10.175
  924   2HB   GLN 112          2HB       GLN 112 -18.841   4.808  -9.318
  925   1HG   GLN 112          1HG       GLN 112 -16.658   4.696  -8.247
  926   2HG   GLN 112          2HG       GLN 112 -16.322   3.179  -9.078
  927   1HE2  GLN 112          2HE2      GLN 112 -15.905   3.198 -11.288
  928   2HE2  GLN 112          1HE2      GLN 112 -15.489   4.648 -12.131
  929    H    GLN 113           H        GLN 113 -20.754   4.274  -6.861
  930    HA   GLN 113           HA       GLN 113 -23.025   4.271  -6.807
  931   1HB   GLN 113          2HB       GLN 113 -22.639   3.367  -9.662
  932   2HB   GLN 113          1HB       GLN 113 -24.208   3.756  -8.973
  933   1HG   GLN 113          1HG       GLN 113 -23.420   5.640 -10.209
  934   2HG   GLN 113          2HG       GLN 113 -23.386   6.037  -8.491
  935   1HE2  GLN 113          1HE2      GLN 113 -21.480   5.346 -11.313
  936   2HE2  GLN 113          2HE2      GLN 113 -19.972   5.904 -10.680
  937    H    GLU 114           H        GLU 114 -25.021   2.727  -7.461
  938    HA   GLU 114           HA       GLU 114 -24.371   0.217  -6.134
  939   1HB   GLU 114          1HB       GLU 114 -26.821  -0.034  -5.917
  940   2HB   GLU 114          2HB       GLU 114 -26.236   1.480  -5.241
  941   1HG   GLU 114          2HG       GLU 114 -26.957   2.656  -7.260
  942   2HG   GLU 114          1HG       GLU 114 -27.557   1.137  -7.924
  943    H    SER 115           H        SER 115 -23.524   0.545  -8.858
  944    HA   SER 115           HA       SER 115 -25.317  -1.158 -10.402
  945   1HB   SER 115          2HB       SER 115 -23.743  -0.737 -12.266
  946   2HB   SER 115          1HB       SER 115 -24.333   0.762 -11.549
  947    HG   SER 115           HG       SER 115 -22.135   0.034 -10.250
  948    H    SER 116           H        SER 116 -25.179  -3.260  -9.943
  949    HA   SER 116           HA       SER 116 -22.660  -4.441  -9.117
  950   1HB   SER 116          1HB       SER 116 -25.405  -5.675  -9.450
  951   2HB   SER 116          2HB       SER 116 -24.001  -6.489  -8.761
  952    HG   SER 116           HG       SER 116 -25.021  -4.063  -7.721
  953    H    ASP 117           H        ASP 117 -25.121  -5.576 -11.431
  954    HA   ASP 117           HA       ASP 117 -24.947  -6.670 -13.418
  955   1HB   ASP 117          1HB       ASP 117 -22.506  -4.903 -13.703
  956   2HB   ASP 117          2HB       ASP 117 -23.290  -5.772 -15.018
  957    H    SER 118           H        SER 118 -24.045  -8.195 -11.376
  958    HA   SER 118           HA       SER 118 -21.433  -9.268 -12.054
  959   1HB   SER 118          1HB       SER 118 -21.795 -10.756 -10.114
  960   2HB   SER 118          2HB       SER 118 -22.029  -9.061  -9.689
  961    HG   SER 118           HG       SER 118 -24.371  -9.910 -10.451
  962    H    SER 119           H        SER 119 -24.693  -9.820 -12.852
  963    HA   SER 119           HA       SER 119 -23.940 -12.236 -14.311
  964   1HB   SER 119          2HB       SER 119 -26.347 -12.090 -12.478
  965   2HB   SER 119          1HB       SER 119 -25.974 -13.425 -13.570
  966    HG   SER 119           HG       SER 119 -25.164 -14.004 -11.611
  Start of MODEL   24
    1   1H    MET   1          1H        MET   1  25.248   9.897  -0.638
    2   2H    MET   1          2H        MET   1  26.454   8.864  -1.218
    3   3H    MET   1          3H        MET   1  26.793   9.929   0.051
    4    HA   MET   1           HA       MET   1  25.276   8.778   1.497
    5   1HB   MET   1          1HB       MET   1  23.714   8.043  -0.261
    6   2HB   MET   1          2HB       MET   1  24.918   6.910  -0.858
    7   1HG   MET   1          2HG       MET   1  23.249   5.778   0.482
    8   2HG   MET   1          1HG       MET   1  24.833   5.694   1.252
    9   1HE   MET   1          1HE       MET   1  21.300   7.408   1.286
   10   2HE   MET   1          2HE       MET   1  22.396   8.782   1.138
   11   3HE   MET   1          3HE       MET   1  21.472   8.547   2.622
   12    H    CYS   2           H        CYS   2  27.682   7.680  -0.776
   13    HA   CYS   2           HA       CYS   2  28.653   5.536   0.863
   14   1HB   CYS   2          2HB       CYS   2  28.950   5.491  -1.567
   15   2HB   CYS   2          1HB       CYS   2  29.929   6.951  -1.488
   16    HG   CYS   2           HG       CYS   2  31.841   5.553   0.240
   17    H    ASN   3           H        ASN   3  29.878   8.780   0.047
   18    HA   ASN   3           HA       ASN   3  31.920   8.580   2.100
   19   1HB   ASN   3          1HB       ASN   3  31.230  10.845   0.216
   20   2HB   ASN   3          2HB       ASN   3  32.621  10.808   1.294
   21   1HD2  ASN   3          1HD2      ASN   3  31.196   9.521  -1.594
   22   2HD2  ASN   3          2HD2      ASN   3  32.624   8.764  -2.206
   23    H    THR   4           H        THR   4  31.582   9.143   4.131
   24    HA   THR   4           HA       THR   4  30.616   9.987   6.012
   25    HB   THR   4           HB       THR   4  30.242  12.388   6.069
   26    HG1  THR   4           1HG      THR   4  30.634  13.455   3.889
   27   1HG2  THR   4          1HG2      THR   4  32.422  13.156   5.241
   28   2HG2  THR   4          2HG2      THR   4  32.594  11.661   4.321
   29   3HG2  THR   4          3HG2      THR   4  32.556  11.611   6.084
   30    H    ASN   5           H        ASN   5  28.573  11.725   6.532
   31    HA   ASN   5           HA       ASN   5  26.254  10.371   5.316
   32   1HB   ASN   5          1HB       ASN   5  26.559   9.779   7.681
   33   2HB   ASN   5          2HB       ASN   5  26.524  11.484   8.117
   34   1HD2  ASN   5          1HD2      ASN   5  24.752  11.218   9.453
   35   2HD2  ASN   5          2HD2      ASN   5  23.162  10.947   8.839
   36    H    MET   6           H        MET   6  27.730  13.380   6.163
   37    HA   MET   6           HA       MET   6  27.255  15.538   5.642
   38   1HB   MET   6          2HB       MET   6  25.297  14.291   3.707
   39   2HB   MET   6          1HB       MET   6  25.809  15.973   3.693
   40   1HG   MET   6          2HG       MET   6  28.104  15.272   3.245
   41   2HG   MET   6          1HG       MET   6  27.591  13.586   3.262
   42   1HE   MET   6          1HE       MET   6  25.224  13.435   0.140
   43   2HE   MET   6          2HE       MET   6  24.757  13.774   1.808
   44   3HE   MET   6          3HE       MET   6  25.949  12.520   1.462
   45    H    SER   7           H        SER   7  23.978  14.385   4.990
   46    HA   SER   7           HA       SER   7  21.967  14.938   5.894
   47   1HB   SER   7          2HB       SER   7  23.584  14.980   8.455
   48   2HB   SER   7          1HB       SER   7  21.824  14.936   8.364
   49    HG   SER   7           HG       SER   7  22.212  12.949   7.051
   50    H    VAL   8           H        VAL   8  23.354  17.061   4.753
   51    HA   VAL   8           HA       VAL   8  23.139  19.333   6.549
   52    HB   VAL   8           HB       VAL   8  23.776  19.333   3.596
   53   1HG1  VAL   8          1HG1      VAL   8  24.244  21.401   5.742
   54   2HG1  VAL   8          2HG1      VAL   8  23.049  21.493   4.448
   55   3HG1  VAL   8          3HG1      VAL   8  24.769  21.523   4.063
   56   1HG2  VAL   8          1HG2      VAL   8  25.656  19.267   5.954
   57   2HG2  VAL   8          2HG2      VAL   8  26.127  19.461   4.265
   58   3HG2  VAL   8          3HG2      VAL   8  25.382  17.957   4.806
   59    HA   PRO   9           HA       PRO   9  18.823  19.994   5.637
   60   1HB   PRO   9          2HB       PRO   9  19.525  22.779   6.418
   61   2HB   PRO   9          1HB       PRO   9  18.235  21.732   7.019
   62   1HG   PRO   9          2HG       PRO   9  20.410  22.185   8.486
   63   2HG   PRO   9          1HG       PRO   9  19.658  20.579   8.444
   64   1HD   PRO   9          1HD       PRO   9  22.132  21.554   7.080
   65   2HD   PRO   9          2HD       PRO   9  21.796  19.972   7.815
   66    H    THR  10           H        THR  10  18.730  19.852   3.410
   67    HA   THR  10           HA       THR  10  19.043  22.400   1.975
   68    HB   THR  10           HB       THR  10  19.820  21.183  -0.021
   69    HG1  THR  10           1HG      THR  10  19.793  18.954   1.753
   70   1HG2  THR  10          1HG2      THR  10  21.508  20.690   2.435
   71   2HG2  THR  10          2HG2      THR  10  21.477  22.170   1.475
   72   3HG2  THR  10          3HG2      THR  10  22.089  20.672   0.770
   73    H    ASP  11           H        ASP  11  17.256  23.009   0.947
   74    HA   ASP  11           HA       ASP  11  15.017  21.163   0.785
   75   1HB   ASP  11          2HB       ASP  11  15.195  24.113   0.137
   76   2HB   ASP  11          1HB       ASP  11  13.712  23.162   0.149
   77    H    GLY  12           H        GLY  12  13.838  20.754  -1.134
   78   1HA   GLY  12          1HA       GLY  12  14.272  21.653  -3.675
   79   2HA   GLY  12          2HA       GLY  12  15.513  20.431  -3.446
   80    H    ALA  13           H        ALA  13  12.021  20.981  -3.349
   81    HA   ALA  13           HA       ALA  13  11.567  18.099  -3.652
   82   1HB   ALA  13          1HB       ALA  13  10.316  19.238  -1.882
   83   2HB   ALA  13          2HB       ALA  13   9.238  18.583  -3.115
   84   3HB   ALA  13          3HB       ALA  13   9.594  20.310  -3.082
   85    H    VAL  14           H        VAL  14  10.614  17.216  -5.429
   86    HA   VAL  14           HA       VAL  14  10.133  19.036  -7.698
   87    HB   VAL  14           HB       VAL  14  10.982  16.136  -7.809
   88   1HG1  VAL  14          1HG1      VAL  14  11.313  16.565 -10.203
   89   2HG1  VAL  14          2HG1      VAL  14  10.663  18.192  -9.994
   90   3HG1  VAL  14          3HG1      VAL  14   9.631  16.788  -9.723
   91   1HG2  VAL  14          1HG2      VAL  14  13.136  17.004  -8.607
   92   2HG2  VAL  14          2HG2      VAL  14  12.778  17.539  -6.965
   93   3HG2  VAL  14          3HG2      VAL  14  12.570  18.651  -8.318
   94    H    THR  15           H        THR  15   9.013  16.137  -6.020
   95    HA   THR  15           HA       THR  15   6.322  16.631  -7.019
   96    HB   THR  15           HB       THR  15   7.644  13.929  -7.322
   97    HG1  THR  15           1HG      THR  15   6.965  15.970  -9.178
   98   1HG2  THR  15          1HG2      THR  15   4.875  14.874  -8.074
   99   2HG2  THR  15          2HG2      THR  15   5.270  13.762  -6.763
  100   3HG2  THR  15          3HG2      THR  15   5.553  13.288  -8.439
  101    H    THR  16           H        THR  16   8.104  14.084  -5.284
  102    HA   THR  16           HA       THR  16   7.764  13.067  -3.279
  103    HB   THR  16           HB       THR  16   6.594  15.757  -2.548
  104    HG1  THR  16           1HG      THR  16   8.645  16.265  -2.768
  105   1HG2  THR  16          1HG2      THR  16   5.894  14.019  -0.972
  106   2HG2  THR  16          2HG2      THR  16   7.058  15.114  -0.227
  107   3HG2  THR  16          3HG2      THR  16   7.573  13.517  -0.772
  108    H    SER  17           H        SER  17   6.313  11.487  -3.819
  109    HA   SER  17           HA       SER  17   4.351  10.345  -3.954
  110   1HB   SER  17          2HB       SER  17   2.811  10.652  -2.104
  111   2HB   SER  17          1HB       SER  17   4.464  10.803  -1.510
  112    HG   SER  17           HG       SER  17   2.807  12.449  -0.860
  113    H    GLN  18           H        GLN  18   1.710  10.962  -3.677
  114    HA   GLN  18           HA       GLN  18   1.109  13.286  -5.310
  115   1HB   GLN  18          2HB       GLN  18   1.663  11.513  -6.955
  116   2HB   GLN  18          1HB       GLN  18   0.433  10.485  -6.230
  117   1HG   GLN  18          1HG       GLN  18  -0.399  11.503  -8.255
  118   2HG   GLN  18          2HG       GLN  18  -1.291  12.089  -6.849
  119   1HE2  GLN  18          1HE2      GLN  18  -1.020  14.218  -6.178
  120   2HE2  GLN  18          2HE2      GLN  18  -0.312  15.421  -7.197
  121    H    ILE  19           H        ILE  19   0.062  10.441  -3.532
  122    HA   ILE  19           HA       ILE  19  -2.633  10.814  -4.294
  123    HB   ILE  19           HB       ILE  19  -3.132   8.838  -2.969
  124   1HG1  ILE  19          2HG1      ILE  19  -0.245   8.943  -2.067
  125   2HG1  ILE  19          1HG1      ILE  19  -1.620   9.389  -1.058
  126   1HG2  ILE  19          1HG2      ILE  19  -2.271   8.429  -5.149
  127   2HG2  ILE  19          2HG2      ILE  19  -1.492   7.280  -4.061
  128   3HG2  ILE  19          3HG2      ILE  19  -0.614   8.706  -4.614
  129   1HD1  ILE  19          1HD1      ILE  19  -1.148   6.675  -2.260
  130   2HD1  ILE  19          2HD1      ILE  19  -2.480   7.132  -1.199
  131   3HD1  ILE  19          3HD1      ILE  19  -0.825   7.132  -0.588
  132    HA   PRO  20           HA       PRO  20  -3.604  13.469  -0.858
  133   1HB   PRO  20          2HB       PRO  20  -6.011  14.277  -1.672
  134   2HB   PRO  20          1HB       PRO  20  -4.550  14.754  -2.546
  135   1HG   PRO  20          2HG       PRO  20  -6.556  12.639  -3.210
  136   2HG   PRO  20          1HG       PRO  20  -5.723  13.771  -4.289
  137   1HD   PRO  20          1HD       PRO  20  -4.987  11.124  -3.865
  138   2HD   PRO  20          2HD       PRO  20  -3.932  12.385  -4.528
  139    H    ALA  21           H        ALA  21  -4.712  10.461  -1.335
  140    HA   ALA  21           HA       ALA  21  -6.023   8.974  -0.212
  141   1HB   ALA  21          1HB       ALA  21  -4.555   9.646   1.625
  142   2HB   ALA  21          2HB       ALA  21  -6.175   9.256   2.201
  143   3HB   ALA  21          3HB       ALA  21  -5.675  10.941   2.046
  144    H    SER  22           H        SER  22  -8.076   8.840   1.306
  145    HA   SER  22           HA       SER  22 -10.315   9.187   1.518
  146   1HB   SER  22          2HB       SER  22  -9.416  12.076   1.414
  147   2HB   SER  22          1HB       SER  22 -11.001  11.529   1.962
  148    HG   SER  22           HG       SER  22  -9.940  11.566   3.814
  149    H    GLU  23           H        GLU  23  -9.082   9.137  -1.245
  150    HA   GLU  23           HA       GLU  23 -11.434  10.217  -2.646
  151   1HB   GLU  23          2HB       GLU  23  -9.478  11.619  -3.127
  152   2HB   GLU  23          1HB       GLU  23  -8.583  10.201  -3.654
  153   1HG   GLU  23          1HG       GLU  23 -10.163   9.880  -5.486
  154   2HG   GLU  23          2HG       GLU  23 -11.066  11.300  -4.955
  155    H    GLN  24           H        GLN  24  -8.619   8.190  -3.458
  156    HA   GLN  24           HA       GLN  24 -10.486   6.140  -4.448
  157   1HB   GLN  24          1HB       GLN  24  -7.576   6.587  -5.141
  158   2HB   GLN  24          2HB       GLN  24  -8.586   5.301  -5.786
  159   1HG   GLN  24          1HG       GLN  24  -9.024   8.251  -6.184
  160   2HG   GLN  24          2HG       GLN  24  -8.343   7.136  -7.366
  161   1HE2  GLN  24          1HE2      GLN  24  -9.684   5.638  -8.375
  162   2HE2  GLN  24          2HE2      GLN  24 -11.403   5.795  -8.368
  163    H    GLU  25           H        GLU  25 -10.192   6.212  -1.753
  164    HA   GLU  25           HA       GLU  25  -8.030   4.818  -0.657
  165   1HB   GLU  25          2HB       GLU  25  -9.612   6.103   0.701
  166   2HB   GLU  25          1HB       GLU  25 -10.888   4.953   0.324
  167   1HG   GLU  25          1HG       GLU  25  -9.562   3.186   1.441
  168   2HG   GLU  25          2HG       GLU  25  -8.385   4.416   1.904
  169    H    THR  26           H        THR  26 -11.327   3.512  -1.061
  170    HA   THR  26           HA       THR  26 -12.058   1.489  -1.840
  171    HB   THR  26           HB       THR  26  -9.171   0.748  -2.325
  172    HG1  THR  26           1HG      THR  26 -10.924   2.371  -3.735
  173   1HG2  THR  26          1HG2      THR  26 -10.130  -0.874  -3.903
  174   2HG2  THR  26          2HG2      THR  26 -11.752  -0.365  -3.435
  175   3HG2  THR  26          3HG2      THR  26 -10.702  -1.154  -2.260
  176    H    LEU  27           H        LEU  27 -12.872   0.334  -0.216
  177    HA   LEU  27           HA       LEU  27 -11.312  -0.376   2.058
  178   1HB   LEU  27          1HB       LEU  27 -13.975  -0.098   1.653
  179   2HB   LEU  27          2HB       LEU  27 -13.826  -1.845   1.559
  180    HG   LEU  27           HG       LEU  27 -14.304  -1.410   3.822
  181   1HD1  LEU  27          1HD1      LEU  27 -12.491  -2.977   3.621
  182   2HD1  LEU  27          2HD1      LEU  27 -12.168  -1.925   5.003
  183   3HD1  LEU  27          3HD1      LEU  27 -11.321  -1.660   3.475
  184   1HD2  LEU  27          1HD2      LEU  27 -12.184   0.736   3.760
  185   2HD2  LEU  27          2HD2      LEU  27 -13.185   0.294   5.146
  186   3HD2  LEU  27          3HD2      LEU  27 -13.926   1.021   3.719
  187    H    VAL  28           H        VAL  28  -9.582  -1.492   1.117
  188    HA   VAL  28           HA       VAL  28  -9.987  -3.317  -0.984
  189    HB   VAL  28           HB       VAL  28  -7.593  -2.667   0.703
  190   1HG1  VAL  28          1HG2      VAL  28  -6.252  -3.965  -0.908
  191   2HG1  VAL  28          2HG2      VAL  28  -7.745  -4.577  -1.621
  192   3HG1  VAL  28          3HG2      VAL  28  -7.336  -4.977   0.046
  193   1HG2  VAL  28          1HG1      VAL  28  -8.450  -0.997  -0.878
  194   2HG2  VAL  28          2HG1      VAL  28  -8.260  -2.173  -2.179
  195   3HG2  VAL  28          3HG1      VAL  28  -6.841  -1.579  -1.316
  196    H    ARG  29           H        ARG  29  -9.987  -5.495  -1.069
  197    HA   ARG  29           HA       ARG  29  -9.901  -6.864   1.488
  198   1HB   ARG  29          1HB       ARG  29 -12.114  -7.317  -0.512
  199   2HB   ARG  29          2HB       ARG  29 -11.990  -7.996   1.106
  200   1HG   ARG  29          1HG       ARG  29 -12.229  -5.740   2.053
  201   2HG   ARG  29          2HG       ARG  29 -12.409  -5.089   0.420
  202   1HD   ARG  29          2HD       ARG  29 -14.225  -7.091   1.761
  203   2HD   ARG  29          1HD       ARG  29 -14.582  -5.390   1.464
  204    HE   ARG  29           HE       ARG  29 -14.054  -6.335  -1.007
  205   1HH1  ARG  29          2HH1      ARG  29 -16.170  -7.408   1.544
  206   2HH1  ARG  29          1HH1      ARG  29 -17.336  -8.095   0.463
  207   1HH2  ARG  29          1HH2      ARG  29 -15.582  -7.237  -2.437
  208   2HH2  ARG  29          2HH2      ARG  29 -17.002  -7.998  -1.800
  209    HA   PRO  30           HA       PRO  30  -7.882  -9.697  -1.470
  210   1HB   PRO  30          1HB       PRO  30  -5.338  -9.412  -0.503
  211   2HB   PRO  30          2HB       PRO  30  -5.992  -8.461  -1.835
  212   1HG   PRO  30          1HG       PRO  30  -5.277  -7.590   0.828
  213   2HG   PRO  30          2HG       PRO  30  -5.793  -6.611  -0.555
  214   1HD   PRO  30          1HD       PRO  30  -7.354  -7.550   1.748
  215   2HD   PRO  30          2HD       PRO  30  -7.715  -6.249   0.596
  216    H    LYS  31           H        LYS  31  -6.025 -11.395  -0.595
  217    HA   LYS  31           HA       LYS  31  -6.643 -12.141   2.161
  218   1HB   LYS  31          1HB       LYS  31  -6.890 -14.048  -0.171
  219   2HB   LYS  31          2HB       LYS  31  -6.981 -14.505   1.524
  220   1HG   LYS  31          1HG       LYS  31  -8.975 -13.131   1.799
  221   2HG   LYS  31          2HG       LYS  31  -8.878 -12.645   0.104
  222   1HD   LYS  31          2HD       LYS  31  -9.163 -14.977  -0.579
  223   2HD   LYS  31          1HD       LYS  31  -9.261 -15.462   1.115
  224   1HE   LYS  31          2HE       LYS  31 -11.482 -15.297   0.130
  225   2HE   LYS  31          1HE       LYS  31 -11.263 -14.089   1.395
  226   1HZ   LYS  31          1HZ       LYS  31 -10.845 -12.429  -0.303
  227   2HZ   LYS  31          2HZ       LYS  31 -12.349 -13.159  -0.554
  228   3HZ   LYS  31          3HZ       LYS  31 -11.031 -13.587  -1.524
  229    HA   PRO  32           HA       PRO  32  -2.605 -14.264   1.085
  230   1HB   PRO  32          2HB       PRO  32  -1.911 -14.919  -1.397
  231   2HB   PRO  32          1HB       PRO  32  -3.233 -15.757  -0.577
  232   1HG   PRO  32          1HG       PRO  32  -3.331 -13.701  -2.724
  233   2HG   PRO  32          2HG       PRO  32  -4.433 -15.052  -2.408
  234   1HD   PRO  32          1HD       PRO  32  -4.783 -12.333  -1.654
  235   2HD   PRO  32          2HD       PRO  32  -5.794 -13.716  -1.189
  236    H    LEU  33           H        LEU  33  -3.172 -11.547  -1.068
  237    HA   LEU  33           HA       LEU  33  -0.270 -11.244  -1.435
  238   1HB   LEU  33          2HB       LEU  33  -2.493 -10.334  -3.260
  239   2HB   LEU  33          1HB       LEU  33  -0.777 -10.206  -3.582
  240    HG   LEU  33           HG       LEU  33  -2.315 -12.791  -3.311
  241   1HD1  LEU  33          1HD1      LEU  33  -1.943 -13.020  -5.707
  242   2HD1  LEU  33          2HD1      LEU  33  -1.163 -11.439  -5.746
  243   3HD1  LEU  33          3HD1      LEU  33  -2.876 -11.567  -5.349
  244   1HD2  LEU  33          1HD2      LEU  33  -0.259 -13.849  -4.093
  245   2HD2  LEU  33          2HD2      LEU  33  -0.007 -13.010  -2.563
  246   3HD2  LEU  33          3HD2      LEU  33   0.558 -12.287  -4.068
  247    H    LEU  34           H        LEU  34  -1.457 -10.063   0.827
  248    HA   LEU  34           HA       LEU  34  -0.157  -7.620   0.678
  249   1HB   LEU  34          2HB       LEU  34  -2.149  -6.941  -0.608
  250   2HB   LEU  34          1HB       LEU  34  -3.166  -7.405   0.740
  251    HG   LEU  34           HG       LEU  34  -2.498  -5.582   2.037
  252   1HD1  LEU  34          1HD1      LEU  34  -0.195  -5.097   0.156
  253   2HD1  LEU  34          2HD1      LEU  34  -0.068  -5.980   1.679
  254   3HD1  LEU  34          3HD1      LEU  34  -0.521  -4.271   1.681
  255   1HD2  LEU  34          1HD2      LEU  34  -3.881  -4.897   0.146
  256   2HD2  LEU  34          2HD2      LEU  34  -2.431  -4.608  -0.815
  257   3HD2  LEU  34          3HD2      LEU  34  -2.755  -3.620   0.611
  258    H    LEU  35           H        LEU  35  -1.317 -10.162   2.223
  259    HA   LEU  35           HA       LEU  35  -1.711  -8.818   4.799
  260   1HB   LEU  35          1HB       LEU  35  -3.435 -11.098   3.884
  261   2HB   LEU  35          2HB       LEU  35  -3.707  -9.995   5.220
  262    HG   LEU  35           HG       LEU  35  -3.728  -8.207   3.247
  263   1HD1  LEU  35          1HD2      LEU  35  -4.732 -10.712   1.915
  264   2HD1  LEU  35          2HD2      LEU  35  -3.211  -9.904   1.540
  265   3HD1  LEU  35          3HD2      LEU  35  -4.744  -9.082   1.245
  266   1HD2  LEU  35          1HD1      LEU  35  -5.519  -8.786   4.918
  267   2HD2  LEU  35          2HD1      LEU  35  -6.141  -9.931   3.724
  268   3HD2  LEU  35          3HD1      LEU  35  -6.079  -8.205   3.347
  269    H    LYS  36           H        LYS  36  -0.437 -11.451   3.005
  270    HA   LYS  36           HA       LYS  36   0.628 -12.792   5.317
  271   1HB   LYS  36          1HB       LYS  36   1.245 -12.820   2.380
  272   2HB   LYS  36          2HB       LYS  36   2.367 -13.544   3.523
  273   1HG   LYS  36          2HG       LYS  36   0.915 -15.239   2.626
  274   2HG   LYS  36          1HG       LYS  36   0.558 -15.004   4.338
  275   1HD   LYS  36          2HD       LYS  36  -1.351 -13.582   3.728
  276   2HD   LYS  36          1HD       LYS  36  -1.003 -13.863   2.021
  277   1HE   LYS  36          1HE       LYS  36  -1.729 -15.974   4.048
  278   2HE   LYS  36          2HE       LYS  36  -2.802 -15.314   2.816
  279   1HZ   LYS  36          1HZ       LYS  36  -1.318 -16.188   1.115
  280   2HZ   LYS  36          2HZ       LYS  36  -1.880 -17.425   2.122
  281   3HZ   LYS  36          3HZ       LYS  36  -0.305 -16.838   2.306
  282    H    LEU  37           H        LEU  37   1.066  -9.795   3.887
  283    HA   LEU  37           HA       LEU  37   3.690  -9.404   5.134
  284   1HB   LEU  37          1HB       LEU  37   2.250  -7.033   4.198
  285   2HB   LEU  37          2HB       LEU  37   3.905  -7.532   3.898
  286    HG   LEU  37           HG       LEU  37   1.629  -8.844   2.456
  287   1HD1  LEU  37          1HD1      LEU  37   1.398  -6.403   2.259
  288   2HD1  LEU  37          2HD1      LEU  37   1.820  -7.170   0.723
  289   3HD1  LEU  37          3HD1      LEU  37   3.054  -6.317   1.656
  290   1HD2  LEU  37          1HD2      LEU  37   3.323  -9.226   0.765
  291   2HD2  LEU  37          2HD2      LEU  37   3.879  -9.841   2.322
  292   3HD2  LEU  37          3HD2      LEU  37   4.501  -8.309   1.706
  293    H    LEU  38           H        LEU  38   0.559  -7.763   5.141
  294    HA   LEU  38           HA       LEU  38   1.238  -6.038   7.200
  295   1HB   LEU  38          1HB       LEU  38  -1.203  -6.752   5.725
  296   2HB   LEU  38          2HB       LEU  38  -1.468  -6.009   7.293
  297    HG   LEU  38           HG       LEU  38  -0.247  -4.040   6.634
  298   1HD1  LEU  38          1HD1      LEU  38   1.505  -5.099   5.317
  299   2HD1  LEU  38          2HD1      LEU  38   0.730  -3.808   4.400
  300   3HD1  LEU  38          3HD1      LEU  38   0.336  -5.493   4.055
  301   1HD2  LEU  38          1HD2      LEU  38  -1.641  -3.226   4.836
  302   2HD2  LEU  38          2HD2      LEU  38  -2.598  -4.201   5.953
  303   3HD2  LEU  38          3HD2      LEU  38  -2.090  -4.878   4.405
  304    H    LYS  39           H        LYS  39  -1.028  -8.797   7.376
  305    HA   LYS  39           HA       LYS  39  -1.456  -8.818  10.100
  306   1HB   LYS  39          2HB       LYS  39  -1.104 -11.237   8.319
  307   2HB   LYS  39          1HB       LYS  39  -1.902 -11.221   9.884
  308   1HG   LYS  39          2HG       LYS  39  -3.647  -9.790   9.023
  309   2HG   LYS  39          1HG       LYS  39  -2.823  -9.683   7.466
  310   1HD   LYS  39          2HD       LYS  39  -3.081 -12.102   7.170
  311   2HD   LYS  39          1HD       LYS  39  -3.922 -12.198   8.718
  312   1HE   LYS  39          2HE       LYS  39  -4.839 -10.593   6.337
  313   2HE   LYS  39          1HE       LYS  39  -5.463 -12.177   6.792
  314   1HZ   LYS  39          1HZ       LYS  39  -5.615  -9.721   8.455
  315   2HZ   LYS  39          2HZ       LYS  39  -6.221 -11.242   8.883
  316   3HZ   LYS  39          3HZ       LYS  39  -6.893 -10.398   7.579
  317    H    SER  40           H        SER  40   1.413  -9.611   8.350
  318    HA   SER  40           HA       SER  40   2.622 -11.048  10.557
  319   1HB   SER  40          2HB       SER  40   3.125 -11.771   8.280
  320   2HB   SER  40          1HB       SER  40   3.776 -10.176   7.898
  321    HG   SER  40           HG       SER  40   5.216 -12.065   8.646
  322    H    VAL  41           H        VAL  41   2.807  -7.836   9.104
  323    HA   VAL  41           HA       VAL  41   5.102  -7.132  10.717
  324    HB   VAL  41           HB       VAL  41   5.321  -6.080   8.688
  325   1HG1  VAL  41          1HG1      VAL  41   3.247  -6.624   7.656
  326   2HG1  VAL  41          2HG1      VAL  41   3.465  -4.879   7.514
  327   3HG1  VAL  41          3HG1      VAL  41   2.361  -5.535   8.725
  328   1HG2  VAL  41          1HG2      VAL  41   5.551  -4.417  10.454
  329   2HG2  VAL  41          2HG2      VAL  41   3.839  -4.013  10.304
  330   3HG2  VAL  41          3HG2      VAL  41   4.943  -3.691   8.966
  331    H    GLY  42           H        GLY  42   1.684  -6.963  11.016
  332   1HA   GLY  42          1HA       GLY  42   1.713  -6.430  13.699
  333   2HA   GLY  42          2HA       GLY  42   1.639  -4.842  12.954
  334    H    ALA  43           H        ALA  43   0.060  -6.171  10.696
  335    HA   ALA  43           HA       ALA  43  -2.439  -5.268  11.702
  336   1HB   ALA  43          1HB       ALA  43  -3.290  -5.752   9.477
  337   2HB   ALA  43          2HB       ALA  43  -1.828  -6.663   9.098
  338   3HB   ALA  43          3HB       ALA  43  -1.736  -4.923   9.379
  339    H    GLN  44           H        GLN  44  -4.441  -6.740  10.903
  340    HA   GLN  44           HA       GLN  44  -4.215  -9.526  11.462
  341   1HB   GLN  44          2HB       GLN  44  -3.902  -8.667  13.739
  342   2HB   GLN  44          1HB       GLN  44  -5.411  -7.772  13.614
  343   1HG   GLN  44          1HG       GLN  44  -5.725  -9.788  14.904
  344   2HG   GLN  44          2HG       GLN  44  -6.637  -9.877  13.399
  345   1HE2  GLN  44          1HE2      GLN  44  -3.927 -11.105  15.186
  346   2HE2  GLN  44          2HE2      GLN  44  -3.631 -12.483  14.186
  347    H    LYS  45           H        LYS  45  -6.086  -6.670  10.886
  348    HA   LYS  45           HA       LYS  45  -8.676  -7.720  10.963
  349   1HB   LYS  45          2HB       LYS  45  -7.752  -5.563   9.067
  350   2HB   LYS  45          1HB       LYS  45  -9.363  -5.792   9.730
  351   1HG   LYS  45          1HG       LYS  45  -8.534  -5.246  11.961
  352   2HG   LYS  45          2HG       LYS  45  -6.915  -5.008  11.297
  353   1HD   LYS  45          2HD       LYS  45  -9.359  -3.448  10.463
  354   2HD   LYS  45          1HD       LYS  45  -8.164  -2.891  11.636
  355   1HE   LYS  45          2HE       LYS  45  -7.630  -3.561   8.743
  356   2HE   LYS  45          1HE       LYS  45  -7.751  -1.940   9.425
  357   1HZ   LYS  45          1HZ       LYS  45  -5.828  -2.416  10.808
  358   2HZ   LYS  45          2HZ       LYS  45  -5.450  -2.620   9.172
  359   3HZ   LYS  45          3HZ       LYS  45  -5.712  -3.972  10.153
  360    H    ASP  46           H        ASP  46  -9.985  -8.702   9.482
  361    HA   ASP  46           HA       ASP  46  -8.775 -10.322   7.510
  362   1HB   ASP  46          1HB       ASP  46 -11.695  -9.644   7.920
  363   2HB   ASP  46          2HB       ASP  46 -11.086 -10.951   6.908
  364    H    THR  47           H        THR  47  -9.873  -7.095   7.454
  365    HA   THR  47           HA       THR  47  -9.354  -7.014   4.561
  366    HB   THR  47           HB       THR  47 -11.063  -5.227   4.314
  367    HG1  THR  47           1HG      THR  47 -11.076  -5.296   6.943
  368   1HG2  THR  47          1HG2      THR  47 -11.595  -7.564   3.741
  369   2HG2  THR  47          2HG2      THR  47 -13.006  -6.666   4.301
  370   3HG2  THR  47          3HG2      THR  47 -12.201  -7.809   5.380
  371    H    TYR  48           H        TYR  48  -9.163  -4.598   3.891
  372    HA   TYR  48           HA       TYR  48  -7.788  -3.008   5.897
  373   1HB   TYR  48          2HB       TYR  48  -6.426  -4.182   3.476
  374   2HB   TYR  48          1HB       TYR  48  -5.784  -2.807   4.370
  375    HD1  TYR  48           1HD      TYR  48  -6.173  -6.387   4.280
  376    HD2  TYR  48           2HD      TYR  48  -5.139  -3.085   6.744
  377    HE1  TYR  48           1HE      TYR  48  -5.070  -7.922   5.854
  378    HE2  TYR  48           2HE      TYR  48  -4.044  -4.617   8.342
  379    HH   TYR  48           HH       TYR  48  -4.209  -7.051   8.962
  380    H    THR  49           H        THR  49  -6.781  -1.026   4.711
  381    HA   THR  49           HA       THR  49  -8.300  -0.339   2.302
  382    HB   THR  49           HB       THR  49  -8.833   1.875   3.026
  383    HG1  THR  49           1HG      THR  49  -6.967   1.311   4.994
  384   1HG2  THR  49          1HG2      THR  49  -9.493  -0.061   5.249
  385   2HG2  THR  49          2HG2      THR  49 -10.411   0.162   3.758
  386   3HG2  THR  49          3HG2      THR  49 -10.316   1.468   4.939
  387    H    MET  50           H        MET  50  -7.320   1.642   1.216
  388    HA   MET  50           HA       MET  50  -4.621   1.008   0.711
  389   1HB   MET  50          1HB       MET  50  -6.582   2.968  -0.298
  390   2HB   MET  50          2HB       MET  50  -4.891   3.423  -0.489
  391   1HG   MET  50          1HG       MET  50  -6.200   0.908  -1.500
  392   2HG   MET  50          2HG       MET  50  -5.685   2.291  -2.466
  393   1HE   MET  50          1HE       MET  50  -3.195  -0.647  -3.404
  394   2HE   MET  50          2HE       MET  50  -4.416   0.462  -4.026
  395   3HE   MET  50          3HE       MET  50  -4.884  -0.837  -2.928
  396    H    LYS  51           H        LYS  51  -6.015   2.998   3.084
  397    HA   LYS  51           HA       LYS  51  -3.633   4.644   3.417
  398   1HB   LYS  51          2HB       LYS  51  -5.845   5.659   3.776
  399   2HB   LYS  51          1HB       LYS  51  -6.172   4.501   5.057
  400   1HG   LYS  51          1HG       LYS  51  -4.327   5.423   6.367
  401   2HG   LYS  51          2HG       LYS  51  -3.996   6.584   5.079
  402   1HD   LYS  51          2HD       LYS  51  -5.282   7.671   6.802
  403   2HD   LYS  51          1HD       LYS  51  -6.289   7.484   5.364
  404   1HE   LYS  51          1HE       LYS  51  -7.544   6.935   7.377
  405   2HE   LYS  51          2HE       LYS  51  -7.343   5.514   6.353
  406   1HZ   LYS  51          1HZ       LYS  51  -6.955   4.993   8.677
  407   2HZ   LYS  51          2HZ       LYS  51  -5.723   6.149   8.759
  408   3HZ   LYS  51          3HZ       LYS  51  -5.537   4.783   7.779
  409    H    GLU  52           H        GLU  52  -5.433   2.143   5.161
  410    HA   GLU  52           HA       GLU  52  -3.648   1.633   7.238
  411   1HB   GLU  52          2HB       GLU  52  -5.971   0.518   6.343
  412   2HB   GLU  52          1HB       GLU  52  -4.809  -0.734   5.926
  413   1HG   GLU  52          1HG       GLU  52  -5.638  -1.271   8.065
  414   2HG   GLU  52          2HG       GLU  52  -4.007  -0.642   8.302
  415    H    VAL  53           H        VAL  53  -3.860  -0.110   4.141
  416    HA   VAL  53           HA       VAL  53  -1.457  -1.475   4.261
  417    HB   VAL  53           HB       VAL  53  -2.760  -0.354   1.775
  418   1HG1  VAL  53          1HG2      VAL  53  -0.478  -1.115   1.387
  419   2HG1  VAL  53          2HG2      VAL  53  -1.639  -2.203   0.627
  420   3HG1  VAL  53          3HG2      VAL  53  -0.857  -2.665   2.139
  421   1HG2  VAL  53          1HG1      VAL  53  -3.193  -2.970   3.210
  422   2HG2  VAL  53          2HG1      VAL  53  -3.842  -2.567   1.621
  423   3HG2  VAL  53          3HG1      VAL  53  -4.354  -1.654   3.041
  424    H    LEU  54           H        LEU  54  -2.099   1.851   3.282
  425    HA   LEU  54           HA       LEU  54   0.253   2.579   2.079
  426   1HB   LEU  54          1HB       LEU  54  -1.732   4.047   2.526
  427   2HB   LEU  54          2HB       LEU  54  -1.162   4.228   4.174
  428    HG   LEU  54           HG       LEU  54   0.631   4.965   1.889
  429   1HD1  LEU  54          1HD2      LEU  54  -0.243   7.243   1.962
  430   2HD1  LEU  54          2HD2      LEU  54  -1.508   6.725   3.078
  431   3HD1  LEU  54          3HD2      LEU  54  -1.475   6.098   1.430
  432   1HD2  LEU  54          1HD1      LEU  54   1.582   4.887   4.126
  433   2HD2  LEU  54          2HD1      LEU  54   0.331   5.987   4.710
  434   3HD2  LEU  54          3HD1      LEU  54   1.518   6.546   3.532
  435    H    PHE  55           H        PHE  55  -0.281   3.199   5.555
  436    HA   PHE  55           HA       PHE  55   2.497   3.516   6.022
  437   1HB   PHE  55          2HB       PHE  55   1.947   4.040   8.213
  438   2HB   PHE  55          1HB       PHE  55   0.457   4.439   7.366
  439    HD1  PHE  55           1HD      PHE  55  -1.495   2.936   7.524
  440    HD2  PHE  55           2HD      PHE  55   2.027   2.301   9.825
  441    HE1  PHE  55           1HE      PHE  55  -2.750   1.451   9.032
  442    HE2  PHE  55           2HE      PHE  55   0.779   0.814  11.336
  443    HZ   PHE  55           HZ       PHE  55  -1.613   0.388  10.939
  444    H    TYR  56           H        TYR  56   0.319   0.795   6.237
  445    HA   TYR  56           HA       TYR  56   1.894  -0.744   8.017
  446   1HB   TYR  56          1HB       TYR  56  -0.624  -1.026   6.670
  447   2HB   TYR  56          2HB       TYR  56   0.304  -2.515   6.525
  448    HD1  TYR  56           1HD      TYR  56  -2.310  -1.906   8.132
  449    HD2  TYR  56           2HD      TYR  56   1.802  -2.150   9.203
  450    HE1  TYR  56           1HE      TYR  56  -2.951  -2.530  10.422
  451    HE2  TYR  56           2HE      TYR  56   1.175  -2.782  11.494
  452    HH   TYR  56           HH       TYR  56  -1.977  -3.705  12.352
  453    H    LEU  57           H        LEU  57   1.228  -1.368   4.557
  454    HA   LEU  57           HA       LEU  57   3.286  -3.229   4.225
  455   1HB   LEU  57          2HB       LEU  57   1.512  -2.964   2.583
  456   2HB   LEU  57          1HB       LEU  57   2.073  -1.348   2.199
  457    HG   LEU  57           HG       LEU  57   3.995  -2.159   1.086
  458   1HD1  LEU  57          1HD1      LEU  57   3.374  -4.869   2.255
  459   2HD1  LEU  57          2HD1      LEU  57   4.712  -3.813   2.707
  460   3HD1  LEU  57          3HD1      LEU  57   4.658  -4.526   1.094
  461   1HD2  LEU  57          1HD2      LEU  57   3.105  -3.646  -0.606
  462   2HD2  LEU  57          2HD2      LEU  57   1.900  -2.435  -0.167
  463   3HD2  LEU  57          3HD2      LEU  57   1.762  -4.082   0.451
  464    H    GLY  58           H        GLY  58   3.331   0.262   4.289
  465   1HA   GLY  58          2HA       GLY  58   5.984   0.699   3.464
  466   2HA   GLY  58          1HA       GLY  58   5.112   1.669   4.644
  467    H    GLN  59           H        GLN  59   4.704  -0.076   6.706
  468    HA   GLN  59           HA       GLN  59   7.139  -0.191   8.062
  469   1HB   GLN  59          2HB       GLN  59   4.812  -2.052   8.563
  470   2HB   GLN  59          1HB       GLN  59   6.031  -1.532   9.716
  471   1HG   GLN  59          2HG       GLN  59   3.814   0.102   8.522
  472   2HG   GLN  59          1HG       GLN  59   4.030  -0.370  10.205
  473   1HE2  GLN  59          1HE2      GLN  59   3.734   2.285   9.013
  474   2HE2  GLN  59          2HE2      GLN  59   5.129   3.180   9.500
  475    H    TYR  60           H        TYR  60   5.409  -2.714   6.268
  476    HA   TYR  60           HA       TYR  60   6.989  -4.878   6.933
  477   1HB   TYR  60          2HB       TYR  60   4.850  -5.057   5.731
  478   2HB   TYR  60          1HB       TYR  60   5.602  -4.376   4.290
  479    HD1  TYR  60           1HD      TYR  60   6.374  -7.100   6.730
  480    HD2  TYR  60           2HD      TYR  60   6.061  -5.926   2.654
  481    HE1  TYR  60           1HE      TYR  60   7.033  -9.359   6.037
  482    HE2  TYR  60           2HE      TYR  60   6.724  -8.187   1.949
  483    HH   TYR  60           HH       TYR  60   6.814 -10.826   4.082
  484    H    ILE  61           H        ILE  61   7.355  -2.764   4.068
  485    HA   ILE  61           HA       ILE  61   9.652  -4.090   3.110
  486    HB   ILE  61           HB       ILE  61  10.042  -1.801   1.917
  487   1HG1  ILE  61          2HG1      ILE  61   7.184  -1.536   2.863
  488   2HG1  ILE  61          1HG1      ILE  61   8.524  -0.490   3.321
  489   1HG2  ILE  61          1HG2      ILE  61   8.454  -2.467   0.196
  490   2HG2  ILE  61          2HG2      ILE  61   7.650  -3.537   1.346
  491   3HG2  ILE  61          3HG2      ILE  61   9.311  -3.861   0.852
  492   1HD1  ILE  61          1HD1      ILE  61   7.057   0.492   1.603
  493   2HD1  ILE  61          2HD1      ILE  61   7.502  -0.821   0.511
  494   3HD1  ILE  61          3HD1      ILE  61   8.728   0.317   1.070
  495    H    MET  62           H        MET  62   9.335  -1.053   4.950
  496    HA   MET  62           HA       MET  62  12.021  -0.453   5.266
  497   1HB   MET  62          1HB       MET  62   9.819  -0.113   7.309
  498   2HB   MET  62          2HB       MET  62  11.372   0.715   7.332
  499   1HG   MET  62          2HG       MET  62  10.821   1.810   5.225
  500   2HG   MET  62          1HG       MET  62   9.269   0.975   5.198
  501   1HE   MET  62          1HE       MET  62   7.996   3.277   4.899
  502   2HE   MET  62          2HE       MET  62   9.537   4.134   4.909
  503   3HE   MET  62          3HE       MET  62   8.224   4.668   5.959
  504    H    THR  63           H        THR  63  10.165  -3.010   6.650
  505    HA   THR  63           HA       THR  63  12.433  -3.762   8.371
  506    HB   THR  63           HB       THR  63  10.885  -5.284   9.523
  507    HG1  THR  63           1HG      THR  63   8.572  -4.912   8.976
  508   1HG2  THR  63          1HG2      THR  63  11.138  -3.004  10.368
  509   2HG2  THR  63          2HG2      THR  63   9.493  -3.589  10.620
  510   3HG2  THR  63          3HG2      THR  63   9.836  -2.459   9.310
  511    H    LYS  64           H        LYS  64  12.403  -6.324   8.635
  512    HA   LYS  64           HA       LYS  64  12.952  -8.322   7.711
  513   1HB   LYS  64          1HB       LYS  64  10.881  -7.495   5.672
  514   2HB   LYS  64          2HB       LYS  64  11.551  -9.114   5.820
  515   1HG   LYS  64          2HG       LYS  64  10.000  -7.686   7.972
  516   2HG   LYS  64          1HG       LYS  64   9.337  -8.891   6.866
  517   1HD   LYS  64          2HD       LYS  64  11.615  -9.381   8.784
  518   2HD   LYS  64          1HD       LYS  64   9.932  -9.821   9.085
  519   1HE   LYS  64          2HE       LYS  64   9.958 -11.281   7.128
  520   2HE   LYS  64          1HE       LYS  64  11.632 -10.831   6.807
  521   1HZ   LYS  64          1HZ       LYS  64  11.504 -12.948   7.947
  522   2HZ   LYS  64          2HZ       LYS  64  10.650 -12.246   9.227
  523   3HZ   LYS  64          3HZ       LYS  64  12.255 -11.799   8.938
  524    H    ARG  65           H        ARG  65  14.094  -5.647   6.644
  525    HA   ARG  65           HA       ARG  65  15.766  -5.017   5.243
  526   1HB   ARG  65          2HB       ARG  65  16.723  -7.130   6.287
  527   2HB   ARG  65          1HB       ARG  65  16.270  -7.957   4.804
  528   1HG   ARG  65          1HG       ARG  65  17.721  -6.494   3.518
  529   2HG   ARG  65          2HG       ARG  65  18.147  -5.610   4.986
  530   1HD   ARG  65          1HD       ARG  65  19.105  -7.658   5.932
  531   2HD   ARG  65          2HD       ARG  65  18.697  -8.526   4.453
  532    HE   ARG  65           HE       ARG  65  20.232  -6.371   3.676
  533   1HH1  ARG  65          2HH1      ARG  65  20.616  -9.164   5.724
  534   2HH1  ARG  65          1HH1      ARG  65  22.322  -9.289   5.450
  535   1HH2  ARG  65          1HH2      ARG  65  22.477  -6.530   3.309
  536   2HH2  ARG  65          2HH2      ARG  65  23.379  -7.794   4.078
  537    H    LEU  66           H        LEU  66  13.020  -5.856   4.150
  538    HA   LEU  66           HA       LEU  66  13.759  -6.169   1.337
  539   1HB   LEU  66          1HB       LEU  66  11.233  -6.412   2.879
  540   2HB   LEU  66          2HB       LEU  66  11.104  -5.875   1.216
  541    HG   LEU  66           HG       LEU  66  10.774  -8.222   1.204
  542   1HD1  LEU  66          1HD1      LEU  66  13.620  -7.674   0.381
  543   2HD1  LEU  66          2HD1      LEU  66  12.182  -7.399  -0.602
  544   3HD1  LEU  66          3HD1      LEU  66  12.636  -9.041  -0.145
  545   1HD2  LEU  66          1HD2      LEU  66  12.296  -9.821   2.192
  546   2HD2  LEU  66          2HD2      LEU  66  11.709  -8.695   3.419
  547   3HD2  LEU  66          3HD2      LEU  66  13.336  -8.512   2.761
  548    H    TYR  67           H        TYR  67  14.886  -4.041   1.515
  549    HA   TYR  67           HA       TYR  67  13.433  -1.990   0.281
  550   1HB   TYR  67          1HB       TYR  67  13.005  -0.422   1.961
  551   2HB   TYR  67          2HB       TYR  67  12.528  -1.942   2.705
  552    HD1  TYR  67           1HD      TYR  67  14.666   0.925   2.943
  553    HD2  TYR  67           2HD      TYR  67  14.138  -3.069   4.303
  554    HE1  TYR  67           1HE      TYR  67  16.186   1.372   4.820
  555    HE2  TYR  67           2HE      TYR  67  15.657  -2.635   6.188
  556    HH   TYR  67           HH       TYR  67  16.648   0.489   7.068
  557    H    ASP  68           H        ASP  68  14.779  -0.410  -0.504
  558    HA   ASP  68           HA       ASP  68  17.535  -0.938  -0.614
  559   1HB   ASP  68          2HB       ASP  68  16.278   0.332  -2.343
  560   2HB   ASP  68          1HB       ASP  68  16.125   1.674  -1.212
  561    H    GLU  69           H        GLU  69  19.222  -0.274   0.592
  562    HA   GLU  69           HA       GLU  69  18.654   1.037   3.100
  563   1HB   GLU  69          2HB       GLU  69  21.041   0.589   3.594
  564   2HB   GLU  69          1HB       GLU  69  20.163  -0.855   3.108
  565   1HG   GLU  69          1HG       GLU  69  21.098  -0.665   0.857
  566   2HG   GLU  69          2HG       GLU  69  21.983   0.777   1.353
  567    H    LYS  70           H        LYS  70  18.316   2.650   0.723
  568    HA   LYS  70           HA       LYS  70  20.427   4.656   1.178
  569   1HB   LYS  70          1HB       LYS  70  18.785   4.172  -1.311
  570   2HB   LYS  70          2HB       LYS  70  19.923   5.496  -1.101
  571   1HG   LYS  70          1HG       LYS  70  21.739   3.862  -0.816
  572   2HG   LYS  70          2HG       LYS  70  20.585   2.558  -1.096
  573   1HD   LYS  70          1HD       LYS  70  20.121   3.434  -3.328
  574   2HD   LYS  70          2HD       LYS  70  21.255   4.757  -3.050
  575   1HE   LYS  70          2HE       LYS  70  23.073   3.130  -2.786
  576   2HE   LYS  70          1HE       LYS  70  21.935   1.818  -3.096
  577   1HZ   LYS  70          1HZ       LYS  70  23.181   2.385  -5.080
  578   2HZ   LYS  70          2HZ       LYS  70  22.637   3.985  -5.002
  579   3HZ   LYS  70          3HZ       LYS  70  21.540   2.733  -5.299
  580    H    GLN  71           H        GLN  71  17.083   4.593  -0.095
  581    HA   GLN  71           HA       GLN  71  16.452   6.801   1.736
  582   1HB   GLN  71          1HB       GLN  71  15.674   6.683  -1.181
  583   2HB   GLN  71          2HB       GLN  71  15.186   7.929  -0.041
  584   1HG   GLN  71          1HG       GLN  71  18.052   7.353  -0.744
  585   2HG   GLN  71          2HG       GLN  71  17.059   8.542  -1.584
  586   1HE2  GLN  71          1HE2      GLN  71  18.390  10.235  -0.973
  587   2HE2  GLN  71          2HE2      GLN  71  18.427  10.847   0.643
  588    H    GLN  72           H        GLN  72  15.827   3.777   1.210
  589    HA   GLN  72           HA       GLN  72  14.105   2.358   1.696
  590   1HB   GLN  72          1HB       GLN  72  13.125   4.731   3.296
  591   2HB   GLN  72          2HB       GLN  72  12.683   3.048   3.552
  592   1HG   GLN  72          2HG       GLN  72  14.262   3.437   5.192
  593   2HG   GLN  72          1HG       GLN  72  15.198   2.662   3.914
  594   1HE2  GLN  72          2HE2      GLN  72  17.133   3.541   4.572
  595   2HE2  GLN  72          1HE2      GLN  72  17.510   5.217   4.390
  596    H    HIS  73           H        HIS  73  13.744   4.237  -0.631
  597    HA   HIS  73           HA       HIS  73  10.796   4.287  -0.710
  598   1HB   HIS  73          1HB       HIS  73  11.035   5.984  -2.502
  599   2HB   HIS  73          2HB       HIS  73  11.722   6.505  -0.971
  600    HD1  HIS  73           1HD      HIS  73  12.728   8.075  -3.192
  601    HD2  HIS  73           2HD      HIS  73  14.436   4.405  -2.259
  602    HE1  HIS  73           1HE      HIS  73  15.035   8.134  -4.188
  603    HE2  HIS  73           2HE      HIS  73  16.082   5.940  -3.530
  604    H    ILE  74           H        ILE  74  13.666   3.065  -2.243
  605    HA   ILE  74           HA       ILE  74  11.985   1.642  -4.193
  606    HB   ILE  74           HB       ILE  74  15.003   1.693  -4.052
  607   1HG1  ILE  74          1HG1      ILE  74  14.159   3.932  -4.554
  608   2HG1  ILE  74          2HG1      ILE  74  14.894   3.220  -5.986
  609   1HG2  ILE  74          1HG2      ILE  74  13.112   0.724  -6.188
  610   2HG2  ILE  74          2HG2      ILE  74  14.120  -0.280  -5.145
  611   3HG2  ILE  74          3HG2      ILE  74  14.867   0.790  -6.331
  612   1HD1  ILE  74          1HD1      ILE  74  11.944   3.389  -5.419
  613   2HD1  ILE  74          2HD1      ILE  74  12.683   2.680  -6.855
  614   3HD1  ILE  74          3HD1      ILE  74  12.853   4.406  -6.537
  615    H    VAL  75           H        VAL  75  12.026  -0.647  -4.277
  616    HA   VAL  75           HA       VAL  75  12.951  -1.883  -1.765
  617    HB   VAL  75           HB       VAL  75  10.337  -2.555  -3.096
  618   1HG1  VAL  75          1HG1      VAL  75  11.335  -4.287  -1.679
  619   2HG1  VAL  75          2HG1      VAL  75   9.844  -3.652  -0.983
  620   3HG1  VAL  75          3HG1      VAL  75  11.405  -3.145  -0.339
  621   1HG2  VAL  75          1HG2      VAL  75  10.095  -0.302  -2.428
  622   2HG2  VAL  75          2HG2      VAL  75  10.913  -0.595  -0.891
  623   3HG2  VAL  75          3HG2      VAL  75   9.315  -1.281  -1.185
  624    H    TYR  76           H        TYR  76  14.721  -2.793  -2.894
  625    HA   TYR  76           HA       TYR  76  14.404  -4.673  -4.991
  626   1HB   TYR  76          2HB       TYR  76  16.564  -4.766  -2.893
  627   2HB   TYR  76          1HB       TYR  76  16.656  -5.275  -4.578
  628    HD1  TYR  76           1HD      TYR  76  15.459  -2.938  -5.940
  629    HD2  TYR  76           2HD      TYR  76  18.218  -3.123  -2.701
  630    HE1  TYR  76           1HE      TYR  76  16.338  -0.725  -6.561
  631    HE2  TYR  76           2HE      TYR  76  19.100  -0.914  -3.317
  632    HH   TYR  76           HH       TYR  76  17.536   1.144  -5.515
  633    H    CYS  77           H        CYS  77  13.477  -6.608  -4.935
  634    HA   CYS  77           HA       CYS  77  13.400  -8.138  -2.454
  635   1HB   CYS  77          2HB       CYS  77  10.908  -8.407  -2.674
  636   2HB   CYS  77          1HB       CYS  77  11.438  -6.799  -2.192
  637    HG   CYS  77           HG       CYS  77  11.309  -6.645  -5.390
  638    H    SER  78           H        SER  78  14.794  -9.460  -3.833
  639    HA   SER  78           HA       SER  78  13.501 -10.967  -5.940
  640   1HB   SER  78          2HB       SER  78  15.619 -12.235  -6.022
  641   2HB   SER  78          1HB       SER  78  15.903 -10.496  -6.107
  642    HG   SER  78           HG       SER  78  17.238 -11.815  -4.598
  643    H    ASN  79           H        ASN  79  12.221 -12.649  -5.579
  644    HA   ASN  79           HA       ASN  79  11.097 -14.322  -4.527
  645   1HB   ASN  79          1HB       ASN  79  13.774 -14.740  -3.177
  646   2HB   ASN  79          2HB       ASN  79  12.428 -15.874  -3.115
  647   1HD2  ASN  79          2HD2      ASN  79  13.606 -17.498  -4.095
  648   2HD2  ASN  79          1HD2      ASN  79  14.003 -17.470  -5.776
  649    H    ASP  80           H        ASP  80   9.999 -12.376  -3.546
  650    HA   ASP  80           HA       ASP  80  10.233 -12.481  -0.613
  651   1HB   ASP  80          1HB       ASP  80  11.301 -10.421  -1.435
  652   2HB   ASP  80          2HB       ASP  80   9.815  -9.986  -2.276
  653    H    LEU  81           H        LEU  81   8.258 -11.635   0.494
  654    HA   LEU  81           HA       LEU  81   5.864 -12.723  -0.485
  655   1HB   LEU  81          2HB       LEU  81   6.443 -10.679   1.645
  656   2HB   LEU  81          1HB       LEU  81   4.807 -11.182   1.269
  657    HG   LEU  81           HG       LEU  81   5.601 -12.397   3.196
  658   1HD1  LEU  81          1HD1      LEU  81   4.130 -13.594   1.675
  659   2HD1  LEU  81          2HD1      LEU  81   5.291 -14.695   2.420
  660   3HD1  LEU  81          3HD1      LEU  81   5.524 -14.164   0.756
  661   1HD2  LEU  81          1HD2      LEU  81   7.862 -13.338   1.439
  662   2HD2  LEU  81          2HD2      LEU  81   7.525 -13.898   3.076
  663   3HD2  LEU  81          3HD2      LEU  81   7.995 -12.222   2.799
  664    H    LEU  82           H        LEU  82   7.292  -9.523  -0.796
  665    HA   LEU  82           HA       LEU  82   5.147  -8.276  -2.146
  666   1HB   LEU  82          2HB       LEU  82   7.207  -7.124  -1.280
  667   2HB   LEU  82          1HB       LEU  82   8.104  -7.837  -2.607
  668    HG   LEU  82           HG       LEU  82   7.385  -5.426  -2.884
  669   1HD1  LEU  82          1HD1      LEU  82   8.110  -6.822  -4.761
  670   2HD1  LEU  82          2HD1      LEU  82   6.863  -5.668  -5.234
  671   3HD1  LEU  82          3HD1      LEU  82   6.447  -7.364  -4.989
  672   1HD2  LEU  82          1HD2      LEU  82   5.093  -5.021  -3.617
  673   2HD2  LEU  82          2HD2      LEU  82   5.145  -5.622  -1.960
  674   3HD2  LEU  82          3HD2      LEU  82   4.684  -6.701  -3.275
  675    H    GLY  83           H        GLY  83   7.732 -10.431  -3.196
  676   1HA   GLY  83          1HA       GLY  83   7.359 -10.385  -5.951
  677   2HA   GLY  83          2HA       GLY  83   7.851 -11.802  -5.035
  678    H    ASP  84           H        ASP  84   5.541 -12.155  -3.480
  679    HA   ASP  84           HA       ASP  84   3.718 -13.431  -5.199
  680   1HB   ASP  84          2HB       ASP  84   3.275 -12.389  -2.390
  681   2HB   ASP  84          1HB       ASP  84   2.220 -13.519  -3.235
  682    H    LEU  85           H        LEU  85   3.852 -10.168  -3.910
  683    HA   LEU  85           HA       LEU  85   1.241  -9.391  -4.724
  684   1HB   LEU  85          1HB       LEU  85   3.685  -7.706  -4.172
  685   2HB   LEU  85          2HB       LEU  85   2.065  -7.081  -4.385
  686    HG   LEU  85           HG       LEU  85   3.335  -7.982  -1.997
  687   1HD1  LEU  85          1HD1      LEU  85   1.332  -7.009  -0.969
  688   2HD1  LEU  85          2HD1      LEU  85   0.573  -6.921  -2.559
  689   3HD1  LEU  85          3HD1      LEU  85   2.014  -5.965  -2.215
  690   1HD2  LEU  85          1HD2      LEU  85   0.812  -9.489  -2.665
  691   2HD2  LEU  85          2HD2      LEU  85   1.590  -9.431  -1.084
  692   3HD2  LEU  85          3HD2      LEU  85   2.416 -10.188  -2.444
  693    H    PHE  86           H        PHE  86   4.253  -7.968  -5.937
  694    HA   PHE  86           HA       PHE  86   2.972  -7.706  -8.564
  695   1HB   PHE  86          2HB       PHE  86   5.371  -6.254  -7.423
  696   2HB   PHE  86          1HB       PHE  86   4.650  -5.951  -8.999
  697    HD1  PHE  86           1HD      PHE  86   4.907  -3.628  -7.609
  698    HD2  PHE  86           2HD      PHE  86   1.939  -6.616  -6.987
  699    HE1  PHE  86           1HE      PHE  86   3.420  -1.937  -6.607
  700    HE2  PHE  86           2HE      PHE  86   0.454  -4.936  -5.983
  701    HZ   PHE  86           HZ       PHE  86   1.194  -2.597  -5.790
  702    H    GLY  87           H        GLY  87   6.050  -8.624  -7.054
  703   1HA   GLY  87          1HA       GLY  87   7.389 -10.442  -7.823
  704   2HA   GLY  87          2HA       GLY  87   6.650 -10.276  -9.409
  705    H    VAL  88           H        VAL  88   7.501  -7.316  -7.995
  706    HA   VAL  88           HA       VAL  88   9.307  -6.722 -10.102
  707    HB   VAL  88           HB       VAL  88   9.574  -4.555  -9.076
  708   1HG1  VAL  88          1HG2      VAL  88   7.496  -4.885 -10.253
  709   2HG1  VAL  88          2HG2      VAL  88   7.207  -3.879  -8.834
  710   3HG1  VAL  88          3HG2      VAL  88   6.752  -5.582  -8.813
  711   1HG2  VAL  88          1HG1      VAL  88   8.614  -4.040  -6.872
  712   2HG2  VAL  88          2HG1      VAL  88   9.902  -5.240  -6.771
  713   3HG2  VAL  88          3HG1      VAL  88   8.218  -5.745  -6.660
  714    HA   PRO  89           HA       PRO  89  13.238  -7.500  -7.958
  715   1HB   PRO  89          2HB       PRO  89  14.823  -5.946  -9.477
  716   2HB   PRO  89          1HB       PRO  89  14.220  -7.504 -10.054
  717   1HG   PRO  89          2HG       PRO  89  13.221  -4.746 -10.652
  718   2HG   PRO  89          1HG       PRO  89  13.446  -6.116 -11.754
  719   1HD   PRO  89          2HD       PRO  89  11.026  -5.409 -10.697
  720   2HD   PRO  89          1HD       PRO  89  11.439  -7.066 -11.179
  721    H    SER  90           H        SER  90  11.629  -4.508  -8.517
  722    HA   SER  90           HA       SER  90  12.324  -3.516  -5.945
  723   1HB   SER  90          2HB       SER  90  13.360  -1.382  -6.756
  724   2HB   SER  90          1HB       SER  90  14.372  -2.808  -6.984
  725    HG   SER  90           HG       SER  90  14.210  -1.360  -8.833
  726    H    PHE  91           H        PHE  91  10.764  -2.041  -5.245
  727    HA   PHE  91           HA       PHE  91   9.196  -0.741  -7.363
  728   1HB   PHE  91          1HB       PHE  91   7.108  -1.158  -6.367
  729   2HB   PHE  91          2HB       PHE  91   7.949  -2.700  -6.362
  730    HD1  PHE  91           1HD      PHE  91   8.370  -3.857  -4.360
  731    HD2  PHE  91           2HD      PHE  91   6.901   0.132  -4.228
  732    HE1  PHE  91           1HE      PHE  91   7.874  -4.120  -1.961
  733    HE2  PHE  91           2HE      PHE  91   6.411  -0.115  -1.837
  734    HZ   PHE  91           HZ       PHE  91   6.897  -2.244  -0.698
  735    H    SER  92           H        SER  92   8.322   1.268  -6.910
  736    HA   SER  92           HA       SER  92   9.821   2.675  -4.820
  737   1HB   SER  92          2HB       SER  92   9.292   4.715  -6.216
  738   2HB   SER  92          1HB       SER  92  10.316   3.516  -7.007
  739    HG   SER  92           HG       SER  92   7.517   3.479  -7.333
  740    H    VAL  93           H        VAL  93   8.696   3.010  -3.033
  741    HA   VAL  93           HA       VAL  93   5.860   3.134  -2.912
  742    HB   VAL  93           HB       VAL  93   6.626   4.299  -0.576
  743   1HG1  VAL  93          1HG2      VAL  93   6.479   2.053   0.396
  744   2HG1  VAL  93          2HG2      VAL  93   6.625   1.352  -1.214
  745   3HG1  VAL  93          3HG2      VAL  93   5.216   2.329  -0.804
  746   1HG2  VAL  93          1HG1      VAL  93   8.975   4.276  -1.144
  747   2HG2  VAL  93          2HG1      VAL  93   8.909   2.538  -1.431
  748   3HG2  VAL  93          3HG1      VAL  93   8.656   3.174   0.196
  749    H    LYS  94           H        LYS  94   8.314   5.483  -3.521
  750    HA   LYS  94           HA       LYS  94   7.191   7.835  -2.624
  751   1HB   LYS  94          1HB       LYS  94   8.964   7.132  -4.911
  752   2HB   LYS  94          2HB       LYS  94   8.261   8.743  -4.884
  753   1HG   LYS  94          2HG       LYS  94   9.837   7.562  -2.610
  754   2HG   LYS  94          1HG       LYS  94  10.529   8.583  -3.872
  755   1HD   LYS  94          2HD       LYS  94   8.985  10.385  -3.242
  756   2HD   LYS  94          1HD       LYS  94   8.326   9.364  -1.962
  757   1HE   LYS  94          1HE       LYS  94  10.512   9.284  -0.886
  758   2HE   LYS  94          2HE       LYS  94  11.192  10.278  -2.174
  759   1HZ   LYS  94          1HZ       LYS  94   9.718  12.074  -1.526
  760   2HZ   LYS  94          2HZ       LYS  94  10.668  11.590  -0.211
  761   3HZ   LYS  94          3HZ       LYS  94   9.046  11.120  -0.301
  762    H    GLU  95           H        GLU  95   6.780   6.479  -5.900
  763    HA   GLU  95           HA       GLU  95   4.534   8.184  -6.452
  764   1HB   GLU  95          1HB       GLU  95   4.334   6.682  -8.504
  765   2HB   GLU  95          2HB       GLU  95   5.818   7.610  -8.343
  766   1HG   GLU  95          1HG       GLU  95   6.990   5.657  -7.533
  767   2HG   GLU  95          2HG       GLU  95   5.502   4.714  -7.582
  768    H    HIS  96           H        HIS  96   3.283   7.560  -4.545
  769    HA   HIS  96           HA       HIS  96   2.397   4.941  -4.069
  770   1HB   HIS  96          1HB       HIS  96   1.072   7.562  -3.335
  771   2HB   HIS  96          2HB       HIS  96   0.660   5.992  -2.654
  772    HD1  HIS  96           1HD      HIS  96   3.258   8.672  -2.525
  773    HD2  HIS  96           2HD      HIS  96   2.439   5.016  -0.728
  774    HE1  HIS  96           1HE      HIS  96   4.812   8.530  -0.553
  775    HE2  HIS  96           2HE      HIS  96   4.344   6.280   0.482
  776    H    ARG  97           H        ARG  97   1.197   7.458  -6.175
  777    HA   ARG  97           HA       ARG  97  -1.429   6.688  -6.518
  778   1HB   ARG  97          1HB       ARG  97  -0.493   8.741  -7.473
  779   2HB   ARG  97          2HB       ARG  97   0.456   7.793  -8.610
  780   1HG   ARG  97          2HG       ARG  97  -1.612   6.955  -9.627
  781   2HG   ARG  97          1HG       ARG  97  -2.551   7.940  -8.501
  782   1HD   ARG  97          2HD       ARG  97  -1.532   9.962  -9.408
  783   2HD   ARG  97          1HD       ARG  97  -0.568   8.988 -10.517
  784    HE   ARG  97           HE       ARG  97  -3.338   8.456 -10.835
  785   1HH1  ARG  97          2HH1      ARG  97  -0.870  10.804 -11.571
  786   2HH1  ARG  97          1HH1      ARG  97  -1.677  11.400 -12.983
  787   1HH2  ARG  97          1HH2      ARG  97  -4.406   9.234 -12.694
  788   2HH2  ARG  97          2HH2      ARG  97  -3.686  10.507 -13.621
  789    H    LYS  98           H        LYS  98   1.256   5.786  -8.693
  790    HA   LYS  98           HA       LYS  98  -0.305   3.781  -9.993
  791   1HB   LYS  98          1HB       LYS  98   2.675   4.279 -10.066
  792   2HB   LYS  98          2HB       LYS  98   1.798   3.209 -11.150
  793   1HG   LYS  98          2HG       LYS  98   0.533   5.115 -12.012
  794   2HG   LYS  98          1HG       LYS  98   1.417   6.189 -10.923
  795   1HD   LYS  98          2HD       LYS  98   3.513   5.587 -12.026
  796   2HD   LYS  98          1HD       LYS  98   2.639   4.500 -13.106
  797   1HE   LYS  98          1HE       LYS  98   2.247   7.483 -12.911
  798   2HE   LYS  98          2HE       LYS  98   3.133   6.643 -14.182
  799   1HZ   LYS  98          1HZ       LYS  98   0.241   6.322 -13.589
  800   2HZ   LYS  98          2HZ       LYS  98   1.091   5.513 -14.807
  801   3HZ   LYS  98          3HZ       LYS  98   0.893   7.189 -14.887
  802    H    ILE  99           H        ILE  99   2.306   3.720  -7.610
  803    HA   ILE  99           HA       ILE  99   2.805   0.995  -7.594
  804    HB   ILE  99           HB       ILE  99   3.871   3.078  -6.261
  805   1HG1  ILE  99          1HG1      ILE  99   4.859   0.824  -6.777
  806   2HG1  ILE  99          2HG1      ILE  99   5.361   1.509  -5.236
  807   1HG2  ILE  99          1HG2      ILE  99   2.287   1.578  -4.193
  808   2HG2  ILE  99          2HG2      ILE  99   2.152   3.287  -4.609
  809   3HG2  ILE  99          3HG2      ILE  99   3.619   2.679  -3.835
  810   1HD1  ILE  99          1HD1      ILE  99   3.769   0.077  -4.076
  811   2HD1  ILE  99          2HD1      ILE  99   4.910  -0.862  -5.040
  812   3HD1  ILE  99          3HD1      ILE  99   3.263  -0.610  -5.619
  813    H    TYR 100           H        TYR 100   0.219   2.785  -6.071
  814    HA   TYR 100           HA       TYR 100  -0.733   0.482  -4.612
  815   1HB   TYR 100          2HB       TYR 100  -1.800   3.273  -4.995
  816   2HB   TYR 100          1HB       TYR 100  -2.713   2.026  -4.148
  817    HD1  TYR 100           1HD      TYR 100  -2.302   4.217  -2.513
  818    HD2  TYR 100           2HD      TYR 100   0.541   1.207  -3.499
  819    HE1  TYR 100           1HE      TYR 100  -1.065   4.714  -0.446
  820    HE2  TYR 100           2HE      TYR 100   1.773   1.689  -1.442
  821    HH   TYR 100           HH       TYR 100   0.513   3.647   1.057
  822    H    THR 101           H        THR 101  -1.556   2.230  -7.567
  823    HA   THR 101           HA       THR 101  -3.890   0.682  -8.137
  824    HB   THR 101           HB       THR 101  -3.702   1.631 -10.429
  825    HG1  THR 101           1HG      THR 101  -2.003   3.130 -10.810
  826   1HG2  THR 101          1HG2      THR 101  -4.023   3.978  -9.797
  827   2HG2  THR 101          2HG2      THR 101  -3.337   3.643  -8.208
  828   3HG2  THR 101          3HG2      THR 101  -4.859   2.895  -8.687
  829    H    MET 102           H        MET 102  -0.591  -0.035  -8.249
  830    HA   MET 102           HA       MET 102  -0.998  -2.300 -10.038
  831   1HB   MET 102          1HB       MET 102   1.356  -1.815  -8.212
  832   2HB   MET 102          2HB       MET 102   1.282  -2.883  -9.606
  833   1HG   MET 102          2HG       MET 102   0.946  -0.863 -11.031
  834   2HG   MET 102          1HG       MET 102   1.252   0.111  -9.594
  835   1HE   MET 102          1HE       MET 102   3.326  -1.071  -8.004
  836   2HE   MET 102          2HE       MET 102   3.777   0.529  -8.589
  837   3HE   MET 102          3HE       MET 102   4.923  -0.806  -8.707
  838    H    ILE 103           H        ILE 103  -0.768  -1.533  -6.607
  839    HA   ILE 103           HA       ILE 103  -0.958  -4.088  -5.542
  840    HB   ILE 103           HB       ILE 103  -2.284  -1.573  -4.515
  841   1HG1  ILE 103          2HG1      ILE 103   0.395  -2.855  -3.925
  842   2HG1  ILE 103          1HG1      ILE 103   0.115  -1.293  -4.689
  843   1HG2  ILE 103          1HG2      ILE 103  -1.701  -4.179  -3.105
  844   2HG2  ILE 103          2HG2      ILE 103  -3.296  -3.568  -3.550
  845   3HG2  ILE 103          3HG2      ILE 103  -2.330  -2.717  -2.344
  846   1HD1  ILE 103          1HD1      ILE 103   0.823  -1.029  -2.389
  847   2HD1  ILE 103          2HD1      ILE 103  -0.540  -2.004  -1.842
  848   3HD1  ILE 103          3HD1      ILE 103  -0.825  -0.442  -2.608
  849    H    TYR 104           H        TYR 104  -3.463  -2.016  -6.915
  850    HA   TYR 104           HA       TYR 104  -5.375  -4.231  -6.600
  851   1HB   TYR 104          2HB       TYR 104  -7.097  -2.773  -5.973
  852   2HB   TYR 104          1HB       TYR 104  -5.698  -2.180  -5.087
  853    HD1  TYR 104           1HD      TYR 104  -8.022  -1.477  -7.837
  854    HD2  TYR 104           2HD      TYR 104  -4.722  -0.041  -5.564
  855    HE1  TYR 104           1HE      TYR 104  -8.389   0.779  -8.743
  856    HE2  TYR 104           2HE      TYR 104  -5.082   2.221  -6.467
  857    HH   TYR 104           HH       TYR 104  -7.899   3.103  -8.154
  858    H    ARG 105           H        ARG 105  -6.848  -4.583  -8.253
  859    HA   ARG 105           HA       ARG 105  -6.391  -3.058 -10.729
  860   1HB   ARG 105          1HB       ARG 105  -5.225  -5.215 -10.856
  861   2HB   ARG 105          2HB       ARG 105  -6.727  -6.054 -10.490
  862   1HG   ARG 105          2HG       ARG 105  -7.701  -5.233 -12.569
  863   2HG   ARG 105          1HG       ARG 105  -6.204  -4.374 -12.934
  864   1HD   ARG 105          1HD       ARG 105  -4.993  -6.499 -12.971
  865   2HD   ARG 105          2HD       ARG 105  -6.488  -7.357 -12.604
  866    HE   ARG 105           HE       ARG 105  -6.921  -5.840 -14.901
  867   1HH1  ARG 105          2HH1      ARG 105  -4.978  -8.541 -13.868
  868   2HH1  ARG 105          1HH1      ARG 105  -4.915  -9.263 -15.442
  869   1HH2  ARG 105          1HH2      ARG 105  -6.845  -6.783 -16.975
  870   2HH2  ARG 105          2HH2      ARG 105  -5.976  -8.264 -17.207
  871    H    ASN 106           H        ASN 106  -8.551  -5.615  -9.483
  872    HA   ASN 106           HA       ASN 106 -10.873  -3.989  -9.611
  873   1HB   ASN 106          2HB       ASN 106 -10.583  -4.283 -12.022
  874   2HB   ASN 106          1HB       ASN 106 -10.531  -6.032 -11.817
  875   1HD2  ASN 106          1HD2      ASN 106 -12.538  -3.199 -11.795
  876   2HD2  ASN 106          2HD2      ASN 106 -14.054  -4.024 -11.839
  877    H    LEU 107           H        LEU 107  -9.326  -7.072  -9.301
  878    HA   LEU 107           HA       LEU 107 -11.728  -8.345  -8.255
  879   1HB   LEU 107          1HB       LEU 107  -8.942  -9.432  -8.670
  880   2HB   LEU 107          2HB       LEU 107 -10.324 -10.372  -8.145
  881    HG   LEU 107           HG       LEU 107 -10.149  -8.954 -10.805
  882   1HD1  LEU 107          1HD2      LEU 107  -9.710 -11.860 -10.136
  883   2HD1  LEU 107          2HD2      LEU 107  -8.481 -10.717 -10.675
  884   3HD1  LEU 107          3HD2      LEU 107  -9.792 -11.177 -11.761
  885   1HD2  LEU 107          1HD1      LEU 107 -12.428  -9.285 -10.011
  886   2HD2  LEU 107          2HD1      LEU 107 -12.097 -10.998  -9.746
  887   3HD2  LEU 107          3HD1      LEU 107 -12.079 -10.339 -11.382
  888    H    VAL 108           H        VAL 108  -9.771  -6.217  -6.967
  889    HA   VAL 108           HA       VAL 108  -9.974  -7.397  -4.296
  890    HB   VAL 108           HB       VAL 108  -7.720  -6.487  -3.707
  891   1HG1  VAL 108          1HG2      VAL 108  -8.043  -8.863  -4.098
  892   2HG1  VAL 108          2HG2      VAL 108  -6.465  -8.350  -4.695
  893   3HG1  VAL 108          3HG2      VAL 108  -7.788  -8.630  -5.828
  894   1HG2  VAL 108          1HG1      VAL 108  -7.466  -4.903  -5.534
  895   2HG2  VAL 108          2HG1      VAL 108  -7.433  -6.227  -6.699
  896   3HG2  VAL 108          3HG1      VAL 108  -6.130  -6.053  -5.523
  897    H    VAL 109           H        VAL 109 -11.573  -5.418  -5.590
  898    HA   VAL 109           HA       VAL 109 -10.875  -3.031  -4.004
  899    HB   VAL 109           HB       VAL 109 -12.111  -1.681  -5.650
  900   1HG1  VAL 109          1HG1      VAL 109  -9.906  -3.363  -6.835
  901   2HG1  VAL 109          2HG1      VAL 109  -9.701  -1.901  -5.871
  902   3HG1  VAL 109          3HG1      VAL 109 -10.457  -1.810  -7.463
  903   1HG2  VAL 109          1HG2      VAL 109 -13.640  -3.382  -6.476
  904   2HG2  VAL 109          2HG2      VAL 109 -12.295  -4.253  -7.215
  905   3HG2  VAL 109          3HG2      VAL 109 -12.744  -2.655  -7.809
  906    H    VAL 110           H        VAL 110 -13.118  -1.606  -4.035
  907    HA   VAL 110           HA       VAL 110 -14.780  -2.936  -2.174
  908    HB   VAL 110           HB       VAL 110 -14.421  -0.488  -2.184
  909   1HG1  VAL 110          1HG1      VAL 110 -15.700   0.895  -3.760
  910   2HG1  VAL 110          2HG1      VAL 110 -16.195  -0.562  -4.617
  911   3HG1  VAL 110          3HG1      VAL 110 -14.494  -0.101  -4.573
  912   1HG2  VAL 110          1HG2      VAL 110 -16.309  -1.432  -0.971
  913   2HG2  VAL 110          2HG2      VAL 110 -17.305  -1.340  -2.424
  914   3HG2  VAL 110          3HG2      VAL 110 -16.728   0.138  -1.653
  915    H    ASN 111           H        ASN 111 -17.031  -3.428  -2.348
  916    HA   ASN 111           HA       ASN 111 -17.735  -4.933  -4.594
  917   1HB   ASN 111          2HB       ASN 111 -19.529  -3.740  -2.470
  918   2HB   ASN 111          1HB       ASN 111 -20.003  -5.002  -3.604
  919   1HD2  ASN 111          2HD2      ASN 111 -18.085  -4.221  -0.817
  920   2HD2  ASN 111          1HD2      ASN 111 -17.751  -5.848  -0.341
  921    H    GLN 112           H        GLN 112 -19.143  -4.581  -6.302
  922    HA   GLN 112           HA       GLN 112 -20.284  -1.927  -6.671
  923   1HB   GLN 112          2HB       GLN 112 -18.024  -1.757  -7.635
  924   2HB   GLN 112          1HB       GLN 112 -18.360  -3.144  -8.663
  925   1HG   GLN 112          2HG       GLN 112 -18.571  -1.103  -9.925
  926   2HG   GLN 112          1HG       GLN 112 -20.146  -1.880  -9.768
  927   1HE2  GLN 112          1HE2      GLN 112 -18.618  -0.125  -7.170
  928   2HE2  GLN 112          2HE2      GLN 112 -19.719   1.205  -7.158
  929    H    GLN 113           H        GLN 113 -22.250  -2.077  -7.535
  930    HA   GLN 113           HA       GLN 113 -23.118  -4.654  -8.590
  931   1HB   GLN 113          1HB       GLN 113 -24.667  -2.176  -7.819
  932   2HB   GLN 113          2HB       GLN 113 -25.402  -3.642  -8.452
  933   1HG   GLN 113          2HG       GLN 113 -25.648  -3.674  -6.096
  934   2HG   GLN 113          1HG       GLN 113 -24.430  -4.877  -6.518
  935   1HE2  GLN 113          2HE2      GLN 113 -23.514  -4.850  -4.478
  936   2HE2  GLN 113          1HE2      GLN 113 -22.569  -3.523  -3.904
  937    H    GLU 114           H        GLU 114 -23.603  -5.034 -10.667
  938    HA   GLU 114           HA       GLU 114 -24.118  -2.843 -12.500
  939   1HB   GLU 114          1HB       GLU 114 -21.669  -3.015 -12.525
  940   2HB   GLU 114          2HB       GLU 114 -21.787  -4.726 -12.911
  941   1HG   GLU 114          2HG       GLU 114 -21.264  -3.424 -14.885
  942   2HG   GLU 114          1HG       GLU 114 -22.848  -4.182 -15.037
  943    H    SER 115           H        SER 115 -25.791  -3.433 -13.693
  944    HA   SER 115           HA       SER 115 -27.343  -4.687 -14.783
  945   1HB   SER 115          2HB       SER 115 -24.945  -6.454 -15.333
  946   2HB   SER 115          1HB       SER 115 -26.488  -6.535 -16.182
  947    HG   SER 115           HG       SER 115 -24.625  -4.402 -16.165
  948    H    SER 116           H        SER 116 -28.458  -5.186 -12.832
  949    HA   SER 116           HA       SER 116 -28.060  -7.950 -11.892
  950   1HB   SER 116          2HB       SER 116 -27.698  -6.290 -10.126
  951   2HB   SER 116          1HB       SER 116 -29.295  -5.603 -10.428
  952    HG   SER 116           HG       SER 116 -28.826  -7.394  -8.704
  953    H    ASP 117           H        ASP 117 -29.514  -9.310 -12.678
  954    HA   ASP 117           HA       ASP 117 -32.331  -8.577 -12.666
  955   1HB   ASP 117          2HB       ASP 117 -32.671  -9.344 -14.988
  956   2HB   ASP 117          1HB       ASP 117 -31.616  -7.936 -14.912
  957    H    SER 118           H        SER 118 -29.793 -10.892 -12.630
  958    HA   SER 118           HA       SER 118 -31.448 -13.224 -12.843
  959   1HB   SER 118          2HB       SER 118 -28.615 -12.910 -11.817
  960   2HB   SER 118          1HB       SER 118 -29.410 -14.448 -12.152
  961    HG   SER 118           HG       SER 118 -28.039 -13.054 -13.834
  962    H    SER 119           H        SER 119 -31.577 -14.851 -11.085
  963    HA   SER 119           HA       SER 119 -32.353 -15.473  -9.042
  964   1HB   SER 119          2HB       SER 119 -30.051 -15.001  -8.353
  965   2HB   SER 119          1HB       SER 119 -30.462 -13.305  -8.097
  966    HG   SER 119           HG       SER 119 -30.485 -14.588  -6.162