*HEADER    CYTOKINE                                01-MAY-01   1IK0              
*TITLE     SOLUTION STRUCTURE OF HUMAN IL-13                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INTERLEUKIN-13;                                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: IL-13;                                                      
*COMPND   5 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: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PRSET                                     
*KEYWDS    LEFT-HANDED FOUR-HELIX BUNDLE                                         
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    F.J.MOY, E.DIBLASIO, J.WILHELM, R.POWERS                              
*REVDAT   1   04-MAY-04 1IK0    0                                                


!!M1
!!G2
assign (resid    2 and  name HA#  )(resid    3 and  name HD#  ) 2.5 2.7 2.2    
assign (resid    2 and  name HA#  )(resid    3 and  name HA   ) 4.0 3.2 2.0  
assign (resid    2 and  name HA#  )(resid    3 and  name HG#  ) 4.0 4.2 3.0    

!!P3
assign (resid    3 and  name HB1  )(resid    4 and  name HN   ) 4.0 2.2 1.0
assign (resid    3 and  name HB2  )(resid    4 and  name HN   ) 4.0 2.2 1.0
assign (resid    3 and  name HD#  )(resid    4 and  name HN   ) 4.0 3.2 2.0  
assign (resid    3 and  name HB#  )(resid    4 and  name HA   ) 4.0 3.2 2.0  
!!V4
assign (resid    4 and  name HA   )(resid    4 and  name HG*  ) 3.0 1.8 0.9  
assign (resid    4 and  name HN   )(resid    4 and  name HG*  ) 3.0 2.9 2.2  
assign (resid    4 and  name HN   )(resid    4 and  name HB   ) 3.0 1.2 0.5
assign (resid    4 and  name HG*  )(resid    8 and  name HN   ) 4.0 4.6 3.4  
assign (resid    4 and  name HG*  )(resid    9 and  name HN   ) 4.0 4.6 3.4  
assign (resid    4 and  name HA   )(resid    5 and  name HD1  ) 3.0 2.2 1.3  
assign (resid    4 and  name HA   )(resid    5 and  name HD2  ) 3.0 2.2 1.3  
assign (resid    4 and  name HG*  )(resid    5 and  name HD1  ) 4.0 5.6 4.4    
assign (resid    4 and  name HG*  )(resid    5 and  name HD2  ) 4.0 5.6 4.4    
assign (resid    4 and  name HG*  )(resid    8 and  name HB   ) 4.0 4.6 3.4  
!assign (resid 4 and name HG*) (resid 8 and name HA) 4.0 2.2 1.0
assign (resid    4 and  name HG*  )(resid    6 and  name HA   ) 4.0 4.6 3.4  
assign (resid    4 and  name HG*  )(resid    5 and  name HA   ) 4.0 4.6 3.4  
assign (resid    4 and  name HB   )(resid    5 and  name HD#  ) 4.0 3.2 2.0  
assign (resid    4 and  name HA   )(resid    8 and  name HG2# ) 4.0 3.7 2.5  
assign (resid    4 and  name HG*  )(resid    6 and  name HD#  ) 4.0 5.6 4.4    
assign (resid    4 and  name HB   )(resid    9 and  name HB#  ) 4.0 3.7 2.5  
assign (resid    4 and  name HB   )(resid    8 and  name HB   ) 4.0 2.2 1.0
assign (resid    4 and  name HB   )(resid    9 and  name HN   ) 4.0 2.2 1.0
assign (resid    4 and  name HA   )(resid    5 and  name HG#  ) 4.0 3.2 2.0  
!!P5
assign (resid    5 and  name HD#  )(resid    8 and  name HG2# ) 4.0 4.7 3.5    
!assign (resid 5 and name HA) (resid 6 and name HB#) 3.0 1.2 0.3
assign (resid    5 and  name HA   )(resid    6 and  name HD1  ) 3.0 2.2 1.3  
assign (resid    5 and  name HA   )(resid    6 and  name HD2  ) 3.0 2.2 1.3  
assign (resid    5 and  name HD#  )(resid    8 and  name HB   ) 4.0 3.2 2.0  
assign (resid    5 and  name HA   )(resid    6 and  name HA   ) 4.0 2.2 1.0
assign (resid    5 and  name HA   )(resid    9 and  name HB#  ) 4.0 3.7 2.5  
assign (resid    5 and  name HA   )(resid    6 and  name HB#  ) 4.0 3.2 2.0  
assign (resid    5 and  name HB#  )(resid    6 and  name HA   ) 4.0 3.2 2.0  
assign (resid    5 and  name HB#  )(resid    8 and  name HB   ) 4.0 3.2 2.0  
assign (resid    5 and  name HB#  )(resid    6 and  name HD#  ) 4.0 4.2 3.0    
assign (resid    5 and  name HG#  )(resid    8 and  name HB   ) 4.0 3.2 2.0  
!!P6
assign (resid    6 and  name HB1  )(resid    7 and  name HN   ) 4.0 2.2 1.0
assign (resid    6 and  name HB2  )(resid    7 and  name HN   ) 3.0 1.2 0.5
!assign (resid 6 and name HB1) (resid 8 and name HN) 4.0 2.2 1.0
assign (resid    6 and  name HB2  )(resid    8 and  name HN   ) 4.0 2.2 1.0
assign (resid    6 and  name HG#  )(resid    7 and  name HN   ) 4.0 3.2 2.0  
assign (resid    6 and  name HG#  )(resid    8 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 6 and name HG#) (resid 9 and name HN) 4.0 2.2 1.0
assign (resid    6 and  name HB#  )(resid    9 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 6 and name HB2) (resid 9 and name HN) 4.0 2.2 1.0
!assign (resid 6 and name HD#) (resid 73 and name HE1) 4.0 2.2 1.0
assign (resid    6 and  name HD#  )(resid    8 and  name HB   ) 4.0 3.2 2.0  
!assign (resid 6 and name HG#) (resid 8 and name HB) 4.0 2.2 1.0
!assign (resid 6 and name HB#) (resid 8 and name HB) 4.0 2.2 1.0
assign (resid    6 and  name HA   )(resid    9 and  name HB#  ) 4.0 3.7 2.5  
!assign (resid 6 and name HA) (resid 73 and name HE1) 4.0 2.2 1.0
!assign (resid 6 and name HD#) (resid 70 and name HZ) 4.0 2.2 1.0
assign (resid    6 and  name HB#  )(resid    9 and  name HB#  ) 4.0 4.7 3.5    
assign (resid    6 and  name HD#  )(resid    9 and  name HB#  ) 4.0 4.7 3.5    
assign (resid    6 and  name HB#  )(resid  112 and  name HD2  ) 4.0 3.2 2.0  
assign (resid    6 and  name HB#  )(resid    7 and  name HB1  ) 4.0 3.2 2.0  
assign (resid    6 and  name HB#  )(resid  112 and  name HB2  ) 4.0 3.2 2.0  
assign (resid    6 and  name HA   )(resid  112 and  name HB2  ) 4.0 2.2 1.0
assign (resid    6 and  name HG#  )(resid  112 and  name HE2  ) 4.0 3.2 2.0  
assign (resid    6 and  name HG#  )(resid  112 and  name HD2  ) 4.0 3.2 2.0  
assign (resid    6 and  name HA   )(resid    7 and  name HA   ) 4.0 2.2 1.0
assign (resid    6 and  name HG#  )(resid    7 and  name HB1  ) 4.0 3.2 2.0  
assign (resid    6 and  name HB#  )(resid    7 and  name HA   ) 4.0 3.2 2.0  
!!S7
assign (resid    7 and  name HB1  )(resid    7 and  name HN   ) 3.0 1.2 0.5
assign (resid    7 and  name HB2  )(resid    7 and  name HN   ) 4.0 2.2 1.0
assign (resid    7 and  name HB1  )(resid    8 and  name HN   ) 4.0 2.2 1.0
assign (resid    7 and  name HB2  )(resid    8 and  name HN   ) 4.0 2.2 1.0
assign (resid    7 and  name HB#  )(resid    9 and  name HN   ) 4.0 3.2 2.0  
assign (resid    7 and  name HB1  )(resid  112 and  name HZ   ) 4.0 2.2 1.0
assign (resid    7 and  name HB2  )(resid  112 and  name HZ   ) 4.0 2.2 1.0
assign (resid    7 and  name HA   )(resid  112 and  name HZ   ) 4.0 2.2 1.0
assign (resid    7 and  name HA   )(resid  112 and  name HD2  ) 4.0 2.2 1.0
!assign (resid 7 and name HB2) (resid 80 and name HZ) 4.0 2.2 1.0
!assign (resid 7 and name HA) (resid 70 and name HZ) 4.0 2.2 1.0
!assign (resid 7 and name HB2) (resid 70 and name HZ) 4.0 2.2 1.0
assign (resid    7 and  name HB1  )(resid  112 and  name HD2  ) 4.0 2.2 1.0
!assign (resid 7 and name HB2) (resid 112 and name HD2) 4.0 2.2 1.0
assign (resid    7 and  name HB2  )(resid   10 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 7 and name HB2) (resid 10 and name HB2) 4.0 2.2 1.0
!assign (resid 7 and name HB1) (resid 10 and name HD1#) 4.0 2.2 1.0
!assign (resid 7 and name HB1) (resid 10 and name HD2#) 4.0 2.2 1.0
assign (resid    7 and  name HA   )(resid  112 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 7 and name HA) (resid 112 and name HB2) 4.0 2.2 1.0
!assign (resid 7 and name HA) (resid 10 and name HA) 4.0 2.2 1.0
assign (resid    7 and  name HA   )(resid   10 and  name HD*  ) 4.0 4.6 3.4  
!assign (resid 7 and name HB1) (resid 70 and name HZ) 4.0 2.2 1.0
!assign (resid 7 and name HB1) (resid 107 and name HE1) 4.0 2.2 1.0
assign (resid    7 and  name HB2  )(resid  107 and  name HE1  ) 4.0 2.2 1.0
assign (resid    7 and  name HB2  )(resid  107 and  name HZ   ) 4.0 2.2 1.0
assign (resid    7 and  name HA   )(resid  107 and  name HE1  ) 4.0 2.2 1.0
assign (resid    7 and  name HA   )(resid    9 and  name HB#  ) 4.0 3.7 2.5  
!!T8
assign (resid    8 and  name HG2# )(resid    8 and  name HA   ) 2.5 1.8 1.3  
assign (resid    8 and  name HG2# )(resid    8 and  name HN   ) 3.0 2.7 2.0  
assign (resid    8 and  name HB   )(resid    8 and  name HN   ) 3.0 1.2 0.5
assign (resid    8 and  name HN   )(resid    9 and  name HB#  ) 4.0 3.7 2.5  
assign (resid    8 and  name HG2# )(resid    9 and  name HN   ) 4.0 3.7 2.5  
assign (resid    8 and  name HG2# )(resid   12 and  name HN   ) 4.0 3.7 2.5  
assign (resid    8 and  name HB   )(resid   12 and  name HG#  ) 4.0 3.2 2.0  
assign (resid    8 and  name HB   )(resid    9 and  name HB#  ) 4.0 3.7 2.5  
assign (resid    8 and  name HA   )(resid   11 and  name HD#  ) 4.0 3.2 2.0  
assign (resid    8 and  name HA   )(resid   11 and  name HG#  ) 4.0 3.2 2.0  
assign (resid    8 and  name HA   )(resid   12 and  name HG#  ) 4.0 3.2 2.0  
assign (resid    8 and  name HA   )(resid    9 and  name HB#  ) 4.0 3.7 2.5  
assign (resid    8 and  name HG2# )(resid   12 and  name HG#  ) 4.0 4.7 3.5    
!assign (resid 8 and name HB) (resid 12 and name HB2) 4.0 2.2 1.0
assign (resid    8 and  name HG2# )(resid   12 and  name HB2  ) 4.0 3.7 2.5  
assign (resid    8 and  name HG2# )(resid   11 and  name HB2  ) 4.0 3.7 2.5  
!!A9
assign (resid    9 and  name HB#  )(resid    9 and  name HN   ) 2.5 1.8 1.5  
assign (resid    9 and  name HB#  )(resid   10 and  name HN   ) 3.0 2.7 2.0  
assign (resid    9 and  name HB#  )(resid   12 and  name HN   ) 4.0 3.7 2.5  
assign (resid    9 and  name HB#  )(resid   13 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 9 and name HB#) (resid 107 and name HE#) 4.0 2.2 1.0
!assign (resid 9 and name HA) (resid 107 and name HZ) 4.0 2.2 1.0
!assign (resid 9 and name HB#) (resid 107 and name HZ) 4.0 2.2 1.0
assign (resid    9 and  name HB#  )(resid   70 and  name HZ   ) 3.0 2.7 1.8  
assign (resid    9 and  name HB#  )(resid   10 and  name HA   ) 4.0 3.7 2.5  
!assign (resid 9 and name HA) (resid 107 and name HE#) 4.0 2.2 1.0
assign (resid    9 and  name HA   )(resid   12 and  name HG#  ) 4.0 3.2 2.0  
assign (resid    9 and  name HA   )(resid   70 and  name HZ   ) 4.0 2.2 1.0
assign (resid    9 and  name HB#  )(resid   12 and  name HB2  ) 4.0 3.7 2.5  
assign (resid    9 and  name HB#  )(resid   70 and  name HD1  ) 4.0 3.7 2.5  
assign (resid    9 and  name HB#  )(resid   70 and  name HD2  ) 4.0 3.7 2.5  
assign (resid    9 and  name HN   )(resid   12 and  name HB2  ) 4.0 2.2 1.0
assign (resid    9 and  name HA   )(resid   13 and  name HB2  ) 4.0 2.2 1.0
!!L10
assign (resid   10 and  name HD1# )(resid   10 and  name HB1  ) 3.0 2.7 1.8  
assign (resid   10 and  name HD1# )(resid   10 and  name HB2  ) 3.0 2.7 1.8  
assign (resid   10 and  name HD2# )(resid   10 and  name HB1  ) 3.0 2.7 1.8  
assign (resid   10 and  name HD2# )(resid   10 and  name HB2  ) 3.0 2.7 1.8  
assign (resid   10 and  name HD*  )(resid   10 and  name HA   ) 3.0 2.9 2.0  
assign (resid   10 and  name HD*  )(resid   10 and  name HN   ) 4.0 3.9 2.7  
assign (resid   10 and  name HB1  )(resid   10 and  name HN   ) 2.5 0.7 0.4
assign (resid   10 and  name HB2  )(resid   10 and  name HN   ) 2.5 0.7 0.4
assign (resid   10 and  name HN   )(resid   70 and  name HZ   ) 3.0 1.2 0.5
assign (resid   10 and  name HN   )(resid   70 and  name HE1  ) 4.0 2.2 1.0
!assign (resid 10 and name HN) (resid 107 and name HZ) 4.0 2.2 1.0
!assign (resid 10 and name HN) (resid 107 and name HE#) 4.0 2.2 1.0
assign (resid   10 and  name HD*  )(resid   11 and  name HN   ) 4.0 4.6 3.4  
assign (resid   10 and  name HB#  )(resid   11 and  name HN   ) 3.0 2.2 1.5  
assign (resid   10 and  name HD*  )(resid  106 and  name HN   ) 4.0 4.6 3.4  
assign (resid   10 and  name HD*  )(resid  107 and  name HN   ) 4.0 4.6 3.4  
!assign (resid 10 and name HD*) (resid 111 and name HN) 4.0 2.2 1.0
!assign (resid 10 and name HD*) (resid 112 and name HN) 4.0 2.2 1.0
assign (resid   10 and  name HB1  )(resid  107 and  name HE1  ) 4.0 2.2 1.0
!assign (resid 10 and name HB2) (resid 107 and name HE1) 4.0 2.2 1.0
!assign (resid 10 and name HD*) (resid 107 and name HE#) 4.0 2.2 1.0
!assign (resid 10 and name HD1#) (resid 112 and name HZ) 4.0 2.2 1.0
assign (resid   10 and  name HD*  )(resid  112 and  name HZ   ) 4.0 4.6 3.4  
assign (resid   10 and  name HD*  )(resid  112 and  name HD1  ) 4.0 4.6 3.4  
!assign (resid 10 and name HD1#) (resid 112 and name HE#) 4.0 2.2 1.0
assign (resid   10 and  name HD*  )(resid  112 and  name HE1  ) 4.0 4.6 3.4  
!assign (resid 10 and name HB1) (resid 112 and name HD2) 4.0 2.2 1.0
!assign (resid 10 and name HB2) (resid 112 and name HD2) 4.0 2.2 1.0
assign (resid   10 and  name HG   )(resid  112 and  name HE1  ) 4.0 2.2 1.0
!assign (resid 10 and name HB1) (resid 112 and name HE2) 4.0 2.2 1.0
!assign (resid 10 and name HB2) (resid 112 and name HE2) 4.0 2.2 1.0
assign (resid   10 and  name HB1  )(resid   70 and  name HZ   ) 4.0 2.2 1.0
assign (resid   10 and  name HB2  )(resid   70 and  name HZ   ) 4.0 2.2 1.0
!assign (resid 10 and name HB1) (resid 107 and name HZ) 4.0 2.2 1.0
!assign (resid 10 and name HB2) (resid 107 and name HZ) 4.0 2.2 1.0
assign (resid   10 and  name HB1  )(resid  112 and  name HZ   ) 4.0 2.2 1.0
!assign (resid 10 and name HD*) (resid 70 and name HZ) 4.0 2.2 1.0
!assign (resid 10 and name HA) (resid 107 and name HZ) 3.0 1.2 0.3
!assign (resid 10 and name HG) (resid 107 and name HZ) 4.0 2.2 1.0
assign (resid   10 and  name HD*  )(resid   44 and  name HE1  ) 3.0 3.6 2.7  
!assign (resid 10 and name HD2#) (resid 44 and name HE1) 4.0 2.2 1.0
assign (resid   10 and  name HD*  )(resid  107 and  name HA   ) 3.0 3.6 2.7  
assign (resid   10 and  name HD*  )(resid   11 and  name HA   ) 4.0 4.6 3.4  
assign (resid   10 and  name HA   )(resid   14 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   10 and  name HA   )(resid   13 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   10 and  name HA   )(resid   70 and  name HE1  ) 4.0 2.2 1.0
assign (resid   10 and  name HA   )(resid   70 and  name HE2  ) 4.0 2.2 1.0
!assign (resid 10 and name HA) (resid 107 and name HE#) 4.0 2.2 1.0
assign (resid   10 and  name HD*  )(resid  103 and  name HA   ) 4.0 4.6 3.4  
assign (resid   10 and  name HD*  )(resid   14 and  name HG1# ) 4.0 5.6 4.4    
assign (resid   10 and  name HG   )(resid  107 and  name HD1  ) 4.0 2.2 1.0
!assign (resid 10 and name HA) (resid 17 and name HD*) 4.0 2.2 1.0
!assign (resid 10 and name HG) (resid 107 and name HB2) 4.0 2.2 1.0
assign (resid   10 and  name HG   )(resid   14 and  name HD1# ) 3.0 2.7 1.8  
assign (resid   10 and  name HD*  )(resid  103 and  name HD2# ) 3.0 5.1 4.2    
assign (resid   10 and  name HD*  )(resid   70 and  name HZ   ) 3.0 3.6 2.7  
!assign (resid 10 and name HD*) (resid 107 and name HZ) 4.0 2.2 1.0
!assign (resid 10 and name HD1#) (resid 107 and name HB1) 4.0 2.2 1.0
assign (resid   10 and  name HD*  )(resid  107 and  name HB1  ) 4.0 4.6 3.4  
assign (resid   10 and  name HD*  )(resid  107 and  name HB2  ) 4.0 4.6 3.4  
assign (resid   10 and  name HD*  )(resid  112 and  name HB1  ) 4.0 4.6 3.4  
!assign (resid 10 and name HD*) (resid 112 and name HB2) 4.0 2.2 1.0
!assign (resid 10 and name HA) (resid 107 and name HZ) 3.0 1.2 0.3
assign (resid   10 and  name HA   )(resid   70 and  name HZ   ) 3.0 1.2 0.3
!assign (resid 10 and name HD*) (resid 113 and name HA) 4.0 2.2 1.0
assign (resid   10 and  name HD*  )(resid   70 and  name HE1  ) 4.0 4.6 3.4  
!assign (resid 10 and name HD1#) (resid 107 and name HE#) 4.0 2.2 1.0
assign (resid   10 and  name HD*  )(resid  103 and  name HG   ) 4.0 4.6 3.4  
assign (resid   10 and  name HD1# )(resid   14 and  name HD1# ) 4.0 5.2 4.0    
assign (resid   10 and  name HD2# )(resid   14 and  name HD1# ) 4.0 5.2 4.0    
!assign (resid 10 and name HD*) (resid 106 and name HD*) 4.0 2.2 1.0
assign (resid   10 and  name HD*  )(resid  112 and  name HA   ) 4.0 4.6 3.4  
assign (resid   10 and  name HD*  )(resid   13 and  name HB1  ) 4.0 4.6 3.4  
assign (resid   10 and  name HD*  )(resid  106 and  name HG   ) 4.0 4.6 3.4  
assign (resid   10 and  name HD*  )(resid   13 and  name HD2# ) 4.0 6.1 4.9    
assign (resid   10 and  name HD*  )(resid  106 and  name HB1  ) 4.0 4.6 3.4  
!assign (resid 10 and name HG) (resid 107 and name HB1) 4.0 2.2 1.0
assign (resid   10 and  name HB1  )(resid   14 and  name HD1# ) 4.0 3.7 2.5  
!assign (resid 10 and name HB1) (resid 107 and name HA) 4.0 2.2 1.0
assign (resid   10 and  name HD*  )(resid  103 and  name HB1  ) 4.0 4.6 3.4  
assign (resid   10 and  name HA   )(resid  103 and  name HD2# ) 4.0 3.7 2.5  
!assign (resid 10 and name HD2#) (resid 108 and name HN) 4.0 2.2 1.0
assign (resid   10 and  name HB1  )(resid  107 and  name HD1  ) 4.0 2.2 1.0
!assign (resid 10 and name HB2) (resid 107 and name HD1) 4.0 2.2 1.0
!!R11
assign (resid   11 and  name HB#  )(resid   11 and  name HN   ) 2.5 1.3 1.0  
assign (resid   11 and  name HG#  )(resid   11 and  name HN   ) 3.0 2.2 1.5  
assign (resid   11 and  name HD#  )(resid   11 and  name HN   ) 4.0 3.2 2.0  
assign (resid   11 and  name HG#  )(resid   11 and  name HA   ) 3.0 1.8 0.9  
assign (resid   11 and  name HD#  )(resid   11 and  name HA   ) 4.0 3.2 2.0  
assign (resid   11 and  name HD#  )(resid   11 and  name HB1  ) 4.0 3.2 2.0  
assign (resid   11 and  name HD#  )(resid   11 and  name HB2  ) 4.0 3.2 2.0  
assign (resid   11 and  name HN   )(resid  107 and  name HE1  ) 5.0 2.0 1.0
assign (resid   11 and  name HN   )(resid  107 and  name HD1  ) 4.0 2.2 1.0
assign (resid   11 and  name HG#  )(resid   12 and  name HN   ) 4.0 3.2 2.0  
assign (resid   11 and  name HD#  )(resid   12 and  name HN   ) 4.0 3.2 2.0  
assign (resid   11 and  name HA   )(resid   12 and  name HA   ) 4.0 2.2 1.0
!assign (resid 11 and name HA) (resid 13 and name HB1) 4.0 2.2 1.0
assign (resid   11 and  name HA   )(resid   14 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   11 and  name HA   )(resid   14 and  name HG2# ) 4.0 3.7 2.5  
!assign (resid 11 and name HD#) (resid 70 and name HZ) 4.0 2.2 1.0
!assign (resid 11 and name HB1) (resid 70 and name HZ) 4.0 2.2 1.0
!assign (resid 11 and name HB2) (resid 70 and name HZ) 4.0 2.2 1.0
!assign (resid 11 and name HG#) (resid 70 and name HZ) 4.0 2.2 1.0
assign (resid   11 and  name HD#  )(resid  107 and  name HZ   ) 4.0 3.2 2.0  
assign (resid   11 and  name HG#  )(resid  107 and  name HZ   ) 4.0 3.2 2.0  
!assign (resid 11 and name HB2) (resid 107 and name HZ) 5.0 2.0 1.0
!assign (resid 11 and name HB1) (resid 107 and name HZ) 5.0 2.0 1.0
!assign (resid 11 and name HD#) (resid 14 and name HG2#) 4.0 2.2 1.0
assign (resid   11 and  name HA   )(resid   15 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 11 and name HG#) (resid 15 and name HN) 4.0 2.2 1.0
!assign (resid 11 and name HN) (resid 112 and name HZ) 4.0 2.2 1.0
!assign (resid 11 and name HN) (resid 112 and name HE2) 4.0 2.2 1.0
!assign (resid 11 and name HB1) (resid 112 and name HE2) 4.0 2.2 1.0
!! E12
assign (resid   12 and  name HB1  )(resid   12 and  name HN   ) 4.0 2.2 1.0
assign (resid   12 and  name HA   )(resid   12 and  name HG#  ) 3.0 1.8 0.9  
assign (resid   12 and  name HB2  )(resid   12 and  name HN   ) 3.0 1.2 0.5
assign (resid   12 and  name HG#  )(resid   12 and  name HN   ) 4.0 3.2 2.0  
assign (resid   12 and  name HA   )(resid   15 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   12 and  name HN   )(resid   13 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   12 and  name HN   )(resid   13 and  name HA   ) 5.0 2.0 1.0
assign (resid   12 and  name HB#  )(resid   13 and  name HN   ) 3.0 2.2 1.5  
assign (resid   12 and  name HG#  )(resid   13 and  name HN   ) 4.0 3.2 2.0  
assign (resid   12 and  name HB2  )(resid   13 and  name HA   ) 4.0 2.2 1.0
!assign (resid 12 and name HA) (resid 107 and name HZ) 4.0 2.2 1.0
!!L13
assign (resid   13 and  name HB1  )(resid   13 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   13 and  name HB2  )(resid   13 and  name HD2# ) 3.0 2.7 1.8  
assign (resid   13 and  name HA   )(resid   13 and  name HD2# ) 3.0 2.7 1.8  
assign (resid   13 and  name HA   )(resid   13 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   13 and  name HB1  )(resid   13 and  name HN   ) 2.5 0.7 0.4
assign (resid   13 and  name HB2  )(resid   13 and  name HN   ) 2.5 0.7 0.4
assign (resid   13 and  name HD1# )(resid   13 and  name HN   ) 4.0 3.7 2.5  
assign (resid   13 and  name HD2# )(resid   13 and  name HN   ) 4.0 3.7 2.5  
assign (resid   13 and  name HG   )(resid   13 and  name HN   ) 4.0 2.2 1.0
assign (resid   13 and  name HA   )(resid   13 and  name HG   ) 4.0 2.2 1.0
!assign (resid 13 and name HN) (resid 70 and name HZ) 4.0 2.2 1.0
!assign (resid 13 and name HN) (resid 107 and name HZ) 4.0 2.2 1.0
!assign (resid 13 and name HN) (resid 107 and name HD#) 4.0 2.2 1.0
assign (resid   13 and  name HG   )(resid   14 and  name HN   ) 4.0 2.2 1.0
assign (resid   13 and  name HB#  )(resid   14 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 13 and name HD2#) (resid 15 and name HN) 5.0 2.0 1.0
!assign (resid 13 and name HG) (resid 15 and name HN) 5.0 2.0 1.0
assign (resid   13 and  name HB#  )(resid   15 and  name HN   ) 4.0 3.2 2.0  
assign (resid   13 and  name HB#  )(resid   16 and  name HN   ) 4.0 3.2 2.0  
assign (resid   13 and  name HG   )(resid   16 and  name HN   ) 5.0 2.0 1.0
!assign (resid 13 and name HD2#) (resid 16 and name HN) 4.0 2.2 1.0
!assign (resid 13 and name HD*) (resid 44 and name HN) 4.0 2.2 1.0
!assign (resid 13 and name HD*) (resid 45 and name HN) 4.0 2.2 1.0
!assign (resid 13 and name HB1) (resid 107 and name HE#) 4.0 2.2 1.0
!assign (resid 13 and name HB2) (resid 107 and name HE#) 4.0 2.2 1.0
!assign (resid 13 and name HD*) (resid 107 and name HE#) 4.0 2.2 1.0
!assign (resid 13 and name HA) (resid 107 and name HE#) 4.0 2.2 1.0
assign (resid   13 and  name HB1  )(resid   70 and  name HZ   ) 4.0 2.2 1.0
assign (resid   13 and  name HB2  )(resid   70 and  name HZ   ) 4.0 2.2 1.0
!assign (resid 13 and name HB1) (resid 107 and name HZ) 4.0 2.2 1.0
!assign (resid 13 and name HB2) (resid 107 and name HZ) 4.0 2.2 1.0
assign (resid   13 and  name HG   )(resid   14 and  name HA   ) 4.0 2.2 1.0
assign (resid   13 and  name HA   )(resid   66 and  name HE#  ) 3.0 2.7 1.8  
assign (resid   13 and  name HD2# )(resid   66 and  name HE#  ) 3.0 4.2 3.3    
assign (resid   13 and  name HD1# )(resid   66 and  name HE#  ) 4.0 5.2 4.0    
!assign (resid 13 and name HA) (resid 15 and name HG#) 4.0 2.2 1.0
!assign (resid 13 and name HG) (resid 70 and name HZ) 4.0 2.2 1.0
!assign (resid 13 and name HA) (resid 17 and name HD*) 4.0 2.2 1.0
!assign (resid 13 and name HD1#) (resid 70 and name HE2) 4.0 2.2 1.0
assign (resid   13 and  name HD2# )(resid   70 and  name HE2  ) 4.0 3.7 2.5  
assign (resid   13 and  name HB2  )(resid   70 and  name HE2  ) 4.0 2.2 1.0
!assign (resid 13 and name HB2) (resid 17 and name HD*) 4.0 2.2 1.0
assign (resid   13 and  name HB1  )(resid   14 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   13 and  name HD2# )(resid   66 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   13 and  name HD2# )(resid   66 and  name HA   ) 4.0 3.7 2.5  
assign (resid   13 and  name HA   )(resid   16 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   13 and  name HG   )(resid   17 and  name HN   ) 4.0 2.2 1.0
assign (resid   13 and  name HD2# )(resid   44 and  name HD1  ) 4.0 3.7 2.5  
assign (resid   13 and  name HD2# )(resid   44 and  name HE1  ) 4.0 3.7 2.5  
assign (resid   13 and  name HD2# )(resid   70 and  name HD2  ) 4.0 3.7 2.5  
assign (resid   13 and  name HD1# )(resid   63 and  name HB   ) 4.0 3.7 2.5  
assign (resid   13 and  name HD2# )(resid   17 and  name HG   ) 4.0 3.7 2.5  
assign (resid   13 and  name HG   )(resid   17 and  name HG   ) 4.0 2.2 1.0
assign (resid   13 and  name HB1  )(resid  103 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   13 and  name HD2# )(resid   67 and  name HG   ) 4.0 3.7 2.5  
assign (resid   13 and  name HD2# )(resid   63 and  name HA   ) 4.0 3.7 2.5  
assign (resid   13 and  name HD1# )(resid   63 and  name HG2# ) 4.0 5.2 4.0    
!!I14
assign (resid   14 and  name HA   )(resid   14 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   14 and  name HA   )(resid   14 and  name HG2# ) 3.0 2.3 1.4  
assign (resid   14 and  name HA   )(resid   14 and  name HG1# ) 3.0 1.8 0.9  
assign (resid   14 and  name HG2# )(resid   14 and  name HN   ) 3.0 2.7 2.0  
assign (resid   14 and  name HB   )(resid   14 and  name HN   ) 3.0 1.2 0.5
assign (resid   14 and  name HD1# )(resid   14 and  name HN   ) 4.0 3.7 2.5  
assign (resid   14 and  name HG1# )(resid   14 and  name HN   ) 2.5 1.7 1.4  
assign (resid   14 and  name HG1# )(resid   15 and  name HN   ) 4.0 3.2 2.0  
assign (resid   14 and  name HG2# )(resid   15 and  name HN   ) 4.0 3.7 2.5  
assign (resid   14 and  name HD1# )(resid   15 and  name HN   ) 4.0 3.7 2.5  
assign (resid   14 and  name HG2# )(resid   16 and  name HN   ) 4.0 3.7 2.5  
assign (resid   14 and  name HG2# )(resid   17 and  name HN   ) 4.0 3.7 2.5  
assign (resid   14 and  name HD1# )(resid  103 and  name HN   ) 4.0 3.7 2.5  
assign (resid   14 and  name HD1# )(resid  104 and  name HN   ) 4.0 3.7 2.5  
assign (resid   14 and  name HD1# )(resid  107 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 14 and name HD1#) (resid 108 and name HN) 5.0 2.0 1.0
!assign (resid 14 and name HD1#) (resid 112 and name HE#) 4.0 2.2 1.0
!assign (resid 14 and name HA) (resid 16 and name HB1) 4.0 2.2 1.0
assign (resid   14 and  name HD1# )(resid  107 and  name HA   ) 4.0 3.7 2.5  
assign (resid   14 and  name HD1# )(resid  104 and  name HA   ) 3.0 2.7 1.8  
assign (resid   14 and  name HG1# )(resid  104 and  name HA   ) 4.0 3.2 2.0  
assign (resid   14 and  name HA   )(resid   15 and  name HA   ) 4.0 2.2 1.0
assign (resid   14 and  name HG2# )(resid   15 and  name HA   ) 4.0 3.7 2.5  
assign (resid   14 and  name HB   )(resid   15 and  name HA   ) 4.0 2.2 1.0
assign (resid   14 and  name HD1# )(resid  103 and  name HA   ) 4.0 3.7 2.5  
assign (resid   14 and  name HG1# )(resid  104 and  name HB1  ) 4.0 3.2 2.0  
assign (resid   14 and  name HG1# )(resid  103 and  name HB1  ) 4.0 3.2 2.0  
assign (resid   14 and  name HG1# )(resid  100 and  name HD1# ) 3.0 3.7 2.8    
assign (resid   14 and  name HG1# )(resid  100 and  name HD2# ) 4.0 4.7 3.5    
assign (resid   14 and  name HD1# )(resid  104 and  name HD#  ) 4.0 4.7 3.5    
assign (resid   14 and  name HA   )(resid  103 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   14 and  name HA   )(resid  103 and  name HD2# ) 4.0 3.7 2.5  
!assign (resid 14 and name HA) (resid 107 and name HZ) 4.0 2.2 1.0
!assign (resid 14 and name HA) (resid 107 and name HE#) 4.0 2.2 1.0
assign (resid   14 and  name HA   )(resid  100 and  name HD1# ) 3.0 2.7 1.8  
assign (resid   14 and  name HD1# )(resid  100 and  name HD1# ) 3.0 4.2 3.3    
assign (resid   14 and  name HG1# )(resid  103 and  name HD2# ) 4.0 4.7 3.5    
assign (resid   14 and  name HA   )(resid   17 and  name HB2  ) 4.0 2.2 1.0
assign (resid   14 and  name HD1# )(resid  103 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   14 and  name HD1# )(resid  103 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   14 and  name HD1# )(resid  107 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   14 and  name HD1# )(resid  107 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   14 and  name HG2# )(resid  104 and  name HA   ) 4.0 3.7 2.5  
assign (resid   14 and  name HG2# )(resid  104 and  name HE#  ) 4.0 4.7 3.5    
assign (resid   14 and  name HG2# )(resid  104 and  name HD#  ) 4.0 4.7 3.5    
assign (resid   14 and  name HG2# )(resid   15 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   14 and  name HG2# )(resid   15 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   14 and  name HG2# )(resid   18 and  name HB   ) 4.0 3.7 2.5  
assign (resid   14 and  name HG2# )(resid  103 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   14 and  name HG2# )(resid   18 and  name HG2# ) 3.0 4.2 3.3    
assign (resid   14 and  name HG2# )(resid  100 and  name HD1# ) 3.0 4.2 3.3    
assign (resid   14 and  name HG2# )(resid  100 and  name HD2# ) 4.0 5.2 4.0    
assign (resid   14 and  name HB   )(resid   15 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 14 and name HD1#) (resid 107 and name HD#) 4.0 2.2 1.0
!assign (resid 14 and name HD1#) (resid 112 and name HE#) 4.0 2.2 1.0
!assign (resid 14 and name HD1#) (resid 112 and name HZ) 4.0 2.2 1.0
assign (resid   14 and  name HA   )(resid   17 and  name HG   ) 4.0 2.2 1.0
assign (resid   14 and  name HG1# )(resid  107 and  name HB2  ) 4.0 3.2 2.0  
!assign (resid 14 and name HG1#) (resid 107 and name HB1) 4.0 2.2 1.0
assign (resid   14 and  name HD1# )(resid  107 and  name HD1  ) 4.0 3.7 2.5  
assign (resid   14 and  name HD1# )(resid  104 and  name HE#  ) 4.0 4.7 3.5    
!! E15
assign (resid   15 and  name HG#  )(resid   15 and  name HA   ) 3.0 1.8 0.9  
assign (resid   15 and  name HB#  )(resid   15 and  name HN   ) 2.5 1.3 1.0  
assign (resid   15 and  name HN   )(resid   15 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   15 and  name HN   )(resid   18 and  name HN   ) 4.0 2.2 1.0
assign (resid   15 and  name HG#  )(resid   16 and  name HN   ) 4.0 3.2 2.0  
assign (resid   15 and  name HA   )(resid   18 and  name HG1# ) 4.0 3.7 2.5  
assign (resid   15 and  name HA   )(resid   18 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   15 and  name HB#  )(resid   16 and  name HA   ) 4.0 3.2 2.0  
!assign (resid 15 and name HN) (resid 100 and name HD1#) 4.0 2.2 1.0
assign (resid   15 and  name HN   )(resid   18 and  name HG2# ) 4.0 3.7 2.5  
!! E16
assign (resid   16 and  name HN   )(resid   16 and  name HB#  ) 2.5 1.3 1.0  
assign (resid   16 and  name HN   )(resid   16 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   16 and  name HA   )(resid   16 and  name HG#  ) 4.0 2.8 1.6  
assign (resid   16 and  name HN   )(resid   19 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   16 and  name HB#  )(resid   17 and  name HN   ) 4.0 3.2 2.0  
assign (resid   16 and  name HB#  )(resid   19 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 16 and name HA) (resid 66 and name HE#) 4.0 2.2 1.0
assign (resid   16 and  name HA   )(resid   20 and  name HG2# ) 4.0 3.7 2.5  
!assign (resid 16 and name HA) (resid 18 and name HB) 4.0 2.2 1.0
assign (resid   16 and  name HB1  )(resid   19 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   16 and  name HB2  )(resid   19 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 16 and name HG#) (resid 17 and name HG) 4.0 2.2 1.0
assign (resid   16 and  name HN   )(resid   18 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   16 and  name HG#  )(resid   62 and  name HD#  ) 4.0 4.2 3.0    
!!L17
assign (resid   17 and  name HA   )(resid   17 and  name HG   ) 4.0 2.2 1.0
assign (resid   17 and  name HN   )(resid   17 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   17 and  name HN   )(resid   17 and  name HD2# ) 4.0 3.7 2.5  
!assign (resid 17 and name HA) (resid 17 and name HD1#) 4.0 2.2 1.0
assign (resid   17 and  name HN   )(resid   17 and  name HG   ) 2.5 0.7 0.4
assign (resid   17 and  name HN   )(resid   17 and  name HB2  ) 3.0 1.0 0.5
assign (resid   17 and  name HD1# )(resid   17 and  name HB2  ) 3.0 2.5 1.8  
assign (resid   17 and  name HD1# )(resid   17 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   17 and  name HN   )(resid   19 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 17 and name HN) (resid 20 and name HD1#) 4.0 2.2 1.0
assign (resid   17 and  name HN   )(resid   20 and  name HG1# ) 4.0 3.2 2.0  
assign (resid   17 and  name HB#  )(resid   18 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 17 and name HD*) (resid 107 and name HZ) 4.0 2.2 1.0
!assign (resid 17 and name HB1) (resid 97 and name HN) 4.0 2.2 1.0
!assign (resid 17 and name HD*) (resid 66 and name HE#) 4.0 2.2 1.0
assign (resid   17 and  name HA   )(resid   20 and  name HD1# ) 4.0 3.7 2.5  
!assign (resid 17 and name HD*) (resid 44 and name HE#) 4.0 2.2 1.0
!assign (resid 17 and name HD*) (resid 44 and name HD#) 4.0 2.2 1.0
!assign (resid 17 and name HD*) (resid 107 and name HE#) 4.0 2.2 1.0
!assign (resid 17 and name HD*) (resid 20 and name HG1#) 4.0 2.2 1.0
assign (resid   17 and  name HB2  )(resid  103 and  name HD1# ) 3.0 2.7 1.8  
!assign (resid 17 and name HB2) (resid 103 and name HD2#) 4.0 2.2 1.0
!assign (resid 17 and name HD*) (resid 70 and name HZ) 4.0 2.2 1.0
!assign (resid 17 and name HD*) (resid 70 and name HE#) 4.0 2.2 1.0
assign (resid   17 and  name HB1  )(resid   20 and  name HG1# ) 4.0 3.2 2.0  
!assign (resid 17 and name HB1) (resid 99 and name HD*) 4.0 2.2 1.0
assign (resid   17 and  name HB2  )(resid  100 and  name HD1# ) 4.0 3.7 2.5  
!assign (resid 17 and name HD*) (resid 63 and name HA) 4.0 2.2 1.0
assign (resid   17 and  name HA   )(resid   21 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   17 and  name HB2  )(resid   20 and  name HG1# ) 4.0 3.2 2.0  
!assign (resid 17 and name HA) (resid 18 and name HG1#) 4.0 2.2 1.0
assign (resid   17 and  name HA   )(resid   20 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   17 and  name HB1  )(resid   20 and  name HD1# ) 4.0 3.7 2.5  
!assign (resid 17 and name HD*) (resid 66 and name HB#) 4.0 2.2 1.0
!assign (resid 17 and name HD*) (resid 63 and name HB) 4.0 2.2 1.0
!assign (resid 17 and name HD*) (resid 20 and name HG1#) 4.0 2.2 1.0
assign (resid   17 and  name HB1  )(resid  100 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   17 and  name HB1  )(resid  100 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   17 and  name HD2# )(resid   20 and  name HG2# ) 4.0 5.2 4.0    
!!V18
assign (resid   18 and  name HN   )(resid   18 and  name HB   ) 2.5 0.7 0.4
assign (resid   18 and  name HN   )(resid   18 and  name HG2# ) 2.5 2.2 1.9  
assign (resid   18 and  name HN   )(resid   18 and  name HG1# ) 4.0 3.7 2.5  
assign (resid   18 and  name HA   )(resid   18 and  name HG1# ) 3.0 2.3 1.4  
assign (resid   18 and  name HA   )(resid   18 and  name HG2# ) 3.0 2.3 1.4  
assign (resid   18 and  name HA   )(resid   21 and  name HG2# ) 4.0 3.7 2.5  
!assign (resid 18 and name HA) (resid 23 and name HN) 4.0 2.2 1.0
!assign (resid 18 and name HN) (resid 21 and name HN) 4.0 2.2 1.0
assign (resid   18 and  name HN   )(resid   19 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   18 and  name HN   )(resid   19 and  name HA   ) 5.0 2.0 1.0
assign (resid   18 and  name HG1# )(resid   19 and  name HN   ) 4.0 3.7 2.5  
assign (resid   18 and  name HG2# )(resid   19 and  name HN   ) 4.0 3.7 2.5  
assign (resid   18 and  name HB   )(resid   19 and  name HN   ) 2.5 0.7 0.4
assign (resid   18 and  name HA   )(resid   22 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   18 and  name HG1# )(resid   19 and  name HA   ) 4.0 3.7 2.5  
assign (resid   18 and  name HG1# )(resid   22 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   18 and  name HG1# )(resid   19 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   18 and  name HG1# )(resid   22 and  name HN   ) 4.0 3.7 2.5  
assign (resid   18 and  name HG1# )(resid   21 and  name HN   ) 4.0 3.7 2.5  
assign (resid   18 and  name HG1# )(resid   22 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   18 and  name HA   )(resid  100 and  name HD2# ) 3.0 2.7 1.8  
assign (resid   18 and  name HG2# )(resid   22 and  name HG#  ) 3.0 3.7 2.8    
!!N19
assign (resid   19 and  name HB#  )(resid   19 and  name HN   ) 2.5 1.3 1.0  
assign (resid   19 and  name HN   )(resid   22 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   19 and  name HB#  )(resid   20 and  name HN   ) 3.0 2.2 1.5  
assign (resid   19 and  name HB#  )(resid   21 and  name HN   ) 4.0 3.2 2.0  
assign (resid   19 and  name HB#  )(resid   20 and  name HA   ) 4.0 3.2 2.0  
!assign (resid 19 and name HA) (resid 23 and name HB#) 4.0 2.2 1.0
assign (resid   19 and  name HA   )(resid   20 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   19 and  name HB#  )(resid   20 and  name HG2# ) 4.0 4.7 3.5    
assign (resid   19 and  name HA   )(resid   22 and  name HG#  ) 4.0 3.2 2.0  
!!I20
assign (resid   20 and  name HB   )(resid   20 and  name HD1# ) 3.0 2.7 1.8  
assign (resid   20 and  name HA   )(resid   20 and  name HG1# ) 4.0 2.8 1.6  
assign (resid   20 and  name HA   )(resid   20 and  name HG2# ) 3.0 2.3 1.4  
assign (resid   20 and  name HA   )(resid   20 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   20 and  name HN   )(resid   20 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   20 and  name HN   )(resid   20 and  name HG2# ) 2.5 2.2 1.9  
assign (resid   20 and  name HN   )(resid   20 and  name HG1# ) 3.0 2.2 1.5  
assign (resid   20 and  name HN   )(resid   20 and  name HB   ) 4.0 2.2 1.0
assign (resid   20 and  name HB   )(resid   21 and  name HN   ) 4.0 2.2 1.0
assign (resid   20 and  name HG11 )(resid   21 and  name HN   ) 4.0 3.2 2.0  
assign (resid   20 and  name HG12 )(resid   21 and  name HN   ) 4.0 3.2 2.0  
assign (resid   20 and  name HD1# )(resid   21 and  name HN   ) 4.0 3.7 2.5  
assign (resid   20 and  name HG2# )(resid   21 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 20 and name HD1#) (resid 46 and name HN) 4.0 2.2 1.0
!assign (resid 20 and name HG1#) (resid 66 and name HN) 4.0 2.2 1.0
assign (resid   20 and  name HG1# )(resid   22 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 20 and name HD1#) (resid 21 and name HB) 4.0 2.2 1.0
assign (resid   20 and  name HA   )(resid   21 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   20 and  name HD1# )(resid   21 and  name HA   ) 4.0 3.7 2.5  
assign (resid   20 and  name HG1# )(resid   21 and  name HA   ) 4.0 3.2 2.0  
assign (resid   20 and  name HG1# )(resid   21 and  name HG2# ) 4.0 4.7 3.5    
assign (resid   20 and  name HB   )(resid   59 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   20 and  name HG2# )(resid   59 and  name HB#  ) 4.0 5.2 4.0    
!assign (resid 20 and name HG2#) (resid 63 and name HB) 4.0 2.2 1.0
assign (resid   20 and  name HB   )(resid   21 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   20 and  name HD1# )(resid   60 and  name HA   ) 4.0 3.7 2.5  
assign (resid   20 and  name HD1# )(resid   63 and  name HB   ) 4.0 3.7 2.5  
assign (resid   20 and  name HD1# )(resid   63 and  name HA   ) 4.0 3.7 2.5  
assign (resid   20 and  name HD1# )(resid   60 and  name HB   ) 4.0 3.7 2.5  
!assign (resid 20 and name HD1#) (resid 47 and name HB#) 4.0 2.2 1.0
assign (resid   20 and  name HD1# )(resid   21 and  name HG2# ) 4.0 5.2 4.0    
assign (resid   20 and  name HG2# )(resid   28 and  name HD2# ) 4.0 5.2 4.0    
assign (resid   20 and  name HB   )(resid   28 and  name HD2# ) 4.0 3.7 2.5  
!!T21
assign (resid   21 and  name HA   )(resid   21 and  name HG2# ) 2.5 1.8 1.3  
assign (resid   21 and  name HN   )(resid   21 and  name HG2# ) 2.5 2.2 1.9  
!assign (resid 21 and name HA) (resid 23 and name HB#) 4.0 2.2 1.0
assign (resid   21 and  name HN   )(resid   22 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 21 and name HN) (resid 92 and name HG*) 4.0 2.2 1.0
assign (resid   21 and  name HG2# )(resid   22 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 21 and name HB) (resid 23 and name HB#) 4.0 2.2 1.0
assign (resid   21 and  name HB   )(resid   24 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 21 and name HB) (resid 92 and name HG*) 4.0 2.2 1.0
assign (resid   21 and  name HA   )(resid   24 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   21 and  name HG2# )(resid   97 and  name HE#  ) 4.0 4.7 3.5    
assign (resid   21 and  name HG2# )(resid   97 and  name HA   ) 4.0 3.7 2.5  
assign (resid   21 and  name HB   )(resid   97 and  name HE#  ) 4.0 3.2 2.0  
!assign (resid 21 and name HG2#) (resid 93 and name HA) 4.0 2.2 1.0
!assign (resid 21 and name HA) (resid 92 and name HG*) 4.0 2.2 1.0
assign (resid   21 and  name HG2# )(resid   96 and  name HB   ) 4.0 3.7 2.5  
assign (resid   21 and  name HG2# )(resid   96 and  name HG1# ) 4.0 5.2 4.0    
assign (resid   21 and  name HG2# )(resid   96 and  name HA   ) 4.0 3.7 2.5  
assign (resid   21 and  name HG2# )(resid   22 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   21 and  name HG2# )(resid   24 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   21 and  name HB   )(resid   96 and  name HG1# ) 4.0 3.7 2.5  
assign (resid   21 and  name HB   )(resid   96 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   21 and  name HA   )(resid   96 and  name HG2# ) 5.0 3.5 2.5  
assign (resid   21 and  name HA   )(resid   28 and  name HG   ) 4.0 2.2 1.0
assign (resid   21 and  name HA   )(resid   28 and  name HD2# ) 4.0 3.7 2.5  
!assign (resid 21 and name HB) (resid 28 and name HG) 5.0 2.0 1.0
assign (resid   21 and  name HB   )(resid   96 and  name HB   ) 4.0 2.2 1.0
assign (resid   21 and  name HB   )(resid   97 and  name HD#  ) 4.0 3.2 2.0  
!assign (resid 21 and name HB) (resid 28 and name HD2#) 4.0 2.2 1.0
assign (resid   21 and  name HG2# )(resid   28 and  name HG   ) 4.0 3.7 2.5  
assign (resid   21 and  name HG2# )(resid   28 and  name HD2# ) 4.0 5.2 4.0    
!! Q22
assign (resid   22 and  name HA   )(resid   22 and  name HG#  ) 2.5 1.3 1.0  
assign (resid   22 and  name HN   )(resid   22 and  name HB#  ) 2.5 1.3 1.0  
assign (resid   22 and  name HN   )(resid   22 and  name HG#  ) 3.0 2.2 1.5  
!assign (resid 22 and name HN) (resid 62 and name HD#) 4.0 2.2 1.0
!assign (resid 22 and name HN) (resid 62 and name HG#) 4.0 2.2 1.0
!assign (resid 22 and name HN) (resid 96 and name HG*) 4.0 2.2 1.0
!assign (resid 22 and name HN) (resid 92 and name HG*) 4.0 2.2 1.0
assign (resid   22 and  name HG#  )(resid   23 and  name HN   ) 4.0 3.2 2.0  
assign (resid   22 and  name HB#  )(resid   23 and  name HN   ) 3.0 2.2 1.5  
assign (resid   22 and  name HB#  )(resid   23 and  name HB#  ) 4.0 4.2 3.0    
!!N23
assign (resid   23 and  name HN   )(resid   23 and  name HB#  ) 3.0 1.8 1.1  
!assign (resid 23 and name HN) (resid 92 and name HG*) 4.0 2.2 1.0
assign (resid   23 and  name HB1  )(resid   24 and  name HN   ) 4.0 2.2 1.0
assign (resid   23 and  name HB2  )(resid   24 and  name HN   ) 4.0 2.2 1.0
!assign (resid 23 and name HB#) (resid 92 and name HN) 4.0 2.2 1.0
!assign (resid 23 and name HB#) (resid 92 and name HG*) 4.0 2.2 1.0
!assign (resid 23 and name HB2) (resid 54 and name HG*) 4.0 2.2 1.0
!!Q24
assign (resid   24 and  name HB#  )(resid   24 and  name HN   ) 4.0 2.8 1.6  
assign (resid   24 and  name HG#  )(resid   24 and  name HN   ) 4.0 3.2 2.0  
assign (resid   24 and  name HG#  )(resid   24 and  name HA   ) 4.0 2.8 1.6  
assign (resid   24 and  name HB#  )(resid   25 and  name HN   ) 4.0 3.2 2.0  
assign (resid   24 and  name HB#  )(resid   26 and  name HN   ) 4.0 3.2 2.0  
assign (resid   24 and  name HG#  )(resid   26 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 24 and name HA) (resid 26 and name HB#) 4.0 2.2 1.0
!assign (resid 24 and name HB2) (resid 25 and name HB2) 4.0 2.2 1.0
assign (resid   24 and  name HG#  )(resid   28 and  name HN   ) 4.0 3.2 2.0  
assign (resid   24 and  name HB2  )(resid   28 and  name HG   ) 4.0 2.2 1.0
!!K25
assign (resid   25 and  name HB#  )(resid   25 and  name HD#  ) 4.0 4.2 3.0    
assign (resid   25 and  name HA   )(resid   25 and  name HG#  ) 4.0 2.8 1.6  
assign (resid   25 and  name HA   )(resid   25 and  name HD#  ) 4.0 3.2 2.0  
assign (resid   25 and  name HN   )(resid   25 and  name HB#  ) 3.0 1.8 1.1  
assign (resid   25 and  name HN   )(resid   25 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   25 and  name HB1  )(resid   26 and  name HN   ) 4.0 2.2 1.0
assign (resid   25 and  name HB2  )(resid   26 and  name HN   ) 4.0 2.2 1.0
assign (resid   25 and  name HE#  )(resid   26 and  name HB#  ) 4.0 4.7 3.5    
!!A26
assign (resid   26 and  name HN   )(resid   26 and  name HB#  ) 2.5 1.8 1.5  
!assign (resid 26 and name HA) (resid 28 and name HN) 4.0 2.2 1.0
assign (resid   26 and  name HB#  )(resid   28 and  name HN   ) 5.0 3.5 2.5  
assign (resid   26 and  name HA   )(resid   27 and  name HD1  ) 2.5 1.7 1.2  
assign (resid   26 and  name HA   )(resid   27 and  name HD2  ) 2.5 1.7 1.2  
assign (resid   26 and  name HB#  )(resid   27 and  name HA   ) 4.0 3.7 2.5  
assign (resid   26 and  name HB#  )(resid   27 and  name HD#  ) 3.0 3.7 2.8    
assign (resid   26 and  name HA   )(resid   27 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   26 and  name HA   )(resid   27 and  name HA   ) 4.0 2.2 1.0
assign (resid   26 and  name HB#  )(resid   27 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   26 and  name HN   )(resid   27 and  name HD#  ) 4.0 3.2 2.0  
!!P27
assign (resid   27 and  name HA   )(resid   28 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   27 and  name HB#  )(resid   30 and  name HA   ) 4.0 3.2 2.0  
assign (resid   27 and  name HB#  )(resid   31 and  name HN   ) 4.0 3.2 2.0  
assign (resid   27 and  name HB#  )(resid   32 and  name HN   ) 4.0 3.2 2.0  
!!L28
assign (resid   28 and  name HA   )(resid   28 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   28 and  name HA   )(resid   28 and  name HD2# ) 3.0 2.7 2.0  
assign (resid   28 and  name HN   )(resid   28 and  name HG   ) 3.0 1.2 0.5
assign (resid   28 and  name HN   )(resid   28 and  name HB#  ) 3.0 1.8 1.1  
assign (resid   28 and  name HN   )(resid   28 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   28 and  name HB#  )(resid   28 and  name HD1# ) 4.0 4.7 3.5    
!assign (resid 28 and name HN) (resid 92 and name HG*) 4.0 2.2 1.0
assign (resid   28 and  name HB#  )(resid   29 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 28 and name HB#) (resid 31 and name HN) 4.0 2.2 1.0
!assign (resid 28 and name HB#) (resid 32 and name HN) 4.0 2.2 1.0
!assign (resid 28 and name HB#) (resid 30 and name HN) 4.0 2.2 1.0
assign (resid   28 and  name HB#  )(resid   92 and  name HG*  ) 4.0 5.6 4.4    
!assign (resid 28 and name HD2#) (resid 91 and name HG#) 4.0 2.2 1.0
!assign (resid 28 and name HD2#) (resid 91 and name HB1) 4.0 2.2 1.0
assign (resid   28 and  name HD1# )(resid   93 and  name HA   ) 4.0 3.7 2.5  
!assign (resid 28 and name HD2#) (resid 29 and name HA) 4.0 2.2 1.0
assign (resid   28 and  name HG   )(resid   92 and  name HG*  ) 4.0 4.6 3.4  
!!C29
assign (resid   29 and  name HB1  )(resid   29 and  name HN   ) 4.0 2.2 1.0
assign (resid   29 and  name HB2  )(resid   29 and  name HN   ) 4.0 2.2 1.0
!assign (resid 29 and name HB#) (resid 57 and name HN) 5.0 2.0 1.0
assign (resid   29 and  name HN   )(resid   92 and  name HG*  ) 4.0 4.6 3.4  
assign (resid   29 and  name HB#  )(resid   30 and  name HN   ) 4.0 3.2 2.0  
assign (resid   29 and  name HB#  )(resid   32 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 29 and name HA) (resid 32 and name HB#) 4.0 2.2 1.0
assign (resid   29 and  name HA   )(resid   57 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 29 and name HA) (resid 57 and name HB2) 4.0 2.2 1.0
!assign (resid 29 and name HA) (resid 54 and name HG1#) 4.0 2.2 1.0
!assign (resid 29 and name HA) (resid 92 and name HG*) 4.0 2.2 1.0
!assign (resid 29 and name HA) (resid 52 and name HG2#) 4.0 2.2 1.0
!assign (resid 29 and name HA) (resid 60 and name HG2#) 4.0 2.2 1.0
!assign (resid 29 and name HA) (resid 60 and name HD1#) 4.0 2.2 1.0
assign (resid   29 and  name HB1  )(resid   32 and  name HB#  ) 3.0 2.2 2.0  
assign (resid   29 and  name HB2  )(resid   32 and  name HB#  ) 3.0 2.2 2.0  
!assign (resid 29 and name HA) (resid 51 and name HD*) 4.0 2.2 1.0
assign (resid   29 and  name HB1  )(resid   92 and  name HG*  ) 3.0 3.6 3.4  
assign (resid   29 and  name HB2  )(resid   92 and  name HG*  ) 3.0 3.6 3.4  
assign (resid   29 and  name HB1  )(resid   54 and  name HG1# ) 4.0 3.7 2.5  
assign (resid   29 and  name HB2  )(resid   54 and  name HG1# ) 4.0 3.7 2.5  
!assign (resid 29 and name HB1) (resid 54 and name HG2#) 4.0 2.2 1.0
assign (resid   29 and  name HB1  )(resid   57 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 29 and name HB2) (resid 57 and name HB1) 4.0 2.2 1.0
!assign (resid 29 and name HB1) (resid 60 and name HD1#) 4.0 2.2 1.0
assign (resid   29 and  name HB2  )(resid   60 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   29 and  name HB2  )(resid   92 and  name HB   ) 4.0 2.2 1.0
!!N30
assign (resid   30 and  name HN   )(resid   30 and  name HB1  ) 4.0 2.2 1.0
assign (resid   30 and  name HN   )(resid   30 and  name HB2  ) 3.0 1.2 0.5
!assign (resid 30 and name HN) (resid 95 and name HD#) 4.0 2.2 1.0
!assign (resid 30 and name HN) (resid 95 and name HE#) 4.0 2.2 1.0
assign (resid   30 and  name HB1  )(resid   31 and  name HN   ) 4.0 2.2 1.0
assign (resid   30 and  name HB2  )(resid   31 and  name HN   ) 4.0 2.2 1.0
!!G31
assign (resid   31 and  name HN   )(resid   92 and  name HG*  ) 4.0 4.6 3.4  
!assign (resid 31 and name HN) (resid 49 and name HB#) 4.0 2.2 1.0
!assign (resid 31 and name HN) (resid 52 and name HD1#) 4.0 2.2 1.0
!assign (resid 31 and name HA#) (resid 88 and name HN) 4.0 2.2 1.0
!assign (resid 31 and name HA#) (resid 35 and name HE1) 4.0 2.2 1.0
!assign (resid 31 and name HN) (resid 91 and name HB1) 4.0 2.2 1.0
!assign (resid 31 and name HN) (resid 91 and name HB2) 4.0 2.2 1.0
!assign (resid 31 and name HA#) (resid 84 and name HE1) 4.0 2.2 1.0
assign (resid   31 and  name HA#  )(resid   91 and  name HG#  ) 4.0 4.2 3.0    
assign (resid   31 and  name HA#  )(resid   91 and  name HB#  ) 4.0 4.2 3.0    
!!S32
assign (resid   32 and  name HN   )(resid   32 and  name HB#  ) 2.5 1.3 1.0  
!assign (resid 32 and name HN) (resid 52 and name HD1#) 4.0 2.2 1.0
assign (resid   32 and  name HB#  )(resid   33 and  name HN   ) 3.0 2.2 1.5  
assign (resid   32 and  name HB#  )(resid   92 and  name HN   ) 4.0 3.2 2.0  
assign (resid   32 and  name HB#  )(resid   92 and  name HB   ) 4.0 3.2 2.0  
assign (resid   32 and  name HB#  )(resid   92 and  name HG*  ) 4.0 5.6 4.4    
assign (resid   32 and  name HA   )(resid   33 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   32 and  name HN   )(resid   92 and  name HG*  ) 4.0 4.6 3.4  
assign (resid   32 and  name HB#  )(resid   34 and  name HG1# ) 4.0 4.7 3.5    
!assign (resid 32 and name HB#) (resid 51 and name HD1#) 4.0 2.2 1.0
!assign (resid 32 and name HA) (resid 92 and name HG*) 4.0 2.2 1.0
assign (resid   32 and  name HB#  )(resid   54 and  name HG1# ) 3.0 3.7 2.8    
assign (resid   32 and  name HB#  )(resid   54 and  name HG2# ) 3.0 3.7 2.8    
assign (resid   32 and  name HA   )(resid   54 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   32 and  name HB#  )(resid   60 and  name HD1# ) 4.0 4.7 3.5    
assign (resid   32 and  name HA   )(resid   33 and  name HB2  ) 4.0 2.2 1.0
assign (resid   32 and  name HN   )(resid   92 and  name HB   ) 4.0 2.2 1.0
assign (resid   32 and  name HB#  )(resid   33 and  name HA   ) 5.0 3.0 2.0  
!!M33
assign (resid   33 and  name HA   )(resid   33 and  name HG#  ) 3.0 1.8 0.9  
assign (resid   33 and  name HN   )(resid   33 and  name HG#  ) 3.0 2.2 1.5  
assign (resid   33 and  name HN   )(resid   33 and  name HB#  ) 3.0 1.8 1.1  
assign (resid   33 and  name HA   )(resid   33 and  name HE#  ) 4.0 3.7 2.5  
assign (resid   33 and  name HE#  )(resid   33 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   33 and  name HN   )(resid   89 and  name HB1  ) 5.0 2.0 1.0
assign (resid   33 and  name HN   )(resid   34 and  name HG1# ) 4.0 3.7 2.5  
assign (resid   33 and  name HG1  )(resid   34 and  name HN   ) 4.0 3.2 2.0  
assign (resid   33 and  name HG2  )(resid   34 and  name HN   ) 4.0 3.2 2.0  
assign (resid   33 and  name HB#  )(resid   34 and  name HN   ) 3.0 2.2 1.5  
!assign (resid 33 and name HG#) (resid 35 and name HE1) 4.0 2.2 1.0
assign (resid   33 and  name HA   )(resid   92 and  name HN   ) 4.0 2.2 1.0
!assign (resid 33 and name HN) (resid 85 and name HG*) 4.0 2.2 1.0
!assign (resid 33 and name HN) (resid 52 and name HD1#) 4.0 2.2 1.0
!assign (resid 33 and name HA) (resid 90 and name HB) 4.0 2.2 1.0
assign (resid   33 and  name HA   )(resid   91 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 33 and name HA) (resid 91 and name HB2) 4.0 2.2 1.0
assign (resid   33 and  name HA   )(resid   89 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 33 and name HA) (resid 92 and name HG2#) 4.0 2.2 1.0
assign (resid   33 and  name HA   )(resid   34 and  name HG1# ) 4.0 3.7 2.5  
assign (resid   33 and  name HB1  )(resid   34 and  name HA   ) 4.0 2.2 1.0
assign (resid   33 and  name HG#  )(resid   91 and  name HA   ) 4.0 3.2 2.0  
assign (resid   33 and  name HB1  )(resid   91 and  name HA   ) 4.0 2.2 1.0
!assign (resid 33 and name HB2) (resid 91 and name HA) 4.0 2.2 1.0
!assign (resid 33 and name HG#) (resid 89 and name HE#) 4.0 2.2 1.0
assign (resid   33 and  name HG#  )(resid   89 and  name HD#  ) 4.0 4.2 3.0    
assign (resid   33 and  name HG#  )(resid   89 and  name HB#  ) 4.0 4.2 3.0    
assign (resid   33 and  name HB2  )(resid   89 and  name HD#  ) 4.0 3.2 2.0  
assign (resid   33 and  name HE#  )(resid   89 and  name HA   ) 4.0 3.7 2.5  
assign (resid   33 and  name HE#  )(resid   90 and  name HA   ) 3.0 2.7 1.8  
assign (resid   33 and  name HE#  )(resid   91 and  name HA   ) 4.0 3.7 2.5  
assign (resid   33 and  name HE#  )(resid   91 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   33 and  name HE#  )(resid   91 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   33 and  name HE#  )(resid   89 and  name HB1  ) 4.0 3.7 2.5  
!assign (resid 33 and name HE#) (resid 54 and name HG*) 4.0 2.2 1.0
assign (resid   33 and  name HE#  )(resid   89 and  name HD#  ) 4.0 4.7 3.5    
assign (resid   33 and  name HE#  )(resid   89 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   33 and  name HA   )(resid   92 and  name HG*  ) 4.0 4.6 3.4  
!assign (resid 33 and name HG#) (resid 54 and name HG2#) 4.0 2.2 1.0
assign (resid   33 and  name HA   )(resid   91 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   33 and  name HB2  )(resid   89 and  name HB1  ) 4.0 2.2 1.0
assign (resid   33 and  name HN   )(resid   54 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   33 and  name HN   )(resid   92 and  name HG*  ) 4.0 4.6 3.4  
assign (resid   33 and  name HE#  )(resid   90 and  name HG2# ) 4.0 5.2 4.0    
assign (resid   33 and  name HN   )(resid   89 and  name HD#  ) 4.0 3.2 2.0  
!!V34
assign (resid   34 and  name HA   )(resid   34 and  name HG1# ) 2.5 1.8 1.5  
assign (resid   34 and  name HA   )(resid   34 and  name HG2# ) 4.0 3.3 2.1  
assign (resid   34 and  name HN   )(resid   34 and  name HG2# ) 2.5 2.2 1.9  
assign (resid   34 and  name HN   )(resid   34 and  name HG1# ) 4.0 3.7 2.5  
assign (resid   34 and  name HN   )(resid   34 and  name HB   ) 4.0 2.2 1.0
assign (resid   34 and  name HN   )(resid   35 and  name HA   ) 5.0 2.0 1.0
assign (resid   34 and  name HN   )(resid   89 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 34 and name HN) (resid 85 and name HG*) 4.0 2.2 1.0
assign (resid   34 and  name HG1# )(resid   35 and  name HN   ) 3.0 2.7 2.0  
assign (resid   34 and  name HG2# )(resid   35 and  name HN   ) 3.0 2.7 2.0  
assign (resid   34 and  name HB   )(resid   35 and  name HN   ) 2.5 0.7 0.4
assign (resid   34 and  name HG2# )(resid   36 and  name HN   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   94 and  name HN   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   95 and  name HN   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   96 and  name HN   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG1# )(resid   92 and  name HN   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   92 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 34 and name HG1#) (resid 93 and name HN) 4.0 2.2 1.0
assign (resid   34 and  name HN   )(resid   92 and  name HN   ) 4.0 2.2 1.0
assign (resid   34 and  name HN   )(resid   91 and  name HN   ) 4.0 2.2 1.0
!assign (resid 34 and name HG*) (resid 35 and name HE1) 4.0 2.2 1.0
assign (resid   34 and  name HG2# )(resid   91 and  name HN   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   95 and  name HD1  ) 3.0 2.7 1.8  
assign (resid   34 and  name HG1# )(resid   95 and  name HD1  ) 4.0 3.7 2.5  
assign (resid   34 and  name HG1# )(resid   95 and  name HE1  ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   95 and  name HE1  ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   92 and  name HA   ) 3.0 2.7 1.8  
assign (resid   34 and  name HG1# )(resid   92 and  name HA   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG1# )(resid   50 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   34 and  name HG1# )(resid   50 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   50 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   50 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   34 and  name HB   )(resid   50 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   34 and  name HG2# )(resid   95 and  name HA   ) 4.0 3.7 2.5  
assign (resid   34 and  name HB   )(resid   50 and  name HA   ) 4.0 2.2 1.0
assign (resid   34 and  name HG2# )(resid   36 and  name HA   ) 4.0 3.7 2.5  
assign (resid   34 and  name HA   )(resid   35 and  name HA   ) 4.0 2.2 1.0
assign (resid   34 and  name HA   )(resid   50 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 34 and name HA) (resid 90 and name HB) 4.0 2.2 1.0
!assign (resid 34 and name HA) (resid 51 and name HD*) 4.0 2.2 1.0
assign (resid   34 and  name HG1# )(resid   51 and  name HA   ) 4.0 3.7 2.5  
assign (resid   34 and  name HB   )(resid   51 and  name HA   ) 4.0 2.2 1.0
assign (resid   34 and  name HG1# )(resid   54 and  name HN   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG1# )(resid   92 and  name HB   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   92 and  name HB   ) 4.0 3.7 2.5  
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assign (resid   34 and  name HA   )(resid   89 and  name HD#  ) 4.0 3.2 2.0  
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assign (resid   34 and  name HN   )(resid   92 and  name HA   ) 4.0 2.2 1.0
assign (resid   34 and  name HG2# )(resid   90 and  name HG1# ) 4.0 4.7 3.5    
assign (resid   34 and  name HA   )(resid   90 and  name HG1# ) 4.0 3.2 2.0  
assign (resid   34 and  name HG1# )(resid   51 and  name HD2# ) 3.0 4.2 3.3    
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assign (resid   34 and  name HG2# )(resid   51 and  name HD2# ) 4.0 5.2 4.0    
!assign (resid 34 and name HG1#) (resid 53 and name HB1) 4.0 2.2 1.0
assign (resid   34 and  name HG1# )(resid   53 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   90 and  name HD1# ) 4.0 5.2 4.0    
assign (resid   34 and  name HA   )(resid   54 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   34 and  name HG1# )(resid   54 and  name HG2# ) 3.0 4.2 3.3    
assign (resid   34 and  name HG1# )(resid   54 and  name HG1# ) 4.0 5.2 4.0    
assign (resid   34 and  name HG2# )(resid   54 and  name HG1# ) 4.0 5.2 4.0    
!assign (resid 34 and name HG*) (resid 96 and name HG*) 4.0 2.2 1.0
assign (resid   34 and  name HG1# )(resid   54 and  name HA   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   95 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   95 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   35 and  name HA   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   91 and  name HA   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG1# )(resid   50 and  name HA   ) 4.0 3.7 2.5  
assign (resid   34 and  name HG1# )(resid   92 and  name HG*  ) 3.0 5.1 4.2    
assign (resid   34 and  name HG2# )(resid   92 and  name HG*  ) 4.0 6.1 4.9    
!assign (resid 34 and name HB) (resid 47 and name HB#) 4.0 2.2 1.0
assign (resid   34 and  name HG1# )(resid   60 and  name HD1# ) 4.0 5.2 4.0    
!assign (resid 34 and name HA) (resid 52 and name HD1#) 4.0 2.2 1.0
assign (resid   34 and  name HG1# )(resid   54 and  name HB   ) 4.0 3.7 2.5  
assign (resid   34 and  name HN   )(resid   92 and  name HG*  ) 3.0 3.6 2.9  
assign (resid   34 and  name HB   )(resid   95 and  name HE1  ) 4.0 2.2 1.0
assign (resid   34 and  name HG1# )(resid   95 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   34 and  name HB   )(resid   51 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   34 and  name HG2# )(resid   90 and  name HG2# ) 4.0 5.2 4.0    
assign (resid   34 and  name HB   )(resid   92 and  name HG*  ) 4.0 4.6 3.4  
!!W35
assign (resid   35 and  name HD1  )(resid   35 and  name HB1  ) 4.0 2.2 1.0
assign (resid   35 and  name HD1  )(resid   35 and  name HB2  ) 4.0 2.2 1.0
assign (resid   35 and  name HN   )(resid   35 and  name HB1  ) 4.0 2.2 1.0
assign (resid   35 and  name HN   )(resid   35 and  name HB2  ) 4.0 2.2 1.0
assign (resid   35 and  name HN   )(resid   35 and  name HD1  ) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 35 and name HB1) 4.0 2.2 1.0
assign (resid   35 and  name HE1  )(resid   35 and  name HB2  ) 4.0 2.2 1.0
assign (resid   35 and  name HD1  )(resid   35 and  name HA   ) 4.0 2.2 1.0
assign (resid   35 and  name HE3  )(resid   35 and  name HA   ) 4.0 2.2 1.0
assign (resid   35 and  name HE3  )(resid   35 and  name HB1  ) 4.0 2.2 1.0
assign (resid   35 and  name HE3  )(resid   35 and  name HB2  ) 4.0 2.2 1.0
assign (resid   35 and  name HN   )(resid   50 and  name HB1  ) 4.0 2.2 1.0
assign (resid   35 and  name HN   )(resid   50 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 50 and name HA) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 50 and name HB#) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 99 and name HB#) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 46 and name HB#) 4.0 2.2 1.0
!assign (resid 35 and name HE3) (resid 36 and name HN) 4.0 2.2 1.0
!assign (resid 35 and name HD1) (resid 36 and name HN) 5.0 2.0 1.0
assign (resid   35 and  name HB1  )(resid   36 and  name HN   ) 3.0 1.2 0.5
assign (resid   35 and  name HB2  )(resid   36 and  name HN   ) 4.0 2.2 1.0
assign (resid   35 and  name HE3  )(resid   88 and  name HN   ) 4.0 2.2 1.0
assign (resid   35 and  name HZ3  )(resid   88 and  name HN   ) 5.0 2.0 1.0
assign (resid   35 and  name HE3  )(resid   89 and  name HN   ) 4.0 2.2 1.0
assign (resid   35 and  name HZ3  )(resid   89 and  name HN   ) 4.0 2.2 1.0
!assign (resid 35 and name HZ2) (resid 78 and name HN) 4.0 2.2 1.0
assign (resid   35 and  name HN   )(resid   90 and  name HN   ) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 83 and name HD*) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 90 and name HB) 4.0 2.2 1.0
assign (resid   35 and  name HE1  )(resid   89 and  name HE#  ) 4.0 3.2 2.0  
!assign (resid 35 and name HE1) (resid 87 and name HB2) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 92 and name HG*) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 88 and name HG2#) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 90 and name HD1#) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 90 and name HG2#) 4.0 2.2 1.0
!assign (resid 35 and name HE1) (resid 90 and name HG1#) 4.0 2.2 1.0
assign (resid   35 and  name HD1  )(resid   50 and  name HA   ) 4.0 2.2 1.0
assign (resid   35 and  name HE1  )(resid   89 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 35 and name HE1) (resid 89 and name HB1) 5.0 2.0 1.0
!assign (resid 35 and name HE1) (resid 89 and name HB2) 4.0 2.2 1.0
assign (resid   35 and  name HE1  )(resid   89 and  name HD#  ) 4.0 3.2 2.0  
assign (resid   35 and  name HA   )(resid   36 and  name HA   ) 4.0 2.2 1.0
assign (resid   35 and  name HZ2  )(resid   89 and  name HE#  ) 4.0 3.2 2.0  
assign (resid   35 and  name HZ2  )(resid   89 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   35 and  name HZ2  )(resid   89 and  name HD#  ) 4.0 3.2 2.0  
!assign (resid 35 and name HZ2) (resid 82 and name HA) 4.0 2.2 1.0
!assign (resid 35 and name HZ2) (resid 50 and name HA) 4.0 2.2 1.0
!assign (resid 35 and name HD1) (resid 80 and name HB1) 4.0 2.2 1.0
!assign (resid 35 and name HD1) (resid 87 and name HB2) 4.0 2.2 1.0
assign (resid   35 and  name HD1  )(resid   89 and  name HE#  ) 4.0 3.2 2.0  
!assign (resid 35 and name HD1) (resid 90 and name HB) 4.0 2.2 1.0
!assign (resid 35 and name HD1) (resid 90 and name HG2#) 4.0 2.2 1.0
!assign (resid 35 and name HD1) (resid 90 and name HD1#) 4.0 2.2 1.0
assign (resid   35 and  name HD1  )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
!assign (resid 35 and name HD1) (resid 85 and name HG*) 4.0 2.2 1.0
assign (resid   35 and  name HD1  )(resid   89 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 35 and name HH2) (resid 82 and name HA) 4.0 2.2 1.0
assign (resid   35 and  name HH2  )(resid   89 and  name HE#  ) 4.0 3.2 2.0  
assign (resid   35 and  name HH2  )(resid   89 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 35 and name HH2) (resid 87 and name HB1) 5.0 2.0 1.0
!assign (resid 35 and name HH2) (resid 84 and name HB#) 4.0 2.2 1.0
assign (resid   35 and  name HZ3  )(resid   88 and  name HA   ) 4.0 2.2 1.0
assign (resid   35 and  name HZ3  )(resid   87 and  name HA   ) 5.0 2.0 1.0
assign (resid   35 and  name HZ3  )(resid   87 and  name HB2  ) 4.0 2.2 1.0
assign (resid   35 and  name HZ3  )(resid   89 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   35 and  name HE3  )(resid   88 and  name HA   ) 4.0 2.2 1.0
!assign (resid 35 and name HE3) (resid 82 and name HA) 4.0 2.2 1.0
assign (resid   35 and  name HE3  )(resid   83 and  name HA   ) 4.0 2.2 1.0
!assign (resid 35 and name HE3) (resid 87 and name HB1) 4.0 2.2 1.0
assign (resid   35 and  name HE3  )(resid   87 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 35 and name HE3) (resid 88 and name HG2#) 4.0 2.2 1.0
assign (resid   35 and  name HE3  )(resid   89 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 35 and name HB1) (resid 84 and name HE1) 4.0 2.2 1.0
assign (resid   35 and  name HA   )(resid   36 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 35 and name HA) (resid 36 and name HB2) 4.0 2.2 1.0
assign (resid   35 and  name HD1  )(resid   50 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 35 and name HZ3) (resid 50 and name HB#) 4.0 2.2 1.0
assign (resid   35 and  name HB2  )(resid   50 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 35 and name HZ2) (resid 85 and name HG*) 4.0 2.2 1.0
!assign (resid 35 and name HZ3) (resid 85 and name HA) 4.0 2.2 1.0
assign (resid   35 and  name HH2  )(resid   88 and  name HA   ) 5.0 2.0 1.0
!assign (resid 35 and name HB2) (resid 50 and name HA) 4.0 2.2 1.0
!assign (resid 35 and name HB2) (resid 36 and name HA) 4.0 2.2 1.0
assign (resid   35 and  name HB1  )(resid   89 and  name HA   ) 4.0 2.2 1.0
!assign (resid 35 and name HB2) (resid 89 and name HA) 4.0 2.2 1.0
!assign (resid 35 and name HA) (resid 84 and name HD2) 4.0 2.2 1.0
assign (resid   35 and  name HA   )(resid   90 and  name HG1# ) 4.0 3.2 2.0  
assign (resid   35 and  name HA   )(resid   89 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   35 and  name HB1  )(resid   37 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   35 and  name HB1  )(resid   83 and  name HD1# ) 4.0 3.7 2.5  
!assign (resid 35 and name HB1) (resid 83 and name HD2#) 4.0 2.2 1.0
assign (resid   35 and  name HB2  )(resid   83 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   35 and  name HB2  )(resid   83 and  name HD2# ) 4.0 3.7 2.5  
!assign (resid 35 and name HB2) (resid 82 and name HA) 4.0 2.2 1.0
!assign (resid 35 and name HZ2) (resid 83 and name HG) 5.0 2.0 1.0
!assign (resid 35 and name HH2) (resid 85 and name HG*) 4.0 2.2 1.0
!assign (resid 35 and name HZ2) (resid 83 and name HD*) 4.0 2.2 1.0
assign (resid   35 and  name HA   )(resid   90 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   35 and  name HA   )(resid   90 and  name HD1# ) 4.0 3.7 2.5  
!assign (resid 35 and name HD1) (resid 83 and name HA) 5.0 2.0 1.0
assign (resid   35 and  name HE1  )(resid   53 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 35 and name HD1) (resid 54 and name HG*) 4.0 2.2 1.0
!assign (resid 35 and name HA) (resid 95 and name HB2) 4.0 2.2 1.0
assign (resid   35 and  name HD1  )(resid   89 and  name HD#  ) 4.0 3.2 2.0  
assign (resid   35 and  name HE1  )(resid   83 and  name HG   ) 5.0 2.0 1.0
assign (resid   35 and  name HE1  )(resid   83 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   35 and  name HE1  )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
!assign (resid 35 and name HD1) (resid 84 and name HE1) 4.0 2.2 1.0
assign (resid   35 and  name HE3  )(resid   87 and  name HN   ) 4.0 2.2 1.0
assign (resid   35 and  name HE3  )(resid   89 and  name HB1  ) 5.0 2.0 1.0
assign (resid   35 and  name HB2  )(resid   50 and  name HA   ) 4.0 2.2 1.0
assign (resid   35 and  name HZ3  )(resid   87 and  name HN   ) 4.0 2.2 1.0
assign (resid   35 and  name HE3  )(resid   36 and  name HN   ) 4.0 2.2 1.0
assign (resid   35 and  name HE3  )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   35 and  name HE3  )(resid   89 and  name HE#  ) 4.0 3.2 2.0  
assign (resid   35 and  name HE3  )(resid   86 and  name HA   ) 4.0 2.2 1.0
!!S36
assign (resid   36 and  name HB#  )(resid   36 and  name HN   ) 2.5 1.3 1.0  
assign (resid   36 and  name HB#  )(resid   37 and  name HN   ) 3.0 2.2 1.5  
!assign (resid 36 and name HN) (resid 37 and name HG2#) 4.0 2.2 1.0
!assign (resid 36 and name HN) (resid 37 and name HG1#) 4.0 2.2 1.0
!assign (resid 36 and name HN) (resid 39 and name HG) 4.0 2.2 1.0
assign (resid   36 and  name HN   )(resid   90 and  name HN   ) 4.0 2.2 1.0
assign (resid   36 and  name HN   )(resid   90 and  name HG1# ) 4.0 3.2 2.0  
assign (resid   36 and  name HN   )(resid   90 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   36 and  name HN   )(resid   90 and  name HG2# ) 4.0 3.7 2.5  
!assign (resid 36 and name HN) (resid 89 and name HG#) 4.0 2.2 1.0
!assign (resid 36 and name HN) (resid 90 and name HB) 5.0 2.0 1.0
assign (resid   36 and  name HA   )(resid   95 and  name HD1  ) 4.0 2.2 1.0
assign (resid   36 and  name HA   )(resid   95 and  name HE1  ) 4.0 2.2 1.0
!assign (resid 36 and name HA) (resid 95 and name HZ) 4.0 2.2 1.0
assign (resid   36 and  name HB#  )(resid   95 and  name HD1  ) 5.0 3.0 2.0  
!assign (resid 36 and name HB#) (resid 95 and name HE1) 4.0 2.2 1.0
assign (resid   36 and  name HB#  )(resid   37 and  name HA   ) 4.0 3.2 2.0  
!assign (resid 36 and name HB2) (resid 37 and name HA) 4.0 2.2 1.0
!assign (resid 36 and name HB1) (resid 46 and name HB#) 4.0 2.2 1.0
!assign (resid 36 and name HB2) (resid 46 and name HB#) 4.0 2.2 1.0
assign (resid   36 and  name HB1  )(resid   90 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   36 and  name HB2  )(resid   90 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   36 and  name HB1  )(resid   90 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   36 and  name HB2  )(resid   90 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   36 and  name HB1  )(resid   90 and  name HG1# ) 4.0 3.2 2.0  
assign (resid   36 and  name HB2  )(resid   90 and  name HG1# ) 4.0 3.2 2.0  
!assign (resid 36 and name HB1) (resid 37 and name HG1#) 4.0 2.2 1.0
!assign (resid 36 and name HB2) (resid 37 and name HG1#) 4.0 2.2 1.0
assign (resid   36 and  name HA   )(resid   37 and  name HG1# ) 4.0 3.2 2.0  
assign (resid   36 and  name HA   )(resid   90 and  name HD1# ) 3.0 2.7 1.8  
assign (resid   36 and  name HA   )(resid   90 and  name HG2# ) 4.0 3.7 2.5  
!assign (resid 36 and name HA) (resid 94 and name HN) 4.0 2.2 1.0
assign (resid   36 and  name HA   )(resid   90 and  name HG1# ) 4.0 3.2 2.0  
assign (resid   36 and  name HB#  )(resid   90 and  name HB   ) 4.0 3.2 2.0  
assign (resid   36 and  name HB#  )(resid   90 and  name HN   ) 4.0 3.2 2.0  
assign (resid   36 and  name HB#  )(resid   88 and  name HN   ) 4.0 3.2 2.0  
assign (resid   36 and  name HN   )(resid   88 and  name HN   ) 4.0 2.2 1.0
!!I37
assign (resid   37 and  name HB   )(resid   37 and  name HD1# ) 3.0 2.7 2.0  
assign (resid   37 and  name HA   )(resid   37 and  name HG1# ) 4.0 2.8 1.6  
assign (resid   37 and  name HN   )(resid   37 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   37 and  name HN   )(resid   37 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   37 and  name HN   )(resid   37 and  name HG1# ) 3.0 2.2 1.5  
assign (resid   37 and  name HN   )(resid   37 and  name HB   ) 4.0 2.2 1.0
assign (resid   37 and  name HA   )(resid   37 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   37 and  name HA   )(resid   37 and  name HG2# ) 4.0 3.3 2.1  
!assign (resid 37 and name HN) (resid 39 and name HG) 5.0 2.0 1.0
assign (resid   37 and  name HN   )(resid   39 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   37 and  name HB   )(resid   38 and  name HN   ) 3.0 1.2 0.5
assign (resid   37 and  name HD1# )(resid   38 and  name HN   ) 4.0 3.7 2.5  
assign (resid   37 and  name HG1# )(resid   38 and  name HN   ) 4.0 3.2 2.0  
assign (resid   37 and  name HN   )(resid   95 and  name HD1  ) 4.0 2.2 1.0
assign (resid   37 and  name HN   )(resid   95 and  name HE1  ) 4.0 2.2 1.0
assign (resid   37 and  name HG1# )(resid   38 and  name HA   ) 4.0 3.2 2.0  
!assign (resid 37 and name HA) (resid 95 and name HE2) 4.0 2.2 1.0
!assign (resid 37 and name HG2#) (resid 95 and name HE#) 4.0 2.2 1.0
assign (resid   37 and  name HG2# )(resid   95 and  name HZ   ) 4.0 3.7 2.5  
!assign (resid 37 and name HG2#) (resid 84 and name HD2) 4.0 2.2 1.0
!assign (resid 37 and name HG2#) (resid 84 and name HE1) 4.0 2.2 1.0
!assign (resid 37 and name HA) (resid 50 and name HB#) 4.0 2.2 1.0
assign (resid   37 and  name HG2# )(resid   50 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   37 and  name HD1# )(resid   43 and  name HA   ) 3.0 2.7 1.8  
!assign (resid 37 and name HG1#) (resid 80 and name HA) 4.0 2.2 1.0
assign (resid   37 and  name HG1# )(resid   47 and  name HA   ) 4.0 3.2 2.0  
assign (resid   37 and  name HG2# )(resid   47 and  name HA   ) 4.0 3.7 2.5  
!assign (resid 37 and name HG2#) (resid 39 and name HA) 4.0 2.2 1.0
assign (resid   37 and  name HD1# )(resid   39 and  name HA   ) 3.0 2.7 1.8  
!assign (resid 37 and name HD1#) (resid 102 and name HE1) 4.0 2.2 1.0
!assign (resid 37 and name HD1#) (resid 102 and name HD2) 4.0 2.2 1.0
assign (resid   37 and  name HG1# )(resid   95 and  name HZ   ) 4.0 3.2 2.0  
assign (resid   37 and  name HG1# )(resid   95 and  name HE1  ) 4.0 3.2 2.0  
assign (resid   37 and  name HG1# )(resid   95 and  name HD1  ) 4.0 3.2 2.0  
assign (resid   37 and  name HG1# )(resid   46 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   37 and  name HG1# )(resid   39 and  name HA   ) 4.0 3.2 2.0  
assign (resid   37 and  name HG1# )(resid   39 and  name HD1# ) 3.0 3.7 2.8    
assign (resid   37 and  name HG1# )(resid   39 and  name HD2# ) 4.0 4.7 3.5    
assign (resid   37 and  name HD1# )(resid   39 and  name HD1# ) 4.0 5.2 4.0    
assign (resid   37 and  name HA   )(resid   46 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   37 and  name HB   )(resid   46 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   37 and  name HD1# )(resid   46 and  name HB#  ) 4.0 5.2 4.0    
assign (resid   37 and  name HG2# )(resid   46 and  name HB#  ) 4.0 5.2 4.0    
assign (resid   37 and  name HG2# )(resid   47 and  name HB#  ) 4.0 5.2 4.0    
assign (resid   37 and  name HG2# )(resid   82 and  name HA   ) 4.0 3.7 2.5  
assign (resid   37 and  name HG2# )(resid   38 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   37 and  name HD1# )(resid   43 and  name HE#  ) 4.0 5.2 4.0    
assign (resid   37 and  name HG2# )(resid   49 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   37 and  name HD1# )(resid   95 and  name HZ   ) 4.0 3.7 2.5  
assign (resid   37 and  name HD1# )(resid   95 and  name HE1  ) 4.0 3.7 2.5  
assign (resid   37 and  name HD1# )(resid   95 and  name HD1  ) 4.0 3.7 2.5  
assign (resid   37 and  name HD1# )(resid   47 and  name HA   ) 4.0 3.7 2.5  
assign (resid   37 and  name HD1# )(resid   46 and  name HA   ) 4.0 3.7 2.5  
assign (resid   37 and  name HD1# )(resid   50 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   37 and  name HD1# )(resid   43 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   37 and  name HD1# )(resid   43 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   37 and  name HD1# )(resid   43 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   37 and  name HD1# )(resid   47 and  name HB#  ) 4.0 5.2 4.0    
assign (resid   37 and  name HD1# )(resid   99 and  name HD*  ) 4.0 6.1 4.9    
assign (resid   37 and  name HD1# )(resid   45 and  name HN   ) 5.0 3.5 2.5  
assign (resid   37 and  name HD1# )(resid   46 and  name HN   ) 5.0 3.5 2.5  
assign (resid   37 and  name HG2# )(resid   46 and  name HN   ) 5.0 3.5 2.5  
assign (resid   37 and  name HN   )(resid   90 and  name HD1# ) 4.0 3.7 2.5  
!assign (resid 37 and name HN) (resid 90 and name HG1#) 4.0 2.2 1.0
!assign (resid 37 and name HB) (resid 95 and name HE1) 4.0 2.2 1.0
assign (resid   37 and  name HD1# )(resid   47 and  name HN   ) 4.0 3.7 2.5  
assign (resid   37 and  name HD1# )(resid   37 and  name HG2# ) 4.0 5.2 4.0    
assign (resid   37 and  name HN   )(resid   90 and  name HG1# ) 4.0 3.2 2.0  
!!N38
assign (resid   38 and  name HN   )(resid   38 and  name HB#  ) 3.0 1.8 1.1  
!assign (resid 38 and name HN) (resid 39 and name HG) 4.0 2.2 1.0
assign (resid   38 and  name HN   )(resid   39 and  name HD1# ) 5.0 3.5 2.5  
assign (resid   38 and  name HB#  )(resid   39 and  name HN   ) 4.0 3.2 2.0  
assign (resid   38 and  name HB#  )(resid   40 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 38 and name HB#) (resid 41 and name HN) 5.0 2.0 1.0
!assign (resid 38 and name HA) (resid 39 and name HG) 4.0 2.2 1.0
assign (resid   38 and  name HA   )(resid   39 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   38 and  name HA   )(resid   40 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   38 and  name HB#  )(resid   46 and  name HB#  ) 4.0 4.7 3.5    
!assign (resid 38 and name HB#) (resid 39 and name HG) 4.0 2.2 1.0
assign (resid   38 and  name HB#  )(resid   40 and  name HG2# ) 4.0 4.7 3.5    
assign (resid   38 and  name HN   )(resid   46 and  name HB#  ) 4.0 3.7 2.5  
!assign (resid 38 and name HB#) (resid 39 and name HB2) 4.0 2.2 1.0
assign (resid   38 and  name HA   )(resid   39 and  name HD2# ) 4.0 3.7 2.5  
!!L39
assign (resid   39 and  name HB1  )(resid   39 and  name HD2# ) 3.0 2.7 1.8  
assign (resid   39 and  name HB1  )(resid   39 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   39 and  name HA   )(resid   39 and  name HD1# ) 3.0 2.7 1.8  
assign (resid   39 and  name HA   )(resid   39 and  name HD2# ) 3.0 2.7 1.8  
assign (resid   39 and  name HN   )(resid   39 and  name HB2  ) 3.0 1.2 0.5
assign (resid   39 and  name HA   )(resid   39 and  name HG   ) 4.0 2.2 1.0
assign (resid   39 and  name HN   )(resid   39 and  name HG   ) 4.0 2.2 1.0
assign (resid   39 and  name HN   )(resid   39 and  name HD2# ) 3.0 2.7 2.0  
assign (resid   39 and  name HN   )(resid   39 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   39 and  name HN   )(resid   40 and  name HG2# ) 4.0 3.7 2.5  
!assign (resid 39 and name HN) (resid 43 and name HB#) 5.0 2.0 1.0
!assign (resid 39 and name HG) (resid 40 and name HN) 4.0 2.2 1.0
assign (resid   39 and  name HB2  )(resid   40 and  name HN   ) 4.0 2.2 1.0
assign (resid   39 and  name HD1# )(resid   40 and  name HN   ) 4.0 3.7 2.5  
assign (resid   39 and  name HD2# )(resid   40 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 39 and name HB#) (resid 43 and name HN) 4.0 2.2 1.0
assign (resid   39 and  name HD1# )(resid  102 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 39 and name HB2) (resid 103 and name HN) 4.0 2.2 1.0
assign (resid   39 and  name HD1# )(resid  102 and  name HD2  ) 3.0 2.7 1.8  
assign (resid   39 and  name HD2# )(resid  102 and  name HD2  ) 4.0 3.7 2.5  
assign (resid   39 and  name HG   )(resid  102 and  name HE1  ) 4.0 2.2 1.0
assign (resid   39 and  name HB1  )(resid  102 and  name HE1  ) 4.0 2.2 1.0
assign (resid   39 and  name HB2  )(resid  102 and  name HE1  ) 4.0 2.2 1.0
assign (resid   39 and  name HD1# )(resid  102 and  name HE1  ) 4.0 3.7 2.5  
assign (resid   39 and  name HD2# )(resid  102 and  name HE1  ) 4.0 3.7 2.5  
!assign (resid 39 and name HA) (resid 102 and name HE1) 4.0 2.2 1.0
!assign (resid 39 and name HD*) (resid 44 and name HA) 4.0 2.2 1.0
!assign (resid 39 and name HG) (resid 40 and name HA) 4.0 2.2 1.0
assign (resid   39 and  name HB1  )(resid   40 and  name HA   ) 4.0 2.2 1.0
assign (resid   39 and  name HD1# )(resid   99 and  name HA   ) 4.0 3.7 2.5  
assign (resid   39 and  name HD1# )(resid   43 and  name HA   ) 4.0 3.7 2.5  
assign (resid   39 and  name HA   )(resid   43 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   39 and  name HA   )(resid   43 and  name HB1  ) 4.0 2.2 1.0
assign (resid   39 and  name HA   )(resid   43 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 39 and name HG) (resid 102 and name HD2) 4.0 2.2 1.0
assign (resid   39 and  name HD1# )(resid   43 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   39 and  name HD1# )(resid   43 and  name HB1  ) 3.0 2.7 1.8  
assign (resid   39 and  name HD2# )(resid   43 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   39 and  name HD1# )(resid  102 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   39 and  name HD1# )(resid  102 and  name HB2  ) 4.0 3.7 2.5  
!assign (resid 39 and name HD2#) (resid 102 and name HB1) 4.0 2.2 1.0
!assign (resid 39 and name HD2#) (resid 102 and name HB2) 4.0 2.2 1.0
!assign (resid 39 and name HB2) (resid 99 and name HD*) 4.0 2.2 1.0
!assign (resid 39 and name HD2#) (resid 98 and name HA) 4.0 2.2 1.0
assign (resid   39 and  name HD2# )(resid   98 and  name HB1  ) 3.0 2.7 1.8  
assign (resid   39 and  name HD2# )(resid   98 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   39 and  name HD1# )(resid   98 and  name HB1  ) 4.0 3.7 2.5  
!assign (resid 39 and name HD2#) (resid 101 and name HB1) 4.0 2.2 1.0
!assign (resid 39 and name HD2#) (resid 101 and name HB2) 4.0 2.2 1.0
assign (resid   39 and  name HD1# )(resid   47 and  name HB#  ) 3.0 4.2 3.3    
assign (resid   39 and  name HD2# )(resid   47 and  name HB#  ) 4.0 5.2 4.0    
assign (resid   39 and  name HD1# )(resid   95 and  name HE1  ) 4.0 3.7 2.5  
assign (resid   39 and  name HA   )(resid   40 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   39 and  name HA   )(resid   46 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   39 and  name HD1# )(resid   46 and  name HB#  ) 4.0 5.2 4.0    
assign (resid   39 and  name HA   )(resid   43 and  name HE#  ) 4.0 3.7 2.5  
assign (resid   39 and  name HB1  )(resid   43 and  name HE#  ) 4.0 3.7 2.5  
assign (resid   39 and  name HD1# )(resid   43 and  name HE#  ) 4.0 5.2 4.0    
assign (resid   39 and  name HD1# )(resid   98 and  name HB2  ) 4.0 3.7 2.5  
!assign (resid 39 and name HB1) (resid 102 and name HA) 4.0 2.2 1.0
assign (resid   39 and  name HG   )(resid  102 and  name HN   ) 4.0 2.2 1.0
assign (resid   39 and  name HD1# )(resid   47 and  name HA   ) 4.0 3.7 2.5  
assign (resid   39 and  name HD*  )(resid   99 and  name HD*  ) 4.0 7.0 5.8    
assign (resid   39 and  name HA   )(resid  102 and  name HD2  ) 5.0 2.0 1.0
assign (resid   39 and  name HB1  )(resid  102 and  name HD2  ) 4.0 2.2 1.0
!!T40
assign (resid   40 and  name HA   )(resid   40 and  name HG2# ) 3.0 2.3 1.6  
assign (resid   40 and  name HN   )(resid   40 and  name HG2# ) 3.0 2.7 2.0  
assign (resid   40 and  name HN   )(resid   43 and  name HB1  ) 4.0 2.2 1.0
assign (resid   40 and  name HN   )(resid   43 and  name HB2  ) 4.0 2.2 1.0
assign (resid   40 and  name HN   )(resid   43 and  name HN   ) 4.0 2.2 1.0
assign (resid   40 and  name HG2# )(resid   41 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 40 and name HA) (resid 80 and name HE#) 4.0 2.2 1.0
assign (resid   40 and  name HA   )(resid  102 and  name HE1  ) 4.0 2.2 1.0
!assign (resid 40 and name HB) (resid 43 and name HB1) 4.0 2.2 1.0
!assign (resid 40 and name HB) (resid 74 and name HD#) 4.0 2.2 1.0
assign (resid   40 and  name HB   )(resid   41 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   40 and  name HG2# )(resid  102 and  name HE1  ) 4.0 3.7 2.5  
!assign (resid 40 and name HG2#) (resid 80 and name HZ) 4.0 2.2 1.0
!assign (resid 40 and name HG2#) (resid 43 and name HB2) 4.0 2.2 1.0
!assign (resid 40 and name HA) (resid 43 and name HE#) 4.0 2.2 1.0
assign (resid   40 and  name HA   )(resid   41 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   40 and  name HN   )(resid   43 and  name HE#  ) 4.0 3.7 2.5  
assign (resid   40 and  name HB   )(resid   41 and  name HN   ) 4.0 2.2 1.0
!assign (resid 40 and name HB) (resid 42 and name HN) 4.0 2.2 1.0
!!A41
assign (resid   41 and  name HN   )(resid   41 and  name HB#  ) 2.5 1.8 1.5  
!assign (resid 41 and name HN) (resid 106 and name HD2#) 5.0 2.0 1.0
!assign (resid 41 and name HN) (resid 43 and name HB#) 5.0 2.0 1.0
assign (resid   41 and  name HB#  )(resid   42 and  name HN   ) 3.0 2.7 2.0  
assign (resid   41 and  name HA   )(resid  106 and  name HD*  ) 4.0 4.6 3.4  
!assign (resid 41 and name HB#) (resid 104 and name HA) 4.0 2.2 1.0
assign (resid   41 and  name HB#  )(resid   42 and  name HA#  ) 4.0 4.7 3.5    
assign (resid   41 and  name HB#  )(resid  106 and  name HD*  ) 4.0 6.1 4.9    
!assign (resid 41 and name HB#) (resid 45 and name HB#) 4.0 2.2 1.0
!!G42
assign (resid   42 and  name HA1  )(resid   46 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   42 and  name HA2  )(resid   46 and  name HB#  ) 4.0 4.7 3.5    
!assign (resid 42 and name HA#) (resid 80 and name HZ) 4.0 2.2 1.0
assign (resid   42 and  name HA#  )(resid   43 and  name HG#  ) 4.0 4.2 3.0    
!assign (resid 42 and name HA#) (resid 103 and name HD*) 4.0 2.2 1.0
!!M43
assign (resid   43 and  name HB1  )(resid   43 and  name HE#  ) 3.0 2.7 1.8  
assign (resid   43 and  name HB2  )(resid   43 and  name HE#  ) 3.0 2.7 1.8  
assign (resid   43 and  name HA   )(resid   43 and  name HG#  ) 3.0 1.8 0.9  
assign (resid   43 and  name HN   )(resid   43 and  name HB#  ) 2.5 1.3 1.0  
assign (resid   43 and  name HN   )(resid   43 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   43 and  name HN   )(resid   44 and  name HD2  ) 4.0 2.2 1.0
assign (resid   43 and  name HB1  )(resid   44 and  name HN   ) 4.0 2.2 1.0
assign (resid   43 and  name HB2  )(resid   44 and  name HN   ) 3.0 1.2 0.5
!assign (resid 43 and name HB1) (resid 45 and name HN) 4.0 2.2 1.0
assign (resid   43 and  name HB2  )(resid   45 and  name HN   ) 5.0 2.0 1.0
assign (resid   43 and  name HB2  )(resid   44 and  name HD2  ) 4.0 2.2 1.0
assign (resid   43 and  name HB2  )(resid   44 and  name HE2  ) 4.0 2.2 1.0
!assign (resid 43 and name HG#) (resid 102 and name HD2) 5.0 2.0 1.0
!assign (resid 43 and name HB2) (resid 102 and name HD2) 4.0 2.2 1.0
!assign (resid 43 and name HB1) (resid 102 and name HD2) 5.0 2.0 1.0
assign (resid   43 and  name HB2  )(resid   44 and  name HA   ) 4.0 2.2 1.0
!assign (resid 43 and name HB1) (resid 47 and name HA) 4.0 2.2 1.0
assign (resid   43 and  name HB1  )(resid   99 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   43 and  name HB2  )(resid   99 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   43 and  name HB1  )(resid   46 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   43 and  name HB2  )(resid   46 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   43 and  name HG#  )(resid   99 and  name HD*  ) 4.0 5.6 4.4    
assign (resid   43 and  name HG#  )(resid   46 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   43 and  name HE#  )(resid   44 and  name HD2  ) 4.0 3.7 2.5  
assign (resid   43 and  name HE#  )(resid   44 and  name HE2  ) 4.0 3.7 2.5  
assign (resid   43 and  name HE#  )(resid  102 and  name HD2  ) 4.0 3.7 2.5  
assign (resid   43 and  name HE#  )(resid  113 and  name HA   ) 5.0 3.5 2.5  
assign (resid   43 and  name HE#  )(resid  102 and  name HA   ) 4.0 3.7 2.5  
assign (resid   43 and  name HE#  )(resid  102 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   43 and  name HE#  )(resid  106 and  name HD*  ) 4.0 6.1 4.9    
assign (resid   43 and  name HB1  )(resid   47 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   43 and  name HB2  )(resid   47 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   43 and  name HE#  )(resid   44 and  name HA   ) 4.0 3.7 2.5  
!assign (resid 43 and name HB1) (resid 46 and name HN) 4.0 2.2 1.0

!!Y44
assign (resid   44 and  name HN   )(resid   44 and  name HB#  ) 2.5 1.3 1.0  
assign (resid   44 and  name HB#  )(resid   44 and  name HD1  ) 3.0 2.2 1.3  
assign (resid   44 and  name HB#  )(resid   44 and  name HD2  ) 3.0 2.2 1.3  
assign (resid   44 and  name HA   )(resid   44 and  name HD1  ) 3.0 1.2 0.3
assign (resid   44 and  name HA   )(resid   44 and  name HE1  ) 4.0 2.2 1.0
assign (resid   44 and  name HN   )(resid   44 and  name HD2  ) 3.0 1.2 0.5
assign (resid   44 and  name HN   )(resid   44 and  name HE2  ) 4.0 2.2 1.0
assign (resid   44 and  name HB#  )(resid   44 and  name HE1  ) 4.0 3.2 2.0  
assign (resid   44 and  name HB#  )(resid   44 and  name HE2  ) 4.0 3.2 2.0  

assign (resid   44 and  name HN   )(resid   45 and  name HA   ) 5.0 2.0 1.0
assign (resid   44 and  name HN   )(resid   45 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   44 and  name HN   )(resid   46 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   44 and  name HN   )(resid   47 and  name HB#  ) 4.0 3.7 2.5  
!assign (resid 44 and name HN) (resid 48 and name HD*) 4.0 2.2 1.0
!assign (resid 44 and name HN) (resid 103 and name HD*) 4.0 2.2 1.0
!assign (resid 44 and name HN) (resid 106 and name HD2#) 4.0 2.2 1.0
assign (resid   44 and  name HD2  )(resid   45 and  name HN   ) 4.0 2.2 1.0
!assign (resid 44 and name HD2) (resid 46 and name HN) 5.0 2.0 1.0
assign (resid   44 and  name HB#  )(resid   45 and  name HN   ) 3.0 2.2 1.5  
assign (resid   44 and  name HB#  )(resid   46 and  name HN   ) 4.0 3.2 2.0  
assign (resid   44 and  name HD1  )(resid   47 and  name HB#  ) 4.0 3.7 2.5  
!assign (resid 44 and name HD1) (resid 103 and name HD1#) 4.0 2.2 1.0
assign (resid   44 and  name HD1  )(resid  103 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   44 and  name HD2  )(resid  113 and  name HA   ) 4.0 2.2 1.0
assign (resid   44 and  name HE2  )(resid  113 and  name HA   ) 4.0 2.2 1.0
assign (resid   44 and  name HE1  )(resid   70 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   44 and  name HE2  )(resid   70 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 44 and name HE#) (resid 46 and name HB#) 3.0 1.2 0.3
assign (resid   44 and  name HE1  )(resid  103 and  name HD2# ) 3.0 2.7 1.8  
assign (resid   44 and  name HE1  )(resid  103 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   44 and  name HB#  )(resid   71 and  name HA   ) 4.0 3.2 2.0  
!assign (resid 44 and name HA) (resid 46 and name HB#) 4.0 2.2 1.0
!assign (resid 44 and name HE1) (resid 99 and name HG) 4.0 2.2 1.0
assign (resid   44 and  name HB#  )(resid   70 and  name HA   ) 4.0 3.2 2.0  
assign (resid   44 and  name HA   )(resid   45 and  name HA   ) 4.0 2.2 1.0
!assign (resid 44 and name HA) (resid 47 and name HA) 4.0 2.2 1.0
assign (resid   44 and  name HD1  )(resid   67 and  name HD2# ) 3.0 2.7 1.8  
assign (resid   44 and  name HD1  )(resid   67 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   44 and  name HB#  )(resid   67 and  name HD2# ) 3.0 3.7 2.8    
assign (resid   44 and  name HB#  )(resid   67 and  name HD1# ) 4.0 4.7 3.5    
!assign (resid 44 and name HD1) (resid 99 and name HD1#) 4.0 2.2 1.0
!assign (resid 44 and name HD1) (resid 99 and name HD2#) 4.0 2.2 1.0
assign (resid   44 and  name HE1  )(resid   99 and  name HD*  ) 4.0 4.6 3.4  
!assign (resid 44 and name HD#) (resid 106 and name HD*) 4.0 2.2 1.0
assign (resid   44 and  name HE2  )(resid  106 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   44 and  name HE1  )(resid   67 and  name HD2# ) 4.0 3.7 2.5  
!assign (resid 44 and name HA) (resid 99 and name HD2#) 4.0 2.2 1.0
assign (resid   44 and  name HB#  )(resid   71 and  name HB#  ) 4.0 4.2 3.0    
assign (resid   44 and  name HB#  )(resid   47 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   44 and  name HB#  )(resid   70 and  name HB#  ) 4.0 4.2 3.0    
assign (resid   44 and  name HB#  )(resid   48 and  name HB2  ) 4.0 3.2 2.0  
assign (resid   44 and  name HB#  )(resid   71 and  name HN   ) 4.0 3.2 2.0  
assign (resid   44 and  name HB#  )(resid   70 and  name HN   ) 4.0 3.2 2.0  
assign (resid   44 and  name HN   )(resid   67 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   44 and  name HN   )(resid   70 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   44 and  name HN   )(resid   99 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   44 and  name HB#  )(resid   67 and  name HA   ) 4.0 3.2 2.0  
assign (resid   44 and  name HE#  )(resid   67 and  name HA   ) 4.0 4.2 3.0  
assign (resid   44 and  name HD1  )(resid   67 and  name HB2  ) 4.0 2.2 1.0
!!C45
assign (resid   45 and  name HN   )(resid   45 and  name HB#  ) 2.5 1.3 1.0  
assign (resid   45 and  name HN   )(resid   71 and  name HA   ) 5.0 2.0 1.0
!assign (resid 45 and name HN) (resid 82 and name HB#) 5.0 2.0 1.0
assign (resid   45 and  name HN   )(resid   47 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   45 and  name HN   )(resid   46 and  name HB#  ) 4.0 3.7 2.5  
!assign (resid 45 and name HN) (resid 48 and name HD*) 4.0 2.2 1.0
!assign (resid 45 and name HN) (resid 103 and name HD*) 4.0 2.2 1.0
assign (resid   45 and  name HB#  )(resid   46 and  name HN   ) 3.0 2.2 1.5  
assign (resid   45 and  name HB#  )(resid   49 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 45 and name HN) (resid 72 and name HD#) 4.0 2.2 1.0
assign (resid   45 and  name HA   )(resid   71 and  name HA   ) 5.0 2.0 1.0
!assign (resid 45 and name HA) (resid 48 and name HA) 4.0 2.2 1.0
!assign (resid 45 and name HA) (resid 72 and name HD#) 5.0 2.0 1.0
assign (resid   45 and  name HA   )(resid   48 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   45 and  name HA   )(resid   48 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   45 and  name HA   )(resid   71 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   45 and  name HA   )(resid   46 and  name HB#  ) 4.0 3.7 2.5  
!assign (resid 45 and name HA) (resid 73 and name HE1) 4.0 2.2 1.0
assign (resid   45 and  name HA   )(resid   73 and  name HD2  ) 4.0 2.2 1.0
assign (resid   45 and  name HA   )(resid   48 and  name HG   ) 5.0 2.0 1.0
assign (resid   45 and  name HB#  )(resid   48 and  name HD2# ) 4.0 4.7 3.5    
assign (resid   45 and  name HN   )(resid   48 and  name HB1  ) 5.0 2.0 1.0
assign (resid   45 and  name HB#  )(resid   73 and  name HE1  ) 4.0 3.2 2.0  
assign (resid   45 and  name HB#  )(resid   73 and  name HD2  ) 4.0 3.2 2.0  
!assign (resid 45 and name HB#) (resid 72 and name HD#) 4.0 2.2 1.0
assign (resid   45 and  name HB#  )(resid   71 and  name HB#  ) 4.0 4.2 3.0    
assign (resid   45 and  name HB#  )(resid   75 and  name HG*  ) 4.0 5.6 4.4    
assign (resid   45 and  name HB#  )(resid   46 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   45 and  name HN   )(resid   70 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   45 and  name HB#  )(resid   82 and  name HB#  ) 4.0 4.2 3.0    
assign (resid   45 and  name HN   )(resid   71 and  name HB#  ) 4.0 3.2 2.0  
!!A46
assign (resid   46 and  name HN   )(resid   46 and  name HB#  ) 2.5 1.8 1.5  
!assign (resid 46 and name HN) (resid 82 and name HB#) 4.0 2.2 1.0
!assign (resid 46 and name HN) (resid 48 and name HB1) 4.0 2.2 1.0
!assign (resid 46 and name HN) (resid 48 and name HB2) 4.0 2.2 1.0
!assign (resid 46 and name HN) (resid 48 and name HD*) 4.0 2.2 1.0
!assign (resid 46 and name HN) (resid 99 and name HD*) 4.0 2.2 1.0
assign (resid   46 and  name HB#  )(resid   47 and  name HN   ) 3.0 2.7 2.0  
assign (resid   46 and  name HB#  )(resid   49 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 46 and name HB#) (resid 95 and name HZ) 4.0 2.2 1.0
!assign (resid 46 and name HB#) (resid 95 and name HE1) 4.0 2.2 1.0
!assign (resid 46 and name HN) (resid 72 and name HD#) 4.0 2.2 1.0
assign (resid   46 and  name HA   )(resid   49 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 46 and name HB#) (resid 49 and name HB1) 4.0 2.2 1.0
!assign (resid 46 and name HA) (resid 80 and name HD#) 4.0 2.2 1.0
!assign (resid 46 and name HB#) (resid 75 and name HG*) 4.0 2.2 1.0
assign (resid   46 and  name HB#  )(resid   47 and  name HA   ) 4.0 3.7 2.5  
assign (resid   46 and  name HB#  )(resid   82 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   46 and  name HB#  )(resid   49 and  name HG#  ) 4.0 4.7 3.5    
!assign (resid 46 and name HB#) (resid 99 and name HD*) 4.0 2.2 1.0
!assign (resid 46 and name HA) (resid 84 and name HE1) 4.0 2.2 1.0
!assign (resid 46 and name HB#) (resid 84 and name HE1) 4.0 2.2 1.0
!assign (resid 46 and name HB#) (resid 84 and name HD2) 4.0 2.2 1.0
assign (resid   46 and  name HB#  )(resid   95 and  name HZ   ) 5.0 3.5 2.5  
assign (resid   46 and  name HA   )(resid   82 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   46 and  name HN   )(resid   49 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   46 and  name HN   )(resid   47 and  name HB#  ) 4.0 3.7 2.5  
!!A47
assign (resid   47 and  name HN   )(resid   47 and  name HB#  ) 3.0 2.3 1.6  
assign (resid   47 and  name HN   )(resid   95 and  name HZ   ) 4.0 2.2 1.0
!assign (resid 47 and name HN) (resid 95 and name HE1) 4.0 2.2 1.0
assign (resid   47 and  name HN   )(resid   48 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 47 and name HN) (resid 99 and name HD*) 4.0 2.2 1.0
assign (resid   47 and  name HA   )(resid   95 and  name HE1  ) 4.0 2.2 1.0
assign (resid   47 and  name HA   )(resid   95 and  name HZ   ) 4.0 2.2 1.0
assign (resid   47 and  name HB#  )(resid   95 and  name HE2  ) 4.0 3.7 2.5  
assign (resid   47 and  name HB#  )(resid   95 and  name HZ   ) 4.0 3.7 2.5  
assign (resid   47 and  name HB#  )(resid   50 and  name HB#  ) 4.0 4.7 3.5    
!assign (resid 47 and name HA) (resid 90 and name HG2#) 4.0 2.2 1.0
assign (resid   47 and  name HA   )(resid   95 and  name HD1  ) 5.0 2.0 1.0
assign (resid   47 and  name HA   )(resid   99 and  name HD*  ) 4.0 4.6 3.4  
!assign (resid 47 and name HA) (resid 51 and name HD*) 4.0 2.2 1.0
assign (resid   47 and  name HB#  )(resid   67 and  name HD2# ) 3.0 4.2 3.3    
!assign (resid 47 and name HB#) (resid 75 and name HG*) 4.0 2.2 1.0
assign (resid   47 and  name HB#  )(resid   99 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   47 and  name HB#  )(resid   95 and  name HD2  ) 4.0 3.7 2.5  
!assign (resid 47 and name HB#) (resid 67 and name HB2) 4.0 2.2 1.0
assign (resid   47 and  name HB#  )(resid   49 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   47 and  name HB#  )(resid   99 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   47 and  name HB#  )(resid   99 and  name HD*  ) 3.0 5.1 4.2    
!assign (resid 47 and name HB#) (resid 51 and name HD2#) 4.0 2.2 1.0
assign (resid   47 and  name HB#  )(resid   51 and  name HD1# ) 4.0 5.2 4.0    
!assign (resid 47 and name HA) (resid 84 and name HE1) 4.0 2.2 1.0
assign (resid   47 and  name HA   )(resid   51 and  name HD2# ) 5.0 3.5 2.5  
!!L48
assign (resid   48 and  name HB2  )(resid   48 and  name HD1# ) 2.5 2.2 1.7  
assign (resid   48 and  name HB1  )(resid   48 and  name HD2# ) 2.5 2.2 1.7  
assign (resid   48 and  name HA   )(resid   48 and  name HD1# ) 2.5 2.2 1.7  
assign (resid   48 and  name HA   )(resid   48 and  name HD2# ) 3.0 2.7 1.8  
assign (resid   48 and  name HN   )(resid   48 and  name HB2  ) 3.0 1.2 0.5
assign (resid   48 and  name HN   )(resid   48 and  name HB1  ) 2.5 0.7 0.3
assign (resid   48 and  name HN   )(resid   48 and  name HD*  ) 4.0 3.9 2.7  
assign (resid   48 and  name HA   )(resid   48 and  name HG   ) 4.0 2.2 1.0
assign (resid   48 and  name HN   )(resid   48 and  name HG   ) 4.0 2.2 1.0
!assign (resid 48 and name HN) (resid 95 and name HE#) 4.0 2.2 1.0
assign (resid   48 and  name HN   )(resid   49 and  name HA   ) 5.0 2.0 1.0
!assign (resid 48 and name HN) (resid 83 and name HD*) 4.0 2.2 1.0
assign (resid   48 and  name HB#  )(resid   49 and  name HN   ) 4.0 3.2 2.0  
assign (resid   48 and  name HD*  )(resid   49 and  name HN   ) 3.0 3.6 2.9  
assign (resid   48 and  name HB#  )(resid   50 and  name HN   ) 4.0 3.2 2.0  
assign (resid   48 and  name HD*  )(resid   51 and  name HN   ) 4.0 4.6 3.4  
assign (resid   48 and  name HD*  )(resid   52 and  name HN   ) 4.0 4.6 3.4  
assign (resid   48 and  name HD*  )(resid   65 and  name HN   ) 4.0 4.6 3.4  
!assign (resid 48 and name HD*) (resid 66 and name HN) 4.0 2.2 1.0
assign (resid   48 and  name HD*  )(resid   71 and  name HN   ) 4.0 4.6 3.4  
!assign (resid 48 and name HB2) (resid 71 and name HN) 5.0 2.0 1.0
assign (resid   48 and  name HN   )(resid   67 and  name HD1# ) 4.0 3.7 2.5  
!assign (resid 48 and name HD*) (resid 71 and name HA) 4.0 2.2 1.0
assign (resid   48 and  name HD*  )(resid   68 and  name HB2  ) 3.0 3.6 2.7  
!assign (resid 48 and name HB2) (resid 68 and name HB2) 5.0 2.0 1.0
!assign (resid 48 and name HD*) (resid 68 and name HA) 3.0 1.2 0.3
assign (resid   48 and  name HD1# )(resid   64 and  name HA   ) 3.0 2.7 1.8  
assign (resid   48 and  name HD2# )(resid   64 and  name HA   ) 4.0 3.7 2.5  
assign (resid   48 and  name HD2# )(resid   49 and  name HA   ) 4.0 3.7 2.5  
!assign (resid 48 and name HD*) (resid 66 and name HA) 4.0 2.2 1.0
assign (resid   48 and  name HG   )(resid   49 and  name HA   ) 4.0 2.2 1.0
assign (resid   48 and  name HB2  )(resid   68 and  name HA   ) 4.0 2.2 1.0
assign (resid   48 and  name HA   )(resid   67 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   48 and  name HA   )(resid   67 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   48 and  name HD1# )(resid   64 and  name HB1  ) 4.0 3.7 2.5  
!assign (resid 48 and name HD*) (resid 77 and name HB#) 4.0 2.2 1.0
assign (resid   48 and  name HD2# )(resid   71 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   48 and  name HD2# )(resid   71 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   48 and  name HD2# )(resid   67 and  name HG   ) 5.0 3.5 2.5  
!assign (resid 48 and name HD1#) (resid 51 and name HB1) 4.0 2.2 1.0
assign (resid   48 and  name HD1# )(resid   51 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   48 and  name HD1# )(resid   64 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   48 and  name HB2  )(resid   71 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   48 and  name HD*  )(resid   67 and  name HB2  ) 4.0 4.6 3.4  
assign (resid   48 and  name HG   )(resid   52 and  name HB   ) 4.0 2.2 1.0
assign (resid   48 and  name HD*  )(resid   52 and  name HB   ) 4.0 4.6 3.4  
assign (resid   48 and  name HA   )(resid   52 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   48 and  name HD*  )(resid   52 and  name HD1# ) 4.0 6.1 4.9    
!assign (resid 48 and name HB2) (resid 75 and name HB) 4.0 2.2 1.0
assign (resid   48 and  name HG   )(resid   75 and  name HB   ) 4.0 2.2 1.0
assign (resid   48 and  name HG   )(resid   75 and  name HG*  ) 4.0 4.6 3.4  
assign (resid   48 and  name HD*  )(resid   52 and  name HA   ) 4.0 4.6 3.4  
assign (resid   48 and  name HD*  )(resid   68 and  name HN   ) 4.0 4.6 3.4  
assign (resid   48 and  name HD*  )(resid   69 and  name HN   ) 4.0 4.6 3.4  
assign (resid   48 and  name HA   )(resid   67 and  name HB1  ) 4.0 2.2 1.0
assign (resid   48 and  name HA   )(resid   67 and  name HB2  ) 4.0 2.2 1.0
assign (resid   48 and  name HD1# )(resid   64 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   48 and  name HD1# )(resid   52 and  name HG2# ) 4.0 5.2 4.0    
assign (resid   48 and  name HD2# )(resid   68 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   48 and  name HG   )(resid   52 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   48 and  name HD2# )(resid   73 and  name HN   ) 4.0 3.7 2.5  
assign (resid   48 and  name HG   )(resid   52 and  name HD1# ) 4.0 3.7 2.5  
!! E49
assign (resid   49 and  name HA   )(resid   49 and  name HG#  ) 3.0 1.8 0.9  
assign (resid   49 and  name HN   )(resid   49 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   49 and  name HN   )(resid   49 and  name HB#  ) 3.0 1.8 1.1  
!assign (resid 49 and name HN) (resid 52 and name HB) 5.0 2.0 1.0
assign (resid   49 and  name HN   )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   49 and  name HG#  )(resid   50 and  name HN   ) 4.0 3.2 2.0  
assign (resid   49 and  name HB#  )(resid   50 and  name HB#  ) 4.0 4.2 3.0    
!assign (resid 49 and name HB#) (resid 51 and name HN) 4.0 2.2 1.0
!assign (resid 49 and name HB1) (resid 80 and name HD2) 4.0 2.2 1.0
assign (resid   49 and  name HB2  )(resid   80 and  name HD2  ) 4.0 2.2 1.0
!assign (resid 49 and name HB1) (resid 80 and name HE2) 4.0 2.2 1.0
assign (resid   49 and  name HB2  )(resid   80 and  name HE2  ) 4.0 2.2 1.0
assign (resid   49 and  name HG#  )(resid   80 and  name HD2  ) 4.0 3.2 2.0  
assign (resid   49 and  name HA   )(resid   80 and  name HD2  ) 4.0 2.2 1.0
assign (resid   49 and  name HG#  )(resid   50 and  name HB#  ) 4.0 4.2 3.0    
!assign (resid 49 and name HA) (resid 52 and name HG2#) 3.0 1.2 0.3
assign (resid   49 and  name HA   )(resid   52 and  name HG1# ) 4.0 3.2 2.0  
assign (resid   49 and  name HG#  )(resid   83 and  name HD*  ) 4.0 5.6 4.4    
assign (resid   49 and  name HG#  )(resid   75 and  name HG*  ) 4.0 5.6 4.4    
assign (resid   49 and  name HB1  )(resid   75 and  name HG*  ) 3.0 3.6 2.7  
assign (resid   49 and  name HB2  )(resid   75 and  name HG*  ) 4.0 4.6 3.4  
assign (resid   49 and  name HB2  )(resid   83 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   49 and  name HA   )(resid   52 and  name HB   ) 4.0 2.2 1.0
assign (resid   49 and  name HA   )(resid   52 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   49 and  name HB#  )(resid   52 and  name HD1# ) 4.0 4.7 3.5    
!assign (resid 49 and name HG#) (resid 52 and name HD1#) 4.0 2.2 1.0
!assign (resid 49 and name HB1) (resid 84 and name HE1) 4.0 2.2 1.0
!assign (resid 49 and name HB2) (resid 84 and name HE1) 4.0 2.2 1.0
!assign (resid 49 and name HA) (resid 84 and name HE1) 5.0 2.0 1.0
assign (resid   49 and  name HA   )(resid   52 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   49 and  name HB1  )(resid   82 and  name HB#  ) 5.0 3.0 2.0  
assign (resid   49 and  name HA   )(resid   75 and  name HG*  ) 3.0 3.6 2.7  
assign (resid   49 and  name HB2  )(resid   50 and  name HA   ) 4.0 2.2 1.0
assign (resid   49 and  name HB1  )(resid   52 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   49 and  name HB2  )(resid   52 and  name HG2# ) 4.0 3.7 2.5  
!!S50
assign (resid   50 and  name HN   )(resid   50 and  name HB#  ) 2.5 1.3 1.0  
assign (resid   50 and  name HN   )(resid   51 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 50 and name HN) (resid 51 and name HG) 4.0 2.2 1.0
assign (resid   50 and  name HN   )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
!assign (resid 50 and name HN) (resid 52 and name HG2#) 4.0 2.2 1.0
assign (resid   50 and  name HB#  )(resid   51 and  name HN   ) 3.0 2.2 1.5  
!assign (resid 50 and name HN) (resid 95 and name HE#) 4.0 2.2 1.0
!assign (resid 50 and name HA) (resid 95 and name HZ) 4.0 2.2 1.0
!assign (resid 50 and name HA) (resid 95 and name HE1) 5.0 2.0 1.0
assign (resid   50 and  name HB#  )(resid   95 and  name HD1  ) 4.0 3.2 2.0  
assign (resid   50 and  name HB1  )(resid   95 and  name HE1  ) 4.0 2.2 1.0
assign (resid   50 and  name HB2  )(resid   95 and  name HZ   ) 4.0 2.2 1.0
assign (resid   50 and  name HB1  )(resid   95 and  name HZ   ) 4.0 2.2 1.0
assign (resid   50 and  name HB2  )(resid   95 and  name HE1  ) 4.0 2.2 1.0
!assign (resid 50 and name HB#) (resid 51 and name HB2) 4.0 2.2 1.0
assign (resid   50 and  name HB#  )(resid   83 and  name HD*  ) 4.0 5.6 4.4    
!assign (resid 50 and name HB#) (resid 90 and name HG2#) 4.0 2.2 1.0
!assign (resid 50 and name HB#) (resid 80 and name HA) 4.0 2.2 1.0
assign (resid   50 and  name HB#  )(resid   51 and  name HD2# ) 4.0 4.7 3.5    
assign (resid   50 and  name HA   )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   50 and  name HB#  )(resid   51 and  name HA   ) 4.0 3.2 2.0  
assign (resid   50 and  name HA   )(resid   51 and  name HA   ) 4.0 2.2 1.0
!assign (resid 50 and name HA) (resid 52 and name HD1#) 4.0 2.2 1.0
assign (resid   50 and  name HA   )(resid   80 and  name HE2  ) 4.0 2.2 1.0
assign (resid   50 and  name HA   )(resid   80 and  name HD2  ) 4.0 2.2 1.0
!assign (resid 50 and name HA) (resid 53 and name HB1) 4.0 2.2 1.0
assign (resid   50 and  name HA   )(resid   53 and  name HB2  ) 4.0 2.2 1.0
!!L51
assign (resid   51 and  name HA   )(resid   51 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   51 and  name HA   )(resid   51 and  name HD2# ) 3.0 2.7 1.8  
assign (resid   51 and  name HN   )(resid   51 and  name HB#  ) 3.0 1.8 1.1  
assign (resid   51 and  name HA   )(resid   51 and  name HG   ) 4.0 2.2 1.0
assign (resid   51 and  name HB1  )(resid   51 and  name HD1# ) 3.0 2.7 1.8  
assign (resid   51 and  name HB2  )(resid   51 and  name HD1# ) 3.0 2.7 1.8  
assign (resid   51 and  name HB1  )(resid   51 and  name HD2# ) 3.0 2.7 1.8  
assign (resid   51 and  name HB2  )(resid   51 and  name HD2# ) 3.0 2.7 1.8  
assign (resid   51 and  name HN   )(resid   51 and  name HG   ) 4.0 2.2 1.0
assign (resid   51 and  name HN   )(resid   51 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   51 and  name HN   )(resid   51 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   51 and  name HN   )(resid   95 and  name HZ   ) 4.0 2.2 1.0
!assign (resid 51 and name HN) (resid 95 and name HE2) 4.0 2.2 1.0
assign (resid   51 and  name HN   )(resid   52 and  name HB   ) 5.0 2.0 1.0
assign (resid   51 and  name HB#  )(resid   52 and  name HN   ) 4.0 3.2 2.0  
assign (resid   51 and  name HB2  )(resid   53 and  name HN   ) 4.0 2.2 1.0
!assign (resid 51 and name HD*) (resid 64 and name HN) 4.0 2.2 1.0
!assign (resid 51 and name HG) (resid 95 and name HD2) 4.0 2.2 1.0
!assign (resid 51 and name HD1#) (resid 95 and name HD1) 4.0 2.2 1.0
assign (resid   51 and  name HD2# )(resid   95 and  name HD2  ) 4.0 3.7 2.5  
!assign (resid 51 and name HD1#) (resid 95 and name HE1) 4.0 2.2 1.0
assign (resid   51 and  name HD2# )(resid   95 and  name HE2  ) 4.0 3.7 2.5  
!assign (resid 51 and name HD1#) (resid 63 and name HB) 4.0 2.2 1.0
assign (resid   51 and  name HD2# )(resid   63 and  name HB   ) 4.0 3.7 2.5  
!assign (resid 51 and name HG) (resid 95 and name HZ) 4.0 2.2 1.0
!assign (resid 51 and name HG) (resid 95 and name HE2) 4.0 2.2 1.0
!assign (resid 51 and name HD1#) (resid 92 and name HA) 4.0 2.2 1.0
assign (resid   51 and  name HD2# )(resid   92 and  name HA   ) 4.0 3.7 2.5  
!assign (resid 51 and name HD*) (resid 95 and name HZ) 4.0 2.2 1.0
assign (resid   51 and  name HB2  )(resid   52 and  name HA   ) 4.0 2.2 1.0
assign (resid   51 and  name HA   )(resid   52 and  name HA   ) 4.0 2.2 1.0
assign (resid   51 and  name HD1# )(resid   60 and  name HG1# ) 4.0 4.7 3.5    
assign (resid   51 and  name HD2# )(resid   60 and  name HG1# ) 4.0 4.7 3.5    
!assign (resid 51 and name HD2#) (resid 67 and name HD1#) 3.0 1.2 0.3
!assign (resid 51 and name HD2#) (resid 67 and name HD2#) 4.0 2.2 1.0
assign (resid   51 and  name HD1# )(resid   67 and  name HD1# ) 3.0 4.2 3.3    
assign (resid   51 and  name HD1# )(resid   63 and  name HG2# ) 4.0 5.2 4.0    
assign (resid   51 and  name HD2# )(resid   92 and  name HG*  ) 4.0 6.1 4.9    
!assign (resid 51 and name HD1#) (resid 92 and name HG*) 4.0 2.2 1.0
!assign (resid 51 and name HD2#) (resid 95 and name HB2) 4.0 2.2 1.0
!assign (resid 51 and name HD2#) (resid 54 and name HB) 4.0 2.2 1.0
assign (resid   51 and  name HD1# )(resid   54 and  name HB   ) 5.0 3.5 2.5  
!assign (resid 51 and name HD1#) (resid 60 and name HB) 4.0 2.2 1.0
!assign (resid 51 and name HD2#) (resid 60 and name HB) 4.0 2.2 1.0
assign (resid   51 and  name HD1# )(resid   60 and  name HD1# ) 4.0 5.2 4.0    
assign (resid   51 and  name HD2# )(resid   60 and  name HD1# ) 4.0 5.2 4.0    
assign (resid   51 and  name HD2# )(resid   96 and  name HG2# ) 4.0 5.2 4.0    
!assign (resid 51 and name HD1#) (resid 96 and name HG2#) 4.0 2.2 1.0
assign (resid   51 and  name HB1  )(resid   60 and  name HD1# ) 4.0 3.7 2.5  
!assign (resid 51 and name HB2) (resid 60 and name HD1#) 4.0 2.2 1.0
assign (resid   51 and  name HB1  )(resid   67 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   51 and  name HB2  )(resid   67 and  name HD1# ) 4.0 3.7 2.5  
!assign (resid 51 and name HB#) (resid 95 and name HZ) 4.0 2.2 1.0
!assign (resid 51 and name HB#) (resid 95 and name HE#) 4.0 2.2 1.0
assign (resid   51 and  name HD1# )(resid   60 and  name HG2# ) 4.0 5.2 4.0    
assign (resid   51 and  name HA   )(resid   60 and  name HD1# ) 4.0 3.7 2.5  
!assign (resid 51 and name HA) (resid 52 and name HD1#) 4.0 2.2 1.0
assign (resid   51 and  name HD2# )(resid   64 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   51 and  name HB1  )(resid   54 and  name HN   ) 4.0 2.2 1.0
!assign (resid 51 and name HB2) (resid 54 and name HN) 4.0 2.2 1.0
!assign (resid 51 and name HB2) (resid 52 and name HD1#) 4.0 2.2 1.0
assign (resid   51 and  name HD2# )(resid   52 and  name HN   ) 4.0 3.7 2.5  
assign (resid   51 and  name HD2# )(resid   95 and  name HZ   ) 4.0 3.7 2.5  
!assign (resid 51 and name HG) (resid 60 and name HD1#) 4.0 2.2 1.0
!assign (resid 51 and name HD2#) (resid 95 and name HB1) 4.0 2.2 1.0
assign (resid   51 and  name HA   )(resid   54 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   51 and  name HD1# )(resid   64 and  name HG#  ) 4.0 4.7 3.5    
!!I52
assign (resid   52 and  name HN   )(resid   52 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   52 and  name HN   )(resid   52 and  name HG1# ) 4.0 3.2 2.0  
assign (resid   52 and  name HN   )(resid   52 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   52 and  name HN   )(resid   52 and  name HB   ) 3.0 1.2 0.5
assign (resid   52 and  name HA   )(resid   52 and  name HG2# ) 3.0 2.3 1.4  
assign (resid   52 and  name HA   )(resid   52 and  name HG1# ) 2.5 1.3 0.8  
assign (resid   52 and  name HA   )(resid   52 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   52 and  name HB   )(resid   52 and  name HD1# ) 3.0 2.7 1.8  
assign (resid   52 and  name HB   )(resid   53 and  name HN   ) 4.0 2.2 1.0
assign (resid   52 and  name HG11 )(resid   53 and  name HN   ) 4.0 3.2 2.0  
assign (resid   52 and  name HG12 )(resid   53 and  name HN   ) 4.0 3.2 2.0  
assign (resid   52 and  name HG2# )(resid   53 and  name HN   ) 3.0 2.7 2.0  
assign (resid   52 and  name HG1# )(resid   54 and  name HN   ) 5.0 3.0 2.0  
!assign (resid 52 and name HG12) (resid 54 and name HN) 4.0 2.2 1.0
assign (resid   52 and  name HB   )(resid   77 and  name HA   ) 4.0 2.2 1.0
assign (resid   52 and  name HG1# )(resid   77 and  name HA   ) 4.0 3.2 2.0  
assign (resid   52 and  name HG2# )(resid   77 and  name HA   ) 3.0 2.7 1.8  
assign (resid   52 and  name HA   )(resid   53 and  name HA   ) 4.0 2.2 1.0
assign (resid   52 and  name HG2# )(resid   53 and  name HA   ) 4.0 3.7 2.5  
assign (resid   52 and  name HB   )(resid   53 and  name HA   ) 4.0 2.2 1.0
!assign (resid 52 and name HG1#) (resid 53 and name HA) 4.0 2.2 1.0
assign (resid   52 and  name HB   )(resid   77 and  name HN   ) 5.0 2.0 1.0
!assign (resid 52 and name HG2#) (resid 79 and name HN) 4.0 2.2 1.0
assign (resid   52 and  name HG2# )(resid   78 and  name HN   ) 4.0 3.7 2.5  
assign (resid   52 and  name HG2# )(resid   77 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 52 and name HG1#) (resid 90 and name HA) 4.0 2.2 1.0
assign (resid   52 and  name HG1# )(resid   77 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   52 and  name HG2# )(resid   53 and  name HB2  ) 4.0 3.7 2.5  
!assign (resid 52 and name HD1#) (resid 53 and name HA) 4.0 2.2 1.0
assign (resid   52 and  name HD1# )(resid   64 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   52 and  name HD1# )(resid   64 and  name HB1  ) 4.0 3.7 2.5  
assign (resid   52 and  name HD1# )(resid   76 and  name HA   ) 4.0 3.7 2.5  
!assign (resid 52 and name HD1#) (resid 75 and name HA) 4.0 2.2 1.0
assign (resid   52 and  name HD1# )(resid   77 and  name HN   ) 4.0 3.7 2.5  
assign (resid   52 and  name HA   )(resid   64 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   52 and  name HG1# )(resid   75 and  name HA   ) 4.0 3.2 2.0  
assign (resid   52 and  name HG2# )(resid   75 and  name HA   ) 4.0 3.7 2.5  
assign (resid   52 and  name HG1# )(resid   76 and  name HA   ) 4.0 3.2 2.0  
!!N53
assign (resid   53 and  name HN   )(resid   53 and  name HB2  ) 2.5 0.7 0.4
assign (resid   53 and  name HN   )(resid   53 and  name HB1  ) 4.0 2.2 1.0
assign (resid   53 and  name HN   )(resid   54 and  name HB   ) 4.0 2.2 1.0
assign (resid   53 and  name HB1  )(resid   54 and  name HN   ) 4.0 2.2 1.0
assign (resid   53 and  name HB2  )(resid   54 and  name HN   ) 4.0 2.2 1.0
assign (resid   53 and  name HB2  )(resid   54 and  name HA   ) 4.0 2.2 1.0
assign (resid   53 and  name HA   )(resid   54 and  name HA   ) 4.0 2.2 1.0
assign (resid   53 and  name HA   )(resid   77 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   53 and  name HB2  )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   53 and  name HB1  )(resid   54 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   53 and  name HB2  )(resid   54 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   53 and  name HB1  )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
!!V54
assign (resid   54 and  name HA   )(resid   54 and  name HG1# ) 2.5 1.8 1.3  
assign (resid   54 and  name HA   )(resid   54 and  name HG2# ) 2.5 1.8 1.3  
assign (resid   54 and  name HN   )(resid   54 and  name HG2# ) 3.0 2.7 2.0  
assign (resid   54 and  name HN   )(resid   54 and  name HG1# ) 4.0 3.7 2.5  
assign (resid   54 and  name HN   )(resid   54 and  name HB   ) 3.0 1.2 0.5
assign (resid   54 and  name HG1# )(resid   55 and  name HN   ) 2.5 2.2 1.9  
assign (resid   54 and  name HG2# )(resid   55 and  name HN   ) 4.0 3.7 2.5  
assign (resid   54 and  name HG1# )(resid   56 and  name HN   ) 4.0 3.7 2.5  
assign (resid   54 and  name HG1# )(resid   57 and  name HN   ) 4.0 3.7 2.5  
assign (resid   54 and  name HG1# )(resid   57 and  name HA   ) 4.0 3.7 2.5  
assign (resid   54 and  name HA   )(resid   55 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   54 and  name HB   )(resid   57 and  name HB2  ) 4.0 2.2 1.0
assign (resid   54 and  name HA   )(resid   55 and  name HA   ) 4.0 2.2 1.0
assign (resid   54 and  name HG1# )(resid   55 and  name HA   ) 4.0 3.7 2.5  
!assign (resid 54 and name HG2#) (resid 55 and name HA) 4.0 2.2 1.0
assign (resid   54 and  name HG1# )(resid   57 and  name HB1  ) 3.0 2.7 1.8  
assign (resid   54 and  name HG1# )(resid   57 and  name HB2  ) 3.0 2.7 1.8  
assign (resid   54 and  name HG2# )(resid   57 and  name HB2  ) 4.0 3.7 2.5  
!assign (resid 54 and name HG2#) (resid 57 and name HB1) 3.0 1.2 0.3
!assign (resid 54 and name HG*) (resid 60 and name HG2#) 4.0 2.2 1.0
assign (resid   54 and  name HB   )(resid   60 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   54 and  name HG2# )(resid   60 and  name HD1# ) 4.0 5.2 4.0    
!!S55
assign (resid   55 and  name HN   )(resid   55 and  name HB#  ) 2.5 1.3 1.0  
!!G56
assign (resid   56 and  name HN   )(resid   57 and  name HB2  ) 5.0 2.0 1.0
!!C57
assign (resid   57 and  name HB1  )(resid   57 and  name HN   ) 4.0 2.2 1.0
assign (resid   57 and  name HB2  )(resid   57 and  name HN   ) 3.0 1.2 0.5
assign (resid   57 and  name HB2  )(resid   60 and  name HN   ) 4.0 2.2 1.0
assign (resid   57 and  name HA   )(resid   60 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   57 and  name HB1  )(resid   60 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   57 and  name HB2  )(resid   60 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   57 and  name HB1  )(resid   60 and  name HG1# ) 4.0 3.2 2.0  
assign (resid   57 and  name HB2  )(resid   60 and  name HG1# ) 4.0 3.2 2.0  
assign (resid   57 and  name HB1  )(resid   60 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   57 and  name HB2  )(resid   60 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   57 and  name HA   )(resid   60 and  name HG1# ) 4.0 3.2 2.0  
!!S58
assign (resid   58 and  name HN   )(resid   58 and  name HB#  ) 4.0 2.8 1.6  
assign (resid   58 and  name HB#  )(resid   59 and  name HN   ) 3.0 2.2 1.5  
assign (resid   58 and  name HB#  )(resid   60 and  name HN   ) 4.0 3.2 2.0  
assign (resid   58 and  name HB#  )(resid   61 and  name HN   ) 4.0 3.2 2.0  
assign (resid   58 and  name HB#  )(resid   61 and  name HG#  ) 4.0 4.2 3.0    
assign (resid   58 and  name HB#  )(resid   61 and  name HB#  ) 4.0 4.2 3.0    
assign (resid   58 and  name HB#  )(resid   59 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   58 and  name HA   )(resid   61 and  name HG#  ) 3.0 2.2 1.3  
assign (resid   58 and  name HA   )(resid   61 and  name HB#  ) 3.0 2.2 1.3  
!!A59
assign (resid   59 and  name HN   )(resid   59 and  name HB#  ) 2.5 1.8 1.5  
assign (resid   59 and  name HN   )(resid   60 and  name HG2# ) 4.0 3.7 2.5  
!assign (resid 59 and name HN) (resid 60 and name HB) 5.0 2.0 1.0
assign (resid   59 and  name HB#  )(resid   60 and  name HN   ) 3.0 2.7 2.0  
assign (resid   59 and  name HB#  )(resid   61 and  name HN   ) 4.0 3.7 2.5  
assign (resid   59 and  name HB#  )(resid   60 and  name HA   ) 4.0 3.7 2.5  
assign (resid   59 and  name HB#  )(resid   60 and  name HG2# ) 4.0 5.2 4.0    
!!I60
assign (resid   60 and  name HA   )(resid   60 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   60 and  name HA   )(resid   60 and  name HG2# ) 3.0 2.3 1.4  
assign (resid   60 and  name HN   )(resid   60 and  name HG2# ) 3.0 2.7 2.0  
assign (resid   60 and  name HN   )(resid   60 and  name HD1# ) 3.0 2.7 2.0  
assign (resid   60 and  name HN   )(resid   60 and  name HG1# ) 3.0 2.2 1.5  
assign (resid   60 and  name HN   )(resid   60 and  name HB   ) 4.0 2.2 1.0
assign (resid   60 and  name HA   )(resid   60 and  name HG1# ) 4.0 2.8 1.6  
assign (resid   60 and  name HB   )(resid   60 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   60 and  name HN   )(resid   61 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   60 and  name HN   )(resid   61 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   60 and  name HG1# )(resid   61 and  name HN   ) 4.0 3.2 2.0  
assign (resid   60 and  name HG2# )(resid   61 and  name HN   ) 4.0 3.7 2.5  
assign (resid   60 and  name HD1# )(resid   61 and  name HN   ) 4.0 3.7 2.5  
assign (resid   60 and  name HA   )(resid   63 and  name HB   ) 3.0 1.2 0.3
assign (resid   60 and  name HB   )(resid   63 and  name HB   ) 4.0 2.2 1.0
assign (resid   60 and  name HG1# )(resid   63 and  name HB   ) 4.0 3.2 2.0  
assign (resid   60 and  name HA   )(resid   63 and  name HA   ) 4.0 2.2 1.0
assign (resid   60 and  name HG1# )(resid   64 and  name HN   ) 4.0 3.2 2.0  
assign (resid   60 and  name HG1# )(resid   61 and  name HA   ) 4.0 3.2 2.0  
assign (resid   60 and  name HD1# )(resid   61 and  name HA   ) 4.0 3.7 2.5  
assign (resid   60 and  name HA   )(resid   62 and  name HB2  ) 4.0 2.2 1.0
assign (resid   60 and  name HG1# )(resid   64 and  name HG#  ) 4.0 4.2 3.0    
assign (resid   60 and  name HA   )(resid   63 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   60 and  name HG2# )(resid   63 and  name HB   ) 4.0 3.7 2.5  
assign (resid   60 and  name HD1# )(resid   63 and  name HB   ) 4.0 3.7 2.5  
assign (resid   60 and  name HD1# )(resid   64 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   60 and  name HD1# )(resid   64 and  name HB2  ) 5.0 3.5 2.5  
!! E61
assign (resid   61 and  name HN   )(resid   61 and  name HB#  ) 2.5 1.3 1.0  
assign (resid   61 and  name HN   )(resid   61 and  name HG#  ) 3.0 2.2 1.5  
assign (resid   61 and  name HA   )(resid   61 and  name HG#  ) 3.0 1.8 1.1  
assign (resid   61 and  name HN   )(resid   64 and  name HN   ) 4.0 2.2 1.0
assign (resid   61 and  name HB#  )(resid   62 and  name HN   ) 3.0 2.2 1.5  
assign (resid   61 and  name HG#  )(resid   62 and  name HN   ) 4.0 3.2 2.0  
assign (resid   61 and  name HB#  )(resid   63 and  name HN   ) 4.0 3.2 2.0  
assign (resid   61 and  name HB#  )(resid   62 and  name HA   ) 4.0 3.2 2.0  
assign (resid   61 and  name HB#  )(resid   62 and  name HG#  ) 4.0 4.2 3.0    
assign (resid   61 and  name HG#  )(resid   62 and  name HG#  ) 4.0 4.2 3.0    
!!K62
assign (resid   62 and  name HB#  )(resid   62 and  name HD#  ) 4.0 4.2 3.0    
assign (resid   62 and  name HN   )(resid   62 and  name HB1  ) 4.0 2.2 1.0
assign (resid   62 and  name HN   )(resid   62 and  name HB2  ) 2.5 0.7 0.4
assign (resid   62 and  name HN   )(resid   62 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   62 and  name HA   )(resid   62 and  name HG#  ) 3.0 1.8 0.9  
assign (resid   62 and  name HA   )(resid   62 and  name HD#  ) 4.0 3.2 2.0  
!assign (resid 62 and name HN) (resid 66 and name HG#) 5.0 2.0 1.0
assign (resid   62 and  name HB1  )(resid   63 and  name HN   ) 4.0 2.2 1.0
assign (resid   62 and  name HB2  )(resid   63 and  name HN   ) 3.0 1.2 0.5
!assign (resid 62 and name HG#) (resid 64 and name HN) 4.0 2.2 1.0
assign (resid   62 and  name HG#  )(resid   65 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 62 and name HG#) (resid 66 and name HN) 4.0 2.2 1.0
!assign (resid 62 and name HB1) (resid 63 and name HB) 4.0 2.2 1.0
!assign (resid 62 and name HB2) (resid 63 and name HB) 4.0 2.2 1.0
assign (resid   62 and  name HB2  )(resid   63 and  name HA   ) 4.0 2.2 1.0
assign (resid   62 and  name HA   )(resid   66 and  name HE#  ) 4.0 3.7 2.5  
assign (resid   62 and  name HG#  )(resid   66 and  name HE#  ) 4.0 4.7 3.5    
assign (resid   62 and  name HD#  )(resid   66 and  name HE#  ) 4.0 4.7 3.5    
assign (resid   62 and  name HB1  )(resid   66 and  name HE#  ) 4.0 3.7 2.5  
assign (resid   62 and  name HA   )(resid   66 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   62 and  name HB1  )(resid   66 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 62 and name HB2) (resid 66 and name HG#) 4.0 2.2 1.0
assign (resid   62 and  name HG#  )(resid   66 and  name HG#  ) 4.0 4.2 3.0    
assign (resid   62 and  name HB2  )(resid   62 and  name HE#  ) 4.0 3.2 2.0  
!!T63
assign (resid   63 and  name HA   )(resid   63 and  name HG2# ) 3.0 2.3 1.6  
assign (resid   63 and  name HN   )(resid   63 and  name HG2# ) 3.0 2.7 2.0  
assign (resid   63 and  name HN   )(resid   64 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   63 and  name HN   )(resid   64 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   63 and  name HB   )(resid   64 and  name HN   ) 3.0 1.2 0.5
assign (resid   63 and  name HG2# )(resid   64 and  name HN   ) 3.0 2.7 2.0  
assign (resid   63 and  name HB   )(resid   64 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   63 and  name HB   )(resid   66 and  name HB#  ) 5.0 3.0 2.0  
!assign (resid 63 and name HA) (resid 66 and name HA) 4.0 2.2 1.0
assign (resid   63 and  name HA   )(resid   66 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   63 and  name HA   )(resid   67 and  name HG   ) 4.0 2.2 1.0
assign (resid   63 and  name HA   )(resid   67 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   63 and  name HA   )(resid   67 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   63 and  name HB   )(resid   64 and  name HA   ) 4.0 2.2 1.0
assign (resid   63 and  name HG2# )(resid   64 and  name HA   ) 4.0 3.7 2.5  
assign (resid   63 and  name HB   )(resid   66 and  name HE#  ) 4.0 3.7 2.5  
assign (resid   63 and  name HA   )(resid   66 and  name HE#  ) 4.0 3.7 2.5  
assign (resid   63 and  name HG2# )(resid   67 and  name HG   ) 4.0 3.7 2.5  
assign (resid   63 and  name HG2# )(resid   67 and  name HD1# ) 4.0 5.2 4.0    
!assign (resid 63 and name HB) (resid 92 and name HG*) 4.0 2.2 1.0
assign (resid   63 and  name HG2# )(resid   67 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   63 and  name HG2# )(resid   64 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   63 and  name HG2# )(resid   64 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   63 and  name HB   )(resid   67 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   63 and  name HB   )(resid   67 and  name HG   ) 4.0 2.2 1.0
assign (resid   63 and  name HG2# )(resid   66 and  name HN   ) 4.0 3.7 2.5  
!!Q64
assign (resid   64 and  name HG#  )(resid   64 and  name HA   ) 3.0 1.8 0.9  
assign (resid   64 and  name HB1  )(resid   64 and  name HN   ) 4.0 2.2 1.0
assign (resid   64 and  name HB2  )(resid   64 and  name HN   ) 3.0 1.2 0.5
assign (resid   64 and  name HN   )(resid   64 and  name HG#  ) 3.0 2.2 1.5  
assign (resid   64 and  name HA   )(resid   65 and  name HA   ) 4.0 2.2 1.0
!assign (resid 64 and name HN) (resid 70 and name HD#) 4.0 2.2 1.0
assign (resid   64 and  name HB2  )(resid   65 and  name HN   ) 3.0 1.2 0.5
assign (resid   64 and  name HA   )(resid   67 and  name HG   ) 4.0 2.2 1.0
assign (resid   64 and  name HA   )(resid   67 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   64 and  name HG#  )(resid   67 and  name HD1# ) 4.0 4.7 3.5    
!!R65
assign (resid   65 and  name HD#  )(resid   65 and  name HB#  ) 3.0 3.2 2.3    
assign (resid   65 and  name HN   )(resid   65 and  name HB#  ) 3.0 1.8 1.1  
assign (resid   65 and  name HA   )(resid   65 and  name HG#  ) 3.0 1.8 0.9  
assign (resid   65 and  name HN   )(resid   65 and  name HG#  ) 3.0 2.2 1.5  
assign (resid   65 and  name HA   )(resid   65 and  name HD#  ) 4.0 3.2 2.0  
!assign (resid 65 and name HN) (resid 67 and name HD*) 4.0 2.2 1.0
assign (resid   65 and  name HB#  )(resid   66 and  name HN   ) 3.0 2.2 1.5  
assign (resid   65 and  name HG#  )(resid   66 and  name HN   ) 4.0 3.2 2.0  
assign (resid   65 and  name HB#  )(resid   69 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 65 and name HG#) (resid 69 and name HN) 4.0 2.2 1.0
!!M66
assign (resid   66 and  name HN   )(resid   66 and  name HB#  ) 2.5 1.3 1.0  
assign (resid   66 and  name HN   )(resid   66 and  name HG#  ) 3.0 2.2 1.5  
assign (resid   66 and  name HA   )(resid   66 and  name HG#  ) 3.0 1.8 0.9  
assign (resid   66 and  name HA   )(resid   66 and  name HE#  ) 4.0 3.7 2.5  
assign (resid   66 and  name HN   )(resid   69 and  name HN   ) 4.0 2.2 1.0
assign (resid   66 and  name HA   )(resid   69 and  name HA#  ) 4.0 3.2 2.0  
assign (resid   66 and  name HG#  )(resid   67 and  name HN   ) 4.0 3.2 2.0  
assign (resid   66 and  name HB#  )(resid   67 and  name HN   ) 2.5 1.7 1.4  
assign (resid   66 and  name HG#  )(resid   69 and  name HN   ) 4.0 3.2 2.0  
assign (resid   66 and  name HB#  )(resid   69 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 66 and name HG#) (resid 70 and name HN) 4.0 2.2 1.0
!assign (resid 66 and name HG#) (resid 71 and name HN) 4.0 2.2 1.0
!assign (resid 66 and name HE#) (resid 70 and name HE2) 4.0 2.2 1.0
!assign (resid 66 and name HE#) (resid 70 and name HZ) 5.0 2.0 1.0
!!L67
assign (resid   67 and  name HN   )(resid   67 and  name HG   ) 2.5 0.7 0.4
assign (resid   67 and  name HN   )(resid   67 and  name HB1  ) 4.0 2.2 1.0
assign (resid   67 and  name HN   )(resid   67 and  name HB2  ) 4.0 2.2 1.0
assign (resid   67 and  name HN   )(resid   67 and  name HD1# ) 3.0 2.7 2.0  
assign (resid   67 and  name HN   )(resid   67 and  name HD2# ) 3.0 2.7 2.0  
assign (resid   67 and  name HA   )(resid   67 and  name HD2# ) 3.0 2.7 2.0  
assign (resid   67 and  name HA   )(resid   67 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   67 and  name HB2  )(resid   67 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   67 and  name HB1  )(resid   67 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   67 and  name HB2  )(resid   67 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   67 and  name HB1  )(resid   67 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   67 and  name HA   )(resid   67 and  name HG   ) 4.0 2.2 1.0
!assign (resid 67 and name HN) (resid 70 and name HB#) 4.0 2.2 1.0
assign (resid   67 and  name HN   )(resid   70 and  name HN   ) 5.0 2.0 1.0
assign (resid   67 and  name HB2  )(resid   68 and  name HN   ) 3.0 1.2 0.5
assign (resid   67 and  name HB1  )(resid   68 and  name HN   ) 4.0 2.2 1.0
assign (resid   67 and  name HG   )(resid   68 and  name HN   ) 4.0 2.2 1.0
assign (resid   67 and  name HD2# )(resid   68 and  name HN   ) 4.0 3.7 2.5  
assign (resid   67 and  name HD1# )(resid   68 and  name HN   ) 4.0 3.7 2.5  
assign (resid   67 and  name HB2  )(resid   69 and  name HN   ) 4.0 2.2 1.0
!assign (resid 67 and name HD2#) (resid 69 and name HN) 4.0 2.2 1.0
assign (resid   67 and  name HB1  )(resid   70 and  name HN   ) 4.0 2.2 1.0
assign (resid   67 and  name HD2# )(resid   70 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 67 and name HB1) (resid 71 and name HN) 4.0 2.2 1.0
!assign (resid 67 and name HD*) (resid 71 and name HN) 4.0 2.2 1.0
assign (resid   67 and  name HA   )(resid   70 and  name HD2  ) 4.0 2.2 1.0
assign (resid   67 and  name HA   )(resid   70 and  name HE2  ) 4.0 2.2 1.0
assign (resid   67 and  name HA   )(resid   70 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 67 and name HD*) (resid 95 and name HE#) 4.0 2.2 1.0
assign (resid   67 and  name HD2# )(resid   70 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   67 and  name HD2# )(resid   71 and  name HB#  ) 4.0 4.7 3.5    
!assign (resid 67 and name HD*) (resid 95 and name HZ) 4.0 2.2 1.0
assign (resid   67 and  name HB2  )(resid   68 and  name HA   ) 4.0 2.2 1.0
!!S68
assign (resid   68 and  name HN   )(resid   68 and  name HB#  ) 3.0 1.8 1.1  
assign (resid   68 and  name HN   )(resid   71 and  name HN   ) 5.0 2.0 1.0
assign (resid   68 and  name HN   )(resid   70 and  name HB#  ) 5.0 3.0 2.0  
assign (resid   68 and  name HA   )(resid   71 and  name HB#  ) 4.0 3.2 2.0  
!!G69
assign (resid   69 and  name HN   )(resid   70 and  name HD2  ) 4.0 2.2 1.0
assign (resid   69 and  name HN   )(resid   70 and  name HB#  ) 4.0 3.2 2.0  
!!F70
assign (resid   70 and  name HA   )(resid   70 and  name HE1  ) 4.0 2.2 1.0
assign (resid   70 and  name HA   )(resid   70 and  name HD1  ) 3.0 1.2 0.3
assign (resid   70 and  name HA   )(resid   70 and  name HD2  ) 4.0 2.2 1.0
assign (resid   70 and  name HN   )(resid   70 and  name HB#  ) 3.0 1.8 1.1  
assign (resid   70 and  name HN   )(resid   70 and  name HD2  ) 3.0 1.2 0.5
assign (resid   70 and  name HN   )(resid   70 and  name HE2  ) 4.0 2.2 1.0
assign (resid   70 and  name HB#  )(resid   70 and  name HE1  ) 4.0 3.2 2.0  
assign (resid   70 and  name HB#  )(resid   70 and  name HE2  ) 4.0 3.2 2.0  
assign (resid   70 and  name HB#  )(resid   70 and  name HD1  ) 4.0 3.2 2.0  
assign (resid   70 and  name HB#  )(resid   70 and  name HD2  ) 4.0 3.2 2.0  
assign (resid   70 and  name HN   )(resid   71 and  name HA   ) 5.0 2.0 1.0
assign (resid   70 and  name HN   )(resid   71 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   70 and  name HD2  )(resid   71 and  name HN   ) 4.0 2.2 1.0
assign (resid   70 and  name HB1  )(resid   71 and  name HN   ) 4.0 2.2 1.0
assign (resid   70 and  name HB2  )(resid   71 and  name HN   ) 4.0 2.2 1.0
assign (resid   70 and  name HD1  )(resid  113 and  name HA   ) 4.0 2.2 1.0
assign (resid   70 and  name HE1  )(resid  113 and  name HA   ) 5.0 2.2 1.0
!assign (resid 70 and name HZ) (resid 110 and name HA1) 4.0 2.2 1.0
!assign (resid 70 and name HZ) (resid 110 and name HA2) 4.0 2.2 1.0
assign (resid   70 and  name HA   )(resid   71 and  name HA   ) 4.0 2.2 1.0
assign (resid   70 and  name HB#  )(resid   71 and  name HA   ) 4.0 3.2 2.0  
!assign (resid 70 and name HZ) (resid 112 and name HA) 4.0 2.2 1.0
!assign (resid 70 and name HE1) (resid 106 and name HD1#) 4.0 2.2 1.0
assign (resid   70 and  name HD1  )(resid  113 and  name HN   ) 4.0 2.2 1.0
!!C71
assign (resid   71 and  name HN   )(resid   71 and  name HB#  ) 3.0 1.8 1.1  
assign (resid   71 and  name HN   )(resid   72 and  name HD#  ) 4.0 3.2 2.0  
assign (resid   71 and  name HN   )(resid   72 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   71 and  name HA   )(resid   72 and  name HD1  ) 3.0 2.2 1.3  
assign (resid   71 and  name HA   )(resid   72 and  name HD2  ) 3.0 2.2 1.3  
assign (resid   71 and  name HN   )(resid   72 and  name HB#  ) 5.0 3.0 2.0  
assign (resid   71 and  name HB#  )(resid   72 and  name HD#  ) 4.0 4.2 3.0    
!assign (resid 71 and name HB#) (resid 80 and name HZ) 4.0 2.2 1.0
assign (resid   71 and  name HA   )(resid   72 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   71 and  name HA   )(resid   72 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   71 and  name HB#  )(resid   75 and  name HG*  ) 4.0 5.6 4.4    
!assign (resid 71 and name HA) (resid 75 and name HG*) 4.0 2.2 1.0
!!P72
assign (resid   72 and  name HD#  )(resid   73 and  name HN   ) 4.0 3.2 2.0  
assign (resid   72 and  name HG#  )(resid   73 and  name HN   ) 4.0 3.2 2.0  
assign (resid   72 and  name HB#  )(resid   73 and  name HN   ) 4.0 3.2 2.0  
assign (resid   72 and  name HB#  )(resid   73 and  name HD2  ) 4.0 3.2 2.0  
assign (resid   72 and  name HB#  )(resid   73 and  name HB#  ) 4.0 4.2 3.0    
assign (resid   72 and  name HD#  )(resid   73 and  name HD2  ) 5.0 3.0 2.0  
!assign (resid 72 and name HD#) (resid 73 and name HE1) 4.0 2.2 1.0
assign (resid   72 and  name HA   )(resid   73 and  name HA   ) 4.0 2.2 1.0
!!H73
assign (resid   73 and  name HE1  )(resid   73 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   73 and  name HD2  )(resid   73 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   73 and  name HD2  )(resid   73 and  name HA   ) 4.0 2.2 1.0
assign (resid   73 and  name HN   )(resid   73 and  name HB#  ) 3.0 1.8 1.1  
assign (resid   73 and  name HA   )(resid   75 and  name HG*  ) 5.0 4.4 3.4  
assign (resid   73 and  name HA   )(resid   74 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   73 and  name HA   )(resid   74 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   73 and  name HA   )(resid   74 and  name HA   ) 4.0 2.2 1.0
!assign (resid 73 and name HN) (resid 75 and name HG*) 4.0 2.2 1.0
assign (resid   73 and  name HB#  )(resid   74 and  name HN   ) 3.0 2.2 1.5  
!assign (resid 73 and name HD2) (resid 75 and name HA) 4.0 2.2 1.0
assign (resid   73 and  name HD2  )(resid   75 and  name HG*  ) 4.0 4.6 3.4  
assign (resid   73 and  name HE1  )(resid   75 and  name HA   ) 4.0 2.2 1.0
assign (resid   73 and  name HE1  )(resid   75 and  name HG*  ) 4.0 4.6 3.4  
assign (resid   73 and  name HB#  )(resid   74 and  name HA   ) 4.0 3.2 2.0  
assign (resid   73 and  name HB#  )(resid   74 and  name HB#  ) 4.0 4.2 3.0    
assign (resid   73 and  name HB#  )(resid   74 and  name HG#  ) 4.0 4.2 3.0    
assign (resid   73 and  name HB#  )(resid   75 and  name HG*  ) 4.0 5.6 4.4    
!!K74
assign (resid   74 and  name HB#  )(resid   74 and  name HN   ) 3.0 1.8 1.1  
assign (resid   74 and  name HG#  )(resid   74 and  name HN   ) 4.0 3.2 2.0  
assign (resid   74 and  name HG#  )(resid   74 and  name HA   ) 4.0 2.8 1.6  
assign (resid   74 and  name HD#  )(resid   74 and  name HA   ) 4.0 3.2 2.0  
assign (resid   74 and  name HE#  )(resid   74 and  name HB#  ) 4.0 4.2 3.0    
assign (resid   74 and  name HD#  )(resid   74 and  name HB#  ) 4.0 4.2 3.0    
assign (resid   74 and  name HE#  )(resid   74 and  name HA   ) 4.0 3.2 2.0  
assign (resid   74 and  name HN   )(resid   75 and  name HG*  ) 4.0 4.6 3.4  
assign (resid   74 and  name HB#  )(resid   75 and  name HN   ) 4.0 3.2 2.0  
assign (resid   74 and  name HG#  )(resid   75 and  name HN   ) 4.0 3.2 2.0  
assign (resid   74 and  name HB#  )(resid   75 and  name HA   ) 4.0 3.2 2.0  
assign (resid   74 and  name HA   )(resid   75 and  name HG*  ) 4.0 4.6 3.4  
!assign (resid 74 and name HG#) (resid 113 and name HA) 4.0 2.2 1.0
!!V75
assign (resid   75 and  name HG*  )(resid   75 and  name HA   ) 2.5 1.3 0.8  
assign (resid   75 and  name HG*  )(resid   75 and  name HN   ) 3.0 2.9 2.2  
assign (resid   75 and  name HB   )(resid   75 and  name HN   ) 3.0 1.2 0.5
assign (resid   75 and  name HG*  )(resid   76 and  name HN   ) 4.0 4.6 3.4  
!assign (resid 75 and name HB) (resid 77 and name HN) 4.0 2.2 1.0
assign (resid   75 and  name HG*  )(resid   80 and  name HE2  ) 4.0 4.6 3.4  
!assign (resid 75 and name HB) (resid 77 and name HA) 4.0 2.2 1.0
assign (resid   75 and  name HG*  )(resid   76 and  name HB#  ) 4.0 5.6 4.4    
assign (resid   75 and  name HA   )(resid   76 and  name HA   ) 4.0 2.2 1.0
assign (resid   75 and  name HG*  )(resid   76 and  name HA   ) 4.0 4.6 3.4  
!assign (resid 75 and name HG*) (resid 77 and name HN) 4.0 2.2 1.0
assign (resid   75 and  name HG*  )(resid   77 and  name HA   ) 4.0 4.6 3.4  
assign (resid   75 and  name HA   )(resid   79 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   75 and  name HG*  )(resid   79 and  name HG#  ) 4.0 5.6 4.4    
!! S76
assign (resid   76 and  name HB#  )(resid   76 and  name HN   ) 3.0 1.8 1.1  

assign (resid   76 and  name HN   )(resid   77 and  name HA   ) 5.0 2.0 1.0
assign (resid   76 and  name HB1  )(resid   77 and  name HN   ) 4.0 2.2 1.0
assign (resid   76 and  name HB2  )(resid   77 and  name HN   ) 4.0 2.2 1.0
assign (resid   76 and  name HA   )(resid   77 and  name HA   ) 4.0 2.2 1.0
assign (resid   76 and  name HB1  )(resid   79 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   76 and  name HB2  )(resid   79 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   76 and  name HB1  )(resid   79 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   76 and  name HB2  )(resid   79 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   76 and  name HB1  )(resid   77 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   76 and  name HB2  )(resid   77 and  name HB#  ) 4.0 3.7 2.5  
!assign (resid 76 and name HB#) (resid 80 and name HZ) 4.0 2.2 1.0
assign (resid   76 and  name HA   )(resid   77 and  name HB#  ) 4.0 3.7 2.5  
!assign (resid 76 and name HA) (resid 83 and name HD*) 4.0 2.2 1.0
assign (resid   76 and  name HA   )(resid   79 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 76 and name HB#) (resid 80 and name HE1) 4.0 2.2 1.0
!!A77
assign (resid   77 and  name HN   )(resid   77 and  name HB#  ) 2.5 1.8 1.5  
assign (resid   77 and  name HB#  )(resid   79 and  name HN   ) 4.0 3.7 2.5  
assign (resid   77 and  name HB#  )(resid   78 and  name HN   ) 3.0 2.7 2.0  
!assign (resid 77 and name HA) (resid 83 and name HG) 4.0 2.2 1.0
!assign (resid 77 and name HA) (resid 83 and name HD*) 3.0 1.2 0.3
!assign (resid 77 and name HN) (resid 83 and name HD*) 4.0 2.2 1.0
!!G78
assign (resid   78 and  name HA#  )(resid   80 and  name HE1  ) 4.0 3.2 2.0  
assign (resid   78 and  name HN   )(resid   80 and  name HE1  ) 4.0 2.2 1.0
!assign (resid 78 and name HA#) (resid 80 and name HE#) 4.0 2.2 1.0
!!Q79
assign (resid   79 and  name HN   )(resid   79 and  name HB#  ) 4.0 2.8 1.6  
assign (resid   79 and  name HN   )(resid   79 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   79 and  name HA   )(resid   79 and  name HG#  ) 4.0 2.8 1.6  
assign (resid   79 and  name HB#  )(resid   80 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 79 and name HN) (resid 83 and name HD*) 4.0 2.2 1.0
assign (resid   79 and  name HA   )(resid   80 and  name HD1  ) 4.0 2.2 1.0
!assign (resid 79 and name HB#) (resid 80 and name HZ) 4.0 2.2 1.0
assign (resid   79 and  name HB#  )(resid   80 and  name HD1  ) 4.0 3.2 2.0  
!!F80
assign (resid   80 and  name HN   )(resid   80 and  name HB#  ) 4.0 2.8 1.6  
assign (resid   80 and  name HN   )(resid   80 and  name HD1  ) 3.0 1.2 0.5
assign (resid   80 and  name HA   )(resid   80 and  name HD2  ) 2.5 0.7 0.4
assign (resid   80 and  name HA   )(resid   80 and  name HE2  ) 4.0 2.2 1.0
assign (resid   80 and  name HB1  )(resid   80 and  name HD2  ) 3.0 1.2 0.3
assign (resid   80 and  name HB1  )(resid   81 and  name HN   ) 4.0 2.2 1.0
assign (resid   80 and  name HB2  )(resid   81 and  name HN   ) 4.0 2.2 1.0
!assign (resid 80 and name HD#) (resid 81 and name HB1) 4.0 2.2 1.0
assign (resid   80 and  name HD2  )(resid   83 and  name HB1  ) 4.0 2.2 1.0
assign (resid   80 and  name HD2  )(resid   83 and  name HB2  ) 4.0 2.2 1.0
assign (resid   80 and  name HD2  )(resid   83 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   80 and  name HD2  )(resid   83 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   80 and  name HE2  )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   80 and  name HE2  )(resid   83 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 80 and name HZ) (resid 111 and name HD#) 4.0 2.2 1.0
!assign (resid 80 and name HZ) (resid 111 and name HG#) 4.0 2.2 1.0
!assign (resid 80 and name HB1) (resid 84 and name HD2) 4.0 2.2 1.0
!assign (resid 80 and name HB2) (resid 84 and name HD2) 4.0 2.2 1.0
!assign (resid 80 and name HD2) (resid 84 and name HE1) 4.0 2.2 1.0
!assign (resid 80 and name HA) (resid 81 and name HB1) 4.0 2.2 1.0
!assign (resid 80 and name HB1) (resid 82 and name HB#) 4.0 2.2 1.0
assign (resid   80 and  name HA   )(resid   84 and  name HE1  ) 4.0 2.2 1.0
!assign (resid 80 and name HZ) (resid 110 and name HA#) 4.0 2.2 1.0
assign (resid   80 and  name HD2  )(resid   83 and  name HG   ) 4.0 2.2 1.0
assign (resid   80 and  name HA   )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   80 and  name HB1  )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   80 and  name HB1  )(resid   83 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   80 and  name HB1  )(resid   83 and  name HN   ) 4.0 2.2 1.0
assign (resid   80 and  name HD2  )(resid   83 and  name HA   ) 5.0 2.0 1.0
assign (resid   80 and  name HB2  )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
!!S81
assign (resid   81 and  name HN   )(resid   81 and  name HB2  ) 4.0 2.2 1.0
assign (resid   81 and  name HB1  )(resid   84 and  name HE1  ) 4.0 2.2 1.0
!assign (resid 81 and name HA) (resid 84 and name HD2) 4.0 2.2 1.0

!!S82
assign (resid   82 and  name HN   )(resid   82 and  name HB#  ) 4.0 2.8 1.6  
assign (resid   82 and  name HB#  )(resid   83 and  name HN   ) 4.0 3.2 2.0  
assign (resid   82 and  name HA   )(resid   84 and  name HD2  ) 4.0 2.2 1.0
assign (resid   82 and  name HA   )(resid   84 and  name HE1  ) 4.0 2.2 1.0
assign (resid   82 and  name HB#  )(resid   83 and  name HD1# ) 4.0 4.7 3.5    
assign (resid   82 and  name HB#  )(resid   83 and  name HD2# ) 4.0 4.7 3.5    
!assign (resid 82 and name HB#) (resid 85 and name HG*) 4.0 2.2 1.0
!assign (resid 82 and name HB#) (resid 83 and name HG) 4.0 2.2 1.0
assign (resid   82 and  name HA   )(resid   83 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   82 and  name HA   )(resid   83 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   82 and  name HA   )(resid   83 and  name HA   ) 4.0 2.2 1.0
assign (resid   82 and  name HA   )(resid   85 and  name HG*  ) 4.0 4.6 3.4  
!!L83
assign (resid   83 and  name HN   )(resid   83 and  name HD*  ) 4.0 3.9 2.7  
assign (resid   83 and  name HN   )(resid   83 and  name HG   ) 4.0 2.2 1.0
assign (resid   83 and  name HN   )(resid   83 and  name HB#  ) 3.0 1.8 1.1  
assign (resid   83 and  name HA   )(resid   83 and  name HD*  ) 3.0 2.9 2.0  
assign (resid   83 and  name HA   )(resid   83 and  name HG   ) 3.0 1.2 0.3
assign (resid   83 and  name HB#  )(resid   83 and  name HD*  ) 2.5 3.4 2.9    
assign (resid   83 and  name HB#  )(resid   84 and  name HN   ) 4.0 3.2 2.0  
assign (resid   83 and  name HD*  )(resid   84 and  name HN   ) 4.0 4.6 3.4  
assign (resid   83 and  name HB#  )(resid   85 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 83 and name HB#) (resid 84 and name HD2) 4.0 2.2 1.0
assign (resid   83 and  name HB#  )(resid   84 and  name HE1  ) 4.0 3.2 2.0  
!assign (resid 83 and name HA) (resid 84 and name HD2) 4.0 2.2 1.0
!assign (resid 83 and name HA) (resid 84 and name HE1) 5.0 2.0 1.0
assign (resid   83 and  name HA   )(resid   84 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   83 and  name HB#  )(resid   84 and  name HA   ) 4.0 3.2 2.0  
!assign (resid 83 and name HD*) (resid 84 and name HB#) 4.0 2.2 1.0
assign (resid   83 and  name HA   )(resid   85 and  name HG*  ) 4.0 4.6 3.4  
!assign (resid 83 and name HD*) (resid 95 and name HZ) 4.0 2.2 1.0
!!H84
assign (resid   84 and  name HD2  )(resid   84 and  name HA   ) 4.0 2.2 1.0
assign (resid   84 and  name HD2  )(resid   84 and  name HB1  ) 4.0 2.2 1.0
assign (resid   84 and  name HD2  )(resid   84 and  name HB2  ) 4.0 2.2 1.0
assign (resid   84 and  name HN   )(resid   84 and  name HD2  ) 4.0 2.2 1.0
assign (resid   84 and  name HN   )(resid   84 and  name HB1  ) 4.0 2.2 1.0
assign (resid   84 and  name HN   )(resid   84 and  name HB2  ) 3.0 1.2 0.5
assign (resid   84 and  name HB1  )(resid   85 and  name HN   ) 4.0 2.2 1.0
assign (resid   84 and  name HB2  )(resid   85 and  name HN   ) 4.0 2.2 1.0
!assign (resid 84 and name HD2) (resid 87 and name HB1) 4.0 2.2 1.0
assign (resid   84 and  name HA   )(resid   85 and  name HG*  ) 4.0 4.6 3.4  
!assign (resid 84 and name HD2) (resid 85 and name HA) 5.0 2.0 1.0
assign (resid   84 and  name HD2  )(resid   85 and  name HG*  ) 4.0 4.6 3.4  
!!V85
assign (resid   85 and  name HA   )(resid   85 and  name HG*  ) 3.0 1.8 0.9  
assign (resid   85 and  name HN   )(resid   85 and  name HG*  ) 2.5 2.4 2.1  
assign (resid   85 and  name HN   )(resid   85 and  name HB   ) 4.0 2.2 1.0
assign (resid   85 and  name HB   )(resid   86 and  name HN   ) 4.0 2.2 1.0
assign (resid   85 and  name HG*  )(resid   86 and  name HN   ) 3.0 3.6 2.9  
assign (resid   85 and  name HG*  )(resid   87 and  name HN   ) 4.0 4.6 3.4  
assign (resid   85 and  name HA   )(resid   86 and  name HB2  ) 4.0 2.2 1.0
assign (resid   85 and  name HG*  )(resid   87 and  name HB2  ) 4.0 4.6 3.4  
!!R86
assign (resid   86 and  name HN   )(resid   86 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   86 and  name HN   )(resid   86 and  name HB2  ) 4.0 2.2 1.0
assign (resid   86 and  name HN   )(resid   86 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 86 and name HN) (resid 87 and name HB2) 4.0 2.2 1.0
assign (resid   86 and  name HB2  )(resid   87 and  name HN   ) 4.0 2.2 1.0
assign (resid   86 and  name HB1  )(resid   87 and  name HN   ) 4.0 2.2 1.0
!!D87
assign (resid   87 and  name HN   )(resid   87 and  name HB#  ) 3.0 1.8 1.1  
assign (resid   87 and  name HB2  )(resid   88 and  name HN   ) 4.0 2.2 1.0
assign (resid   87 and  name HB1  )(resid   88 and  name HN   ) 3.0 1.2 0.5
assign (resid   87 and  name HA   )(resid   88 and  name HG2# ) 4.0 3.7 2.5  
!!T88
assign (resid   88 and  name HA   )(resid   88 and  name HG2# ) 3.0 2.3 1.4  
assign (resid   88 and  name HN   )(resid   88 and  name HG2# ) 3.0 2.7 2.0  
assign (resid   88 and  name HN   )(resid   88 and  name HB   ) 4.0 2.2 1.0
!assign (resid 88 and name HN) (resid 90 and name HD1#) 4.0 2.2 1.0
assign (resid   88 and  name HB   )(resid   89 and  name HN   ) 4.0 2.2 1.0
assign (resid   88 and  name HG2# )(resid   89 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 88 and name HB) (resid 90 and name HD1#) 4.0 2.2 1.0
!assign (resid 88 and name HA) (resid 90 and name HD1#) 4.0 2.2 1.0
assign (resid   88 and  name HA   )(resid   90 and  name HG2# ) 5.0 3.5 2.5  
assign (resid   88 and  name HA   )(resid   89 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   88 and  name HA   )(resid   89 and  name HA   ) 4.0 2.2 1.0
!assign (resid 88 and name HG2#) (resid 89 and name HA) 4.0 2.2 1.0
assign (resid   88 and  name HB   )(resid   90 and  name HG2# ) 4.0 3.7 2.5  
!!K89
assign (resid   89 and  name HA   )(resid   89 and  name HD#  ) 4.0 3.2 2.0  
assign (resid   89 and  name HA   )(resid   89 and  name HE#  ) 4.0 3.2 2.0  
assign (resid   89 and  name HN   )(resid   89 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   89 and  name HN   )(resid   89 and  name HD#  ) 4.0 3.2 2.0  
assign (resid   89 and  name HN   )(resid   89 and  name HE#  ) 4.0 3.2 2.0  
assign (resid   89 and  name HB2  )(resid   89 and  name HN   ) 3.0 1.2 0.5
assign (resid   89 and  name HA   )(resid   89 and  name HG#  ) 3.0 1.8 0.9  
assign (resid   89 and  name HB1  )(resid   89 and  name HD#  ) 4.0 3.2 2.0  
assign (resid   89 and  name HB2  )(resid   89 and  name HD#  ) 4.0 3.2 2.0  
assign (resid   89 and  name HA   )(resid   90 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   89 and  name HG#  )(resid   90 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 89 and name HG#) (resid 91 and name HN) 5.0 2.0 1.0
!!I90
assign (resid   90 and  name HN   )(resid   90 and  name HB   ) 4.0 2.2 1.0
assign (resid   90 and  name HG1# )(resid   90 and  name HN   ) 3.0 2.2 1.5  
assign (resid   90 and  name HN   )(resid   90 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   90 and  name HN   )(resid   90 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   90 and  name HA   )(resid   90 and  name HG1# ) 4.0 2.8 1.6  
assign (resid   90 and  name HA   )(resid   90 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   90 and  name HA   )(resid   90 and  name HG2# ) 3.0 2.3 1.4  
assign (resid   90 and  name HB   )(resid   90 and  name HD1# ) 2.5 2.2 1.7  
assign (resid   90 and  name HN   )(resid   91 and  name HA   ) 5.0 2.0 1.0
assign (resid   90 and  name HB   )(resid   91 and  name HN   ) 3.0 1.2 0.5
assign (resid   90 and  name HG1# )(resid   91 and  name HN   ) 4.0 3.2 2.0  
assign (resid   90 and  name HG2# )(resid   91 and  name HN   ) 4.0 3.7 2.5  
assign (resid   90 and  name HD1# )(resid   91 and  name HN   ) 4.0 3.7 2.5  
!assign (resid 90 and name HN) (resid 95 and name HN) 4.0 2.2 1.0
!assign (resid 90 and name HD1#) (resid 95 and name HN) 3.0 1.2 0.5
assign (resid   90 and  name HD1# )(resid   95 and  name HE1  ) 4.0 3.7 2.5  
!assign (resid 90 and name HG2#) (resid 95 and name HE#) 3.0 1.2 0.3
!assign (resid 90 and name HD1#) (resid 95 and name HZ) 4.0 2.2 1.0
!assign (resid 90 and name HG2#) (resid 95 and name HD#) 4.0 2.2 1.0
!assign (resid 90 and name HG2#) (resid 95 and name HZ) 4.0 2.2 1.0
!assign (resid 90 and name HG1#) (resid 95 and name HZ) 4.0 2.2 1.0
assign (resid   90 and  name HG1# )(resid   95 and  name HD1  ) 4.0 3.2 2.0  
assign (resid   90 and  name HG1# )(resid   95 and  name HE1  ) 4.0 3.2 2.0  
assign (resid   90 and  name HD1# )(resid   95 and  name HA   ) 3.0 2.7 1.8  
!assign (resid 90 and name HG2#) (resid 95 and name HA) 3.0 1.2 0.3
assign (resid   90 and  name HA   )(resid   91 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 90 and name HA) (resid 91 and name HB1) 4.0 2.2 1.0
assign (resid   90 and  name HA   )(resid   94 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 90 and name HB) (resid 91 and name HA) 4.0 2.2 1.0
assign (resid   90 and  name HG1# )(resid   95 and  name HA   ) 4.0 3.2 2.0  
assign (resid   90 and  name HB   )(resid   94 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   90 and  name HG2# )(resid   94 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   90 and  name HD1# )(resid   94 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   90 and  name HB   )(resid   94 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   90 and  name HD1# )(resid   94 and  name HB#  ) 3.0 3.7 2.8    
assign (resid   90 and  name HG1# )(resid   94 and  name HB#  ) 4.0 4.2 3.0    
assign (resid   90 and  name HG1# )(resid   91 and  name HA   ) 4.0 3.2 2.0  
assign (resid   90 and  name HG1# )(resid   92 and  name HA   ) 4.0 3.2 2.0  
!assign (resid 90 and name HG1#) (resid 95 and name HB1) 4.0 2.2 1.0
assign (resid   90 and  name HG1# )(resid   95 and  name HB2  ) 4.0 3.2 2.0  
assign (resid   90 and  name HG1# )(resid   94 and  name HG#  ) 4.0 4.2 3.0    
!assign (resid 90 and name HD1#) (resid 95 and name HB1) 4.0 2.2 1.0
assign (resid   90 and  name HD1# )(resid   95 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   90 and  name HD1# )(resid   95 and  name HD1  ) 3.0 2.7 1.8  
assign (resid   90 and  name HD1# )(resid   92 and  name HA   ) 4.0 3.7 2.5  
assign (resid   90 and  name HD1# )(resid   98 and  name HB2  ) 4.0 3.7 2.5  
assign (resid   90 and  name HD1# )(resid   95 and  name HN   ) 3.0 2.7 2.0  
assign (resid   90 and  name HD1# )(resid   98 and  name HN   ) 4.0 3.7 2.5  
assign (resid   90 and  name HD1# )(resid   94 and  name HN   ) 4.0 3.7 2.5  
!! E91
assign (resid   91 and  name HN   )(resid   91 and  name HB2  ) 4.0 2.2 1.0
assign (resid   91 and  name HN   )(resid   91 and  name HG#  ) 3.0 2.2 1.5  
assign (resid   91 and  name HA   )(resid   91 and  name HG#  ) 2.5 1.3 0.8  
!assign (resid 91 and name HN) (resid 94 and name HN) 4.0 2.2 1.0
assign (resid   91 and  name HB1  )(resid   92 and  name HN   ) 4.0 2.2 1.0
assign (resid   91 and  name HB2  )(resid   92 and  name HN   ) 4.0 2.2 1.0
assign (resid   91 and  name HG#  )(resid   92 and  name HN   ) 4.0 3.2 2.0  
assign (resid   91 and  name HG#  )(resid   93 and  name HN   ) 4.0 3.2 2.0  
assign (resid   91 and  name HB1  )(resid   93 and  name HN   ) 4.0 2.2 1.0
assign (resid   91 and  name HB2  )(resid   94 and  name HN   ) 4.0 2.2 1.0
assign (resid   91 and  name HB1  )(resid   93 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   91 and  name HB1  )(resid   92 and  name HG*  ) 4.0 4.6 3.4  
assign (resid   91 and  name HG#  )(resid   92 and  name HG*  ) 4.0 5.6 4.4    
assign (resid   91 and  name HA   )(resid   92 and  name HG*  ) 4.0 4.6 3.4  
assign (resid   91 and  name HB2  )(resid   93 and  name HB#  ) 4.0 3.7 2.5  
!!V92
assign (resid   92 and  name HA   )(resid   92 and  name HG*  ) 2.5 1.3 0.8  
assign (resid   92 and  name HN   )(resid   92 and  name HG*  ) 2.5 2.4 2.1  
assign (resid   92 and  name HN   )(resid   92 and  name HB   ) 3.0 1.2 0.5
!assign (resid 92 and name HN) (resid 95 and name HN) 4.0 2.2 1.0
assign (resid   92 and  name HN   )(resid   93 and  name HA   ) 5.0 2.0 1.0
!assign (resid 92 and name HN) (resid 95 and name HB1) 4.0 2.2 1.0
assign (resid   92 and  name HN   )(resid   93 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   92 and  name HB   )(resid   93 and  name HN   ) 4.0 2.2 1.0
assign (resid   92 and  name HG*  )(resid   93 and  name HN   ) 3.0 3.6 2.9  
assign (resid   92 and  name HG*  )(resid   96 and  name HN   ) 4.0 4.6 3.4  
!assign (resid 92 and name HG*) (resid 97 and name HN) 4.0 2.2 1.0
!assign (resid 92 and name HG*) (resid 94 and name HN) 4.0 2.2 1.0
!assign (resid 92 and name HG*) (resid 95 and name HN) 3.0 1.2 0.5
assign (resid   92 and  name HA   )(resid   95 and  name HD2  ) 4.0 2.2 1.0
assign (resid   92 and  name HA   )(resid   93 and  name HA   ) 4.0 2.2 1.0
assign (resid   92 and  name HB   )(resid   93 and  name HA   ) 4.0 2.2 1.0
assign (resid   92 and  name HA   )(resid   93 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   92 and  name HG*  )(resid   95 and  name HD2  ) 4.0 4.6 3.4  
assign (resid   92 and  name HG*  )(resid   95 and  name HB1  ) 4.0 4.6 3.4  
assign (resid   92 and  name HG*  )(resid   95 and  name HB2  ) 4.0 4.6 3.4  
assign (resid   92 and  name HB   )(resid   96 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   92 and  name HG*  )(resid   96 and  name HG2# ) 4.0 6.1 4.9    
assign (resid   92 and  name HG*  )(resid   93 and  name HA   ) 4.0 4.6 3.4  
assign (resid   92 and  name HG*  )(resid   96 and  name HB   ) 4.0 4.6 3.4  
assign (resid   92 and  name HG*  )(resid   93 and  name HB#  ) 4.0 6.1 4.9    
!!A93
assign (resid   93 and  name HN   )(resid   93 and  name HB#  ) 2.5 1.8 1.5  
assign (resid   93 and  name HN   )(resid   96 and  name HN   ) 5.0 2.0 1.0
!assign (resid 93 and name HN) (resid 96 and name HG1#) 4.0 2.2 1.0
assign (resid   93 and  name HN   )(resid   96 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   93 and  name HB#  )(resid   94 and  name HN   ) 3.0 2.7 2.0  
!assign (resid 93 and name HB#) (resid 96 and name HA) 4.0 2.2 1.0
assign (resid   93 and  name HA   )(resid   96 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   93 and  name HB#  )(resid   96 and  name HB   ) 4.0 3.7 2.5  
assign (resid   93 and  name HB#  )(resid   94 and  name HB#  ) 4.0 4.7 3.5    
assign (resid   93 and  name HB#  )(resid   96 and  name HG2# ) 4.0 5.2 4.0    
assign (resid   93 and  name HB#  )(resid   97 and  name HE#  ) 4.0 4.7 3.5    
assign (resid   93 and  name HB#  )(resid   94 and  name HG#  ) 4.0 4.7 3.5    
!!Q94
assign (resid   94 and  name HN   )(resid   94 and  name HB#  ) 2.5 1.3 1.0  
assign (resid   94 and  name HN   )(resid   94 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   94 and  name HA   )(resid   94 and  name HG#  ) 3.0 1.8 0.9  
assign (resid   94 and  name HA   )(resid   97 and  name HD#  ) 4.0 3.2 2.0  
!assign (resid 94 and name HN) (resid 95 and name HB1) 4.0 2.2 1.0
assign (resid   94 and  name HN   )(resid   95 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 94 and name HN) (resid 96 and name HG1#) 4.0 2.2 1.0
assign (resid   94 and  name HN   )(resid   96 and  name HG2# ) 4.0 3.7 2.5  
!assign (resid 94 and name HN) (resid 101 and name HD*) 4.0 2.2 1.0
assign (resid   94 and  name HB1  )(resid   95 and  name HN   ) 4.0 2.2 1.0
assign (resid   94 and  name HB2  )(resid   95 and  name HN   ) 4.0 2.2 1.0
assign (resid   94 and  name HG#  )(resid   95 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 94 and name HN) (resid 98 and name HN) 5.0 2.0 1.0
assign (resid   94 and  name HA   )(resid   97 and  name HE#  ) 4.0 3.2 2.0  
assign (resid   94 and  name HG#  )(resid   97 and  name HE#  ) 4.0 4.2 3.0    
!assign (resid 94 and name HG#) (resid 95 and name HB2) 4.0 2.2 1.0
assign (resid   94 and  name HB#  )(resid   95 and  name HA   ) 4.0 3.2 2.0  
assign (resid   94 and  name HG#  )(resid   97 and  name HD#  ) 4.0 4.2 3.0    
!assign (resid 94 and name HB#) (resid 95 and name HD1) 4.0 2.2 1.0
!!F95
assign (resid   95 and  name HB1  )(resid   95 and  name HD2  ) 3.0 1.2 0.3
assign (resid   95 and  name HB1  )(resid   95 and  name HN   ) 4.0 2.2 1.0
assign (resid   95 and  name HB2  )(resid   95 and  name HN   ) 3.0 1.2 0.5
assign (resid   95 and  name HN   )(resid   95 and  name HD1  ) 4.0 2.2 1.0
assign (resid   95 and  name HB#  )(resid   95 and  name HE1  ) 4.0 3.2 2.0  
assign (resid   95 and  name HB#  )(resid   95 and  name HE2  ) 4.0 3.2 2.0  
assign (resid   95 and  name HA   )(resid   95 and  name HD1  ) 3.0 1.2 0.3
assign (resid   95 and  name HA   )(resid   95 and  name HE1  ) 5.0 2.0 1.0
assign (resid   95 and  name HD2  )(resid   96 and  name HN   ) 4.0 2.2 1.0
!assign (resid 95 and name HD#) (resid 97 and name HN) 3.0 1.2 0.5
!assign (resid 95 and name HD#) (resid 98 and name HN) 3.0 1.2 0.5
assign (resid   95 and  name HB1  )(resid   96 and  name HN   ) 3.0 1.2 0.5
assign (resid   95 and  name HB2  )(resid   96 and  name HN   ) 4.0 2.2 1.0
!assign (resid 95 and name HB1) (resid 97 and name HN) 4.0 2.2 1.0
assign (resid   95 and  name HD2  )(resid   99 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 95 and name HE2) (resid 99 and name HB2) 4.0 2.2 1.0
assign (resid   95 and  name HE2  )(resid   99 and  name HD*  ) 4.0 4.6 3.4  
!assign (resid 95 and name HZ) (resid 99 and name HD*) 4.0 2.2 1.0
!assign (resid 95 and name HD#) (resid 96 and name HB) 4.0 2.2 1.0
!assign (resid 95 and name HD#) (resid 96 and name HG*) 4.0 2.2 1.0
!assign (resid 95 and name HE#) (resid 96 and name HG*) 4.0 2.2 1.0
!assign (resid 95 and name HA) (resid 99 and name HB1) 4.0 2.2 1.0
assign (resid   95 and  name HA   )(resid   99 and  name HB2  ) 4.0 2.2 1.0
assign (resid   95 and  name HA   )(resid   96 and  name HA   ) 4.0 2.2 1.0
!assign (resid 95 and name HA) (resid 99 and name HG) 4.0 2.2 1.0
assign (resid   95 and  name HB1  )(resid   96 and  name HG2# ) 4.0 3.7 2.5  
assign (resid   95 and  name HB2  )(resid   96 and  name HG2# ) 4.0 3.7 2.5  
!assign (resid 95 and name HB1) (resid 96 and name HA) 4.0 2.2 1.0
!assign (resid 95 and name HB2) (resid 96 and name HA) 4.0 2.2 1.0
assign (resid   95 and  name HD2  )(resid   99 and  name HD*  ) 4.0 4.6 3.4  
assign (resid   95 and  name HD2  )(resid   96 and  name HB   ) 4.0 2.2 1.0
assign (resid   95 and  name HD2  )(resid   96 and  name HG1# ) 4.0 3.7 2.5  
assign (resid   95 and  name HE2  )(resid   96 and  name HG1# ) 4.0 3.7 2.5  
!!V96
assign (resid   96 and  name HN   )(resid   96 and  name HG2# ) 2.5 2.2 1.9  
assign (resid   96 and  name HN   )(resid   96 and  name HG1# ) 4.0 3.7 2.5  
assign (resid   96 and  name HN   )(resid   96 and  name HB   ) 3.0 1.2 0.5
assign (resid   96 and  name HA   )(resid   96 and  name HG1# ) 3.0 2.3 1.4  
assign (resid   96 and  name HA   )(resid   96 and  name HG2# ) 3.0 2.3 1.4  
assign (resid   96 and  name HN   )(resid   99 and  name HN   ) 4.0 2.2 1.0
assign (resid   96 and  name HN   )(resid   97 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   96 and  name HN   )(resid   97 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   96 and  name HB   )(resid   97 and  name HN   ) 3.0 1.2 0.3
assign (resid   96 and  name HG1# )(resid   97 and  name HN   ) 4.0 3.7 2.5  
assign (resid   96 and  name HG2# )(resid   97 and  name HN   ) 3.0 2.7 1.8  
!assign (resid 96 and name HG*) (resid 102 and name HE1) 4.0 2.2 1.0
assign (resid   96 and  name HA   )(resid   97 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 96 and name HG1#) (resid 97 and name HA) 4.0 2.2 1.0
assign (resid   96 and  name HG2# )(resid   97 and  name HA   ) 4.0 3.7 2.5  
!assign (resid 96 and name HA) (resid 103 and name HD*) 4.0 2.2 1.0
assign (resid   96 and  name HA   )(resid   99 and  name HD*  ) 4.0 4.6 3.4  
!assign (resid 96 and name HG1#) (resid 100 and name HD1#) 3.0 1.2 0.3
assign (resid   96 and  name HG2# )(resid   97 and  name HB#  ) 4.0 4.7 3.5    
!assign (resid 96 and name HG2#) (resid 97 and name HD#) 4.0 2.2 1.0
assign (resid   96 and  name HG2# )(resid   97 and  name HG#  ) 4.0 4.7 3.5    
assign (resid   96 and  name HG1# )(resid   97 and  name HA   ) 4.0 3.7 2.5  
!!K97
assign (resid   97 and  name HB#  )(resid   97 and  name HE#  ) 4.0 4.2 3.0    
assign (resid   97 and  name HN   )(resid   97 and  name HG#  ) 4.0 3.2 2.0  
assign (resid   97 and  name HN   )(resid   97 and  name HD#  ) 4.0 3.2 2.0  
assign (resid   97 and  name HN   )(resid   97 and  name HB#  ) 2.5 1.3 1.0  
assign (resid   97 and  name HA   )(resid   97 and  name HD#  ) 4.0 3.2 2.0  
assign (resid   97 and  name HB#  )(resid   97 and  name HD#  ) 3.0 3.2 2.3    
assign (resid   97 and  name HN   )(resid  100 and  name HN   ) 4.0 2.2 1.0
assign (resid   97 and  name HN   )(resid   98 and  name HA   ) 5.0 2.0 1.0
!assign (resid 97 and name HN) (resid 98 and name HB1) 5.0 2.0 1.0
assign (resid   97 and  name HN   )(resid   98 and  name HB2  ) 5.0 2.0 1.0
assign (resid   97 and  name HB#  )(resid   98 and  name HN   ) 2.5 1.7 1.4  
assign (resid   97 and  name HG#  )(resid   98 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 97 and name HA) (resid 102 and name HE1) 4.0 2.2 1.0
!assign (resid 97 and name HA) (resid 100 and name HD1#) 4.0 2.2 1.0
assign (resid   97 and  name HA   )(resid  100 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   97 and  name HA   )(resid   98 and  name HA   ) 4.0 2.2 1.0
assign (resid   97 and  name HB#  )(resid   98 and  name HA   ) 4.0 3.2 2.0  
!assign (resid 97 and name HB#) (resid 101 and name HD1#) 4.0 2.2 1.0
assign (resid   97 and  name HB#  )(resid  101 and  name HD2# ) 4.0 4.7 3.5    
!assign (resid 97 and name HN) (resid 100 and name HD2#) 4.0 2.2 1.0
!!D98
assign (resid   98 and  name HB1  )(resid   98 and  name HN   ) 4.0 2.2 1.0
assign (resid   98 and  name HB2  )(resid   98 and  name HN   ) 3.0 1.2 0.5
assign (resid   98 and  name HB1  )(resid   99 and  name HN   ) 4.0 2.2 1.0
assign (resid   98 and  name HB2  )(resid   99 and  name HN   ) 3.0 1.2 0.5
!assign (resid 98 and name HB1) (resid 100 and name HN) 4.0 2.2 1.0
assign (resid   98 and  name HB2  )(resid  100 and  name HN   ) 4.0 2.2 1.0
assign (resid   98 and  name HN   )(resid   99 and  name HB2  ) 5.0 2.0 1.0
!assign (resid 98 and name HN) (resid 101 and name HD1#) 4.0 2.2 1.0
!assign (resid 98 and name HB1) (resid 101 and name HN) 4.0 2.2 1.0
!assign (resid 98 and name HB2) (resid 101 and name HN) 4.0 2.2 1.0
assign (resid   98 and  name HA   )(resid   99 and  name HA   ) 4.0 2.2 1.0
assign (resid   98 and  name HA   )(resid  101 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   98 and  name HA   )(resid  101 and  name HD2# ) 4.0 3.7 2.5  
assign (resid   98 and  name HA   )(resid  101 and  name HG   ) 4.0 2.2 1.0
!assign (resid 98 and name HB1) (resid 101 and name HD1#) 4.0 2.2 1.0
!assign (resid 98 and name HB2) (resid 99 and name HD2#) 4.0 2.2 1.0
!!L99
assign (resid   99 and  name HN   )(resid   99 and  name HB2  ) 2.5 0.7 0.4
assign (resid   99 and  name HD*  )(resid   99 and  name HB1  ) 3.0 2.9 2.0  
assign (resid   99 and  name HD*  )(resid   99 and  name HB2  ) 3.0 2.9 2.0  
!assign (resid 99 and name HN) (resid 99 and name HB1) 3.0 1.2 0.5
assign (resid   99 and  name HA   )(resid   99 and  name HD*  ) 2.5 2.4 1.9  
assign (resid   99 and  name HN   )(resid   99 and  name HD*  ) 4.0 3.9 2.7  
assign (resid   99 and  name HN   )(resid   99 and  name HG   ) 4.0 2.2 1.0
assign (resid   99 and  name HA   )(resid   99 and  name HG   ) 4.0 2.2 1.0
!assign (resid 99 and name HN) (resid 102 and name HN) 4.0 2.2 1.0
assign (resid   99 and  name HN   )(resid  100 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 99 and name HN) (resid 100 and name HB2) 4.0 2.2 1.0
!assign (resid 99 and name HD*) (resid 100 and name HN) 3.0 1.2 0.5
assign (resid   99 and  name HB1  )(resid  100 and  name HN   ) 4.0 2.2 1.0
!assign (resid 99 and name HB2) (resid 101 and name HN) 4.0 2.2 1.0
assign (resid   99 and  name HB2  )(resid  102 and  name HN   ) 5.0 2.0 1.0
!assign (resid 99 and name HB2) (resid 103 and name HN) 4.0 2.2 1.0
!assign (resid 99 and name HG) (resid 102 and name HN) 4.0 2.2 1.0
assign (resid   99 and  name HA   )(resid  102 and  name HD2  ) 4.0 2.2 1.0
!assign (resid 99 and name HG) (resid 102 and name HD2) 4.0 2.2 1.0
assign (resid   99 and  name HD*  )(resid  102 and  name HD2  ) 4.0 4.6 3.4  
!assign (resid 99 and name HD*) (resid 102 and name HE1) 4.0 2.2 1.0
!assign (resid 99 and name HG) (resid 102 and name HB1) 4.0 2.2 1.0
assign (resid   99 and  name HG   )(resid  103 and  name HD1# ) 4.0 3.7 2.5  
assign (resid   99 and  name HG   )(resid  103 and  name HG   ) 4.0 2.2 1.0
assign (resid   99 and  name HD*  )(resid  103 and  name HG   ) 4.0 4.6 3.4  
assign (resid   99 and  name HD*  )(resid  102 and  name HB2  ) 3.0 3.6 2.7  
!assign (resid 99 and name HD1#) (resid 102 and name HA) 4.0 2.2 1.0
assign (resid   99 and  name HD*  )(resid  102 and  name HB1  ) 4.0 4.6 3.4  
!!L100
assign (resid  100 and  name HD2# )(resid  100 and  name HB2  ) 3.0 2.7 1.8  
assign (resid  100 and  name HD2# )(resid  100 and  name HB1  ) 3.0 2.7 1.8  
assign (resid  100 and  name HD1# )(resid  100 and  name HB1  ) 3.0 2.7 1.8  
assign (resid  100 and  name HN   )(resid  100 and  name HB1  ) 2.5 0.7 0.4
assign (resid  100 and  name HN   )(resid  100 and  name HB2  ) 2.5 0.7 0.4
assign (resid  100 and  name HN   )(resid  100 and  name HD1# ) 4.0 3.7 2.5  
assign (resid  100 and  name HN   )(resid  100 and  name HD2# ) 4.0 3.7 2.5  
assign (resid  100 and  name HA   )(resid  100 and  name HD1# ) 3.0 2.7 1.8  
assign (resid  100 and  name HA   )(resid  100 and  name HD2# ) 3.0 2.7 1.8  
assign (resid  100 and  name HA   )(resid  100 and  name HG   ) 3.0 1.2 0.3
!assign (resid 100 and name HN) (resid 102 and name HB#) 4.0 2.2 1.0
assign (resid  100 and  name HB1  )(resid  101 and  name HN   ) 2.5 0.7 0.4
!assign (resid 100 and name HB1) (resid 103 and name HN) 4.0 2.2 1.0
assign (resid  100 and  name HB2  )(resid  103 and  name HN   ) 5.0 2.0 1.0
assign (resid  100 and  name HD1# )(resid  103 and  name HN   ) 4.0 3.7 2.5  
assign (resid  100 and  name HD1# )(resid  104 and  name HN   ) 4.0 3.7 2.5  
assign (resid  100 and  name HD1# )(resid  104 and  name HD#  ) 3.0 3.7 2.8    
!assign (resid 100 and name HD2#) (resid 104 and name HD#) 3.0 1.2 0.3
assign (resid  100 and  name HA   )(resid  103 and  name HD1# ) 4.0 3.7 2.5  
assign (resid  100 and  name HB1  )(resid  103 and  name HD1# ) 4.0 3.7 2.5  
assign (resid  100 and  name HB2  )(resid  103 and  name HD1# ) 4.0 3.7 2.5  
assign (resid  100 and  name HD1# )(resid  104 and  name HE#  ) 3.0 3.7 2.8    
assign (resid  100 and  name HD1# )(resid  103 and  name HB1  ) 4.0 3.7 2.5  
assign (resid  100 and  name HD1# )(resid  103 and  name HB2  ) 3.0 2.7 1.8  
assign (resid  100 and  name HG   )(resid  104 and  name HE#  ) 4.0 3.2 2.0  
assign (resid  100 and  name HD2# )(resid  104 and  name HE#  ) 4.0 4.7 3.5    
assign (resid  100 and  name HD1# )(resid  104 and  name HG#  ) 4.0 4.7 3.5    
!!L101
assign (resid  101 and  name HB2  )(resid  101 and  name HN   ) 2.5 0.7 0.4
assign (resid  101 and  name HD2# )(resid  101 and  name HA   ) 3.0 2.7 2.0  
assign (resid  101 and  name HG   )(resid  101 and  name HN   ) 4.0 2.2 1.0
assign (resid  101 and  name HB1  )(resid  101 and  name HN   ) 4.0 2.2 1.0
assign (resid  101 and  name HG   )(resid  101 and  name HA   ) 4.0 2.2 1.0
assign (resid  101 and  name HB2  )(resid  101 and  name HD2# ) 4.0 3.7 2.5  
assign (resid  101 and  name HN   )(resid  102 and  name HB#  ) 4.0 3.2 2.0  
assign (resid  101 and  name HB2  )(resid  102 and  name HN   ) 3.0 1.2 0.5
assign (resid  101 and  name HB1  )(resid  102 and  name HN   ) 4.0 2.2 1.0
assign (resid  101 and  name HD2# )(resid  102 and  name HN   ) 4.0 3.7 2.5  
assign (resid  101 and  name HB1  )(resid  102 and  name HD2  ) 4.0 2.2 1.0
assign (resid  101 and  name HB2  )(resid  102 and  name HD2  ) 4.0 2.2 1.0
!assign (resid 101 and name HB1) (resid 102 and name HE1) 5.0 2.0 1.0
!assign (resid 101 and name HB1) (resid 103 and name HN) 4.0 2.2 1.0
assign (resid  101 and  name HB1  )(resid  102 and  name HA   ) 4.0 2.2 1.0
assign (resid  101 and  name HA   )(resid  104 and  name HE#  ) 4.0 3.2 2.0  
!assign (resid 101 and name HD2#) (resid 104 and name HE#) 4.0 2.2 1.0
assign (resid  101 and  name HD1# )(resid  104 and  name HE#  ) 4.0 4.7 3.5    
!assign (resid 101 and name HN) (resid 104 and name HE#) 4.0 2.2 1.0
!assign (resid 101 and name HD1#) (resid 105 and name HE#) 4.0 2.2 1.0
assign (resid  101 and  name HD2# )(resid  104 and  name HE#  ) 4.0 4.7 3.5    
!!H102
assign (resid  102 and  name HN   )(resid  102 and  name HB#  ) 2.5 1.3 1.0  
assign (resid  102 and  name HN   )(resid  102 and  name HD2  ) 4.0 2.2 1.0
assign (resid  102 and  name HA   )(resid  102 and  name HD2  ) 4.0 2.2 1.0
assign (resid  102 and  name HB1  )(resid  102 and  name HD2  ) 4.0 2.2 1.0
assign (resid  102 and  name HB2  )(resid  102 and  name HD2  ) 4.0 2.2 1.0
assign (resid  102 and  name HA   )(resid  102 and  name HE1  ) 4.0 2.2 1.0
assign (resid  102 and  name HN   )(resid  105 and  name HN   ) 5.0 2.0 1.0
assign (resid  102 and  name HN   )(resid  105 and  name HB#  ) 4.0 3.2 2.0  
assign (resid  102 and  name HN   )(resid  103 and  name HD1# ) 4.0 3.7 2.5  
assign (resid  102 and  name HD2  )(resid  103 and  name HN   ) 4.0 2.2 1.0
assign (resid  102 and  name HB#  )(resid  103 and  name HN   ) 2.5 1.7 1.4  
assign (resid  102 and  name HB#  )(resid  104 and  name HN   ) 4.0 3.2 2.0  
assign (resid  102 and  name HB#  )(resid  105 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 102 and name HD2) (resid 103 and name HG) 4.0 2.2 1.0
assign (resid  102 and  name HA   )(resid  105 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 102 and name HA) (resid 103 and name HD1#) 4.0 2.2 1.0
assign (resid  102 and  name HB1  )(resid  105 and  name HB#  ) 4.0 3.2 2.0  
assign (resid  102 and  name HB2  )(resid  105 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 102 and name HB1) (resid 103 and name HD1#) 4.0 2.2 1.0
assign (resid  102 and  name HB2  )(resid  103 and  name HD1# ) 4.0 3.7 2.5  
assign (resid  102 and  name HB1  )(resid  103 and  name HD2# ) 4.0 3.7 2.5  
assign (resid  102 and  name HB2  )(resid  103 and  name HD2# ) 4.0 3.7 2.5  
!assign (resid 102 and name HD2) (resid 106 and name HD*) 4.0 2.2 1.0
assign (resid  102 and  name HA   )(resid  106 and  name HD*  ) 4.0 4.6 3.4  
!assign (resid 102 and name HB2) (resid 106 and name HD*) 4.0 2.2 1.0
!assign (resid 102 and name HE1) (resid 106 and name HD*) 4.0 2.2 1.0
assign (resid  102 and  name HE1  )(resid  105 and  name HE#  ) 4.0 3.2 2.0  
assign (resid  102 and  name HA   )(resid  105 and  name HE#  ) 4.0 3.2 2.0  
assign (resid  102 and  name HE1  )(resid  105 and  name HD#  ) 4.0 3.2 2.0  
assign (resid  102 and  name HE1  )(resid  106 and  name HD*  ) 4.0 4.6 3.4  
!!L103
assign (resid  103 and  name HA   )(resid  103 and  name HG   ) 4.0 2.2 1.0
assign (resid  103 and  name HA   )(resid  103 and  name HD1# ) 4.0 3.7 2.5  
assign (resid  103 and  name HA   )(resid  103 and  name HD2# ) 2.5 2.2 1.7  
assign (resid  103 and  name HN   )(resid  103 and  name HD*  ) 2.5 2.4 2.1  
assign (resid  103 and  name HN   )(resid  103 and  name HG   ) 2.5 0.7 0.4
assign (resid  103 and  name HB1  )(resid  103 and  name HN   ) 4.0 2.2 1.0
assign (resid  103 and  name HB2  )(resid  103 and  name HN   ) 4.0 2.2 1.0
assign (resid  103 and  name HB2  )(resid  103 and  name HD1# ) 4.0 3.7 2.5  
assign (resid  103 and  name HB2  )(resid  103 and  name HD2# ) 4.0 3.7 2.5  
assign (resid  103 and  name HN   )(resid  106 and  name HN   ) 5.0 2.0 1.0
assign (resid  103 and  name HB1  )(resid  104 and  name HN   ) 4.0 2.2 1.0
assign (resid  103 and  name HB2  )(resid  104 and  name HN   ) 4.0 2.2 1.0
assign (resid  103 and  name HD*  )(resid  104 and  name HN   ) 3.0 3.6 2.9  
!assign (resid 103 and name HD*) (resid 105 and name HN) 4.0 2.2 1.0
!assign (resid 103 and name HD*) (resid 107 and name HE#) 4.0 2.2 1.0
!assign (resid 103 and name HD*) (resid 107 and name HZ) 4.0 2.2 1.0
!assign (resid 103 and name HD*) (resid 106 and name HD*) 4.0 2.2 1.0
assign (resid  103 and  name HA   )(resid  106 and  name HG   ) 4.0 2.2 1.0
!!K104
assign (resid  104 and  name HB1  )(resid  104 and  name HN   ) 2.5 0.7 0.4
assign (resid  104 and  name HD#  )(resid  104 and  name HN   ) 4.0 3.2 2.0  
assign (resid  104 and  name HE#  )(resid  104 and  name HN   ) 4.0 3.2 2.0  
assign (resid  104 and  name HE#  )(resid  104 and  name HA   ) 5.0 3.0 2.0  
assign (resid  104 and  name HG#  )(resid  104 and  name HA   ) 4.0 2.8 1.6  
assign (resid  104 and  name HE#  )(resid  104 and  name HB#  ) 4.0 4.2 3.0    
assign (resid  104 and  name HD#  )(resid  104 and  name HA   ) 4.0 3.2 2.0  
assign (resid  104 and  name HN   )(resid  105 and  name HB#  ) 4.0 3.2 2.0  
!assign (resid 104 and name HA) (resid 112 and name HE#) 4.0 2.2 1.0
assign (resid  104 and  name HA   )(resid  107 and  name HD1  ) 5.0 2.0 1.0
assign (resid  104 and  name HE#  )(resid  105 and  name HB#  ) 4.0 4.2 3.0    
!!K105
assign (resid  105 and  name HB#  )(resid  105 and  name HE#  ) 4.0 4.2 3.0    
assign (resid  105 and  name HG#  )(resid  105 and  name HN   ) 4.0 3.2 2.0  
assign (resid  105 and  name HB#  )(resid  105 and  name HN   ) 3.0 1.8 1.1  
assign (resid  105 and  name HG#  )(resid  105 and  name HA   ) 3.0 1.8 0.9  
assign (resid  105 and  name HB#  )(resid  105 and  name HG#  ) 3.0 3.2 2.3    
assign (resid  105 and  name HG#  )(resid  106 and  name HN   ) 4.0 3.2 2.0  
assign (resid  105 and  name HN   )(resid  108 and  name HN   ) 5.0 2.0 1.0
!assign (resid 105 and name HN) (resid 107 and name HB#) 4.0 2.2 1.0
assign (resid  105 and  name HN   )(resid  106 and  name HD*  ) 4.0 4.6 3.4  
assign (resid  105 and  name HG#  )(resid  109 and  name HN   ) 4.0 3.2 2.0  
assign (resid  105 and  name HG#  )(resid  106 and  name HA   ) 4.0 3.2 2.0  
assign (resid  105 and  name HG#  )(resid  108 and  name HD#  ) 4.0 4.2 3.0    
assign (resid  105 and  name HG#  )(resid  109 and  name HG#  ) 4.0 4.2 3.0    
assign (resid  105 and  name HE#  )(resid  106 and  name HD*  ) 4.0 5.6 4.4    
!!L106
!assign (resid 106 and name HB2) (resid 106 and name HD1#) 3.0 1.2 0.3
!assign (resid 106 and name HB2) (resid 106 and name HD2#) 3.0 1.2 0.3
assign (resid  106 and  name HB1  )(resid  106 and  name HD*  ) 3.0 2.9 2.0  
assign (resid  106 and  name HA   )(resid  106 and  name HD*  ) 2.5 2.4 1.9  
assign (resid  106 and  name HN   )(resid  106 and  name HG   ) 4.0 2.2 1.0
assign (resid  106 and  name HA   )(resid  106 and  name HG   ) 4.0 2.2 1.0
assign (resid  106 and  name HN   )(resid  106 and  name HD*  ) 3.0 2.9 2.2  
assign (resid  106 and  name HN   )(resid  106 and  name HB1  ) 4.0 2.2 1.0
assign (resid  106 and  name HN   )(resid  106 and  name HB2  ) 3.0 1.2 0.5
assign (resid  106 and  name HN   )(resid  107 and  name HB#  ) 4.0 3.2 2.0  
assign (resid  106 and  name HA   )(resid  111 and  name HN   ) 4.0 2.2 1.0
assign (resid  106 and  name HB1  )(resid  107 and  name HN   ) 4.0 2.2 1.0
assign (resid  106 and  name HB2  )(resid  107 and  name HN   ) 3.0 2.0 1.0
assign (resid  106 and  name HG   )(resid  107 and  name HN   ) 5.0 2.0 1.0
assign (resid  106 and  name HD*  )(resid  107 and  name HN   ) 4.0 4.6 3.4  
!assign (resid 106 and name HG) (resid 108 and name HN) 4.0 2.2 1.0
assign (resid  106 and  name HD*  )(resid  108 and  name HN   ) 4.0 4.6 3.4  
assign (resid  106 and  name HD*  )(resid  109 and  name HN   ) 4.0 4.6 3.4  
assign (resid  106 and  name HD*  )(resid  110 and  name HN   ) 4.0 4.6 3.4  
assign (resid  106 and  name HD*  )(resid  111 and  name HN   ) 4.0 4.6 3.4  
!assign (resid 106 and name HD*) (resid 112 and name HN) 4.0 2.2 1.0
assign (resid  106 and  name HD*  )(resid  111 and  name HD#  ) 4.0 5.6 4.4    
assign (resid  106 and  name HB1  )(resid  107 and  name HA   ) 4.0 2.2 1.0
assign (resid  106 and  name HB2  )(resid  107 and  name HA   ) 4.0 2.2 1.0
assign (resid  106 and  name HA   )(resid  109 and  name HG#  ) 4.0 3.2 2.0  
!assign (resid 106 and name HG) (resid 109 and name HA) 4.0 2.2 1.0
assign (resid  106 and  name HD*  )(resid  113 and  name HA   ) 4.0 4.6 3.4  
assign (resid  106 and  name HB1  )(resid  110 and  name HN   ) 4.0 2.2 1.0
!assign (resid 106 and name HB2) (resid 110 and name HN) 4.0 2.2 1.0
assign (resid  106 and  name HD*  )(resid  111 and  name HB1  ) 4.0 4.6 3.4  
assign (resid  106 and  name HD*  )(resid  111 and  name HB2  ) 4.0 4.6 3.4  
assign (resid  106 and  name HD*  )(resid  107 and  name HA   ) 4.0 4.6 3.4  
!assign (resid 106 and name HD2#) (resid 109 and name HB1) 4.0 2.2 1.0
assign (resid  106 and  name HD*  )(resid  109 and  name HB2  ) 4.0 4.6 3.4  
!assign (resid 106 and name HD2#) (resid 109 and name HG#) 4.0 2.2 1.0
assign (resid  106 and  name HB2  )(resid  112 and  name HE1  ) 4.0 2.2 1.0
assign (resid  106 and  name HB2  )(resid  112 and  name HD1  ) 4.0 2.2 1.0
!assign (resid 106 and name HD*) (resid 112 and name HD1) 4.0 2.2 1.0
!assign (resid 106 and name HD*) (resid 112 and name HB1) 4.0 2.2 1.0
!!F107
assign (resid  107 and  name HA   )(resid  107 and  name HD1  ) 2.5 0.7 0.2
assign (resid  107 and  name HN   )(resid  107 and  name HB#  ) 2.5 1.3 1.0  
assign (resid  107 and  name HN   )(resid  107 and  name HD1  ) 4.0 2.2 1.0
!assign (resid 107 and name HB2) (resid 107 and name HZ) 4.0 2.2 1.0
!assign (resid 107 and name HA) (resid 107 and name HZ) 4.0 2.2 1.0
assign (resid  107 and  name HA   )(resid  112 and  name HE1  ) 3.0 1.2 0.3
assign (resid  107 and  name HA   )(resid  112 and  name HD1  ) 4.0 2.2 1.0
assign (resid  107 and  name HN   )(resid  108 and  name HB#  ) 4.0 3.2 2.0  
assign (resid  107 and  name HD2  )(resid  108 and  name HN   ) 4.0 2.2 1.0
assign (resid  107 and  name HB#  )(resid  108 and  name HN   ) 3.0 2.2 1.5  
assign (resid  107 and  name HB#  )(resid  109 and  name HN   ) 4.0 3.2 2.0  
assign (resid  107 and  name HB#  )(resid  110 and  name HN   ) 5.0 3.0 2.0  
!assign (resid 107 and name HZ) (resid 113 and name HN) 4.0 2.2 1.0
assign (resid  107 and  name HB2  )(resid  112 and  name HZ   ) 4.0 2.2 1.0
!assign (resid 107 and name HA) (resid 108 and name HB#) 4.0 2.2 1.0
!assign (resid 107 and name HZ) (resid 110 and name HA#) 4.0 2.2 1.0
assign (resid  107 and  name HB1  )(resid  108 and  name HG#  ) 4.0 3.2 2.0  
assign (resid  107 and  name HB2  )(resid  108 and  name HG#  ) 4.0 3.2 2.0  
assign (resid  107 and  name HD2  )(resid  108 and  name HA   ) 4.0 2.2 1.0
assign (resid  107 and  name HE1  )(resid  110 and  name HA#  ) 4.0 3.2 2.0  
!!R108
assign (resid  108 and  name HB#  )(resid  108 and  name HD#  ) 2.5 2.7 2.2    
assign (resid  108 and  name HB#  )(resid  108 and  name HN   ) 2.5 1.3 1.0  
assign (resid  108 and  name HD#  )(resid  108 and  name HN   ) 4.0 3.2 2.0  
assign (resid  108 and  name HA   )(resid  108 and  name HD#  ) 4.0 3.2 2.0  
assign (resid  108 and  name HB#  )(resid  109 and  name HN   ) 2.5 1.7 1.4  
assign (resid  108 and  name HG#  )(resid  109 and  name HN   ) 4.0 3.2 2.0  
!assign (resid 108 and name HG#) (resid 110 and name HN) 4.0 2.2 1.0
!assign (resid 108 and name HA) (resid 112 and name HE#) 4.0 2.2 1.0
!assign (resid 108 and name HG#) (resid 109 and name HA) 4.0 2.2 1.0

!! E109
assign (resid  109 and  name HN   )(resid  109 and  name HG#  ) 3.0 2.2 1.3  
assign (resid  109 and  name HA   )(resid  109 and  name HG#  ) 3.0 1.8 0.9  
assign (resid  109 and  name HN   )(resid  109 and  name HB#  ) 4.0 2.8 1.6  
assign (resid  109 and  name HN   )(resid  110 and  name HA#  ) 4.0 3.2 2.0  
assign (resid  109 and  name HG#  )(resid  110 and  name HN   ) 4.0 3.2 2.0  
assign (resid  109 and  name HB1  )(resid  110 and  name HN   ) 4.0 2.2 1.0
assign (resid  109 and  name HB2  )(resid  110 and  name HN   ) 4.0 2.2 1.0
assign (resid  109 and  name HN   )(resid  111 and  name HN   ) 4.0 2.2 1.0
assign (resid  109 and  name HB2  )(resid  111 and  name HN   ) 4.0 2.2 1.0
!assign (resid 109 and name HB2) (resid 112 and name HZ) 4.0 2.2 1.0
!assign (resid 109 and name HB2) (resid 112 and name HE#) 4.0 2.2 1.0
assign (resid  109 and  name HB1  )(resid  111 and  name HG#  ) 4.0 3.2 2.0  
assign (resid  109 and  name HB1  )(resid  111 and  name HB2  ) 4.0 2.2 1.0
assign (resid  109 and  name HG#  )(resid  111 and  name HD#  ) 4.0 4.2 3.0    
assign (resid  109 and  name HA   )(resid  111 and  name HG#  ) 4.0 3.2 2.0  
assign (resid  109 and  name HB1  )(resid  111 and  name HD#  ) 4.0 3.2 2.0  
assign (resid  109 and  name HB2  )(resid  111 and  name HB2  ) 4.0 2.2 1.0
!!G110
assign (resid  110 and  name HN   )(resid  112 and  name HE2  ) 4.0 2.2 1.0
!assign (resid 110 and name HN) (resid 112 and name HD2) 4.0 2.2 1.0
!assign (resid 110 and name HN) (resid 111 and name HB2) 4.0 2.2 1.0
assign (resid  110 and  name HN   )(resid  111 and  name HG#  ) 4.0 3.2 2.0  
assign (resid  110 and  name HA1  )(resid  112 and  name HD2  ) 4.0 3.2 2.0  
assign (resid  110 and  name HA2  )(resid  112 and  name HD2  ) 4.0 3.2 2.0  
!!R111
assign (resid  111 and  name HN   )(resid  111 and  name HG#  ) 3.0 2.2 1.5  
assign (resid  111 and  name HN   )(resid  111 and  name HB2  ) 3.0 1.2 0.5
assign (resid  111 and  name HN   )(resid  111 and  name HB1  ) 4.0 2.2 1.0
assign (resid  111 and  name HN   )(resid  111 and  name HD#  ) 4.0 3.2 2.0  
assign (resid  111 and  name HA   )(resid  111 and  name HD#  ) 4.0 3.2 2.0  
assign (resid  111 and  name HB1  )(resid  111 and  name HD#  ) 4.0 3.2 2.0  
assign (resid  111 and  name HB2  )(resid  111 and  name HD#  ) 4.0 3.2 2.0  
assign (resid  111 and  name HN   )(resid  112 and  name HD1  ) 5.0 2.0 1.0
assign (resid  111 and  name HN   )(resid  112 and  name HE1  ) 5.0 2.0 1.0
assign (resid  111 and  name HB1  )(resid  112 and  name HN   ) 4.0 2.2 1.0
assign (resid  111 and  name HB2  )(resid  112 and  name HN   ) 4.0 2.2 1.0
assign (resid  111 and  name HG#  )(resid  112 and  name HN   ) 4.0 3.2 2.0  
assign (resid  111 and  name HB#  )(resid  112 and  name HA   ) 4.0 3.2 2.0  
!!F112
assign (resid  112 and  name HA   )(resid  112 and  name HE1  ) 4.0 2.2 1.0
assign (resid  112 and  name HA   )(resid  112 and  name HD1  ) 2.5 0.7 0.2
assign (resid  112 and  name HB2  )(resid  112 and  name HN   ) 2.5 0.7 0.4
assign (resid  112 and  name HB1  )(resid  112 and  name HN   ) 4.0 2.2 1.0
assign (resid  112 and  name HN   )(resid  112 and  name HD1  ) 4.0 2.2 1.0
assign (resid  112 and  name HD1  )(resid  113 and  name HN   ) 4.0 2.2 1.0
assign (resid  112 and  name HB1  )(resid  113 and  name HN   ) 4.0 2.2 1.0
!!N113
assign (resid  113 and  name HB#  )(resid  113 and  name HN   ) 4.0 2.8 1.6  
!helical restraints
!hn(i)-hn(i+1)
assign (resid    7 and  name HN   )(resid    8 and  name HN   ) 2.5 0.7 0.4
assign (resid    8 and  name HN   )(resid    9 and  name HN   ) 2.5 0.7 0.4
assign (resid    9 and  name HN   )(resid   10 and  name HN   ) 2.5 0.7 0.4
assign (resid   10 and  name HN   )(resid   11 and  name HN   ) 2.5 0.7 0.4
assign (resid   12 and  name HN   )(resid   13 and  name HN   ) 2.5 0.7 0.4
assign (resid   13 and  name HN   )(resid   14 and  name HN   ) 2.5 0.7 0.4
assign (resid   14 and  name HN   )(resid   15 and  name HN   ) 3.0 1.2 0.5
assign (resid   15 and  name HN   )(resid   16 and  name HN   ) 2.5 0.7 0.4
assign (resid   16 and  name HN   )(resid   17 and  name HN   ) 2.5 0.7 0.4
assign (resid   17 and  name HN   )(resid   18 and  name HN   ) 2.5 0.7 0.4
assign (resid   18 and  name HN   )(resid   19 and  name HN   ) 2.5 0.7 0.4
assign (resid   19 and  name HN   )(resid   20 and  name HN   ) 3.0 1.2 0.5
assign (resid   20 and  name HN   )(resid   21 and  name HN   ) 2.5 0.7 0.4
assign (resid   21 and  name HN   )(resid   22 and  name HN   ) 2.5 0.7 0.4
assign (resid   22 and  name HN   )(resid   23 and  name HN   ) 4.0 2.2 1.0
assign (resid   24 and  name HN   )(resid   25 and  name HN   ) 4.0 2.2 1.0
assign (resid   25 and  name HN   )(resid   26 and  name HN   ) 3.0 1.2 0.5
assign (resid   30 and  name HN   )(resid   31 and  name HN   ) 4.0 2.2 1.0
assign (resid   31 and  name HN   )(resid   32 and  name HN   ) 3.0 1.2 0.5
assign (resid   32 and  name HN   )(resid   33 and  name HN   ) 4.0 2.2 1.0
assign (resid   33 and  name HN   )(resid   34 and  name HN   ) 4.0 2.2 1.0
assign (resid   34 and  name HN   )(resid   35 and  name HN   ) 4.0 2.2 1.0
assign (resid   35 and  name HN   )(resid   36 and  name HN   ) 4.0 2.2 1.0
assign (resid   36 and  name HN   )(resid   37 and  name HN   ) 4.0 2.2 1.0
assign (resid   39 and  name HN   )(resid   40 and  name HN   ) 4.0 2.2 1.0
assign (resid   40 and  name HN   )(resid   41 and  name HN   ) 4.0 2.2 1.0
assign (resid   41 and  name HN   )(resid   42 and  name HN   ) 4.0 2.2 1.0
assign (resid   42 and  name HN   )(resid   43 and  name HN   ) 4.0 2.2 1.0
assign (resid   43 and  name HN   )(resid   44 and  name HN   ) 3.0 1.2 0.5
assign (resid   44 and  name HN   )(resid   45 and  name HN   ) 2.5 0.7 0.4
assign (resid   45 and  name HN   )(resid   46 and  name HN   ) 2.5 0.7 0.4
assign (resid   46 and  name HN   )(resid   47 and  name HN   ) 3.0 1.2 0.5
assign (resid   47 and  name HN   )(resid   48 and  name HN   ) 3.0 1.2 0.5
assign (resid   48 and  name HN   )(resid   49 and  name HN   ) 2.5 0.7 0.4
assign (resid   49 and  name HN   )(resid   50 and  name HN   ) 2.5 0.7 0.4
assign (resid   50 and  name HN   )(resid   51 and  name HN   ) 2.5 0.7 0.4
assign (resid   51 and  name HN   )(resid   52 and  name HN   ) 2.5 0.7 0.4
assign (resid   52 and  name HN   )(resid   53 and  name HN   ) 3.0 1.2 0.5
assign (resid   53 and  name HN   )(resid   54 and  name HN   ) 2.5 0.7 0.4
assign (resid   54 and  name HN   )(resid   55 and  name HN   ) 4.0 2.2 1.0
assign (resid   55 and  name HN   )(resid   56 and  name HN   ) 4.0 2.2 1.0
assign (resid   56 and  name HN   )(resid   57 and  name HN   ) 3.0 1.2 0.5
assign (resid   59 and  name HN   )(resid   60 and  name HN   ) 3.0 1.2 0.5
assign (resid   60 and  name HN   )(resid   61 and  name HN   ) 2.5 0.7 0.4
assign (resid   61 and  name HN   )(resid   62 and  name HN   ) 3.0 1.2 0.5
assign (resid   62 and  name HN   )(resid   63 and  name HN   ) 4.0 2.2 1.0
assign (resid   63 and  name HN   )(resid   64 and  name HN   ) 3.0 1.2 0.5
assign (resid   65 and  name HN   )(resid   66 and  name HN   ) 2.5 0.7 0.4
assign (resid   66 and  name HN   )(resid   67 and  name HN   ) 2.5 0.7 0.4
assign (resid   67 and  name HN   )(resid   68 and  name HN   ) 3.0 1.2 0.5
assign (resid   68 and  name HN   )(resid   69 and  name HN   ) 2.5 0.7 0.4
assign (resid   73 and  name HN   )(resid   74 and  name HN   ) 4.0 2.2 1.0
assign (resid   76 and  name HN   )(resid   77 and  name HN   ) 4.0 2.2 1.0
assign (resid   78 and  name HN   )(resid   79 and  name HN   ) 3.0 1.2 0.5
assign (resid   79 and  name HN   )(resid   80 and  name HN   ) 4.0 2.2 1.0
assign (resid   80 and  name HN   )(resid   81 and  name HN   ) 4.0 2.2 1.0
assign (resid   82 and  name HN   )(resid   83 and  name HN   ) 4.0 2.2 1.0
assign (resid   83 and  name HN   )(resid   84 and  name HN   ) 4.0 2.2 1.0
assign (resid   84 and  name HN   )(resid   85 and  name HN   ) 4.0 2.2 1.0
assign (resid   85 and  name HN   )(resid   86 and  name HN   ) 4.0 2.2 1.0
assign (resid   86 and  name HN   )(resid   87 and  name HN   ) 4.0 2.2 1.0
assign (resid   87 and  name HN   )(resid   88 and  name HN   ) 4.0 2.2 1.0
assign (resid   89 and  name HN   )(resid   90 and  name HN   ) 4.0 2.2 1.0
assign (resid   90 and  name HN   )(resid   91 and  name HN   ) 4.0 2.2 1.0
assign (resid   91 and  name HN   )(resid   92 and  name HN   ) 4.0 2.2 1.0
assign (resid   92 and  name HN   )(resid   93 and  name HN   ) 4.0 2.2 1.0
assign (resid   93 and  name HN   )(resid   94 and  name HN   ) 3.0 1.2 0.5
assign (resid   94 and  name HN   )(resid   95 and  name HN   ) 2.5 0.7 0.4
assign (resid   95 and  name HN   )(resid   96 and  name HN   ) 3.0 1.2 0.5
assign (resid   96 and  name HN   )(resid   97 and  name HN   ) 3.0 1.2 0.5
assign (resid   97 and  name HN   )(resid   98 and  name HN   ) 3.0 1.2 0.5
assign (resid   98 and  name HN   )(resid   99 and  name HN   ) 3.0 1.2 0.5
assign (resid   99 and  name HN   )(resid  100 and  name HN   ) 3.0 1.2 0.5
assign (resid  100 and  name HN   )(resid  101 and  name HN   ) 3.0 1.2 0.5
assign (resid  101 and  name HN   )(resid  102 and  name HN   ) 3.0 1.2 0.5
assign (resid  102 and  name HN   )(resid  103 and  name HN   ) 2.5 0.7 0.4
assign (resid  103 and  name HN   )(resid  104 and  name HN   ) 3.0 1.2 0.5
assign (resid  104 and  name HN   )(resid  105 and  name HN   ) 2.5 0.7 0.4
assign (resid  105 and  name HN   )(resid  106 and  name HN   ) 2.5 0.7 0.4
assign (resid  106 and  name HN   )(resid  107 and  name HN   ) 3.0 1.2 0.5
assign (resid  107 and  name HN   )(resid  108 and  name HN   ) 3.0 1.2 0.5
assign (resid  108 and  name HN   )(resid  109 and  name HN   ) 3.0 1.2 0.5
assign (resid  109 and  name HN   )(resid  110 and  name HN   ) 3.0 1.2 0.5
assign (resid  111 and  name HN   )(resid  112 and  name HN   ) 4.0 2.2 1.0
!hn(i)-hn(i+2)
assign (resid    8 and  name HN   )(resid   10 and  name HN   ) 4.0 2.2 1.0
assign (resid   10 and  name HN   )(resid   12 and  name HN   ) 4.0 2.2 1.0
assign (resid   16 and  name HN   )(resid   18 and  name HN   ) 4.0 2.2 1.0
assign (resid   17 and  name HN   )(resid   19 and  name HN   ) 4.0 2.2 1.0
assign (resid   18 and  name HN   )(resid   20 and  name HN   ) 4.0 2.2 1.0
assign (resid   19 and  name HN   )(resid   21 and  name HN   ) 4.0 2.2 1.0
assign (resid   20 and  name HN   )(resid   22 and  name HN   ) 4.0 2.2 1.0
assign (resid   21 and  name HN   )(resid   23 and  name HN   ) 4.0 2.2 1.0
!assign (resid 24 and name HN) (resid 26 and name HN) 4.0 2.2 1.0
assign (resid   30 and  name HN   )(resid   32 and  name HN   ) 4.0 2.2 1.0
!assign (resid 34 and name HN) (resid 36 and name HN) 4.0 2.2 1.0
assign (resid   44 and  name HN   )(resid   46 and  name HN   ) 4.0 2.2 1.0
assign (resid   46 and  name HN   )(resid   48 and  name HN   ) 4.0 2.2 1.0
assign (resid   49 and  name HN   )(resid   51 and  name HN   ) 4.0 2.2 1.0
assign (resid   50 and  name HN   )(resid   52 and  name HN   ) 4.0 2.2 1.0
assign (resid   51 and  name HN   )(resid   53 and  name HN   ) 4.0 2.2 1.0
assign (resid   52 and  name HN   )(resid   54 and  name HN   ) 4.0 2.2 1.0
!assign (resid 53 and name HN) (resid 55 and name HN) 4.0 2.2 1.0
assign (resid   59 and  name HN   )(resid   61 and  name HN   ) 4.0 2.2 1.0
assign (resid   60 and  name HN   )(resid   62 and  name HN   ) 4.0 2.2 1.0
assign (resid   61 and  name HN   )(resid   63 and  name HN   ) 4.0 2.2 1.0
assign (resid   62 and  name HN   )(resid   64 and  name HN   ) 4.0 2.2 1.0
assign (resid   64 and  name HN   )(resid   66 and  name HN   ) 4.0 2.2 1.0
assign (resid   65 and  name HN   )(resid   67 and  name HN   ) 4.0 2.2 1.0
assign (resid   66 and  name HN   )(resid   68 and  name HN   ) 4.0 2.2 1.0
assign (resid   67 and  name HN   )(resid   69 and  name HN   ) 4.0 2.2 1.0
assign (resid   68 and  name HN   )(resid   70 and  name HN   ) 4.0 2.2 1.0
!assign (resid 76 and name HN) (resid 78 and name HN) 4.0 2.2 1.0
!assign (resid 83 and name HN) (resid 85 and name HN) 4.0 2.2 1.0
!assign (resid 84 and name HN) (resid 86 and name HN) 4.0 2.2 1.0
!assign (resid 90 and name HN) (resid 92 and name HN) 4.0 2.2 1.0
!assign (resid 91 and name HN) (resid 93 and name HN) 4.0 2.2 1.0
assign (resid   92 and  name HN   )(resid   94 and  name HN   ) 4.0 2.2 1.0
assign (resid   93 and  name HN   )(resid   95 and  name HN   ) 4.0 2.2 1.0
assign (resid   94 and  name HN   )(resid   96 and  name HN   ) 4.0 2.2 1.0
assign (resid   95 and  name HN   )(resid   97 and  name HN   ) 4.0 2.2 1.0
assign (resid   96 and  name HN   )(resid   98 and  name HN   ) 4.0 2.2 1.0
assign (resid   97 and  name HN   )(resid   99 and  name HN   ) 4.0 2.2 1.0
assign (resid   98 and  name HN   )(resid  100 and  name HN   ) 4.0 2.2 1.0
assign (resid   99 and  name HN   )(resid  101 and  name HN   ) 4.0 2.2 1.0
assign (resid  100 and  name HN   )(resid  102 and  name HN   ) 4.0 2.2 1.0
assign (resid  101 and  name HN   )(resid  103 and  name HN   ) 4.0 2.2 1.0
assign (resid  102 and  name HN   )(resid  104 and  name HN   ) 4.0 2.2 1.0
assign (resid  103 and  name HN   )(resid  105 and  name HN   ) 4.0 2.2 1.0
assign (resid  104 and  name HN   )(resid  106 and  name HN   ) 4.0 2.2 1.0
assign (resid  105 and  name HN   )(resid  107 and  name HN   ) 4.0 2.2 1.0
assign (resid  106 and  name HN   )(resid  108 and  name HN   ) 4.0 2.2 1.0
assign (resid  107 and  name HN   )(resid  109 and  name HN   ) 4.0 2.2 1.0
assign (resid  108 and  name HN   )(resid  110 and  name HN   ) 4.0 2.2 1.0
!CaH(i)-hn(i+1)
assign (resid    6 and  name HA   )(resid    7 and  name HN   ) 3.0 1.2 0.5
assign (resid    8 and  name HA   )(resid    9 and  name HN   ) 4.0 2.2 1.0
assign (resid    9 and  name HA   )(resid   10 and  name HN   ) 4.0 2.2 1.0
assign (resid   10 and  name HA   )(resid   11 and  name HN   ) 4.0 2.2 1.0
assign (resid   11 and  name HA   )(resid   12 and  name HN   ) 4.0 2.2 1.0
assign (resid   12 and  name HA   )(resid   13 and  name HN   ) 4.0 2.2 1.0
assign (resid   13 and  name HA   )(resid   14 and  name HN   ) 4.0 2.2 1.0
assign (resid   14 and  name HA   )(resid   15 and  name HN   ) 4.0 2.2 1.0
assign (resid   15 and  name HA   )(resid   16 and  name HN   ) 4.0 2.2 1.0
assign (resid   16 and  name HA   )(resid   17 and  name HN   ) 4.0 2.2 1.0
assign (resid   17 and  name HA   )(resid   18 and  name HN   ) 4.0 2.2 1.0
assign (resid   18 and  name HA   )(resid   19 and  name HN   ) 4.0 2.2 1.0
assign (resid   19 and  name HA   )(resid   20 and  name HN   ) 4.0 2.2 1.0
assign (resid   20 and  name HA   )(resid   21 and  name HN   ) 4.0 2.2 1.0
assign (resid   21 and  name HA   )(resid   22 and  name HN   ) 3.0 1.2 0.5
assign (resid   22 and  name HA   )(resid   23 and  name HN   ) 3.0 1.2 0.5
!assign (resid 23 and name HA) (resid 24 and name HN) 4.0 2.2 1.0
assign (resid   24 and  name HA   )(resid   25 and  name HN   ) 3.0 1.2 0.5
assign (resid   25 and  name HA   )(resid   26 and  name HN   ) 4.0 2.2 1.0
assign (resid   28 and  name HA   )(resid   29 and  name HN   ) 3.0 1.2 0.5
assign (resid   29 and  name HA   )(resid   30 and  name HN   ) 2.5 0.7 0.4
assign (resid   30 and  name HA   )(resid   31 and  name HN   ) 2.5 0.7 0.4
assign (resid   31 and  name HA#  )(resid   32 and  name HN   ) 4.0 3.2 2.0  
assign (resid   32 and  name HA   )(resid   33 and  name HN   ) 2.5 0.7 0.4
assign (resid   33 and  name HA   )(resid   34 and  name HN   ) 2.5 0.7 0.4
assign (resid   34 and  name HA   )(resid   35 and  name HN   ) 2.5 0.7 0.4
assign (resid   35 and  name HA   )(resid   36 and  name HN   ) 2.5 0.7 0.4
assign (resid   36 and  name HA   )(resid   37 and  name HN   ) 2.5 0.7 0.4
assign (resid   37 and  name HA   )(resid   38 and  name HN   ) 2.5 0.7 0.4
assign (resid   38 and  name HA   )(resid   39 and  name HN   ) 3.0 1.2 0.5
assign (resid   39 and  name HA   )(resid   40 and  name HN   ) 2.5 0.7 0.4
assign (resid   40 and  name HA   )(resid   41 and  name HN   ) 4.0 2.2 1.0
assign (resid   41 and  name HA   )(resid   42 and  name HN   ) 4.0 2.2 1.0
assign (resid   42 and  name HA#  )(resid   43 and  name HN   ) 2.5 1.7 1.4  
assign (resid   43 and  name HA   )(resid   44 and  name HN   ) 4.0 2.2 1.0
assign (resid   44 and  name HA   )(resid   45 and  name HN   ) 4.0 2.2 1.0
assign (resid   45 and  name HA   )(resid   46 and  name HN   ) 4.0 2.2 1.0
assign (resid   46 and  name HA   )(resid   47 and  name HN   ) 4.0 2.2 1.0
assign (resid   47 and  name HA   )(resid   48 and  name HN   ) 4.0 2.2 1.0
assign (resid   48 and  name HA   )(resid   49 and  name HN   ) 4.0 2.2 1.0
assign (resid   50 and  name HA   )(resid   51 and  name HN   ) 4.0 2.2 1.0
assign (resid   51 and  name HA   )(resid   52 and  name HN   ) 4.0 2.2 1.0
assign (resid   52 and  name HA   )(resid   53 and  name HN   ) 4.0 2.2 1.0
assign (resid   53 and  name HA   )(resid   54 and  name HN   ) 3.0 1.2 0.5
assign (resid   54 and  name HA   )(resid   55 and  name HN   ) 2.5 0.7 0.4
assign (resid   55 and  name HA   )(resid   56 and  name HN   ) 2.5 0.7 0.4
assign (resid   56 and  name HA#  )(resid   57 and  name HN   ) 3.0 2.2 1.5  
assign (resid   57 and  name HA   )(resid   58 and  name HN   ) 2.5 0.7 0.4
assign (resid   59 and  name HA   )(resid   60 and  name HN   ) 4.0 2.2 1.0
assign (resid   60 and  name HA   )(resid   61 and  name HN   ) 4.0 2.2 1.0
assign (resid   61 and  name HA   )(resid   62 and  name HN   ) 4.0 2.2 1.0
assign (resid   62 and  name HA   )(resid   63 and  name HN   ) 4.0 2.2 1.0
assign (resid   63 and  name HA   )(resid   64 and  name HN   ) 4.0 2.2 1.0
assign (resid   64 and  name HA   )(resid   65 and  name HN   ) 4.0 2.2 1.0
assign (resid   66 and  name HA   )(resid   67 and  name HN   ) 4.0 2.2 1.0
assign (resid   68 and  name HA   )(resid   69 and  name HN   ) 4.0 2.2 1.0
assign (resid   69 and  name HA#  )(resid   70 and  name HN   ) 3.0 2.2 1.5  
assign (resid   70 and  name HA   )(resid   71 and  name HN   ) 3.0 1.2 0.5
assign (resid   72 and  name HA   )(resid   73 and  name HN   ) 3.0 1.2 0.5
assign (resid   73 and  name HA   )(resid   74 and  name HN   ) 2.5 0.7 0.4
assign (resid   74 and  name HA   )(resid   75 and  name HN   ) 2.5 0.7 0.4
assign (resid   75 and  name HA   )(resid   76 and  name HN   ) 2.5 0.7 0.4
assign (resid   76 and  name HA   )(resid   77 and  name HN   ) 2.5 0.7 0.4
assign (resid   78 and  name HA#  )(resid   79 and  name HN   ) 4.0 3.2 2.0  
assign (resid   79 and  name HA   )(resid   80 and  name HN   ) 2.5 0.7 0.4
assign (resid   82 and  name HA   )(resid   83 and  name HN   ) 3.0 1.2 0.5
assign (resid   83 and  name HA   )(resid   84 and  name HN   ) 3.0 1.2 0.5
assign (resid   84 and  name HA   )(resid   85 and  name HN   ) 3.0 1.2 0.5
assign (resid   85 and  name HA   )(resid   86 and  name HN   ) 3.0 1.2 0.5
assign (resid   86 and  name HA   )(resid   87 and  name HN   ) 2.5 0.7 0.4
assign (resid   87 and  name HA   )(resid   88 and  name HN   ) 3.0 1.2 0.5
assign (resid   88 and  name HA   )(resid   89 and  name HN   ) 2.5 0.7 0.4
assign (resid   89 and  name HA   )(resid   90 and  name HN   ) 2.5 0.7 0.4
assign (resid   90 and  name HA   )(resid   91 and  name HN   ) 2.5 0.7 0.4
assign (resid   91 and  name HA   )(resid   92 and  name HN   ) 2.5 0.7 0.4
assign (resid   92 and  name HA   )(resid   93 and  name HN   ) 4.0 2.2 1.0
assign (resid   95 and  name HA   )(resid   96 and  name HN   ) 4.0 2.2 1.0
assign (resid   96 and  name HA   )(resid   97 and  name HN   ) 4.0 2.2 1.0
assign (resid   97 and  name HA   )(resid   98 and  name HN   ) 4.0 2.2 1.0
assign (resid   98 and  name HA   )(resid   99 and  name HN   ) 4.0 2.2 1.0
assign (resid  101 and  name HA   )(resid  102 and  name HN   ) 4.0 2.2 1.0
assign (resid  102 and  name HA   )(resid  103 and  name HN   ) 4.0 2.2 1.0
assign (resid  106 and  name HA   )(resid  107 and  name HN   ) 4.0 2.2 1.0
assign (resid  109 and  name HA   )(resid  110 and  name HN   ) 3.0 1.2 0.5
assign (resid  110 and  name HA#  )(resid  111 and  name HN   ) 3.0 2.2 1.5  
assign (resid  111 and  name HA   )(resid  112 and  name HN   ) 2.5 0.7 0.4
!CaH(i)-hn(i+2)
assign (resid    6 and  name HA   )(resid    8 and  name HN   ) 4.0 2.2 1.0
assign (resid    9 and  name HA   )(resid   11 and  name HN   ) 4.0 2.2 1.0
assign (resid   10 and  name HA   )(resid   12 and  name HN   ) 4.0 2.2 1.0
assign (resid   11 and  name HA   )(resid   13 and  name HN   ) 4.0 2.2 1.0
assign (resid   12 and  name HA   )(resid   14 and  name HN   ) 4.0 2.2 1.0
assign (resid   13 and  name HA   )(resid   15 and  name HN   ) 4.0 2.2 1.0
assign (resid   14 and  name HA   )(resid   16 and  name HN   ) 4.0 2.2 1.0
assign (resid   15 and  name HA   )(resid   17 and  name HN   ) 4.0 2.2 1.0
assign (resid   16 and  name HA   )(resid   18 and  name HN   ) 4.0 2.2 1.0
assign (resid   17 and  name HA   )(resid   19 and  name HN   ) 4.0 2.2 1.0
assign (resid   18 and  name HA   )(resid   20 and  name HN   ) 4.0 2.2 1.0
assign (resid   21 and  name HA   )(resid   23 and  name HN   ) 4.0 2.2 1.0
assign (resid   29 and  name HA   )(resid   31 and  name HN   ) 4.0 2.2 1.0
!assign (resid 39 and name HA) (resid 41 and name HN) 4.0 2.2 1.0
assign (resid   43 and  name HA   )(resid   45 and  name HN   ) 4.0 2.2 1.0
assign (resid   44 and  name HA   )(resid   46 and  name HN   ) 4.0 2.2 1.0
assign (resid   47 and  name HA   )(resid   49 and  name HN   ) 4.0 2.2 1.0
assign (resid   51 and  name HA   )(resid   53 and  name HN   ) 4.0 2.2 1.0
assign (resid   52 and  name HA   )(resid   54 and  name HN   ) 4.0 2.2 1.0
!assign (resid 54 and name HA) (resid 56 and name HN) 4.0 2.2 1.0
assign (resid   58 and  name HA   )(resid   60 and  name HN   ) 4.0 2.2 1.0
assign (resid   60 and  name HA   )(resid   62 and  name HN   ) 4.0 2.2 1.0
assign (resid   61 and  name HA   )(resid   63 and  name HN   ) 4.0 2.2 1.0
assign (resid   67 and  name HA   )(resid   69 and  name HN   ) 4.0 2.2 1.0
assign (resid   69 and  name HA#  )(resid   71 and  name HN   ) 4.0 3.2 2.0  
assign (resid   71 and  name HA   )(resid   73 and  name HN   ) 4.0 2.2 1.0
!assign (resid 76 and name HA) (resid 78 and name HN) 4.0 2.2 1.0
assign (resid   83 and  name HA   )(resid   85 and  name HN   ) 4.0 2.2 1.0
!assign (resid 84 and name HA) (resid 86 and name HN) 5.0 2.0 1.0
assign (resid   85 and  name HA   )(resid   87 and  name HN   ) 4.0 2.2 1.0
assign (resid   91 and  name HA   )(resid   93 and  name HN   ) 4.0 2.2 1.0
assign (resid   92 and  name HA   )(resid   94 and  name HN   ) 4.0 2.2 1.0
assign (resid   94 and  name HA   )(resid   96 and  name HN   ) 4.0 2.2 1.0
assign (resid   96 and  name HA   )(resid   98 and  name HN   ) 4.0 2.2 1.0
assign (resid   97 and  name HA   )(resid   99 and  name HN   ) 4.0 2.2 1.0
assign (resid   98 and  name HA   )(resid  100 and  name HN   ) 4.0 2.2 1.0
assign (resid  102 and  name HA   )(resid  104 and  name HN   ) 4.0 2.2 1.0
assign (resid  106 and  name HA   )(resid  108 and  name HN   ) 4.0 2.2 1.0
assign (resid  109 and  name HA   )(resid  111 and  name HN   ) 4.0 2.2 1.0
!CaH(i)-hn(i+3)
assign (resid    6 and  name HA   )(resid    9 and  name HN   ) 4.0 2.2 1.0
assign (resid    8 and  name HA   )(resid   11 and  name HN   ) 4.0 2.2 1.0
assign (resid    9 and  name HA   )(resid   12 and  name HN   ) 4.0 2.2 1.0
assign (resid   10 and  name HA   )(resid   13 and  name HN   ) 4.0 2.2 1.0
assign (resid   11 and  name HA   )(resid   14 and  name HN   ) 4.0 2.2 1.0
assign (resid   12 and  name HA   )(resid   15 and  name HN   ) 4.0 2.2 1.0
assign (resid   13 and  name HA   )(resid   16 and  name HN   ) 4.0 2.2 1.0
assign (resid   14 and  name HA   )(resid   17 and  name HN   ) 4.0 2.2 1.0
assign (resid   15 and  name HA   )(resid   18 and  name HN   ) 4.0 2.2 1.0
assign (resid   16 and  name HA   )(resid   19 and  name HN   ) 4.0 2.2 1.0
assign (resid   17 and  name HA   )(resid   20 and  name HN   ) 4.0 2.2 1.0
assign (resid   18 and  name HA   )(resid   21 and  name HN   ) 4.0 2.2 1.0
assign (resid   29 and  name HA   )(resid   32 and  name HN   ) 4.0 2.2 1.0
assign (resid   44 and  name HA   )(resid   47 and  name HN   ) 4.0 2.2 1.0
assign (resid   45 and  name HA   )(resid   48 and  name HN   ) 4.0 2.2 1.0
assign (resid   46 and  name HA   )(resid   49 and  name HN   ) 4.0 2.2 1.0
assign (resid   48 and  name HA   )(resid   51 and  name HN   ) 4.0 2.2 1.0
assign (resid   49 and  name HA   )(resid   52 and  name HN   ) 4.0 2.2 1.0
assign (resid   60 and  name HA   )(resid   63 and  name HN   ) 4.0 2.2 1.0
assign (resid   63 and  name HA   )(resid   66 and  name HN   ) 4.0 2.2 1.0
assign (resid   64 and  name HA   )(resid   67 and  name HN   ) 4.0 2.2 1.0
!assign (resid 84 and name HA) (resid 87 and name HN) 4.0 2.2 1.0
assign (resid   91 and  name HA   )(resid   94 and  name HN   ) 4.0 2.2 1.0
assign (resid   93 and  name HA   )(resid   96 and  name HN   ) 4.0 2.2 1.0
assign (resid   95 and  name HA   )(resid   98 and  name HN   ) 4.0 2.2 1.0
assign (resid   96 and  name HA   )(resid   99 and  name HN   ) 4.0 2.2 1.0
assign (resid   98 and  name HA   )(resid  101 and  name HN   ) 4.0 2.2 1.0
assign (resid  102 and  name HA   )(resid  105 and  name HN   ) 4.0 2.2 1.0
assign (resid  106 and  name HA   )(resid  109 and  name HN   ) 4.0 2.2 1.0
!assign (resid 108 and name HA) (resid 111 and name HN) 4.0 2.2 1.0
!CaH(i)-hn(i+4)
assign (resid    9 and  name HA   )(resid   13 and  name HN   ) 4.0 2.2 1.0
assign (resid   11 and  name HA   )(resid   15 and  name HN   ) 4.0 2.2 1.0
assign (resid   12 and  name HA   )(resid   16 and  name HN   ) 4.0 2.2 1.0
assign (resid   13 and  name HA   )(resid   17 and  name HN   ) 4.0 2.2 1.0
assign (resid   14 and  name HA   )(resid   18 and  name HN   ) 4.0 2.2 1.0
assign (resid   15 and  name HA   )(resid   19 and  name HN   ) 4.0 2.2 1.0
assign (resid   16 and  name HA   )(resid   20 and  name HN   ) 4.0 2.2 1.0
assign (resid   17 and  name HA   )(resid   21 and  name HN   ) 4.0 2.2 1.0
assign (resid   18 and  name HA   )(resid   22 and  name HN   ) 4.0 2.2 1.0
assign (resid   24 and  name HA   )(resid   26 and  name HN   ) 4.0 2.2 1.0
assign (resid   45 and  name HA   )(resid   49 and  name HN   ) 4.0 2.2 1.0
assign (resid   58 and  name HA   )(resid   62 and  name HN   ) 4.0 2.2 1.0
assign (resid   64 and  name HA   )(resid   68 and  name HN   ) 4.0 2.2 1.0
assign (resid   94 and  name HA   )(resid   98 and  name HN   ) 4.0 2.2 1.0
assign (resid   96 and  name HA   )(resid  100 and  name HN   ) 4.0 2.2 1.0
assign (resid  106 and  name HA   )(resid  110 and  name HN   ) 4.0 2.2 1.0
!CaH(i)-CbH(i+3)
assign (resid    7 and  name HA   )(resid   10 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 8 and name HA) (resid 11 and name HB1) 4.0 2.2 1.0
assign (resid    8 and  name HA   )(resid   11 and  name HB2  ) 4.0 2.2 1.0
assign (resid    9 and  name HA   )(resid   12 and  name HB1  ) 4.0 2.2 1.0
assign (resid    9 and  name HA   )(resid   12 and  name HB2  ) 4.0 2.2 1.0
assign (resid   10 and  name HA   )(resid   13 and  name HB1  ) 4.0 2.2 1.0
assign (resid   10 and  name HA   )(resid   13 and  name HB2  ) 4.0 2.2 1.0
assign (resid   11 and  name HA   )(resid   14 and  name HB   ) 4.0 2.2 1.0
assign (resid   12 and  name HA   )(resid   15 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   13 and  name HA   )(resid   16 and  name HB1  ) 4.0 2.2 1.0
assign (resid   13 and  name HA   )(resid   16 and  name HB2  ) 4.0 2.2 1.0
assign (resid   14 and  name HA   )(resid   17 and  name HB1  ) 4.0 2.2 1.0
assign (resid   15 and  name HA   )(resid   18 and  name HB   ) 4.0 2.2 1.0
assign (resid   16 and  name HA   )(resid   19 and  name HB#  ) 3.0 2.2 1.3  
assign (resid   17 and  name HA   )(resid   20 and  name HB   ) 5.0 2.0 1.0
assign (resid   18 and  name HA   )(resid   21 and  name HB   ) 4.0 2.2 1.0
assign (resid   19 and  name HA   )(resid   22 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   21 and  name HA   )(resid   24 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 21 and name HA) (resid 24 and name HB2) 4.0 2.2 1.0
!assign (resid 40 and name HA) (resid 43 and name HB1) 4.0 2.2 1.0
assign (resid   43 and  name HA   )(resid   46 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   44 and  name HA   )(resid   47 and  name HB#  ) 4.0 3.7 2.5  
assign (resid   45 and  name HA   )(resid   48 and  name HB1  ) 4.0 2.2 1.0
assign (resid   45 and  name HA   )(resid   48 and  name HB2  ) 4.0 2.2 1.0
assign (resid   46 and  name HA   )(resid   49 and  name HB1  ) 4.0 2.2 1.0
!assign (resid 46 and name HA) (resid 49 and name HB2) 4.0 2.2 1.0
assign (resid   47 and  name HA   )(resid   50 and  name HB1  ) 4.0 2.2 1.0
assign (resid   47 and  name HA   )(resid   50 and  name HB2  ) 4.0 2.2 1.0
assign (resid   48 and  name HA   )(resid   51 and  name HB1  ) 4.0 2.2 1.0
assign (resid   48 and  name HA   )(resid   51 and  name HB2  ) 4.0 2.2 1.0
assign (resid   61 and  name HA   )(resid   64 and  name HB1  ) 4.0 2.2 1.0
assign (resid   61 and  name HA   )(resid   64 and  name HB2  ) 4.0 2.2 1.0
assign (resid   62 and  name HA   )(resid   65 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   63 and  name HA   )(resid   66 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   64 and  name HA   )(resid   67 and  name HB1  ) 4.0 2.2 1.0
assign (resid   64 and  name HA   )(resid   67 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 92 and name HA) (resid 95 and name HB1) 4.0 2.2 1.0
assign (resid   92 and  name HA   )(resid   95 and  name HB2  ) 4.0 2.2 1.0
assign (resid   93 and  name HA   )(resid   96 and  name HB   ) 4.0 2.2 1.0
assign (resid   94 and  name HA   )(resid   97 and  name HB#  ) 4.0 3.2 2.0  
assign (resid   95 and  name HA   )(resid   98 and  name HB1  ) 4.0 2.2 1.0
assign (resid   95 and  name HA   )(resid   98 and  name HB2  ) 4.0 2.2 1.0
assign (resid   96 and  name HA   )(resid   99 and  name HB1  ) 4.0 2.2 1.0
assign (resid   97 and  name HA   )(resid  100 and  name HB1  ) 4.0 2.2 1.0
assign (resid   97 and  name HA   )(resid  100 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 98 and name HA) (resid 101 and name HB1) 4.0 2.2 1.0
assign (resid   98 and  name HA   )(resid  101 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 99 and name HA) (resid 102 and name HB1) 4.0 2.2 1.0
assign (resid   99 and  name HA   )(resid  102 and  name HB2  ) 4.0 2.2 1.0
assign (resid  100 and  name HA   )(resid  103 and  name HB1  ) 4.0 2.2 1.0
assign (resid  100 and  name HA   )(resid  103 and  name HB2  ) 4.0 2.2 1.0
assign (resid  102 and  name HA   )(resid  105 and  name HB1  ) 4.0 2.2 1.0
assign (resid  102 and  name HA   )(resid  105 and  name HB2  ) 4.0 2.2 1.0
!assign (resid 104 and name HA) (resid 107 and name HB1) 4.0 2.2 1.0
assign (resid  104 and  name HA   )(resid  107 and  name HB2  ) 4.0 2.2 1.0
assign (resid  105 and  name HA   )(resid  108 and  name HB#  ) 4.0 3.2 2.0  
assign (resid  106 and  name HA   )(resid  109 and  name HB2  ) 4.0 2.2 1.0
!H-BONDS
!assign (resid 8 and name o)  (resid 12 and name hn) 1.8 0.3 0.5
!assign (resid 8 and name o)  (resid 12 and name n) 2.8 0.4 0.5
assign (resid    9 and  name O    )(resid   13 and  name HN   ) 1.8 0.3 0.5
assign (resid    9 and  name O    )(resid   13 and  name N    ) 2.8 0.4 0.5
assign (resid   10 and  name O    )(resid   14 and  name HN   ) 1.8 0.3 0.5
assign (resid   10 and  name O    )(resid   14 and  name N    ) 2.8 0.4 0.5
assign (resid   11 and  name O    )(resid   15 and  name HN   ) 1.8 0.3 0.5
assign (resid   11 and  name O    )(resid   15 and  name N    ) 2.8 0.4 0.5
assign (resid   12 and  name O    )(resid   16 and  name HN   ) 1.8 0.3 0.5
assign (resid   12 and  name O    )(resid   16 and  name N    ) 2.8 0.4 0.5
assign (resid   13 and  name O    )(resid   17 and  name HN   ) 1.8 0.3 0.5
assign (resid   13 and  name O    )(resid   17 and  name N    ) 2.8 0.4 0.5
assign (resid   14 and  name O    )(resid   18 and  name HN   ) 1.8 0.3 0.5
assign (resid   14 and  name O    )(resid   18 and  name N    ) 2.8 0.4 0.5
assign (resid   15 and  name O    )(resid   19 and  name HN   ) 1.8 0.3 0.5
assign (resid   15 and  name O    )(resid   19 and  name N    ) 2.8 0.4 0.5
assign (resid   16 and  name O    )(resid   20 and  name HN   ) 1.8 0.3 0.5
assign (resid   16 and  name O    )(resid   20 and  name N    ) 2.8 0.4 0.5
!assign (resid 41 and name o)  (resid 45 and name hn) 1.8 0.3 0.5
!assign (resid 41 and name o)  (resid 45 and name n) 2.8 0.4 0.5
!assign (resid 42 and name o)  (resid 46 and name hn) 1.8 0.3 0.5
!assign (resid 42 and name o)  (resid 46 and name n) 2.8 0.4 0.5
!assign (resid 43 and name o)  (resid 47 and name hn) 1.8 0.3 0.5
!assign (resid 43 and name o)  (resid 47 and name n) 2.8 0.4 0.5
assign (resid   44 and  name O    )(resid   48 and  name HN   ) 1.8 0.3 0.5
assign (resid   44 and  name O    )(resid   48 and  name N    ) 2.8 0.4 0.5
assign (resid   45 and  name O    )(resid   49 and  name HN   ) 1.8 0.3 0.5
assign (resid   45 and  name O    )(resid   49 and  name N    ) 2.8 0.4 0.5
assign (resid   46 and  name O    )(resid   50 and  name HN   ) 1.8 0.3 0.5
assign (resid   46 and  name O    )(resid   50 and  name N    ) 2.8 0.4 0.5
assign (resid   47 and  name O    )(resid   51 and  name HN   ) 1.8 0.3 0.5
assign (resid   47 and  name O    )(resid   51 and  name N    ) 2.8 0.4 0.5
!assign (resid 61 and name o)  (resid 65 and name hn) 1.8 0.3 0.5
!assign (resid 61 and name o)  (resid 65 and name n) 2.8 0.4 0.5
assign (resid   62 and  name O    )(resid   66 and  name HN   ) 1.8 0.3 0.5
assign (resid   62 and  name O    )(resid   66 and  name N    ) 2.8 0.4 0.5
assign (resid   63 and  name O    )(resid   67 and  name HN   ) 1.8 0.3 0.5
assign (resid   63 and  name O    )(resid   67 and  name N    ) 2.8 0.4 0.5
!assign (resid 64 and name o)  (resid 68 and name hn) 1.8 0.3 0.5
!assign (resid 64 and name o)  (resid 68 and name n) 2.8 0.4 0.5
!assign (resid 65 and name o)  (resid 69 and name hn) 1.8 0.3 0.5
!assign (resid 65 and name o)  (resid 69 and name n) 2.8 0.4 0.5
assign (resid   92 and  name O    )(resid   96 and  name HN   ) 1.8 0.3 0.5
assign (resid   92 and  name O    )(resid   96 and  name N    ) 2.8 0.4 0.5
assign (resid   93 and  name O    )(resid   97 and  name HN   ) 1.8 0.3 0.5
assign (resid   93 and  name O    )(resid   97 and  name N    ) 2.8 0.4 0.5
assign (resid   94 and  name O    )(resid   98 and  name HN   ) 1.8 0.3 0.5
assign (resid   94 and  name O    )(resid   98 and  name N    ) 2.8 0.4 0.5
assign (resid   95 and  name O    )(resid   99 and  name HN   ) 1.8 0.3 0.5
assign (resid   95 and  name O    )(resid   99 and  name N    ) 2.8 0.4 0.5
assign (resid   96 and  name O    )(resid  100 and  name HN   ) 1.8 0.3 0.5
assign (resid   96 and  name O    )(resid  100 and  name N    ) 2.8 0.4 0.5
assign (resid   97 and  name O    )(resid  101 and  name HN   ) 1.8 0.3 0.5
assign (resid   97 and  name O    )(resid  101 and  name N    ) 2.8 0.4 0.5
!assign (resid 98 and name o)  (resid 102 and name hn) 1.8 0.3 0.5
!assign (resid 98 and name o)  (resid 102 and name n) 2.8 0.4 0.5
assign (resid   99 and  name O    )(resid  103 and  name HN   ) 1.8 0.3 0.5
assign (resid   99 and  name O    )(resid  103 and  name N    ) 2.8 0.4 0.5
assign (resid  100 and  name O    )(resid  104 and  name HN   ) 1.8 0.3 0.5
assign (resid  100 and  name O    )(resid  104 and  name N    ) 2.8 0.4 0.5
!assign (resid 101 and name o)  (resid 105 and name hn) 1.8 0.3 0.5
!assign (resid 101 and name o)  (resid 105 and name n) 2.8 0.4 0.5
!assign (resid 102 and name o)  (resid 106 and name hn) 1.8 0.3 0.5
!assign (resid 102 and name o)  (resid 106 and name n) 2.8 0.4 0.5
!assign (resid 103 and name o)  (resid 107 and name hn) 1.8 0.3 0.5
!assign (resid 103 and name o)  (resid 107 and name n) 2.8 0.4 0.5
!assign (resid 104 and name o)  (resid 108 and name hn) 1.8 0.3 0.5
!assign (resid 104 and name o)  (resid 108 and name n) 2.8 0.4 0.5
!assign (resid 105 and name o)  (resid 109 and name hn) 1.8 0.3 0.5
!assign (resid 105 and name o)  (resid 109 and name n) 2.8 0.4 0.5
!BETA SHEET CONSTRAINTS
assign (resid   89 and  name HA   )(resid   36 and  name HN   ) 4.0 2.2 1.0
assign (resid   33 and  name HA   )(resid   90 and  name HN   ) 4.0 2.2 1.0
assign (resid   33 and  name HA   )(resid   91 and  name HA   ) 2.5 0.7 0.2
assign (resid   91 and  name HA   )(resid   34 and  name HN   ) 4.0 2.2 1.0
assign (resid   90 and  name O    )(resid   34 and  name HN   ) 1.8 0.3 0.5
assign (resid   90 and  name O    )(resid   34 and  name N    ) 2.8 0.4 0.5
assign (resid   34 and  name O    )(resid   90 and  name HN   ) 1.8 0.3 0.5
assign (resid   34 and  name O    )(resid   90 and  name N    ) 2.8 0.4 0.5
assign (resid   32 and  name O    )(resid   92 and  name HN   ) 1.8 0.3 0.5
assign (resid   32 and  name O    )(resid   92 and  name N    ) 2.8 0.4 0.5
set echo on message on end




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1           HT1      MET   1  23.912   8.071  13.394
    2   2H    MET   1           HT2      MET   1  24.456   6.499  13.736
    3   3H    MET   1           HT3      MET   1  22.843   6.930  14.051
    4    HA   MET   1           HA       MET   1  24.099   6.793  11.363
    5   1HB   MET   1          HB2       MET   1  22.200   4.955  12.846
    6   2HB   MET   1          HB1       MET   1  22.467   4.871  11.103
    7   1HG   MET   1          HG2       MET   1  24.922   4.601  11.552
    8   2HG   MET   1          HG1       MET   1  24.552   4.514  13.274
    9   1HE   MET   1          HE1       MET   1  22.955   3.118  14.284
   10   2HE   MET   1          HE2       MET   1  22.655   1.427  13.887
   11   3HE   MET   1          HE3       MET   1  21.649   2.684  13.171
   12    H    GLY   2           HN       GLY   2  22.933   7.834   9.812
   13   1HA   GLY   2          HA2       GLY   2  20.697   9.503  10.582
   14   2HA   GLY   2          HA1       GLY   2  21.326   9.317   8.945
   15    HA   PRO   3           HA       PRO   3  17.084   7.115   9.770
   16   1HB   PRO   3          HB2       PRO   3  16.142   8.614   7.457
   17   2HB   PRO   3          HB1       PRO   3  15.547   8.673   9.119
   18   1HG   PRO   3          HG2       PRO   3  17.221  10.607   7.725
   19   2HG   PRO   3          HG1       PRO   3  16.465  10.751   9.317
   20   1HD   PRO   3          HD2       PRO   3  19.236  10.455   8.823
   21   2HD   PRO   3          HD1       PRO   3  18.431  10.228  10.396
   22    H    VAL   4           HN       VAL   4  15.931   5.838   7.897
   23    HA   VAL   4           HA       VAL   4  18.006   4.488   6.373
   24    HB   VAL   4           HB       VAL   4  16.132   3.063   5.581
   25   1HG1  VAL   4          HG11      VAL   4  15.539   2.144   7.780
   26   2HG1  VAL   4          HG12      VAL   4  16.058   3.639   8.557
   27   3HG1  VAL   4          HG13      VAL   4  17.240   2.608   7.752
   28   1HG2  VAL   4          HG21      VAL   4  14.302   4.559   5.380
   29   2HG2  VAL   4          HG22      VAL   4  14.512   5.171   7.018
   30   3HG2  VAL   4          HG23      VAL   4  13.881   3.547   6.758
   31    HA   PRO   5           HA       PRO   5  17.549   7.413   2.940
   32   1HB   PRO   5          HB2       PRO   5  18.424   5.355   1.048
   33   2HB   PRO   5          HB1       PRO   5  19.267   6.821   1.559
   34   1HG   PRO   5          HG2       PRO   5  19.891   4.146   2.307
   35   2HG   PRO   5          HG1       PRO   5  20.624   5.626   2.935
   36   1HD   PRO   5          HD2       PRO   5  18.832   3.805   4.313
   37   2HD   PRO   5          HD1       PRO   5  19.610   5.275   4.951
   38    HA   PRO   6           HA       PRO   6  13.683   6.341   1.048
   39   1HB   PRO   6          HB2       PRO   6  14.039   7.252  -1.579
   40   2HB   PRO   6          HB1       PRO   6  13.585   8.256  -0.197
   41   1HG   PRO   6          HG2       PRO   6  16.195   8.053  -1.588
   42   2HG   PRO   6          HG1       PRO   6  15.535   9.384  -0.628
   43   1HD   PRO   6          HD2       PRO   6  17.533   7.585   0.225
   44   2HD   PRO   6          HD1       PRO   6  16.574   8.647   1.287
   45    H    SER   7           HN       SER   7  16.267   5.617  -1.321
   46    HA   SER   7           HA       SER   7  14.863   3.551  -2.684
   47   1HB   SER   7          HB2       SER   7  17.082   2.847  -3.502
   48   2HB   SER   7          HB1       SER   7  16.912   4.598  -3.576
   49    HG   SER   7           HG       SER   7  17.834   4.224  -1.229
   50    H    THR   8           HN       THR   8  16.910   3.473   0.207
   51    HA   THR   8           HA       THR   8  16.993   0.595   0.408
   52    HB   THR   8           HB       THR   8  17.248   2.695   2.590
   53    HG1  THR   8           HG1      THR   8  19.547   2.033   2.155
   54   1HG2  THR   8          HG21      THR   8  18.086  -0.217   2.474
   55   2HG2  THR   8          HG22      THR   8  16.830   0.464   3.508
   56   3HG2  THR   8          HG23      THR   8  18.518   0.906   3.764
   57    H    ALA   9           HN       ALA   9  14.819   3.083   1.725
   58    HA   ALA   9           HA       ALA   9  13.261   1.339   3.366
   59   1HB   ALA   9          HB1       ALA   9  12.706   3.983   2.023
   60   2HB   ALA   9          HB2       ALA   9  12.928   3.647   3.738
   61   3HB   ALA   9          HB3       ALA   9  11.444   3.148   2.931
   62    H    LEU  10           HN       LEU  10  12.956   2.270  -0.058
   63    HA   LEU  10           HA       LEU  10  10.476   0.943  -0.534
   64   1HB   LEU  10          HB2       LEU  10  11.576   2.563  -2.114
   65   2HB   LEU  10          HB1       LEU  10  12.758   1.315  -2.498
   66    HG   LEU  10           HG       LEU  10  10.758  -0.184  -3.116
   67   1HD1  LEU  10          HD11      LEU  10   8.767   1.276  -3.912
   68   2HD1  LEU  10          HD12      LEU  10   9.386   2.490  -2.796
   69   3HD1  LEU  10          HD13      LEU  10   8.878   0.914  -2.192
   70   1HD2  LEU  10          HD21      LEU  10  10.655   0.715  -5.357
   71   2HD2  LEU  10          HD22      LEU  10  12.286   0.966  -4.744
   72   3HD2  LEU  10          HD23      LEU  10  11.145   2.311  -4.790
   73    H    ARG  11           HN       ARG  11  13.845  -0.201  -0.956
   74    HA   ARG  11           HA       ARG  11  13.171  -2.816  -1.863
   75   1HB   ARG  11          HB2       ARG  11  15.556  -1.797  -0.294
   76   2HB   ARG  11          HB1       ARG  11  15.447  -3.437  -0.935
   77   1HG   ARG  11          HG2       ARG  11  15.231  -2.581  -3.207
   78   2HG   ARG  11          HG1       ARG  11  15.204  -0.921  -2.610
   79   1HD   ARG  11          HD2       ARG  11  17.450  -1.596  -3.466
   80   2HD   ARG  11          HD1       ARG  11  17.478  -1.143  -1.762
   81    HE   ARG  11           HE       ARG  11  17.084  -3.883  -1.707
   82   1HH1  ARG  11          HH21      ARG  11  19.313  -1.714  -3.192
   83   2HH1  ARG  11          HH22      ARG  11  20.638  -2.828  -3.139
   84   1HH2  ARG  11          HH11      ARG  11  18.800  -5.349  -1.624
   85   2HH2  ARG  11          HH12      ARG  11  20.348  -4.887  -2.248
   86    H    GLU  12           HN       GLU  12  13.627  -1.503   1.404
   87    HA   GLU  12           HA       GLU  12  13.229  -3.976   2.795
   88   1HB   GLU  12          HB2       GLU  12  12.791  -1.093   3.616
   89   2HB   GLU  12          HB1       GLU  12  12.588  -2.449   4.725
   90   1HG   GLU  12          HG2       GLU  12  14.915  -3.150   4.303
   91   2HG   GLU  12          HG1       GLU  12  15.125  -1.792   3.197
   92    H    LEU  13           HN       LEU  13  11.004  -1.457   1.658
   93    HA   LEU  13           HA       LEU  13   8.653  -2.618   2.850
   94   1HB   LEU  13          HB2       LEU  13   8.745  -0.263   2.123
   95   2HB   LEU  13          HB1       LEU  13   8.937  -0.777   0.450
   96    HG   LEU  13           HG       LEU  13   6.718  -1.886   0.547
   97   1HD1  LEU  13          HD11      LEU  13   5.297  -1.089   2.614
   98   2HD1  LEU  13          HD12      LEU  13   6.867  -0.928   3.398
   99   3HD1  LEU  13          HD13      LEU  13   6.345  -2.494   2.781
  100   1HD2  LEU  13          HD21      LEU  13   5.373   0.208   0.688
  101   2HD2  LEU  13          HD22      LEU  13   6.854   0.423  -0.245
  102   3HD2  LEU  13          HD23      LEU  13   6.761   1.022   1.411
  103    H    ILE  14           HN       ILE  14  10.038  -2.805  -0.446
  104    HA   ILE  14           HA       ILE  14   8.006  -4.470  -1.539
  105    HB   ILE  14           HB       ILE  14  10.945  -4.225  -2.245
  106   1HG1  ILE  14          HG12      ILE  14   8.462  -3.160  -3.629
  107   2HG1  ILE  14          HG11      ILE  14   9.438  -2.213  -2.506
  108   1HG2  ILE  14          HG21      ILE  14   8.681  -5.702  -3.617
  109   2HG2  ILE  14          HG22      ILE  14  10.226  -6.364  -3.086
  110   3HG2  ILE  14          HG23      ILE  14  10.170  -5.248  -4.447
  111   1HD1  ILE  14          HD11      ILE  14  11.392  -2.440  -3.941
  112   2HD1  ILE  14          HD12      ILE  14  10.049  -1.820  -4.900
  113   3HD1  ILE  14          HD13      ILE  14  10.511  -3.517  -5.024
  114    H    GLU  15           HN       GLU  15  11.144  -5.400  -0.072
  115    HA   GLU  15           HA       GLU  15  10.805  -8.200  -0.366
  116   1HB   GLU  15          HB2       GLU  15  12.334  -6.601   1.693
  117   2HB   GLU  15          HB1       GLU  15  12.420  -8.359   1.577
  118   1HG   GLU  15          HG2       GLU  15  13.165  -8.162  -0.774
  119   2HG   GLU  15          HG1       GLU  15  13.107  -6.405  -0.637
  120    H    GLU  16           HN       GLU  16   9.788  -6.086   2.334
  121    HA   GLU  16           HA       GLU  16   8.876  -8.290   3.956
  122   1HB   GLU  16          HB2       GLU  16   9.387  -5.962   4.794
  123   2HB   GLU  16          HB1       GLU  16   7.884  -5.438   4.041
  124   1HG   GLU  16          HG2       GLU  16   7.422  -5.903   6.370
  125   2HG   GLU  16          HG1       GLU  16   6.671  -7.172   5.401
  126    H    LEU  17           HN       LEU  17   7.198  -6.095   1.686
  127    HA   LEU  17           HA       LEU  17   4.579  -7.142   2.151
  128   1HB   LEU  17          HB2       LEU  17   5.803  -5.839  -0.293
  129   2HB   LEU  17          HB1       LEU  17   4.094  -6.250  -0.174
  130    HG   LEU  17           HG       LEU  17   5.562  -4.462   1.788
  131   1HD1  LEU  17          HD11      LEU  17   3.651  -3.684  -0.434
  132   2HD1  LEU  17          HD12      LEU  17   5.404  -3.518  -0.528
  133   3HD1  LEU  17          HD13      LEU  17   4.493  -2.591   0.664
  134   1HD2  LEU  17          HD21      LEU  17   2.987  -3.815   2.131
  135   2HD2  LEU  17          HD22      LEU  17   3.696  -5.181   2.983
  136   3HD2  LEU  17          HD23      LEU  17   2.732  -5.455   1.533
  137    H    VAL  18           HN       VAL  18   7.125  -8.109  -0.131
  138    HA   VAL  18           HA       VAL  18   5.554 -10.093  -1.491
  139    HB   VAL  18           HB       VAL  18   8.549  -9.791  -1.111
  140   1HG1  VAL  18          HG11      VAL  18   6.956 -11.732  -2.801
  141   2HG1  VAL  18          HG12      VAL  18   8.188 -12.113  -1.598
  142   3HG1  VAL  18          HG13      VAL  18   8.646 -11.350  -3.121
  143   1HG2  VAL  18          HG21      VAL  18   7.279  -8.029  -2.402
  144   2HG2  VAL  18          HG22      VAL  18   6.802  -9.291  -3.538
  145   3HG2  VAL  18          HG23      VAL  18   8.506  -8.874  -3.346
  146    H    ASN  19           HN       ASN  19   7.708 -10.243   1.322
  147    HA   ASN  19           HA       ASN  19   7.726 -13.052   1.666
  148   1HB   ASN  19          HB2       ASN  19   8.009 -10.753   3.604
  149   2HB   ASN  19          HB1       ASN  19   8.172 -12.432   4.118
  150   1HD2  ASN  19          HD21      ASN  19   9.471 -13.436   1.713
  151   2HD2  ASN  19          HD22      ASN  19  11.020 -12.749   1.645
  152    H    ILE  20           HN       ILE  20   5.385 -10.657   2.930
  153    HA   ILE  20           HA       ILE  20   3.945 -12.721   4.406
  154    HB   ILE  20           HB       ILE  20   2.308 -10.904   4.865
  155   1HG1  ILE  20          HG12      ILE  20   4.226  -9.191   3.262
  156   2HG1  ILE  20          HG11      ILE  20   2.672  -9.746   2.658
  157   1HG2  ILE  20          HG21      ILE  20   3.951  -9.484   6.122
  158   2HG2  ILE  20          HG22      ILE  20   5.253 -10.303   5.258
  159   3HG2  ILE  20          HG23      ILE  20   4.206 -11.213   6.347
  160   1HD1  ILE  20          HD11      ILE  20   2.901  -8.226   5.257
  161   2HD1  ILE  20          HD12      ILE  20   1.466  -8.489   4.267
  162   3HD1  ILE  20          HD13      ILE  20   2.735  -7.399   3.710
  163    H    THR  21           HN       THR  21   3.720 -11.539   1.123
  164    HA   THR  21           HA       THR  21   0.954 -12.643   0.863
  165    HB   THR  21           HB       THR  21   1.084 -11.719  -1.465
  166    HG1  THR  21           HG1      THR  21   3.355 -10.292  -0.753
  167   1HG2  THR  21          HG21      THR  21   1.885  -9.584   0.501
  168   2HG2  THR  21          HG22      THR  21   0.330 -10.403   0.626
  169   3HG2  THR  21          HG23      THR  21   0.729  -9.481  -0.823
  170    H    GLN  22           HN       GLN  22   4.264 -13.455   0.143
  171    HA   GLN  22           HA       GLN  22   3.626 -15.400  -1.923
  172   1HB   GLN  22          HB2       GLN  22   6.090 -14.895  -0.246
  173   2HB   GLN  22          HB1       GLN  22   5.998 -16.209  -1.420
  174   1HG   GLN  22          HG2       GLN  22   5.402 -13.329  -2.127
  175   2HG   GLN  22          HG1       GLN  22   7.003 -14.049  -2.305
  176   1HE2  GLN  22          HE21      GLN  22   4.480 -13.263  -4.193
  177   2HE2  GLN  22          HE22      GLN  22   4.496 -14.549  -5.302
  178    H    ASN  23           HN       ASN  23   4.045 -15.516   1.583
  179    HA   ASN  23           HA       ASN  23   3.649 -18.468   1.562
  180   1HB   ASN  23          HB2       ASN  23   4.270 -16.558   3.834
  181   2HB   ASN  23          HB1       ASN  23   4.175 -18.314   3.972
  182   1HD2  ASN  23          HD21      ASN  23   5.514 -19.171   1.677
  183   2HD2  ASN  23          HD22      ASN  23   7.123 -18.633   1.708
  184    H    GLN  24           HN       GLN  24   1.566 -16.031   1.278
  185    HA   GLN  24           HA       GLN  24  -0.235 -16.672   3.508
  186   1HB   GLN  24          HB2       GLN  24  -1.631 -14.941   2.689
  187   2HB   GLN  24          HB1       GLN  24   0.007 -14.382   2.384
  188   1HG   GLN  24          HG2       GLN  24  -0.989 -13.940   0.324
  189   2HG   GLN  24          HG1       GLN  24  -0.340 -15.551   0.034
  190   1HE2  GLN  24          HE21      GLN  24  -1.910 -16.571  -1.252
  191   2HE2  GLN  24          HE22      GLN  24  -3.565 -16.635  -0.880
  192    H    LYS  25           HN       LYS  25  -1.621 -18.347   3.495
  193    HA   LYS  25           HA       LYS  25  -2.055 -19.889   1.035
  194   1HB   LYS  25          HB2       LYS  25  -1.795 -20.997   3.260
  195   2HB   LYS  25          HB1       LYS  25  -3.299 -20.236   3.781
  196   1HG   LYS  25          HG2       LYS  25  -4.551 -21.391   2.045
  197   2HG   LYS  25          HG1       LYS  25  -3.066 -22.047   1.362
  198   1HD   LYS  25          HD2       LYS  25  -3.886 -23.839   2.644
  199   2HD   LYS  25          HD1       LYS  25  -2.702 -23.099   3.718
  200   1HE   LYS  25          HE2       LYS  25  -4.472 -21.897   4.901
  201   2HE   LYS  25          HE1       LYS  25  -5.679 -22.512   3.772
  202   1HZ   LYS  25          HZ1       LYS  25  -5.791 -23.912   5.624
  203   2HZ   LYS  25          HZ2       LYS  25  -4.101 -24.020   5.768
  204   3HZ   LYS  25          HZ3       LYS  25  -4.898 -24.793   4.482
  205    H    ALA  26           HN       ALA  26  -3.834 -17.677   3.112
  206    HA   ALA  26           HA       ALA  26  -5.899 -17.373   0.992
  207   1HB   ALA  26          HB1       ALA  26  -6.291 -18.676   3.564
  208   2HB   ALA  26          HB2       ALA  26  -7.451 -18.483   2.251
  209   3HB   ALA  26          HB3       ALA  26  -7.294 -17.228   3.480
  210    HA   PRO  27           HA       PRO  27  -5.662 -13.013   1.612
  211   1HB   PRO  27          HB2       PRO  27  -8.359 -12.928   2.865
  212   2HB   PRO  27          HB1       PRO  27  -7.765 -12.095   1.422
  213   1HG   PRO  27          HG2       PRO  27  -9.446 -14.337   1.416
  214   2HG   PRO  27          HG1       PRO  27  -8.514 -13.754   0.033
  215   1HD   PRO  27          HD2       PRO  27  -8.115 -16.207   1.551
  216   2HD   PRO  27          HD1       PRO  27  -7.224 -15.653   0.111
  217    H    LEU  28           HN       LEU  28  -4.653 -11.873   3.241
  218    HA   LEU  28           HA       LEU  28  -4.277 -13.002   5.830
  219   1HB   LEU  28          HB2       LEU  28  -3.933 -10.123   4.939
  220   2HB   LEU  28          HB1       LEU  28  -3.245 -10.827   6.399
  221    HG   LEU  28           HG       LEU  28  -2.677 -11.859   3.604
  222   1HD1  LEU  28          HD11      LEU  28  -0.576 -10.659   3.703
  223   2HD1  LEU  28          HD12      LEU  28  -0.919 -10.105   5.342
  224   3HD1  LEU  28          HD13      LEU  28  -1.879  -9.505   3.990
  225   1HD2  LEU  28          HD21      LEU  28  -2.162 -13.602   5.104
  226   2HD2  LEU  28          HD22      LEU  28  -1.636 -12.492   6.370
  227   3HD2  LEU  28          HD23      LEU  28  -0.619 -12.765   4.958
  228    H    CYS  29           HN       CYS  29  -6.393 -10.361   4.731
  229    HA   CYS  29           HA       CYS  29  -7.564 -10.071   7.414
  230   1HB   CYS  29          HB2       CYS  29  -8.170  -8.798   4.733
  231   2HB   CYS  29          HB1       CYS  29  -9.100  -8.456   6.193
  232    H    ASN  30           HN       ASN  30 -10.070 -10.101   7.491
  233    HA   ASN  30           HA       ASN  30 -10.965 -12.756   6.819
  234   1HB   ASN  30          HB2       ASN  30 -12.437 -10.286   7.776
  235   2HB   ASN  30          HB1       ASN  30 -13.217 -11.855   7.560
  236   1HD2  ASN  30          HD21      ASN  30 -12.941 -10.556  10.150
  237   2HD2  ASN  30          HD22      ASN  30 -11.929 -11.530  11.103
  238    H    GLY  31           HN       GLY  31 -10.072 -11.649   4.443
  239   1HA   GLY  31          HA2       GLY  31 -10.794 -11.566   2.201
  240   2HA   GLY  31          HA1       GLY  31 -12.428 -11.917   2.767
  241    H    SER  32           HN       SER  32 -10.748  -9.273   4.242
  242    HA   SER  32           HA       SER  32 -12.783  -7.391   3.567
  243   1HB   SER  32          HB2       SER  32  -9.929  -6.970   4.496
  244   2HB   SER  32          HB1       SER  32 -11.121  -5.681   4.372
  245    HG   SER  32           HG       SER  32 -12.352  -6.697   5.915
  246    H    MET  33           HN       MET  33 -12.961  -5.941   1.879
  247    HA   MET  33           HA       MET  33 -10.870  -6.102  -0.271
  248   1HB   MET  33          HB2       MET  33 -13.797  -5.345  -0.552
  249   2HB   MET  33          HB1       MET  33 -12.640  -5.607  -1.857
  250   1HG   MET  33          HG2       MET  33 -12.373  -7.992  -0.653
  251   2HG   MET  33          HG1       MET  33 -14.008  -7.619  -0.109
  252   1HE   MET  33          HE1       MET  33 -15.123  -5.899  -2.991
  253   2HE   MET  33          HE2       MET  33 -15.665  -6.617  -1.477
  254   3HE   MET  33          HE3       MET  33 -16.172  -7.322  -3.011
  255    H    VAL  34           HN       VAL  34 -10.350  -4.085  -1.341
  256    HA   VAL  34           HA       VAL  34 -11.036  -1.634   0.263
  257    HB   VAL  34           HB       VAL  34  -8.694  -0.862  -0.452
  258   1HG1  VAL  34          HG11      VAL  34  -7.619  -2.336   1.363
  259   2HG1  VAL  34          HG12      VAL  34  -9.194  -3.117   1.499
  260   3HG1  VAL  34          HG13      VAL  34  -9.032  -1.395   1.840
  261   1HG2  VAL  34          HG21      VAL  34  -8.204  -3.833  -0.756
  262   2HG2  VAL  34          HG22      VAL  34  -7.121  -2.500  -1.160
  263   3HG2  VAL  34          HG23      VAL  34  -8.549  -2.805  -2.148
  264    H    TRP  35           HN       TRP  35 -10.880   0.377  -0.960
  265    HA   TRP  35           HA       TRP  35 -12.164   0.158  -3.544
  266   1HB   TRP  35          HB2       TRP  35 -10.993   2.542  -2.082
  267   2HB   TRP  35          HB1       TRP  35 -11.985   2.645  -3.538
  268    HD1  TRP  35           HD1      TRP  35 -12.161   1.844   0.172
  269    HE1  TRP  35           HE1      TRP  35 -14.631   1.764   0.898
  270    HE3  TRP  35           HE3      TRP  35 -14.432   2.181  -4.395
  271    HZ2  TRP  35           HZ2      TRP  35 -17.225   1.825  -0.295
  272    HZ3  TRP  35           HZ3      TRP  35 -16.908   2.164  -4.562
  273    HH2  TRP  35           HH2      TRP  35 -18.301   1.984  -2.521
  274    H    SER  36           HN       SER  36 -11.266   0.371  -5.569
  275    HA   SER  36           HA       SER  36  -8.405   0.051  -5.857
  276   1HB   SER  36          HB2       SER  36  -8.841   0.119  -8.246
  277   2HB   SER  36          HB1       SER  36 -10.124  -0.817  -7.485
  278    HG   SER  36           HG       SER  36 -10.717   0.919  -9.050
  279    H    ILE  37           HN       ILE  37  -6.918   1.611  -6.694
  280    HA   ILE  37           HA       ILE  37  -7.871   4.457  -6.698
  281    HB   ILE  37           HB       ILE  37  -5.792   5.113  -5.547
  282   1HG1  ILE  37          HG12      ILE  37  -5.298   2.172  -5.014
  283   2HG1  ILE  37          HG11      ILE  37  -4.509   3.008  -6.344
  284   1HG2  ILE  37          HG21      ILE  37  -7.894   4.553  -4.284
  285   2HG2  ILE  37          HG22      ILE  37  -6.416   4.351  -3.341
  286   3HG2  ILE  37          HG23      ILE  37  -7.236   2.940  -4.010
  287   1HD1  ILE  37          HD11      ILE  37  -3.331   2.873  -3.987
  288   2HD1  ILE  37          HD12      ILE  37  -4.386   4.233  -3.605
  289   3HD1  ILE  37          HD13      ILE  37  -3.240   4.353  -4.941
  290    H    ASN  38           HN       ASN  38  -6.412   5.907  -7.909
  291    HA   ASN  38           HA       ASN  38  -5.360   4.543 -10.306
  292   1HB   ASN  38          HB2       ASN  38  -5.536   7.480  -9.539
  293   2HB   ASN  38          HB1       ASN  38  -4.918   6.892 -11.082
  294   1HD2  ASN  38          HD21      ASN  38  -6.868   4.686 -11.323
  295   2HD2  ASN  38          HD22      ASN  38  -8.371   5.405 -11.652
  296    H    LEU  39           HN       LEU  39  -3.224   3.997 -10.458
  297    HA   LEU  39           HA       LEU  39  -1.417   4.663  -8.261
  298   1HB   LEU  39          HB2       LEU  39  -1.058   3.153 -10.865
  299   2HB   LEU  39          HB1       LEU  39   0.251   3.399  -9.714
  300    HG   LEU  39           HG       LEU  39  -0.890   1.195  -9.435
  301   1HD1  LEU  39          HD11      LEU  39  -0.758   1.208  -7.126
  302   2HD1  LEU  39          HD12      LEU  39  -1.572   2.761  -6.965
  303   3HD1  LEU  39          HD13      LEU  39   0.109   2.694  -7.494
  304   1HD2  LEU  39          HD21      LEU  39  -3.148   0.996  -8.808
  305   2HD2  LEU  39          HD22      LEU  39  -3.181   2.234 -10.062
  306   3HD2  LEU  39          HD23      LEU  39  -3.273   2.697  -8.361
  307    H    THR  40           HN       THR  40  -0.802   6.773  -8.228
  308    HA   THR  40           HA       THR  40   0.709   7.798 -10.584
  309    HB   THR  40           HB       THR  40  -0.380   9.996 -10.379
  310    HG1  THR  40           HG1      THR  40  -2.002   8.671  -8.467
  311   1HG2  THR  40          HG21      THR  40  -2.470   7.814 -10.585
  312   2HG2  THR  40          HG22      THR  40  -1.332   8.206 -11.874
  313   3HG2  THR  40          HG23      THR  40  -2.513   9.405 -11.347
  314    H    ALA  41           HN       ALA  41   2.011   9.777  -9.885
  315    HA   ALA  41           HA       ALA  41   3.927   9.387  -8.068
  316   1HB   ALA  41          HB1       ALA  41   3.912  11.446  -9.284
  317   2HB   ALA  41          HB2       ALA  41   3.955  11.869  -7.573
  318   3HB   ALA  41          HB3       ALA  41   2.443  11.986  -8.472
  319    H    GLY  42           HN       GLY  42   0.649  10.323  -7.052
  320   1HA   GLY  42          HA2       GLY  42   1.521  10.401  -4.215
  321   2HA   GLY  42          HA1       GLY  42  -0.086  10.806  -4.814
  322    H    MET  43           HN       MET  43   1.732   7.815  -5.535
  323    HA   MET  43           HA       MET  43  -0.528   6.137  -5.082
  324   1HB   MET  43          HB2       MET  43   2.349   5.269  -4.762
  325   2HB   MET  43          HB1       MET  43   0.977   4.265  -5.202
  326   1HG   MET  43          HG2       MET  43   0.743   5.800  -7.255
  327   2HG   MET  43          HG1       MET  43   2.367   6.366  -6.845
  328   1HE   MET  43          HE1       MET  43   3.614   3.432  -5.600
  329   2HE   MET  43          HE2       MET  43   4.168   4.984  -6.223
  330   3HE   MET  43          HE3       MET  43   4.653   3.498  -7.030
  331    H    TYR  44           HN       TYR  44   2.245   6.851  -2.941
  332    HA   TYR  44           HA       TYR  44   1.478   5.145  -0.812
  333   1HB   TYR  44          HB2       TYR  44   2.996   7.767  -0.734
  334   2HB   TYR  44          HB1       TYR  44   2.913   6.616   0.600
  335    HD1  TYR  44           HD1      TYR  44   4.024   4.434   0.458
  336    HD2  TYR  44           HD2      TYR  44   4.234   7.254  -2.776
  337    HE1  TYR  44           HE1      TYR  44   5.866   3.124  -0.566
  338    HE2  TYR  44           HE2      TYR  44   6.076   5.944  -3.797
  339    HH   TYR  44           HH       TYR  44   7.660   4.321  -3.323
  340    H    CYS  45           HN       CYS  45   0.624   8.568  -1.372
  341    HA   CYS  45           HA       CYS  45  -0.880   8.833   1.076
  342   1HB   CYS  45          HB2       CYS  45  -0.816  10.370  -1.520
  343   2HB   CYS  45          HB1       CYS  45  -1.947  10.786  -0.231
  344    H    ALA  46           HN       ALA  46  -1.881   8.232  -2.305
  345    HA   ALA  46           HA       ALA  46  -4.669   7.940  -1.755
  346   1HB   ALA  46          HB1       ALA  46  -3.028   6.660  -3.960
  347   2HB   ALA  46          HB2       ALA  46  -3.743   8.270  -4.028
  348   3HB   ALA  46          HB3       ALA  46  -4.781   6.845  -3.952
  349    H    ALA  47           HN       ALA  47  -2.095   5.480  -2.048
  350    HA   ALA  47           HA       ALA  47  -3.759   3.219  -1.601
  351   1HB   ALA  47          HB1       ALA  47  -1.592   2.138  -0.802
  352   2HB   ALA  47          HB2       ALA  47  -0.826   3.707  -1.049
  353   3HB   ALA  47          HB3       ALA  47  -1.540   2.850  -2.416
  354    H    LEU  48           HN       LEU  48  -2.046   5.319   0.686
  355    HA   LEU  48           HA       LEU  48  -2.518   3.787   3.014
  356   1HB   LEU  48          HB2       LEU  48  -0.959   5.678   2.949
  357   2HB   LEU  48          HB1       LEU  48  -2.301   6.795   2.723
  358    HG   LEU  48           HG       LEU  48  -3.217   6.162   4.924
  359   1HD1  LEU  48          HD11      LEU  48  -2.602   3.937   5.326
  360   2HD1  LEU  48          HD12      LEU  48  -1.502   4.804   6.392
  361   3HD1  LEU  48          HD13      LEU  48  -0.928   4.201   4.838
  362   1HD2  LEU  48          HD21      LEU  48  -1.246   7.023   6.306
  363   2HD2  LEU  48          HD22      LEU  48  -1.732   8.037   4.947
  364   3HD2  LEU  48          HD23      LEU  48  -0.312   7.003   4.810
  365    H    GLU  49           HN       GLU  49  -4.524   6.488   1.706
  366    HA   GLU  49           HA       GLU  49  -6.487   6.352   3.759
  367   1HB   GLU  49          HB2       GLU  49  -8.041   7.385   2.031
  368   2HB   GLU  49          HB1       GLU  49  -6.538   8.255   2.330
  369   1HG   GLU  49          HG2       GLU  49  -5.536   7.340   0.334
  370   2HG   GLU  49          HG1       GLU  49  -6.920   6.278   0.070
  371    H    SER  50           HN       SER  50  -6.286   4.535   0.694
  372    HA   SER  50           HA       SER  50  -8.853   3.299   0.914
  373   1HB   SER  50          HB2       SER  50  -6.287   2.276  -0.335
  374   2HB   SER  50          HB1       SER  50  -7.856   1.502  -0.527
  375    HG   SER  50           HG       SER  50  -8.400   3.002  -1.898
  376    H    LEU  51           HN       LEU  51  -5.679   2.406   2.227
  377    HA   LEU  51           HA       LEU  51  -6.563  -0.092   3.370
  378   1HB   LEU  51          HB2       LEU  51  -4.207   1.707   3.978
  379   2HB   LEU  51          HB1       LEU  51  -4.454   0.147   4.759
  380    HG   LEU  51           HG       LEU  51  -4.257   0.554   1.758
  381   1HD1  LEU  51          HD11      LEU  51  -2.191  -0.600   3.651
  382   2HD1  LEU  51          HD12      LEU  51  -2.146   1.052   3.035
  383   3HD1  LEU  51          HD13      LEU  51  -2.003  -0.309   1.921
  384   1HD2  LEU  51          HD21      LEU  51  -5.378  -1.474   1.947
  385   2HD2  LEU  51          HD22      LEU  51  -4.711  -1.826   3.541
  386   3HD2  LEU  51          HD23      LEU  51  -3.722  -2.054   2.099
  387    H    ILE  52           HN       ILE  52  -6.461   3.245   4.562
  388    HA   ILE  52           HA       ILE  52  -6.873   2.799   7.307
  389    HB   ILE  52           HB       ILE  52  -7.966   4.941   5.465
  390   1HG1  ILE  52          HG12      ILE  52  -5.537   4.973   5.820
  391   2HG1  ILE  52          HG11      ILE  52  -6.286   6.359   6.588
  392   1HG2  ILE  52          HG21      ILE  52  -8.298   4.656   8.450
  393   2HG2  ILE  52          HG22      ILE  52  -9.544   4.933   7.233
  394   3HG2  ILE  52          HG23      ILE  52  -8.403   6.216   7.636
  395   1HD1  ILE  52          HD11      ILE  52  -6.317   4.661   8.690
  396   2HD1  ILE  52          HD12      ILE  52  -4.937   5.692   8.326
  397   3HD1  ILE  52          HD13      ILE  52  -4.932   4.007   7.817
  398    H    ASN  53           HN       ASN  53  -8.847   1.839   4.722
  399    HA   ASN  53           HA       ASN  53 -11.354   1.866   6.268
  400   1HB   ASN  53          HB2       ASN  53 -10.614   0.767   3.542
  401   2HB   ASN  53          HB1       ASN  53 -12.224   0.610   4.245
  402   1HD2  ASN  53          HD21      ASN  53 -11.483   2.198   1.829
  403   2HD2  ASN  53          HD22      ASN  53 -11.909   3.804   2.179
  404    H    VAL  54           HN       VAL  54  -8.637  -0.193   5.871
  405    HA   VAL  54           HA       VAL  54 -10.134  -2.618   6.737
  406    HB   VAL  54           HB       VAL  54  -7.167  -2.352   6.192
  407   1HG1  VAL  54          HG11      VAL  54  -9.092  -4.696   6.248
  408   2HG1  VAL  54          HG12      VAL  54  -7.842  -4.346   7.442
  409   3HG1  VAL  54          HG13      VAL  54  -7.389  -4.801   5.799
  410   1HG2  VAL  54          HG21      VAL  54  -7.697  -3.235   3.931
  411   2HG2  VAL  54          HG22      VAL  54  -8.420  -1.648   4.195
  412   3HG2  VAL  54          HG23      VAL  54  -9.417  -3.098   4.294
  413    H    SER  55           HN       SER  55 -10.318  -2.994   8.900
  414    HA   SER  55           HA       SER  55  -8.133  -2.026  10.723
  415   1HB   SER  55          HB2       SER  55 -11.126  -1.929  11.194
  416   2HB   SER  55          HB1       SER  55  -9.907  -1.572  12.414
  417    HG   SER  55           HG       SER  55 -10.902   0.027  10.533
  418    H    GLY  56           HN       GLY  56  -7.712  -3.376  12.528
  419   1HA   GLY  56          HA2       GLY  56  -8.019  -5.308  13.916
  420   2HA   GLY  56          HA1       GLY  56  -9.248  -5.897  12.798
  421    H    CYS  57           HN       CYS  57  -6.875  -4.983  10.773
  422    HA   CYS  57           HA       CYS  57  -5.770  -7.748  10.648
  423   1HB   CYS  57          HB2       CYS  57  -5.763  -5.434   8.693
  424   2HB   CYS  57          HB1       CYS  57  -4.879  -6.936   8.419
  425    H    SER  58           HN       SER  58  -4.131  -7.782  12.183
  426    HA   SER  58           HA       SER  58  -2.279  -5.647  12.668
  427   1HB   SER  58          HB2       SER  58  -2.713  -7.532  14.246
  428   2HB   SER  58          HB1       SER  58  -1.881  -8.613  13.133
  429    HG   SER  58           HG       SER  58  -0.848  -6.386  14.551
  430    H    ALA  59           HN       ALA  59  -2.130  -8.490  10.565
  431    HA   ALA  59           HA       ALA  59   0.527  -8.476   9.785
  432   1HB   ALA  59          HB1       ALA  59  -1.867  -8.864   7.971
  433   2HB   ALA  59          HB2       ALA  59  -1.119 -10.110   8.972
  434   3HB   ALA  59          HB3       ALA  59  -0.223  -9.400   7.629
  435    H    ILE  60           HN       ILE  60  -1.914  -6.072   8.866
  436    HA   ILE  60           HA       ILE  60   0.048  -4.858   6.958
  437    HB   ILE  60           HB       ILE  60  -1.834  -3.533   6.128
  438   1HG1  ILE  60          HG12      ILE  60  -3.534  -5.091   8.092
  439   2HG1  ILE  60          HG11      ILE  60  -3.057  -3.415   8.340
  440   1HG2  ILE  60          HG21      ILE  60  -3.076  -5.371   5.125
  441   2HG2  ILE  60          HG22      ILE  60  -2.560  -6.463   6.411
  442   3HG2  ILE  60          HG23      ILE  60  -1.379  -5.833   5.262
  443   1HD1  ILE  60          HD11      ILE  60  -5.257  -3.421   7.334
  444   2HD1  ILE  60          HD12      ILE  60  -4.717  -4.510   6.057
  445   3HD1  ILE  60          HD13      ILE  60  -4.102  -2.858   6.125
  446    H    GLU  61           HN       GLU  61  -0.734  -4.488  10.204
  447    HA   GLU  61           HA       GLU  61  -0.931  -1.644  10.424
  448   1HB   GLU  61          HB2       GLU  61   0.153  -3.762  12.288
  449   2HB   GLU  61          HB1       GLU  61   0.210  -2.052  12.716
  450   1HG   GLU  61          HG2       GLU  61  -2.187  -1.858  12.569
  451   2HG   GLU  61          HG1       GLU  61  -2.331  -3.477  11.885
  452    H    LYS  62           HN       LYS  62   1.897  -3.809  10.327
  453    HA   LYS  62           HA       LYS  62   3.860  -1.728  10.557
  454   1HB   LYS  62          HB2       LYS  62   3.959  -4.454   9.235
  455   2HB   LYS  62          HB1       LYS  62   5.369  -3.410   9.395
  456   1HG   LYS  62          HG2       LYS  62   3.697  -4.109  11.805
  457   2HG   LYS  62          HG1       LYS  62   4.937  -5.216  11.225
  458   1HD   LYS  62          HD2       LYS  62   6.589  -3.300  11.362
  459   2HD   LYS  62          HD1       LYS  62   5.333  -2.363  12.169
  460   1HE   LYS  62          HE2       LYS  62   6.598  -3.326  13.929
  461   2HE   LYS  62          HE1       LYS  62   5.147  -4.322  13.814
  462   1HZ   LYS  62          HZ1       LYS  62   7.119  -5.288  12.043
  463   2HZ   LYS  62          HZ2       LYS  62   6.384  -6.079  13.355
  464   3HZ   LYS  62          HZ3       LYS  62   7.783  -5.148  13.597
  465    H    THR  63           HN       THR  63   2.176  -3.161   7.790
  466    HA   THR  63           HA       THR  63   3.597  -1.775   5.747
  467    HB   THR  63           HB       THR  63   0.674  -2.597   5.792
  468    HG1  THR  63           HG1      THR  63   3.086  -3.916   5.224
  469   1HG2  THR  63          HG21      THR  63   1.133  -2.712   3.263
  470   2HG2  THR  63          HG22      THR  63   2.562  -1.735   3.599
  471   3HG2  THR  63          HG23      THR  63   0.957  -1.108   3.971
  472    H    GLN  64           HN       GLN  64   0.773  -0.896   7.706
  473    HA   GLN  64           HA       GLN  64   0.208   1.591   6.443
  474   1HB   GLN  64          HB2       GLN  64  -0.204   0.665   9.298
  475   2HB   GLN  64          HB1       GLN  64  -0.810   2.202   8.683
  476   1HG   GLN  64          HG2       GLN  64  -1.444  -0.462   7.392
  477   2HG   GLN  64          HG1       GLN  64  -2.480   0.299   8.602
  478   1HE2  GLN  64          HE21      GLN  64  -1.739   0.221   5.248
  479   2HE2  GLN  64          HE22      GLN  64  -2.625   1.593   4.789
  480    H    ARG  65           HN       ARG  65   2.411   0.802   9.163
  481    HA   ARG  65           HA       ARG  65   3.184   3.523   9.644
  482   1HB   ARG  65          HB2       ARG  65   3.677   1.673  11.217
  483   2HB   ARG  65          HB1       ARG  65   4.813   0.998  10.052
  484   1HG   ARG  65          HG2       ARG  65   5.444   3.812  10.469
  485   2HG   ARG  65          HG1       ARG  65   5.340   3.012  12.028
  486   1HD   ARG  65          HD2       ARG  65   7.040   2.123   9.688
  487   2HD   ARG  65          HD1       ARG  65   7.639   2.912  11.141
  488    HE   ARG  65           HE       ARG  65   7.095   0.096  10.775
  489   1HH1  ARG  65          HH21      ARG  65   6.718   2.628  13.094
  490   2HH1  ARG  65          HH22      ARG  65   6.513   1.540  14.424
  491   1HH2  ARG  65          HH11      ARG  65   6.847  -1.315  12.494
  492   2HH2  ARG  65          HH12      ARG  65   6.589  -0.686  14.087
  493    H    MET  66           HN       MET  66   4.705   0.978   7.644
  494    HA   MET  66           HA       MET  66   6.852   2.596   6.710
  495   1HB   MET  66          HB2       MET  66   5.475   0.202   5.467
  496   2HB   MET  66          HB1       MET  66   6.921   0.949   4.787
  497   1HG   MET  66          HG2       MET  66   8.024   0.619   7.061
  498   2HG   MET  66          HG1       MET  66   6.631  -0.371   7.497
  499   1HE   MET  66          HE1       MET  66   6.805  -3.491   5.459
  500   2HE   MET  66          HE2       MET  66   5.800  -2.093   5.098
  501   3HE   MET  66          HE3       MET  66   6.083  -2.554   6.774
  502    H    LEU  67           HN       LEU  67   3.583   2.086   5.339
  503    HA   LEU  67           HA       LEU  67   4.038   3.619   2.962
  504   1HB   LEU  67          HB2       LEU  67   1.505   3.110   4.546
  505   2HB   LEU  67          HB1       LEU  67   1.523   3.948   2.997
  506    HG   LEU  67           HG       LEU  67   2.613   1.149   3.426
  507   1HD1  LEU  67          HD11      LEU  67  -0.067   2.124   2.401
  508   2HD1  LEU  67          HD12      LEU  67   0.228   1.099   3.805
  509   3HD1  LEU  67          HD13      LEU  67   0.518   0.475   2.181
  510   1HD2  LEU  67          HD21      LEU  67   2.166   1.224   0.814
  511   2HD2  LEU  67          HD22      LEU  67   3.645   1.918   1.466
  512   3HD2  LEU  67          HD23      LEU  67   2.293   2.968   1.040
  513    H    SER  68           HN       SER  68   2.949   4.547   6.212
  514    HA   SER  68           HA       SER  68   2.353   7.269   5.635
  515   1HB   SER  68          HB2       SER  68   3.366   5.944   8.163
  516   2HB   SER  68          HB1       SER  68   2.869   7.632   8.089
  517    HG   SER  68           HG       SER  68   0.843   7.029   7.938
  518    H    GLY  69           HN       GLY  69   5.392   5.655   6.490
  519   1HA   GLY  69          HA2       GLY  69   7.051   7.898   6.836
  520   2HA   GLY  69          HA1       GLY  69   7.607   6.369   6.153
  521    H    PHE  70           HN       PHE  70   5.697   6.557   3.880
  522    HA   PHE  70           HA       PHE  70   7.336   8.377   2.196
  523   1HB   PHE  70          HB2       PHE  70   5.389   6.142   1.609
  524   2HB   PHE  70          HB1       PHE  70   5.932   7.237   0.339
  525    HD1  PHE  70           HD1      PHE  70   8.259   7.262  -0.401
  526    HD2  PHE  70           HD2      PHE  70   6.931   4.566   2.668
  527    HE1  PHE  70           HE1      PHE  70  10.341   5.942  -0.662
  528    HE2  PHE  70           HE2      PHE  70   9.014   3.246   2.409
  529    HZ   PHE  70           HZ       PHE  70  10.719   3.931   0.743
  530    H    CYS  71           HN       CYS  71   4.273   8.374   3.768
  531    HA   CYS  71           HA       CYS  71   3.528  10.827   2.250
  532   1HB   CYS  71          HB2       CYS  71   2.126   8.259   2.139
  533   2HB   CYS  71          HB1       CYS  71   1.058   9.563   2.650
  534    HA   PRO  72           HA       PRO  72   3.069  11.577   6.828
  535   1HB   PRO  72          HB2       PRO  72   3.065  14.384   5.849
  536   2HB   PRO  72          HB1       PRO  72   4.092  13.628   7.074
  537   1HG   PRO  72          HG2       PRO  72   5.008  14.355   4.607
  538   2HG   PRO  72          HG1       PRO  72   5.699  13.013   5.532
  539   1HD   PRO  72          HD2       PRO  72   3.938  12.925   3.126
  540   2HD   PRO  72          HD1       PRO  72   5.132  11.728   3.697
  541    H    HIS  73           HN       HIS  73   0.878  10.989   4.926
  542    HA   HIS  73           HA       HIS  73  -1.079  13.151   5.299
  543   1HB   HIS  73          HB2       HIS  73  -0.620  11.273   3.316
  544   2HB   HIS  73          HB1       HIS  73  -2.008  10.576   4.142
  545    HD1  HIS  73           HD1      HIS  73  -4.256  11.736   3.826
  546    HD2  HIS  73           HD2      HIS  73  -1.067  13.900   2.251
  547    HE1  HIS  73           HE1      HIS  73  -5.282  13.645   2.526
  548    H    LYS  74           HN       LYS  74  -1.859  13.213   7.388
  549    HA   LYS  74           HA       LYS  74  -2.479  10.737   8.847
  550   1HB   LYS  74          HB2       LYS  74  -3.000  13.669   9.447
  551   2HB   LYS  74          HB1       LYS  74  -3.460  12.355  10.529
  552   1HG   LYS  74          HG2       LYS  74  -1.103  11.638  10.666
  553   2HG   LYS  74          HG1       LYS  74  -0.640  12.955   9.586
  554   1HD   LYS  74          HD2       LYS  74  -1.510  14.598  11.210
  555   2HD   LYS  74          HD1       LYS  74  -1.968  13.282  12.293
  556   1HE   LYS  74          HE2       LYS  74   0.302  12.660  12.664
  557   2HE   LYS  74          HE1       LYS  74   0.869  13.650  11.319
  558   1HZ   LYS  74          HZ1       LYS  74   1.046  14.518  13.748
  559   2HZ   LYS  74          HZ2       LYS  74  -0.588  14.928  13.526
  560   3HZ   LYS  74          HZ3       LYS  74   0.601  15.576  12.500
  561    H    VAL  75           HN       VAL  75  -4.065   9.728   7.524
  562    HA   VAL  75           HA       VAL  75  -6.527  11.278   6.882
  563    HB   VAL  75           HB       VAL  75  -5.608   8.518   6.034
  564   1HG1  VAL  75          HG11      VAL  75  -8.084  10.144   5.432
  565   2HG1  VAL  75          HG12      VAL  75  -7.982   8.473   5.985
  566   3HG1  VAL  75          HG13      VAL  75  -7.514   8.886   4.339
  567   1HG2  VAL  75          HG21      VAL  75  -4.313  10.437   5.105
  568   2HG2  VAL  75          HG22      VAL  75  -5.819  11.129   4.501
  569   3HG2  VAL  75          HG23      VAL  75  -5.238   9.591   3.863
  570    H    SER  76           HN       SER  76  -8.430  10.920   7.928
  571    HA   SER  76           HA       SER  76  -8.476   8.864  10.096
  572   1HB   SER  76          HB2       SER  76  -9.042  11.004  10.959
  573   2HB   SER  76          HB1       SER  76 -10.050  11.389   9.567
  574    HG   SER  76           HG       SER  76 -11.633  10.215  10.377
  575    H    ALA  77           HN       ALA  77 -10.416   7.538  10.317
  576    HA   ALA  77           HA       ALA  77 -11.294   6.329   7.909
  577   1HB   ALA  77          HB1       ALA  77 -11.469   5.161  10.037
  578   2HB   ALA  77          HB2       ALA  77 -13.080   5.301   9.332
  579   3HB   ALA  77          HB3       ALA  77 -12.597   6.373  10.646
  580    H    GLY  78           HN       GLY  78 -12.029   9.387   8.978
  581   1HA   GLY  78          HA2       GLY  78 -14.759   9.388   7.731
  582   2HA   GLY  78          HA1       GLY  78 -14.170  10.599   8.867
  583    H    GLN  79           HN       GLN  79 -11.517  10.759   7.536
  584    HA   GLN  79           HA       GLN  79 -12.326  12.635   5.393
  585   1HB   GLN  79          HB2       GLN  79  -9.674  12.048   6.731
  586   2HB   GLN  79          HB1       GLN  79  -9.862  13.200   5.408
  587   1HG   GLN  79          HG2       GLN  79 -11.505  14.468   6.743
  588   2HG   GLN  79          HG1       GLN  79 -11.315  13.318   8.067
  589   1HE2  GLN  79          HE21      GLN  79 -10.251  14.629   9.617
  590   2HE2  GLN  79          HE22      GLN  79  -8.760  15.392   9.337
  591    H    PHE  80           HN       PHE  80 -12.142  12.157   3.256
  592    HA   PHE  80           HA       PHE  80 -10.376   9.881   2.427
  593   1HB   PHE  80          HB2       PHE  80 -13.225  10.429   1.560
  594   2HB   PHE  80          HB1       PHE  80 -12.152   9.272   0.774
  595    HD1  PHE  80           HD1      PHE  80 -14.389   9.834   3.541
  596    HD2  PHE  80           HD2      PHE  80 -11.094   7.430   2.195
  597    HE1  PHE  80           HE1      PHE  80 -14.894   8.157   5.298
  598    HE2  PHE  80           HE2      PHE  80 -11.601   5.751   3.947
  599    HZ   PHE  80           HZ       PHE  80 -13.500   6.115   5.500
  600    H    SER  81           HN       SER  81  -9.326  10.176   0.432
  601    HA   SER  81           HA       SER  81  -9.694  12.874  -0.845
  602   1HB   SER  81          HB2       SER  81  -7.191  11.298  -0.257
  603   2HB   SER  81          HB1       SER  81  -7.219  12.618  -1.425
  604    HG   SER  81           HG       SER  81  -8.251  13.823   0.401
  605    H    SER  82           HN       SER  82  -8.536   9.530  -1.534
  606    HA   SER  82           HA       SER  82  -8.915  10.066  -4.430
  607   1HB   SER  82          HB2       SER  82  -6.845   8.945  -3.502
  608   2HB   SER  82          HB1       SER  82  -7.855   7.546  -3.145
  609    HG   SER  82           HG       SER  82  -8.462   8.117  -5.570
  610    H    LEU  83           HN       LEU  83 -10.776   8.679  -1.931
  611    HA   LEU  83           HA       LEU  83 -12.060   6.650  -3.636
  612   1HB   LEU  83          HB2       LEU  83 -12.505   7.689  -0.843
  613   2HB   LEU  83          HB1       LEU  83 -13.747   6.713  -1.616
  614    HG   LEU  83           HG       LEU  83 -12.011   4.950  -2.045
  615   1HD1  LEU  83          HD11      LEU  83 -10.342   6.872  -0.403
  616   2HD1  LEU  83          HD12      LEU  83  -9.979   6.225  -2.003
  617   3HD1  LEU  83          HD13      LEU  83  -9.927   5.168  -0.592
  618   1HD2  LEU  83          HD21      LEU  83 -13.516   4.854  -0.077
  619   2HD2  LEU  83          HD22      LEU  83 -12.344   5.785   0.855
  620   3HD2  LEU  83          HD23      LEU  83 -11.934   4.168   0.289
  621    H    HIS  84           HN       HIS  84 -12.031   9.487  -4.537
  622    HA   HIS  84           HA       HIS  84 -14.707  10.561  -4.197
  623   1HB   HIS  84          HB2       HIS  84 -12.539  11.174  -6.225
  624   2HB   HIS  84          HB1       HIS  84 -14.033  12.096  -6.054
  625    HD1  HIS  84           HD1      HIS  84 -13.151  11.046  -2.772
  626    HD2  HIS  84           HD2      HIS  84 -11.795  14.073  -5.294
  627    HE1  HIS  84           HE1      HIS  84 -11.962  12.721  -1.302
  628    H    VAL  85           HN       VAL  85 -13.085   8.688  -6.749
  629    HA   VAL  85           HA       VAL  85 -15.408   8.747  -8.499
  630    HB   VAL  85           HB       VAL  85 -14.164   7.082  -9.828
  631   1HG1  VAL  85          HG11      VAL  85 -12.619   9.442  -8.737
  632   2HG1  VAL  85          HG12      VAL  85 -13.535   9.348 -10.240
  633   3HG1  VAL  85          HG13      VAL  85 -12.021   8.459 -10.074
  634   1HG2  VAL  85          HG21      VAL  85 -11.845   6.469  -8.959
  635   2HG2  VAL  85          HG22      VAL  85 -13.193   5.697  -8.125
  636   3HG2  VAL  85          HG23      VAL  85 -12.370   7.071  -7.387
  637    H    ARG  86           HN       ARG  86 -16.893   7.028  -8.862
  638    HA   ARG  86           HA       ARG  86 -17.274   5.288  -6.499
  639   1HB   ARG  86          HB2       ARG  86 -18.971   5.820  -8.955
  640   2HB   ARG  86          HB1       ARG  86 -19.429   4.708  -7.664
  641   1HG   ARG  86          HG2       ARG  86 -19.271   6.558  -6.025
  642   2HG   ARG  86          HG1       ARG  86 -18.853   7.666  -7.331
  643   1HD   ARG  86          HD2       ARG  86 -21.415   6.052  -7.234
  644   2HD   ARG  86          HD1       ARG  86 -21.283   7.730  -6.709
  645    HE   ARG  86           HE       ARG  86 -20.288   7.790  -9.284
  646   1HH1  ARG  86          HH21      ARG  86 -23.121   6.569  -7.748
  647   2HH1  ARG  86          HH22      ARG  86 -24.146   6.844  -9.117
  648   1HH2  ARG  86          HH11      ARG  86 -21.610   8.160 -11.084
  649   2HH2  ARG  86          HH12      ARG  86 -23.290   7.744 -11.007
  650    H    ASP  87           HN       ASP  87 -15.146   4.211  -7.332
  651    HA   ASP  87           HA       ASP  87 -15.535   2.328  -9.563
  652   1HB   ASP  87          HB2       ASP  87 -13.252   2.784  -7.620
  653   2HB   ASP  87          HB1       ASP  87 -13.231   1.539  -8.870
  654    H    THR  88           HN       THR  88 -14.801  -0.052  -8.971
  655    HA   THR  88           HA       THR  88 -16.604  -0.929  -6.791
  656    HB   THR  88           HB       THR  88 -16.314  -3.163  -7.726
  657    HG1  THR  88           HG1      THR  88 -14.615  -2.101  -9.693
  658   1HG2  THR  88          HG21      THR  88 -16.668  -1.014  -9.832
  659   2HG2  THR  88          HG22      THR  88 -17.937  -1.761  -8.861
  660   3HG2  THR  88          HG23      THR  88 -17.077  -2.714 -10.070
  661    H    LYS  89           HN       LYS  89 -15.812  -2.572  -5.242
  662    HA   LYS  89           HA       LYS  89 -13.119  -1.857  -4.259
  663   1HB   LYS  89          HB2       LYS  89 -15.319  -3.588  -3.095
  664   2HB   LYS  89          HB1       LYS  89 -13.800  -3.220  -2.280
  665   1HG   LYS  89          HG2       LYS  89 -14.331  -0.805  -2.400
  666   2HG   LYS  89          HG1       LYS  89 -15.851  -1.186  -3.203
  667   1HD   LYS  89          HD2       LYS  89 -16.518  -0.957  -0.963
  668   2HD   LYS  89          HD1       LYS  89 -16.309  -2.699  -1.119
  669   1HE   LYS  89          HE2       LYS  89 -14.138  -2.600  -0.066
  670   2HE   LYS  89          HE1       LYS  89 -14.147  -0.837  -0.094
  671   1HZ   LYS  89          HZ1       LYS  89 -16.044  -0.848   1.384
  672   2HZ   LYS  89          HZ2       LYS  89 -14.754  -1.707   2.080
  673   3HZ   LYS  89          HZ3       LYS  89 -16.065  -2.543   1.396
  674    H    ILE  90           HN       ILE  90 -11.497  -3.469  -3.825
  675    HA   ILE  90           HA       ILE  90 -11.861  -6.076  -5.266
  676    HB   ILE  90           HB       ILE  90  -9.488  -5.855  -6.013
  677   1HG1  ILE  90          HG12      ILE  90  -9.769  -2.965  -5.129
  678   2HG1  ILE  90          HG11      ILE  90  -8.882  -4.175  -4.203
  679   1HG2  ILE  90          HG21      ILE  90 -11.352  -5.252  -7.504
  680   2HG2  ILE  90          HG22      ILE  90  -9.970  -4.190  -7.778
  681   3HG2  ILE  90          HG23      ILE  90 -11.355  -3.615  -6.849
  682   1HD1  ILE  90          HD11      ILE  90  -7.318  -2.960  -5.620
  683   2HD1  ILE  90          HD12      ILE  90  -8.298  -3.304  -7.046
  684   3HD1  ILE  90          HD13      ILE  90  -7.465  -4.615  -6.211
  685    H    GLU  91           HN       GLU  91 -10.372  -7.766  -4.526
  686    HA   GLU  91           HA       GLU  91 -10.288  -7.986  -1.683
  687   1HB   GLU  91          HB2       GLU  91  -8.765  -9.521  -3.808
  688   2HB   GLU  91          HB1       GLU  91  -8.889 -10.002  -2.115
  689   1HG   GLU  91          HG2       GLU  91 -11.344 -10.123  -2.326
  690   2HG   GLU  91          HG1       GLU  91 -11.222  -9.646  -4.020
  691    H    VAL  92           HN       VAL  92  -8.612  -7.658  -0.205
  692    HA   VAL  92           HA       VAL  92  -6.672  -5.666  -0.779
  693    HB   VAL  92           HB       VAL  92  -6.813  -7.742   1.425
  694   1HG1  VAL  92          HG11      VAL  92  -4.492  -7.139   1.288
  695   2HG1  VAL  92          HG12      VAL  92  -5.175  -6.161   2.587
  696   3HG1  VAL  92          HG13      VAL  92  -4.882  -5.443   1.004
  697   1HG2  VAL  92          HG21      VAL  92  -7.809  -6.040   2.714
  698   2HG2  VAL  92          HG22      VAL  92  -8.532  -5.792   1.125
  699   3HG2  VAL  92          HG23      VAL  92  -7.212  -4.756   1.664
  700    H    ALA  93           HN       ALA  93  -6.395  -9.221  -0.788
  701    HA   ALA  93           HA       ALA  93  -3.603  -9.438  -1.126
  702   1HB   ALA  93          HB1       ALA  93  -5.736 -11.132  -2.460
  703   2HB   ALA  93          HB2       ALA  93  -5.117 -11.382  -0.828
  704   3HB   ALA  93          HB3       ALA  93  -4.050 -11.591  -2.216
  705    H    GLN  94           HN       GLN  94  -6.121  -8.823  -3.561
  706    HA   GLN  94           HA       GLN  94  -4.231  -8.812  -5.774
  707   1HB   GLN  94          HB2       GLN  94  -6.661  -9.307  -6.067
  708   2HB   GLN  94          HB1       GLN  94  -7.029  -7.639  -5.629
  709   1HG   GLN  94          HG2       GLN  94  -5.680  -6.840  -7.539
  710   2HG   GLN  94          HG1       GLN  94  -5.317  -8.509  -7.978
  711   1HE2  GLN  94          HE21      GLN  94  -6.487  -8.597  -9.973
  712   2HE2  GLN  94          HE22      GLN  94  -8.171  -8.400 -10.067
  713    H    PHE  95           HN       PHE  95  -5.594  -6.423  -3.585
  714    HA   PHE  95           HA       PHE  95  -4.832  -4.053  -4.970
  715   1HB   PHE  95          HB2       PHE  95  -6.286  -3.977  -3.005
  716   2HB   PHE  95          HB1       PHE  95  -4.995  -4.628  -1.998
  717    HD1  PHE  95           HD1      PHE  95  -6.297  -1.653  -3.681
  718    HD2  PHE  95           HD2      PHE  95  -2.986  -3.291  -1.490
  719    HE1  PHE  95           HE1      PHE  95  -5.437   0.635  -3.266
  720    HE2  PHE  95           HE2      PHE  95  -2.125  -1.003  -1.077
  721    HZ   PHE  95           HZ       PHE  95  -3.351   0.958  -1.965
  722    H    VAL  96           HN       VAL  96  -3.083  -5.944  -2.490
  723    HA   VAL  96           HA       VAL  96  -0.717  -4.358  -2.495
  724    HB   VAL  96           HB       VAL  96  -1.050  -7.325  -1.958
  725   1HG1  VAL  96          HG11      VAL  96   1.270  -6.938  -2.330
  726   2HG1  VAL  96          HG12      VAL  96   1.067  -6.897  -0.578
  727   3HG1  VAL  96          HG13      VAL  96   1.225  -5.392  -1.483
  728   1HG2  VAL  96          HG21      VAL  96  -1.031  -6.566   0.424
  729   2HG2  VAL  96          HG22      VAL  96  -2.418  -5.954  -0.476
  730   3HG2  VAL  96          HG23      VAL  96  -1.047  -4.895  -0.142
  731    H    LYS  97           HN       LYS  97  -1.586  -7.251  -4.403
  732    HA   LYS  97           HA       LYS  97   0.900  -7.518  -5.754
  733   1HB   LYS  97          HB2       LYS  97  -1.920  -8.194  -6.623
  734   2HB   LYS  97          HB1       LYS  97  -0.485  -8.651  -7.543
  735   1HG   LYS  97          HG2       LYS  97   0.383  -9.879  -5.587
  736   2HG   LYS  97          HG1       LYS  97  -1.051  -9.427  -4.666
  737   1HD   LYS  97          HD2       LYS  97  -2.476 -10.603  -6.302
  738   2HD   LYS  97          HD1       LYS  97  -1.042 -11.059  -7.219
  739   1HE   LYS  97          HE2       LYS  97  -1.619 -12.937  -5.835
  740   2HE   LYS  97          HE1       LYS  97  -0.182 -12.195  -5.133
  741   1HZ   LYS  97          HZ1       LYS  97  -1.980 -10.846  -3.818
  742   2HZ   LYS  97          HZ2       LYS  97  -1.487 -12.386  -3.295
  743   3HZ   LYS  97          HZ3       LYS  97  -2.941 -12.203  -4.153
  744    H    ASP  98           HN       ASP  98  -2.044  -5.728  -6.745
  745    HA   ASP  98           HA       ASP  98  -0.984  -4.732  -9.192
  746   1HB   ASP  98          HB2       ASP  98  -3.047  -3.582  -7.294
  747   2HB   ASP  98          HB1       ASP  98  -2.693  -2.882  -8.876
  748    H    LEU  99           HN       LEU  99  -0.855  -3.443  -5.891
  749    HA   LEU  99           HA       LEU  99   0.511  -1.016  -6.595
  750   1HB   LEU  99          HB2       LEU  99  -0.667  -1.303  -4.441
  751   2HB   LEU  99          HB1       LEU  99   0.488  -2.547  -3.972
  752    HG   LEU  99           HG       LEU  99   2.320  -0.872  -4.126
  753   1HD1  LEU  99          HD11      LEU  99   1.627   0.769  -5.658
  754   2HD1  LEU  99          HD12      LEU  99   1.419   1.593  -4.117
  755   3HD1  LEU  99          HD13      LEU  99   0.021   0.899  -4.939
  756   1HD2  LEU  99          HD21      LEU  99   1.739   0.329  -2.086
  757   2HD2  LEU  99          HD22      LEU  99   1.111  -1.316  -1.991
  758   3HD2  LEU  99          HD23      LEU  99   0.025   0.023  -2.363
  759    H    LEU 100           HN       LEU 100   1.580  -4.280  -5.792
  760    HA   LEU 100           HA       LEU 100   4.320  -3.821  -5.352
  761   1HB   LEU 100          HB2       LEU 100   3.230  -5.993  -4.982
  762   2HB   LEU 100          HB1       LEU 100   3.013  -6.188  -6.717
  763    HG   LEU 100           HG       LEU 100   5.454  -6.188  -7.043
  764   1HD1  LEU 100          HD11      LEU 100   6.402  -4.872  -5.359
  765   2HD1  LEU 100          HD12      LEU 100   6.774  -6.491  -4.774
  766   3HD1  LEU 100          HD13      LEU 100   5.416  -5.596  -4.088
  767   1HD2  LEU 100          HD21      LEU 100   4.393  -8.335  -6.694
  768   2HD2  LEU 100          HD22      LEU 100   4.386  -8.100  -4.946
  769   3HD2  LEU 100          HD23      LEU 100   5.912  -8.335  -5.798
  770    H    LEU 101           HN       LEU 101   2.631  -4.225  -8.491
  771    HA   LEU 101           HA       LEU 101   5.006  -4.324 -10.077
  772   1HB   LEU 101          HB2       LEU 101   2.273  -3.187 -10.742
  773   2HB   LEU 101          HB1       LEU 101   3.564  -3.353 -11.922
  774    HG   LEU 101           HG       LEU 101   2.079  -5.249 -12.140
  775   1HD1  LEU 101          HD11      LEU 101   3.648  -6.953 -12.159
  776   2HD1  LEU 101          HD12      LEU 101   4.355  -6.482 -10.615
  777   3HD1  LEU 101          HD13      LEU 101   4.702  -5.543 -12.069
  778   1HD2  LEU 101          HD21      LEU 101   1.267  -5.008  -9.715
  779   2HD2  LEU 101          HD22      LEU 101   2.637  -6.031  -9.280
  780   3HD2  LEU 101          HD23      LEU 101   1.388  -6.640 -10.364
  781    H    HIS 102           HN       HIS 102   3.117  -1.533  -8.940
  782    HA   HIS 102           HA       HIS 102   4.790   0.395 -10.276
  783   1HB   HIS 102          HB2       HIS 102   2.763   0.574  -8.052
  784   2HB   HIS 102          HB1       HIS 102   3.722   1.978  -8.514
  785    HD1  HIS 102           HD1      HIS 102   3.117   3.172 -10.676
  786    HD2  HIS 102           HD2      HIS 102   1.030  -0.395 -10.164
  787    HE1  HIS 102           HE1      HIS 102   1.332   3.129 -12.473
  788    H    LEU 103           HN       LEU 103   4.875  -0.973  -6.968
  789    HA   LEU 103           HA       LEU 103   6.763   0.812  -5.873
  790   1HB   LEU 103          HB2       LEU 103   6.494  -2.167  -5.394
  791   2HB   LEU 103          HB1       LEU 103   7.469  -1.088  -4.400
  792    HG   LEU 103           HG       LEU 103   4.495  -0.773  -4.870
  793   1HD1  LEU 103          HD11      LEU 103   4.122  -1.740  -2.733
  794   2HD1  LEU 103          HD12      LEU 103   5.828  -1.635  -2.300
  795   3HD1  LEU 103          HD13      LEU 103   5.295  -2.811  -3.499
  796   1HD2  LEU 103          HD21      LEU 103   6.557   0.778  -3.322
  797   2HD2  LEU 103          HD22      LEU 103   4.912   0.694  -2.694
  798   3HD2  LEU 103          HD23      LEU 103   5.208   1.373  -4.289
  799    H    LYS 104           HN       LYS 104   7.574  -2.352  -7.411
  800    HA   LYS 104           HA       LYS 104  10.382  -1.723  -7.402
  801   1HB   LYS 104          HB2       LYS 104  10.582  -3.607  -9.049
  802   2HB   LYS 104          HB1       LYS 104   9.733  -4.032  -7.565
  803   1HG   LYS 104          HG2       LYS 104   7.571  -3.714  -8.707
  804   2HG   LYS 104          HG1       LYS 104   8.421  -3.292 -10.197
  805   1HD   LYS 104          HD2       LYS 104   9.510  -5.506 -10.210
  806   2HD   LYS 104          HD1       LYS 104   8.664  -5.934  -8.724
  807   1HE   LYS 104          HE2       LYS 104   6.573  -6.011  -9.789
  808   2HE   LYS 104          HE1       LYS 104   7.127  -5.052 -11.163
  809   1HZ   LYS 104          HZ1       LYS 104   7.995  -6.844 -12.166
  810   2HZ   LYS 104          HZ2       LYS 104   6.934  -7.717 -11.169
  811   3HZ   LYS 104          HZ3       LYS 104   8.561  -7.528 -10.721
  812    H    LYS 105           HN       LYS 105   7.813  -0.733  -9.486
  813    HA   LYS 105           HA       LYS 105   9.344  -0.256 -11.868
  814   1HB   LYS 105          HB2       LYS 105   6.860  -0.296 -11.795
  815   2HB   LYS 105          HB1       LYS 105   6.885   1.210 -10.882
  816   1HG   LYS 105          HG2       LYS 105   8.019   2.345 -12.742
  817   2HG   LYS 105          HG1       LYS 105   8.032   0.839 -13.661
  818   1HD   LYS 105          HD2       LYS 105   5.567   0.783 -13.613
  819   2HD   LYS 105          HD1       LYS 105   5.550   2.290 -12.694
  820   1HE   LYS 105          HE2       LYS 105   5.176   2.689 -15.112
  821   2HE   LYS 105          HE1       LYS 105   6.660   3.455 -14.547
  822   1HZ   LYS 105          HZ1       LYS 105   7.887   1.504 -15.350
  823   2HZ   LYS 105          HZ2       LYS 105   7.072   2.313 -16.602
  824   3HZ   LYS 105          HZ3       LYS 105   6.448   0.862 -15.975
  825    H    LEU 106           HN       LEU 106   8.471   1.960  -9.168
  826    HA   LEU 106           HA       LEU 106   9.853   4.221 -10.241
  827   1HB   LEU 106          HB2       LEU 106   9.040   3.446  -7.440
  828   2HB   LEU 106          HB1       LEU 106  10.022   4.879  -7.704
  829    HG   LEU 106           HG       LEU 106   7.653   5.469  -7.594
  830   1HD1  LEU 106          HD11      LEU 106   7.710   6.995  -9.304
  831   2HD1  LEU 106          HD12      LEU 106   8.171   5.805 -10.518
  832   3HD1  LEU 106          HD13      LEU 106   9.381   6.447  -9.408
  833   1HD2  LEU 106          HD21      LEU 106   6.736   3.315  -8.363
  834   2HD2  LEU 106          HD22      LEU 106   7.297   3.660  -9.999
  835   3HD2  LEU 106          HD23      LEU 106   6.054   4.665  -9.264
  836    H    PHE 107           HN       PHE 107  10.980   1.412  -8.501
  837    HA   PHE 107           HA       PHE 107  13.490   2.406  -7.618
  838   1HB   PHE 107          HB2       PHE 107  12.592   0.203  -6.931
  839   2HB   PHE 107          HB1       PHE 107  12.819  -0.394  -8.577
  840    HD1  PHE 107           HD1      PHE 107  14.645   1.147  -5.715
  841    HD2  PHE 107           HD2      PHE 107  14.915  -1.272  -9.253
  842    HE1  PHE 107           HE1      PHE 107  17.008   0.651  -5.189
  843    HE2  PHE 107           HE2      PHE 107  17.287  -1.778  -8.725
  844    HZ   PHE 107           HZ       PHE 107  18.335  -0.815  -6.691
  845    H    ARG 108           HN       ARG 108  12.499   1.040 -10.742
  846    HA   ARG 108           HA       ARG 108  15.078   0.920 -11.930
  847   1HB   ARG 108          HB2       ARG 108  12.342   1.385 -13.148
  848   2HB   ARG 108          HB1       ARG 108  13.801   1.145 -14.110
  849   1HG   ARG 108          HG2       ARG 108  14.166  -1.039 -13.019
  850   2HG   ARG 108          HG1       ARG 108  12.706  -0.804 -12.058
  851   1HD   ARG 108          HD2       ARG 108  12.198  -2.218 -13.990
  852   2HD   ARG 108          HD1       ARG 108  11.377  -0.669 -14.158
  853    HE   ARG 108           HE       ARG 108  13.764  -0.287 -15.505
  854   1HH1  ARG 108          HH21      ARG 108  11.217  -2.614 -15.554
  855   2HH1  ARG 108          HH22      ARG 108  11.393  -2.968 -17.240
  856   1HH2  ARG 108          HH11      ARG 108  14.007  -0.742 -17.710
  857   2HH2  ARG 108          HH12      ARG 108  12.971  -1.910 -18.459
  858    H    GLU 109           HN       GLU 109  12.749   3.617 -11.701
  859    HA   GLU 109           HA       GLU 109  14.580   5.384 -13.202
  860   1HB   GLU 109          HB2       GLU 109  11.953   5.982 -11.805
  861   2HB   GLU 109          HB1       GLU 109  12.831   7.092 -12.861
  862   1HG   GLU 109          HG2       GLU 109  12.625   5.472 -14.722
  863   2HG   GLU 109          HG1       GLU 109  11.724   4.386 -13.666
  864    H    GLY 110           HN       GLY 110  14.212   4.385  -9.975
  865   1HA   GLY 110          HA2       GLY 110  15.303   5.085  -8.027
  866   2HA   GLY 110          HA1       GLY 110  16.285   6.138  -9.044
  867    H    ARG 111           HN       ARG 111  12.981   6.704  -9.548
  868    HA   ARG 111           HA       ARG 111  13.159   9.229  -7.980
  869   1HB   ARG 111          HB2       ARG 111  11.153   8.242 -10.034
  870   2HB   ARG 111          HB1       ARG 111  11.053   9.803  -9.218
  871   1HG   ARG 111          HG2       ARG 111  13.261  10.419 -10.127
  872   2HG   ARG 111          HG1       ARG 111  13.359   8.867 -10.954
  873   1HD   ARG 111          HD2       ARG 111  11.098   9.525 -12.030
  874   2HD   ARG 111          HD1       ARG 111  11.458  11.160 -11.486
  875    HE   ARG 111           HE       ARG 111  12.537   9.859 -13.800
  876   1HH1  ARG 111          HH21      ARG 111  13.559  11.791 -11.125
  877   2HH1  ARG 111          HH22      ARG 111  15.047  12.254 -11.875
  878   1HH2  ARG 111          HH11      ARG 111  14.453  10.468 -14.780
  879   2HH2  ARG 111          HH12      ARG 111  15.551  11.512 -13.941
  880    H    PHE 112           HN       PHE 112  12.789   8.503  -5.869
  881    HA   PHE 112           HA       PHE 112  10.471   6.784  -5.281
  882   1HB   PHE 112          HB2       PHE 112  12.407   8.130  -3.381
  883   2HB   PHE 112          HB1       PHE 112  11.337   6.766  -3.028
  884    HD1  PHE 112           HD1      PHE 112  11.705   4.567  -4.088
  885    HD2  PHE 112           HD2      PHE 112  14.437   7.827  -4.662
  886    HE1  PHE 112           HE1      PHE 112  13.394   2.994  -4.998
  887    HE2  PHE 112           HE2      PHE 112  16.124   6.253  -5.576
  888    HZ   PHE 112           HZ       PHE 112  15.603   3.837  -5.739
  889    H    ASN 113           HN       ASN 113   8.888   7.474  -3.601
  890    HA   ASN 113           HA       ASN 113   7.879  10.150  -4.208
  891   1HB   ASN 113          HB2       ASN 113   6.311   8.284  -3.945
  892   2HB   ASN 113          HB1       ASN 113   6.882   8.015  -2.298
  893   1HD2  ASN 113          HD21      ASN 113   5.849  10.937  -4.167
  894   2HD2  ASN 113          HD22      ASN 113   4.793  11.505  -2.964
  Start of MODEL    2
    1   1H    MET   1           HT1      MET   1  21.423   5.005  11.766
    2   2H    MET   1           HT2      MET   1  22.675   4.927  12.912
    3   3H    MET   1           HT3      MET   1  22.589   6.235  11.832
    4    HA   MET   1           HA       MET   1  20.485   5.632  13.831
    5   1HB   MET   1          HB2       MET   1  22.888   7.469  13.981
    6   2HB   MET   1          HB1       MET   1  21.494   7.613  15.052
    7   1HG   MET   1          HG2       MET   1  21.836   5.285  15.811
    8   2HG   MET   1          HG1       MET   1  23.235   5.147  14.743
    9   1HE   MET   1          HE1       MET   1  24.539   4.326  16.722
   10   2HE   MET   1          HE2       MET   1  23.297   4.608  17.940
   11   3HE   MET   1          HE3       MET   1  24.924   5.236  18.189
   12    H    GLY   2           HN       GLY   2  21.902   7.695  11.352
   13   1HA   GLY   2          HA2       GLY   2  19.931   9.797  11.572
   14   2HA   GLY   2          HA1       GLY   2  21.017   9.548  10.204
   15    HA   PRO   3           HA       PRO   3  16.394   8.346   9.381
   16   1HB   PRO   3          HB2       PRO   3  16.657  10.143   7.082
   17   2HB   PRO   3          HB1       PRO   3  15.479  10.191   8.397
   18   1HG   PRO   3          HG2       PRO   3  17.736  11.924   8.012
   19   2HG   PRO   3          HG1       PRO   3  16.582  11.940   9.350
   20   1HD   PRO   3          HD2       PRO   3  19.344  11.154   9.461
   21   2HD   PRO   3          HD1       PRO   3  18.140  11.040  10.769
   22    H    VAL   4           HN       VAL   4  15.836   6.871   7.696
   23    HA   VAL   4           HA       VAL   4  18.105   5.654   6.341
   24    HB   VAL   4           HB       VAL   4  16.434   3.989   5.603
   25   1HG1  VAL   4          HG11      VAL   4  17.403   3.686   7.803
   26   2HG1  VAL   4          HG12      VAL   4  15.685   3.303   7.904
   27   3HG1  VAL   4          HG13      VAL   4  16.279   4.851   8.502
   28   1HG2  VAL   4          HG21      VAL   4  14.511   5.956   6.878
   29   2HG2  VAL   4          HG22      VAL   4  14.080   4.293   6.484
   30   3HG2  VAL   4          HG23      VAL   4  14.523   5.416   5.199
   31    HA   PRO   5           HA       PRO   5  17.433   7.941   2.529
   32   1HB   PRO   5          HB2       PRO   5  18.566   6.084   0.745
   33   2HB   PRO   5          HB1       PRO   5  19.451   7.321   1.649
   34   1HG   PRO   5          HG2       PRO   5  19.291   4.401   2.136
   35   2HG   PRO   5          HG1       PRO   5  20.554   5.547   2.600
   36   1HD   PRO   5          HD2       PRO   5  18.643   4.444   4.349
   37   2HD   PRO   5          HD1       PRO   5  19.618   5.903   4.669
   38    HA   PRO   6           HA       PRO   6  13.697   6.345   0.704
   39   1HB   PRO   6          HB2       PRO   6  14.063   7.119  -1.972
   40   2HB   PRO   6          HB1       PRO   6  13.408   8.132  -0.679
   41   1HG   PRO   6          HG2       PRO   6  16.094   8.193  -1.933
   42   2HG   PRO   6          HG1       PRO   6  15.215   9.480  -1.097
   43   1HD   PRO   6          HD2       PRO   6  17.386   8.054  -0.027
   44   2HD   PRO   6          HD1       PRO   6  16.200   8.986   0.924
   45    H    SER   7           HN       SER   7  16.466   5.667  -1.466
   46    HA   SER   7           HA       SER   7  15.263   3.492  -2.844
   47   1HB   SER   7          HB2       SER   7  17.473   2.920  -3.581
   48   2HB   SER   7          HB1       SER   7  17.432   4.674  -3.444
   49    HG   SER   7           HG       SER   7  18.106   3.400  -1.116
   50    H    THR   8           HN       THR   8  17.140   3.561   0.160
   51    HA   THR   8           HA       THR   8  17.217   0.691   0.469
   52    HB   THR   8           HB       THR   8  17.504   2.911   2.511
   53    HG1  THR   8           HG1      THR   8  19.045   2.777   0.772
   54   1HG2  THR   8          HG21      THR   8  17.944  -0.072   2.670
   55   2HG2  THR   8          HG22      THR   8  16.977   0.945   3.738
   56   3HG2  THR   8          HG23      THR   8  18.737   1.053   3.772
   57    H    ALA   9           HN       ALA   9  15.030   3.201   1.736
   58    HA   ALA   9           HA       ALA   9  13.505   1.457   3.405
   59   1HB   ALA   9          HB1       ALA   9  12.555   3.949   1.963
   60   2HB   ALA   9          HB2       ALA   9  13.415   3.945   3.501
   61   3HB   ALA   9          HB3       ALA   9  11.814   3.215   3.387
   62    H    LEU  10           HN       LEU  10  13.113   2.367  -0.027
   63    HA   LEU  10           HA       LEU  10  10.636   0.971  -0.393
   64   1HB   LEU  10          HB2       LEU  10  11.553   2.650  -2.006
   65   2HB   LEU  10          HB1       LEU  10  12.793   1.482  -2.465
   66    HG   LEU  10           HG       LEU  10  10.964  -0.128  -3.093
   67   1HD1  LEU  10          HD11      LEU  10   9.013   0.472  -1.984
   68   2HD1  LEU  10          HD12      LEU  10   8.717   1.211  -3.554
   69   3HD1  LEU  10          HD13      LEU  10   9.281   2.202  -2.209
   70   1HD2  LEU  10          HD21      LEU  10  10.237   1.246  -5.134
   71   2HD2  LEU  10          HD22      LEU  10  11.968   1.056  -4.881
   72   3HD2  LEU  10          HD23      LEU  10  11.175   2.565  -4.439
   73    H    ARG  11           HN       ARG  11  14.030  -0.046  -0.895
   74    HA   ARG  11           HA       ARG  11  13.438  -2.650  -1.892
   75   1HB   ARG  11          HB2       ARG  11  15.784  -1.625  -0.263
   76   2HB   ARG  11          HB1       ARG  11  15.729  -3.241  -0.960
   77   1HG   ARG  11          HG2       ARG  11  15.275  -0.814  -2.697
   78   2HG   ARG  11          HG1       ARG  11  16.911  -1.331  -2.299
   79   1HD   ARG  11          HD2       ARG  11  14.793  -3.006  -3.689
   80   2HD   ARG  11          HD1       ARG  11  16.249  -2.338  -4.417
   81    HE   ARG  11           HE       ARG  11  17.236  -3.866  -2.346
   82   1HH1  ARG  11          HH21      ARG  11  15.021  -4.365  -4.943
   83   2HH1  ARG  11          HH22      ARG  11  15.423  -6.038  -5.139
   84   1HH2  ARG  11          HH11      ARG  11  17.773  -6.048  -2.590
   85   2HH2  ARG  11          HH12      ARG  11  16.980  -6.990  -3.807
   86    H    GLU  12           HN       GLU  12  13.879  -1.436   1.401
   87    HA   GLU  12           HA       GLU  12  13.539  -3.944   2.735
   88   1HB   GLU  12          HB2       GLU  12  13.066  -1.084   3.617
   89   2HB   GLU  12          HB1       GLU  12  12.913  -2.465   4.707
   90   1HG   GLU  12          HG2       GLU  12  15.232  -3.093   4.313
   91   2HG   GLU  12          HG1       GLU  12  15.404  -1.823   3.101
   92    H    LEU  13           HN       LEU  13  11.249  -1.447   1.698
   93    HA   LEU  13           HA       LEU  13   8.947  -2.655   2.927
   94   1HB   LEU  13          HB2       LEU  13   9.009  -0.288   2.253
   95   2HB   LEU  13          HB1       LEU  13   9.167  -0.764   0.565
   96    HG   LEU  13           HG       LEU  13   6.954  -1.841   0.643
   97   1HD1  LEU  13          HD11      LEU  13   5.579  -1.194   2.798
   98   2HD1  LEU  13          HD12      LEU  13   7.171  -1.091   3.552
   99   3HD1  LEU  13          HD13      LEU  13   6.630  -2.608   2.833
  100   1HD2  LEU  13          HD21      LEU  13   7.012   0.995   1.724
  101   2HD2  LEU  13          HD22      LEU  13   5.611   0.239   0.968
  102   3HD2  LEU  13          HD23      LEU  13   7.073   0.528   0.025
  103    H    ILE  14           HN       ILE  14  10.284  -2.836  -0.384
  104    HA   ILE  14           HA       ILE  14   8.203  -4.464  -1.468
  105    HB   ILE  14           HB       ILE  14  11.131  -4.208  -2.202
  106   1HG1  ILE  14          HG12      ILE  14   8.649  -3.174  -3.601
  107   2HG1  ILE  14          HG11      ILE  14   9.554  -2.223  -2.422
  108   1HG2  ILE  14          HG21      ILE  14  10.568  -6.296  -3.135
  109   2HG2  ILE  14          HG22      ILE  14  10.197  -5.178  -4.446
  110   3HG2  ILE  14          HG23      ILE  14   8.898  -5.820  -3.441
  111   1HD1  ILE  14          HD11      ILE  14  10.288  -1.699  -4.717
  112   2HD1  ILE  14          HD12      ILE  14  10.681  -3.397  -4.982
  113   3HD1  ILE  14          HD13      ILE  14  11.591  -2.455  -3.800
  114    H    GLU  15           HN       GLU  15  11.287  -5.373   0.086
  115    HA   GLU  15           HA       GLU  15  11.053  -8.178  -0.276
  116   1HB   GLU  15          HB2       GLU  15  12.379  -6.550   1.907
  117   2HB   GLU  15          HB1       GLU  15  12.545  -8.300   1.771
  118   1HG   GLU  15          HG2       GLU  15  13.204  -6.396  -0.487
  119   2HG   GLU  15          HG1       GLU  15  14.404  -6.967   0.673
  120    H    GLU  16           HN       GLU  16   9.792  -6.084   2.328
  121    HA   GLU  16           HA       GLU  16   8.803  -8.280   3.922
  122   1HB   GLU  16          HB2       GLU  16   9.222  -5.965   4.792
  123   2HB   GLU  16          HB1       GLU  16   7.820  -5.416   3.877
  124   1HG   GLU  16          HG2       GLU  16   7.120  -5.846   6.161
  125   2HG   GLU  16          HG1       GLU  16   6.423  -7.090   5.127
  126    H    LEU  17           HN       LEU  17   7.216  -6.115   1.548
  127    HA   LEU  17           HA       LEU  17   4.592  -7.186   1.839
  128   1HB   LEU  17          HB2       LEU  17   5.976  -5.968  -0.562
  129   2HB   LEU  17          HB1       LEU  17   4.260  -6.363  -0.531
  130    HG   LEU  17           HG       LEU  17   5.619  -4.523   1.460
  131   1HD1  LEU  17          HD11      LEU  17   3.907  -3.820  -0.941
  132   2HD1  LEU  17          HD12      LEU  17   5.659  -3.639  -0.867
  133   3HD1  LEU  17          HD13      LEU  17   4.629  -2.682   0.197
  134   1HD2  LEU  17          HD21      LEU  17   2.791  -5.469   1.025
  135   2HD2  LEU  17          HD22      LEU  17   3.047  -3.827   1.613
  136   3HD2  LEU  17          HD23      LEU  17   3.661  -5.195   2.535
  137    H    VAL  18           HN       VAL  18   7.178  -8.071  -0.442
  138    HA   VAL  18           HA       VAL  18   5.759 -10.166  -1.748
  139    HB   VAL  18           HB       VAL  18   8.725  -9.750  -1.265
  140   1HG1  VAL  18          HG11      VAL  18   8.429 -12.084  -1.772
  141   2HG1  VAL  18          HG12      VAL  18   8.966 -11.295  -3.253
  142   3HG1  VAL  18          HG13      VAL  18   7.267 -11.715  -3.047
  143   1HG2  VAL  18          HG21      VAL  18   7.399  -8.032  -2.592
  144   2HG2  VAL  18          HG22      VAL  18   7.084  -9.305  -3.771
  145   3HG2  VAL  18          HG23      VAL  18   8.739  -8.779  -3.462
  146    H    ASN  19           HN       ASN  19   7.890 -10.190   1.094
  147    HA   ASN  19           HA       ASN  19   7.956 -12.989   1.515
  148   1HB   ASN  19          HB2       ASN  19   8.153 -10.654   3.424
  149   2HB   ASN  19          HB1       ASN  19   8.405 -12.325   3.931
  150   1HD2  ASN  19          HD21      ASN  19  10.458 -10.185   3.874
  151   2HD2  ASN  19          HD22      ASN  19  11.667 -10.716   2.807
  152    H    ILE  20           HN       ILE  20   5.675 -10.575   2.859
  153    HA   ILE  20           HA       ILE  20   4.177 -12.651   4.254
  154    HB   ILE  20           HB       ILE  20   2.691 -10.851   4.939
  155   1HG1  ILE  20          HG12      ILE  20   4.203  -9.263   2.845
  156   2HG1  ILE  20          HG11      ILE  20   2.478  -9.612   2.878
  157   1HG2  ILE  20          HG21      ILE  20   4.285  -9.565   6.166
  158   2HG2  ILE  20          HG22      ILE  20   5.514  -9.768   4.917
  159   3HG2  ILE  20          HG23      ILE  20   5.037 -11.141   5.916
  160   1HD1  ILE  20          HD11      ILE  20   2.594  -7.409   3.700
  161   2HD1  ILE  20          HD12      ILE  20   4.046  -7.741   4.645
  162   3HD1  ILE  20          HD13      ILE  20   2.488  -8.382   5.167
  163    H    THR  21           HN       THR  21   4.042 -11.406   1.018
  164    HA   THR  21           HA       THR  21   1.205 -12.292   0.731
  165    HB   THR  21           HB       THR  21   1.405 -11.292  -1.570
  166    HG1  THR  21           HG1      THR  21   3.901 -11.459  -1.143
  167   1HG2  THR  21          HG21      THR  21   1.156  -9.062  -0.815
  168   2HG2  THR  21          HG22      THR  21   2.193  -9.332   0.582
  169   3HG2  THR  21          HG23      THR  21   0.592 -10.067   0.516
  170    H    GLN  22           HN       GLN  22   4.423 -13.402  -0.007
  171    HA   GLN  22           HA       GLN  22   3.543 -15.184  -2.159
  172   1HB   GLN  22          HB2       GLN  22   6.106 -14.955  -0.572
  173   2HB   GLN  22          HB1       GLN  22   5.843 -16.251  -1.738
  174   1HG   GLN  22          HG2       GLN  22   5.435 -14.589  -3.511
  175   2HG   GLN  22          HG1       GLN  22   5.684 -13.285  -2.349
  176   1HE2  GLN  22          HE21      GLN  22   7.350 -13.780  -4.735
  177   2HE2  GLN  22          HE22      GLN  22   8.917 -14.109  -4.172
  178    H    ASN  23           HN       ASN  23   3.887 -15.362   1.323
  179    HA   ASN  23           HA       ASN  23   3.361 -18.294   1.301
  180   1HB   ASN  23          HB2       ASN  23   3.893 -18.176   3.696
  181   2HB   ASN  23          HB1       ASN  23   5.173 -17.423   2.745
  182   1HD2  ASN  23          HD21      ASN  23   5.360 -16.422   5.151
  183   2HD2  ASN  23          HD22      ASN  23   4.562 -14.938   5.357
  184    H    GLN  24           HN       GLN  24   1.421 -15.722   1.007
  185    HA   GLN  24           HA       GLN  24  -0.476 -16.342   3.179
  186   1HB   GLN  24          HB2       GLN  24  -1.697 -14.453   2.457
  187   2HB   GLN  24          HB1       GLN  24  -0.017 -14.006   2.170
  188   1HG   GLN  24          HG2       GLN  24  -0.355 -14.901  -0.216
  189   2HG   GLN  24          HG1       GLN  24  -2.079 -14.902   0.146
  190   1HE2  GLN  24          HE21      GLN  24  -0.933 -13.172  -1.862
  191   2HE2  GLN  24          HE22      GLN  24  -1.108 -11.570  -1.332
  192    H    LYS  25           HN       LYS  25  -2.107 -17.803   2.996
  193    HA   LYS  25           HA       LYS  25  -2.544 -19.150   0.398
  194   1HB   LYS  25          HB2       LYS  25  -2.388 -20.476   2.494
  195   2HB   LYS  25          HB1       LYS  25  -3.789 -19.616   3.128
  196   1HG   LYS  25          HG2       LYS  25  -5.177 -20.484   1.293
  197   2HG   LYS  25          HG1       LYS  25  -3.775 -21.314   0.616
  198   1HD   LYS  25          HD2       LYS  25  -5.111 -22.893   1.928
  199   2HD   LYS  25          HD1       LYS  25  -3.559 -22.622   2.720
  200   1HE   LYS  25          HE2       LYS  25  -4.508 -21.393   4.459
  201   2HE   LYS  25          HE1       LYS  25  -5.891 -20.883   3.489
  202   1HZ   LYS  25          HZ1       LYS  25  -6.790 -23.081   3.601
  203   2HZ   LYS  25          HZ2       LYS  25  -6.450 -22.556   5.180
  204   3HZ   LYS  25          HZ3       LYS  25  -5.418 -23.664   4.410
  205    H    ALA  26           HN       ALA  26  -4.994 -18.310   2.824
  206    HA   ALA  26           HA       ALA  26  -6.799 -17.361   0.695
  207   1HB   ALA  26          HB1       ALA  26  -7.905 -16.855   3.296
  208   2HB   ALA  26          HB2       ALA  26  -7.068 -18.402   3.388
  209   3HB   ALA  26          HB3       ALA  26  -8.334 -18.160   2.189
  210    HA   PRO  27           HA       PRO  27  -6.115 -13.005   0.901
  211   1HB   PRO  27          HB2       PRO  27  -8.683 -12.496   2.298
  212   2HB   PRO  27          HB1       PRO  27  -8.135 -11.924   0.716
  213   1HG   PRO  27          HG2       PRO  27 -10.023 -13.962   1.164
  214   2HG   PRO  27          HG1       PRO  27  -9.209 -13.624  -0.368
  215   1HD   PRO  27          HD2       PRO  27  -8.861 -15.936   1.358
  216   2HD   PRO  27          HD1       PRO  27  -8.078 -15.614  -0.210
  217    H    LEU  28           HN       LEU  28  -5.115 -11.610   2.394
  218    HA   LEU  28           HA       LEU  28  -4.460 -12.599   4.980
  219   1HB   LEU  28          HB2       LEU  28  -4.340  -9.808   3.811
  220   2HB   LEU  28          HB1       LEU  28  -3.680 -10.216   5.392
  221    HG   LEU  28           HG       LEU  28  -2.892 -11.631   2.826
  222   1HD1  LEU  28          HD11      LEU  28  -1.688  -9.245   4.236
  223   2HD1  LEU  28          HD12      LEU  28  -2.137  -9.400   2.538
  224   3HD1  LEU  28          HD13      LEU  28  -0.738 -10.272   3.162
  225   1HD2  LEU  28          HD21      LEU  28  -2.014 -11.779   5.708
  226   2HD2  LEU  28          HD22      LEU  28  -0.816 -12.060   4.447
  227   3HD2  LEU  28          HD23      LEU  28  -2.245 -13.080   4.541
  228    H    CYS  29           HN       CYS  29  -6.817 -10.116   3.991
  229    HA   CYS  29           HA       CYS  29  -7.814  -9.860   6.747
  230   1HB   CYS  29          HB2       CYS  29  -8.696  -8.662   4.109
  231   2HB   CYS  29          HB1       CYS  29  -9.513  -8.341   5.638
  232    H    ASN  30           HN       ASN  30 -10.263 -10.098   7.066
  233    HA   ASN  30           HA       ASN  30 -11.044 -12.791   6.420
  234   1HB   ASN  30          HB2       ASN  30 -12.581 -10.449   7.571
  235   2HB   ASN  30          HB1       ASN  30 -13.274 -12.061   7.386
  236   1HD2  ASN  30          HD21      ASN  30 -12.789 -10.738   9.964
  237   2HD2  ASN  30          HD22      ASN  30 -11.659 -11.688  10.801
  238    H    GLY  31           HN       GLY  31 -10.474 -11.389   4.002
  239   1HA   GLY  31          HA2       GLY  31 -11.454 -11.503   1.842
  240   2HA   GLY  31          HA1       GLY  31 -13.015 -11.836   2.591
  241    H    SER  32           HN       SER  32 -11.183  -9.159   3.804
  242    HA   SER  32           HA       SER  32 -13.285  -7.291   3.245
  243   1HB   SER  32          HB2       SER  32 -10.388  -6.763   3.960
  244   2HB   SER  32          HB1       SER  32 -11.690  -5.579   4.028
  245    HG   SER  32           HG       SER  32 -10.997  -7.048   5.966
  246    H    MET  33           HN       MET  33 -13.258  -5.492   1.793
  247    HA   MET  33           HA       MET  33 -11.515  -5.859  -0.625
  248   1HB   MET  33          HB2       MET  33 -14.346  -4.780  -0.444
  249   2HB   MET  33          HB1       MET  33 -13.383  -4.896  -1.918
  250   1HG   MET  33          HG2       MET  33 -13.240  -7.344  -1.636
  251   2HG   MET  33          HG1       MET  33 -14.203  -7.230  -0.165
  252   1HE   MET  33          HE1       MET  33 -15.409  -6.676  -4.507
  253   2HE   MET  33          HE2       MET  33 -13.809  -6.631  -3.775
  254   3HE   MET  33          HE3       MET  33 -14.833  -5.200  -3.724
  255    H    VAL  34           HN       VAL  34 -10.946  -3.831  -1.726
  256    HA   VAL  34           HA       VAL  34 -11.144  -1.391   0.005
  257    HB   VAL  34           HB       VAL  34  -8.768  -0.880  -0.760
  258   1HG1  VAL  34          HG11      VAL  34  -9.413  -3.199   1.071
  259   2HG1  VAL  34          HG12      VAL  34  -9.113  -1.518   1.512
  260   3HG1  VAL  34          HG13      VAL  34  -7.788  -2.526   0.929
  261   1HG2  VAL  34          HG21      VAL  34  -8.650  -2.524  -2.586
  262   2HG2  VAL  34          HG22      VAL  34  -8.869  -3.841  -1.431
  263   3HG2  VAL  34          HG23      VAL  34  -7.408  -2.855  -1.379
  264    H    TRP  35           HN       TRP  35 -10.813   0.624  -1.195
  265    HA   TRP  35           HA       TRP  35 -12.210   0.604  -3.732
  266   1HB   TRP  35          HB2       TRP  35 -10.719   2.789  -2.257
  267   2HB   TRP  35          HB1       TRP  35 -11.636   3.054  -3.736
  268    HD1  TRP  35           HD1      TRP  35 -12.033   2.368  -0.035
  269    HE1  TRP  35           HE1      TRP  35 -14.494   2.709   0.630
  270    HE3  TRP  35           HE3      TRP  35 -14.119   2.887  -4.663
  271    HZ2  TRP  35           HZ2      TRP  35 -17.029   3.139  -0.643
  272    HZ3  TRP  35           HZ3      TRP  35 -16.558   3.254  -4.908
  273    HH2  TRP  35           HH2      TRP  35 -18.013   3.384  -2.909
  274    H    SER  36           HN       SER  36 -11.335   0.594  -5.783
  275    HA   SER  36           HA       SER  36  -8.501   0.086  -6.112
  276   1HB   SER  36          HB2       SER  36  -8.974   0.052  -8.486
  277   2HB   SER  36          HB1       SER  36 -10.305  -0.755  -7.664
  278    HG   SER  36           HG       SER  36 -10.850   1.830  -7.740
  279    H    ILE  37           HN       ILE  37  -6.953   1.548  -7.102
  280    HA   ILE  37           HA       ILE  37  -7.773   4.432  -7.164
  281    HB   ILE  37           HB       ILE  37  -5.594   4.983  -6.072
  282   1HG1  ILE  37          HG12      ILE  37  -5.483   2.033  -5.390
  283   2HG1  ILE  37          HG11      ILE  37  -4.547   2.739  -6.698
  284   1HG2  ILE  37          HG21      ILE  37  -7.690   4.861  -4.766
  285   2HG2  ILE  37          HG22      ILE  37  -6.304   4.351  -3.804
  286   3HG2  ILE  37          HG23      ILE  37  -7.404   3.146  -4.474
  287   1HD1  ILE  37          HD11      ILE  37  -3.359   4.181  -5.195
  288   2HD1  ILE  37          HD12      ILE  37  -3.316   2.562  -4.497
  289   3HD1  ILE  37          HD13      ILE  37  -4.434   3.768  -3.860
  290    H    ASN  38           HN       ASN  38  -6.153   5.790  -8.312
  291    HA   ASN  38           HA       ASN  38  -5.165   4.379 -10.722
  292   1HB   ASN  38          HB2       ASN  38  -6.426   6.576 -10.856
  293   2HB   ASN  38          HB1       ASN  38  -5.045   7.340 -10.066
  294   1HD2  ASN  38          HD21      ASN  38  -4.332   8.579 -11.900
  295   2HD2  ASN  38          HD22      ASN  38  -3.738   7.855 -13.316
  296    H    LEU  39           HN       LEU  39  -3.097   3.614 -10.671
  297    HA   LEU  39           HA       LEU  39  -1.257   4.497  -8.582
  298   1HB   LEU  39          HB2       LEU  39  -0.900   2.601 -10.924
  299   2HB   LEU  39          HB1       LEU  39   0.327   2.894  -9.696
  300    HG   LEU  39           HG       LEU  39  -0.951   0.847  -9.197
  301   1HD1  LEU  39          HD11      LEU  39  -1.897   2.822  -7.140
  302   2HD1  LEU  39          HD12      LEU  39  -0.168   2.573  -7.380
  303   3HD1  LEU  39          HD13      LEU  39  -1.196   1.221  -6.921
  304   1HD2  LEU  39          HD21      LEU  39  -3.412   2.501  -8.692
  305   2HD2  LEU  39          HD22      LEU  39  -3.271   0.765  -8.939
  306   3HD2  LEU  39          HD23      LEU  39  -3.091   1.864 -10.305
  307    H    THR  40           HN       THR  40  -0.154   6.374  -8.802
  308    HA   THR  40           HA       THR  40   1.149   6.987 -11.405
  309    HB   THR  40           HB       THR  40   0.367   9.296 -11.369
  310    HG1  THR  40           HG1      THR  40  -0.332  10.077  -9.572
  311   1HG2  THR  40          HG21      THR  40  -2.091   7.615 -10.903
  312   2HG2  THR  40          HG22      THR  40  -1.078   7.378 -12.329
  313   3HG2  THR  40          HG23      THR  40  -1.862   8.933 -12.052
  314    H    ALA  41           HN       ALA  41   0.888   9.450  -8.991
  315    HA   ALA  41           HA       ALA  41   3.742   8.961  -8.196
  316   1HB   ALA  41          HB1       ALA  41   3.473  11.080  -9.325
  317   2HB   ALA  41          HB2       ALA  41   3.701  11.411  -7.608
  318   3HB   ALA  41          HB3       ALA  41   2.088  11.497  -8.316
  319    H    GLY  42           HN       GLY  42   0.991  10.732  -6.743
  320   1HA   GLY  42          HA2       GLY  42   1.844  10.184  -4.056
  321   2HA   GLY  42          HA1       GLY  42   0.257  10.801  -4.515
  322    H    MET  43           HN       MET  43   1.763   7.725  -5.486
  323    HA   MET  43           HA       MET  43  -0.615   6.212  -5.087
  324   1HB   MET  43          HB2       MET  43   2.272   5.283  -5.032
  325   2HB   MET  43          HB1       MET  43   0.869   4.233  -5.218
  326   1HG   MET  43          HG2       MET  43   0.245   5.628  -7.242
  327   2HG   MET  43          HG1       MET  43   1.832   6.380  -7.117
  328   1HE   MET  43          HE1       MET  43   3.877   5.157  -6.762
  329   2HE   MET  43          HE2       MET  43   4.359   3.714  -7.652
  330   3HE   MET  43          HE3       MET  43   3.589   3.552  -6.075
  331    H    TYR  44           HN       TYR  44   2.166   6.812  -2.956
  332    HA   TYR  44           HA       TYR  44   1.428   5.038  -0.857
  333   1HB   TYR  44          HB2       TYR  44   2.859   7.712  -0.718
  334   2HB   TYR  44          HB1       TYR  44   2.808   6.525   0.584
  335    HD1  TYR  44           HD1      TYR  44   4.028   4.418   0.426
  336    HD2  TYR  44           HD2      TYR  44   4.130   7.283  -2.769
  337    HE1  TYR  44           HE1      TYR  44   5.932   3.205  -0.598
  338    HE2  TYR  44           HE2      TYR  44   6.038   6.074  -3.792
  339    HH   TYR  44           HH       TYR  44   7.394   3.150  -2.255
  340    H    CYS  45           HN       CYS  45   0.644   8.469  -1.371
  341    HA   CYS  45           HA       CYS  45  -0.952   8.795   0.984
  342   1HB   CYS  45          HB2       CYS  45  -1.294  10.263  -1.641
  343   2HB   CYS  45          HB1       CYS  45  -1.671  10.853  -0.021
  344    H    ALA  46           HN       ALA  46  -1.943   8.235  -2.413
  345    HA   ALA  46           HA       ALA  46  -4.728   7.988  -1.889
  346   1HB   ALA  46          HB1       ALA  46  -3.854   8.265  -4.156
  347   2HB   ALA  46          HB2       ALA  46  -4.797   6.778  -4.070
  348   3HB   ALA  46          HB3       ALA  46  -3.034   6.707  -4.057
  349    H    ALA  47           HN       ALA  47  -2.225   5.444  -2.131
  350    HA   ALA  47           HA       ALA  47  -3.984   3.259  -1.611
  351   1HB   ALA  47          HB1       ALA  47  -1.015   3.635  -1.219
  352   2HB   ALA  47          HB2       ALA  47  -1.840   2.709  -2.471
  353   3HB   ALA  47          HB3       ALA  47  -1.817   2.121  -0.809
  354    H    LEU  48           HN       LEU  48  -2.157   5.371   0.579
  355    HA   LEU  48           HA       LEU  48  -2.602   3.901   2.957
  356   1HB   LEU  48          HB2       LEU  48  -1.010   5.763   2.820
  357   2HB   LEU  48          HB1       LEU  48  -2.337   6.901   2.598
  358    HG   LEU  48           HG       LEU  48  -3.221   6.313   4.831
  359   1HD1  LEU  48          HD11      LEU  48  -0.948   4.333   4.736
  360   2HD1  LEU  48          HD12      LEU  48  -2.611   4.093   5.270
  361   3HD1  LEU  48          HD13      LEU  48  -1.481   4.974   6.291
  362   1HD2  LEU  48          HD21      LEU  48  -0.296   7.099   4.690
  363   2HD2  LEU  48          HD22      LEU  48  -1.263   7.222   6.159
  364   3HD2  LEU  48          HD23      LEU  48  -1.692   8.176   4.739
  365    H    GLU  49           HN       GLU  49  -4.598   6.601   1.619
  366    HA   GLU  49           HA       GLU  49  -6.524   6.508   3.714
  367   1HB   GLU  49          HB2       GLU  49  -8.113   7.495   1.972
  368   2HB   GLU  49          HB1       GLU  49  -6.625   8.394   2.265
  369   1HG   GLU  49          HG2       GLU  49  -5.600   7.414   0.286
  370   2HG   GLU  49          HG1       GLU  49  -7.032   6.418   0.007
  371    H    SER  50           HN       SER  50  -6.279   4.614   0.718
  372    HA   SER  50           HA       SER  50  -8.847   3.359   0.966
  373   1HB   SER  50          HB2       SER  50  -7.421   3.284  -1.093
  374   2HB   SER  50          HB1       SER  50  -6.330   2.187  -0.253
  375    HG   SER  50           HG       SER  50  -7.656   0.660  -0.786
  376    H    LEU  51           HN       LEU  51  -5.621   2.444   2.188
  377    HA   LEU  51           HA       LEU  51  -6.530  -0.028   3.374
  378   1HB   LEU  51          HB2       LEU  51  -4.095   1.677   3.975
  379   2HB   LEU  51          HB1       LEU  51  -4.361   0.051   4.603
  380    HG   LEU  51           HG       LEU  51  -4.290   0.735   1.647
  381   1HD1  LEU  51          HD11      LEU  51  -2.037  -0.144   1.609
  382   2HD1  LEU  51          HD12      LEU  51  -2.129  -0.587   3.313
  383   3HD1  LEU  51          HD13      LEU  51  -2.105   1.113   2.844
  384   1HD2  LEU  51          HD21      LEU  51  -5.448  -1.300   1.798
  385   2HD2  LEU  51          HD22      LEU  51  -4.566  -1.817   3.236
  386   3HD2  LEU  51          HD23      LEU  51  -3.785  -1.861   1.656
  387    H    ILE  52           HN       ILE  52  -6.287   3.308   4.553
  388    HA   ILE  52           HA       ILE  52  -6.627   2.866   7.309
  389    HB   ILE  52           HB       ILE  52  -7.644   5.058   5.487
  390   1HG1  ILE  52          HG12      ILE  52  -5.219   4.989   5.913
  391   2HG1  ILE  52          HG11      ILE  52  -5.941   6.414   6.640
  392   1HG2  ILE  52          HG21      ILE  52  -8.124   4.715   8.439
  393   2HG2  ILE  52          HG22      ILE  52  -9.266   5.171   7.176
  394   3HG2  ILE  52          HG23      ILE  52  -8.043   6.322   7.714
  395   1HD1  ILE  52          HD11      ILE  52  -4.709   4.031   7.940
  396   2HD1  ILE  52          HD12      ILE  52  -6.095   4.742   8.759
  397   3HD1  ILE  52          HD13      ILE  52  -4.671   5.721   8.427
  398    H    ASN  53           HN       ASN  53  -8.767   2.071   4.750
  399    HA   ASN  53           HA       ASN  53 -11.169   2.077   6.465
  400   1HB   ASN  53          HB2       ASN  53 -10.684   1.122   3.626
  401   2HB   ASN  53          HB1       ASN  53 -12.233   0.965   4.452
  402   1HD2  ASN  53          HD21      ASN  53 -11.932   2.588   2.098
  403   2HD2  ASN  53          HD22      ASN  53 -12.165   4.210   2.542
  404    H    VAL  54           HN       VAL  54  -8.605  -0.087   5.586
  405    HA   VAL  54           HA       VAL  54 -10.109  -2.478   6.518
  406    HB   VAL  54           HB       VAL  54  -7.264  -2.208   5.492
  407   1HG1  VAL  54          HG11      VAL  54  -7.462  -4.166   6.886
  408   2HG1  VAL  54          HG12      VAL  54  -7.523  -4.704   5.209
  409   3HG1  VAL  54          HG13      VAL  54  -9.006  -4.595   6.153
  410   1HG2  VAL  54          HG21      VAL  54  -9.099  -1.681   3.843
  411   2HG2  VAL  54          HG22      VAL  54  -9.729  -3.307   4.108
  412   3HG2  VAL  54          HG23      VAL  54  -8.126  -3.086   3.404
  413    H    SER  55           HN       SER  55 -10.068  -2.957   8.667
  414    HA   SER  55           HA       SER  55  -7.626  -2.225  10.260
  415   1HB   SER  55          HB2       SER  55 -10.533  -1.944  11.057
  416   2HB   SER  55          HB1       SER  55  -9.178  -1.771  12.170
  417    HG   SER  55           HG       SER  55  -8.620  -0.295  10.076
  418    H    GLY  56           HN       GLY  56  -7.104  -3.666  11.959
  419   1HA   GLY  56          HA2       GLY  56  -7.394  -5.631  13.308
  420   2HA   GLY  56          HA1       GLY  56  -8.751  -6.111  12.289
  421    H    CYS  57           HN       CYS  57  -6.612  -5.266  10.035
  422    HA   CYS  57           HA       CYS  57  -5.627  -8.058   9.743
  423   1HB   CYS  57          HB2       CYS  57  -5.531  -5.704   7.829
  424   2HB   CYS  57          HB1       CYS  57  -4.997  -7.343   7.460
  425    H    SER  58           HN       SER  58  -3.925  -8.077  11.268
  426    HA   SER  58           HA       SER  58  -1.937  -6.068  11.580
  427   1HB   SER  58          HB2       SER  58  -2.283  -7.965  13.156
  428   2HB   SER  58          HB1       SER  58  -1.627  -9.063  11.946
  429    HG   SER  58           HG       SER  58   0.335  -8.162  12.180
  430    H    ALA  59           HN       ALA  59  -2.168  -8.804   9.372
  431    HA   ALA  59           HA       ALA  59   0.411  -8.935   8.334
  432   1HB   ALA  59          HB1       ALA  59  -0.554  -9.908   6.371
  433   2HB   ALA  59          HB2       ALA  59  -2.080  -9.064   6.632
  434   3HB   ALA  59          HB3       ALA  59  -1.593 -10.361   7.723
  435    H    ILE  60           HN       ILE  60  -1.823  -6.275   7.988
  436    HA   ILE  60           HA       ILE  60   0.091  -4.987   6.055
  437    HB   ILE  60           HB       ILE  60  -1.874  -3.790   5.091
  438   1HG1  ILE  60          HG12      ILE  60  -3.470  -5.788   6.719
  439   2HG1  ILE  60          HG11      ILE  60  -3.342  -4.076   7.101
  440   1HG2  ILE  60          HG21      ILE  60  -1.006  -5.767   3.956
  441   2HG2  ILE  60          HG22      ILE  60  -2.765  -5.770   3.849
  442   3HG2  ILE  60          HG23      ILE  60  -1.950  -6.822   5.007
  443   1HD1  ILE  60          HD11      ILE  60  -4.702  -5.377   4.751
  444   2HD1  ILE  60          HD12      ILE  60  -4.175  -3.696   4.664
  445   3HD1  ILE  60          HD13      ILE  60  -5.345  -4.191   5.885
  446    H    GLU  61           HN       GLU  61  -1.274  -4.898   9.098
  447    HA   GLU  61           HA       GLU  61  -1.805  -2.127   9.469
  448   1HB   GLU  61          HB2       GLU  61  -2.378  -3.859  11.132
  449   2HB   GLU  61          HB1       GLU  61  -0.662  -4.135  11.439
  450   1HG   GLU  61          HG2       GLU  61  -0.423  -1.811  12.195
  451   2HG   GLU  61          HG1       GLU  61  -2.134  -1.531  11.877
  452    H    LYS  62           HN       LYS  62   1.204  -4.002   9.771
  453    HA   LYS  62           HA       LYS  62   2.871  -1.810  10.555
  454   1HB   LYS  62          HB2       LYS  62   3.481  -4.389   9.078
  455   2HB   LYS  62          HB1       LYS  62   4.728  -3.261   9.618
  456   1HG   LYS  62          HG2       LYS  62   3.923  -3.478  11.941
  457   2HG   LYS  62          HG1       LYS  62   2.679  -4.604  11.403
  458   1HD   LYS  62          HD2       LYS  62   4.438  -6.142  10.581
  459   2HD   LYS  62          HD1       LYS  62   5.672  -5.019  11.155
  460   1HE   LYS  62          HE2       LYS  62   5.357  -6.758  12.830
  461   2HE   LYS  62          HE1       LYS  62   4.732  -5.236  13.464
  462   1HZ   LYS  62          HZ1       LYS  62   2.546  -6.134  12.332
  463   2HZ   LYS  62          HZ2       LYS  62   2.978  -6.580  13.912
  464   3HZ   LYS  62          HZ3       LYS  62   3.289  -7.631  12.614
  465    H    THR  63           HN       THR  63   1.881  -3.075   7.397
  466    HA   THR  63           HA       THR  63   3.566  -1.465   5.776
  467    HB   THR  63           HB       THR  63   0.770  -2.457   5.163
  468    HG1  THR  63           HG1      THR  63   3.123  -3.697   5.491
  469   1HG2  THR  63          HG21      THR  63   1.654  -2.317   2.788
  470   2HG2  THR  63          HG22      THR  63   3.017  -1.401   3.431
  471   3HG2  THR  63          HG23      THR  63   1.379  -0.761   3.572
  472    H    GLN  64           HN       GLN  64   0.372  -0.773   7.188
  473    HA   GLN  64           HA       GLN  64  -0.064   1.692   5.834
  474   1HB   GLN  64          HB2       GLN  64  -0.923   0.764   8.586
  475   2HB   GLN  64          HB1       GLN  64  -1.477   2.271   7.858
  476   1HG   GLN  64          HG2       GLN  64  -2.384   1.013   5.936
  477   2HG   GLN  64          HG1       GLN  64  -1.835  -0.496   6.667
  478   1HE2  GLN  64          HE21      GLN  64  -2.597   0.948   9.394
  479   2HE2  GLN  64          HE22      GLN  64  -4.265   0.655   9.500
  480    H    ARG  65           HN       ARG  65   1.742   0.979   8.830
  481    HA   ARG  65           HA       ARG  65   2.308   3.734   9.436
  482   1HB   ARG  65          HB2       ARG  65   3.747   1.163  10.164
  483   2HB   ARG  65          HB1       ARG  65   4.216   2.740  10.791
  484   1HG   ARG  65          HG2       ARG  65   1.377   1.760  11.074
  485   2HG   ARG  65          HG1       ARG  65   2.617   1.259  12.220
  486   1HD   ARG  65          HD2       ARG  65   3.101   3.619  12.749
  487   2HD   ARG  65          HD1       ARG  65   1.885   4.142  11.592
  488    HE   ARG  65           HE       ARG  65   0.497   2.451  13.286
  489   1HH1  ARG  65          HH21      ARG  65   2.537   5.209  13.609
  490   2HH1  ARG  65          HH22      ARG  65   1.735   5.802  15.025
  491   1HH2  ARG  65          HH11      ARG  65  -0.568   3.212  15.130
  492   2HH2  ARG  65          HH12      ARG  65  -0.023   4.672  15.887
  493    H    MET  66           HN       MET  66   4.058   1.251   7.588
  494    HA   MET  66           HA       MET  66   6.337   2.912   7.032
  495   1HB   MET  66          HB2       MET  66   5.234   0.451   5.655
  496   2HB   MET  66          HB1       MET  66   6.744   1.231   5.173
  497   1HG   MET  66          HG2       MET  66   7.525   0.998   7.572
  498   2HG   MET  66          HG1       MET  66   6.091   0.020   7.878
  499   1HE   MET  66          HE1       MET  66   5.503  -2.043   6.950
  500   2HE   MET  66          HE2       MET  66   6.507  -3.181   6.059
  501   3HE   MET  66          HE3       MET  66   5.757  -1.834   5.215
  502    H    LEU  67           HN       LEU  67   3.296   2.354   5.262
  503    HA   LEU  67           HA       LEU  67   4.002   3.833   2.922
  504   1HB   LEU  67          HB2       LEU  67   1.316   3.412   4.261
  505   2HB   LEU  67          HB1       LEU  67   1.502   4.197   2.697
  506    HG   LEU  67           HG       LEU  67   2.539   1.405   3.280
  507   1HD1  LEU  67          HD11      LEU  67   0.146   1.316   3.543
  508   2HD1  LEU  67          HD12      LEU  67   0.510   0.691   1.936
  509   3HD1  LEU  67          HD13      LEU  67  -0.103   2.334   2.125
  510   1HD2  LEU  67          HD21      LEU  67   2.294   1.319   0.702
  511   2HD2  LEU  67          HD22      LEU  67   3.635   2.261   1.339
  512   3HD2  LEU  67          HD23      LEU  67   2.172   3.074   0.780
  513    H    SER  68           HN       SER  68   2.659   4.841   6.039
  514    HA   SER  68           HA       SER  68   2.145   7.560   5.399
  515   1HB   SER  68          HB2       SER  68   3.103   6.379   8.025
  516   2HB   SER  68          HB1       SER  68   2.388   7.977   7.830
  517    HG   SER  68           HG       SER  68   1.218   5.428   7.524
  518    H    GLY  69           HN       GLY  69   5.122   5.932   6.436
  519   1HA   GLY  69          HA2       GLY  69   6.775   8.169   6.849
  520   2HA   GLY  69          HA1       GLY  69   7.357   6.629   6.214
  521    H    PHE  70           HN       PHE  70   5.518   6.832   3.869
  522    HA   PHE  70           HA       PHE  70   7.270   8.556   2.209
  523   1HB   PHE  70          HB2       PHE  70   5.202   6.440   1.586
  524   2HB   PHE  70          HB1       PHE  70   5.896   7.464   0.329
  525    HD1  PHE  70           HD1      PHE  70   8.250   7.297  -0.283
  526    HD2  PHE  70           HD2      PHE  70   6.564   4.787   2.768
  527    HE1  PHE  70           HE1      PHE  70  10.245   5.830  -0.390
  528    HE2  PHE  70           HE2      PHE  70   8.562   3.320   2.662
  529    HZ   PHE  70           HZ       PHE  70  10.400   3.842   1.082
  530    H    CYS  71           HN       CYS  71   4.214   8.748   3.743
  531    HA   CYS  71           HA       CYS  71   3.593  11.197   2.160
  532   1HB   CYS  71          HB2       CYS  71   2.288   9.211   1.264
  533   2HB   CYS  71          HB1       CYS  71   1.444   9.184   2.815
  534    HA   PRO  72           HA       PRO  72   3.232  12.139   6.709
  535   1HB   PRO  72          HB2       PRO  72   3.009  14.900   5.636
  536   2HB   PRO  72          HB1       PRO  72   4.137  14.251   6.833
  537   1HG   PRO  72          HG2       PRO  72   4.875  14.926   4.285
  538   2HG   PRO  72          HG1       PRO  72   5.705  13.689   5.241
  539   1HD   PRO  72          HD2       PRO  72   3.881  13.348   2.915
  540   2HD   PRO  72          HD1       PRO  72   5.146  12.251   3.528
  541    H    HIS  73           HN       HIS  73   0.942  11.307   5.073
  542    HA   HIS  73           HA       HIS  73  -1.113  13.387   5.432
  543   1HB   HIS  73          HB2       HIS  73  -0.713  11.231   3.663
  544   2HB   HIS  73          HB1       HIS  73  -2.102  10.739   4.615
  545    HD1  HIS  73           HD1      HIS  73  -4.299  11.914   4.162
  546    HD2  HIS  73           HD2      HIS  73  -1.079  13.732   2.258
  547    HE1  HIS  73           HE1      HIS  73  -5.289  13.653   2.614
  548    H    LYS  74           HN       LYS  74  -1.932  13.617   7.458
  549    HA   LYS  74           HA       LYS  74  -2.280  11.274   9.233
  550   1HB   LYS  74          HB2       LYS  74  -3.058  14.202   9.557
  551   2HB   LYS  74          HB1       LYS  74  -3.242  12.969  10.807
  552   1HG   LYS  74          HG2       LYS  74  -0.809  12.566  10.770
  553   2HG   LYS  74          HG1       LYS  74  -0.624  13.797   9.521
  554   1HD   LYS  74          HD2       LYS  74  -1.563  15.490  11.078
  555   2HD   LYS  74          HD1       LYS  74  -1.680  14.251  12.330
  556   1HE   LYS  74          HE2       LYS  74   0.714  13.940  12.349
  557   2HE   LYS  74          HE1       LYS  74   0.910  14.980  10.939
  558   1HZ   LYS  74          HZ1       LYS  74   1.370  16.014  13.177
  559   2HZ   LYS  74          HZ2       LYS  74  -0.304  15.945  13.460
  560   3HZ   LYS  74          HZ3       LYS  74   0.306  16.864  12.167
  561    H    VAL  75           HN       VAL  75  -3.688  10.266   7.526
  562    HA   VAL  75           HA       VAL  75  -6.327  11.546   7.133
  563    HB   VAL  75           HB       VAL  75  -5.407  10.714   5.133
  564   1HG1  VAL  75          HG11      VAL  75  -4.743   8.176   5.063
  565   2HG1  VAL  75          HG12      VAL  75  -4.599   8.349   6.812
  566   3HG1  VAL  75          HG13      VAL  75  -3.614   9.346   5.744
  567   1HG2  VAL  75          HG21      VAL  75  -7.082   9.278   4.367
  568   2HG2  VAL  75          HG22      VAL  75  -7.831   9.943   5.814
  569   3HG2  VAL  75          HG23      VAL  75  -7.108   8.336   5.858
  570    H    SER  76           HN       SER  76  -8.042  11.041   8.327
  571    HA   SER  76           HA       SER  76  -7.994   8.620  10.067
  572   1HB   SER  76          HB2       SER  76  -9.823   9.699  11.274
  573   2HB   SER  76          HB1       SER  76  -8.500  10.847  11.090
  574    HG   SER  76           HG       SER  76 -10.993  11.136  10.327
  575    H    ALA  77           HN       ALA  77 -10.282   7.579  10.281
  576    HA   ALA  77           HA       ALA  77 -11.055   6.550   7.730
  577   1HB   ALA  77          HB1       ALA  77 -13.056   5.655   9.011
  578   2HB   ALA  77          HB2       ALA  77 -12.432   6.506  10.423
  579   3HB   ALA  77          HB3       ALA  77 -11.484   5.217   9.681
  580    H    GLY  78           HN       GLY  78 -11.731   9.545   9.133
  581   1HA   GLY  78          HA2       GLY  78 -14.332   9.851   7.698
  582   2HA   GLY  78          HA1       GLY  78 -13.676  10.973   8.890
  583    H    GLN  79           HN       GLN  79 -10.977  10.910   7.638
  584    HA   GLN  79           HA       GLN  79 -11.521  12.950   5.572
  585   1HB   GLN  79          HB2       GLN  79  -8.940  11.957   6.822
  586   2HB   GLN  79          HB1       GLN  79  -9.046  13.278   5.657
  587   1HG   GLN  79          HG2       GLN  79 -10.486  14.546   7.177
  588   2HG   GLN  79          HG1       GLN  79 -10.479  13.211   8.330
  589   1HE2  GLN  79          HE21      GLN  79  -9.492  15.845   9.002
  590   2HE2  GLN  79          HE22      GLN  79  -7.823  15.716   9.284
  591    H    PHE  80           HN       PHE  80 -11.430  12.529   3.426
  592    HA   PHE  80           HA       PHE  80  -9.908  10.128   2.464
  593   1HB   PHE  80          HB2       PHE  80 -12.673  11.034   1.604
  594   2HB   PHE  80          HB1       PHE  80 -11.724   9.800   0.770
  595    HD1  PHE  80           HD1      PHE  80 -13.928  10.494   3.547
  596    HD2  PHE  80           HD2      PHE  80 -10.959   7.753   2.087
  597    HE1  PHE  80           HE1      PHE  80 -14.697   8.791   5.177
  598    HE2  PHE  80           HE2      PHE  80 -11.729   6.050   3.712
  599    HZ   PHE  80           HZ       PHE  80 -13.600   6.567   5.258
  600    H    SER  81           HN       SER  81  -8.708  10.512   0.596
  601    HA   SER  81           HA       SER  81  -8.919  13.271  -0.587
  602   1HB   SER  81          HB2       SER  81  -6.526  11.605   0.157
  603   2HB   SER  81          HB1       SER  81  -6.398  12.842  -1.091
  604    HG   SER  81           HG       SER  81  -7.524  13.338   1.461
  605    H    SER  82           HN       SER  82  -8.719   9.827  -1.257
  606    HA   SER  82           HA       SER  82  -8.617  10.460  -4.197
  607   1HB   SER  82          HB2       SER  82  -6.685   9.135  -3.207
  608   2HB   SER  82          HB1       SER  82  -7.841   7.835  -2.927
  609    HG   SER  82           HG       SER  82  -6.549   8.366  -5.139
  610    H    LEU  83           HN       LEU  83 -10.691   9.307  -1.781
  611    HA   LEU  83           HA       LEU  83 -12.091   7.406  -3.554
  612   1HB   LEU  83          HB2       LEU  83 -12.972   8.466  -0.859
  613   2HB   LEU  83          HB1       LEU  83 -13.581   7.039  -1.688
  614    HG   LEU  83           HG       LEU  83 -10.853   7.443  -0.457
  615   1HD1  LEU  83          HD11      LEU  83 -12.931   6.640   0.861
  616   2HD1  LEU  83          HD12      LEU  83 -11.459   5.678   0.986
  617   3HD1  LEU  83          HD13      LEU  83 -12.771   5.149  -0.066
  618   1HD2  LEU  83          HD21      LEU  83 -10.478   5.034  -1.318
  619   2HD2  LEU  83          HD22      LEU  83 -10.315   6.339  -2.490
  620   3HD2  LEU  83          HD23      LEU  83 -11.789   5.371  -2.449
  621    H    HIS  84           HN       HIS  84 -11.912  10.350  -4.270
  622    HA   HIS  84           HA       HIS  84 -14.603  11.411  -3.909
  623   1HB   HIS  84          HB2       HIS  84 -12.663  12.255  -6.073
  624   2HB   HIS  84          HB1       HIS  84 -13.921  13.219  -5.301
  625    HD1  HIS  84           HD1      HIS  84 -13.295  12.552  -2.341
  626    HD2  HIS  84           HD2      HIS  84 -10.411  13.584  -5.163
  627    HE1  HIS  84           HE1      HIS  84 -11.308  13.431  -1.047
  628    H    VAL  85           HN       VAL  85 -12.891   9.685  -6.480
  629    HA   VAL  85           HA       VAL  85 -15.144   9.817  -8.325
  630    HB   VAL  85           HB       VAL  85 -12.950   9.643  -9.289
  631   1HG1  VAL  85          HG11      VAL  85 -11.523   7.626  -8.816
  632   2HG1  VAL  85          HG12      VAL  85 -12.652   7.194  -7.533
  633   3HG1  VAL  85          HG13      VAL  85 -11.734   8.695  -7.432
  634   1HG2  VAL  85          HG21      VAL  85 -14.152   6.869  -9.523
  635   2HG2  VAL  85          HG22      VAL  85 -13.194   7.728 -10.726
  636   3HG2  VAL  85          HG23      VAL  85 -14.823   8.281 -10.339
  637    H    ARG  86           HN       ARG  86 -16.396   7.931  -8.995
  638    HA   ARG  86           HA       ARG  86 -16.983   6.141  -6.700
  639   1HB   ARG  86          HB2       ARG  86 -18.416   6.614  -9.334
  640   2HB   ARG  86          HB1       ARG  86 -18.987   5.537  -8.058
  641   1HG   ARG  86          HG2       ARG  86 -19.047   7.427  -6.481
  642   2HG   ARG  86          HG1       ARG  86 -18.483   8.513  -7.748
  643   1HD   ARG  86          HD2       ARG  86 -20.652   7.370  -8.985
  644   2HD   ARG  86          HD1       ARG  86 -21.197   7.381  -7.309
  645    HE   ARG  86           HE       ARG  86 -21.176   9.633  -8.997
  646   1HH1  ARG  86          HH21      ARG  86 -19.945   8.739  -5.897
  647   2HH1  ARG  86          HH22      ARG  86 -19.751  10.371  -5.364
  648   1HH2  ARG  86          HH11      ARG  86 -20.939  11.758  -8.303
  649   2HH2  ARG  86          HH12      ARG  86 -20.318  12.077  -6.718
  650    H    ASP  87           HN       ASP  87 -14.764   5.104  -7.262
  651    HA   ASP  87           HA       ASP  87 -14.758   3.341  -9.616
  652   1HB   ASP  87          HB2       ASP  87 -12.866   3.663  -7.266
  653   2HB   ASP  87          HB1       ASP  87 -12.612   2.498  -8.566
  654    H    THR  88           HN       THR  88 -14.279   0.905  -9.150
  655    HA   THR  88           HA       THR  88 -16.343  -0.027  -7.230
  656    HB   THR  88           HB       THR  88 -16.046  -2.212  -8.306
  657    HG1  THR  88           HG1      THR  88 -14.411  -2.598  -9.628
  658   1HG2  THR  88          HG21      THR  88 -16.698  -1.578 -10.607
  659   2HG2  THR  88          HG22      THR  88 -16.158   0.071 -10.295
  660   3HG2  THR  88          HG23      THR  88 -17.526  -0.593  -9.402
  661    H    LYS  89           HN       LYS  89 -15.821  -1.756  -5.700
  662    HA   LYS  89           HA       LYS  89 -13.171  -1.357  -4.470
  663   1HB   LYS  89          HB2       LYS  89 -15.577  -2.986  -3.609
  664   2HB   LYS  89          HB1       LYS  89 -14.098  -2.810  -2.668
  665   1HG   LYS  89          HG2       LYS  89 -14.432  -0.370  -2.586
  666   2HG   LYS  89          HG1       LYS  89 -15.917  -0.542  -3.524
  667   1HD   LYS  89          HD2       LYS  89 -16.874  -1.975  -1.762
  668   2HD   LYS  89          HD1       LYS  89 -15.398  -1.801  -0.813
  669   1HE   LYS  89          HE2       LYS  89 -15.766   0.541  -0.504
  670   2HE   LYS  89          HE1       LYS  89 -17.053   0.565  -1.711
  671   1HZ   LYS  89          HZ1       LYS  89 -17.718   0.499   0.733
  672   2HZ   LYS  89          HZ2       LYS  89 -17.233  -1.128   0.701
  673   3HZ   LYS  89          HZ3       LYS  89 -18.485  -0.593  -0.314
  674    H    ILE  90           HN       ILE  90 -11.705  -3.091  -4.043
  675    HA   ILE  90           HA       ILE  90 -12.152  -5.605  -5.613
  676    HB   ILE  90           HB       ILE  90  -9.776  -5.523  -6.310
  677   1HG1  ILE  90          HG12      ILE  90  -9.801  -2.708  -5.174
  678   2HG1  ILE  90          HG11      ILE  90  -9.020  -4.073  -4.382
  679   1HG2  ILE  90          HG21      ILE  90 -11.687  -4.522  -7.664
  680   2HG2  ILE  90          HG22      ILE  90 -10.080  -3.902  -8.047
  681   3HG2  ILE  90          HG23      ILE  90 -11.180  -2.947  -7.053
  682   1HD1  ILE  90          HD11      ILE  90  -8.367  -3.246  -7.218
  683   2HD1  ILE  90          HD12      ILE  90  -7.467  -4.350  -6.179
  684   3HD1  ILE  90          HD13      ILE  90  -7.499  -2.625  -5.815
  685    H    GLU  91           HN       GLU  91 -10.803  -7.410  -4.842
  686    HA   GLU  91           HA       GLU  91 -10.819  -7.623  -1.980
  687   1HB   GLU  91          HB2       GLU  91  -9.573  -9.331  -4.141
  688   2HB   GLU  91          HB1       GLU  91  -9.539  -9.764  -2.432
  689   1HG   GLU  91          HG2       GLU  91 -11.999  -9.681  -2.353
  690   2HG   GLU  91          HG1       GLU  91 -12.042  -9.247  -4.063
  691    H    VAL  92           HN       VAL  92  -9.093  -7.625  -0.505
  692    HA   VAL  92           HA       VAL  92  -6.984  -5.779  -0.947
  693    HB   VAL  92           HB       VAL  92  -7.218  -8.059   1.036
  694   1HG1  VAL  92          HG11      VAL  92  -5.215  -5.804   0.803
  695   2HG1  VAL  92          HG12      VAL  92  -4.890  -7.533   0.929
  696   3HG1  VAL  92          HG13      VAL  92  -5.517  -6.649   2.320
  697   1HG2  VAL  92          HG21      VAL  92  -8.951  -6.304   1.188
  698   2HG2  VAL  92          HG22      VAL  92  -7.697  -5.071   1.275
  699   3HG2  VAL  92          HG23      VAL  92  -7.870  -6.247   2.578
  700    H    ALA  93           HN       ALA  93  -7.030  -9.327  -1.256
  701    HA   ALA  93           HA       ALA  93  -4.306  -9.826  -1.655
  702   1HB   ALA  93          HB1       ALA  93  -6.705 -11.046  -3.050
  703   2HB   ALA  93          HB2       ALA  93  -5.886 -11.658  -1.614
  704   3HB   ALA  93          HB3       ALA  93  -5.069 -11.691  -3.177
  705    H    GLN  94           HN       GLN  94  -6.687  -8.659  -4.032
  706    HA   GLN  94           HA       GLN  94  -4.774  -8.587  -6.218
  707   1HB   GLN  94          HB2       GLN  94  -7.499  -7.326  -5.820
  708   2HB   GLN  94          HB1       GLN  94  -6.578  -7.190  -7.317
  709   1HG   GLN  94          HG2       GLN  94  -6.590  -9.586  -7.622
  710   2HG   GLN  94          HG1       GLN  94  -7.312  -9.828  -6.031
  711   1HE2  GLN  94          HE21      GLN  94  -8.696 -10.878  -8.209
  712   2HE2  GLN  94          HE22      GLN  94 -10.085  -9.951  -8.518
  713    H    PHE  95           HN       PHE  95  -6.072  -6.189  -3.952
  714    HA   PHE  95           HA       PHE  95  -4.932  -3.866  -5.119
  715   1HB   PHE  95          HB2       PHE  95  -6.603  -3.768  -3.346
  716   2HB   PHE  95          HB1       PHE  95  -5.481  -4.516  -2.212
  717    HD1  PHE  95           HD1      PHE  95  -6.365  -1.444  -4.011
  718    HD2  PHE  95           HD2      PHE  95  -3.518  -3.292  -1.380
  719    HE1  PHE  95           HE1      PHE  95  -5.443   0.785  -3.436
  720    HE2  PHE  95           HE2      PHE  95  -2.596  -1.060  -0.810
  721    HZ   PHE  95           HZ       PHE  95  -3.560   0.974  -1.843
  722    H    VAL  96           HN       VAL  96  -3.603  -5.962  -2.526
  723    HA   VAL  96           HA       VAL  96  -1.152  -4.524  -2.264
  724    HB   VAL  96           HB       VAL  96  -1.597  -7.489  -1.824
  725   1HG1  VAL  96          HG11      VAL  96   0.228  -7.055  -0.094
  726   2HG1  VAL  96          HG12      VAL  96   0.472  -5.496  -0.879
  727   3HG1  VAL  96          HG13      VAL  96   0.741  -6.986  -1.782
  728   1HG2  VAL  96          HG21      VAL  96  -1.985  -6.771   0.555
  729   2HG2  VAL  96          HG22      VAL  96  -3.247  -6.244  -0.557
  730   3HG2  VAL  96          HG23      VAL  96  -2.024  -5.100  -0.007
  731    H    LYS  97           HN       LYS  97  -1.968  -7.386  -4.251
  732    HA   LYS  97           HA       LYS  97   0.623  -7.739  -5.361
  733   1HB   LYS  97          HB2       LYS  97  -2.127  -8.380  -6.450
  734   2HB   LYS  97          HB1       LYS  97  -0.636  -8.873  -7.254
  735   1HG   LYS  97          HG2       LYS  97   0.066 -10.082  -5.214
  736   2HG   LYS  97          HG1       LYS  97  -1.423  -9.592  -4.412
  737   1HD   LYS  97          HD2       LYS  97  -2.746 -10.788  -6.116
  738   2HD   LYS  97          HD1       LYS  97  -1.259 -11.279  -6.925
  739   1HE   LYS  97          HE2       LYS  97  -2.047 -12.005  -4.086
  740   2HE   LYS  97          HE1       LYS  97  -2.088 -13.088  -5.477
  741   1HZ   LYS  97          HZ1       LYS  97   0.436 -11.953  -5.428
  742   2HZ   LYS  97          HZ2       LYS  97   0.020 -13.562  -5.075
  743   3HZ   LYS  97          HZ3       LYS  97   0.102 -12.408  -3.830
  744    H    ASP  98           HN       ASP  98  -2.133  -5.792  -6.576
  745    HA   ASP  98           HA       ASP  98  -0.836  -4.880  -8.948
  746   1HB   ASP  98          HB2       ASP  98  -2.935  -3.580  -7.191
  747   2HB   ASP  98          HB1       ASP  98  -2.416  -2.906  -8.736
  748    H    LEU  99           HN       LEU  99  -0.866  -3.576  -5.642
  749    HA   LEU  99           HA       LEU  99   0.653  -1.226  -6.176
  750   1HB   LEU  99          HB2       LEU  99  -0.552  -1.603  -4.051
  751   2HB   LEU  99          HB1       LEU  99   0.558  -2.911  -3.653
  752    HG   LEU  99           HG       LEU  99   2.447  -1.309  -3.670
  753   1HD1  LEU  99          HD11      LEU  99   1.642   1.197  -3.574
  754   2HD1  LEU  99          HD12      LEU  99   0.263   0.593  -4.492
  755   3HD1  LEU  99          HD13      LEU  99   1.896   0.427  -5.137
  756   1HD2  LEU  99          HD21      LEU  99   0.080  -0.628  -1.912
  757   2HD2  LEU  99          HD22      LEU  99   1.700   0.017  -1.648
  758   3HD2  LEU  99          HD23      LEU  99   1.414  -1.719  -1.540
  759    H    LEU 100           HN       LEU 100   1.649  -4.541  -5.383
  760    HA   LEU 100           HA       LEU 100   4.392  -4.077  -4.989
  761   1HB   LEU 100          HB2       LEU 100   3.363  -6.231  -4.511
  762   2HB   LEU 100          HB1       LEU 100   3.032  -6.485  -6.222
  763    HG   LEU 100           HG       LEU 100   5.439  -6.543  -6.709
  764   1HD1  LEU 100          HD11      LEU 100   6.458  -5.081  -5.161
  765   2HD1  LEU 100          HD12      LEU 100   6.966  -6.669  -4.597
  766   3HD1  LEU 100          HD13      LEU 100   5.648  -5.827  -3.783
  767   1HD2  LEU 100          HD21      LEU 100   5.913  -8.663  -5.705
  768   2HD2  LEU 100          HD22      LEU 100   4.160  -8.590  -5.879
  769   3HD2  LEU 100          HD23      LEU 100   4.903  -8.302  -4.306
  770    H    LEU 101           HN       LEU 101   2.702  -4.648  -8.120
  771    HA   LEU 101           HA       LEU 101   5.107  -4.720  -9.665
  772   1HB   LEU 101          HB2       LEU 101   2.271  -3.958 -10.332
  773   2HB   LEU 101          HB1       LEU 101   3.539  -3.759 -11.535
  774    HG   LEU 101           HG       LEU 101   2.314  -5.955 -11.676
  775   1HD1  LEU 101          HD11      LEU 101   5.148  -6.631 -10.948
  776   2HD1  LEU 101          HD12      LEU 101   4.871  -5.496 -12.268
  777   3HD1  LEU 101          HD13      LEU 101   4.195  -7.119 -12.346
  778   1HD2  LEU 101          HD21      LEU 101   2.683  -7.644  -9.987
  779   2HD2  LEU 101          HD22      LEU 101   2.061  -6.201  -9.194
  780   3HD2  LEU 101          HD23      LEU 101   3.778  -6.586  -9.097
  781    H    HIS 102           HN       HIS 102   3.124  -1.953  -8.633
  782    HA   HIS 102           HA       HIS 102   4.703  -0.018 -10.078
  783   1HB   HIS 102          HB2       HIS 102   2.699   0.172  -7.835
  784   2HB   HIS 102          HB1       HIS 102   3.575   1.600  -8.390
  785    HD1  HIS 102           HD1      HIS 102   3.024   2.510 -10.735
  786    HD2  HIS 102           HD2      HIS 102   0.884  -0.924  -9.753
  787    HE1  HIS 102           HE1      HIS 102   1.251   2.241 -12.520
  788    H    LEU 103           HN       LEU 103   4.870  -1.204  -6.707
  789    HA   LEU 103           HA       LEU 103   6.762   0.715  -5.799
  790   1HB   LEU 103          HB2       LEU 103   6.442  -2.192  -4.996
  791   2HB   LEU 103          HB1       LEU 103   7.400  -1.010  -4.108
  792    HG   LEU 103           HG       LEU 103   4.442  -0.708  -4.687
  793   1HD1  LEU 103          HD11      LEU 103   4.648  -2.576  -3.212
  794   2HD1  LEU 103          HD12      LEU 103   4.267  -1.196  -2.182
  795   3HD1  LEU 103          HD13      LEU 103   5.925  -1.789  -2.285
  796   1HD2  LEU 103          HD21      LEU 103   5.224   1.459  -4.259
  797   2HD2  LEU 103          HD22      LEU 103   6.469   0.898  -3.147
  798   3HD2  LEU 103          HD23      LEU 103   4.783   0.918  -2.644
  799    H    LYS 104           HN       LYS 104   7.364  -2.532  -7.180
  800    HA   LYS 104           HA       LYS 104  10.228  -2.211  -7.159
  801   1HB   LYS 104          HB2       LYS 104  10.255  -4.228  -8.551
  802   2HB   LYS 104          HB1       LYS 104   9.107  -4.419  -7.225
  803   1HG   LYS 104          HG2       LYS 104   7.328  -3.557  -8.866
  804   2HG   LYS 104          HG1       LYS 104   8.519  -3.846 -10.133
  805   1HD   LYS 104          HD2       LYS 104   7.351  -5.881  -8.216
  806   2HD   LYS 104          HD1       LYS 104   7.142  -5.821  -9.965
  807   1HE   LYS 104          HE2       LYS 104   9.734  -6.013 -10.065
  808   2HE   LYS 104          HE1       LYS 104   9.603  -6.558  -8.392
  809   1HZ   LYS 104          HZ1       LYS 104   7.718  -7.813 -10.161
  810   2HZ   LYS 104          HZ2       LYS 104   8.767  -8.510  -9.020
  811   3HZ   LYS 104          HZ3       LYS 104   9.332  -8.130 -10.577
  812    H    LYS 105           HN       LYS 105   7.733  -1.313  -9.455
  813    HA   LYS 105           HA       LYS 105   9.389  -1.041 -11.773
  814   1HB   LYS 105          HB2       LYS 105   6.888  -1.038 -11.762
  815   2HB   LYS 105          HB1       LYS 105   6.930   0.577 -11.057
  816   1HG   LYS 105          HG2       LYS 105   8.192   1.397 -13.019
  817   2HG   LYS 105          HG1       LYS 105   8.127  -0.218 -13.727
  818   1HD   LYS 105          HD2       LYS 105   5.608  -0.087 -13.576
  819   2HD   LYS 105          HD1       LYS 105   5.789   1.608 -13.119
  820   1HE   LYS 105          HE2       LYS 105   5.408   1.499 -15.512
  821   2HE   LYS 105          HE1       LYS 105   7.083   1.975 -15.238
  822   1HZ   LYS 105          HZ1       LYS 105   7.256  -0.704 -15.273
  823   2HZ   LYS 105          HZ2       LYS 105   7.539   0.296 -16.618
  824   3HZ   LYS 105          HZ3       LYS 105   6.022  -0.439 -16.406
  825    H    LEU 106           HN       LEU 106   8.456   1.390  -9.301
  826    HA   LEU 106           HA       LEU 106   9.863   3.561 -10.509
  827   1HB   LEU 106          HB2       LEU 106   8.967   2.994  -7.686
  828   2HB   LEU 106          HB1       LEU 106   9.950   4.409  -8.028
  829    HG   LEU 106           HG       LEU 106   7.371   4.685  -8.029
  830   1HD1  LEU 106          HD11      LEU 106   8.935   5.635 -10.447
  831   2HD1  LEU 106          HD12      LEU 106   8.979   6.382  -8.852
  832   3HD1  LEU 106          HD13      LEU 106   7.482   6.374  -9.782
  833   1HD2  LEU 106          HD21      LEU 106   7.616   3.701 -10.878
  834   2HD2  LEU 106          HD22      LEU 106   6.158   4.085  -9.972
  835   3HD2  LEU 106          HD23      LEU 106   7.083   2.647  -9.575
  836    H    PHE 107           HN       PHE 107  10.971   0.923  -8.479
  837    HA   PHE 107           HA       PHE 107  13.474   2.037  -7.705
  838   1HB   PHE 107          HB2       PHE 107  12.621  -0.092  -6.776
  839   2HB   PHE 107          HB1       PHE 107  12.838  -0.861  -8.348
  840    HD1  PHE 107           HD1      PHE 107  14.664   0.974  -5.666
  841    HD2  PHE 107           HD2      PHE 107  14.950  -1.743  -8.976
  842    HE1  PHE 107           HE1      PHE 107  17.041   0.569  -5.116
  843    HE2  PHE 107           HE2      PHE 107  17.335  -2.154  -8.428
  844    HZ   PHE 107           HZ       PHE 107  18.382  -1.000  -6.497
  845    H    ARG 108           HN       ARG 108  12.477   0.320 -10.641
  846    HA   ARG 108           HA       ARG 108  15.046   0.113 -11.837
  847   1HB   ARG 108          HB2       ARG 108  12.288   0.367 -13.066
  848   2HB   ARG 108          HB1       ARG 108  13.745   0.050 -14.010
  849   1HG   ARG 108          HG2       ARG 108  14.182  -1.975 -12.655
  850   2HG   ARG 108          HG1       ARG 108  12.714  -1.663 -11.728
  851   1HD   ARG 108          HD2       ARG 108  11.358  -1.876 -13.767
  852   2HD   ARG 108          HD1       ARG 108  12.816  -2.152 -14.720
  853    HE   ARG 108           HE       ARG 108  12.943  -4.123 -12.790
  854   1HH1  ARG 108          HH21      ARG 108  10.549  -3.001 -15.004
  855   2HH1  ARG 108          HH22      ARG 108   9.859  -4.569 -15.260
  856   1HH2  ARG 108          HH11      ARG 108  12.057  -6.180 -13.118
  857   2HH2  ARG 108          HH12      ARG 108  10.713  -6.368 -14.193
  858    H    GLU 109           HN       GLU 109  12.712   2.796 -11.785
  859    HA   GLU 109           HA       GLU 109  14.355   4.409 -13.615
  860   1HB   GLU 109          HB2       GLU 109  11.906   5.039 -11.942
  861   2HB   GLU 109          HB1       GLU 109  12.706   6.225 -12.974
  862   1HG   GLU 109          HG2       GLU 109  12.339   4.776 -14.934
  863   2HG   GLU 109          HG1       GLU 109  11.538   3.585 -13.908
  864    H    GLY 110           HN       GLY 110  14.279   3.747 -10.241
  865   1HA   GLY 110          HA2       GLY 110  15.679   4.533  -8.534
  866   2HA   GLY 110          HA1       GLY 110  16.558   5.449  -9.758
  867    H    ARG 111           HN       ARG 111  13.300   6.203 -10.018
  868    HA   ARG 111           HA       ARG 111  13.759   8.782  -8.608
  869   1HB   ARG 111          HB2       ARG 111  11.508   7.868 -10.430
  870   2HB   ARG 111          HB1       ARG 111  11.647   9.482  -9.729
  871   1HG   ARG 111          HG2       ARG 111  13.946   9.620 -10.813
  872   2HG   ARG 111          HG1       ARG 111  13.522   8.155 -11.698
  873   1HD   ARG 111          HD2       ARG 111  12.120  10.835 -11.805
  874   2HD   ARG 111          HD1       ARG 111  12.975  10.023 -13.113
  875    HE   ARG 111           HE       ARG 111  10.978   8.232 -12.395
  876   1HH1  ARG 111          HH21      ARG 111  11.191  11.549 -13.299
  877   2HH1  ARG 111          HH22      ARG 111   9.624  11.591 -14.037
  878   1HH2  ARG 111          HH11      ARG 111   8.920   8.267 -13.347
  879   2HH2  ARG 111          HH12      ARG 111   8.338   9.733 -14.062
  880    H    PHE 112           HN       PHE 112  13.398   8.495  -6.465
  881    HA   PHE 112           HA       PHE 112  11.075   6.883  -5.562
  882   1HB   PHE 112          HB2       PHE 112  13.303   8.206  -3.981
  883   2HB   PHE 112          HB1       PHE 112  12.116   7.056  -3.354
  884    HD1  PHE 112           HD1      PHE 112  12.022   4.736  -4.300
  885    HD2  PHE 112           HD2      PHE 112  15.213   7.452  -5.214
  886    HE1  PHE 112           HE1      PHE 112  13.389   2.849  -5.136
  887    HE2  PHE 112           HE2      PHE 112  16.582   5.560  -6.049
  888    HZ   PHE 112           HZ       PHE 112  15.672   3.257  -6.007
  889    H    ASN 113           HN       ASN 113   9.230   7.830  -4.864
  890    HA   ASN 113           HA       ASN 113   7.697   9.539  -4.385
  891   1HB   ASN 113          HB2       ASN 113   9.234   9.562  -2.345
  892   2HB   ASN 113          HB1       ASN 113  10.060  10.926  -3.100
  893   1HD2  ASN 113          HD21      ASN 113   9.242  12.220  -1.197
  894   2HD2  ASN 113          HD22      ASN 113   7.648  12.803  -1.227
  Start of MODEL    3
    1   1H    MET   1           HT1      MET   1  23.746   8.621  10.778
    2   2H    MET   1           HT2      MET   1  24.882   7.408  10.427
    3   3H    MET   1           HT3      MET   1  24.836   8.111  11.973
    4    HA   MET   1           HA       MET   1  23.343   5.918  10.939
    5   1HB   MET   1          HB2       MET   1  23.751   7.193  13.659
    6   2HB   MET   1          HB1       MET   1  22.836   5.705  13.416
    7   1HG   MET   1          HG2       MET   1  25.051   5.007  13.967
    8   2HG   MET   1          HG1       MET   1  24.912   4.791  12.224
    9   1HE   MET   1          HE1       MET   1  27.585   7.581  14.589
   10   2HE   MET   1          HE2       MET   1  27.002   5.963  14.972
   11   3HE   MET   1          HE3       MET   1  25.888   7.326  15.022
   12    H    GLY   2           HN       GLY   2  22.364   8.658  10.165
   13   1HA   GLY   2          HA2       GLY   2  19.929   9.162  11.645
   14   2HA   GLY   2          HA1       GLY   2  20.322   9.824  10.056
   15    HA   PRO   3           HA       PRO   3  16.860   6.493   9.968
   16   1HB   PRO   3          HB2       PRO   3  15.702   8.469   8.095
   17   2HB   PRO   3          HB1       PRO   3  14.957   7.677   9.488
   18   1HG   PRO   3          HG2       PRO   3  15.817  10.355   9.389
   19   2HG   PRO   3          HG1       PRO   3  15.405   9.454  10.853
   20   1HD   PRO   3          HD2       PRO   3  18.038  10.364   9.984
   21   2HD   PRO   3          HD1       PRO   3  17.602   9.555  11.510
   22    H    VAL   4           HN       VAL   4  16.222   5.315   7.936
   23    HA   VAL   4           HA       VAL   4  18.496   5.122   6.139
   24    HB   VAL   4           HB       VAL   4  17.212   3.249   5.151
   25   1HG1  VAL   4          HG11      VAL   4  17.015   1.905   7.256
   26   2HG1  VAL   4          HG12      VAL   4  17.232   3.394   8.178
   27   3HG1  VAL   4          HG13      VAL   4  18.532   2.798   7.144
   28   1HG2  VAL   4          HG21      VAL   4  15.054   4.335   6.974
   29   2HG2  VAL   4          HG22      VAL   4  15.012   2.700   6.314
   30   3HG2  VAL   4          HG23      VAL   4  14.967   4.089   5.230
   31    HA   PRO   5           HA       PRO   5  16.843   7.818   2.990
   32   1HB   PRO   5          HB2       PRO   5  17.898   6.590   0.708
   33   2HB   PRO   5          HB1       PRO   5  18.772   7.712   1.759
   34   1HG   PRO   5          HG2       PRO   5  18.977   4.750   1.585
   35   2HG   PRO   5          HG1       PRO   5  20.204   5.934   2.055
   36   1HD   PRO   5          HD2       PRO   5  18.816   4.293   3.845
   37   2HD   PRO   5          HD1       PRO   5  19.628   5.817   4.285
   38    HA   PRO   6           HA       PRO   6  13.066   6.138   1.338
   39   1HB   PRO   6          HB2       PRO   6  13.415   7.141  -1.365
   40   2HB   PRO   6          HB1       PRO   6  12.366   7.766  -0.089
   41   1HG   PRO   6          HG2       PRO   6  14.825   8.902  -1.072
   42   2HG   PRO   6          HG1       PRO   6  13.766   9.536   0.192
   43   1HD   PRO   6          HD2       PRO   6  16.381   8.390   0.534
   44   2HD   PRO   6          HD1       PRO   6  15.256   8.922   1.809
   45    H    SER   7           HN       SER   7  15.749   5.828  -0.999
   46    HA   SER   7           HA       SER   7  14.686   3.625  -2.445
   47   1HB   SER   7          HB2       SER   7  16.951   3.263  -3.248
   48   2HB   SER   7          HB1       SER   7  16.658   4.998  -3.150
   49    HG   SER   7           HG       SER   7  17.530   4.285  -0.795
   50    H    THR   8           HN       THR   8  16.678   3.724   0.493
   51    HA   THR   8           HA       THR   8  17.001   0.855   0.648
   52    HB   THR   8           HB       THR   8  17.164   2.985   2.801
   53    HG1  THR   8           HG1      THR   8  18.693   2.487   0.770
   54   1HG2  THR   8          HG21      THR   8  16.802   0.862   3.875
   55   2HG2  THR   8          HG22      THR   8  18.526   1.215   3.988
   56   3HG2  THR   8          HG23      THR   8  17.939   0.059   2.792
   57    H    ALA   9           HN       ALA   9  14.650   3.132   2.024
   58    HA   ALA   9           HA       ALA   9  13.263   1.241   3.657
   59   1HB   ALA   9          HB1       ALA   9  12.434   3.836   2.345
   60   2HB   ALA   9          HB2       ALA   9  12.802   3.546   4.045
   61   3HB   ALA   9          HB3       ALA   9  11.320   2.899   3.340
   62    H    LEU  10           HN       LEU  10  12.821   2.237   0.275
   63    HA   LEU  10           HA       LEU  10  10.436   0.777  -0.230
   64   1HB   LEU  10          HB2       LEU  10  11.464   2.489  -1.758
   65   2HB   LEU  10          HB1       LEU  10  12.696   1.304  -2.175
   66    HG   LEU  10           HG       LEU  10  10.692  -0.257  -2.787
   67   1HD1  LEU  10          HD11      LEU  10   8.842   0.963  -1.888
   68   2HD1  LEU  10          HD12      LEU  10   8.734   1.132  -3.637
   69   3HD1  LEU  10          HD13      LEU  10   9.360   2.458  -2.666
   70   1HD2  LEU  10          HD21      LEU  10  11.095   2.184  -4.525
   71   2HD2  LEU  10          HD22      LEU  10  10.686   0.552  -5.040
   72   3HD2  LEU  10          HD23      LEU  10  12.285   0.890  -4.392
   73    H    ARG  11           HN       ARG  11  13.849  -0.182  -0.752
   74    HA   ARG  11           HA       ARG  11  13.293  -2.795  -1.729
   75   1HB   ARG  11          HB2       ARG  11  15.658  -1.698  -0.181
   76   2HB   ARG  11          HB1       ARG  11  15.626  -3.316  -0.882
   77   1HG   ARG  11          HG2       ARG  11  15.240  -2.347  -3.117
   78   2HG   ARG  11          HG1       ARG  11  15.267  -0.726  -2.421
   79   1HD   ARG  11          HD2       ARG  11  17.559  -2.712  -2.331
   80   2HD   ARG  11          HD1       ARG  11  17.461  -1.312  -3.401
   81    HE   ARG  11           HE       ARG  11  17.140  -0.226  -0.877
   82   1HH1  ARG  11          HH21      ARG  11  19.417  -2.309  -2.417
   83   2HH1  ARG  11          HH22      ARG  11  20.756  -1.766  -1.463
   84   1HH2  ARG  11          HH11      ARG  11  18.876   0.493   0.375
   85   2HH2  ARG  11          HH12      ARG  11  20.451  -0.180   0.116
   86    H    GLU  12           HN       GLU  12  13.774  -1.595   1.579
   87    HA   GLU  12           HA       GLU  12  13.580  -4.140   2.876
   88   1HB   GLU  12          HB2       GLU  12  12.983  -1.320   3.813
   89   2HB   GLU  12          HB1       GLU  12  12.921  -2.723   4.882
   90   1HG   GLU  12          HG2       GLU  12  15.353  -2.024   3.220
   91   2HG   GLU  12          HG1       GLU  12  15.132  -1.469   4.880
   92    H    LEU  13           HN       LEU  13  11.154  -1.726   1.948
   93    HA   LEU  13           HA       LEU  13   8.932  -3.077   3.186
   94   1HB   LEU  13          HB2       LEU  13   8.883  -0.685   2.589
   95   2HB   LEU  13          HB1       LEU  13   9.003  -1.103   0.883
   96    HG   LEU  13           HG       LEU  13   6.839  -2.315   1.040
   97   1HD1  LEU  13          HD11      LEU  13   6.628  -3.037   3.268
   98   2HD1  LEU  13          HD12      LEU  13   5.496  -1.691   3.203
   99   3HD1  LEU  13          HD13      LEU  13   7.090  -1.466   3.925
  100   1HD2  LEU  13          HD21      LEU  13   6.948   0.098   0.418
  101   2HD2  LEU  13          HD22      LEU  13   6.709   0.520   2.113
  102   3HD2  LEU  13          HD23      LEU  13   5.437  -0.319   1.226
  103    H    ILE  14           HN       ILE  14  10.223  -3.087  -0.148
  104    HA   ILE  14           HA       ILE  14   8.177  -4.700  -1.283
  105    HB   ILE  14           HB       ILE  14  11.105  -4.403  -2.002
  106   1HG1  ILE  14          HG12      ILE  14   8.593  -3.376  -3.357
  107   2HG1  ILE  14          HG11      ILE  14   9.532  -2.432  -2.201
  108   1HG2  ILE  14          HG21      ILE  14  10.279  -5.374  -4.243
  109   2HG2  ILE  14          HG22      ILE  14   8.883  -5.955  -3.339
  110   3HG2  ILE  14          HG23      ILE  14  10.499  -6.517  -2.918
  111   1HD1  ILE  14          HD11      ILE  14  11.524  -2.637  -3.641
  112   2HD1  ILE  14          HD12      ILE  14  10.187  -1.896  -4.520
  113   3HD1  ILE  14          HD13      ILE  14  10.592  -3.590  -4.795
  114    H    GLU  15           HN       GLU  15  11.295  -5.672   0.169
  115    HA   GLU  15           HA       GLU  15  10.997  -8.466  -0.239
  116   1HB   GLU  15          HB2       GLU  15  12.422  -6.904   1.929
  117   2HB   GLU  15          HB1       GLU  15  12.566  -8.652   1.738
  118   1HG   GLU  15          HG2       GLU  15  13.392  -8.337  -0.566
  119   2HG   GLU  15          HG1       GLU  15  13.252  -6.588  -0.375
  120    H    GLU  16           HN       GLU  16   9.887  -6.392   2.432
  121    HA   GLU  16           HA       GLU  16   8.908  -8.586   4.030
  122   1HB   GLU  16          HB2       GLU  16   9.438  -6.291   4.902
  123   2HB   GLU  16          HB1       GLU  16   7.987  -5.707   4.090
  124   1HG   GLU  16          HG2       GLU  16   6.611  -7.286   5.384
  125   2HG   GLU  16          HG1       GLU  16   8.058  -7.885   6.196
  126    H    LEU  17           HN       LEU  17   7.318  -6.393   1.691
  127    HA   LEU  17           HA       LEU  17   4.662  -7.321   2.129
  128   1HB   LEU  17          HB2       LEU  17   5.991  -6.238  -0.371
  129   2HB   LEU  17          HB1       LEU  17   4.266  -6.572  -0.265
  130    HG   LEU  17           HG       LEU  17   5.751  -4.714   1.617
  131   1HD1  LEU  17          HD11      LEU  17   4.161  -4.157  -0.900
  132   2HD1  LEU  17          HD12      LEU  17   5.849  -3.752  -0.589
  133   3HD1  LEU  17          HD13      LEU  17   4.566  -2.917   0.286
  134   1HD2  LEU  17          HD21      LEU  17   3.788  -5.284   2.755
  135   2HD2  LEU  17          HD22      LEU  17   2.872  -5.540   1.271
  136   3HD2  LEU  17          HD23      LEU  17   3.227  -3.903   1.818
  137    H    VAL  18           HN       VAL  18   7.174  -8.499  -0.094
  138    HA   VAL  18           HA       VAL  18   5.551 -10.527  -1.303
  139    HB   VAL  18           HB       VAL  18   8.551 -10.307  -0.943
  140   1HG1  VAL  18          HG11      VAL  18   8.532 -11.925  -2.933
  141   2HG1  VAL  18          HG12      VAL  18   6.852 -12.252  -2.509
  142   3HG1  VAL  18          HG13      VAL  18   8.138 -12.612  -1.357
  143   1HG2  VAL  18          HG21      VAL  18   8.531  -9.458  -3.209
  144   2HG2  VAL  18          HG22      VAL  18   7.357  -8.529  -2.276
  145   3HG2  VAL  18          HG23      VAL  18   6.808  -9.798  -3.371
  146    H    ASN  19           HN       ASN  19   7.712 -10.560   1.511
  147    HA   ASN  19           HA       ASN  19   7.662 -13.344   2.035
  148   1HB   ASN  19          HB2       ASN  19   7.954 -10.962   3.871
  149   2HB   ASN  19          HB1       ASN  19   8.153 -12.626   4.419
  150   1HD2  ASN  19          HD21      ASN  19  10.316 -10.689   4.413
  151   2HD2  ASN  19          HD22      ASN  19  11.484 -11.230   3.306
  152    H    ILE  20           HN       ILE  20   5.448 -10.800   3.242
  153    HA   ILE  20           HA       ILE  20   3.927 -12.723   4.801
  154    HB   ILE  20           HB       ILE  20   2.388 -10.834   5.215
  155   1HG1  ILE  20          HG12      ILE  20   4.217  -9.292   3.347
  156   2HG1  ILE  20          HG11      ILE  20   2.596  -9.829   2.928
  157   1HG2  ILE  20          HG21      ILE  20   4.024  -9.407   6.361
  158   2HG2  ILE  20          HG22      ILE  20   5.323 -10.083   5.378
  159   3HG2  ILE  20          HG23      ILE  20   4.470 -11.105   6.535
  160   1HD1  ILE  20          HD11      ILE  20   1.622  -8.477   4.689
  161   2HD1  ILE  20          HD12      ILE  20   2.674  -7.451   3.715
  162   3HD1  ILE  20          HD13      ILE  20   3.220  -8.032   5.287
  163    H    THR  21           HN       THR  21   3.788 -11.751   1.466
  164    HA   THR  21           HA       THR  21   0.975 -12.732   1.244
  165    HB   THR  21           HB       THR  21   1.087 -11.854  -1.074
  166    HG1  THR  21           HG1      THR  21   3.049 -10.403  -1.293
  167   1HG2  THR  21          HG21      THR  21   0.590 -10.438   1.113
  168   2HG2  THR  21          HG22      THR  21   0.750  -9.638  -0.449
  169   3HG2  THR  21          HG23      THR  21   2.100  -9.642   0.677
  170    H    GLN  22           HN       GLN  22   4.216 -13.819   0.619
  171    HA   GLN  22           HA       GLN  22   3.374 -15.750  -1.429
  172   1HB   GLN  22          HB2       GLN  22   5.969 -15.268   0.041
  173   2HB   GLN  22          HB1       GLN  22   5.749 -16.660  -1.020
  174   1HG   GLN  22          HG2       GLN  22   5.224 -13.809  -1.896
  175   2HG   GLN  22          HG1       GLN  22   6.767 -14.628  -2.144
  176   1HE2  GLN  22          HE21      GLN  22   3.896 -13.958  -3.708
  177   2HE2  GLN  22          HE22      GLN  22   3.859 -15.265  -4.792
  178    H    ASN  23           HN       ASN  23   3.915 -15.782   2.056
  179    HA   ASN  23           HA       ASN  23   3.470 -18.728   2.129
  180   1HB   ASN  23          HB2       ASN  23   4.251 -16.739   4.278
  181   2HB   ASN  23          HB1       ASN  23   4.021 -18.466   4.555
  182   1HD2  ASN  23          HD21      ASN  23   5.327 -19.836   2.731
  183   2HD2  ASN  23          HD22      ASN  23   6.931 -19.329   2.508
  184    H    GLN  24           HN       GLN  24   1.456 -16.166   1.941
  185    HA   GLN  24           HA       GLN  24  -0.308 -16.798   4.198
  186   1HB   GLN  24          HB2       GLN  24  -1.694 -15.028   3.425
  187   2HB   GLN  24          HB1       GLN  24  -0.050 -14.492   3.087
  188   1HG   GLN  24          HG2       GLN  24  -0.335 -15.401   0.740
  189   2HG   GLN  24          HG1       GLN  24  -2.038 -15.658   1.115
  190   1HE2  GLN  24          HE21      GLN  24  -2.069 -13.963  -0.819
  191   2HE2  GLN  24          HE22      GLN  24  -2.115 -12.333  -0.348
  192    H    LYS  25           HN       LYS  25  -2.023 -18.195   4.173
  193    HA   LYS  25           HA       LYS  25  -2.458 -19.822   1.742
  194   1HB   LYS  25          HB2       LYS  25  -2.378 -20.928   3.955
  195   2HB   LYS  25          HB1       LYS  25  -3.738 -19.947   4.499
  196   1HG   LYS  25          HG2       LYS  25  -5.161 -20.941   2.738
  197   2HG   LYS  25          HG1       LYS  25  -3.800 -21.922   2.195
  198   1HD   LYS  25          HD2       LYS  25  -3.689 -22.977   4.436
  199   2HD   LYS  25          HD1       LYS  25  -5.080 -22.018   4.942
  200   1HE   LYS  25          HE2       LYS  25  -5.169 -23.839   2.531
  201   2HE   LYS  25          HE1       LYS  25  -5.585 -24.398   4.152
  202   1HZ   LYS  25          HZ1       LYS  25  -7.050 -22.664   2.366
  203   2HZ   LYS  25          HZ2       LYS  25  -6.992 -22.124   3.976
  204   3HZ   LYS  25          HZ3       LYS  25  -7.613 -23.663   3.614
  205    H    ALA  26           HN       ALA  26  -4.912 -18.630   4.011
  206    HA   ALA  26           HA       ALA  26  -6.669 -17.932   1.762
  207   1HB   ALA  26          HB1       ALA  26  -7.835 -17.025   4.190
  208   2HB   ALA  26          HB2       ALA  26  -6.953 -18.489   4.614
  209   3HB   ALA  26          HB3       ALA  26  -8.188 -18.542   3.360
  210    HA   PRO  27           HA       PRO  27  -5.819 -13.612   1.360
  211   1HB   PRO  27          HB2       PRO  27  -8.437 -12.759   2.411
  212   2HB   PRO  27          HB1       PRO  27  -7.793 -12.607   0.773
  213   1HG   PRO  27          HG2       PRO  27  -9.768 -14.461   1.677
  214   2HG   PRO  27          HG1       PRO  27  -9.019 -14.400   0.078
  215   1HD   PRO  27          HD2       PRO  27  -8.656 -16.425   2.090
  216   2HD   PRO  27          HD1       PRO  27  -7.818 -16.304   0.523
  217    H    LEU  28           HN       LEU  28  -4.997 -11.920   2.715
  218    HA   LEU  28           HA       LEU  28  -4.492 -12.557   5.443
  219   1HB   LEU  28          HB2       LEU  28  -4.442  -9.862   4.055
  220   2HB   LEU  28          HB1       LEU  28  -3.759 -10.179   5.648
  221    HG   LEU  28           HG       LEU  28  -2.928 -11.614   3.109
  222   1HD1  LEU  28          HD11      LEU  28  -1.737  -9.258   4.589
  223   2HD1  LEU  28          HD12      LEU  28  -2.231  -9.334   2.897
  224   3HD1  LEU  28          HD13      LEU  28  -0.813 -10.230   3.443
  225   1HD2  LEU  28          HD21      LEU  28  -2.321 -13.065   4.844
  226   2HD2  LEU  28          HD22      LEU  28  -2.079 -11.755   6.000
  227   3HD2  LEU  28          HD23      LEU  28  -0.882 -12.054   4.740
  228    H    CYS  29           HN       CYS  29  -6.787 -10.207   4.051
  229    HA   CYS  29           HA       CYS  29  -8.023  -9.793   6.694
  230   1HB   CYS  29          HB2       CYS  29  -8.508  -8.655   3.939
  231   2HB   CYS  29          HB1       CYS  29  -9.623  -8.350   5.272
  232    H    ASN  30           HN       ASN  30 -10.484  -9.976   6.801
  233    HA   ASN  30           HA       ASN  30 -11.261 -12.683   6.195
  234   1HB   ASN  30          HB2       ASN  30 -12.843 -10.266   7.113
  235   2HB   ASN  30          HB1       ASN  30 -13.544 -11.876   6.943
  236   1HD2  ASN  30          HD21      ASN  30 -13.198 -10.372   9.475
  237   2HD2  ASN  30          HD22      ASN  30 -12.189 -11.320  10.457
  238    H    GLY  31           HN       GLY  31 -10.465 -11.332   3.785
  239   1HA   GLY  31          HA2       GLY  31 -11.252 -11.421   1.549
  240   2HA   GLY  31          HA1       GLY  31 -12.852 -11.841   2.165
  241    H    SER  32           HN       SER  32 -11.234  -9.099   3.533
  242    HA   SER  32           HA       SER  32 -13.382  -7.318   2.889
  243   1HB   SER  32          HB2       SER  32 -10.544  -6.678   3.735
  244   2HB   SER  32          HB1       SER  32 -11.895  -5.550   3.763
  245    HG   SER  32           HG       SER  32 -11.278  -6.886   5.745
  246    H    MET  33           HN       MET  33 -13.443  -5.578   1.410
  247    HA   MET  33           HA       MET  33 -11.603  -5.851  -0.947
  248   1HB   MET  33          HB2       MET  33 -14.361  -4.582  -0.870
  249   2HB   MET  33          HB1       MET  33 -13.402  -4.981  -2.293
  250   1HG   MET  33          HG2       MET  33 -14.279  -7.110  -0.340
  251   2HG   MET  33          HG1       MET  33 -15.296  -6.607  -1.685
  252   1HE   MET  33          HE1       MET  33 -14.932  -7.939  -4.221
  253   2HE   MET  33          HE2       MET  33 -13.413  -7.251  -4.789
  254   3HE   MET  33          HE3       MET  33 -14.539  -6.248  -3.881
  255    H    VAL  34           HN       VAL  34 -10.906  -3.825  -1.954
  256    HA   VAL  34           HA       VAL  34 -11.142  -1.398  -0.200
  257    HB   VAL  34           HB       VAL  34  -8.740  -0.901  -0.929
  258   1HG1  VAL  34          HG11      VAL  34  -7.812  -2.532   0.792
  259   2HG1  VAL  34          HG12      VAL  34  -9.440  -3.206   0.900
  260   3HG1  VAL  34          HG13      VAL  34  -9.149  -1.524   1.341
  261   1HG2  VAL  34          HG21      VAL  34  -7.391  -2.853  -1.566
  262   2HG2  VAL  34          HG22      VAL  34  -8.677  -2.591  -2.743
  263   3HG2  VAL  34          HG23      VAL  34  -8.831  -3.872  -1.541
  264    H    TRP  35           HN       TRP  35 -10.763   0.638  -1.381
  265    HA   TRP  35           HA       TRP  35 -12.127   0.659  -3.935
  266   1HB   TRP  35          HB2       TRP  35 -10.573   2.814  -2.471
  267   2HB   TRP  35          HB1       TRP  35 -11.510   3.094  -3.936
  268    HD1  TRP  35           HD1      TRP  35 -11.845   2.536  -0.219
  269    HE1  TRP  35           HE1      TRP  35 -14.303   2.886   0.473
  270    HE3  TRP  35           HE3      TRP  35 -14.019   2.846  -4.826
  271    HZ2  TRP  35           HZ2      TRP  35 -16.857   3.243  -0.765
  272    HZ3  TRP  35           HZ3      TRP  35 -16.464   3.179  -5.043
  273    HH2  TRP  35           HH2      TRP  35 -17.886   3.383  -3.019
  274    H    SER  36           HN       SER  36 -11.238   0.506  -5.957
  275    HA   SER  36           HA       SER  36  -8.387   0.067  -6.269
  276   1HB   SER  36          HB2       SER  36  -8.876  -0.059  -8.657
  277   2HB   SER  36          HB1       SER  36 -10.120  -0.939  -7.775
  278    HG   SER  36           HG       SER  36 -10.846   1.612  -7.936
  279    H    ILE  37           HN       ILE  37  -6.875   1.531  -7.249
  280    HA   ILE  37           HA       ILE  37  -7.804   4.354  -7.615
  281    HB   ILE  37           HB       ILE  37  -5.709   5.093  -6.428
  282   1HG1  ILE  37          HG12      ILE  37  -5.632   2.288  -5.291
  283   2HG1  ILE  37          HG11      ILE  37  -4.656   2.737  -6.688
  284   1HG2  ILE  37          HG21      ILE  37  -6.611   4.535  -4.123
  285   2HG2  ILE  37          HG22      ILE  37  -7.798   3.502  -4.919
  286   3HG2  ILE  37          HG23      ILE  37  -7.787   5.237  -5.233
  287   1HD1  ILE  37          HD11      ILE  37  -3.639   4.577  -5.381
  288   2HD1  ILE  37          HD12      ILE  37  -3.357   3.011  -4.621
  289   3HD1  ILE  37          HD13      ILE  37  -4.591   4.094  -3.977
  290    H    ASN  38           HN       ASN  38  -6.044   5.668  -8.728
  291    HA   ASN  38           HA       ASN  38  -4.945   4.062 -10.953
  292   1HB   ASN  38          HB2       ASN  38  -4.978   7.046 -10.384
  293   2HB   ASN  38          HB1       ASN  38  -4.247   6.328 -11.820
  294   1HD2  ASN  38          HD21      ASN  38  -6.825   8.051 -11.293
  295   2HD2  ASN  38          HD22      ASN  38  -8.018   7.219 -12.169
  296    H    LEU  39           HN       LEU  39  -2.878   3.303 -10.863
  297    HA   LEU  39           HA       LEU  39  -1.150   4.105  -8.641
  298   1HB   LEU  39          HB2       LEU  39  -0.747   2.180 -10.948
  299   2HB   LEU  39          HB1       LEU  39   0.447   2.458  -9.685
  300    HG   LEU  39           HG       LEU  39  -0.946   0.445  -9.247
  301   1HD1  LEU  39          HD11      LEU  39  -1.122   0.805  -6.961
  302   2HD1  LEU  39          HD12      LEU  39  -1.736   2.445  -7.146
  303   3HD1  LEU  39          HD13      LEU  39  -0.029   2.105  -7.420
  304   1HD2  LEU  39          HD21      LEU  39  -3.031   1.602 -10.309
  305   2HD2  LEU  39          HD22      LEU  39  -3.282   2.272  -8.695
  306   3HD2  LEU  39          HD23      LEU  39  -3.269   0.526  -8.934
  307    H    THR  40           HN       THR  40   0.058   5.929  -8.794
  308    HA   THR  40           HA       THR  40   1.522   6.470 -11.327
  309    HB   THR  40           HB       THR  40   0.902   8.865 -11.211
  310    HG1  THR  40           HG1      THR  40  -0.413   7.919  -8.947
  311   1HG2  THR  40          HG21      THR  40  -0.403   7.271 -12.610
  312   2HG2  THR  40          HG22      THR  40  -1.380   8.622 -12.034
  313   3HG2  THR  40          HG23      THR  40  -1.516   7.042 -11.261
  314    H    ALA  41           HN       ALA  41   1.331   8.968  -8.956
  315    HA   ALA  41           HA       ALA  41   4.068   8.226  -7.961
  316   1HB   ALA  41          HB1       ALA  41   4.276  10.695  -7.506
  317   2HB   ALA  41          HB2       ALA  41   2.733  10.920  -8.331
  318   3HB   ALA  41          HB3       ALA  41   4.122  10.287  -9.214
  319    H    GLY  42           HN       GLY  42   1.243  10.153  -6.855
  320   1HA   GLY  42          HA2       GLY  42   1.929   9.834  -4.069
  321   2HA   GLY  42          HA1       GLY  42   0.394  10.447  -4.681
  322    H    MET  43           HN       MET  43   1.754   7.291  -5.485
  323    HA   MET  43           HA       MET  43  -0.663   5.886  -4.971
  324   1HB   MET  43          HB2       MET  43   2.165   4.799  -4.917
  325   2HB   MET  43          HB1       MET  43   0.691   3.864  -5.171
  326   1HG   MET  43          HG2       MET  43   0.208   5.264  -7.178
  327   2HG   MET  43          HG1       MET  43   1.767   6.051  -6.967
  328   1HE   MET  43          HE1       MET  43   3.622   3.239  -6.011
  329   2HE   MET  43          HE2       MET  43   3.806   4.902  -6.567
  330   3HE   MET  43          HE3       MET  43   4.400   3.577  -7.563
  331    H    TYR  44           HN       TYR  44   2.172   6.473  -2.918
  332    HA   TYR  44           HA       TYR  44   1.467   4.745  -0.775
  333   1HB   TYR  44          HB2       TYR  44   2.980   7.371  -0.823
  334   2HB   TYR  44          HB1       TYR  44   2.844   6.364   0.617
  335    HD1  TYR  44           HD1      TYR  44   4.028   4.249   0.799
  336    HD2  TYR  44           HD2      TYR  44   4.201   6.564  -2.818
  337    HE1  TYR  44           HE1      TYR  44   5.898   2.834  -0.023
  338    HE2  TYR  44           HE2      TYR  44   6.067   5.146  -3.630
  339    HH   TYR  44           HH       TYR  44   7.878   3.690  -2.531
  340    H    CYS  45           HN       CYS  45   0.666   8.193  -1.300
  341    HA   CYS  45           HA       CYS  45  -0.929   8.398   1.103
  342   1HB   CYS  45          HB2       CYS  45  -0.729  10.072  -1.406
  343   2HB   CYS  45          HB1       CYS  45  -1.846  10.469  -0.100
  344    H    ALA  46           HN       ALA  46  -1.849   8.105  -2.353
  345    HA   ALA  46           HA       ALA  46  -4.650   7.906  -1.894
  346   1HB   ALA  46          HB1       ALA  46  -4.757   6.891  -4.134
  347   2HB   ALA  46          HB2       ALA  46  -3.015   6.617  -4.101
  348   3HB   ALA  46          HB3       ALA  46  -3.648   8.262  -4.132
  349    H    ALA  47           HN       ALA  47  -2.171   5.356  -2.160
  350    HA   ALA  47           HA       ALA  47  -3.941   3.146  -1.807
  351   1HB   ALA  47          HB1       ALA  47  -1.595   2.907  -2.569
  352   2HB   ALA  47          HB2       ALA  47  -1.919   1.888  -1.167
  353   3HB   ALA  47          HB3       ALA  47  -1.033   3.399  -0.971
  354    H    LEU  48           HN       LEU  48  -2.203   5.181   0.525
  355    HA   LEU  48           HA       LEU  48  -2.779   3.687   2.858
  356   1HB   LEU  48          HB2       LEU  48  -1.154   5.513   2.840
  357   2HB   LEU  48          HB1       LEU  48  -2.432   6.679   2.518
  358    HG   LEU  48           HG       LEU  48  -3.474   6.159   4.695
  359   1HD1  LEU  48          HD11      LEU  48  -1.254   4.117   4.789
  360   2HD1  LEU  48          HD12      LEU  48  -2.968   3.908   5.149
  361   3HD1  LEU  48          HD13      LEU  48  -1.931   4.767   6.283
  362   1HD2  LEU  48          HD21      LEU  48  -0.516   6.648   5.101
  363   2HD2  LEU  48          HD22      LEU  48  -1.858   7.276   6.057
  364   3HD2  LEU  48          HD23      LEU  48  -1.592   7.865   4.416
  365    H    GLU  49           HN       GLU  49  -4.639   6.474   1.520
  366    HA   GLU  49           HA       GLU  49  -6.658   6.389   3.524
  367   1HB   GLU  49          HB2       GLU  49  -8.125   7.491   1.743
  368   2HB   GLU  49          HB1       GLU  49  -6.620   8.320   2.145
  369   1HG   GLU  49          HG2       GLU  49  -5.528   7.295   0.190
  370   2HG   GLU  49          HG1       GLU  49  -7.029   6.459  -0.214
  371    H    SER  50           HN       SER  50  -6.350   4.588   0.492
  372    HA   SER  50           HA       SER  50  -8.968   3.421   0.560
  373   1HB   SER  50          HB2       SER  50  -7.471   3.333  -1.428
  374   2HB   SER  50          HB1       SER  50  -6.393   2.252  -0.549
  375    HG   SER  50           HG       SER  50  -8.829   1.771  -1.745
  376    H    LEU  51           HN       LEU  51  -5.858   2.461   1.959
  377    HA   LEU  51           HA       LEU  51  -6.791  -0.048   3.031
  378   1HB   LEU  51          HB2       LEU  51  -4.443   1.724   3.733
  379   2HB   LEU  51          HB1       LEU  51  -4.710   0.141   4.458
  380    HG   LEU  51           HG       LEU  51  -4.496   0.627   1.472
  381   1HD1  LEU  51          HD11      LEU  51  -2.405  -0.496   3.357
  382   2HD1  LEU  51          HD12      LEU  51  -2.388   1.145   2.712
  383   3HD1  LEU  51          HD13      LEU  51  -2.228  -0.232   1.622
  384   1HD2  LEU  51          HD21      LEU  51  -3.919  -1.973   1.744
  385   2HD2  LEU  51          HD22      LEU  51  -5.586  -1.424   1.631
  386   3HD2  LEU  51          HD23      LEU  51  -4.890  -1.801   3.206
  387    H    ILE  52           HN       ILE  52  -6.736   3.261   4.281
  388    HA   ILE  52           HA       ILE  52  -7.186   2.754   7.013
  389    HB   ILE  52           HB       ILE  52  -8.188   4.961   5.197
  390   1HG1  ILE  52          HG12      ILE  52  -5.767   4.905   5.617
  391   2HG1  ILE  52          HG11      ILE  52  -6.493   6.308   6.381
  392   1HG2  ILE  52          HG21      ILE  52  -8.517   4.734   8.195
  393   2HG2  ILE  52          HG22      ILE  52  -9.797   4.866   6.991
  394   3HG2  ILE  52          HG23      ILE  52  -8.723   6.230   7.285
  395   1HD1  ILE  52          HD11      ILE  52  -6.636   4.571   8.456
  396   2HD1  ILE  52          HD12      ILE  52  -5.226   5.580   8.155
  397   3HD1  ILE  52          HD13      ILE  52  -5.239   3.905   7.615
  398    H    ASN  53           HN       ASN  53  -9.210   1.973   4.358
  399    HA   ASN  53           HA       ASN  53 -11.698   1.964   5.931
  400   1HB   ASN  53          HB2       ASN  53 -11.002   0.931   3.168
  401   2HB   ASN  53          HB1       ASN  53 -12.610   0.798   3.880
  402   1HD2  ASN  53          HD21      ASN  53 -12.725   3.336   5.212
  403   2HD2  ASN  53          HD22      ASN  53 -12.737   4.556   4.032
  404    H    VAL  54           HN       VAL  54  -9.027  -0.117   5.410
  405    HA   VAL  54           HA       VAL  54 -10.529  -2.575   6.115
  406    HB   VAL  54           HB       VAL  54  -7.567  -2.150   5.609
  407   1HG1  VAL  54          HG11      VAL  54  -9.305  -4.594   5.979
  408   2HG1  VAL  54          HG12      VAL  54  -7.825  -4.168   6.839
  409   3HG1  VAL  54          HG13      VAL  54  -7.750  -4.673   5.151
  410   1HG2  VAL  54          HG21      VAL  54  -8.008  -2.990   3.374
  411   2HG2  VAL  54          HG22      VAL  54  -9.080  -1.621   3.673
  412   3HG2  VAL  54          HG23      VAL  54  -9.704  -3.267   3.770
  413    H    SER  55           HN       SER  55 -10.840  -3.046   8.232
  414    HA   SER  55           HA       SER  55  -8.763  -2.203  10.232
  415   1HB   SER  55          HB2       SER  55 -11.776  -2.142  10.576
  416   2HB   SER  55          HB1       SER  55 -10.595  -1.770  11.829
  417    HG   SER  55           HG       SER  55 -11.030  -0.410   9.373
  418    H    GLY  56           HN       GLY  56  -8.516  -3.638  12.017
  419   1HA   GLY  56          HA2       GLY  56  -8.926  -5.641  13.261
  420   2HA   GLY  56          HA1       GLY  56 -10.066  -6.162  12.021
  421    H    CYS  57           HN       CYS  57  -7.620  -5.208  10.157
  422    HA   CYS  57           HA       CYS  57  -6.473  -7.952  10.039
  423   1HB   CYS  57          HB2       CYS  57  -6.226  -5.584   8.155
  424   2HB   CYS  57          HB1       CYS  57  -5.500  -7.168   7.884
  425    H    SER  58           HN       SER  58  -5.064  -7.828  11.876
  426    HA   SER  58           HA       SER  58  -3.177  -5.725  12.330
  427   1HB   SER  58          HB2       SER  58  -3.843  -7.519  13.984
  428   2HB   SER  58          HB1       SER  58  -2.834  -8.641  13.075
  429    HG   SER  58           HG       SER  58  -1.068  -7.587  13.712
  430    H    ALA  59           HN       ALA  59  -3.051  -8.686  10.437
  431    HA   ALA  59           HA       ALA  59  -0.349  -8.921   9.849
  432   1HB   ALA  59          HB1       ALA  59  -2.322 -10.359   9.059
  433   2HB   ALA  59          HB2       ALA  59  -0.981 -10.155   7.932
  434   3HB   ALA  59          HB3       ALA  59  -2.463  -9.221   7.719
  435    H    ILE  60           HN       ILE  60  -2.292  -6.194   9.047
  436    HA   ILE  60           HA       ILE  60  -0.140  -5.250   7.169
  437    HB   ILE  60           HB       ILE  60  -1.858  -4.055   5.872
  438   1HG1  ILE  60          HG12      ILE  60  -3.849  -5.571   7.587
  439   2HG1  ILE  60          HG11      ILE  60  -3.526  -3.846   7.730
  440   1HG2  ILE  60          HG21      ILE  60  -1.127  -6.462   5.388
  441   2HG2  ILE  60          HG22      ILE  60  -2.651  -5.947   4.666
  442   3HG2  ILE  60          HG23      ILE  60  -2.658  -6.960   6.110
  443   1HD1  ILE  60          HD11      ILE  60  -5.434  -3.992   6.323
  444   2HD1  ILE  60          HD12      ILE  60  -4.741  -5.320   5.392
  445   3HD1  ILE  60          HD13      ILE  60  -4.083  -3.692   5.230
  446    H    GLU  61           HN       GLU  61  -1.490  -4.819  10.103
  447    HA   GLU  61           HA       GLU  61  -1.963  -2.018  10.245
  448   1HB   GLU  61          HB2       GLU  61  -2.543  -3.586  12.044
  449   2HB   GLU  61          HB1       GLU  61  -0.837  -3.896  12.346
  450   1HG   GLU  61          HG2       GLU  61  -1.715  -2.293  13.956
  451   2HG   GLU  61          HG1       GLU  61  -0.539  -1.508  12.905
  452    H    LYS  62           HN       LYS  62   1.023  -3.928  10.607
  453    HA   LYS  62           HA       LYS  62   2.755  -1.725  11.191
  454   1HB   LYS  62          HB2       LYS  62   3.290  -4.393   9.854
  455   2HB   LYS  62          HB1       LYS  62   4.560  -3.241  10.269
  456   1HG   LYS  62          HG2       LYS  62   3.864  -3.311  12.628
  457   2HG   LYS  62          HG1       LYS  62   2.592  -4.462  12.221
  458   1HD   LYS  62          HD2       LYS  62   4.291  -6.063  11.421
  459   2HD   LYS  62          HD1       LYS  62   5.565  -4.914  11.832
  460   1HE   LYS  62          HE2       LYS  62   4.742  -4.951  14.205
  461   2HE   LYS  62          HE1       LYS  62   3.628  -6.240  13.749
  462   1HZ   LYS  62          HZ1       LYS  62   5.315  -7.591  14.242
  463   2HZ   LYS  62          HZ2       LYS  62   6.466  -6.341  14.205
  464   3HZ   LYS  62          HZ3       LYS  62   5.989  -7.105  12.764
  465    H    THR  63           HN       THR  63   1.630  -3.154   8.154
  466    HA   THR  63           HA       THR  63   3.292  -1.721   6.363
  467    HB   THR  63           HB       THR  63   0.410  -2.572   5.968
  468    HG1  THR  63           HG1      THR  63   2.882  -3.853   5.435
  469   1HG2  THR  63          HG21      THR  63   2.599  -1.767   4.043
  470   2HG2  THR  63          HG22      THR  63   1.026  -0.999   4.259
  471   3HG2  THR  63          HG23      THR  63   1.130  -2.609   3.547
  472    H    GLN  64           HN       GLN  64   0.253  -0.792   7.940
  473    HA   GLN  64           HA       GLN  64  -0.212   1.612   6.495
  474   1HB   GLN  64          HB2       GLN  64  -0.836   0.872   9.370
  475   2HB   GLN  64          HB1       GLN  64  -1.445   2.327   8.580
  476   1HG   GLN  64          HG2       GLN  64  -1.874  -0.461   7.480
  477   2HG   GLN  64          HG1       GLN  64  -3.034   0.356   8.527
  478   1HE2  GLN  64          HE21      GLN  64  -2.058  -0.022   5.269
  479   2HE2  GLN  64          HE22      GLN  64  -2.941   1.268   4.611
  480    H    ARG  65           HN       ARG  65   1.789   0.976   9.379
  481    HA   ARG  65           HA       ARG  65   2.500   3.721   9.839
  482   1HB   ARG  65          HB2       ARG  65   3.884   1.125  10.561
  483   2HB   ARG  65          HB1       ARG  65   4.457   2.708  11.092
  484   1HG   ARG  65          HG2       ARG  65   2.279   3.135  12.165
  485   2HG   ARG  65          HG1       ARG  65   1.709   1.551  11.648
  486   1HD   ARG  65          HD2       ARG  65   3.605   0.517  12.909
  487   2HD   ARG  65          HD1       ARG  65   4.034   2.109  13.525
  488    HE   ARG  65           HE       ARG  65   1.978   0.350  14.532
  489   1HH1  ARG  65          HH21      ARG  65   2.559   3.681  13.833
  490   2HH1  ARG  65          HH22      ARG  65   1.250   4.239  14.819
  491   1HH2  ARG  65          HH11      ARG  65   0.288   1.069  15.815
  492   2HH2  ARG  65          HH12      ARG  65  -0.028   2.768  15.940
  493    H    MET  66           HN       MET  66   4.103   1.120   7.985
  494    HA   MET  66           HA       MET  66   6.373   2.700   7.233
  495   1HB   MET  66          HB2       MET  66   5.092   0.276   5.950
  496   2HB   MET  66          HB1       MET  66   6.595   0.994   5.369
  497   1HG   MET  66          HG2       MET  66   7.518   0.735   7.716
  498   2HG   MET  66          HG1       MET  66   6.074  -0.193   8.111
  499   1HE   MET  66          HE1       MET  66   5.459  -1.994   5.525
  500   2HE   MET  66          HE2       MET  66   5.375  -2.253   7.266
  501   3HE   MET  66          HE3       MET  66   6.253  -3.396   6.254
  502    H    LEU  67           HN       LEU  67   3.209   2.210   5.682
  503    HA   LEU  67           HA       LEU  67   3.808   3.662   3.288
  504   1HB   LEU  67          HB2       LEU  67   1.200   3.226   4.764
  505   2HB   LEU  67          HB1       LEU  67   1.297   4.023   3.196
  506    HG   LEU  67           HG       LEU  67   2.382   1.241   3.740
  507   1HD1  LEU  67          HD11      LEU  67   0.353   0.456   2.517
  508   2HD1  LEU  67          HD12      LEU  67  -0.263   2.108   2.539
  509   3HD1  LEU  67          HD13      LEU  67  -0.038   1.231   4.052
  510   1HD2  LEU  67          HD21      LEU  67   2.008   1.244   1.111
  511   2HD2  LEU  67          HD22      LEU  67   3.460   1.966   1.790
  512   3HD2  LEU  67          HD23      LEU  67   2.115   2.994   1.298
  513    H    SER  68           HN       SER  68   2.637   4.683   6.469
  514    HA   SER  68           HA       SER  68   2.095   7.397   5.840
  515   1HB   SER  68          HB2       SER  68   3.107   6.122   8.395
  516   2HB   SER  68          HB1       SER  68   2.610   7.807   8.283
  517    HG   SER  68           HG       SER  68   0.628   6.704   7.255
  518    H    GLY  69           HN       GLY  69   5.130   5.754   6.685
  519   1HA   GLY  69          HA2       GLY  69   6.829   7.959   7.017
  520   2HA   GLY  69          HA1       GLY  69   7.347   6.444   6.275
  521    H    PHE  70           HN       PHE  70   5.400   6.681   4.061
  522    HA   PHE  70           HA       PHE  70   6.957   8.584   2.387
  523   1HB   PHE  70          HB2       PHE  70   4.906   6.446   1.721
  524   2HB   PHE  70          HB1       PHE  70   5.646   7.498   0.516
  525    HD1  PHE  70           HD1      PHE  70   8.025   7.277  -0.069
  526    HD2  PHE  70           HD2      PHE  70   6.205   4.731   2.874
  527    HE1  PHE  70           HE1      PHE  70   9.983   5.761  -0.170
  528    HE2  PHE  70           HE2      PHE  70   8.165   3.215   2.773
  529    HZ   PHE  70           HZ       PHE  70  10.053   3.729   1.250
  530    H    CYS  71           HN       CYS  71   4.082   8.437   4.162
  531    HA   CYS  71           HA       CYS  71   3.058  10.914   2.842
  532   1HB   CYS  71          HB2       CYS  71   1.528   8.376   3.434
  533   2HB   CYS  71          HB1       CYS  71   0.713   9.933   3.311
  534    HA   PRO  72           HA       PRO  72   3.528  11.148   7.486
  535   1HB   PRO  72          HB2       PRO  72   4.253  13.947   7.033
  536   2HB   PRO  72          HB1       PRO  72   5.224  12.647   7.733
  537   1HG   PRO  72          HG2       PRO  72   5.653  13.813   5.226
  538   2HG   PRO  72          HG1       PRO  72   6.315  12.263   5.761
  539   1HD   PRO  72          HD2       PRO  72   4.114  12.786   3.841
  540   2HD   PRO  72          HD1       PRO  72   5.106  11.320   4.044
  541    H    HIS  73           HN       HIS  73   1.235  12.276   5.368
  542    HA   HIS  73           HA       HIS  73   0.020  14.230   7.244
  543   1HB   HIS  73          HB2       HIS  73  -1.681  14.547   5.520
  544   2HB   HIS  73          HB1       HIS  73  -0.078  14.655   4.798
  545    HD1  HIS  73           HD1      HIS  73  -3.140  12.503   4.913
  546    HD2  HIS  73           HD2      HIS  73   0.600  12.490   3.071
  547    HE1  HIS  73           HE1      HIS  73  -3.233  10.719   3.118
  548    H    LYS  74           HN       LYS  74  -1.720  13.780   8.536
  549    HA   LYS  74           HA       LYS  74  -2.310  10.989   9.084
  550   1HB   LYS  74          HB2       LYS  74  -3.428  13.586  10.163
  551   2HB   LYS  74          HB1       LYS  74  -3.936  11.999  10.742
  552   1HG   LYS  74          HG2       LYS  74  -1.603  11.463  11.338
  553   2HG   LYS  74          HG1       LYS  74  -1.093  13.051  10.763
  554   1HD   LYS  74          HD2       LYS  74  -2.546  14.131  12.435
  555   2HD   LYS  74          HD1       LYS  74  -3.060  12.546  13.015
  556   1HE   LYS  74          HE2       LYS  74  -0.791  12.004  13.695
  557   2HE   LYS  74          HE1       LYS  74  -0.182  13.500  12.988
  558   1HZ   LYS  74          HZ1       LYS  74  -0.441  14.188  15.114
  559   2HZ   LYS  74          HZ2       LYS  74  -1.683  13.079  15.455
  560   3HZ   LYS  74          HZ3       LYS  74  -2.021  14.496  14.581
  561    H    VAL  75           HN       VAL  75  -4.247   9.883   8.730
  562    HA   VAL  75           HA       VAL  75  -6.312  11.233   7.022
  563    HB   VAL  75           HB       VAL  75  -5.224   8.418   6.701
  564   1HG1  VAL  75          HG11      VAL  75  -7.581   8.503   6.143
  565   2HG1  VAL  75          HG12      VAL  75  -6.662   8.463   4.638
  566   3HG1  VAL  75          HG13      VAL  75  -7.350   9.983   5.211
  567   1HG2  VAL  75          HG21      VAL  75  -3.712  10.271   5.924
  568   2HG2  VAL  75          HG22      VAL  75  -5.002  10.813   4.851
  569   3HG2  VAL  75          HG23      VAL  75  -4.269   9.227   4.617
  570    H    SER  76           HN       SER  76  -8.338  10.983   7.833
  571    HA   SER  76           HA       SER  76  -8.739   9.040  10.074
  572   1HB   SER  76          HB2       SER  76  -9.371  11.193  10.805
  573   2HB   SER  76          HB1       SER  76 -10.100  11.604   9.256
  574    HG   SER  76           HG       SER  76 -11.682  11.082  10.811
  575    H    ALA  77           HN       ALA  77 -10.613   7.668  10.035
  576    HA   ALA  77           HA       ALA  77 -11.259   6.550   7.498
  577   1HB   ALA  77          HB1       ALA  77 -11.517   5.346   9.671
  578   2HB   ALA  77          HB2       ALA  77 -12.976   5.277   8.684
  579   3HB   ALA  77          HB3       ALA  77 -12.888   6.388  10.051
  580    H    GLY  78           HN       GLY  78 -12.309   9.410   8.962
  581   1HA   GLY  78          HA2       GLY  78 -14.871   9.474   7.442
  582   2HA   GLY  78          HA1       GLY  78 -14.372  10.640   8.669
  583    H    GLN  79           HN       GLN  79 -11.661  10.931   7.570
  584    HA   GLN  79           HA       GLN  79 -12.330  12.862   5.434
  585   1HB   GLN  79          HB2       GLN  79  -9.777  12.260   6.945
  586   2HB   GLN  79          HB1       GLN  79  -9.882  13.451   5.649
  587   1HG   GLN  79          HG2       GLN  79 -11.489  14.759   6.874
  588   2HG   GLN  79          HG1       GLN  79 -11.665  13.498   8.095
  589   1HE2  GLN  79          HE21      GLN  79 -10.816  16.229   8.691
  590   2HE2  GLN  79          HE22      GLN  79  -9.230  16.142   9.288
  591    H    PHE  80           HN       PHE  80 -12.121  12.367   3.331
  592    HA   PHE  80           HA       PHE  80 -10.186  10.229   2.504
  593   1HB   PHE  80          HB2       PHE  80 -13.032  10.664   1.553
  594   2HB   PHE  80          HB1       PHE  80 -11.873   9.615   0.735
  595    HD1  PHE  80           HD1      PHE  80 -14.265   9.866   3.407
  596    HD2  PHE  80           HD2      PHE  80 -10.760   7.750   2.113
  597    HE1  PHE  80           HE1      PHE  80 -14.792   8.028   4.987
  598    HE2  PHE  80           HE2      PHE  80 -11.285   5.912   3.694
  599    HZ   PHE  80           HZ       PHE  80 -13.301   6.051   5.131
  600    H    SER  81           HN       SER  81  -9.149  10.648   0.496
  601    HA   SER  81           HA       SER  81  -9.607  13.405  -0.620
  602   1HB   SER  81          HB2       SER  81  -7.013  11.871  -0.334
  603   2HB   SER  81          HB1       SER  81  -7.184  13.441  -1.113
  604    HG   SER  81           HG       SER  81  -8.027  14.201   0.914
  605    H    SER  82           HN       SER  82  -8.515  10.088  -1.441
  606    HA   SER  82           HA       SER  82  -8.831  10.759  -4.326
  607   1HB   SER  82          HB2       SER  82  -6.747   9.638  -3.532
  608   2HB   SER  82          HB1       SER  82  -7.718   8.243  -3.069
  609    HG   SER  82           HG       SER  82  -7.987   7.744  -5.118
  610    H    LEU  83           HN       LEU  83 -10.815   9.493  -1.949
  611    HA   LEU  83           HA       LEU  83 -12.036   7.421  -3.681
  612   1HB   LEU  83          HB2       LEU  83 -13.028   8.510  -1.031
  613   2HB   LEU  83          HB1       LEU  83 -13.557   7.032  -1.828
  614    HG   LEU  83           HG       LEU  83 -10.861   7.603  -0.580
  615   1HD1  LEU  83          HD11      LEU  83 -12.921   6.755   0.747
  616   2HD1  LEU  83          HD12      LEU  83 -11.413   5.859   0.920
  617   3HD1  LEU  83          HD13      LEU  83 -12.689   5.241  -0.126
  618   1HD2  LEU  83          HD21      LEU  83 -10.252   6.447  -2.560
  619   2HD2  LEU  83          HD22      LEU  83 -11.694   5.431  -2.513
  620   3HD2  LEU  83          HD23      LEU  83 -10.393   5.170  -1.353
  621    H    HIS  84           HN       HIS  84 -11.988  10.327  -4.463
  622    HA   HIS  84           HA       HIS  84 -14.735  11.268  -4.218
  623   1HB   HIS  84          HB2       HIS  84 -12.557  12.134  -6.148
  624   2HB   HIS  84          HB1       HIS  84 -14.048  13.012  -5.806
  625    HD1  HIS  84           HD1      HIS  84 -13.220  11.702  -2.667
  626    HD2  HIS  84           HD2      HIS  84 -11.599  14.789  -4.950
  627    HE1  HIS  84           HE1      HIS  84 -11.908  13.161  -1.072
  628    H    VAL  85           HN       VAL  85 -12.851   9.524  -6.643
  629    HA   VAL  85           HA       VAL  85 -14.948   9.595  -8.653
  630    HB   VAL  85           HB       VAL  85 -13.525   7.806  -9.743
  631   1HG1  VAL  85          HG11      VAL  85 -11.513   9.390  -9.983
  632   2HG1  VAL  85          HG12      VAL  85 -12.350  10.443  -8.843
  633   3HG1  VAL  85          HG13      VAL  85 -13.094  10.054 -10.395
  634   1HG2  VAL  85          HG21      VAL  85 -11.631   8.393  -7.451
  635   2HG2  VAL  85          HG22      VAL  85 -11.422   7.208  -8.740
  636   3HG2  VAL  85          HG23      VAL  85 -12.655   6.959  -7.504
  637    H    ARG  86           HN       ARG  86 -16.323   7.852  -9.261
  638    HA   ARG  86           HA       ARG  86 -17.037   6.058  -7.014
  639   1HB   ARG  86          HB2       ARG  86 -18.343   6.670  -9.682
  640   2HB   ARG  86          HB1       ARG  86 -18.974   5.482  -8.541
  641   1HG   ARG  86          HG2       ARG  86 -19.174   7.220  -6.814
  642   2HG   ARG  86          HG1       ARG  86 -18.513   8.417  -7.929
  643   1HD   ARG  86          HD2       ARG  86 -20.412   7.967  -9.482
  644   2HD   ARG  86          HD1       ARG  86 -21.095   6.866  -8.284
  645    HE   ARG  86           HE       ARG  86 -20.769   9.214  -6.870
  646   1HH1  ARG  86          HH21      ARG  86 -22.215   8.300  -9.864
  647   2HH1  ARG  86          HH22      ARG  86 -23.440   9.524  -9.799
  648   1HH2  ARG  86          HH11      ARG  86 -22.358  10.822  -6.771
  649   2HH2  ARG  86          HH12      ARG  86 -23.520  10.952  -8.049
  650    H    ASP  87           HN       ASP  87 -14.785   5.010  -7.567
  651    HA   ASP  87           HA       ASP  87 -14.828   3.208  -9.893
  652   1HB   ASP  87          HB2       ASP  87 -12.878   3.577  -7.601
  653   2HB   ASP  87          HB1       ASP  87 -12.659   2.383  -8.881
  654    H    THR  88           HN       THR  88 -14.330   0.808  -9.409
  655    HA   THR  88           HA       THR  88 -16.315  -0.134  -7.412
  656    HB   THR  88           HB       THR  88 -16.186  -2.257  -8.543
  657    HG1  THR  88           HG1      THR  88 -14.263  -2.785  -9.173
  658   1HG2  THR  88          HG21      THR  88 -17.431  -0.499  -9.745
  659   2HG2  THR  88          HG22      THR  88 -16.663  -1.616 -10.875
  660   3HG2  THR  88          HG23      THR  88 -15.953  -0.028 -10.584
  661    H    LYS  89           HN       LYS  89 -15.704  -1.788  -5.851
  662    HA   LYS  89           HA       LYS  89 -12.993  -1.346  -4.794
  663   1HB   LYS  89          HB2       LYS  89 -15.353  -2.953  -3.784
  664   2HB   LYS  89          HB1       LYS  89 -13.809  -2.851  -2.949
  665   1HG   LYS  89          HG2       LYS  89 -14.034  -0.411  -2.783
  666   2HG   LYS  89          HG1       LYS  89 -15.585  -0.497  -3.624
  667   1HD   LYS  89          HD2       LYS  89 -16.480  -1.943  -1.834
  668   2HD   LYS  89          HD1       LYS  89 -14.934  -1.855  -0.990
  669   1HE   LYS  89          HE2       LYS  89 -15.175   0.538  -0.690
  670   2HE   LYS  89          HE1       LYS  89 -16.645   0.553  -1.664
  671   1HZ   LYS  89          HZ1       LYS  89 -17.078   0.543   0.743
  672   2HZ   LYS  89          HZ2       LYS  89 -16.304  -0.964   0.866
  673   3HZ   LYS  89          HZ3       LYS  89 -17.734  -0.811  -0.038
  674    H    ILE  90           HN       ILE  90 -11.543  -3.141  -4.283
  675    HA   ILE  90           HA       ILE  90 -11.987  -5.632  -5.888
  676    HB   ILE  90           HB       ILE  90  -9.542  -5.545  -6.471
  677   1HG1  ILE  90          HG12      ILE  90  -9.782  -2.675  -5.516
  678   2HG1  ILE  90          HG11      ILE  90  -8.954  -3.949  -4.622
  679   1HG2  ILE  90          HG21      ILE  90 -11.245  -3.216  -7.412
  680   2HG2  ILE  90          HG22      ILE  90 -11.277  -4.848  -8.079
  681   3HG2  ILE  90          HG23      ILE  90  -9.831  -3.854  -8.251
  682   1HD1  ILE  90          HD11      ILE  90  -8.250  -3.145  -7.458
  683   2HD1  ILE  90          HD12      ILE  90  -7.364  -4.264  -6.422
  684   3HD1  ILE  90          HD13      ILE  90  -7.414  -2.547  -6.025
  685    H    GLU  91           HN       GLU  91 -10.495  -7.411  -5.161
  686    HA   GLU  91           HA       GLU  91 -10.653  -7.771  -2.321
  687   1HB   GLU  91          HB2       GLU  91  -9.076  -9.280  -4.423
  688   2HB   GLU  91          HB1       GLU  91  -9.298  -9.823  -2.759
  689   1HG   GLU  91          HG2       GLU  91 -11.743  -9.824  -3.079
  690   2HG   GLU  91          HG1       GLU  91 -11.528  -9.282  -4.743
  691    H    VAL  92           HN       VAL  92  -9.121  -7.553  -0.711
  692    HA   VAL  92           HA       VAL  92  -7.018  -5.665  -1.019
  693    HB   VAL  92           HB       VAL  92  -7.505  -7.787   1.086
  694   1HG1  VAL  92          HG11      VAL  92  -5.419  -5.604   0.930
  695   2HG1  VAL  92          HG12      VAL  92  -5.175  -7.321   1.250
  696   3HG1  VAL  92          HG13      VAL  92  -5.938  -6.298   2.466
  697   1HG2  VAL  92          HG21      VAL  92  -7.798  -4.797   1.374
  698   2HG2  VAL  92          HG22      VAL  92  -8.543  -6.075   2.331
  699   3HG2  VAL  92          HG23      VAL  92  -9.103  -5.766   0.689
  700    H    ALA  93           HN       ALA  93  -6.920  -9.237  -0.996
  701    HA   ALA  93           HA       ALA  93  -4.131  -9.604  -1.054
  702   1HB   ALA  93          HB1       ALA  93  -6.049 -11.239  -2.724
  703   2HB   ALA  93          HB2       ALA  93  -5.967 -11.388  -0.969
  704   3HB   ALA  93          HB3       ALA  93  -4.555 -11.772  -1.953
  705    H    GLN  94           HN       GLN  94  -6.336  -8.996  -3.792
  706    HA   GLN  94           HA       GLN  94  -4.189  -9.066  -5.749
  707   1HB   GLN  94          HB2       GLN  94  -6.616  -9.516  -6.261
  708   2HB   GLN  94          HB1       GLN  94  -6.930  -7.798  -6.017
  709   1HG   GLN  94          HG2       GLN  94  -5.316  -7.246  -7.798
  710   2HG   GLN  94          HG1       GLN  94  -5.001  -8.965  -8.045
  711   1HE2  GLN  94          HE21      GLN  94  -5.851  -8.546 -10.320
  712   2HE2  GLN  94          HE22      GLN  94  -7.530  -8.547 -10.567
  713    H    PHE  95           HN       PHE  95  -5.736  -6.610  -3.780
  714    HA   PHE  95           HA       PHE  95  -4.786  -4.284  -5.123
  715   1HB   PHE  95          HB2       PHE  95  -6.441  -4.183  -3.299
  716   2HB   PHE  95          HB1       PHE  95  -5.224  -4.752  -2.159
  717    HD1  PHE  95           HD1      PHE  95  -6.533  -1.881  -3.957
  718    HD2  PHE  95           HD2      PHE  95  -3.192  -3.358  -1.699
  719    HE1  PHE  95           HE1      PHE  95  -5.750   0.441  -3.598
  720    HE2  PHE  95           HE2      PHE  95  -2.405  -1.038  -1.340
  721    HZ   PHE  95           HZ       PHE  95  -3.689   0.865  -2.289
  722    H    VAL  96           HN       VAL  96  -3.328  -6.219  -2.494
  723    HA   VAL  96           HA       VAL  96  -0.951  -4.668  -2.224
  724    HB   VAL  96           HB       VAL  96  -1.375  -7.641  -1.784
  725   1HG1  VAL  96          HG11      VAL  96   0.979  -7.250  -1.929
  726   2HG1  VAL  96          HG12      VAL  96   0.601  -7.292  -0.207
  727   3HG1  VAL  96          HG13      VAL  96   0.854  -5.746  -1.017
  728   1HG2  VAL  96          HG21      VAL  96  -1.607  -6.958   0.594
  729   2HG2  VAL  96          HG22      VAL  96  -2.861  -6.241  -0.418
  730   3HG2  VAL  96          HG23      VAL  96  -1.486  -5.268   0.105
  731    H    LYS  97           HN       LYS  97  -1.635  -7.557  -4.220
  732    HA   LYS  97           HA       LYS  97   0.964  -7.788  -5.346
  733   1HB   LYS  97          HB2       LYS  97  -1.755  -8.541  -6.432
  734   2HB   LYS  97          HB1       LYS  97  -0.241  -8.967  -7.235
  735   1HG   LYS  97          HG2       LYS  97   0.519 -10.130  -5.197
  736   2HG   LYS  97          HG1       LYS  97  -0.995  -9.710  -4.393
  737   1HD   LYS  97          HD2       LYS  97  -2.253 -10.969  -6.100
  738   2HD   LYS  97          HD1       LYS  97  -0.738 -11.394  -6.899
  739   1HE   LYS  97          HE2       LYS  97  -1.607 -13.190  -5.373
  740   2HE   LYS  97          HE1       LYS  97   0.013 -12.629  -4.959
  741   1HZ   LYS  97          HZ1       LYS  97  -0.692 -11.793  -3.031
  742   2HZ   LYS  97          HZ2       LYS  97  -2.074 -12.756  -3.251
  743   3HZ   LYS  97          HZ3       LYS  97  -2.093 -11.121  -3.710
  744    H    ASP  98           HN       ASP  98  -1.888  -6.013  -6.639
  745    HA   ASP  98           HA       ASP  98  -0.562  -5.075  -8.984
  746   1HB   ASP  98          HB2       ASP  98  -2.799  -3.856  -7.343
  747   2HB   ASP  98          HB1       ASP  98  -2.261  -3.197  -8.889
  748    H    LEU  99           HN       LEU  99  -0.736  -3.763  -5.702
  749    HA   LEU  99           HA       LEU  99   0.655  -1.328  -6.228
  750   1HB   LEU  99          HB2       LEU  99  -0.599  -1.744  -4.139
  751   2HB   LEU  99          HB1       LEU  99   0.561  -2.990  -3.688
  752    HG   LEU  99           HG       LEU  99   2.360  -1.305  -3.639
  753   1HD1  LEU  99          HD11      LEU  99   1.440   1.166  -3.638
  754   2HD1  LEU  99          HD12      LEU  99   0.134   0.482  -4.605
  755   3HD1  LEU  99          HD13      LEU  99   1.801   0.379  -5.172
  756   1HD2  LEU  99          HD21      LEU  99  -0.024  -0.346  -2.034
  757   2HD2  LEU  99          HD22      LEU  99   1.680  -0.227  -1.595
  758   3HD2  LEU  99          HD23      LEU  99   0.888  -1.802  -1.635
  759    H    LEU 100           HN       LEU 100   1.759  -4.586  -5.384
  760    HA   LEU 100           HA       LEU 100   4.491  -4.062  -4.951
  761   1HB   LEU 100          HB2       LEU 100   3.552  -6.228  -4.452
  762   2HB   LEU 100          HB1       LEU 100   3.142  -6.490  -6.142
  763    HG   LEU 100           HG       LEU 100   5.485  -6.600  -6.761
  764   1HD1  LEU 100          HD11      LEU 100   5.912  -5.710  -3.906
  765   2HD1  LEU 100          HD12      LEU 100   6.578  -5.017  -5.383
  766   3HD1  LEU 100          HD13      LEU 100   7.176  -6.563  -4.792
  767   1HD2  LEU 100          HD21      LEU 100   6.164  -8.583  -5.433
  768   2HD2  LEU 100          HD22      LEU 100   4.463  -8.663  -5.893
  769   3HD2  LEU 100          HD23      LEU 100   4.912  -8.205  -4.250
  770    H    LEU 101           HN       LEU 101   2.875  -4.725  -8.106
  771    HA   LEU 101           HA       LEU 101   5.301  -4.728  -9.614
  772   1HB   LEU 101          HB2       LEU 101   2.443  -4.087 -10.325
  773   2HB   LEU 101          HB1       LEU 101   3.717  -3.862 -11.517
  774    HG   LEU 101           HG       LEU 101   2.539  -6.120 -11.579
  775   1HD1  LEU 101          HD11      LEU 101   5.003  -5.566 -12.347
  776   2HD1  LEU 101          HD12      LEU 101   4.461  -7.238 -12.269
  777   3HD1  LEU 101          HD13      LEU 101   5.454  -6.578 -10.975
  778   1HD2  LEU 101          HD21      LEU 101   2.967  -7.732  -9.879
  779   2HD2  LEU 101          HD22      LEU 101   2.499  -6.262  -9.032
  780   3HD2  LEU 101          HD23      LEU 101   4.196  -6.719  -9.121
  781    H    HIS 102           HN       HIS 102   3.217  -2.014  -8.613
  782    HA   HIS 102           HA       HIS 102   4.802  -0.062 -10.056
  783   1HB   HIS 102          HB2       HIS 102   2.681   0.123  -7.922
  784   2HB   HIS 102          HB1       HIS 102   3.590   1.555  -8.401
  785    HD1  HIS 102           HD1      HIS 102   3.200   2.498 -10.767
  786    HD2  HIS 102           HD2      HIS 102   0.980  -0.934  -9.968
  787    HE1  HIS 102           HE1      HIS 102   1.546   2.265 -12.669
  788    H    LEU 103           HN       LEU 103   4.896  -1.304  -6.718
  789    HA   LEU 103           HA       LEU 103   6.689   0.658  -5.697
  790   1HB   LEU 103          HB2       LEU 103   6.390  -2.273  -4.985
  791   2HB   LEU 103          HB1       LEU 103   7.397  -1.152  -4.076
  792    HG   LEU 103           HG       LEU 103   4.424  -0.794  -4.548
  793   1HD1  LEU 103          HD11      LEU 103   5.931  -1.734  -2.087
  794   2HD1  LEU 103          HD12      LEU 103   4.905  -2.740  -3.104
  795   3HD1  LEU 103          HD13      LEU 103   4.197  -1.430  -2.165
  796   1HD2  LEU 103          HD21      LEU 103   4.878   0.793  -2.478
  797   2HD2  LEU 103          HD22      LEU 103   5.210   1.366  -4.106
  798   3HD2  LEU 103          HD23      LEU 103   6.528   0.788  -3.091
  799    H    LYS 104           HN       LYS 104   7.468  -2.515  -7.175
  800    HA   LYS 104           HA       LYS 104  10.312  -2.084  -7.056
  801   1HB   LYS 104          HB2       LYS 104  10.473  -4.003  -8.570
  802   2HB   LYS 104          HB1       LYS 104   9.296  -4.330  -7.296
  803   1HG   LYS 104          HG2       LYS 104   7.525  -3.464  -8.923
  804   2HG   LYS 104          HG1       LYS 104   8.761  -3.576 -10.173
  805   1HD   LYS 104          HD2       LYS 104   7.687  -5.829  -8.453
  806   2HD   LYS 104          HD1       LYS 104   7.489  -5.636 -10.193
  807   1HE   LYS 104          HE2       LYS 104  10.111  -5.645 -10.234
  808   2HE   LYS 104          HE1       LYS 104   9.953  -6.399  -8.646
  809   1HZ   LYS 104          HZ1       LYS 104   8.269  -7.465 -10.767
  810   2HZ   LYS 104          HZ2       LYS 104   9.087  -8.273  -9.516
  811   3HZ   LYS 104          HZ3       LYS 104   9.931  -7.776 -10.905
  812    H    LYS 105           HN       LYS 105   7.860  -1.151  -9.387
  813    HA   LYS 105           HA       LYS 105   9.567  -0.683 -11.629
  814   1HB   LYS 105          HB2       LYS 105   7.060  -0.733 -11.674
  815   2HB   LYS 105          HB1       LYS 105   7.056   0.847 -10.894
  816   1HG   LYS 105          HG2       LYS 105   8.401   1.756 -12.782
  817   2HG   LYS 105          HG1       LYS 105   8.306   0.189 -13.579
  818   1HD   LYS 105          HD2       LYS 105   5.801   1.642 -12.720
  819   2HD   LYS 105          HD1       LYS 105   6.583   2.021 -14.252
  820   1HE   LYS 105          HE2       LYS 105   5.524  -0.691 -13.394
  821   2HE   LYS 105          HE1       LYS 105   4.857   0.353 -14.643
  822   1HZ   LYS 105          HZ1       LYS 105   7.098   0.180 -15.745
  823   2HZ   LYS 105          HZ2       LYS 105   6.152  -1.232 -15.756
  824   3HZ   LYS 105          HZ3       LYS 105   7.445  -1.080 -14.665
  825    H    LEU 106           HN       LEU 106   8.519   1.542  -9.029
  826    HA   LEU 106           HA       LEU 106   9.870   3.843 -10.036
  827   1HB   LEU 106          HB2       LEU 106   8.928   3.010  -7.295
  828   2HB   LEU 106          HB1       LEU 106   9.865   4.486  -7.488
  829    HG   LEU 106           HG       LEU 106   7.271   4.651  -7.535
  830   1HD1  LEU 106          HD11      LEU 106   8.390   6.623  -8.054
  831   2HD1  LEU 106          HD12      LEU 106   7.459   6.347  -9.523
  832   3HD1  LEU 106          HD13      LEU 106   9.173   5.941  -9.475
  833   1HD2  LEU 106          HD21      LEU 106   7.119   2.755  -9.273
  834   2HD2  LEU 106          HD22      LEU 106   7.628   3.952 -10.456
  835   3HD2  LEU 106          HD23      LEU 106   6.134   4.179  -9.556
  836    H    PHE 107           HN       PHE 107  11.057   1.095  -8.189
  837    HA   PHE 107           HA       PHE 107  13.471   2.246  -7.226
  838   1HB   PHE 107          HB2       PHE 107  12.690   0.016  -6.509
  839   2HB   PHE 107          HB1       PHE 107  13.015  -0.615  -8.123
  840    HD1  PHE 107           HD1      PHE 107  14.663   1.161  -5.276
  841    HD2  PHE 107           HD2      PHE 107  15.174  -1.424  -8.665
  842    HE1  PHE 107           HE1      PHE 107  17.034   0.823  -4.653
  843    HE2  PHE 107           HE2      PHE 107  17.552  -1.766  -8.040
  844    HZ   PHE 107           HZ       PHE 107  18.481  -0.640  -6.033
  845    H    ARG 108           HN       ARG 108  12.726   0.783 -10.377
  846    HA   ARG 108           HA       ARG 108  15.378   0.714 -11.388
  847   1HB   ARG 108          HB2       ARG 108  12.730   1.114 -12.800
  848   2HB   ARG 108          HB1       ARG 108  14.258   0.890 -13.650
  849   1HG   ARG 108          HG2       ARG 108  14.580  -1.268 -12.503
  850   2HG   ARG 108          HG1       ARG 108  13.043  -1.058 -11.667
  851   1HD   ARG 108          HD2       ARG 108  12.020  -0.798 -14.029
  852   2HD   ARG 108          HD1       ARG 108  13.527  -1.489 -14.621
  853    HE   ARG 108           HE       ARG 108  11.332  -2.935 -13.492
  854   1HH1  ARG 108          HH21      ARG 108  14.780  -2.780 -13.308
  855   2HH1  ARG 108          HH22      ARG 108  14.928  -4.331 -12.556
  856   1HH2  ARG 108          HH11      ARG 108  11.522  -4.948 -12.537
  857   2HH2  ARG 108          HH12      ARG 108  13.090  -5.559 -12.127
  858    H    GLU 109           HN       GLU 109  12.991   3.378 -11.396
  859    HA   GLU 109           HA       GLU 109  14.867   5.118 -12.854
  860   1HB   GLU 109          HB2       GLU 109  12.158   5.640 -11.604
  861   2HB   GLU 109          HB1       GLU 109  13.092   6.858 -12.473
  862   1HG   GLU 109          HG2       GLU 109  13.100   5.416 -14.481
  863   2HG   GLU 109          HG1       GLU 109  12.150   4.211 -13.612
  864    H    GLY 110           HN       GLY 110  14.438   4.213  -9.601
  865   1HA   GLY 110          HA2       GLY 110  15.550   4.994  -7.683
  866   2HA   GLY 110          HA1       GLY 110  16.449   6.095  -8.728
  867    H    ARG 111           HN       ARG 111  13.219   6.556  -9.366
  868    HA   ARG 111           HA       ARG 111  13.179   9.011  -7.683
  869   1HB   ARG 111          HB2       ARG 111  11.446   8.060  -9.985
  870   2HB   ARG 111          HB1       ARG 111  11.141   9.545  -9.082
  871   1HG   ARG 111          HG2       ARG 111  13.392  10.369  -9.675
  872   2HG   ARG 111          HG1       ARG 111  13.691   8.888 -10.584
  873   1HD   ARG 111          HD2       ARG 111  11.762   9.411 -12.050
  874   2HD   ARG 111          HD1       ARG 111  11.514  10.916 -11.164
  875    HE   ARG 111           HE       ARG 111  14.156  11.061 -11.976
  876   1HH1  ARG 111          HH21      ARG 111  11.105  10.482 -13.477
  877   2HH1  ARG 111          HH22      ARG 111  11.571  11.176 -14.994
  878   1HH2  ARG 111          HH11      ARG 111  14.779  11.971 -13.948
  879   2HH2  ARG 111          HH12      ARG 111  13.649  12.019 -15.260
  880    H    PHE 112           HN       PHE 112  12.424   8.569  -5.675
  881    HA   PHE 112           HA       PHE 112  10.249   6.571  -5.321
  882   1HB   PHE 112          HB2       PHE 112  11.933   8.017  -3.252
  883   2HB   PHE 112          HB1       PHE 112  10.904   6.601  -2.989
  884    HD1  PHE 112           HD1      PHE 112  11.457   4.435  -4.007
  885    HD2  PHE 112           HD2      PHE 112  14.074   7.812  -4.384
  886    HE1  PHE 112           HE1      PHE 112  13.272   2.946  -4.793
  887    HE2  PHE 112           HE2      PHE 112  15.892   6.315  -5.173
  888    HZ   PHE 112           HZ       PHE 112  15.489   3.880  -5.374
  889    H    ASN 113           HN       ASN 113   8.191   7.257  -5.109
  890    HA   ASN 113           HA       ASN 113   7.567   9.716  -3.646
  891   1HB   ASN 113          HB2       ASN 113   6.358  10.784  -5.496
  892   2HB   ASN 113          HB1       ASN 113   8.055  10.567  -5.923
  893   1HD2  ASN 113          HD21      ASN 113   7.118  10.702  -8.226
  894   2HD2  ASN 113          HD22      ASN 113   6.536   9.268  -8.923
  Start of MODEL    4
    1   1H    MET   1           HT1      MET   1  20.925   4.102  12.213
    2   2H    MET   1           HT2      MET   1  22.234   4.662  13.138
    3   3H    MET   1           HT3      MET   1  21.511   5.676  11.981
    4    HA   MET   1           HA       MET   1  19.803   4.613  14.099
    5   1HB   MET   1          HB2       MET   1  20.496   6.553  15.550
    6   2HB   MET   1          HB1       MET   1  21.726   5.299  15.395
    7   1HG   MET   1          HG2       MET   1  22.760   6.660  13.535
    8   2HG   MET   1          HG1       MET   1  21.625   7.951  13.932
    9   1HE   MET   1          HE1       MET   1  25.226   7.902  14.312
   10   2HE   MET   1          HE2       MET   1  24.876   9.365  15.229
   11   3HE   MET   1          HE3       MET   1  23.931   8.990  13.791
   12    H    GLY   2           HN       GLY   2  20.913   7.214  11.963
   13   1HA   GLY   2          HA2       GLY   2  18.570   8.869  12.327
   14   2HA   GLY   2          HA1       GLY   2  19.733   9.014  11.009
   15    HA   PRO   3           HA       PRO   3  15.391   7.255   9.732
   16   1HB   PRO   3          HB2       PRO   3  15.764   9.272   7.601
   17   2HB   PRO   3          HB1       PRO   3  14.370   9.000   8.654
   18   1HG   PRO   3          HG2       PRO   3  16.239  11.109   8.873
   19   2HG   PRO   3          HG1       PRO   3  15.023  10.659  10.075
   20   1HD   PRO   3          HD2       PRO   3  17.905  10.380  10.279
   21   2HD   PRO   3          HD1       PRO   3  16.676   9.947  11.493
   22    H    VAL   4           HN       VAL   4  15.091   5.922   7.833
   23    HA   VAL   4           HA       VAL   4  17.583   4.944   6.700
   24    HB   VAL   4           HB       VAL   4  15.965   3.387   5.452
   25   1HG1  VAL   4          HG11      VAL   4  15.973   3.569   8.480
   26   2HG1  VAL   4          HG12      VAL   4  17.086   2.644   7.471
   27   3HG1  VAL   4          HG13      VAL   4  15.392   2.166   7.583
   28   1HG2  VAL   4          HG21      VAL   4  13.978   4.584   7.401
   29   2HG2  VAL   4          HG22      VAL   4  13.663   3.395   6.138
   30   3HG2  VAL   4          HG23      VAL   4  14.050   5.059   5.706
   31    HA   PRO   5           HA       PRO   5  17.614   7.565   3.046
   32   1HB   PRO   5          HB2       PRO   5  18.370   5.294   1.342
   33   2HB   PRO   5          HB1       PRO   5  19.336   6.697   1.812
   34   1HG   PRO   5          HG2       PRO   5  19.609   4.035   2.782
   35   2HG   PRO   5          HG1       PRO   5  20.472   5.466   3.341
   36   1HD   PRO   5          HD2       PRO   5  18.449   3.966   4.758
   37   2HD   PRO   5          HD1       PRO   5  19.305   5.433   5.299
   38    HA   PRO   6           HA       PRO   6  13.792   6.792   0.892
   39   1HB   PRO   6          HB2       PRO   6  14.472   7.450  -1.749
   40   2HB   PRO   6          HB1       PRO   6  14.015   8.604  -0.490
   41   1HG   PRO   6          HG2       PRO   6  16.694   8.020  -1.615
   42   2HG   PRO   6          HG1       PRO   6  16.108   9.484  -0.813
   43   1HD   PRO   6          HD2       PRO   6  17.813   7.564   0.341
   44   2HD   PRO   6          HD1       PRO   6  16.889   8.793   1.239
   45    H    SER   7           HN       SER   7  16.471   5.659  -1.175
   46    HA   SER   7           HA       SER   7  15.003   3.617  -2.519
   47   1HB   SER   7          HB2       SER   7  17.180   2.795  -3.232
   48   2HB   SER   7          HB1       SER   7  17.197   4.556  -3.264
   49    HG   SER   7           HG       SER   7  19.012   3.989  -2.184
   50    H    THR   8           HN       THR   8  16.926   3.551   0.468
   51    HA   THR   8           HA       THR   8  16.798   0.690   0.811
   52    HB   THR   8           HB       THR   8  17.161   2.877   2.878
   53    HG1  THR   8           HG1      THR   8  18.713   2.749   1.152
   54   1HG2  THR   8          HG21      THR   8  17.618  -0.113   2.961
   55   2HG2  THR   8          HG22      THR   8  16.536   0.832   3.985
   56   3HG2  THR   8          HG23      THR   8  18.284   1.007   4.149
   57    H    ALA   9           HN       ALA   9  14.751   3.363   1.952
   58    HA   ALA   9           HA       ALA   9  13.057   1.821   3.640
   59   1HB   ALA   9          HB1       ALA   9  11.350   3.631   3.117
   60   2HB   ALA   9          HB2       ALA   9  12.529   4.309   1.994
   61   3HB   ALA   9          HB3       ALA   9  12.899   4.223   3.717
   62    H    LEU  10           HN       LEU  10  12.761   2.639   0.174
   63    HA   LEU  10           HA       LEU  10  10.333   1.223  -0.273
   64   1HB   LEU  10          HB2       LEU  10  11.279   2.829  -1.892
   65   2HB   LEU  10          HB1       LEU  10  12.629   1.734  -2.198
   66    HG   LEU  10           HG       LEU  10  11.014   0.013  -3.007
   67   1HD1  LEU  10          HD11      LEU  10   8.668   1.059  -3.575
   68   2HD1  LEU  10          HD12      LEU  10   9.046   2.173  -2.262
   69   3HD1  LEU  10          HD13      LEU  10   8.961   0.439  -1.953
   70   1HD2  LEU  10          HD21      LEU  10  11.955   1.261  -4.747
   71   2HD2  LEU  10          HD22      LEU  10  11.142   2.749  -4.274
   72   3HD2  LEU  10          HD23      LEU  10  10.234   1.452  -5.048
   73    H    ARG  11           HN       ARG  11  13.728   0.174  -0.674
   74    HA   ARG  11           HA       ARG  11  13.153  -2.476  -1.537
   75   1HB   ARG  11          HB2       ARG  11  15.499  -1.343   0.010
   76   2HB   ARG  11          HB1       ARG  11  15.455  -2.997  -0.601
   77   1HG   ARG  11          HG2       ARG  11  15.128  -2.134  -2.898
   78   2HG   ARG  11          HG1       ARG  11  15.189  -0.487  -2.282
   79   1HD   ARG  11          HD2       ARG  11  17.431  -2.495  -1.951
   80   2HD   ARG  11          HD1       ARG  11  17.375  -1.279  -3.228
   81    HE   ARG  11           HE       ARG  11  17.057   0.197  -0.910
   82   1HH1  ARG  11          HH21      ARG  11  19.277  -2.167  -2.077
   83   2HH1  ARG  11          HH22      ARG  11  20.631  -1.516  -1.215
   84   1HH2  ARG  11          HH11      ARG  11  18.813   1.051   0.240
   85   2HH2  ARG  11          HH12      ARG  11  20.366   0.297   0.104
   86    H    GLU  12           HN       GLU  12  13.671  -1.177   1.751
   87    HA   GLU  12           HA       GLU  12  13.283  -3.678   3.094
   88   1HB   GLU  12          HB2       GLU  12  12.878  -0.815   4.002
   89   2HB   GLU  12          HB1       GLU  12  12.698  -2.203   5.079
   90   1HG   GLU  12          HG2       GLU  12  15.012  -2.900   4.573
   91   2HG   GLU  12          HG1       GLU  12  15.198  -1.511   3.502
   92    H    LEU  13           HN       LEU  13  11.036  -1.166   2.000
   93    HA   LEU  13           HA       LEU  13   8.725  -2.316   3.281
   94   1HB   LEU  13          HB2       LEU  13   8.782   0.033   2.528
   95   2HB   LEU  13          HB1       LEU  13   8.921  -0.500   0.855
   96    HG   LEU  13           HG       LEU  13   6.715  -1.582   0.997
   97   1HD1  LEU  13          HD11      LEU  13   5.357  -0.869   3.142
   98   2HD1  LEU  13          HD12      LEU  13   6.955  -0.750   3.880
   99   3HD1  LEU  13          HD13      LEU  13   6.404  -2.283   3.204
  100   1HD2  LEU  13          HD21      LEU  13   6.772   0.754   0.285
  101   2HD2  LEU  13          HD22      LEU  13   6.763   1.294   1.964
  102   3HD2  LEU  13          HD23      LEU  13   5.346   0.491   1.289
  103    H    ILE  14           HN       ILE  14  10.073  -2.621  -0.016
  104    HA   ILE  14           HA       ILE  14   7.965  -4.277  -1.023
  105    HB   ILE  14           HB       ILE  14  10.875  -4.033  -1.834
  106   1HG1  ILE  14          HG12      ILE  14   8.351  -3.044  -3.195
  107   2HG1  ILE  14          HG11      ILE  14   9.314  -2.052  -2.099
  108   1HG2  ILE  14          HG21      ILE  14   9.981  -5.111  -3.993
  109   2HG2  ILE  14          HG22      ILE  14   8.597  -5.621  -3.028
  110   3HG2  ILE  14          HG23      ILE  14  10.216  -6.181  -2.613
  111   1HD1  ILE  14          HD11      ILE  14   9.922  -1.669  -4.480
  112   2HD1  ILE  14          HD12      ILE  14  10.364  -3.371  -4.620
  113   3HD1  ILE  14          HD13      ILE  14  11.277  -2.309  -3.549
  114    H    GLU  15           HN       GLU  15  11.086  -5.114   0.501
  115    HA   GLU  15           HA       GLU  15  10.872  -7.927   0.189
  116   1HB   GLU  15          HB2       GLU  15  12.224  -6.265   2.333
  117   2HB   GLU  15          HB1       GLU  15  12.396  -8.016   2.215
  118   1HG   GLU  15          HG2       GLU  15  13.284  -7.780  -0.077
  119   2HG   GLU  15          HG1       GLU  15  13.113  -6.028   0.039
  120    H    GLU  16           HN       GLU  16   9.637  -5.806   2.769
  121    HA   GLU  16           HA       GLU  16   8.650  -8.007   4.365
  122   1HB   GLU  16          HB2       GLU  16   9.128  -5.746   5.291
  123   2HB   GLU  16          HB1       GLU  16   7.758  -5.111   4.377
  124   1HG   GLU  16          HG2       GLU  16   6.218  -6.555   5.573
  125   2HG   GLU  16          HG1       GLU  16   7.552  -7.363   6.397
  126    H    LEU  17           HN       LEU  17   7.125  -5.825   1.978
  127    HA   LEU  17           HA       LEU  17   4.469  -6.828   2.311
  128   1HB   LEU  17          HB2       LEU  17   5.842  -5.607  -0.096
  129   2HB   LEU  17          HB1       LEU  17   4.122  -5.978  -0.049
  130    HG   LEU  17           HG       LEU  17   5.510  -4.188   1.969
  131   1HD1  LEU  17          HD11      LEU  17   5.650  -3.219  -0.289
  132   2HD1  LEU  17          HD12      LEU  17   4.507  -2.313   0.704
  133   3HD1  LEU  17          HD13      LEU  17   3.916  -3.453  -0.503
  134   1HD2  LEU  17          HD21      LEU  17   2.993  -3.395   2.117
  135   2HD2  LEU  17          HD22      LEU  17   3.492  -4.850   2.971
  136   3HD2  LEU  17          HD23      LEU  17   2.648  -4.982   1.430
  137    H    VAL  18           HN       VAL  18   7.077  -7.823   0.111
  138    HA   VAL  18           HA       VAL  18   5.557  -9.845  -1.236
  139    HB   VAL  18           HB       VAL  18   8.537  -9.501  -0.811
  140   1HG1  VAL  18          HG11      VAL  18   6.971 -11.514  -2.431
  141   2HG1  VAL  18          HG12      VAL  18   8.286 -11.806  -1.291
  142   3HG1  VAL  18          HG13      VAL  18   8.625 -11.069  -2.856
  143   1HG2  VAL  18          HG21      VAL  18   7.489  -7.726  -2.119
  144   2HG2  VAL  18          HG22      VAL  18   6.671  -8.916  -3.131
  145   3HG2  VAL  18          HG23      VAL  18   8.427  -8.762  -3.194
  146    H    ASN  19           HN       ASN  19   7.643  -9.938   1.632
  147    HA   ASN  19           HA       ASN  19   7.703 -12.744   2.007
  148   1HB   ASN  19          HB2       ASN  19   9.135 -11.184   3.252
  149   2HB   ASN  19          HB1       ASN  19   7.723 -10.552   4.099
  150   1HD2  ASN  19          HD21      ASN  19   8.337 -11.310   6.215
  151   2HD2  ASN  19          HD22      ASN  19   8.421 -12.962   6.600
  152    H    ILE  20           HN       ILE  20   5.310 -10.367   3.186
  153    HA   ILE  20           HA       ILE  20   3.841 -12.398   4.655
  154    HB   ILE  20           HB       ILE  20   2.201 -10.609   5.058
  155   1HG1  ILE  20          HG12      ILE  20   3.955  -8.917   3.246
  156   2HG1  ILE  20          HG11      ILE  20   2.385  -9.564   2.775
  157   1HG2  ILE  20          HG21      ILE  20   4.267 -10.737   6.410
  158   2HG2  ILE  20          HG22      ILE  20   3.735  -9.067   6.211
  159   3HG2  ILE  20          HG23      ILE  20   5.082  -9.685   5.253
  160   1HD1  ILE  20          HD11      ILE  20   2.043  -7.299   3.552
  161   2HD1  ILE  20          HD12      ILE  20   2.941  -7.625   5.035
  162   3HD1  ILE  20          HD13      ILE  20   1.379  -8.397   4.761
  163    H    THR  21           HN       THR  21   3.804 -11.404   1.334
  164    HA   THR  21           HA       THR  21   1.066 -12.555   0.954
  165    HB   THR  21           HB       THR  21   1.217 -11.589  -1.327
  166    HG1  THR  21           HG1      THR  21   3.273 -11.464  -1.861
  167   1HG2  THR  21          HG21      THR  21   0.696  -9.435  -0.646
  168   2HG2  THR  21          HG22      THR  21   2.037  -9.357   0.491
  169   3HG2  THR  21          HG23      THR  21   0.585 -10.267   0.905
  170    H    GLN  22           HN       GLN  22   4.339 -13.501   0.660
  171    HA   GLN  22           HA       GLN  22   3.846 -15.343  -1.593
  172   1HB   GLN  22          HB2       GLN  22   6.243 -14.801   0.162
  173   2HB   GLN  22          HB1       GLN  22   6.223 -16.085  -1.046
  174   1HG   GLN  22          HG2       GLN  22   5.484 -13.244  -1.764
  175   2HG   GLN  22          HG1       GLN  22   7.161 -13.788  -1.772
  176   1HE2  GLN  22          HE21      GLN  22   7.479 -15.959  -3.094
  177   2HE2  GLN  22          HE22      GLN  22   6.610 -16.068  -4.548
  178    H    ASN  23           HN       ASN  23   4.562 -15.637   1.892
  179    HA   ASN  23           HA       ASN  23   3.912 -18.545   1.750
  180   1HB   ASN  23          HB2       ASN  23   5.041 -18.762   3.843
  181   2HB   ASN  23          HB1       ASN  23   6.036 -17.704   2.846
  182   1HD2  ASN  23          HD21      ASN  23   6.307 -17.567   5.644
  183   2HD2  ASN  23          HD22      ASN  23   5.664 -16.099   6.202
  184    H    GLN  24           HN       GLN  24   1.825 -16.367   1.715
  185    HA   GLN  24           HA       GLN  24   0.551 -16.520   4.342
  186   1HB   GLN  24          HB2       GLN  24  -1.059 -15.031   3.481
  187   2HB   GLN  24          HB1       GLN  24   0.417 -14.579   2.637
  188   1HG   GLN  24          HG2       GLN  24  -1.879 -16.240   1.557
  189   2HG   GLN  24          HG1       GLN  24  -1.326 -14.667   0.986
  190   1HE2  GLN  24          HE21      GLN  24  -1.407 -17.492  -0.347
  191   2HE2  GLN  24          HE22      GLN  24   0.162 -17.673  -0.969
  192    H    LYS  25           HN       LYS  25  -0.924 -18.002   4.993
  193    HA   LYS  25           HA       LYS  25  -1.644 -20.192   3.141
  194   1HB   LYS  25          HB2       LYS  25  -0.856 -20.700   5.434
  195   2HB   LYS  25          HB1       LYS  25  -2.226 -19.812   6.093
  196   1HG   LYS  25          HG2       LYS  25  -3.779 -21.382   4.993
  197   2HG   LYS  25          HG1       LYS  25  -2.407 -22.274   4.332
  198   1HD   LYS  25          HD2       LYS  25  -1.602 -22.726   6.625
  199   2HD   LYS  25          HD1       LYS  25  -2.986 -21.854   7.280
  200   1HE   LYS  25          HE2       LYS  25  -4.523 -23.461   6.295
  201   2HE   LYS  25          HE1       LYS  25  -3.189 -24.293   5.494
  202   1HZ   LYS  25          HZ1       LYS  25  -2.912 -25.494   7.320
  203   2HZ   LYS  25          HZ2       LYS  25  -4.157 -24.648   8.108
  204   3HZ   LYS  25          HZ3       LYS  25  -2.556 -24.087   8.199
  205    H    ALA  26           HN       ALA  26  -3.683 -18.743   5.670
  206    HA   ALA  26           HA       ALA  26  -6.011 -18.930   3.926
  207   1HB   ALA  26          HB1       ALA  26  -5.445 -18.319   6.768
  208   2HB   ALA  26          HB2       ALA  26  -6.806 -19.194   6.072
  209   3HB   ALA  26          HB3       ALA  26  -6.821 -17.431   6.118
  210    HA   PRO  27           HA       PRO  27  -6.042 -14.981   1.955
  211   1HB   PRO  27          HB2       PRO  27  -8.490 -14.098   3.354
  212   2HB   PRO  27          HB1       PRO  27  -8.234 -14.398   1.631
  213   1HG   PRO  27          HG2       PRO  27  -9.635 -16.071   3.447
  214   2HG   PRO  27          HG1       PRO  27  -9.181 -16.468   1.786
  215   1HD   PRO  27          HD2       PRO  27  -8.123 -17.618   4.216
  216   2HD   PRO  27          HD1       PRO  27  -7.631 -17.978   2.543
  217    H    LEU  28           HN       LEU  28  -5.667 -12.677   2.415
  218    HA   LEU  28           HA       LEU  28  -4.181 -12.216   4.810
  219   1HB   LEU  28          HB2       LEU  28  -5.398 -10.230   2.868
  220   2HB   LEU  28          HB1       LEU  28  -4.187  -9.832   4.085
  221    HG   LEU  28           HG       LEU  28  -3.796 -11.891   1.889
  222   1HD1  LEU  28          HD11      LEU  28  -2.259 -10.131   0.935
  223   2HD1  LEU  28          HD12      LEU  28  -2.937  -8.996   2.103
  224   3HD1  LEU  28          HD13      LEU  28  -3.972  -9.715   0.870
  225   1HD2  LEU  28          HD21      LEU  28  -2.075 -10.817   4.124
  226   2HD2  LEU  28          HD22      LEU  28  -1.310 -11.330   2.621
  227   3HD2  LEU  28          HD23      LEU  28  -2.259 -12.477   3.561
  228    H    CYS  29           HN       CYS  29  -7.522 -11.478   3.920
  229    HA   CYS  29           HA       CYS  29  -8.132 -11.051   6.800
  230   1HB   CYS  29          HB2       CYS  29  -8.735  -9.081   4.577
  231   2HB   CYS  29          HB1       CYS  29  -9.535  -9.046   6.149
  232    H    ASN  30           HN       ASN  30 -10.663 -10.793   6.963
  233    HA   ASN  30           HA       ASN  30 -11.814 -13.157   5.809
  234   1HB   ASN  30          HB2       ASN  30 -12.496 -12.067   7.987
  235   2HB   ASN  30          HB1       ASN  30 -13.311 -10.827   7.033
  236   1HD2  ASN  30          HD21      ASN  30 -15.314 -11.774   8.181
  237   2HD2  ASN  30          HD22      ASN  30 -16.055 -13.126   7.473
  238    H    GLY  31           HN       GLY  31 -10.938 -11.982   3.578
  239   1HA   GLY  31          HA2       GLY  31 -11.711 -11.448   1.426
  240   2HA   GLY  31          HA1       GLY  31 -13.355 -11.595   2.047
  241    H    SER  32           HN       SER  32 -11.027  -9.404   3.513
  242    HA   SER  32           HA       SER  32 -12.781  -7.162   3.347
  243   1HB   SER  32          HB2       SER  32  -9.761  -7.195   3.625
  244   2HB   SER  32          HB1       SER  32 -10.804  -5.818   3.972
  245    HG   SER  32           HG       SER  32 -10.993  -6.677   5.873
  246    H    MET  33           HN       MET  33 -12.787  -5.385   1.886
  247    HA   MET  33           HA       MET  33 -11.221  -5.770  -0.654
  248   1HB   MET  33          HB2       MET  33 -14.107  -4.868  -0.380
  249   2HB   MET  33          HB1       MET  33 -13.205  -5.003  -1.889
  250   1HG   MET  33          HG2       MET  33 -12.905  -7.423  -1.499
  251   2HG   MET  33          HG1       MET  33 -13.810  -7.288   0.006
  252   1HE   MET  33          HE1       MET  33 -14.789  -5.429  -3.590
  253   2HE   MET  33          HE2       MET  33 -15.187  -6.992  -4.295
  254   3HE   MET  33          HE3       MET  33 -13.591  -6.729  -3.604
  255    H    VAL  34           HN       VAL  34 -10.682  -3.789  -1.743
  256    HA   VAL  34           HA       VAL  34 -11.058  -1.283  -0.131
  257    HB   VAL  34           HB       VAL  34  -8.713  -0.677  -0.955
  258   1HG1  VAL  34          HG11      VAL  34  -9.016  -1.212   1.353
  259   2HG1  VAL  34          HG12      VAL  34  -7.633  -2.163   0.812
  260   3HG1  VAL  34          HG13      VAL  34  -9.211  -2.929   1.003
  261   1HG2  VAL  34          HG21      VAL  34  -8.568  -3.679  -1.377
  262   2HG2  VAL  34          HG22      VAL  34  -7.266  -2.513  -1.615
  263   3HG2  VAL  34          HG23      VAL  34  -8.666  -2.500  -2.686
  264    H    TRP  35           HN       TRP  35 -10.778   0.697  -1.457
  265    HA   TRP  35           HA       TRP  35 -12.200   0.480  -3.980
  266   1HB   TRP  35          HB2       TRP  35 -10.785   2.786  -2.619
  267   2HB   TRP  35          HB1       TRP  35 -11.678   2.950  -4.129
  268    HD1  TRP  35           HD1      TRP  35 -12.126   2.485  -0.406
  269    HE1  TRP  35           HE1      TRP  35 -14.619   2.769   0.190
  270    HE3  TRP  35           HE3      TRP  35 -14.137   2.620  -5.091
  271    HZ2  TRP  35           HZ2      TRP  35 -17.137   3.022  -1.151
  272    HZ3  TRP  35           HZ3      TRP  35 -16.580   2.883  -5.406
  273    HH2  TRP  35           HH2      TRP  35 -18.082   3.084  -3.446
  274    H    SER  36           HN       SER  36 -11.312   0.334  -6.024
  275    HA   SER  36           HA       SER  36  -8.460  -0.082  -6.319
  276   1HB   SER  36          HB2       SER  36 -10.105  -1.153  -7.834
  277   2HB   SER  36          HB1       SER  36 -10.583   0.435  -8.429
  278    HG   SER  36           HG       SER  36  -8.710  -1.045  -9.391
  279    H    ILE  37           HN       ILE  37  -6.920   1.379  -7.134
  280    HA   ILE  37           HA       ILE  37  -7.846   4.200  -7.598
  281    HB   ILE  37           HB       ILE  37  -5.814   4.975  -6.412
  282   1HG1  ILE  37          HG12      ILE  37  -5.470   2.125  -5.446
  283   2HG1  ILE  37          HG11      ILE  37  -4.565   2.746  -6.821
  284   1HG2  ILE  37          HG21      ILE  37  -6.589   4.410  -4.129
  285   2HG2  ILE  37          HG22      ILE  37  -7.577   3.109  -4.793
  286   3HG2  ILE  37          HG23      ILE  37  -7.943   4.786  -5.194
  287   1HD1  ILE  37          HD11      ILE  37  -3.281   2.981  -4.723
  288   2HD1  ILE  37          HD12      ILE  37  -4.575   3.975  -4.053
  289   3HD1  ILE  37          HD13      ILE  37  -3.649   4.551  -5.439
  290    H    ASN  38           HN       ASN  38  -6.091   5.499  -8.737
  291    HA   ASN  38           HA       ASN  38  -5.045   3.866 -10.972
  292   1HB   ASN  38          HB2       ASN  38  -5.112   6.858 -10.458
  293   2HB   ASN  38          HB1       ASN  38  -4.375   6.128 -11.885
  294   1HD2  ASN  38          HD21      ASN  38  -6.679   7.894 -12.048
  295   2HD2  ASN  38          HD22      ASN  38  -7.988   6.975 -12.619
  296    H    LEU  39           HN       LEU  39  -2.969   3.142 -10.953
  297    HA   LEU  39           HA       LEU  39  -1.184   3.923  -8.775
  298   1HB   LEU  39          HB2       LEU  39  -0.865   2.067 -11.149
  299   2HB   LEU  39          HB1       LEU  39   0.395   2.323  -9.948
  300    HG   LEU  39           HG       LEU  39  -0.956   0.294  -9.472
  301   1HD1  LEU  39          HD11      LEU  39   0.010   1.965  -7.657
  302   2HD1  LEU  39          HD12      LEU  39  -0.998   0.604  -7.181
  303   3HD1  LEU  39          HD13      LEU  39  -1.697   2.218  -7.289
  304   1HD2  LEU  39          HD21      LEU  39  -3.263   0.337  -9.054
  305   2HD2  LEU  39          HD22      LEU  39  -3.102   1.438 -10.419
  306   3HD2  LEU  39          HD23      LEU  39  -3.289   2.078  -8.785
  307    H    THR  40           HN       THR  40  -0.128   5.854  -8.935
  308    HA   THR  40           HA       THR  40   1.335   6.460 -11.457
  309    HB   THR  40           HB       THR  40   0.582   8.873 -11.251
  310    HG1  THR  40           HG1      THR  40  -1.674   8.043  -9.901
  311   1HG2  THR  40          HG21      THR  40  -1.532   8.495 -12.397
  312   2HG2  THR  40          HG22      THR  40  -1.633   6.864 -11.736
  313   3HG2  THR  40          HG23      THR  40  -0.376   7.263 -12.906
  314    H    ALA  41           HN       ALA  41   1.294   9.202  -9.631
  315    HA   ALA  41           HA       ALA  41   3.965   8.603  -8.525
  316   1HB   ALA  41          HB1       ALA  41   2.411  11.203  -8.480
  317   2HB   ALA  41          HB2       ALA  41   3.467  10.703  -9.801
  318   3HB   ALA  41          HB3       ALA  41   4.140  10.994  -8.197
  319    H    GLY  42           HN       GLY  42   1.388  10.593  -7.075
  320   1HA   GLY  42          HA2       GLY  42   2.188   9.997  -4.397
  321   2HA   GLY  42          HA1       GLY  42   0.659  10.742  -4.851
  322    H    MET  43           HN       MET  43   1.935   7.505  -5.635
  323    HA   MET  43           HA       MET  43  -0.571   6.195  -5.188
  324   1HB   MET  43          HB2       MET  43   2.256   5.118  -5.212
  325   2HB   MET  43          HB1       MET  43   0.815   4.104  -5.180
  326   1HG   MET  43          HG2       MET  43   0.035   5.172  -7.270
  327   2HG   MET  43          HG1       MET  43   1.513   6.125  -7.325
  328   1HE   MET  43          HE1       MET  43   3.737   3.636  -6.265
  329   2HE   MET  43          HE2       MET  43   3.710   5.218  -7.041
  330   3HE   MET  43          HE3       MET  43   4.327   3.823  -7.922
  331    H    TYR  44           HN       TYR  44   2.267   6.681  -3.112
  332    HA   TYR  44           HA       TYR  44   1.550   4.971  -0.989
  333   1HB   TYR  44          HB2       TYR  44   2.972   7.650  -0.906
  334   2HB   TYR  44          HB1       TYR  44   2.906   6.516   0.441
  335    HD1  TYR  44           HD1      TYR  44   4.184   4.441   0.416
  336    HD2  TYR  44           HD2      TYR  44   4.198   7.092  -2.967
  337    HE1  TYR  44           HE1      TYR  44   6.102   3.197  -0.557
  338    HE2  TYR  44           HE2      TYR  44   6.113   5.853  -3.932
  339    HH   TYR  44           HH       TYR  44   7.538   4.194  -3.672
  340    H    CYS  45           HN       CYS  45   0.733   8.439  -1.399
  341    HA   CYS  45           HA       CYS  45  -0.903   8.535   0.972
  342   1HB   CYS  45          HB2       CYS  45  -0.870  10.277  -1.508
  343   2HB   CYS  45          HB1       CYS  45  -1.818  10.634  -0.067
  344    H    ALA  46           HN       ALA  46  -1.716   8.182  -2.495
  345    HA   ALA  46           HA       ALA  46  -4.533   7.960  -2.138
  346   1HB   ALA  46          HB1       ALA  46  -2.689   6.842  -4.264
  347   2HB   ALA  46          HB2       ALA  46  -3.666   8.308  -4.354
  348   3HB   ALA  46          HB3       ALA  46  -4.447   6.727  -4.354
  349    H    ALA  47           HN       ALA  47  -2.035   5.417  -2.330
  350    HA   ALA  47           HA       ALA  47  -3.835   3.230  -1.945
  351   1HB   ALA  47          HB1       ALA  47  -1.740   2.033  -1.116
  352   2HB   ALA  47          HB2       ALA  47  -0.883   3.555  -1.357
  353   3HB   ALA  47          HB3       ALA  47  -1.622   2.734  -2.731
  354    H    LEU  48           HN       LEU  48  -2.124   5.348   0.311
  355    HA   LEU  48           HA       LEU  48  -2.624   3.890   2.691
  356   1HB   LEU  48          HB2       LEU  48  -1.058   5.776   2.579
  357   2HB   LEU  48          HB1       LEU  48  -2.395   6.889   2.303
  358    HG   LEU  48           HG       LEU  48  -3.335   6.312   4.516
  359   1HD1  LEU  48          HD11      LEU  48  -1.584   5.021   6.028
  360   2HD1  LEU  48          HD12      LEU  48  -1.044   4.356   4.485
  361   3HD1  LEU  48          HD13      LEU  48  -2.709   4.120   5.014
  362   1HD2  LEU  48          HD21      LEU  48  -0.390   7.053   4.626
  363   2HD2  LEU  48          HD22      LEU  48  -1.596   7.418   5.860
  364   3HD2  LEU  48          HD23      LEU  48  -1.704   8.175   4.271
  365    H    GLU  49           HN       GLU  49  -4.613   6.547   1.257
  366    HA   GLU  49           HA       GLU  49  -6.623   6.459   3.272
  367   1HB   GLU  49          HB2       GLU  49  -8.167   7.374   1.434
  368   2HB   GLU  49          HB1       GLU  49  -6.729   8.321   1.808
  369   1HG   GLU  49          HG2       GLU  49  -5.560   7.366  -0.111
  370   2HG   GLU  49          HG1       GLU  49  -6.952   6.337  -0.467
  371    H    SER  50           HN       SER  50  -6.289   4.566   0.282
  372    HA   SER  50           HA       SER  50  -8.820   3.258   0.419
  373   1HB   SER  50          HB2       SER  50  -6.149   2.327  -0.673
  374   2HB   SER  50          HB1       SER  50  -7.639   1.408  -0.864
  375    HG   SER  50           HG       SER  50  -8.337   3.741  -1.599
  376    H    LEU  51           HN       LEU  51  -5.706   2.511   1.944
  377    HA   LEU  51           HA       LEU  51  -6.570   0.036   3.149
  378   1HB   LEU  51          HB2       LEU  51  -4.325   1.951   3.830
  379   2HB   LEU  51          HB1       LEU  51  -4.544   0.389   4.615
  380    HG   LEU  51           HG       LEU  51  -4.274   0.736   1.612
  381   1HD1  LEU  51          HD11      LEU  51  -2.236   1.456   2.918
  382   2HD1  LEU  51          HD12      LEU  51  -1.962   0.098   1.827
  383   3HD1  LEU  51          HD13      LEU  51  -2.143  -0.185   3.557
  384   1HD2  LEU  51          HD21      LEU  51  -5.238  -1.371   1.895
  385   2HD2  LEU  51          HD22      LEU  51  -4.507  -1.619   3.479
  386   3HD2  LEU  51          HD23      LEU  51  -3.534  -1.792   2.021
  387    H    ILE  52           HN       ILE  52  -6.516   3.411   4.283
  388    HA   ILE  52           HA       ILE  52  -7.166   3.003   6.988
  389    HB   ILE  52           HB       ILE  52  -8.045   5.190   5.081
  390   1HG1  ILE  52          HG12      ILE  52  -5.622   5.058   5.462
  391   2HG1  ILE  52          HG11      ILE  52  -6.278   6.500   6.217
  392   1HG2  ILE  52          HG21      ILE  52  -9.641   5.248   6.851
  393   2HG2  ILE  52          HG22      ILE  52  -8.462   6.508   7.212
  394   3HG2  ILE  52          HG23      ILE  52  -8.402   4.969   8.073
  395   1HD1  ILE  52          HD11      ILE  52  -6.450   4.808   8.322
  396   2HD1  ILE  52          HD12      ILE  52  -5.000   5.744   7.976
  397   3HD1  ILE  52          HD13      ILE  52  -5.104   4.062   7.465
  398    H    ASN  53           HN       ASN  53  -9.040   2.220   4.234
  399    HA   ASN  53           HA       ASN  53 -11.618   2.344   5.661
  400   1HB   ASN  53          HB2       ASN  53 -10.772   1.403   2.913
  401   2HB   ASN  53          HB1       ASN  53 -12.401   1.122   3.527
  402   1HD2  ASN  53          HD21      ASN  53 -11.474   2.969   1.294
  403   2HD2  ASN  53          HD22      ASN  53 -12.057   4.502   1.733
  404    H    VAL  54           HN       VAL  54  -9.010   0.146   5.317
  405    HA   VAL  54           HA       VAL  54 -10.682  -2.226   5.942
  406    HB   VAL  54           HB       VAL  54  -7.665  -2.057   5.723
  407   1HG1  VAL  54          HG11      VAL  54  -8.396  -4.106   6.742
  408   2HG1  VAL  54          HG12      VAL  54  -8.012  -4.482   5.063
  409   3HG1  VAL  54          HG13      VAL  54  -9.693  -4.301   5.563
  410   1HG2  VAL  54          HG21      VAL  54  -7.996  -2.794   3.369
  411   2HG2  VAL  54          HG22      VAL  54  -8.663  -1.188   3.662
  412   3HG2  VAL  54          HG23      VAL  54  -9.736  -2.585   3.569
  413    H    SER  55           HN       SER  55 -11.121  -2.681   8.043
  414    HA   SER  55           HA       SER  55  -9.141  -1.865  10.149
  415   1HB   SER  55          HB2       SER  55 -12.159  -1.637  10.178
  416   2HB   SER  55          HB1       SER  55 -11.166  -1.506  11.627
  417    HG   SER  55           HG       SER  55 -10.679   0.035   9.304
  418    H    GLY  56           HN       GLY  56  -8.958  -3.305  11.907
  419   1HA   GLY  56          HA2       GLY  56  -9.535  -5.289  13.158
  420   2HA   GLY  56          HA1       GLY  56 -10.540  -5.824  11.812
  421    H    CYS  57           HN       CYS  57  -8.015  -4.878  10.130
  422    HA   CYS  57           HA       CYS  57  -6.727  -7.566  10.221
  423   1HB   CYS  57          HB2       CYS  57  -6.651  -5.329   8.176
  424   2HB   CYS  57          HB1       CYS  57  -5.699  -6.809   8.051
  425    H    SER  58           HN       SER  58  -5.227  -7.444  11.882
  426    HA   SER  58           HA       SER  58  -3.600  -5.125  12.399
  427   1HB   SER  58          HB2       SER  58  -4.000  -6.727  14.168
  428   2HB   SER  58          HB1       SER  58  -3.282  -8.023  13.214
  429    HG   SER  58           HG       SER  58  -1.451  -7.412  14.027
  430    H    ALA  59           HN       ALA  59  -3.087  -8.111  10.587
  431    HA   ALA  59           HA       ALA  59  -0.372  -8.033  10.072
  432   1HB   ALA  59          HB1       ALA  59  -0.918  -9.068   7.857
  433   2HB   ALA  59          HB2       ALA  59  -2.616  -8.699   8.157
  434   3HB   ALA  59          HB3       ALA  59  -1.756  -9.817   9.216
  435    H    ILE  60           HN       ILE  60  -2.800  -5.841   8.678
  436    HA   ILE  60           HA       ILE  60  -0.704  -4.683   6.890
  437    HB   ILE  60           HB       ILE  60  -2.557  -3.476   5.826
  438   1HG1  ILE  60          HG12      ILE  60  -4.353  -4.935   7.791
  439   2HG1  ILE  60          HG11      ILE  60  -3.949  -3.227   7.916
  440   1HG2  ILE  60          HG21      ILE  60  -3.133  -6.420   6.272
  441   2HG2  ILE  60          HG22      ILE  60  -2.015  -5.759   5.079
  442   3HG2  ILE  60          HG23      ILE  60  -3.744  -5.450   4.933
  443   1HD1  ILE  60          HD11      ILE  60  -6.093  -3.480   6.771
  444   2HD1  ILE  60          HD12      ILE  60  -5.352  -4.554   5.583
  445   3HD1  ILE  60          HD13      ILE  60  -4.884  -2.854   5.650
  446    H    GLU  61           HN       GLU  61  -1.993  -4.083   9.986
  447    HA   GLU  61           HA       GLU  61  -2.156  -1.236   9.971
  448   1HB   GLU  61          HB2       GLU  61  -1.438  -3.209  12.151
  449   2HB   GLU  61          HB1       GLU  61  -1.513  -1.472  12.451
  450   1HG   GLU  61          HG2       GLU  61  -3.837  -1.404  11.724
  451   2HG   GLU  61          HG1       GLU  61  -3.784  -3.111  11.295
  452    H    LYS  62           HN       LYS  62   0.626  -3.396  10.476
  453    HA   LYS  62           HA       LYS  62   2.536  -1.339  11.022
  454   1HB   LYS  62          HB2       LYS  62   2.822  -4.085   9.768
  455   2HB   LYS  62          HB1       LYS  62   4.197  -3.057  10.176
  456   1HG   LYS  62          HG2       LYS  62   3.454  -2.995  12.531
  457   2HG   LYS  62          HG1       LYS  62   2.085  -4.029  12.123
  458   1HD   LYS  62          HD2       LYS  62   3.583  -5.836  11.470
  459   2HD   LYS  62          HD1       LYS  62   4.991  -4.806  11.730
  460   1HE   LYS  62          HE2       LYS  62   4.657  -6.285  13.662
  461   2HE   LYS  62          HE1       LYS  62   4.381  -4.607  14.127
  462   1HZ   LYS  62          HZ1       LYS  62   2.200  -4.958  14.447
  463   2HZ   LYS  62          HZ2       LYS  62   2.678  -6.575  14.652
  464   3HZ   LYS  62          HZ3       LYS  62   2.058  -6.053  13.159
  465    H    THR  63           HN       THR  63   1.355  -2.798   8.021
  466    HA   THR  63           HA       THR  63   3.153  -1.552   6.228
  467    HB   THR  63           HB       THR  63   0.256  -2.299   5.784
  468    HG1  THR  63           HG1      THR  63   1.244  -4.215   4.959
  469   1HG2  THR  63          HG21      THR  63   0.962  -2.475   3.405
  470   2HG2  THR  63          HG22      THR  63   2.540  -1.828   3.850
  471   3HG2  THR  63          HG23      THR  63   1.098  -0.829   4.018
  472    H    GLN  64           HN       GLN  64   0.076  -0.408   7.575
  473    HA   GLN  64           HA       GLN  64  -0.177   1.952   6.005
  474   1HB   GLN  64          HB2       GLN  64  -1.061   1.326   8.830
  475   2HB   GLN  64          HB1       GLN  64  -1.521   2.797   7.973
  476   1HG   GLN  64          HG2       GLN  64  -2.553   1.461   6.190
  477   2HG   GLN  64          HG1       GLN  64  -2.062  -0.024   7.006
  478   1HE2  GLN  64          HE21      GLN  64  -4.842   1.143   6.449
  479   2HE2  GLN  64          HE22      GLN  64  -5.601   1.162   7.967
  480    H    ARG  65           HN       ARG  65   1.555   1.378   9.060
  481    HA   ARG  65           HA       ARG  65   2.310   4.092   9.527
  482   1HB   ARG  65          HB2       ARG  65   3.609   1.474  10.311
  483   2HB   ARG  65          HB1       ARG  65   4.189   3.042  10.873
  484   1HG   ARG  65          HG2       ARG  65   2.029   3.514  11.905
  485   2HG   ARG  65          HG1       ARG  65   1.360   2.017  11.259
  486   1HD   ARG  65          HD2       ARG  65   2.930   0.701  12.592
  487   2HD   ARG  65          HD1       ARG  65   3.694   2.176  13.188
  488    HE   ARG  65           HE       ARG  65   1.035   2.489  13.896
  489   1HH1  ARG  65          HH21      ARG  65   3.470   0.095  14.296
  490   2HH1  ARG  65          HH22      ARG  65   2.846  -0.490  15.803
  491   1HH2  ARG  65          HH11      ARG  65   0.199   1.748  15.879
  492   2HH2  ARG  65          HH12      ARG  65   0.994   0.444  16.697
  493    H    MET  66           HN       MET  66   3.965   1.479   7.741
  494    HA   MET  66           HA       MET  66   6.309   3.004   7.135
  495   1HB   MET  66          HB2       MET  66   5.029   0.694   5.646
  496   2HB   MET  66          HB1       MET  66   6.643   1.324   5.312
  497   1HG   MET  66          HG2       MET  66   7.159   0.918   7.788
  498   2HG   MET  66          HG1       MET  66   5.657  -0.002   7.848
  499   1HE   MET  66          HE1       MET  66   5.274  -1.611   5.388
  500   2HE   MET  66          HE2       MET  66   5.248  -2.204   7.044
  501   3HE   MET  66          HE3       MET  66   6.153  -3.082   5.812
  502    H    LEU  67           HN       LEU  67   3.219   2.605   5.440
  503    HA   LEU  67           HA       LEU  67   3.900   4.055   3.078
  504   1HB   LEU  67          HB2       LEU  67   1.263   3.688   4.509
  505   2HB   LEU  67          HB1       LEU  67   1.401   4.461   2.936
  506    HG   LEU  67           HG       LEU  67   2.413   1.661   3.530
  507   1HD1  LEU  67          HD11      LEU  67   0.347   1.058   2.063
  508   2HD1  LEU  67          HD12      LEU  67  -0.255   2.649   2.528
  509   3HD1  LEU  67          HD13      LEU  67   0.083   1.438   3.762
  510   1HD2  LEU  67          HD21      LEU  67   2.094   1.637   0.901
  511   2HD2  LEU  67          HD22      LEU  67   3.542   2.352   1.596
  512   3HD2  LEU  67          HD23      LEU  67   2.218   3.388   1.064
  513    H    SER  68           HN       SER  68   2.699   5.118   6.235
  514    HA   SER  68           HA       SER  68   2.174   7.827   5.597
  515   1HB   SER  68          HB2       SER  68   3.270   6.661   8.172
  516   2HB   SER  68          HB1       SER  68   2.569   8.269   8.007
  517    HG   SER  68           HG       SER  68   1.053   6.702   8.736
  518    H    GLY  69           HN       GLY  69   5.214   6.206   6.462
  519   1HA   GLY  69          HA2       GLY  69   6.893   8.428   6.783
  520   2HA   GLY  69          HA1       GLY  69   7.427   6.911   6.057
  521    H    PHE  70           HN       PHE  70   5.474   7.136   3.839
  522    HA   PHE  70           HA       PHE  70   7.036   9.011   2.140
  523   1HB   PHE  70          HB2       PHE  70   4.943   6.915   1.485
  524   2HB   PHE  70          HB1       PHE  70   5.760   7.910   0.281
  525    HD1  PHE  70           HD1      PHE  70   8.167   7.626  -0.161
  526    HD2  PHE  70           HD2      PHE  70   6.096   5.135   2.654
  527    HE1  PHE  70           HE1      PHE  70  10.069   6.032  -0.178
  528    HE2  PHE  70           HE2      PHE  70   8.000   3.546   2.649
  529    HZ   PHE  70           HZ       PHE  70   9.985   3.992   1.231
  530    H    CYS  71           HN       CYS  71   4.169   8.863   3.912
  531    HA   CYS  71           HA       CYS  71   3.093  11.285   2.520
  532   1HB   CYS  71          HB2       CYS  71   1.603   8.806   3.413
  533   2HB   CYS  71          HB1       CYS  71   0.792  10.347   3.134
  534    HA   PRO  72           HA       PRO  72   4.032  11.809   7.111
  535   1HB   PRO  72          HB2       PRO  72   4.220  14.620   6.160
  536   2HB   PRO  72          HB1       PRO  72   5.345  13.693   7.164
  537   1HG   PRO  72          HG2       PRO  72   5.827  14.298   4.533
  538   2HG   PRO  72          HG1       PRO  72   6.501  12.878   5.345
  539   1HD   PRO  72          HD2       PRO  72   4.368  13.011   3.290
  540   2HD   PRO  72          HD1       PRO  72   5.383  11.625   3.766
  541    H    HIS  73           HN       HIS  73   1.466  12.622   5.083
  542    HA   HIS  73           HA       HIS  73   0.041  14.170   7.209
  543   1HB   HIS  73          HB2       HIS  73  -1.552  14.775   5.535
  544   2HB   HIS  73          HB1       HIS  73   0.035  14.963   4.797
  545    HD1  HIS  73           HD1      HIS  73  -3.135  13.050   4.521
  546    HD2  HIS  73           HD2      HIS  73   0.699  12.864   2.892
  547    HE1  HIS  73           HE1      HIS  73  -3.278  11.501   2.523
  548    H    LYS  74           HN       LYS  74  -1.175  13.017   8.593
  549    HA   LYS  74           HA       LYS  74  -1.836  10.224   8.099
  550   1HB   LYS  74          HB2       LYS  74  -2.605  12.170  10.289
  551   2HB   LYS  74          HB1       LYS  74  -3.090  10.474  10.288
  552   1HG   LYS  74          HG2       LYS  74  -0.709   9.802  10.199
  553   2HG   LYS  74          HG1       LYS  74  -0.235  11.501  10.218
  554   1HD   LYS  74          HD2       LYS  74  -1.327  11.787  12.416
  555   2HD   LYS  74          HD1       LYS  74  -1.798  10.087  12.397
  556   1HE   LYS  74          HE2       LYS  74   0.659   9.507  12.172
  557   2HE   LYS  74          HE1       LYS  74   1.014  11.207  12.479
  558   1HZ   LYS  74          HZ1       LYS  74   0.441   9.195  14.342
  559   2HZ   LYS  74          HZ2       LYS  74  -0.815  10.337  14.406
  560   3HZ   LYS  74          HZ3       LYS  74   0.796  10.828  14.634
  561    H    VAL  75           HN       VAL  75  -3.823   9.393   7.466
  562    HA   VAL  75           HA       VAL  75  -5.911  11.382   6.636
  563    HB   VAL  75           HB       VAL  75  -5.387   8.579   5.616
  564   1HG1  VAL  75          HG11      VAL  75  -7.698   8.968   5.314
  565   2HG1  VAL  75          HG12      VAL  75  -6.996   9.491   3.786
  566   3HG1  VAL  75          HG13      VAL  75  -7.462  10.686   4.993
  567   1HG2  VAL  75          HG21      VAL  75  -4.697   9.817   3.549
  568   2HG2  VAL  75          HG22      VAL  75  -3.642  10.141   4.925
  569   3HG2  VAL  75          HG23      VAL  75  -4.855  11.327   4.445
  570    H    SER  76           HN       SER  76  -7.848  11.304   7.623
  571    HA   SER  76           HA       SER  76  -8.340   9.189   9.638
  572   1HB   SER  76          HB2       SER  76 -10.127  10.630  10.416
  573   2HB   SER  76          HB1       SER  76  -8.702  11.627  10.150
  574    HG   SER  76           HG       SER  76  -9.805  12.685   8.717
  575    H    ALA  77           HN       ALA  77 -10.531   8.182   9.698
  576    HA   ALA  77           HA       ALA  77 -11.226   6.958   7.219
  577   1HB   ALA  77          HB1       ALA  77 -11.787   5.820   9.252
  578   2HB   ALA  77          HB2       ALA  77 -13.321   6.263   8.505
  579   3HB   ALA  77          HB3       ALA  77 -12.692   7.207   9.856
  580    H    GLY  78           HN       GLY  78 -11.812  10.090   8.273
  581   1HA   GLY  78          HA2       GLY  78 -14.350  10.366   6.714
  582   2HA   GLY  78          HA1       GLY  78 -13.727  11.543   7.867
  583    H    GLN  79           HN       GLN  79 -10.955  11.223   6.676
  584    HA   GLN  79           HA       GLN  79 -11.343  13.205   4.506
  585   1HB   GLN  79          HB2       GLN  79  -8.911  12.233   6.025
  586   2HB   GLN  79          HB1       GLN  79  -8.822  13.393   4.698
  587   1HG   GLN  79          HG2       GLN  79 -10.353  14.904   5.908
  588   2HG   GLN  79          HG1       GLN  79 -10.452  13.747   7.235
  589   1HE2  GLN  79          HE21      GLN  79  -7.383  13.252   6.455
  590   2HE2  GLN  79          HE22      GLN  79  -6.605  14.475   7.337
  591    H    PHE  80           HN       PHE  80 -11.350  12.580   2.410
  592    HA   PHE  80           HA       PHE  80  -9.744  10.180   1.595
  593   1HB   PHE  80          HB2       PHE  80 -12.555  10.922   0.749
  594   2HB   PHE  80          HB1       PHE  80 -11.572   9.694  -0.042
  595    HD1  PHE  80           HD1      PHE  80 -13.753  10.413   2.732
  596    HD2  PHE  80           HD2      PHE  80 -10.664   7.761   1.365
  597    HE1  PHE  80           HE1      PHE  80 -14.403   8.762   4.465
  598    HE2  PHE  80           HE2      PHE  80 -11.313   6.109   3.099
  599    HZ   PHE  80           HZ       PHE  80 -13.183   6.610   4.649
  600    H    SER  81           HN       SER  81  -8.631  10.417  -0.355
  601    HA   SER  81           HA       SER  81  -8.936  13.062  -1.753
  602   1HB   SER  81          HB2       SER  81  -6.431  11.469  -1.183
  603   2HB   SER  81          HB1       SER  81  -6.491  12.903  -2.204
  604    HG   SER  81           HG       SER  81  -7.385  12.800   0.492
  605    H    SER  82           HN       SER  82  -8.393   9.569  -2.190
  606    HA   SER  82           HA       SER  82  -8.386  10.006  -5.162
  607   1HB   SER  82          HB2       SER  82  -6.471   8.753  -4.195
  608   2HB   SER  82          HB1       SER  82  -7.599   7.525  -3.622
  609    HG   SER  82           HG       SER  82  -6.853   6.882  -5.612
  610    H    LEU  83           HN       LEU  83 -10.578   9.180  -2.774
  611    HA   LEU  83           HA       LEU  83 -11.962   7.092  -4.344
  612   1HB   LEU  83          HB2       LEU  83 -12.489   8.453  -1.706
  613   2HB   LEU  83          HB1       LEU  83 -13.735   7.479  -2.472
  614    HG   LEU  83           HG       LEU  83 -12.121   5.569  -2.580
  615   1HD1  LEU  83          HD11      LEU  83  -9.993   6.635  -2.552
  616   2HD1  LEU  83          HD12      LEU  83 -10.113   5.825  -0.990
  617   3HD1  LEU  83          HD13      LEU  83 -10.389   7.562  -1.104
  618   1HD2  LEU  83          HD21      LEU  83 -13.626   5.474  -0.750
  619   2HD2  LEU  83          HD22      LEU  83 -12.843   6.821   0.076
  620   3HD2  LEU  83          HD23      LEU  83 -12.041   5.252  -0.009
  621    H    HIS  84           HN       HIS  84 -11.563   9.935  -5.349
  622    HA   HIS  84           HA       HIS  84 -14.214  11.139  -5.367
  623   1HB   HIS  84          HB2       HIS  84 -11.934  11.648  -7.290
  624   2HB   HIS  84          HB1       HIS  84 -13.273  12.731  -6.909
  625    HD1  HIS  84           HD1      HIS  84 -12.843  11.689  -3.731
  626    HD2  HIS  84           HD2      HIS  84 -10.242  13.798  -6.211
  627    HE1  HIS  84           HE1      HIS  84 -11.233  12.910  -2.207
  628    H    VAL  85           HN       VAL  85 -12.348   9.058  -7.535
  629    HA   VAL  85           HA       VAL  85 -14.356   9.122  -9.648
  630    HB   VAL  85           HB       VAL  85 -12.242   6.991  -9.257
  631   1HG1  VAL  85          HG11      VAL  85 -13.430   8.252 -11.744
  632   2HG1  VAL  85          HG12      VAL  85 -13.997   6.740 -11.033
  633   3HG1  VAL  85          HG13      VAL  85 -12.359   6.852 -11.678
  634   1HG2  VAL  85          HG21      VAL  85 -11.963   9.798 -10.375
  635   2HG2  VAL  85          HG22      VAL  85 -10.787   8.515 -10.658
  636   3HG2  VAL  85          HG23      VAL  85 -11.078   9.100  -9.020
  637    H    ARG  86           HN       ARG  86 -15.857   7.410 -10.131
  638    HA   ARG  86           HA       ARG  86 -16.706   5.916  -7.720
  639   1HB   ARG  86          HB2       ARG  86 -17.915   6.288 -10.475
  640   2HB   ARG  86          HB1       ARG  86 -18.645   5.287  -9.221
  641   1HG   ARG  86          HG2       ARG  86 -18.761   7.233  -7.717
  642   2HG   ARG  86          HG1       ARG  86 -18.020   8.240  -8.953
  643   1HD   ARG  86          HD2       ARG  86 -20.640   6.755  -9.257
  644   2HD   ARG  86          HD1       ARG  86 -20.505   8.476  -8.917
  645    HE   ARG  86           HE       ARG  86 -20.335   7.199 -11.497
  646   1HH1  ARG  86          HH21      ARG  86 -18.802   9.686  -9.643
  647   2HH1  ARG  86          HH22      ARG  86 -18.071  10.425 -11.028
  648   1HH2  ARG  86          HH11      ARG  86 -19.402   8.176 -13.284
  649   2HH2  ARG  86          HH12      ARG  86 -18.418   9.585 -13.072
  650    H    ASP  87           HN       ASP  87 -14.468   4.727  -8.148
  651    HA   ASP  87           HA       ASP  87 -14.594   2.659 -10.232
  652   1HB   ASP  87          HB2       ASP  87 -12.635   3.224  -7.991
  653   2HB   ASP  87          HB1       ASP  87 -12.473   1.848  -9.082
  654    H    THR  88           HN       THR  88 -14.208   0.318  -9.476
  655    HA   THR  88           HA       THR  88 -16.251  -0.300  -7.412
  656    HB   THR  88           HB       THR  88 -16.068  -2.604  -8.279
  657    HG1  THR  88           HG1      THR  88 -13.875  -1.448  -9.554
  658   1HG2  THR  88          HG21      THR  88 -17.528  -0.885  -9.394
  659   2HG2  THR  88          HG22      THR  88 -17.011  -2.190 -10.461
  660   3HG2  THR  88          HG23      THR  88 -16.225  -0.614 -10.553
  661    H    LYS  89           HN       LYS  89 -15.708  -2.073  -5.836
  662    HA   LYS  89           HA       LYS  89 -13.033  -1.581  -4.678
  663   1HB   LYS  89          HB2       LYS  89 -15.412  -3.183  -3.692
  664   2HB   LYS  89          HB1       LYS  89 -13.907  -2.988  -2.800
  665   1HG   LYS  89          HG2       LYS  89 -14.230  -0.549  -2.765
  666   2HG   LYS  89          HG1       LYS  89 -15.741  -0.735  -3.660
  667   1HD   LYS  89          HD2       LYS  89 -16.649  -2.134  -1.834
  668   2HD   LYS  89          HD1       LYS  89 -15.142  -1.934  -0.939
  669   1HE   LYS  89          HE2       LYS  89 -15.489   0.455  -0.770
  670   2HE   LYS  89          HE1       LYS  89 -16.908   0.363  -1.815
  671   1HZ   LYS  89          HZ1       LYS  89 -17.604  -1.382   0.030
  672   2HZ   LYS  89          HZ2       LYS  89 -17.937   0.277   0.178
  673   3HZ   LYS  89          HZ3       LYS  89 -16.602  -0.399   0.981
  674    H    ILE  90           HN       ILE  90 -11.557  -3.321  -4.212
  675    HA   ILE  90           HA       ILE  90 -12.030  -5.870  -5.724
  676    HB   ILE  90           HB       ILE  90  -9.660  -5.799  -6.435
  677   1HG1  ILE  90          HG12      ILE  90  -9.713  -3.032  -5.176
  678   2HG1  ILE  90          HG11      ILE  90  -8.791  -4.414  -4.582
  679   1HG2  ILE  90          HG21      ILE  90 -11.146  -3.258  -7.163
  680   2HG2  ILE  90          HG22      ILE  90 -11.501  -4.844  -7.847
  681   3HG2  ILE  90          HG23      ILE  90  -9.936  -4.089  -8.142
  682   1HD1  ILE  90          HD11      ILE  90  -7.236  -3.157  -5.861
  683   2HD1  ILE  90          HD12      ILE  90  -8.403  -2.888  -7.156
  684   3HD1  ILE  90          HD13      ILE  90  -7.714  -4.492  -6.910
  685    H    GLU  91           HN       GLU  91 -10.570  -7.645  -4.931
  686    HA   GLU  91           HA       GLU  91 -10.645  -7.817  -2.060
  687   1HB   GLU  91          HB2       GLU  91  -9.217  -9.508  -4.131
  688   2HB   GLU  91          HB1       GLU  91  -9.300  -9.914  -2.416
  689   1HG   GLU  91          HG2       GLU  91 -11.764  -9.925  -2.531
  690   2HG   GLU  91          HG1       GLU  91 -11.686  -9.519  -4.246
  691    H    VAL  92           HN       VAL  92  -8.919  -7.738  -0.551
  692    HA   VAL  92           HA       VAL  92  -6.880  -5.802  -1.014
  693    HB   VAL  92           HB       VAL  92  -7.118  -7.999   1.063
  694   1HG1  VAL  92          HG11      VAL  92  -4.795  -7.523   1.012
  695   2HG1  VAL  92          HG12      VAL  92  -5.424  -6.508   2.310
  696   3HG1  VAL  92          HG13      VAL  92  -5.069  -5.805   0.731
  697   1HG2  VAL  92          HG21      VAL  92  -7.752  -6.106   2.526
  698   2HG2  VAL  92          HG22      VAL  92  -8.845  -6.248   1.149
  699   3HG2  VAL  92          HG23      VAL  92  -7.596  -5.004   1.158
  700    H    ALA  93           HN       ALA  93  -6.786  -9.359  -1.168
  701    HA   ALA  93           HA       ALA  93  -4.028  -9.754  -1.514
  702   1HB   ALA  93          HB1       ALA  93  -5.903 -11.503  -1.394
  703   2HB   ALA  93          HB2       ALA  93  -4.582 -11.848  -2.511
  704   3HB   ALA  93          HB3       ALA  93  -6.117 -11.234  -3.124
  705    H    GLN  94           HN       GLN  94  -6.453  -8.807  -3.932
  706    HA   GLN  94           HA       GLN  94  -4.521  -8.796  -6.109
  707   1HB   GLN  94          HB2       GLN  94  -7.313  -7.632  -5.855
  708   2HB   GLN  94          HB1       GLN  94  -6.366  -7.605  -7.344
  709   1HG   GLN  94          HG2       GLN  94  -6.236 -10.059  -7.331
  710   2HG   GLN  94          HG1       GLN  94  -7.145 -10.108  -5.819
  711   1HE2  GLN  94          HE21      GLN  94  -8.132 -11.382  -8.196
  712   2HE2  GLN  94          HE22      GLN  94  -9.525 -10.554  -8.701
  713    H    PHE  95           HN       PHE  95  -5.871  -6.402  -3.880
  714    HA   PHE  95           HA       PHE  95  -4.882  -4.052  -5.138
  715   1HB   PHE  95          HB2       PHE  95  -6.453  -4.001  -3.238
  716   2HB   PHE  95          HB1       PHE  95  -5.197  -4.645  -2.179
  717    HD1  PHE  95           HD1      PHE  95  -6.343  -1.698  -4.067
  718    HD2  PHE  95           HD2      PHE  95  -3.271  -3.295  -1.526
  719    HE1  PHE  95           HE1      PHE  95  -5.459   0.587  -3.696
  720    HE2  PHE  95           HE2      PHE  95  -2.388  -1.012  -1.155
  721    HZ   PHE  95           HZ       PHE  95  -3.482   0.932  -2.241
  722    H    VAL  96           HN       VAL  96  -3.369  -6.076  -2.596
  723    HA   VAL  96           HA       VAL  96  -0.950  -4.577  -2.420
  724    HB   VAL  96           HB       VAL  96  -1.453  -7.523  -1.910
  725   1HG1  VAL  96          HG11      VAL  96   0.889  -7.348  -2.080
  726   2HG1  VAL  96          HG12      VAL  96   0.599  -7.121  -0.356
  727   3HG1  VAL  96          HG13      VAL  96   0.916  -5.726  -1.387
  728   1HG2  VAL  96          HG21      VAL  96  -2.839  -6.074  -0.525
  729   2HG2  VAL  96          HG22      VAL  96  -1.438  -5.089  -0.101
  730   3HG2  VAL  96          HG23      VAL  96  -1.549  -6.756   0.465
  731    H    LYS  97           HN       LYS  97  -1.719  -7.478  -4.383
  732    HA   LYS  97           HA       LYS  97   0.869  -7.776  -5.520
  733   1HB   LYS  97          HB2       LYS  97  -1.869  -8.491  -6.590
  734   2HB   LYS  97          HB1       LYS  97  -0.363  -8.955  -7.386
  735   1HG   LYS  97          HG2       LYS  97   0.376 -10.115  -5.348
  736   2HG   LYS  97          HG1       LYS  97  -1.122  -9.655  -4.535
  737   1HD   LYS  97          HD2       LYS  97  -2.421 -10.890  -6.228
  738   2HD   LYS  97          HD1       LYS  97  -0.926 -11.356  -7.039
  739   1HE   LYS  97          HE2       LYS  97  -0.212 -12.380  -4.797
  740   2HE   LYS  97          HE1       LYS  97  -1.891 -12.178  -4.296
  741   1HZ   LYS  97          HZ1       LYS  97  -1.097 -14.366  -5.448
  742   2HZ   LYS  97          HZ2       LYS  97  -1.334 -13.468  -6.870
  743   3HZ   LYS  97          HZ3       LYS  97  -2.625 -13.716  -5.794
  744    H    ASP  98           HN       ASP  98  -1.960  -6.000  -6.846
  745    HA   ASP  98           HA       ASP  98  -0.639  -5.098  -9.203
  746   1HB   ASP  98          HB2       ASP  98  -2.867  -3.847  -7.565
  747   2HB   ASP  98          HB1       ASP  98  -2.341  -3.219  -9.127
  748    H    LEU  99           HN       LEU  99  -0.818  -3.735  -5.943
  749    HA   LEU  99           HA       LEU  99   0.596  -1.311  -6.526
  750   1HB   LEU  99          HB2       LEU  99  -0.763  -1.625  -4.484
  751   2HB   LEU  99          HB1       LEU  99   0.367  -2.853  -3.921
  752    HG   LEU  99           HG       LEU  99   2.175  -1.171  -3.870
  753   1HD1  LEU  99          HD11      LEU  99   1.237   1.301  -4.031
  754   2HD1  LEU  99          HD12      LEU  99   0.008   0.553  -5.051
  755   3HD1  LEU  99          HD13      LEU  99   1.711   0.441  -5.494
  756   1HD2  LEU  99          HD21      LEU  99  -0.265  -0.107  -2.427
  757   2HD2  LEU  99          HD22      LEU  99   1.417  -0.027  -1.901
  758   3HD2  LEU  99          HD23      LEU  99   0.574  -1.576  -1.927
  759    H    LEU 100           HN       LEU 100   1.643  -4.556  -5.586
  760    HA   LEU 100           HA       LEU 100   4.339  -4.015  -4.938
  761   1HB   LEU 100          HB2       LEU 100   3.255  -6.199  -4.580
  762   2HB   LEU 100          HB1       LEU 100   3.181  -6.453  -6.320
  763    HG   LEU 100           HG       LEU 100   5.651  -6.398  -6.441
  764   1HD1  LEU 100          HD11      LEU 100   6.797  -6.648  -4.096
  765   2HD1  LEU 100          HD12      LEU 100   5.364  -5.812  -3.500
  766   3HD1  LEU 100          HD13      LEU 100   6.409  -5.035  -4.690
  767   1HD2  LEU 100          HD21      LEU 100   6.033  -8.553  -5.402
  768   2HD2  LEU 100          HD22      LEU 100   4.381  -8.523  -6.019
  769   3HD2  LEU 100          HD23      LEU 100   4.682  -8.305  -4.295
  770    H    LEU 101           HN       LEU 101   2.889  -4.639  -8.157
  771    HA   LEU 101           HA       LEU 101   5.350  -4.696  -9.601
  772   1HB   LEU 101          HB2       LEU 101   2.526  -3.972 -10.354
  773   2HB   LEU 101          HB1       LEU 101   3.821  -3.757 -11.523
  774    HG   LEU 101           HG       LEU 101   2.532  -5.984 -11.592
  775   1HD1  LEU 101          HD11      LEU 101   5.504  -6.352 -11.202
  776   2HD1  LEU 101          HD12      LEU 101   4.849  -5.494 -12.596
  777   3HD1  LEU 101          HD13      LEU 101   4.432  -7.182 -12.326
  778   1HD2  LEU 101          HD21      LEU 101   2.679  -6.231  -9.039
  779   2HD2  LEU 101          HD22      LEU 101   4.342  -6.751  -9.298
  780   3HD2  LEU 101          HD23      LEU 101   3.011  -7.665 -10.000
  781    H    HIS 102           HN       HIS 102   3.235  -1.937  -8.814
  782    HA   HIS 102           HA       HIS 102   4.899  -0.010 -10.151
  783   1HB   HIS 102          HB2       HIS 102   2.726   0.195  -8.070
  784   2HB   HIS 102          HB1       HIS 102   3.619   1.626  -8.591
  785    HD1  HIS 102           HD1      HIS 102   3.325   2.381 -11.069
  786    HD2  HIS 102           HD2      HIS 102   0.991  -0.895 -10.009
  787    HE1  HIS 102           HE1      HIS 102   1.648   2.073 -12.934
  788    H    LEU 103           HN       LEU 103   4.823  -1.119  -6.742
  789    HA   LEU 103           HA       LEU 103   6.560   0.868  -5.736
  790   1HB   LEU 103          HB2       LEU 103   6.311  -2.047  -4.957
  791   2HB   LEU 103          HB1       LEU 103   7.269  -0.877  -4.053
  792    HG   LEU 103           HG       LEU 103   4.313  -0.547  -4.651
  793   1HD1  LEU 103          HD11      LEU 103   5.660  -1.449  -2.087
  794   2HD1  LEU 103          HD12      LEU 103   4.772  -2.504  -3.187
  795   3HD1  LEU 103          HD13      LEU 103   3.930  -1.214  -2.328
  796   1HD2  LEU 103          HD21      LEU 103   5.042   1.612  -4.162
  797   2HD2  LEU 103          HD22      LEU 103   6.366   1.056  -3.140
  798   3HD2  LEU 103          HD23      LEU 103   4.712   1.032  -2.534
  799    H    LYS 104           HN       LYS 104   7.538  -2.387  -6.955
  800    HA   LYS 104           HA       LYS 104  10.328  -1.657  -6.848
  801   1HB   LYS 104          HB2       LYS 104  10.748  -3.722  -8.117
  802   2HB   LYS 104          HB1       LYS 104   9.658  -4.007  -6.765
  803   1HG   LYS 104          HG2       LYS 104   7.725  -3.908  -8.289
  804   2HG   LYS 104          HG1       LYS 104   8.811  -3.610  -9.649
  805   1HD   LYS 104          HD2       LYS 104   9.940  -5.762  -9.230
  806   2HD   LYS 104          HD1       LYS 104   8.861  -6.068  -7.870
  807   1HE   LYS 104          HE2       LYS 104   8.263  -7.167 -10.119
  808   2HE   LYS 104          HE1       LYS 104   6.976  -6.310  -9.277
  809   1HZ   LYS 104          HZ1       LYS 104   8.604  -4.742 -11.111
  810   2HZ   LYS 104          HZ2       LYS 104   6.932  -4.677 -10.816
  811   3HZ   LYS 104          HZ3       LYS 104   7.575  -5.888 -11.820
  812    H    LYS 105           HN       LYS 105   7.853  -1.022  -9.184
  813    HA   LYS 105           HA       LYS 105   9.477  -0.840 -11.526
  814   1HB   LYS 105          HB2       LYS 105   6.980  -0.793 -11.530
  815   2HB   LYS 105          HB1       LYS 105   7.041   0.830 -10.841
  816   1HG   LYS 105          HG2       LYS 105   8.309   1.623 -12.804
  817   2HG   LYS 105          HG1       LYS 105   8.252   0.001 -13.496
  818   1HD   LYS 105          HD2       LYS 105   5.790   0.098 -13.542
  819   2HD   LYS 105          HD1       LYS 105   5.837   1.721 -12.850
  820   1HE   LYS 105          HE2       LYS 105   5.616   2.055 -15.198
  821   2HE   LYS 105          HE1       LYS 105   7.317   2.357 -14.848
  822   1HZ   LYS 105          HZ1       LYS 105   6.706   0.825 -16.799
  823   2HZ   LYS 105          HZ2       LYS 105   6.404  -0.342 -15.603
  824   3HZ   LYS 105          HZ3       LYS 105   7.951   0.345 -15.752
  825    H    LEU 106           HN       LEU 106   8.604   1.688  -9.126
  826    HA   LEU 106           HA       LEU 106  10.085   3.785 -10.386
  827   1HB   LEU 106          HB2       LEU 106   9.209   3.312  -7.536
  828   2HB   LEU 106          HB1       LEU 106  10.181   4.716  -7.957
  829    HG   LEU 106           HG       LEU 106   7.641   5.053  -7.928
  830   1HD1  LEU 106          HD11      LEU 106   7.692   6.635  -9.665
  831   2HD1  LEU 106          HD12      LEU 106   8.782   5.668 -10.654
  832   3HD1  LEU 106          HD13      LEU 106   9.386   6.483  -9.212
  833   1HD2  LEU 106          HD21      LEU 106   7.762   3.638 -10.598
  834   2HD2  LEU 106          HD22      LEU 106   6.334   4.228  -9.747
  835   3HD2  LEU 106          HD23      LEU 106   7.226   2.851  -9.119
  836    H    PHE 107           HN       PHE 107  11.070   1.147  -8.287
  837    HA   PHE 107           HA       PHE 107  13.605   2.149  -7.471
  838   1HB   PHE 107          HB2       PHE 107  12.612   0.048  -6.575
  839   2HB   PHE 107          HB1       PHE 107  12.900  -0.725  -8.131
  840    HD1  PHE 107           HD1      PHE 107  14.631   1.057  -5.346
  841    HD2  PHE 107           HD2      PHE 107  15.019  -1.644  -8.658
  842    HE1  PHE 107           HE1      PHE 107  16.963   0.591  -4.679
  843    HE2  PHE 107           HE2      PHE 107  17.360  -2.119  -7.993
  844    HZ   PHE 107           HZ       PHE 107  18.335  -1.005  -6.001
  845    H    ARG 108           HN       ARG 108  12.613   0.477 -10.431
  846    HA   ARG 108           HA       ARG 108  15.204   0.095 -11.543
  847   1HB   ARG 108          HB2       ARG 108  12.519   0.576 -12.857
  848   2HB   ARG 108          HB1       ARG 108  13.974   0.148 -13.756
  849   1HG   ARG 108          HG2       ARG 108  14.183  -1.926 -12.440
  850   2HG   ARG 108          HG1       ARG 108  12.728  -1.501 -11.538
  851   1HD   ARG 108          HD2       ARG 108  12.214  -3.079 -13.378
  852   2HD   ARG 108          HD1       ARG 108  11.412  -1.527 -13.617
  853    HE   ARG 108           HE       ARG 108  13.820  -1.269 -14.983
  854   1HH1  ARG 108          HH21      ARG 108  11.191  -3.499 -14.944
  855   2HH1  ARG 108          HH22      ARG 108  11.330  -3.894 -16.625
  856   1HH2  ARG 108          HH11      ARG 108  14.013  -1.776 -17.178
  857   2HH2  ARG 108          HH12      ARG 108  12.928  -2.926 -17.886
  858    H    GLU 109           HN       GLU 109  13.009   2.888 -11.629
  859    HA   GLU 109           HA       GLU 109  14.886   4.409 -13.319
  860   1HB   GLU 109          HB2       GLU 109  12.250   5.123 -12.008
  861   2HB   GLU 109          HB1       GLU 109  13.198   6.248 -12.985
  862   1HG   GLU 109          HG2       GLU 109  13.099   4.695 -14.894
  863   2HG   GLU 109          HG1       GLU 109  12.153   3.562 -13.928
  864    H    GLY 110           HN       GLY 110  14.653   3.711 -10.030
  865   1HA   GLY 110          HA2       GLY 110  15.773   4.591  -8.172
  866   2HA   GLY 110          HA1       GLY 110  16.779   5.481  -9.315
  867    H    ARG 111           HN       ARG 111  13.472   6.124  -9.778
  868    HA   ARG 111           HA       ARG 111  13.830   8.809  -8.555
  869   1HB   ARG 111          HB2       ARG 111  11.682   7.656 -10.359
  870   2HB   ARG 111          HB1       ARG 111  11.663   9.303  -9.725
  871   1HG   ARG 111          HG2       ARG 111  13.858   9.729 -10.787
  872   2HG   ARG 111          HG1       ARG 111  13.845   8.094 -11.447
  873   1HD   ARG 111          HD2       ARG 111  13.052   9.669 -13.145
  874   2HD   ARG 111          HD1       ARG 111  11.728   8.618 -12.641
  875    HE   ARG 111           HE       ARG 111  11.524  10.833 -10.971
  876   1HH1  ARG 111          HH21      ARG 111  11.642  10.218 -14.362
  877   2HH1  ARG 111          HH22      ARG 111  10.699  11.609 -14.780
  878   1HH2  ARG 111          HH11      ARG 111  10.296  12.652 -11.501
  879   2HH2  ARG 111          HH12      ARG 111   9.942  12.988 -13.163
  880    H    PHE 112           HN       PHE 112  13.513   8.540  -6.372
  881    HA   PHE 112           HA       PHE 112  11.148   7.024  -5.414
  882   1HB   PHE 112          HB2       PHE 112  13.385   8.375  -3.871
  883   2HB   PHE 112          HB1       PHE 112  12.180   7.264  -3.213
  884    HD1  PHE 112           HD1      PHE 112  12.080   4.896  -4.068
  885    HD2  PHE 112           HD2      PHE 112  15.305   7.563  -5.028
  886    HE1  PHE 112           HE1      PHE 112  13.461   2.977  -4.791
  887    HE2  PHE 112           HE2      PHE 112  16.686   5.632  -5.753
  888    HZ   PHE 112           HZ       PHE 112  15.764   3.336  -5.630
  889    H    ASN 113           HN       ASN 113   9.336   8.037  -4.676
  890    HA   ASN 113           HA       ASN 113   7.829   9.787  -4.258
  891   1HB   ASN 113          HB2       ASN 113  10.255  11.216  -3.135
  892   2HB   ASN 113          HB1       ASN 113   8.565  11.463  -2.695
  893   1HD2  ASN 113          HD21      ASN 113  10.296  10.813  -0.606
  894   2HD2  ASN 113          HD22      ASN 113  10.032   9.213  -0.105
  Start of MODEL    5
    1   1H    MET   1           HT1      MET   1  21.532   6.862  13.068
    2   2H    MET   1           HT2      MET   1  21.862   5.633  11.942
    3   3H    MET   1           HT3      MET   1  22.003   5.325  13.607
    4    HA   MET   1           HA       MET   1  19.925   4.489  12.385
    5   1HB   MET   1          HB2       MET   1  18.539   5.071  14.421
    6   2HB   MET   1          HB1       MET   1  20.107   4.351  14.783
    7   1HG   MET   1          HG2       MET   1  21.057   6.597  15.161
    8   2HG   MET   1          HG1       MET   1  19.492   7.322  14.797
    9   1HE   MET   1          HE1       MET   1  20.828   4.839  18.348
   10   2HE   MET   1          HE2       MET   1  21.449   4.871  16.700
   11   3HE   MET   1          HE3       MET   1  20.037   3.890  17.082
   12    H    GLY   2           HN       GLY   2  20.700   7.217  11.240
   13   1HA   GLY   2          HA2       GLY   2  18.342   8.887  11.487
   14   2HA   GLY   2          HA1       GLY   2  19.618   9.078  10.282
   15    HA   PRO   3           HA       PRO   3  15.449   7.254   8.596
   16   1HB   PRO   3          HB2       PRO   3  15.730   9.412   6.624
   17   2HB   PRO   3          HB1       PRO   3  14.368   9.053   7.691
   18   1HG   PRO   3          HG2       PRO   3  16.298  11.165   7.968
   19   2HG   PRO   3          HG1       PRO   3  14.958  10.781   9.054
   20   1HD   PRO   3          HD2       PRO   3  17.751  10.450   9.597
   21   2HD   PRO   3          HD1       PRO   3  16.395   9.888  10.607
   22    H    VAL   4           HN       VAL   4  15.606   5.751   6.936
   23    HA   VAL   4           HA       VAL   4  18.201   5.410   5.650
   24    HB   VAL   4           HB       VAL   4  16.905   3.437   4.549
   25   1HG1  VAL   4          HG11      VAL   4  18.412   2.982   6.351
   26   2HG1  VAL   4          HG12      VAL   4  16.891   2.205   6.789
   27   3HG1  VAL   4          HG13      VAL   4  17.339   3.742   7.527
   28   1HG2  VAL   4          HG21      VAL   4  14.944   4.117   6.750
   29   2HG2  VAL   4          HG22      VAL   4  14.803   2.849   5.534
   30   3HG2  VAL   4          HG23      VAL   4  14.667   4.542   5.061
   31    HA   PRO   5           HA       PRO   5  17.267   7.623   1.928
   32   1HB   PRO   5          HB2       PRO   5  18.392   5.836   0.030
   33   2HB   PRO   5          HB1       PRO   5  19.226   7.156   0.859
   34   1HG   PRO   5          HG2       PRO   5  19.371   4.246   1.368
   35   2HG   PRO   5          HG1       PRO   5  20.532   5.514   1.779
   36   1HD   PRO   5          HD2       PRO   5  18.853   4.222   3.613
   37   2HD   PRO   5          HD1       PRO   5  19.643   5.793   3.888
   38    HA   PRO   6           HA       PRO   6  13.514   6.061   0.156
   39   1HB   PRO   6          HB2       PRO   6  13.910   6.798  -2.560
   40   2HB   PRO   6          HB1       PRO   6  13.157   7.779  -1.297
   41   1HG   PRO   6          HG2       PRO   6  15.842   8.024  -2.493
   42   2HG   PRO   6          HG1       PRO   6  14.908   9.221  -1.586
   43   1HD   PRO   6          HD2       PRO   6  17.156   7.825  -0.613
   44   2HD   PRO   6          HD1       PRO   6  15.966   8.698   0.386
   45    H    SER   7           HN       SER   7  16.184   5.386  -2.138
   46    HA   SER   7           HA       SER   7  14.962   3.152  -3.388
   47   1HB   SER   7          HB2       SER   7  17.149   2.613  -4.244
   48   2HB   SER   7          HB1       SER   7  17.024   4.369  -4.186
   49    HG   SER   7           HG       SER   7  17.896   3.603  -1.833
   50    H    THR   8           HN       THR   8  17.022   3.309  -0.501
   51    HA   THR   8           HA       THR   8  17.212   0.449  -0.188
   52    HB   THR   8           HB       THR   8  17.514   2.676   1.843
   53    HG1  THR   8           HG1      THR   8  19.491   1.145   0.526
   54   1HG2  THR   8          HG21      THR   8  17.174   0.737   3.135
   55   2HG2  THR   8          HG22      THR   8  18.928   0.828   2.983
   56   3HG2  THR   8          HG23      THR   8  18.014  -0.295   1.976
   57    H    ALA   9           HN       ALA   9  14.972   2.877   1.154
   58    HA   ALA   9           HA       ALA   9  13.603   1.083   2.912
   59   1HB   ALA   9          HB1       ALA   9  13.258   3.436   3.209
   60   2HB   ALA   9          HB2       ALA   9  11.710   2.767   2.693
   61   3HB   ALA   9          HB3       ALA   9  12.724   3.632   1.539
   62    H    LEU  10           HN       LEU  10  13.053   1.936  -0.492
   63    HA   LEU  10           HA       LEU  10  10.587   0.567  -0.811
   64   1HB   LEU  10          HB2       LEU  10  11.531   2.123  -2.492
   65   2HB   LEU  10          HB1       LEU  10  12.801   0.956  -2.846
   66    HG   LEU  10           HG       LEU  10  11.031  -0.701  -3.495
   67   1HD1  LEU  10          HD11      LEU  10   9.045  -0.062  -2.434
   68   2HD1  LEU  10          HD12      LEU  10   8.769   0.530  -4.070
   69   3HD1  LEU  10          HD13      LEU  10   9.272   1.648  -2.803
   70   1HD2  LEU  10          HD21      LEU  10  11.064   1.958  -4.949
   71   2HD2  LEU  10          HD22      LEU  10  10.482   0.443  -5.638
   72   3HD2  LEU  10          HD23      LEU  10  12.175   0.611  -5.190
   73    H    ARG  11           HN       ARG  11  13.938  -0.615  -1.359
   74    HA   ARG  11           HA       ARG  11  13.191  -3.261  -2.121
   75   1HB   ARG  11          HB2       ARG  11  15.670  -2.234  -0.699
   76   2HB   ARG  11          HB1       ARG  11  15.497  -3.890  -1.276
   77   1HG   ARG  11          HG2       ARG  11  15.131  -3.038  -3.576
   78   2HG   ARG  11          HG1       ARG  11  15.360  -1.390  -2.987
   79   1HD   ARG  11          HD2       ARG  11  17.408  -3.625  -2.869
   80   2HD   ARG  11          HD1       ARG  11  17.455  -2.231  -3.947
   81    HE   ARG  11           HE       ARG  11  17.319  -1.134  -1.389
   82   1HH1  ARG  11          HH21      ARG  11  19.322  -3.348  -3.113
   83   2HH1  ARG  11          HH22      ARG  11  20.741  -2.996  -2.185
   84   1HH2  ARG  11          HH11      ARG  11  19.162  -0.667  -0.159
   85   2HH2  ARG  11          HH12      ARG  11  20.650  -1.481  -0.511
   86    H    GLU  12           HN       GLU  12  13.778  -1.783   1.046
   87    HA   GLU  12           HA       GLU  12  13.500  -4.173   2.608
   88   1HB   GLU  12          HB2       GLU  12  13.001  -1.250   3.253
   89   2HB   GLU  12          HB1       GLU  12  12.940  -2.536   4.460
   90   1HG   GLU  12          HG2       GLU  12  15.344  -2.031   2.692
   91   2HG   GLU  12          HG1       GLU  12  15.165  -1.340   4.304
   92    H    LEU  13           HN       LEU  13  11.180  -1.720   1.510
   93    HA   LEU  13           HA       LEU  13   8.932  -2.869   2.903
   94   1HB   LEU  13          HB2       LEU  13   8.995  -0.509   2.195
   95   2HB   LEU  13          HB1       LEU  13   9.032  -1.009   0.508
   96    HG   LEU  13           HG       LEU  13   6.808  -2.100   0.811
   97   1HD1  LEU  13          HD11      LEU  13   5.577  -1.243   2.963
   98   2HD1  LEU  13          HD12      LEU  13   7.204  -1.058   3.617
   99   3HD1  LEU  13          HD13      LEU  13   6.636  -2.644   3.096
  100   1HD2  LEU  13          HD21      LEU  13   6.973   0.822   1.617
  101   2HD2  LEU  13          HD22      LEU  13   5.527   0.024   0.996
  102   3HD2  LEU  13          HD23      LEU  13   6.948   0.202  -0.034
  103    H    ILE  14           HN       ILE  14  10.087  -3.116  -0.486
  104    HA   ILE  14           HA       ILE  14   7.912  -4.712  -1.411
  105    HB   ILE  14           HB       ILE  14  10.788  -4.598  -2.365
  106   1HG1  ILE  14          HG12      ILE  14   8.242  -3.403  -3.513
  107   2HG1  ILE  14          HG11      ILE  14   9.386  -2.509  -2.513
  108   1HG2  ILE  14          HG21      ILE  14   8.348  -6.014  -3.453
  109   2HG2  ILE  14          HG22      ILE  14   9.949  -6.684  -3.153
  110   3HG2  ILE  14          HG23      ILE  14   9.698  -5.571  -4.495
  111   1HD1  ILE  14          HD11      ILE  14  11.173  -2.950  -4.158
  112   2HD1  ILE  14          HD12      ILE  14   9.814  -2.115  -4.910
  113   3HD1  ILE  14          HD13      ILE  14  10.030  -3.847  -5.157
  114    H    GLU  15           HN       GLU  15  11.122  -5.749  -0.202
  115    HA   GLU  15           HA       GLU  15  10.648  -8.538  -0.454
  116   1HB   GLU  15          HB2       GLU  15  12.457  -6.896   1.317
  117   2HB   GLU  15          HB1       GLU  15  12.383  -8.648   1.498
  118   1HG   GLU  15          HG2       GLU  15  14.194  -8.141  -0.017
  119   2HG   GLU  15          HG1       GLU  15  12.890  -8.849  -0.967
  120    H    GLU  16           HN       GLU  16   9.911  -6.326   2.243
  121    HA   GLU  16           HA       GLU  16   9.031  -8.430   4.010
  122   1HB   GLU  16          HB2       GLU  16   9.685  -6.188   4.824
  123   2HB   GLU  16          HB1       GLU  16   8.294  -5.490   3.999
  124   1HG   GLU  16          HG2       GLU  16   6.772  -6.844   5.383
  125   2HG   GLU  16          HG1       GLU  16   8.155  -7.583   6.191
  126    H    LEU  17           HN       LEU  17   7.238  -6.192   1.853
  127    HA   LEU  17           HA       LEU  17   4.648  -7.220   2.502
  128   1HB   LEU  17          HB2       LEU  17   5.678  -5.892  -0.018
  129   2HB   LEU  17          HB1       LEU  17   3.979  -6.253   0.273
  130    HG   LEU  17           HG       LEU  17   5.708  -4.531   2.072
  131   1HD1  LEU  17          HD11      LEU  17   5.283  -3.567  -0.198
  132   2HD1  LEU  17          HD12      LEU  17   4.537  -2.633   1.100
  133   3HD1  LEU  17          HD13      LEU  17   3.552  -3.707   0.107
  134   1HD2  LEU  17          HD21      LEU  17   2.844  -5.462   2.157
  135   2HD2  LEU  17          HD22      LEU  17   3.215  -3.842   2.748
  136   3HD2  LEU  17          HD23      LEU  17   3.989  -5.242   3.481
  137    H    VAL  18           HN       VAL  18   7.000  -8.148   0.017
  138    HA   VAL  18           HA       VAL  18   5.331 -10.063  -1.306
  139    HB   VAL  18           HB       VAL  18   8.338  -9.785  -1.077
  140   1HG1  VAL  18          HG11      VAL  18   6.662 -11.707  -2.703
  141   2HG1  VAL  18          HG12      VAL  18   7.983 -12.091  -1.599
  142   3HG1  VAL  18          HG13      VAL  18   8.321 -11.295  -3.135
  143   1HG2  VAL  18          HG21      VAL  18   8.194  -8.745  -3.218
  144   2HG2  VAL  18          HG22      VAL  18   6.897  -8.028  -2.262
  145   3HG2  VAL  18          HG23      VAL  18   6.532  -9.282  -3.445
  146    H    ASN  19           HN       ASN  19   7.711 -10.407   1.318
  147    HA   ASN  19           HA       ASN  19   7.609 -13.228   1.556
  148   1HB   ASN  19          HB2       ASN  19   9.303 -11.837   2.669
  149   2HB   ASN  19          HB1       ASN  19   8.062 -11.157   3.722
  150   1HD2  ASN  19          HD21      ASN  19   9.572 -14.305   2.837
  151   2HD2  ASN  19          HD22      ASN  19   9.291 -15.032   4.345
  152    H    ILE  20           HN       ILE  20   5.592 -10.762   3.191
  153    HA   ILE  20           HA       ILE  20   4.149 -12.774   4.712
  154    HB   ILE  20           HB       ILE  20   2.715 -10.904   5.416
  155   1HG1  ILE  20          HG12      ILE  20   4.325  -9.331   3.384
  156   2HG1  ILE  20          HG11      ILE  20   2.613  -9.717   3.259
  157   1HG2  ILE  20          HG21      ILE  20   4.425  -9.646   6.553
  158   2HG2  ILE  20          HG22      ILE  20   5.617 -10.043   5.315
  159   3HG2  ILE  20          HG23      ILE  20   5.014 -11.301   6.395
  160   1HD1  ILE  20          HD11      ILE  20   2.725  -7.487   4.116
  161   2HD1  ILE  20          HD12      ILE  20   3.949  -7.936   5.303
  162   3HD1  ILE  20          HD13      ILE  20   2.295  -8.521   5.479
  163    H    THR  21           HN       THR  21   3.713 -11.463   1.504
  164    HA   THR  21           HA       THR  21   0.860 -12.337   1.460
  165    HB   THR  21           HB       THR  21   0.912 -11.385  -0.874
  166    HG1  THR  21           HG1      THR  21   3.225 -11.683  -1.060
  167   1HG2  THR  21          HG21      THR  21   0.712  -9.156  -0.165
  168   2HG2  THR  21          HG22      THR  21   1.962  -9.333   1.062
  169   3HG2  THR  21          HG23      THR  21   0.380 -10.071   1.304
  170    H    GLN  22           HN       GLN  22   4.014 -13.353   0.298
  171    HA   GLN  22           HA       GLN  22   2.929 -15.224  -1.653
  172   1HB   GLN  22          HB2       GLN  22   5.675 -14.920  -0.416
  173   2HB   GLN  22          HB1       GLN  22   5.293 -16.139  -1.632
  174   1HG   GLN  22          HG2       GLN  22   4.820 -13.174  -2.035
  175   2HG   GLN  22          HG1       GLN  22   6.279 -14.009  -2.568
  176   1HE2  GLN  22          HE21      GLN  22   3.427 -12.918  -3.786
  177   2HE2  GLN  22          HE22      GLN  22   3.154 -14.077  -4.996
  178    H    ASN  23           HN       ASN  23   3.854 -15.374   1.740
  179    HA   ASN  23           HA       ASN  23   3.355 -18.318   1.789
  180   1HB   ASN  23          HB2       ASN  23   4.540 -16.418   3.832
  181   2HB   ASN  23          HB1       ASN  23   4.290 -18.142   4.107
  182   1HD2  ASN  23          HD21      ASN  23   6.915 -16.919   4.109
  183   2HD2  ASN  23          HD22      ASN  23   7.781 -17.550   2.792
  184    H    GLN  24           HN       GLN  24   1.260 -15.964   1.764
  185    HA   GLN  24           HA       GLN  24  -0.034 -16.320   4.377
  186   1HB   GLN  24          HB2       GLN  24  -1.627 -14.709   3.643
  187   2HB   GLN  24          HB1       GLN  24  -0.085 -14.177   2.980
  188   1HG   GLN  24          HG2       GLN  24  -0.695 -15.369   0.832
  189   2HG   GLN  24          HG1       GLN  24  -2.302 -15.635   1.510
  190   1HE2  GLN  24          HE21      GLN  24  -2.887 -14.210  -0.479
  191   2HE2  GLN  24          HE22      GLN  24  -2.880 -12.529  -0.240
  192    H    LYS  25           HN       LYS  25  -1.614 -17.784   4.855
  193    HA   LYS  25           HA       LYS  25  -2.415 -19.711   2.760
  194   1HB   LYS  25          HB2       LYS  25  -1.777 -20.508   5.036
  195   2HB   LYS  25          HB1       LYS  25  -3.142 -19.618   5.708
  196   1HG   LYS  25          HG2       LYS  25  -4.696 -20.949   4.320
  197   2HG   LYS  25          HG1       LYS  25  -3.328 -21.841   3.653
  198   1HD   LYS  25          HD2       LYS  25  -2.745 -22.658   5.897
  199   2HD   LYS  25          HD1       LYS  25  -4.087 -21.744   6.588
  200   1HE   LYS  25          HE2       LYS  25  -4.516 -23.788   4.403
  201   2HE   LYS  25          HE1       LYS  25  -4.511 -24.235   6.110
  202   1HZ   LYS  25          HZ1       LYS  25  -6.199 -22.040   5.069
  203   2HZ   LYS  25          HZ2       LYS  25  -6.340 -22.870   6.546
  204   3HZ   LYS  25          HZ3       LYS  25  -6.734 -23.650   5.089
  205    H    ALA  26           HN       ALA  26  -4.447 -18.379   5.365
  206    HA   ALA  26           HA       ALA  26  -6.684 -18.142   3.493
  207   1HB   ALA  26          HB1       ALA  26  -6.421 -18.469   6.284
  208   2HB   ALA  26          HB2       ALA  26  -7.934 -18.271   5.405
  209   3HB   ALA  26          HB3       ALA  26  -7.127 -16.865   6.099
  210    HA   PRO  27           HA       PRO  27  -6.226 -13.926   2.236
  211   1HB   PRO  27          HB2       PRO  27  -8.727 -13.026   3.499
  212   2HB   PRO  27          HB1       PRO  27  -8.329 -13.146   1.784
  213   1HG   PRO  27          HG2       PRO  27 -10.040 -14.875   3.249
  214   2HG   PRO  27          HG1       PRO  27  -9.461 -15.115   1.596
  215   1HD   PRO  27          HD2       PRO  27  -8.729 -16.618   3.966
  216   2HD   PRO  27          HD1       PRO  27  -8.165 -16.866   2.294
  217    H    LEU  28           HN       LEU  28  -5.723 -11.768   3.106
  218    HA   LEU  28           HA       LEU  28  -4.598 -11.849   5.764
  219   1HB   LEU  28          HB2       LEU  28  -5.058  -9.544   3.852
  220   2HB   LEU  28          HB1       LEU  28  -4.129  -9.419   5.343
  221    HG   LEU  28           HG       LEU  28  -3.497 -11.398   3.132
  222   1HD1  LEU  28          HD11      LEU  28  -1.600  -9.802   2.637
  223   2HD1  LEU  28          HD12      LEU  28  -2.399  -8.630   3.685
  224   3HD1  LEU  28          HD13      LEU  28  -3.199  -9.189   2.216
  225   1HD2  LEU  28          HD21      LEU  28  -2.177 -10.593   5.727
  226   2HD2  LEU  28          HD22      LEU  28  -1.187 -11.175   4.390
  227   3HD2  LEU  28          HD23      LEU  28  -2.439 -12.207   5.069
  228    H    CYS  29           HN       CYS  29  -7.731 -11.102   4.586
  229    HA   CYS  29           HA       CYS  29  -8.546 -10.262   7.320
  230   1HB   CYS  29          HB2       CYS  29  -9.224  -8.689   4.815
  231   2HB   CYS  29          HB1       CYS  29  -9.856  -8.368   6.430
  232    H    ASN  30           HN       ASN  30 -10.998 -10.271   7.477
  233    HA   ASN  30           HA       ASN  30 -12.031 -12.725   6.416
  234   1HB   ASN  30          HB2       ASN  30 -14.129 -12.060   7.473
  235   2HB   ASN  30          HB1       ASN  30 -12.787 -11.699   8.554
  236   1HD2  ASN  30          HD21      ASN  30 -15.328 -10.316   8.696
  237   2HD2  ASN  30          HD22      ASN  30 -15.054  -8.691   8.287
  238    H    GLY  31           HN       GLY  31 -11.179 -11.329   4.182
  239   1HA   GLY  31          HA2       GLY  31 -12.019 -10.978   2.001
  240   2HA   GLY  31          HA1       GLY  31 -13.649 -11.200   2.635
  241    H    SER  32           HN       SER  32 -11.363  -8.871   3.974
  242    HA   SER  32           HA       SER  32 -13.234  -6.725   3.887
  243   1HB   SER  32          HB2       SER  32 -10.213  -6.705   4.077
  244   2HB   SER  32          HB1       SER  32 -11.211  -5.267   4.268
  245    HG   SER  32           HG       SER  32 -11.573  -7.650   5.765
  246    H    MET  33           HN       MET  33 -13.625  -5.141   2.382
  247    HA   MET  33           HA       MET  33 -12.301  -5.439  -0.292
  248   1HB   MET  33          HB2       MET  33 -14.972  -4.203   0.454
  249   2HB   MET  33          HB1       MET  33 -14.331  -4.355  -1.177
  250   1HG   MET  33          HG2       MET  33 -14.834  -6.701   0.667
  251   2HG   MET  33          HG1       MET  33 -15.958  -6.166  -0.582
  252   1HE   MET  33          HE1       MET  33 -15.477  -5.782  -2.822
  253   2HE   MET  33          HE2       MET  33 -14.547  -6.871  -3.846
  254   3HE   MET  33          HE3       MET  33 -13.782  -5.430  -3.184
  255    H    VAL  34           HN       VAL  34 -11.442  -3.577  -1.291
  256    HA   VAL  34           HA       VAL  34 -11.482  -1.032   0.300
  257    HB   VAL  34           HB       VAL  34  -9.077  -0.725  -0.399
  258   1HG1  VAL  34          HG11      VAL  34  -9.681  -3.174   1.288
  259   2HG1  VAL  34          HG12      VAL  34  -9.723  -1.509   1.866
  260   3HG1  VAL  34          HG13      VAL  34  -8.198  -2.222   1.341
  261   1HG2  VAL  34          HG21      VAL  34  -9.219  -3.693  -0.992
  262   2HG2  VAL  34          HG22      VAL  34  -7.836  -2.621  -1.214
  263   3HG2  VAL  34          HG23      VAL  34  -9.253  -2.459  -2.252
  264    H    TRP  35           HN       TRP  35 -11.001   0.888  -1.010
  265    HA   TRP  35           HA       TRP  35 -12.357   0.793  -3.583
  266   1HB   TRP  35          HB2       TRP  35 -10.874   2.997  -2.124
  267   2HB   TRP  35          HB1       TRP  35 -11.698   3.236  -3.663
  268    HD1  TRP  35           HD1      TRP  35 -12.315   2.765   0.033
  269    HE1  TRP  35           HE1      TRP  35 -14.815   3.134   0.533
  270    HE3  TRP  35           HE3      TRP  35 -14.136   3.002  -4.731
  271    HZ2  TRP  35           HZ2      TRP  35 -17.267   3.482  -0.901
  272    HZ3  TRP  35           HZ3      TRP  35 -16.559   3.348  -5.134
  273    HH2  TRP  35           HH2      TRP  35 -18.124   3.590  -3.227
  274    H    SER  36           HN       SER  36 -11.426   0.641  -5.592
  275    HA   SER  36           HA       SER  36  -8.595   0.068  -5.830
  276   1HB   SER  36          HB2       SER  36  -9.017  -0.106  -8.200
  277   2HB   SER  36          HB1       SER  36 -10.413  -0.797  -7.379
  278    HG   SER  36           HG       SER  36 -10.433   1.939  -7.922
  279    H    ILE  37           HN       ILE  37  -7.033   1.443  -6.983
  280    HA   ILE  37           HA       ILE  37  -7.785   4.340  -7.143
  281    HB   ILE  37           HB       ILE  37  -5.539   4.860  -6.123
  282   1HG1  ILE  37          HG12      ILE  37  -5.599   2.001  -5.131
  283   2HG1  ILE  37          HG11      ILE  37  -4.711   2.446  -6.587
  284   1HG2  ILE  37          HG21      ILE  37  -7.581   5.031  -4.790
  285   2HG2  ILE  37          HG22      ILE  37  -6.285   4.367  -3.794
  286   3HG2  ILE  37          HG23      ILE  37  -7.531   3.302  -4.445
  287   1HD1  ILE  37          HD11      ILE  37  -3.269   3.910  -5.393
  288   2HD1  ILE  37          HD12      ILE  37  -3.384   2.461  -4.394
  289   3HD1  ILE  37          HD13      ILE  37  -4.312   3.900  -3.970
  290    H    ASN  38           HN       ASN  38  -6.119   5.599  -8.382
  291    HA   ASN  38           HA       ASN  38  -5.291   4.047 -10.753
  292   1HB   ASN  38          HB2       ASN  38  -4.694   6.269 -11.679
  293   2HB   ASN  38          HB1       ASN  38  -6.349   6.254 -11.070
  294   1HD2  ASN  38          HD21      ASN  38  -4.838   8.693 -11.309
  295   2HD2  ASN  38          HD22      ASN  38  -4.560   9.295  -9.746
  296    H    LEU  39           HN       LEU  39  -3.301   3.112 -10.766
  297    HA   LEU  39           HA       LEU  39  -1.305   3.873  -8.779
  298   1HB   LEU  39          HB2       LEU  39  -1.249   1.904 -11.083
  299   2HB   LEU  39          HB1       LEU  39   0.098   2.139  -9.975
  300    HG   LEU  39           HG       LEU  39  -1.294   0.208  -9.312
  301   1HD1  LEU  39          HD11      LEU  39  -1.875   2.275  -7.211
  302   2HD1  LEU  39          HD12      LEU  39  -0.195   1.936  -7.632
  303   3HD1  LEU  39          HD13      LEU  39  -1.233   0.642  -7.039
  304   1HD2  LEU  39          HD21      LEU  39  -3.535   2.103  -8.622
  305   2HD2  LEU  39          HD22      LEU  39  -3.580   0.352  -8.811
  306   3HD2  LEU  39          HD23      LEU  39  -3.438   1.386 -10.232
  307    H    THR  40           HN       THR  40  -0.189   5.744  -9.108
  308    HA   THR  40           HA       THR  40   1.146   6.139 -11.741
  309    HB   THR  40           HB       THR  40   0.537   8.557 -11.688
  310    HG1  THR  40           HG1      THR  40  -0.500   7.753  -9.301
  311   1HG2  THR  40          HG21      THR  40  -0.805   6.735 -12.907
  312   2HG2  THR  40          HG22      THR  40  -1.623   8.271 -12.622
  313   3HG2  THR  40          HG23      THR  40  -1.972   6.882 -11.592
  314    H    ALA  41           HN       ALA  41   1.058   8.766  -9.506
  315    HA   ALA  41           HA       ALA  41   3.862   8.119  -8.647
  316   1HB   ALA  41          HB1       ALA  41   3.579  10.185 -10.005
  317   2HB   ALA  41          HB2       ALA  41   4.164  10.528  -8.376
  318   3HB   ALA  41          HB3       ALA  41   2.472  10.810  -8.783
  319    H    GLY  42           HN       GLY  42   1.146  10.100  -7.389
  320   1HA   GLY  42          HA2       GLY  42   1.976   9.768  -4.652
  321   2HA   GLY  42          HA1       GLY  42   0.407  10.383  -5.175
  322    H    MET  43           HN       MET  43   1.843   7.220  -5.904
  323    HA   MET  43           HA       MET  43  -0.566   5.789  -5.402
  324   1HB   MET  43          HB2       MET  43   2.306   4.826  -5.353
  325   2HB   MET  43          HB1       MET  43   0.891   3.779  -5.435
  326   1HG   MET  43          HG2       MET  43   0.221   5.034  -7.527
  327   2HG   MET  43          HG1       MET  43   1.801   5.808  -7.487
  328   1HE   MET  43          HE1       MET  43   3.663   3.091  -6.348
  329   2HE   MET  43          HE2       MET  43   3.844   4.675  -7.100
  330   3HE   MET  43          HE3       MET  43   4.362   3.233  -7.967
  331    H    TYR  44           HN       TYR  44   2.265   6.413  -3.343
  332    HA   TYR  44           HA       TYR  44   1.533   4.750  -1.161
  333   1HB   TYR  44          HB2       TYR  44   3.047   7.377  -1.176
  334   2HB   TYR  44          HB1       TYR  44   2.998   6.252   0.183
  335    HD1  TYR  44           HD1      TYR  44   4.243   4.179   0.149
  336    HD2  TYR  44           HD2      TYR  44   4.113   6.723  -3.309
  337    HE1  TYR  44           HE1      TYR  44   6.073   2.863  -0.890
  338    HE2  TYR  44           HE2      TYR  44   5.944   5.412  -4.346
  339    HH   TYR  44           HH       TYR  44   7.677   3.923  -3.791
  340    H    CYS  45           HN       CYS  45   0.841   8.212  -1.712
  341    HA   CYS  45           HA       CYS  45  -0.712   8.503   0.692
  342   1HB   CYS  45          HB2       CYS  45  -0.628  10.137  -1.854
  343   2HB   CYS  45          HB1       CYS  45  -1.512  10.616  -0.404
  344    H    ALA  46           HN       ALA  46  -1.692   8.058  -2.729
  345    HA   ALA  46           HA       ALA  46  -4.497   8.032  -2.233
  346   1HB   ALA  46          HB1       ALA  46  -4.592   6.670  -4.374
  347   2HB   ALA  46          HB2       ALA  46  -2.829   6.676  -4.368
  348   3HB   ALA  46          HB3       ALA  46  -3.716   8.194  -4.504
  349    H    ALA  47           HN       ALA  47  -2.108   5.392  -2.224
  350    HA   ALA  47           HA       ALA  47  -4.014   3.308  -1.712
  351   1HB   ALA  47          HB1       ALA  47  -1.894   2.600  -2.500
  352   2HB   ALA  47          HB2       ALA  47  -1.927   2.092  -0.812
  353   3HB   ALA  47          HB3       ALA  47  -1.035   3.539  -1.280
  354    H    LEU  48           HN       LEU  48  -2.091   5.390   0.437
  355    HA   LEU  48           HA       LEU  48  -2.696   4.066   2.867
  356   1HB   LEU  48          HB2       LEU  48  -0.973   5.805   2.706
  357   2HB   LEU  48          HB1       LEU  48  -2.206   7.017   2.372
  358    HG   LEU  48           HG       LEU  48  -3.195   6.665   4.593
  359   1HD1  LEU  48          HD11      LEU  48  -1.703   5.231   6.203
  360   2HD1  LEU  48          HD12      LEU  48  -1.134   4.464   4.720
  361   3HD1  LEU  48          HD13      LEU  48  -2.845   4.405   5.146
  362   1HD2  LEU  48          HD21      LEU  48  -0.182   7.007   4.741
  363   2HD2  LEU  48          HD22      LEU  48  -1.352   7.581   5.929
  364   3HD2  LEU  48          HD23      LEU  48  -1.322   8.282   4.311
  365    H    GLU  49           HN       GLU  49  -4.442   6.838   1.354
  366    HA   GLU  49           HA       GLU  49  -6.443   7.016   3.369
  367   1HB   GLU  49          HB2       GLU  49  -7.894   7.975   1.498
  368   2HB   GLU  49          HB1       GLU  49  -6.350   8.785   1.771
  369   1HG   GLU  49          HG2       GLU  49  -5.345   7.508  -0.066
  370   2HG   GLU  49          HG1       GLU  49  -6.877   6.682  -0.344
  371    H    SER  50           HN       SER  50  -6.278   4.960   0.461
  372    HA   SER  50           HA       SER  50  -8.910   3.857   0.762
  373   1HB   SER  50          HB2       SER  50  -6.397   2.763  -0.523
  374   2HB   SER  50          HB1       SER  50  -7.952   1.940  -0.597
  375    HG   SER  50           HG       SER  50  -8.252   4.535  -1.207
  376    H    LEU  51           HN       LEU  51  -5.734   2.849   2.011
  377    HA   LEU  51           HA       LEU  51  -6.722   0.467   3.314
  378   1HB   LEU  51          HB2       LEU  51  -4.224   2.128   3.724
  379   2HB   LEU  51          HB1       LEU  51  -4.536   0.633   4.600
  380    HG   LEU  51           HG       LEU  51  -4.496   0.838   1.572
  381   1HD1  LEU  51          HD11      LEU  51  -2.332  -0.031   3.511
  382   2HD1  LEU  51          HD12      LEU  51  -2.274   1.352   2.419
  383   3HD1  LEU  51          HD13      LEU  51  -2.267  -0.287   1.767
  384   1HD2  LEU  51          HD21      LEU  51  -4.029  -1.737   2.006
  385   2HD2  LEU  51          HD22      LEU  51  -5.678  -1.128   2.050
  386   3HD2  LEU  51          HD23      LEU  51  -4.807  -1.415   3.555
  387    H    ILE  52           HN       ILE  52  -6.485   3.843   4.264
  388    HA   ILE  52           HA       ILE  52  -6.725   3.566   7.063
  389    HB   ILE  52           HB       ILE  52  -7.637   5.685   5.117
  390   1HG1  ILE  52          HG12      ILE  52  -5.192   5.275   5.807
  391   2HG1  ILE  52          HG11      ILE  52  -5.794   6.921   5.940
  392   1HG2  ILE  52          HG21      ILE  52  -8.123   5.613   8.099
  393   2HG2  ILE  52          HG22      ILE  52  -9.283   5.939   6.811
  394   3HG2  ILE  52          HG23      ILE  52  -8.038   7.126   7.196
  395   1HD1  ILE  52          HD11      ILE  52  -6.177   5.328   8.408
  396   2HD1  ILE  52          HD12      ILE  52  -5.528   6.950   8.197
  397   3HD1  ILE  52          HD13      ILE  52  -4.493   5.549   7.945
  398    H    ASN  53           HN       ASN  53  -8.998   2.799   4.597
  399    HA   ASN  53           HA       ASN  53 -11.333   2.962   6.393
  400   1HB   ASN  53          HB2       ASN  53 -10.970   1.933   3.564
  401   2HB   ASN  53          HB1       ASN  53 -12.507   1.875   4.429
  402   1HD2  ASN  53          HD21      ASN  53 -12.809   4.255   5.642
  403   2HD2  ASN  53          HD22      ASN  53 -12.673   5.554   4.559
  404    H    VAL  54           HN       VAL  54  -8.814   0.779   5.789
  405    HA   VAL  54           HA       VAL  54 -10.395  -1.635   6.455
  406    HB   VAL  54           HB       VAL  54  -7.433  -1.244   5.918
  407   1HG1  VAL  54          HG11      VAL  54  -7.546  -3.786   5.660
  408   2HG1  VAL  54          HG12      VAL  54  -9.109  -3.700   6.473
  409   3HG1  VAL  54          HG13      VAL  54  -7.649  -3.174   7.310
  410   1HG2  VAL  54          HG21      VAL  54  -8.654  -0.896   3.892
  411   2HG2  VAL  54          HG22      VAL  54  -9.770  -2.212   4.257
  412   3HG2  VAL  54          HG23      VAL  54  -8.098  -2.569   3.825
  413    H    SER  55           HN       SER  55 -10.757  -2.129   8.556
  414    HA   SER  55           HA       SER  55  -8.690  -1.378  10.602
  415   1HB   SER  55          HB2       SER  55 -11.704  -1.128  10.780
  416   2HB   SER  55          HB1       SER  55 -10.638  -1.037  12.179
  417    HG   SER  55           HG       SER  55 -10.666   0.640   9.886
  418    H    GLY  56           HN       GLY  56  -8.389  -2.895  12.259
  419   1HA   GLY  56          HA2       GLY  56  -8.872  -4.889  13.504
  420   2HA   GLY  56          HA1       GLY  56 -10.074  -5.335  12.296
  421    H    CYS  57           HN       CYS  57  -7.667  -4.501  10.337
  422    HA   CYS  57           HA       CYS  57  -6.628  -7.292  10.208
  423   1HB   CYS  57          HB2       CYS  57  -6.430  -4.965   8.271
  424   2HB   CYS  57          HB1       CYS  57  -5.702  -6.548   8.004
  425    H    SER  58           HN       SER  58  -5.147  -7.172  11.985
  426    HA   SER  58           HA       SER  58  -3.147  -5.102  12.192
  427   1HB   SER  58          HB2       SER  58  -3.908  -6.611  14.077
  428   2HB   SER  58          HB1       SER  58  -2.993  -7.909  13.318
  429    HG   SER  58           HG       SER  58  -1.214  -6.234  13.380
  430    H    ALA  59           HN       ALA  59  -3.333  -8.174  10.519
  431    HA   ALA  59           HA       ALA  59  -0.655  -8.749  10.012
  432   1HB   ALA  59          HB1       ALA  59  -3.064  -8.979   8.196
  433   2HB   ALA  59          HB2       ALA  59  -2.329 -10.245   9.180
  434   3HB   ALA  59          HB3       ALA  59  -1.479  -9.621   7.766
  435    H    ILE  60           HN       ILE  60  -2.340  -5.908   9.068
  436    HA   ILE  60           HA       ILE  60  -0.096  -5.190   7.192
  437    HB   ILE  60           HB       ILE  60  -1.785  -3.816   5.960
  438   1HG1  ILE  60          HG12      ILE  60  -3.747  -5.346   7.693
  439   2HG1  ILE  60          HG11      ILE  60  -3.387  -3.632   7.870
  440   1HG2  ILE  60          HG21      ILE  60  -1.153  -6.090   5.199
  441   2HG2  ILE  60          HG22      ILE  60  -2.841  -5.736   4.832
  442   3HG2  ILE  60          HG23      ILE  60  -2.434  -6.772   6.200
  443   1HD1  ILE  60          HD11      ILE  60  -5.349  -3.692   6.541
  444   2HD1  ILE  60          HD12      ILE  60  -4.744  -5.028   5.562
  445   3HD1  ILE  60          HD13      ILE  60  -4.043  -3.418   5.388
  446    H    GLU  61           HN       GLU  61  -1.182  -4.505  10.206
  447    HA   GLU  61           HA       GLU  61  -1.494  -1.664  10.187
  448   1HB   GLU  61          HB2       GLU  61  -0.970  -1.717  12.549
  449   2HB   GLU  61          HB1       GLU  61  -1.912  -3.157  12.184
  450   1HG   GLU  61          HG2       GLU  61   0.281  -4.407  11.923
  451   2HG   GLU  61          HG1       GLU  61   1.087  -2.976  12.565
  452    H    LYS  62           HN       LYS  62   1.378  -3.729  10.354
  453    HA   LYS  62           HA       LYS  62   3.304  -1.645  10.705
  454   1HB   LYS  62          HB2       LYS  62   3.498  -4.358   9.367
  455   2HB   LYS  62          HB1       LYS  62   4.890  -3.311   9.655
  456   1HG   LYS  62          HG2       LYS  62   4.395  -3.311  12.069
  457   2HG   LYS  62          HG1       LYS  62   3.006  -4.360  11.784
  458   1HD   LYS  62          HD2       LYS  62   4.500  -6.093  10.857
  459   2HD   LYS  62          HD1       LYS  62   5.891  -5.047  11.145
  460   1HE   LYS  62          HE2       LYS  62   5.527  -5.108  13.534
  461   2HE   LYS  62          HE1       LYS  62   3.998  -5.962  13.326
  462   1HZ   LYS  62          HZ1       LYS  62   5.495  -7.661  12.084
  463   2HZ   LYS  62          HZ2       LYS  62   5.420  -7.677  13.781
  464   3HZ   LYS  62          HZ3       LYS  62   6.741  -6.955  12.994
  465    H    THR  63           HN       THR  63   1.825  -3.086   7.828
  466    HA   THR  63           HA       THR  63   3.386  -1.729   5.882
  467    HB   THR  63           HB       THR  63   0.491  -2.599   5.704
  468    HG1  THR  63           HG1      THR  63   2.300  -4.108   4.415
  469   1HG2  THR  63          HG21      THR  63   2.531  -1.729   3.656
  470   2HG2  THR  63          HG22      THR  63   0.882  -1.143   3.875
  471   3HG2  THR  63          HG23      THR  63   1.165  -2.756   3.221
  472    H    GLN  64           HN       GLN  64   0.426  -0.752   7.589
  473    HA   GLN  64           HA       GLN  64  -0.091   1.604   6.098
  474   1HB   GLN  64          HB2       GLN  64  -0.656   0.918   8.988
  475   2HB   GLN  64          HB1       GLN  64  -1.249   2.387   8.211
  476   1HG   GLN  64          HG2       GLN  64  -2.404   1.039   6.509
  477   2HG   GLN  64          HG1       GLN  64  -1.793  -0.440   7.253
  478   1HE2  GLN  64          HE21      GLN  64  -4.657   0.588   6.976
  479   2HE2  GLN  64          HE22      GLN  64  -5.265   0.584   8.561
  480    H    ARG  65           HN       ARG  65   1.875   1.262   9.109
  481    HA   ARG  65           HA       ARG  65   2.543   4.062   9.131
  482   1HB   ARG  65          HB2       ARG  65   4.398   3.381  10.680
  483   2HB   ARG  65          HB1       ARG  65   2.806   2.810  11.173
  484   1HG   ARG  65          HG2       ARG  65   3.278   0.615  10.179
  485   2HG   ARG  65          HG1       ARG  65   4.875   1.173   9.678
  486   1HD   ARG  65          HD2       ARG  65   5.442   1.617  12.053
  487   2HD   ARG  65          HD1       ARG  65   3.859   1.012  12.533
  488    HE   ARG  65           HE       ARG  65   4.979  -1.065  11.052
  489   1HH1  ARG  65          HH21      ARG  65   5.850   0.869  13.768
  490   2HH1  ARG  65          HH22      ARG  65   6.791  -0.374  14.523
  491   1HH2  ARG  65          HH11      ARG  65   6.208  -2.704  12.023
  492   2HH2  ARG  65          HH12      ARG  65   6.995  -2.395  13.535
  493    H    MET  66           HN       MET  66   4.168   1.222   7.707
  494    HA   MET  66           HA       MET  66   6.514   2.647   6.895
  495   1HB   MET  66          HB2       MET  66   5.194   0.173   5.747
  496   2HB   MET  66          HB1       MET  66   6.737   0.803   5.169
  497   1HG   MET  66          HG2       MET  66   7.566   0.688   7.568
  498   2HG   MET  66          HG1       MET  66   6.087  -0.188   7.956
  499   1HE   MET  66          HE1       MET  66   5.606  -2.112   5.346
  500   2HE   MET  66          HE2       MET  66   5.328  -2.223   7.083
  501   3HE   MET  66          HE3       MET  66   6.252  -3.479   6.263
  502    H    LEU  67           HN       LEU  67   3.365   2.168   5.279
  503    HA   LEU  67           HA       LEU  67   4.096   3.401   2.803
  504   1HB   LEU  67          HB2       LEU  67   1.426   3.258   4.222
  505   2HB   LEU  67          HB1       LEU  67   1.622   3.934   2.609
  506    HG   LEU  67           HG       LEU  67   2.467   1.125   3.370
  507   1HD1  LEU  67          HD11      LEU  67   0.411   0.422   2.138
  508   2HD1  LEU  67          HD12      LEU  67  -0.069   2.116   2.040
  509   3HD1  LEU  67          HD13      LEU  67   0.050   1.323   3.611
  510   1HD2  LEU  67          HD21      LEU  67   3.654   1.593   1.423
  511   2HD2  LEU  67          HD22      LEU  67   2.446   2.727   0.823
  512   3HD2  LEU  67          HD23      LEU  67   2.152   0.992   0.729
  513    H    SER  68           HN       SER  68   2.909   4.757   5.858
  514    HA   SER  68           HA       SER  68   2.529   7.428   5.011
  515   1HB   SER  68          HB2       SER  68   3.462   6.316   7.667
  516   2HB   SER  68          HB1       SER  68   3.078   8.016   7.414
  517    HG   SER  68           HG       SER  68   1.324   6.638   8.204
  518    H    GLY  69           HN       GLY  69   5.485   5.698   5.906
  519   1HA   GLY  69          HA2       GLY  69   7.297   7.818   6.152
  520   2HA   GLY  69          HA1       GLY  69   7.725   6.262   5.434
  521    H    PHE  70           HN       PHE  70   5.721   6.569   3.279
  522    HA   PHE  70           HA       PHE  70   7.320   8.366   1.522
  523   1HB   PHE  70          HB2       PHE  70   5.252   6.231   0.943
  524   2HB   PHE  70          HB1       PHE  70   6.009   7.225  -0.301
  525    HD1  PHE  70           HD1      PHE  70   8.384   6.979  -0.848
  526    HD2  PHE  70           HD2      PHE  70   6.528   4.543   2.165
  527    HE1  PHE  70           HE1      PHE  70  10.336   5.450  -0.880
  528    HE2  PHE  70           HE2      PHE  70   8.482   3.015   2.133
  529    HZ   PHE  70           HZ       PHE  70  10.386   3.469   0.610
  530    H    CYS  71           HN       CYS  71   4.528   8.447   3.373
  531    HA   CYS  71           HA       CYS  71   3.424  10.725   1.766
  532   1HB   CYS  71          HB2       CYS  71   2.091   8.548   1.547
  533   2HB   CYS  71          HB1       CYS  71   1.704   8.734   3.257
  534    HA   PRO  72           HA       PRO  72   4.555  11.806   6.203
  535   1HB   PRO  72          HB2       PRO  72   4.654  14.505   4.971
  536   2HB   PRO  72          HB1       PRO  72   5.858  13.678   5.969
  537   1HG   PRO  72          HG2       PRO  72   6.125  14.046   3.258
  538   2HG   PRO  72          HG1       PRO  72   6.902  12.731   4.150
  539   1HD   PRO  72          HD2       PRO  72   4.623  12.606   2.260
  540   2HD   PRO  72          HD1       PRO  72   5.711  11.299   2.794
  541    H    HIS  73           HN       HIS  73   1.997  12.903   4.069
  542    HA   HIS  73           HA       HIS  73   0.650  14.330   6.308
  543   1HB   HIS  73          HB2       HIS  73  -0.793  15.272   4.715
  544   2HB   HIS  73          HB1       HIS  73   0.733  15.165   3.847
  545    HD1  HIS  73           HD1      HIS  73  -2.700  13.648   4.014
  546    HD2  HIS  73           HD2      HIS  73   0.753  13.272   1.714
  547    HE1  HIS  73           HE1      HIS  73  -3.333  12.276   1.979
  548    H    LYS  74           HN       LYS  74  -0.414  13.043   7.702
  549    HA   LYS  74           HA       LYS  74  -1.370  10.399   6.951
  550   1HB   LYS  74          HB2       LYS  74  -1.731  12.061   9.460
  551   2HB   LYS  74          HB1       LYS  74  -2.306  10.402   9.288
  552   1HG   LYS  74          HG2       LYS  74  -0.006   9.648   8.813
  553   2HG   LYS  74          HG1       LYS  74   0.573  11.305   8.988
  554   1HD   LYS  74          HD2       LYS  74  -0.225  11.341  11.322
  555   2HD   LYS  74          HD1       LYS  74  -0.800   9.682  11.150
  556   1HE   LYS  74          HE2       LYS  74   1.371   9.602  12.213
  557   2HE   LYS  74          HE1       LYS  74   1.555   9.007  10.563
  558   1HZ   LYS  74          HZ1       LYS  74   2.738  10.807   9.943
  559   2HZ   LYS  74          HZ2       LYS  74   3.109  10.877  11.600
  560   3HZ   LYS  74          HZ3       LYS  74   1.890  11.870  10.957
  561    H    VAL  75           HN       VAL  75  -3.463   9.781   6.492
  562    HA   VAL  75           HA       VAL  75  -5.448  11.978   6.090
  563    HB   VAL  75           HB       VAL  75  -5.360   9.167   4.962
  564   1HG1  VAL  75          HG11      VAL  75  -7.163  10.194   3.445
  565   2HG1  VAL  75          HG12      VAL  75  -7.281  11.481   4.643
  566   3HG1  VAL  75          HG13      VAL  75  -7.648   9.816   5.097
  567   1HG2  VAL  75          HG21      VAL  75  -4.648  11.896   3.865
  568   2HG2  VAL  75          HG22      VAL  75  -5.022  10.535   2.807
  569   3HG2  VAL  75          HG23      VAL  75  -3.645  10.445   3.905
  570    H    SER  76           HN       SER  76  -7.389  11.948   7.144
  571    HA   SER  76           HA       SER  76  -7.713   9.940   9.307
  572   1HB   SER  76          HB2       SER  76  -9.149  12.533   8.668
  573   2HB   SER  76          HB1       SER  76  -9.583  11.479  10.011
  574    HG   SER  76           HG       SER  76  -7.385  11.726  10.731
  575    H    ALA  77           HN       ALA  77  -9.823   8.862   9.556
  576    HA   ALA  77           HA       ALA  77 -10.777   7.710   7.123
  577   1HB   ALA  77          HB1       ALA  77 -12.337   7.830   9.712
  578   2HB   ALA  77          HB2       ALA  77 -10.963   6.749   9.485
  579   3HB   ALA  77          HB3       ALA  77 -12.395   6.580   8.470
  580    H    GLY  78           HN       GLY  78 -11.303  10.778   8.359
  581   1HA   GLY  78          HA2       GLY  78 -14.029  11.037   7.166
  582   2HA   GLY  78          HA1       GLY  78 -13.255  12.217   8.223
  583    H    GLN  79           HN       GLN  79 -10.706  12.243   6.855
  584    HA   GLN  79           HA       GLN  79 -11.466  13.987   4.592
  585   1HB   GLN  79          HB2       GLN  79  -8.748  13.358   5.789
  586   2HB   GLN  79          HB1       GLN  79  -9.073  14.595   4.574
  587   1HG   GLN  79          HG2       GLN  79 -10.422  14.534   7.285
  588   2HG   GLN  79          HG1       GLN  79  -8.958  15.459   6.951
  589   1HE2  GLN  79          HE21      GLN  79 -11.936  16.259   7.483
  590   2HE2  GLN  79          HE22      GLN  79 -12.266  17.362   6.235
  591    H    PHE  80           HN       PHE  80 -11.564  13.194   2.568
  592    HA   PHE  80           HA       PHE  80  -9.902  10.794   1.848
  593   1HB   PHE  80          HB2       PHE  80 -12.679  11.602   0.945
  594   2HB   PHE  80          HB1       PHE  80 -11.730  10.327   0.185
  595    HD1  PHE  80           HD1      PHE  80 -13.791  11.242   3.030
  596    HD2  PHE  80           HD2      PHE  80 -11.002   8.329   1.543
  597    HE1  PHE  80           HE1      PHE  80 -14.511   9.653   4.792
  598    HE2  PHE  80           HE2      PHE  80 -11.729   6.739   3.302
  599    HZ   PHE  80           HZ       PHE  80 -13.481   7.401   4.926
  600    H    SER  81           HN       SER  81  -8.732  10.943  -0.086
  601    HA   SER  81           HA       SER  81  -8.895  13.576  -1.533
  602   1HB   SER  81          HB2       SER  81  -6.460  11.843  -1.073
  603   2HB   SER  81          HB1       SER  81  -6.490  13.400  -1.894
  604    HG   SER  81           HG       SER  81  -6.361  14.279   0.001
  605    H    SER  82           HN       SER  82  -8.223  10.081  -1.950
  606    HA   SER  82           HA       SER  82  -8.294  10.456  -4.907
  607   1HB   SER  82          HB2       SER  82  -6.473   9.124  -3.712
  608   2HB   SER  82          HB1       SER  82  -7.704   7.900  -3.414
  609    HG   SER  82           HG       SER  82  -7.047   8.962  -5.967
  610    H    LEU  83           HN       LEU  83 -10.491   9.568  -2.471
  611    HA   LEU  83           HA       LEU  83 -11.916   7.569  -4.108
  612   1HB   LEU  83          HB2       LEU  83 -12.400   8.841  -1.417
  613   2HB   LEU  83          HB1       LEU  83 -13.641   7.866  -2.188
  614    HG   LEU  83           HG       LEU  83 -11.925   6.014  -2.403
  615   1HD1  LEU  83          HD11      LEU  83 -10.367   7.980  -0.707
  616   2HD1  LEU  83          HD12      LEU  83  -9.854   7.179  -2.192
  617   3HD1  LEU  83          HD13      LEU  83 -10.019   6.252  -0.702
  618   1HD2  LEU  83          HD21      LEU  83 -12.650   7.039   0.358
  619   2HD2  LEU  83          HD22      LEU  83 -12.075   5.406   0.020
  620   3HD2  LEU  83          HD23      LEU  83 -13.613   5.955  -0.647
  621    H    HIS  84           HN       HIS  84 -11.607  10.407  -5.129
  622    HA   HIS  84           HA       HIS  84 -14.256  11.608  -4.940
  623   1HB   HIS  84          HB2       HIS  84 -12.131  12.118  -7.045
  624   2HB   HIS  84          HB1       HIS  84 -13.478  13.173  -6.623
  625    HD1  HIS  84           HD1      HIS  84 -12.845  12.319  -3.439
  626    HD2  HIS  84           HD2      HIS  84 -10.432  14.344  -6.168
  627    HE1  HIS  84           HE1      HIS  84 -11.150  13.607  -2.079
  628    H    VAL  85           HN       VAL  85 -12.571   9.534  -7.247
  629    HA   VAL  85           HA       VAL  85 -14.743   9.580  -9.188
  630    HB   VAL  85           HB       VAL  85 -12.563   7.493  -9.011
  631   1HG1  VAL  85          HG11      VAL  85 -12.789   7.613 -11.496
  632   2HG1  VAL  85          HG12      VAL  85 -14.103   8.771 -11.291
  633   3HG1  VAL  85          HG13      VAL  85 -14.283   7.119 -10.700
  634   1HG2  VAL  85          HG21      VAL  85 -11.371   9.557  -8.797
  635   2HG2  VAL  85          HG22      VAL  85 -12.408  10.358  -9.977
  636   3HG2  VAL  85          HG23      VAL  85 -11.271   9.116 -10.501
  637    H    ARG  86           HN       ARG  86 -16.195   7.827  -9.632
  638    HA   ARG  86           HA       ARG  86 -16.853   6.220  -7.233
  639   1HB   ARG  86          HB2       ARG  86 -18.277   6.670  -9.868
  640   2HB   ARG  86          HB1       ARG  86 -18.870   5.570  -8.621
  641   1HG   ARG  86          HG2       ARG  86 -18.872   7.429  -7.003
  642   2HG   ARG  86          HG1       ARG  86 -18.333   8.532  -8.263
  643   1HD   ARG  86          HD2       ARG  86 -20.394   7.826  -9.583
  644   2HD   ARG  86          HD1       ARG  86 -20.968   7.038  -8.117
  645    HE   ARG  86           HE       ARG  86 -21.158   9.830  -8.722
  646   1HH1  ARG  86          HH21      ARG  86 -20.320   7.731  -6.106
  647   2HH1  ARG  86          HH22      ARG  86 -20.425   8.980  -4.914
  648   1HH2  ARG  86          HH11      ARG  86 -21.316  11.443  -7.172
  649   2HH2  ARG  86          HH12      ARG  86 -20.994  11.069  -5.512
  650    H    ASP  87           HN       ASP  87 -14.726   5.053  -7.668
  651    HA   ASP  87           HA       ASP  87 -14.740   3.122  -9.878
  652   1HB   ASP  87          HB2       ASP  87 -12.876   3.561  -7.528
  653   2HB   ASP  87          HB1       ASP  87 -12.646   2.288  -8.728
  654    H    THR  88           HN       THR  88 -14.266   0.760  -9.217
  655    HA   THR  88           HA       THR  88 -16.408  -0.089  -7.350
  656    HB   THR  88           HB       THR  88 -14.644  -1.789  -9.137
  657    HG1  THR  88           HG1      THR  88 -16.681  -0.084  -9.708
  658   1HG2  THR  88          HG21      THR  88 -16.542  -3.376  -8.940
  659   2HG2  THR  88          HG22      THR  88 -17.332  -2.263  -7.824
  660   3HG2  THR  88          HG23      THR  88 -15.805  -3.024  -7.377
  661    H    LYS  89           HN       LYS  89 -15.955  -1.609  -5.625
  662    HA   LYS  89           HA       LYS  89 -13.295  -1.211  -4.419
  663   1HB   LYS  89          HB2       LYS  89 -15.707  -2.778  -3.450
  664   2HB   LYS  89          HB1       LYS  89 -14.237  -2.502  -2.524
  665   1HG   LYS  89          HG2       LYS  89 -14.629  -0.072  -2.600
  666   2HG   LYS  89          HG1       LYS  89 -16.106  -0.342  -3.532
  667   1HD   LYS  89          HD2       LYS  89 -17.031  -1.695  -1.686
  668   2HD   LYS  89          HD1       LYS  89 -15.561  -1.426  -0.751
  669   1HE   LYS  89          HE2       LYS  89 -16.001   0.910  -0.554
  670   2HE   LYS  89          HE1       LYS  89 -17.281   0.846  -1.766
  671   1HZ   LYS  89          HZ1       LYS  89 -18.514   0.765   0.129
  672   2HZ   LYS  89          HZ2       LYS  89 -17.307  -0.021   1.030
  673   3HZ   LYS  89          HZ3       LYS  89 -18.249  -0.897  -0.081
  674    H    ILE  90           HN       ILE  90 -11.849  -2.954  -3.928
  675    HA   ILE  90           HA       ILE  90 -12.407  -5.564  -5.299
  676    HB   ILE  90           HB       ILE  90 -10.031  -5.615  -6.007
  677   1HG1  ILE  90          HG12      ILE  90 -10.021  -2.776  -4.926
  678   2HG1  ILE  90          HG11      ILE  90  -9.104  -4.134  -4.280
  679   1HG2  ILE  90          HG21      ILE  90 -11.323  -3.054  -6.963
  680   2HG2  ILE  90          HG22      ILE  90 -11.926  -4.646  -7.426
  681   3HG2  ILE  90          HG23      ILE  90 -10.292  -4.157  -7.875
  682   1HD1  ILE  90          HD11      ILE  90  -8.268  -4.206  -6.872
  683   2HD1  ILE  90          HD12      ILE  90  -7.450  -3.282  -5.613
  684   3HD1  ILE  90          HD13      ILE  90  -8.590  -2.479  -6.691
  685    H    GLU  91           HN       GLU  91 -11.113  -7.360  -4.403
  686    HA   GLU  91           HA       GLU  91 -11.102  -7.358  -1.538
  687   1HB   GLU  91          HB2       GLU  91  -9.865  -9.243  -3.558
  688   2HB   GLU  91          HB1       GLU  91  -9.830  -9.538  -1.820
  689   1HG   GLU  91          HG2       GLU  91 -12.279  -9.487  -1.736
  690   2HG   GLU  91          HG1       GLU  91 -12.348  -9.126  -3.461
  691    H    VAL  92           HN       VAL  92  -9.363  -7.295  -0.072
  692    HA   VAL  92           HA       VAL  92  -7.255  -5.481  -0.648
  693    HB   VAL  92           HB       VAL  92  -7.535  -7.572   1.526
  694   1HG1  VAL  92          HG11      VAL  92  -5.198  -7.112   1.414
  695   2HG1  VAL  92          HG12      VAL  92  -5.815  -6.075   2.700
  696   3HG1  VAL  92          HG13      VAL  92  -5.474  -5.397   1.108
  697   1HG2  VAL  92          HG21      VAL  92  -7.835  -4.563   1.675
  698   2HG2  VAL  92          HG22      VAL  92  -8.312  -5.756   2.883
  699   3HG2  VAL  92          HG23      VAL  92  -9.194  -5.643   1.361
  700    H    ALA  93           HN       ALA  93  -7.284  -9.044  -0.645
  701    HA   ALA  93           HA       ALA  93  -4.551  -9.570  -0.916
  702   1HB   ALA  93          HB1       ALA  93  -5.220 -11.615  -2.149
  703   2HB   ALA  93          HB2       ALA  93  -6.844 -10.954  -2.340
  704   3HB   ALA  93          HB3       ALA  93  -6.234 -11.346  -0.732
  705    H    GLN  94           HN       GLN  94  -6.843  -8.714  -3.518
  706    HA   GLN  94           HA       GLN  94  -4.773  -8.817  -5.564
  707   1HB   GLN  94          HB2       GLN  94  -7.573  -7.651  -5.558
  708   2HB   GLN  94          HB1       GLN  94  -6.532  -7.699  -6.981
  709   1HG   GLN  94          HG2       GLN  94  -7.271 -10.158  -5.376
  710   2HG   GLN  94          HG1       GLN  94  -8.154  -9.632  -6.810
  711   1HE2  GLN  94          HE21      GLN  94  -5.727 -11.714  -5.869
  712   2HE2  GLN  94          HE22      GLN  94  -4.866 -11.813  -7.329
  713    H    PHE  95           HN       PHE  95  -6.151  -6.356  -3.468
  714    HA   PHE  95           HA       PHE  95  -5.170  -4.037  -4.797
  715   1HB   PHE  95          HB2       PHE  95  -6.734  -3.913  -2.898
  716   2HB   PHE  95          HB1       PHE  95  -5.486  -4.549  -1.826
  717    HD1  PHE  95           HD1      PHE  95  -6.751  -1.609  -3.551
  718    HD2  PHE  95           HD2      PHE  95  -3.392  -3.233  -1.422
  719    HE1  PHE  95           HE1      PHE  95  -5.856   0.679  -3.215
  720    HE2  PHE  95           HE2      PHE  95  -2.497  -0.945  -1.087
  721    HZ   PHE  95           HZ       PHE  95  -3.729   1.009  -1.984
  722    H    VAL  96           HN       VAL  96  -3.675  -5.992  -2.200
  723    HA   VAL  96           HA       VAL  96  -1.241  -4.498  -2.113
  724    HB   VAL  96           HB       VAL  96  -1.678  -7.426  -1.447
  725   1HG1  VAL  96          HG11      VAL  96   0.667  -7.040  -1.541
  726   2HG1  VAL  96          HG12      VAL  96   0.252  -6.878   0.165
  727   3HG1  VAL  96          HG13      VAL  96   0.511  -5.438  -0.819
  728   1HG2  VAL  96          HG21      VAL  96  -2.105  -6.657   0.819
  729   2HG2  VAL  96          HG22      VAL  96  -3.207  -5.817  -0.272
  730   3HG2  VAL  96          HG23      VAL  96  -1.781  -4.988   0.352
  731    H    LYS  97           HN       LYS  97  -2.147  -7.426  -3.946
  732    HA   LYS  97           HA       LYS  97   0.426  -7.850  -5.095
  733   1HB   LYS  97          HB2       LYS  97  -2.346  -8.539  -6.096
  734   2HB   LYS  97          HB1       LYS  97  -0.864  -9.075  -6.893
  735   1HG   LYS  97          HG2       LYS  97  -0.124 -10.155  -4.805
  736   2HG   LYS  97          HG1       LYS  97  -1.604  -9.628  -4.004
  737   1HD   LYS  97          HD2       LYS  97  -2.944 -10.923  -5.626
  738   2HD   LYS  97          HD1       LYS  97  -1.462 -11.459  -6.416
  739   1HE   LYS  97          HE2       LYS  97  -2.471 -12.151  -3.659
  740   2HE   LYS  97          HE1       LYS  97  -2.002 -13.242  -4.961
  741   1HZ   LYS  97          HZ1       LYS  97  -0.295 -11.674  -3.148
  742   2HZ   LYS  97          HZ2       LYS  97   0.288 -12.115  -4.682
  743   3HZ   LYS  97          HZ3       LYS  97  -0.186 -13.312  -3.573
  744    H    ASP  98           HN       ASP  98  -2.368  -5.980  -6.371
  745    HA   ASP  98           HA       ASP  98  -1.082  -5.203  -8.797
  746   1HB   ASP  98          HB2       ASP  98  -3.209  -3.858  -7.115
  747   2HB   ASP  98          HB1       ASP  98  -2.658  -3.190  -8.652
  748    H    LEU  99           HN       LEU  99  -1.056  -3.766  -5.560
  749    HA   LEU  99           HA       LEU  99   0.450  -1.434  -6.250
  750   1HB   LEU  99          HB2       LEU  99  -0.793  -1.664  -4.123
  751   2HB   LEU  99          HB1       LEU  99   0.319  -2.932  -3.612
  752    HG   LEU  99           HG       LEU  99   2.199  -1.326  -3.722
  753   1HD1  LEU  99          HD11      LEU  99   0.013   0.480  -4.743
  754   2HD1  LEU  99          HD12      LEU  99   1.670   0.299  -5.320
  755   3HD1  LEU  99          HD13      LEU  99   1.351   1.181  -3.831
  756   1HD2  LEU  99          HD21      LEU  99  -0.155  -0.317  -2.093
  757   2HD2  LEU  99          HD22      LEU  99   1.546   0.006  -1.762
  758   3HD2  LEU  99          HD23      LEU  99   0.917  -1.635  -1.619
  759    H    LEU 100           HN       LEU 100   1.393  -4.704  -5.281
  760    HA   LEU 100           HA       LEU 100   4.158  -4.325  -4.878
  761   1HB   LEU 100          HB2       LEU 100   3.108  -6.437  -4.344
  762   2HB   LEU 100          HB1       LEU 100   2.647  -6.686  -6.022
  763    HG   LEU 100           HG       LEU 100   4.983  -6.907  -6.686
  764   1HD1  LEU 100          HD11      LEU 100   5.471  -6.087  -3.822
  765   2HD1  LEU 100          HD12      LEU 100   6.176  -5.421  -5.296
  766   3HD1  LEU 100          HD13      LEU 100   6.678  -7.008  -4.721
  767   1HD2  LEU 100          HD21      LEU 100   5.511  -8.976  -5.523
  768   2HD2  LEU 100          HD22      LEU 100   3.768  -8.890  -5.771
  769   3HD2  LEU 100          HD23      LEU 100   4.450  -8.534  -4.185
  770    H    LEU 101           HN       LEU 101   2.424  -4.956  -7.940
  771    HA   LEU 101           HA       LEU 101   4.738  -5.168  -9.587
  772   1HB   LEU 101          HB2       LEU 101   1.885  -4.344 -10.112
  773   2HB   LEU 101          HB1       LEU 101   3.075  -4.243 -11.401
  774    HG   LEU 101           HG       LEU 101   1.654  -6.405 -11.211
  775   1HD1  LEU 101          HD11      LEU 101   4.663  -6.731 -11.281
  776   2HD1  LEU 101          HD12      LEU 101   3.704  -6.116 -12.625
  777   3HD1  LEU 101          HD13      LEU 101   3.463  -7.763 -12.049
  778   1HD2  LEU 101          HD21      LEU 101   3.752  -7.181  -9.175
  779   2HD2  LEU 101          HD22      LEU 101   2.310  -8.067  -9.656
  780   3HD2  LEU 101          HD23      LEU 101   2.159  -6.602  -8.701
  781    H    HIS 102           HN       HIS 102   2.810  -2.288  -8.740
  782    HA   HIS 102           HA       HIS 102   4.458  -0.497 -10.283
  783   1HB   HIS 102          HB2       HIS 102   2.432  -0.095  -8.083
  784   2HB   HIS 102          HB1       HIS 102   3.354   1.263  -8.729
  785    HD1  HIS 102           HD1      HIS 102   2.918   1.966 -11.172
  786    HD2  HIS 102           HD2      HIS 102   0.553  -1.220  -9.908
  787    HE1  HIS 102           HE1      HIS 102   1.158   1.643 -12.954
  788    H    LEU 103           HN       LEU 103   4.548  -1.453  -6.838
  789    HA   LEU 103           HA       LEU 103   6.419   0.479  -5.997
  790   1HB   LEU 103          HB2       LEU 103   6.070  -2.395  -5.125
  791   2HB   LEU 103          HB1       LEU 103   7.155  -1.271  -4.311
  792    HG   LEU 103           HG       LEU 103   4.204  -0.737  -4.756
  793   1HD1  LEU 103          HD11      LEU 103   4.082  -1.228  -2.246
  794   2HD1  LEU 103          HD12      LEU 103   5.671  -1.972  -2.416
  795   3HD1  LEU 103          HD13      LEU 103   4.293  -2.625  -3.298
  796   1HD2  LEU 103          HD21      LEU 103   5.108   1.360  -4.316
  797   2HD2  LEU 103          HD22      LEU 103   6.454   0.713  -3.380
  798   3HD2  LEU 103          HD23      LEU 103   4.847   0.812  -2.664
  799    H    LYS 104           HN       LYS 104   7.212  -2.828  -7.175
  800    HA   LYS 104           HA       LYS 104  10.034  -2.261  -7.230
  801   1HB   LYS 104          HB2       LYS 104  10.285  -4.371  -8.353
  802   2HB   LYS 104          HB1       LYS 104   9.019  -4.558  -7.142
  803   1HG   LYS 104          HG2       LYS 104   7.336  -4.077  -8.969
  804   2HG   LYS 104          HG1       LYS 104   8.667  -4.189 -10.123
  805   1HD   LYS 104          HD2       LYS 104   9.185  -6.474  -9.157
  806   2HD   LYS 104          HD1       LYS 104   7.677  -6.356  -8.251
  807   1HE   LYS 104          HE2       LYS 104   6.898  -7.444 -10.140
  808   2HE   LYS 104          HE1       LYS 104   6.701  -5.778 -10.678
  809   1HZ   LYS 104          HZ1       LYS 104   8.607  -7.789 -11.531
  810   2HZ   LYS 104          HZ2       LYS 104   9.234  -6.221 -11.348
  811   3HZ   LYS 104          HZ3       LYS 104   7.927  -6.500 -12.397
  812    H    LYS 105           HN       LYS 105   7.483  -1.473  -9.427
  813    HA   LYS 105           HA       LYS 105   9.048  -1.322 -11.838
  814   1HB   LYS 105          HB2       LYS 105   6.545  -1.340 -11.730
  815   2HB   LYS 105          HB1       LYS 105   6.601   0.310 -11.113
  816   1HG   LYS 105          HG2       LYS 105   7.823   1.017 -13.150
  817   2HG   LYS 105          HG1       LYS 105   7.710  -0.625 -13.777
  818   1HD   LYS 105          HD2       LYS 105   5.283   1.009 -12.989
  819   2HD   LYS 105          HD1       LYS 105   5.935   0.997 -14.625
  820   1HE   LYS 105          HE2       LYS 105   5.733  -1.593 -14.457
  821   2HE   LYS 105          HE1       LYS 105   4.665  -1.268 -13.091
  822   1HZ   LYS 105          HZ1       LYS 105   3.839  -1.363 -15.615
  823   2HZ   LYS 105          HZ2       LYS 105   4.171   0.298 -15.480
  824   3HZ   LYS 105          HZ3       LYS 105   3.073  -0.441 -14.415
  825    H    LEU 106           HN       LEU 106   8.266   1.109  -9.339
  826    HA   LEU 106           HA       LEU 106   9.551   3.306 -10.660
  827   1HB   LEU 106          HB2       LEU 106   8.814   2.734  -7.789
  828   2HB   LEU 106          HB1       LEU 106   9.762   4.161  -8.184
  829    HG   LEU 106           HG       LEU 106   7.184   4.405  -8.046
  830   1HD1  LEU 106          HD11      LEU 106   9.031   5.491 -10.129
  831   2HD1  LEU 106          HD12      LEU 106   8.138   6.321  -8.859
  832   3HD1  LEU 106          HD13      LEU 106   7.310   5.822 -10.329
  833   1HD2  LEU 106          HD21      LEU 106   5.869   3.763  -9.909
  834   2HD2  LEU 106          HD22      LEU 106   6.844   2.349  -9.553
  835   3HD2  LEU 106          HD23      LEU 106   7.278   3.396 -10.897
  836    H    PHE 107           HN       PHE 107  10.787   0.645  -8.761
  837    HA   PHE 107           HA       PHE 107  13.316   1.719  -8.032
  838   1HB   PHE 107          HB2       PHE 107  12.432  -0.472  -7.213
  839   2HB   PHE 107          HB1       PHE 107  12.716  -1.147  -8.818
  840    HD1  PHE 107           HD1      PHE 107  14.432   0.633  -6.023
  841    HD2  PHE 107           HD2      PHE 107  14.856  -1.972  -9.412
  842    HE1  PHE 107           HE1      PHE 107  16.814   0.280  -5.452
  843    HE2  PHE 107           HE2      PHE 107  17.241  -2.334  -8.833
  844    HZ   PHE 107           HZ       PHE 107  18.221  -1.208  -6.852
  845    H    ARG 108           HN       ARG 108  12.245   0.161 -11.032
  846    HA   ARG 108           HA       ARG 108  14.778  -0.076 -12.296
  847   1HB   ARG 108          HB2       ARG 108  12.057   0.478 -13.521
  848   2HB   ARG 108          HB1       ARG 108  13.472  -0.069 -14.416
  849   1HG   ARG 108          HG2       ARG 108  12.447  -1.633 -12.047
  850   2HG   ARG 108          HG1       ARG 108  11.736  -1.849 -13.644
  851   1HD   ARG 108          HD2       ARG 108  14.038  -2.331 -14.536
  852   2HD   ARG 108          HD1       ARG 108  14.636  -2.292 -12.875
  853    HE   ARG 108           HE       ARG 108  12.593  -4.110 -12.719
  854   1HH1  ARG 108          HH21      ARG 108  15.280  -3.645 -14.829
  855   2HH1  ARG 108          HH22      ARG 108  15.514  -5.336 -15.119
  856   1HH2  ARG 108          HH11      ARG 108  12.889  -6.321 -13.080
  857   2HH2  ARG 108          HH12      ARG 108  14.162  -6.851 -14.128
  858    H    GLU 109           HN       GLU 109  12.500   2.668 -12.195
  859    HA   GLU 109           HA       GLU 109  14.300   4.287 -13.884
  860   1HB   GLU 109          HB2       GLU 109  11.701   4.962 -12.472
  861   2HB   GLU 109          HB1       GLU 109  12.577   6.060 -13.538
  862   1HG   GLU 109          HG2       GLU 109  11.635   3.310 -14.390
  863   2HG   GLU 109          HG1       GLU 109  10.708   4.786 -14.667
  864    H    GLY 110           HN       GLY 110  13.966   3.590 -10.551
  865   1HA   GLY 110          HA2       GLY 110  15.178   4.424  -8.725
  866   2HA   GLY 110          HA1       GLY 110  16.099   5.410  -9.862
  867    H    ARG 111           HN       ARG 111  12.813   5.922 -10.360
  868    HA   ARG 111           HA       ARG 111  12.966   8.533  -8.944
  869   1HB   ARG 111          HB2       ARG 111  10.848   7.422 -10.820
  870   2HB   ARG 111          HB1       ARG 111  10.877   9.057 -10.163
  871   1HG   ARG 111          HG2       ARG 111  13.076   9.433 -11.270
  872   2HG   ARG 111          HG1       ARG 111  12.962   7.824 -11.988
  873   1HD   ARG 111          HD2       ARG 111  10.842   8.473 -13.089
  874   2HD   ARG 111          HD1       ARG 111  10.986  10.087 -12.397
  875    HE   ARG 111           HE       ARG 111  13.364   9.772 -13.761
  876   1HH1  ARG 111          HH21      ARG 111  10.019   9.366 -14.479
  877   2HH1  ARG 111          HH22      ARG 111  10.181   9.820 -16.143
  878   1HH2  ARG 111          HH11      ARG 111  13.599  10.376 -15.931
  879   2HH2  ARG 111          HH12      ARG 111  12.209  10.395 -16.965
  880    H    PHE 112           HN       PHE 112  12.539   8.149  -6.803
  881    HA   PHE 112           HA       PHE 112  10.379   6.274  -6.047
  882   1HB   PHE 112          HB2       PHE 112  12.300   7.874  -4.333
  883   2HB   PHE 112          HB1       PHE 112  11.266   6.543  -3.792
  884    HD1  PHE 112           HD1      PHE 112  11.607   4.248  -4.681
  885    HD2  PHE 112           HD2      PHE 112  14.329   7.445  -5.573
  886    HE1  PHE 112           HE1      PHE 112  13.284   2.605  -5.468
  887    HE2  PHE 112           HE2      PHE 112  16.005   5.793  -6.364
  888    HZ   PHE 112           HZ       PHE 112  15.482   3.373  -6.306
  889    H    ASN 113           HN       ASN 113   8.359   7.000  -5.792
  890    HA   ASN 113           HA       ASN 113   7.839   9.537  -4.413
  891   1HB   ASN 113          HB2       ASN 113   6.981   9.083  -7.285
  892   2HB   ASN 113          HB1       ASN 113   6.354  10.370  -6.253
  893   1HD2  ASN 113          HD21      ASN 113   8.161  11.817  -5.244
  894   2HD2  ASN 113          HD22      ASN 113   9.486  12.182  -6.240
  Start of MODEL    6
    1   1H    MET   1           HT1      MET   1  22.739   4.453  12.657
    2   2H    MET   1           HT2      MET   1  22.858   5.455  14.025
    3   3H    MET   1           HT3      MET   1  24.263   4.847  13.288
    4    HA   MET   1           HA       MET   1  23.930   7.174  12.718
    5   1HB   MET   1          HB2       MET   1  23.492   5.186  10.467
    6   2HB   MET   1          HB1       MET   1  23.981   6.865  10.236
    7   1HG   MET   1          HG2       MET   1  26.000   6.468  11.602
    8   2HG   MET   1          HG1       MET   1  25.513   4.789  11.832
    9   1HE   MET   1          HE1       MET   1  26.185   7.583   9.557
   10   2HE   MET   1          HE2       MET   1  25.242   6.885   8.245
   11   3HE   MET   1          HE3       MET   1  26.997   6.936   8.125
   12    H    GLY   2           HN       GLY   2  22.532   8.055  10.471
   13   1HA   GLY   2          HA2       GLY   2  19.941   8.629  11.615
   14   2HA   GLY   2          HA1       GLY   2  20.477   9.106  10.002
   15    HA   PRO   3           HA       PRO   3  17.111   5.660   9.986
   16   1HB   PRO   3          HB2       PRO   3  16.170   7.431   7.787
   17   2HB   PRO   3          HB1       PRO   3  15.250   6.693   9.106
   18   1HG   PRO   3          HG2       PRO   3  15.933   9.375   8.991
   19   2HG   PRO   3          HG1       PRO   3  15.541   8.508  10.482
   20   1HD   PRO   3          HD2       PRO   3  18.154   9.538   9.592
   21   2HD   PRO   3          HD1       PRO   3  17.679   8.938  11.201
   22    H    VAL   4           HN       VAL   4  16.518   4.409   7.877
   23    HA   VAL   4           HA       VAL   4  18.996   3.890   6.435
   24    HB   VAL   4           HB       VAL   4  17.638   2.113   5.318
   25   1HG1  VAL   4          HG11      VAL   4  18.707   1.529   7.398
   26   2HG1  VAL   4          HG12      VAL   4  17.072   0.870   7.447
   27   3HG1  VAL   4          HG13      VAL   4  17.452   2.349   8.329
   28   1HG2  VAL   4          HG21      VAL   4  15.411   3.287   7.006
   29   2HG2  VAL   4          HG22      VAL   4  15.310   1.775   6.107
   30   3HG2  VAL   4          HG23      VAL   4  15.493   3.302   5.244
   31    HA   PRO   5           HA       PRO   5  18.236   6.656   3.039
   32   1HB   PRO   5          HB2       PRO   5  18.975   4.849   0.928
   33   2HB   PRO   5          HB1       PRO   5  19.982   6.082   1.694
   34   1HG   PRO   5          HG2       PRO   5  20.035   3.173   2.065
   35   2HG   PRO   5          HG1       PRO   5  21.235   4.377   2.548
   36   1HD   PRO   5          HD2       PRO   5  19.523   2.976   4.297
   37   2HD   PRO   5          HD1       PRO   5  20.435   4.450   4.703
   38    HA   PRO   6           HA       PRO   6  14.243   5.783   1.317
   39   1HB   PRO   6          HB2       PRO   6  14.567   6.777  -1.304
   40   2HB   PRO   6          HB1       PRO   6  14.099   7.720   0.116
   41   1HG   PRO   6          HG2       PRO   6  16.698   7.629  -1.293
   42   2HG   PRO   6          HG1       PRO   6  16.039   8.886  -0.239
   43   1HD   PRO   6          HD2       PRO   6  18.073   7.068   0.469
   44   2HD   PRO   6          HD1       PRO   6  17.105   8.033   1.612
   45    H    SER   7           HN       SER   7  16.837   4.975  -1.002
   46    HA   SER   7           HA       SER   7  15.338   3.096  -2.531
   47   1HB   SER   7          HB2       SER   7  17.452   2.329  -3.377
   48   2HB   SER   7          HB1       SER   7  17.629   4.058  -3.098
   49    HG   SER   7           HG       SER   7  18.526   3.474  -1.022
   50    H    THR   8           HN       THR   8  17.264   2.737   0.420
   51    HA   THR   8           HA       THR   8  16.965  -0.135   0.582
   52    HB   THR   8           HB       THR   8  17.542   1.870   2.782
   53    HG1  THR   8           HG1      THR   8  19.273   0.233   1.247
   54   1HG2  THR   8          HG21      THR   8  16.859  -0.147   3.829
   55   2HG2  THR   8          HG22      THR   8  18.621  -0.228   3.803
   56   3HG2  THR   8          HG23      THR   8  17.678  -1.143   2.627
   57    H    ALA   9           HN       ALA   9  15.155   2.595   1.961
   58    HA   ALA   9           HA       ALA   9  13.447   1.094   3.662
   59   1HB   ALA   9          HB1       ALA   9  11.860   3.022   3.382
   60   2HB   ALA   9          HB2       ALA   9  12.918   3.655   2.122
   61   3HB   ALA   9          HB3       ALA   9  13.503   3.529   3.780
   62    H    LEU  10           HN       LEU  10  13.121   1.986   0.236
   63    HA   LEU  10           HA       LEU  10  10.550   0.824  -0.146
   64   1HB   LEU  10          HB2       LEU  10  11.614   2.343  -1.783
   65   2HB   LEU  10          HB1       LEU  10  12.824   1.112  -2.130
   66    HG   LEU  10           HG       LEU  10  10.989  -0.432  -2.862
   67   1HD1  LEU  10          HD11      LEU  10   8.793   0.906  -3.426
   68   2HD1  LEU  10          HD12      LEU  10   9.332   1.982  -2.138
   69   3HD1  LEU  10          HD13      LEU  10   9.025   0.280  -1.795
   70   1HD2  LEU  10          HD21      LEU  10  12.174   0.812  -4.546
   71   2HD2  LEU  10          HD22      LEU  10  11.229   2.265  -4.215
   72   3HD2  LEU  10          HD23      LEU  10  10.466   0.863  -4.957
   73    H    ARG  11           HN       ARG  11  13.826  -0.558  -0.682
   74    HA   ARG  11           HA       ARG  11  12.933  -3.128  -1.522
   75   1HB   ARG  11          HB2       ARG  11  15.442  -2.292  -0.042
   76   2HB   ARG  11          HB1       ARG  11  15.183  -3.920  -0.654
   77   1HG   ARG  11          HG2       ARG  11  14.929  -1.526  -2.476
   78   2HG   ARG  11          HG1       ARG  11  16.504  -2.240  -2.139
   79   1HD   ARG  11          HD2       ARG  11  15.526  -4.477  -2.862
   80   2HD   ARG  11          HD1       ARG  11  14.115  -3.586  -3.432
   81    HE   ARG  11           HE       ARG  11  16.234  -2.287  -4.638
   82   1HH1  ARG  11          HH21      ARG  11  15.076  -5.524  -4.381
   83   2HH1  ARG  11          HH22      ARG  11  15.735  -6.023  -5.903
   84   1HH2  ARG  11          HH11      ARG  11  17.111  -2.923  -6.624
   85   2HH2  ARG  11          HH12      ARG  11  16.889  -4.552  -7.171
   86    H    GLU  12           HN       GLU  12  13.647  -1.878   1.732
   87    HA   GLU  12           HA       GLU  12  13.179  -4.325   3.119
   88   1HB   GLU  12          HB2       GLU  12  12.807  -1.435   3.971
   89   2HB   GLU  12          HB1       GLU  12  12.642  -2.803   5.075
   90   1HG   GLU  12          HG2       GLU  12  15.121  -2.266   3.419
   91   2HG   GLU  12          HG1       GLU  12  14.931  -1.751   5.093
   92    H    LEU  13           HN       LEU  13  11.030  -1.738   2.035
   93    HA   LEU  13           HA       LEU  13   8.650  -2.824   3.246
   94   1HB   LEU  13          HB2       LEU  13   8.832  -0.461   2.544
   95   2HB   LEU  13          HB1       LEU  13   8.978  -0.968   0.863
   96    HG   LEU  13           HG       LEU  13   6.720  -1.993   0.990
   97   1HD1  LEU  13          HD11      LEU  13   5.358  -1.137   3.073
   98   2HD1  LEU  13          HD12      LEU  13   6.943  -1.050   3.841
   99   3HD1  LEU  13          HD13      LEU  13   6.345  -2.589   3.221
  100   1HD2  LEU  13          HD21      LEU  13   7.030   0.360   0.246
  101   2HD2  LEU  13          HD22      LEU  13   6.785   0.898   1.908
  102   3HD2  LEU  13          HD23      LEU  13   5.470   0.113   1.032
  103    H    ILE  14           HN       ILE  14  10.081  -3.093  -0.023
  104    HA   ILE  14           HA       ILE  14   7.943  -4.641  -1.129
  105    HB   ILE  14           HB       ILE  14  10.882  -4.575  -1.882
  106   1HG1  ILE  14          HG12      ILE  14   8.481  -3.267  -3.197
  107   2HG1  ILE  14          HG11      ILE  14   9.533  -2.434  -2.060
  108   1HG2  ILE  14          HG21      ILE  14   8.463  -5.792  -3.224
  109   2HG2  ILE  14          HG22      ILE  14   9.948  -6.615  -2.758
  110   3HG2  ILE  14          HG23      ILE  14   9.960  -5.460  -4.088
  111   1HD1  ILE  14          HD11      ILE  14  11.460  -2.799  -3.515
  112   2HD1  ILE  14          HD12      ILE  14  10.173  -2.007  -4.424
  113   3HD1  ILE  14          HD13      ILE  14  10.464  -3.734  -4.631
  114    H    GLU  15           HN       GLU  15  11.045  -5.683   0.298
  115    HA   GLU  15           HA       GLU  15  10.645  -8.464  -0.047
  116   1HB   GLU  15          HB2       GLU  15  12.200  -6.921   2.042
  117   2HB   GLU  15          HB1       GLU  15  12.283  -8.675   1.866
  118   1HG   GLU  15          HG2       GLU  15  13.059  -8.454  -0.435
  119   2HG   GLU  15          HG1       GLU  15  12.872  -6.702  -0.359
  120    H    GLU  16           HN       GLU  16   9.659  -6.355   2.664
  121    HA   GLU  16           HA       GLU  16   8.671  -8.554   4.256
  122   1HB   GLU  16          HB2       GLU  16   9.262  -6.292   5.172
  123   2HB   GLU  16          HB1       GLU  16   7.818  -5.649   4.387
  124   1HG   GLU  16          HG2       GLU  16   6.415  -7.227   5.656
  125   2HG   GLU  16          HG1       GLU  16   7.853  -7.879   6.442
  126    H    LEU  17           HN       LEU  17   7.087  -6.269   2.001
  127    HA   LEU  17           HA       LEU  17   4.427  -7.218   2.430
  128   1HB   LEU  17          HB2       LEU  17   5.723  -5.998  -0.019
  129   2HB   LEU  17          HB1       LEU  17   4.001  -6.345   0.093
  130    HG   LEU  17           HG       LEU  17   5.506  -4.572   2.040
  131   1HD1  LEU  17          HD11      LEU  17   5.459  -3.649  -0.270
  132   2HD1  LEU  17          HD12      LEU  17   4.493  -2.689   0.852
  133   3HD1  LEU  17          HD13      LEU  17   3.700  -3.796  -0.269
  134   1HD2  LEU  17          HD21      LEU  17   2.983  -3.801   2.347
  135   2HD2  LEU  17          HD22      LEU  17   3.582  -5.220   3.196
  136   3HD2  LEU  17          HD23      LEU  17   2.631  -5.416   1.725
  137    H    VAL  18           HN       VAL  18   6.940  -8.220   0.134
  138    HA   VAL  18           HA       VAL  18   5.395 -10.182  -1.244
  139    HB   VAL  18           HB       VAL  18   8.374  -9.888  -0.777
  140   1HG1  VAL  18          HG11      VAL  18   6.863 -11.852  -2.518
  141   2HG1  VAL  18          HG12      VAL  18   8.034 -12.224  -1.254
  142   3HG1  VAL  18          HG13      VAL  18   8.566 -11.464  -2.752
  143   1HG2  VAL  18          HG21      VAL  18   8.388  -8.976  -3.007
  144   2HG2  VAL  18          HG22      VAL  18   7.100  -8.158  -2.123
  145   3HG2  VAL  18          HG23      VAL  18   6.708  -9.441  -3.268
  146    H    ASN  19           HN       ASN  19   7.516 -10.476   1.611
  147    HA   ASN  19           HA       ASN  19   7.381 -13.295   1.870
  148   1HB   ASN  19          HB2       ASN  19   8.951 -11.900   3.142
  149   2HB   ASN  19          HB1       ASN  19   7.608 -11.205   4.051
  150   1HD2  ASN  19          HD21      ASN  19   7.816 -12.103   6.123
  151   2HD2  ASN  19          HD22      ASN  19   7.956 -13.765   6.438
  152    H    ILE  20           HN       ILE  20   5.178 -10.807   3.170
  153    HA   ILE  20           HA       ILE  20   3.601 -12.785   4.606
  154    HB   ILE  20           HB       ILE  20   2.084 -10.900   5.078
  155   1HG1  ILE  20          HG12      ILE  20   3.957  -9.265   3.348
  156   2HG1  ILE  20          HG11      ILE  20   2.382  -9.822   2.796
  157   1HG2  ILE  20          HG21      ILE  20   4.989 -10.060   5.289
  158   2HG2  ILE  20          HG22      ILE  20   4.243 -11.267   6.337
  159   3HG2  ILE  20          HG23      ILE  20   3.666  -9.601   6.362
  160   1HD1  ILE  20          HD11      ILE  20   2.360  -7.483   3.716
  161   2HD1  ILE  20          HD12      ILE  20   2.787  -8.155   5.290
  162   3HD1  ILE  20          HD13      ILE  20   1.252  -8.587   4.536
  163    H    THR  21           HN       THR  21   3.492 -11.547   1.333
  164    HA   THR  21           HA       THR  21   0.687 -12.499   1.010
  165    HB   THR  21           HB       THR  21   0.848 -11.483  -1.248
  166    HG1  THR  21           HG1      THR  21   3.436 -11.663  -0.699
  167   1HG2  THR  21          HG21      THR  21   0.426  -9.377  -0.437
  168   2HG2  THR  21          HG22      THR  21   1.942  -9.313   0.455
  169   3HG2  THR  21          HG23      THR  21   0.557 -10.162   1.136
  170    H    GLN  22           HN       GLN  22   3.925 -13.580   0.334
  171    HA   GLN  22           HA       GLN  22   3.152 -15.344  -1.847
  172   1HB   GLN  22          HB2       GLN  22   5.607 -15.180  -0.092
  173   2HB   GLN  22          HB1       GLN  22   5.405 -16.442  -1.307
  174   1HG   GLN  22          HG2       GLN  22   5.113 -14.728  -3.053
  175   2HG   GLN  22          HG1       GLN  22   5.310 -13.461  -1.850
  176   1HE2  GLN  22          HE21      GLN  22   7.402 -15.365  -0.498
  177   2HE2  GLN  22          HE22      GLN  22   8.805 -15.101  -1.416
  178    H    ASN  23           HN       ASN  23   3.376 -15.658   1.665
  179    HA   ASN  23           HA       ASN  23   2.675 -18.551   1.468
  180   1HB   ASN  23          HB2       ASN  23   3.166 -18.615   3.875
  181   2HB   ASN  23          HB1       ASN  23   4.518 -17.931   2.973
  182   1HD2  ASN  23          HD21      ASN  23   4.550 -17.213   5.582
  183   2HD2  ASN  23          HD22      ASN  23   3.989 -15.628   5.812
  184    H    GLN  24           HN       GLN  24   0.869 -15.796   1.430
  185    HA   GLN  24           HA       GLN  24  -1.049 -16.579   3.527
  186   1HB   GLN  24          HB2       GLN  24  -2.212 -14.585   3.044
  187   2HB   GLN  24          HB1       GLN  24  -0.527 -14.160   2.774
  188   1HG   GLN  24          HG2       GLN  24  -0.878 -14.625   0.318
  189   2HG   GLN  24          HG1       GLN  24  -2.598 -14.826   0.658
  190   1HE2  GLN  24          HE21      GLN  24  -2.811 -12.862  -0.830
  191   2HE2  GLN  24          HE22      GLN  24  -2.622 -11.323  -0.139
  192    H    LYS  25           HN       LYS  25  -2.741 -17.955   3.220
  193    HA   LYS  25           HA       LYS  25  -3.222 -19.019   0.503
  194   1HB   LYS  25          HB2       LYS  25  -3.139 -20.560   2.469
  195   2HB   LYS  25          HB1       LYS  25  -4.559 -19.752   3.133
  196   1HG   LYS  25          HG2       LYS  25  -5.854 -20.361   1.121
  197   2HG   LYS  25          HG1       LYS  25  -4.436 -21.165   0.450
  198   1HD   LYS  25          HD2       LYS  25  -4.416 -22.731   2.361
  199   2HD   LYS  25          HD1       LYS  25  -5.838 -21.929   3.032
  200   1HE   LYS  25          HE2       LYS  25  -7.206 -22.602   1.187
  201   2HE   LYS  25          HE1       LYS  25  -5.806 -23.119   0.250
  202   1HZ   LYS  25          HZ1       LYS  25  -5.481 -24.963   1.616
  203   2HZ   LYS  25          HZ2       LYS  25  -7.166 -24.904   1.412
  204   3HZ   LYS  25          HZ3       LYS  25  -6.462 -24.351   2.856
  205    H    ALA  26           HN       ALA  26  -5.624 -18.226   3.016
  206    HA   ALA  26           HA       ALA  26  -7.430 -17.160   0.974
  207   1HB   ALA  26          HB1       ALA  26  -7.560 -17.634   3.943
  208   2HB   ALA  26          HB2       ALA  26  -8.625 -18.243   2.677
  209   3HB   ALA  26          HB3       ALA  26  -8.751 -16.565   3.202
  210    HA   PRO  27           HA       PRO  27  -6.252 -12.870   1.008
  211   1HB   PRO  27          HB2       PRO  27  -8.890 -12.050   2.060
  212   2HB   PRO  27          HB1       PRO  27  -8.142 -11.676   0.503
  213   1HG   PRO  27          HG2       PRO  27 -10.222 -13.568   0.992
  214   2HG   PRO  27          HG1       PRO  27  -9.365 -13.301  -0.531
  215   1HD   PRO  27          HD2       PRO  27  -9.206 -15.624   1.143
  216   2HD   PRO  27          HD1       PRO  27  -8.218 -15.278  -0.295
  217    H    LEU  28           HN       LEU  28  -5.495 -11.316   2.554
  218    HA   LEU  28           HA       LEU  28  -5.048 -12.282   5.197
  219   1HB   LEU  28          HB2       LEU  28  -4.851  -9.480   4.061
  220   2HB   LEU  28          HB1       LEU  28  -4.247  -9.942   5.650
  221    HG   LEU  28           HG       LEU  28  -3.381 -11.295   3.076
  222   1HD1  LEU  28          HD11      LEU  28  -1.298  -9.948   3.316
  223   2HD1  LEU  28          HD12      LEU  28  -2.058  -9.051   4.631
  224   3HD1  LEU  28          HD13      LEU  28  -2.715  -8.948   2.997
  225   1HD2  LEU  28          HD21      LEU  28  -2.522 -11.442   5.971
  226   2HD2  LEU  28          HD22      LEU  28  -1.370 -11.814   4.690
  227   3HD2  LEU  28          HD23      LEU  28  -2.845 -12.759   4.846
  228    H    CYS  29           HN       CYS  29  -7.296  -9.773   4.027
  229    HA   CYS  29           HA       CYS  29  -8.512  -9.542   6.695
  230   1HB   CYS  29          HB2       CYS  29  -9.162  -8.305   4.011
  231   2HB   CYS  29          HB1       CYS  29 -10.092  -7.988   5.477
  232    H    ASN  30           HN       ASN  30 -10.972  -9.750   6.827
  233    HA   ASN  30           HA       ASN  30 -11.760 -12.411   6.041
  234   1HB   ASN  30          HB2       ASN  30 -13.356 -10.068   7.118
  235   2HB   ASN  30          HB1       ASN  30 -14.023 -11.684   6.882
  236   1HD2  ASN  30          HD21      ASN  30 -12.059 -13.374   7.803
  237   2HD2  ASN  30          HD22      ASN  30 -11.695 -13.050   9.429
  238    H    GLY  31           HN       GLY  31 -10.982 -10.867   3.739
  239   1HA   GLY  31          HA2       GLY  31 -11.822 -10.916   1.503
  240   2HA   GLY  31          HA1       GLY  31 -13.453 -11.148   2.140
  241    H    SER  32           HN       SER  32 -11.535  -8.680   3.611
  242    HA   SER  32           HA       SER  32 -13.416  -6.617   3.055
  243   1HB   SER  32          HB2       SER  32 -10.489  -6.406   3.805
  244   2HB   SER  32          HB1       SER  32 -11.615  -5.056   3.802
  245    HG   SER  32           HG       SER  32 -11.477  -5.973   5.867
  246    H    MET  33           HN       MET  33 -13.501  -5.057   1.468
  247    HA   MET  33           HA       MET  33 -11.651  -5.407  -0.868
  248   1HB   MET  33          HB2       MET  33 -14.427  -4.183  -0.790
  249   2HB   MET  33          HB1       MET  33 -13.456  -4.507  -2.228
  250   1HG   MET  33          HG2       MET  33 -13.451  -6.941  -1.594
  251   2HG   MET  33          HG1       MET  33 -14.594  -6.554  -0.308
  252   1HE   MET  33          HE1       MET  33 -13.788  -6.033  -4.012
  253   2HE   MET  33          HE2       MET  33 -15.221  -6.665  -4.819
  254   3HE   MET  33          HE3       MET  33 -14.218  -7.742  -3.850
  255    H    VAL  34           HN       VAL  34 -10.949  -3.424  -1.931
  256    HA   VAL  34           HA       VAL  34 -11.144  -0.955  -0.240
  257    HB   VAL  34           HB       VAL  34  -8.756  -0.505  -0.802
  258   1HG1  VAL  34          HG11      VAL  34  -9.371  -3.106   0.630
  259   2HG1  VAL  34          HG12      VAL  34  -9.323  -1.498   1.347
  260   3HG1  VAL  34          HG13      VAL  34  -7.840  -2.238   0.748
  261   1HG2  VAL  34          HG21      VAL  34  -8.553  -1.869  -2.815
  262   2HG2  VAL  34          HG22      VAL  34  -8.920  -3.331  -1.899
  263   3HG2  VAL  34          HG23      VAL  34  -7.413  -2.462  -1.608
  264    H    TRP  35           HN       TRP  35 -10.725   1.037  -1.459
  265    HA   TRP  35           HA       TRP  35 -12.070   1.001  -4.025
  266   1HB   TRP  35          HB2       TRP  35 -10.569   3.179  -2.548
  267   2HB   TRP  35          HB1       TRP  35 -11.447   3.442  -4.052
  268    HD1  TRP  35           HD1      TRP  35 -11.949   2.837  -0.349
  269    HE1  TRP  35           HE1      TRP  35 -14.427   3.221   0.236
  270    HE3  TRP  35           HE3      TRP  35 -13.898   3.253  -5.043
  271    HZ2  TRP  35           HZ2      TRP  35 -16.914   3.644  -1.115
  272    HZ3  TRP  35           HZ3      TRP  35 -16.322   3.635  -5.370
  273    HH2  TRP  35           HH2      TRP  35 -17.832   3.834  -3.415
  274    H    SER  36           HN       SER  36 -11.158   0.760  -6.004
  275    HA   SER  36           HA       SER  36  -8.307   0.334  -6.293
  276   1HB   SER  36          HB2       SER  36  -8.816   0.204  -8.710
  277   2HB   SER  36          HB1       SER  36  -9.953  -0.765  -7.778
  278    HG   SER  36           HG       SER  36 -10.491   1.188  -9.453
  279    H    ILE  37           HN       ILE  37  -6.821   1.752  -7.415
  280    HA   ILE  37           HA       ILE  37  -7.752   4.563  -7.836
  281    HB   ILE  37           HB       ILE  37  -5.702   5.379  -6.670
  282   1HG1  ILE  37          HG12      ILE  37  -5.451   2.563  -5.582
  283   2HG1  ILE  37          HG11      ILE  37  -4.492   3.122  -6.950
  284   1HG2  ILE  37          HG21      ILE  37  -7.548   3.629  -5.018
  285   2HG2  ILE  37          HG22      ILE  37  -7.836   5.310  -5.467
  286   3HG2  ILE  37          HG23      ILE  37  -6.516   4.905  -4.371
  287   1HD1  ILE  37          HD11      ILE  37  -3.237   3.407  -4.859
  288   2HD1  ILE  37          HD12      ILE  37  -4.543   4.390  -4.197
  289   3HD1  ILE  37          HD13      ILE  37  -3.607   4.975  -5.573
  290    H    ASN  38           HN       ASN  38  -5.968   5.851  -8.956
  291    HA   ASN  38           HA       ASN  38  -4.873   4.199 -11.155
  292   1HB   ASN  38          HB2       ASN  38  -4.878   7.201 -10.668
  293   2HB   ASN  38          HB1       ASN  38  -4.223   6.422 -12.109
  294   1HD2  ASN  38          HD21      ASN  38  -6.869   8.099 -11.252
  295   2HD2  ASN  38          HD22      ASN  38  -8.062   7.307 -12.165
  296    H    LEU  39           HN       LEU  39  -2.820   3.427 -10.992
  297    HA   LEU  39           HA       LEU  39  -1.112   4.280  -8.775
  298   1HB   LEU  39          HB2       LEU  39  -0.694   2.314 -11.045
  299   2HB   LEU  39          HB1       LEU  39   0.483   2.590  -9.766
  300    HG   LEU  39           HG       LEU  39  -0.937   0.601  -9.324
  301   1HD1  LEU  39          HD11      LEU  39  -1.754   2.660  -7.289
  302   2HD1  LEU  39          HD12      LEU  39  -0.055   2.239  -7.491
  303   3HD1  LEU  39          HD13      LEU  39  -1.222   0.999  -7.049
  304   1HD2  LEU  39          HD21      LEU  39  -3.283   2.435  -8.863
  305   2HD2  LEU  39          HD22      LEU  39  -3.262   0.687  -9.084
  306   3HD2  LEU  39          HD23      LEU  39  -2.985   1.747 -10.462
  307    H    THR  40           HN       THR  40   0.192   6.032  -8.916
  308    HA   THR  40           HA       THR  40   1.624   6.571 -11.468
  309    HB   THR  40           HB       THR  40   1.024   8.957 -11.380
  310    HG1  THR  40           HG1      THR  40  -0.863   8.276  -9.401
  311   1HG2  THR  40          HG21      THR  40  -1.223   8.751 -12.182
  312   2HG2  THR  40          HG22      THR  40  -1.498   7.296 -11.224
  313   3HG2  THR  40          HG23      THR  40  -0.403   7.246 -12.605
  314    H    ALA  41           HN       ALA  41   1.498   9.071  -9.088
  315    HA   ALA  41           HA       ALA  41   4.231   8.282  -8.107
  316   1HB   ALA  41          HB1       ALA  41   4.078  10.361  -9.529
  317   2HB   ALA  41          HB2       ALA  41   4.736  10.632  -7.915
  318   3HB   ALA  41          HB3       ALA  41   3.067  11.073  -8.272
  319    H    GLY  42           HN       GLY  42   1.498  10.368  -7.054
  320   1HA   GLY  42          HA2       GLY  42   2.168  10.126  -4.264
  321   2HA   GLY  42          HA1       GLY  42   0.627  10.712  -4.894
  322    H    MET  43           HN       MET  43   1.970   7.559  -5.664
  323    HA   MET  43           HA       MET  43  -0.416   6.146  -5.092
  324   1HB   MET  43          HB2       MET  43   2.448   5.168  -5.198
  325   2HB   MET  43          HB1       MET  43   1.030   4.123  -5.219
  326   1HG   MET  43          HG2       MET  43   0.241   5.387  -7.251
  327   2HG   MET  43          HG1       MET  43   1.803   6.202  -7.278
  328   1HE   MET  43          HE1       MET  43   3.744   3.500  -6.254
  329   2HE   MET  43          HE2       MET  43   3.906   5.079  -7.021
  330   3HE   MET  43          HE3       MET  43   4.388   3.631  -7.897
  331    H    TYR  44           HN       TYR  44   2.471   6.738  -3.094
  332    HA   TYR  44           HA       TYR  44   1.826   4.975  -0.971
  333   1HB   TYR  44          HB2       TYR  44   3.275   7.638  -0.913
  334   2HB   TYR  44          HB1       TYR  44   3.223   6.512   0.441
  335    HD1  TYR  44           HD1      TYR  44   4.369   4.345   0.333
  336    HD2  TYR  44           HD2      TYR  44   4.557   7.136  -2.927
  337    HE1  TYR  44           HE1      TYR  44   6.259   3.074  -0.647
  338    HE2  TYR  44           HE2      TYR  44   6.448   5.865  -3.906
  339    HH   TYR  44           HH       TYR  44   8.161   4.310  -3.230
  340    H    CYS  45           HN       CYS  45   1.021   8.459  -1.313
  341    HA   CYS  45           HA       CYS  45  -0.560   8.495   1.102
  342   1HB   CYS  45          HB2       CYS  45  -0.462  10.350  -1.289
  343   2HB   CYS  45          HB1       CYS  45  -1.472  10.653   0.125
  344    H    ALA  46           HN       ALA  46  -1.454   8.316  -2.360
  345    HA   ALA  46           HA       ALA  46  -4.266   8.129  -1.950
  346   1HB   ALA  46          HB1       ALA  46  -3.043   8.469  -4.160
  347   2HB   ALA  46          HB2       ALA  46  -4.394   7.338  -4.208
  348   3HB   ALA  46          HB3       ALA  46  -2.741   6.730  -4.159
  349    H    ALA  47           HN       ALA  47  -1.831   5.528  -2.292
  350    HA   ALA  47           HA       ALA  47  -3.662   3.365  -1.946
  351   1HB   ALA  47          HB1       ALA  47  -1.306   3.112  -2.744
  352   2HB   ALA  47          HB2       ALA  47  -1.694   2.018  -1.416
  353   3HB   ALA  47          HB3       ALA  47  -0.746   3.474  -1.113
  354    H    LEU  48           HN       LEU  48  -1.862   5.348   0.384
  355    HA   LEU  48           HA       LEU  48  -2.396   3.813   2.698
  356   1HB   LEU  48          HB2       LEU  48  -0.775   5.657   2.658
  357   2HB   LEU  48          HB1       LEU  48  -2.082   6.817   2.445
  358    HG   LEU  48           HG       LEU  48  -3.024   6.164   4.639
  359   1HD1  LEU  48          HD11      LEU  48  -2.429   3.916   4.990
  360   2HD1  LEU  48          HD12      LEU  48  -1.362   4.766   6.100
  361   3HD1  LEU  48          HD13      LEU  48  -0.742   4.194   4.552
  362   1HD2  LEU  48          HD21      LEU  48  -1.376   7.265   5.986
  363   2HD2  LEU  48          HD22      LEU  48  -1.235   7.954   4.369
  364   3HD2  LEU  48          HD23      LEU  48  -0.068   6.752   4.919
  365    H    GLU  49           HN       GLU  49  -4.307   6.606   1.424
  366    HA   GLU  49           HA       GLU  49  -6.281   6.476   3.474
  367   1HB   GLU  49          HB2       GLU  49  -7.802   7.603   1.776
  368   2HB   GLU  49          HB1       GLU  49  -6.278   8.427   2.104
  369   1HG   GLU  49          HG2       GLU  49  -5.295   7.495   0.080
  370   2HG   GLU  49          HG1       GLU  49  -6.759   6.559  -0.234
  371    H    SER  50           HN       SER  50  -6.065   4.770   0.366
  372    HA   SER  50           HA       SER  50  -8.644   3.561   0.481
  373   1HB   SER  50          HB2       SER  50  -6.046   2.562  -0.725
  374   2HB   SER  50          HB1       SER  50  -7.607   1.787  -0.980
  375    HG   SER  50           HG       SER  50  -8.091   4.246  -1.490
  376    H    LEU  51           HN       LEU  51  -5.521   2.590   1.869
  377    HA   LEU  51           HA       LEU  51  -6.480   0.085   2.935
  378   1HB   LEU  51          HB2       LEU  51  -4.094   1.816   3.625
  379   2HB   LEU  51          HB1       LEU  51  -4.396   0.251   4.378
  380    HG   LEU  51           HG       LEU  51  -4.150   0.689   1.384
  381   1HD1  LEU  51          HD11      LEU  51  -1.921  -0.335   1.608
  382   2HD1  LEU  51          HD12      LEU  51  -2.127  -0.416   3.358
  383   3HD1  LEU  51          HD13      LEU  51  -2.025   1.151   2.554
  384   1HD2  LEU  51          HD21      LEU  51  -4.681  -1.696   3.135
  385   2HD2  LEU  51          HD22      LEU  51  -3.659  -1.936   1.718
  386   3HD2  LEU  51          HD23      LEU  51  -5.297  -1.323   1.527
  387    H    ILE  52           HN       ILE  52  -6.238   3.375   4.275
  388    HA   ILE  52           HA       ILE  52  -6.812   2.796   6.974
  389    HB   ILE  52           HB       ILE  52  -7.578   5.172   5.257
  390   1HG1  ILE  52          HG12      ILE  52  -5.168   4.858   5.647
  391   2HG1  ILE  52          HG11      ILE  52  -5.751   6.288   6.482
  392   1HG2  ILE  52          HG21      ILE  52  -9.182   5.211   7.027
  393   2HG2  ILE  52          HG22      ILE  52  -7.919   6.352   7.484
  394   3HG2  ILE  52          HG23      ILE  52  -7.970   4.753   8.226
  395   1HD1  ILE  52          HD11      ILE  52  -4.673   3.756   7.588
  396   2HD1  ILE  52          HD12      ILE  52  -6.052   4.422   8.459
  397   3HD1  ILE  52          HD13      ILE  52  -4.597   5.389   8.239
  398    H    ASN  53           HN       ASN  53  -8.828   2.318   4.250
  399    HA   ASN  53           HA       ASN  53 -11.352   2.548   5.744
  400   1HB   ASN  53          HB2       ASN  53 -10.689   1.455   2.992
  401   2HB   ASN  53          HB1       ASN  53 -12.324   1.539   3.648
  402   1HD2  ASN  53          HD21      ASN  53 -13.027   3.826   4.370
  403   2HD2  ASN  53          HD22      ASN  53 -12.465   5.139   3.451
  404    H    VAL  54           HN       VAL  54  -8.889   0.237   5.336
  405    HA   VAL  54           HA       VAL  54 -10.640  -2.089   5.898
  406    HB   VAL  54           HB       VAL  54  -7.623  -1.962   5.617
  407   1HG1  VAL  54          HG11      VAL  54  -7.881  -4.379   5.133
  408   2HG1  VAL  54          HG12      VAL  54  -9.610  -4.246   5.456
  409   3HG1  VAL  54          HG13      VAL  54  -8.445  -3.971   6.752
  410   1HG2  VAL  54          HG21      VAL  54  -8.883  -1.151   3.595
  411   2HG2  VAL  54          HG22      VAL  54  -9.689  -2.718   3.530
  412   3HG2  VAL  54          HG23      VAL  54  -7.943  -2.613   3.305
  413    H    SER  55           HN       SER  55 -11.059  -2.649   7.978
  414    HA   SER  55           HA       SER  55  -9.052  -1.958  10.104
  415   1HB   SER  55          HB2       SER  55 -12.073  -1.812  10.326
  416   2HB   SER  55          HB1       SER  55 -10.930  -1.512  11.631
  417    HG   SER  55           HG       SER  55 -11.001  -0.099   9.167
  418    H    GLY  56           HN       GLY  56  -9.060  -3.442  11.919
  419   1HA   GLY  56          HA2       GLY  56  -9.607  -5.504  13.009
  420   2HA   GLY  56          HA1       GLY  56 -10.625  -5.940  11.635
  421    H    CYS  57           HN       CYS  57  -8.042  -4.887  10.087
  422    HA   CYS  57           HA       CYS  57  -6.831  -7.606   9.914
  423   1HB   CYS  57          HB2       CYS  57  -6.534  -5.199   8.100
  424   2HB   CYS  57          HB1       CYS  57  -5.918  -6.821   7.782
  425    H    SER  58           HN       SER  58  -5.403  -7.570  11.691
  426    HA   SER  58           HA       SER  58  -3.623  -5.373  12.264
  427   1HB   SER  58          HB2       SER  58  -4.228  -7.042  13.970
  428   2HB   SER  58          HB1       SER  58  -3.435  -8.302  13.029
  429    HG   SER  58           HG       SER  58  -1.743  -6.273  13.323
  430    H    ALA  59           HN       ALA  59  -3.374  -8.253  10.260
  431    HA   ALA  59           HA       ALA  59  -0.603  -8.409   9.889
  432   1HB   ALA  59          HB1       ALA  59  -2.672  -8.815   7.717
  433   2HB   ALA  59          HB2       ALA  59  -2.314  -9.998   8.976
  434   3HB   ALA  59          HB3       ALA  59  -1.070  -9.547   7.810
  435    H    ILE  60           HN       ILE  60  -2.846  -6.060   8.460
  436    HA   ILE  60           HA       ILE  60  -0.617  -4.975   6.787
  437    HB   ILE  60           HB       ILE  60  -2.370  -3.695   5.636
  438   1HG1  ILE  60          HG12      ILE  60  -4.320  -5.165   7.429
  439   2HG1  ILE  60          HG11      ILE  60  -3.869  -3.482   7.672
  440   1HG2  ILE  60          HG21      ILE  60  -1.782  -6.161   5.125
  441   2HG2  ILE  60          HG22      ILE  60  -3.289  -5.534   4.461
  442   3HG2  ILE  60          HG23      ILE  60  -3.319  -6.552   5.900
  443   1HD1  ILE  60          HD11      ILE  60  -5.981  -3.738   6.360
  444   2HD1  ILE  60          HD12      ILE  60  -5.060  -4.570   5.109
  445   3HD1  ILE  60          HD13      ILE  60  -4.719  -2.879   5.477
  446    H    GLU  61           HN       GLU  61  -1.917  -4.368   9.843
  447    HA   GLU  61           HA       GLU  61  -2.072  -1.516   9.841
  448   1HB   GLU  61          HB2       GLU  61  -1.314  -3.487  12.013
  449   2HB   GLU  61          HB1       GLU  61  -1.432  -1.752  12.305
  450   1HG   GLU  61          HG2       GLU  61  -3.688  -3.344  11.071
  451   2HG   GLU  61          HG1       GLU  61  -3.536  -3.104  12.812
  452    H    LYS  62           HN       LYS  62   0.676  -3.725  10.250
  453    HA   LYS  62           HA       LYS  62   2.636  -1.715  10.823
  454   1HB   LYS  62          HB2       LYS  62   2.886  -4.444   9.526
  455   2HB   LYS  62          HB1       LYS  62   4.269  -3.438   9.962
  456   1HG   LYS  62          HG2       LYS  62   3.511  -3.401  12.305
  457   2HG   LYS  62          HG1       LYS  62   2.130  -4.405  11.875
  458   1HD   LYS  62          HD2       LYS  62   3.653  -6.195  11.141
  459   2HD   LYS  62          HD1       LYS  62   5.041  -5.193  11.568
  460   1HE   LYS  62          HE2       LYS  62   4.295  -5.144  13.915
  461   2HE   LYS  62          HE1       LYS  62   2.891  -6.126  13.495
  462   1HZ   LYS  62          HZ1       LYS  62   5.091  -7.207  14.385
  463   2HZ   LYS  62          HZ2       LYS  62   5.543  -7.115  12.750
  464   3HZ   LYS  62          HZ3       LYS  62   4.152  -7.979  13.203
  465    H    THR  63           HN       THR  63   1.409  -3.083   7.798
  466    HA   THR  63           HA       THR  63   3.225  -1.838   6.015
  467    HB   THR  63           HB       THR  63   0.287  -2.453   5.595
  468    HG1  THR  63           HG1      THR  63   1.641  -4.234   4.415
  469   1HG2  THR  63          HG21      THR  63   0.983  -1.007   3.838
  470   2HG2  THR  63          HG22      THR  63   1.080  -2.639   3.176
  471   3HG2  THR  63          HG23      THR  63   2.547  -1.809   3.698
  472    H    GLN  64           HN       GLN  64   0.223  -0.651   7.474
  473    HA   GLN  64           HA       GLN  64   0.004   1.768   6.006
  474   1HB   GLN  64          HB2       GLN  64  -0.800   1.069   8.842
  475   2HB   GLN  64          HB1       GLN  64  -1.243   2.584   8.054
  476   1HG   GLN  64          HG2       GLN  64  -2.369   1.337   6.258
  477   2HG   GLN  64          HG1       GLN  64  -1.910  -0.186   7.021
  478   1HE2  GLN  64          HE21      GLN  64  -4.672   0.653   6.591
  479   2HE2  GLN  64          HE22      GLN  64  -5.385   0.832   8.121
  480    H    ARG  65           HN       ARG  65   1.846   1.059   9.000
  481    HA   ARG  65           HA       ARG  65   2.659   3.777   9.440
  482   1HB   ARG  65          HB2       ARG  65   3.953   1.163  10.265
  483   2HB   ARG  65          HB1       ARG  65   4.505   2.747  10.810
  484   1HG   ARG  65          HG2       ARG  65   2.257   3.195  11.754
  485   2HG   ARG  65          HG1       ARG  65   1.737   1.587  11.245
  486   1HD   ARG  65          HD2       ARG  65   3.984   2.192  13.191
  487   2HD   ARG  65          HD1       ARG  65   2.396   1.553  13.611
  488    HE   ARG  65           HE       ARG  65   3.382  -0.257  11.752
  489   1HH1  ARG  65          HH21      ARG  65   4.448   1.136  14.722
  490   2HH1  ARG  65          HH22      ARG  65   5.386  -0.245  15.185
  491   1HH2  ARG  65          HH11      ARG  65   4.618  -2.053  12.331
  492   2HH2  ARG  65          HH12      ARG  65   5.474  -2.055  13.835
  493    H    MET  66           HN       MET  66   4.237   1.084   7.692
  494    HA   MET  66           HA       MET  66   6.605   2.554   7.044
  495   1HB   MET  66          HB2       MET  66   5.260   0.238   5.619
  496   2HB   MET  66          HB1       MET  66   6.856   0.862   5.196
  497   1HG   MET  66          HG2       MET  66   7.514   0.487   7.633
  498   2HG   MET  66          HG1       MET  66   6.001  -0.398   7.813
  499   1HE   MET  66          HE1       MET  66   6.316  -3.566   5.910
  500   2HE   MET  66          HE2       MET  66   5.447  -2.120   5.409
  501   3HE   MET  66          HE3       MET  66   5.483  -2.569   7.110
  502    H    LEU  67           HN       LEU  67   3.485   2.221   5.375
  503    HA   LEU  67           HA       LEU  67   4.222   3.702   3.029
  504   1HB   LEU  67          HB2       LEU  67   1.539   3.328   4.385
  505   2HB   LEU  67          HB1       LEU  67   1.740   4.095   2.814
  506    HG   LEU  67           HG       LEU  67   2.699   1.287   3.451
  507   1HD1  LEU  67          HD11      LEU  67   0.276   1.354   3.653
  508   2HD1  LEU  67          HD12      LEU  67   0.697   0.568   2.132
  509   3HD1  LEU  67          HD13      LEU  67   0.140   2.241   2.134
  510   1HD2  LEU  67          HD21      LEU  67   3.892   1.974   1.544
  511   2HD2  LEU  67          HD22      LEU  67   2.576   2.992   0.961
  512   3HD2  LEU  67          HD23      LEU  67   2.463   1.240   0.821
  513    H    SER  68           HN       SER  68   2.986   4.648   6.203
  514    HA   SER  68           HA       SER  68   2.462   7.384   5.654
  515   1HB   SER  68          HB2       SER  68   3.515   6.123   8.206
  516   2HB   SER  68          HB1       SER  68   2.830   7.741   8.085
  517    HG   SER  68           HG       SER  68   0.870   6.891   7.691
  518    H    GLY  69           HN       GLY  69   5.463   5.699   6.519
  519   1HA   GLY  69          HA2       GLY  69   7.173   7.888   6.909
  520   2HA   GLY  69          HA1       GLY  69   7.690   6.376   6.158
  521    H    PHE  70           HN       PHE  70   5.746   6.660   3.941
  522    HA   PHE  70           HA       PHE  70   7.317   8.586   2.296
  523   1HB   PHE  70          HB2       PHE  70   5.318   6.443   1.506
  524   2HB   PHE  70          HB1       PHE  70   6.214   7.457   0.377
  525    HD1  PHE  70           HD1      PHE  70   8.634   7.186   0.078
  526    HD2  PHE  70           HD2      PHE  70   6.416   4.666   2.759
  527    HE1  PHE  70           HE1      PHE  70  10.538   5.600   0.163
  528    HE2  PHE  70           HE2      PHE  70   8.323   3.080   2.844
  529    HZ   PHE  70           HZ       PHE  70  10.384   3.547   1.544
  530    H    CYS  71           HN       CYS  71   4.504   8.546   4.083
  531    HA   CYS  71           HA       CYS  71   3.344  10.797   2.486
  532   1HB   CYS  71          HB2       CYS  71   2.101   8.608   2.121
  533   2HB   CYS  71          HB1       CYS  71   1.671   8.664   3.830
  534    HA   PRO  72           HA       PRO  72   4.268  11.827   6.974
  535   1HB   PRO  72          HB2       PRO  72   4.120  14.567   5.840
  536   2HB   PRO  72          HB1       PRO  72   5.387  13.824   6.826
  537   1HG   PRO  72          HG2       PRO  72   5.647  14.313   4.133
  538   2HG   PRO  72          HG1       PRO  72   6.537  13.047   4.990
  539   1HD   PRO  72          HD2       PRO  72   4.304  12.775   3.064
  540   2HD   PRO  72          HD1       PRO  72   5.504  11.557   3.569
  541    H    HIS  73           HN       HIS  73   1.683  12.873   4.825
  542    HA   HIS  73           HA       HIS  73   0.145  13.976   7.122
  543   1HB   HIS  73          HB2       HIS  73  -1.281  14.976   5.556
  544   2HB   HIS  73          HB1       HIS  73   0.275  15.028   4.737
  545    HD1  HIS  73           HD1      HIS  73  -3.086  13.396   4.622
  546    HD2  HIS  73           HD2      HIS  73   0.499  13.233   2.502
  547    HE1  HIS  73           HE1      HIS  73  -3.571  12.116   2.492
  548    H    LYS  74           HN       LYS  74  -0.932  12.502   8.338
  549    HA   LYS  74           HA       LYS  74  -1.687   9.894   7.246
  550   1HB   LYS  74          HB2       LYS  74  -2.170  11.197   9.938
  551   2HB   LYS  74          HB1       LYS  74  -2.680   9.557   9.541
  552   1HG   LYS  74          HG2       LYS  74  -0.340   8.952   9.022
  553   2HG   LYS  74          HG1       LYS  74   0.174  10.584   9.440
  554   1HD   LYS  74          HD2       LYS  74  -1.341   8.842  11.395
  555   2HD   LYS  74          HD1       LYS  74   0.413   8.774  11.265
  556   1HE   LYS  74          HE2       LYS  74   0.394  11.317  11.614
  557   2HE   LYS  74          HE1       LYS  74  -1.296  11.133  12.082
  558   1HZ   LYS  74          HZ1       LYS  74   1.060   9.861  13.355
  559   2HZ   LYS  74          HZ2       LYS  74  -0.548   9.467  13.732
  560   3HZ   LYS  74          HZ3       LYS  74   0.037  11.033  14.032
  561    H    VAL  75           HN       VAL  75  -3.804   9.175   6.838
  562    HA   VAL  75           HA       VAL  75  -5.887  11.327   6.625
  563    HB   VAL  75           HB       VAL  75  -5.655   8.720   5.095
  564   1HG1  VAL  75          HG11      VAL  75  -7.469  11.130   4.772
  565   2HG1  VAL  75          HG12      VAL  75  -7.963   9.528   5.318
  566   3HG1  VAL  75          HG13      VAL  75  -7.398   9.759   3.665
  567   1HG2  VAL  75          HG21      VAL  75  -5.102  10.302   3.190
  568   2HG2  VAL  75          HG22      VAL  75  -3.853  10.179   4.428
  569   3HG2  VAL  75          HG23      VAL  75  -4.924  11.578   4.399
  570    H    SER  76           HN       SER  76  -7.816  11.033   7.691
  571    HA   SER  76           HA       SER  76  -8.031   8.682   9.486
  572   1HB   SER  76          HB2       SER  76  -9.837   9.952  10.553
  573   2HB   SER  76          HB1       SER  76  -8.402  10.959  10.391
  574    HG   SER  76           HG       SER  76  -9.836  12.248   9.491
  575    H    ALA  77           HN       ALA  77 -10.193   7.632   9.703
  576    HA   ALA  77           HA       ALA  77 -11.135   6.626   7.196
  577   1HB   ALA  77          HB1       ALA  77 -12.947   5.595   8.553
  578   2HB   ALA  77          HB2       ALA  77 -12.433   6.561   9.936
  579   3HB   ALA  77          HB3       ALA  77 -11.356   5.336   9.267
  580    H    GLY  78           HN       GLY  78 -11.954   9.459   8.999
  581   1HA   GLY  78          HA2       GLY  78 -14.578   9.776   7.683
  582   2HA   GLY  78          HA1       GLY  78 -13.850  10.897   8.833
  583    H    GLN  79           HN       GLN  79 -11.312  11.161   7.507
  584    HA   GLN  79           HA       GLN  79 -12.160  12.959   5.298
  585   1HB   GLN  79          HB2       GLN  79  -9.479  12.640   6.676
  586   2HB   GLN  79          HB1       GLN  79  -9.884  13.876   5.486
  587   1HG   GLN  79          HG2       GLN  79 -11.315  13.507   8.133
  588   2HG   GLN  79          HG1       GLN  79 -10.063  14.712   7.831
  589   1HE2  GLN  79          HE21      GLN  79 -13.131  14.917   8.345
  590   2HE2  GLN  79          HE22      GLN  79 -13.668  15.937   7.098
  591    H    PHE  80           HN       PHE  80 -11.708  12.540   3.194
  592    HA   PHE  80           HA       PHE  80  -9.749  10.374   2.525
  593   1HB   PHE  80          HB2       PHE  80 -12.523  10.790   1.378
  594   2HB   PHE  80          HB1       PHE  80 -11.313   9.715   0.671
  595    HD1  PHE  80           HD1      PHE  80 -13.887  10.027   3.157
  596    HD2  PHE  80           HD2      PHE  80 -10.265   7.927   2.200
  597    HE1  PHE  80           HE1      PHE  80 -14.483   8.257   4.790
  598    HE2  PHE  80           HE2      PHE  80 -10.859   6.157   3.831
  599    HZ   PHE  80           HZ       PHE  80 -12.968   6.319   5.124
  600    H    SER  81           HN       SER  81  -8.617  10.726   0.539
  601    HA   SER  81           HA       SER  81  -8.917  13.503  -0.577
  602   1HB   SER  81          HB2       SER  81  -6.423  11.846  -0.141
  603   2HB   SER  81          HB1       SER  81  -6.459  13.366  -1.030
  604    HG   SER  81           HG       SER  81  -7.431  14.261   0.932
  605    H    SER  82           HN       SER  82  -8.576  10.084  -1.351
  606    HA   SER  82           HA       SER  82  -8.591  10.812  -4.272
  607   1HB   SER  82          HB2       SER  82  -6.549   9.591  -3.503
  608   2HB   SER  82          HB1       SER  82  -7.580   8.246  -3.026
  609    HG   SER  82           HG       SER  82  -7.654   7.669  -5.036
  610    H    LEU  83           HN       LEU  83 -10.605   9.681  -1.881
  611    HA   LEU  83           HA       LEU  83 -11.943   7.654  -3.579
  612   1HB   LEU  83          HB2       LEU  83 -12.777   8.715  -0.868
  613   2HB   LEU  83          HB1       LEU  83 -13.388   7.272  -1.669
  614    HG   LEU  83           HG       LEU  83 -10.608   7.735  -0.564
  615   1HD1  LEU  83          HD11      LEU  83 -12.610   6.963   0.882
  616   2HD1  LEU  83          HD12      LEU  83 -11.139   5.990   0.949
  617   3HD1  LEU  83          HD13      LEU  83 -12.511   5.452  -0.019
  618   1HD2  LEU  83          HD21      LEU  83 -10.161   6.569  -2.583
  619   2HD2  LEU  83          HD22      LEU  83 -11.639   5.615  -2.459
  620   3HD2  LEU  83          HD23      LEU  83 -10.286   5.289  -1.376
  621    H    HIS  84           HN       HIS  84 -11.896  10.608  -4.321
  622    HA   HIS  84           HA       HIS  84 -14.666  11.486  -3.969
  623   1HB   HIS  84          HB2       HIS  84 -12.789  12.552  -6.085
  624   2HB   HIS  84          HB1       HIS  84 -14.076  13.398  -5.226
  625    HD1  HIS  84           HD1      HIS  84 -13.351  12.661  -2.328
  626    HD2  HIS  84           HD2      HIS  84 -10.561  13.893  -5.166
  627    HE1  HIS  84           HE1      HIS  84 -11.370  13.567  -1.041
  628    H    VAL  85           HN       VAL  85 -12.742   9.981  -6.519
  629    HA   VAL  85           HA       VAL  85 -14.895  10.008  -8.468
  630    HB   VAL  85           HB       VAL  85 -12.548   9.957  -9.179
  631   1HG1  VAL  85          HG11      VAL  85 -11.159   7.981  -8.776
  632   2HG1  VAL  85          HG12      VAL  85 -12.478   7.208  -7.897
  633   3HG1  VAL  85          HG13      VAL  85 -11.704   8.649  -7.237
  634   1HG2  VAL  85          HG21      VAL  85 -12.734   8.220 -10.847
  635   2HG2  VAL  85          HG22      VAL  85 -14.357   8.847 -10.558
  636   3HG2  VAL  85          HG23      VAL  85 -13.865   7.309  -9.848
  637    H    ARG  86           HN       ARG  86 -16.176   8.212  -9.114
  638    HA   ARG  86           HA       ARG  86 -16.675   6.266  -6.944
  639   1HB   ARG  86          HB2       ARG  86 -18.132   6.913  -9.520
  640   2HB   ARG  86          HB1       ARG  86 -18.630   5.628  -8.419
  641   1HG   ARG  86          HG2       ARG  86 -18.844   7.270  -6.590
  642   2HG   ARG  86          HG1       ARG  86 -18.350   8.560  -7.687
  643   1HD   ARG  86          HD2       ARG  86 -20.302   8.073  -9.128
  644   2HD   ARG  86          HD1       ARG  86 -20.806   6.809  -8.006
  645    HE   ARG  86           HE       ARG  86 -20.600   9.062  -6.409
  646   1HH1  ARG  86          HH21      ARG  86 -22.193   8.212  -9.350
  647   2HH1  ARG  86          HH22      ARG  86 -23.513   9.307  -9.104
  648   1HH2  ARG  86          HH11      ARG  86 -22.312  10.498  -6.078
  649   2HH2  ARG  86          HH12      ARG  86 -23.581  10.598  -7.252
  650    H    ASP  87           HN       ASP  87 -14.521   5.226  -7.429
  651    HA   ASP  87           HA       ASP  87 -14.370   3.622  -9.895
  652   1HB   ASP  87          HB2       ASP  87 -12.596   3.820  -7.442
  653   2HB   ASP  87          HB1       ASP  87 -12.270   2.733  -8.792
  654    H    THR  88           HN       THR  88 -13.880   1.187  -9.539
  655    HA   THR  88           HA       THR  88 -16.045   0.108  -7.827
  656    HB   THR  88           HB       THR  88 -14.183  -1.408  -9.678
  657    HG1  THR  88           HG1      THR  88 -15.925  -1.169 -11.175
  658   1HG2  THR  88          HG21      THR  88 -16.036  -3.027  -9.700
  659   2HG2  THR  88          HG22      THR  88 -16.957  -1.991  -8.610
  660   3HG2  THR  88          HG23      THR  88 -15.465  -2.750  -8.057
  661    H    LYS  89           HN       LYS  89 -15.645  -1.358  -6.114
  662    HA   LYS  89           HA       LYS  89 -12.999  -1.089  -4.876
  663   1HB   LYS  89          HB2       LYS  89 -15.414  -2.697  -3.991
  664   2HB   LYS  89          HB1       LYS  89 -13.976  -2.384  -3.023
  665   1HG   LYS  89          HG2       LYS  89 -14.427   0.038  -3.127
  666   2HG   LYS  89          HG1       LYS  89 -15.870  -0.277  -4.093
  667   1HD   LYS  89          HD2       LYS  89 -16.811  -1.626  -2.252
  668   2HD   LYS  89          HD1       LYS  89 -15.372  -1.310  -1.285
  669   1HE   LYS  89          HE2       LYS  89 -17.399   0.180  -0.822
  670   2HE   LYS  89          HE1       LYS  89 -15.870   1.010  -1.116
  671   1HZ   LYS  89          HZ1       LYS  89 -17.783   0.443  -3.299
  672   2HZ   LYS  89          HZ2       LYS  89 -16.506   1.565  -3.274
  673   3HZ   LYS  89          HZ3       LYS  89 -17.905   1.844  -2.352
  674    H    ILE  90           HN       ILE  90 -11.631  -2.867  -4.345
  675    HA   ILE  90           HA       ILE  90 -12.108  -5.408  -5.857
  676    HB   ILE  90           HB       ILE  90  -9.629  -5.382  -6.365
  677   1HG1  ILE  90          HG12      ILE  90  -9.859  -2.440  -5.675
  678   2HG1  ILE  90          HG11      ILE  90  -9.164  -3.628  -4.574
  679   1HG2  ILE  90          HG21      ILE  90  -9.864  -3.703  -8.214
  680   2HG2  ILE  90          HG22      ILE  90 -11.381  -3.175  -7.483
  681   3HG2  ILE  90          HG23      ILE  90 -11.225  -4.818  -8.105
  682   1HD1  ILE  90          HD11      ILE  90  -7.590  -2.301  -6.202
  683   2HD1  ILE  90          HD12      ILE  90  -8.151  -3.465  -7.402
  684   3HD1  ILE  90          HD13      ILE  90  -7.321  -4.022  -5.948
  685    H    GLU  91           HN       GLU  91 -10.726  -7.199  -5.000
  686    HA   GLU  91           HA       GLU  91 -10.884  -7.328  -2.132
  687   1HB   GLU  91          HB2       GLU  91  -9.464  -9.093  -4.147
  688   2HB   GLU  91          HB1       GLU  91  -9.612  -9.484  -2.434
  689   1HG   GLU  91          HG2       GLU  91 -11.962  -8.969  -4.283
  690   2HG   GLU  91          HG1       GLU  91 -11.378 -10.571  -3.834
  691    H    VAL  92           HN       VAL  92  -9.204  -7.284  -0.574
  692    HA   VAL  92           HA       VAL  92  -7.098  -5.423  -1.003
  693    HB   VAL  92           HB       VAL  92  -7.469  -7.570   1.101
  694   1HG1  VAL  92          HG11      VAL  92  -5.333  -5.455   0.789
  695   2HG1  VAL  92          HG12      VAL  92  -5.130  -7.174   1.127
  696   3HG1  VAL  92          HG13      VAL  92  -5.767  -6.099   2.372
  697   1HG2  VAL  92          HG21      VAL  92  -9.041  -5.506   0.852
  698   2HG2  VAL  92          HG22      VAL  92  -7.666  -4.574   1.442
  699   3HG2  VAL  92          HG23      VAL  92  -8.365  -5.846   2.444
  700    H    ALA  93           HN       ALA  93  -7.040  -8.995  -1.012
  701    HA   ALA  93           HA       ALA  93  -4.277  -9.403  -1.322
  702   1HB   ALA  93          HB1       ALA  93  -6.628 -10.912  -2.482
  703   2HB   ALA  93          HB2       ALA  93  -5.701 -11.309  -1.035
  704   3HB   ALA  93          HB3       ALA  93  -4.962 -11.475  -2.628
  705    H    GLN  94           HN       GLN  94  -6.692  -8.656  -3.829
  706    HA   GLN  94           HA       GLN  94  -4.743  -8.812  -5.981
  707   1HB   GLN  94          HB2       GLN  94  -7.196  -9.155  -6.315
  708   2HB   GLN  94          HB1       GLN  94  -7.455  -7.451  -5.946
  709   1HG   GLN  94          HG2       GLN  94  -6.018  -6.814  -7.844
  710   2HG   GLN  94          HG1       GLN  94  -5.744  -8.518  -8.211
  711   1HE2  GLN  94          HE21      GLN  94  -6.875  -7.161 -10.280
  712   2HE2  GLN  94          HE22      GLN  94  -8.537  -7.483 -10.406
  713    H    PHE  95           HN       PHE  95  -6.095  -6.268  -3.950
  714    HA   PHE  95           HA       PHE  95  -5.039  -4.004  -5.321
  715   1HB   PHE  95          HB2       PHE  95  -6.668  -3.795  -3.492
  716   2HB   PHE  95          HB1       PHE  95  -5.487  -4.440  -2.353
  717    HD1  PHE  95           HD1      PHE  95  -6.565  -1.492  -4.227
  718    HD2  PHE  95           HD2      PHE  95  -3.427  -3.158  -1.813
  719    HE1  PHE  95           HE1      PHE  95  -5.643   0.777  -3.863
  720    HE2  PHE  95           HE2      PHE  95  -2.503  -0.885  -1.451
  721    HZ   PHE  95           HZ       PHE  95  -3.613   1.081  -2.475
  722    H    VAL  96           HN       VAL  96  -3.656  -5.977  -2.688
  723    HA   VAL  96           HA       VAL  96  -1.222  -4.517  -2.450
  724    HB   VAL  96           HB       VAL  96  -1.808  -7.435  -1.877
  725   1HG1  VAL  96          HG11      VAL  96   0.191  -7.040  -0.258
  726   2HG1  VAL  96          HG12      VAL  96   0.580  -5.676  -1.307
  727   3HG1  VAL  96          HG13      VAL  96   0.545  -7.313  -1.963
  728   1HG2  VAL  96          HG21      VAL  96  -1.938  -6.561   0.482
  729   2HG2  VAL  96          HG22      VAL  96  -3.214  -5.954  -0.574
  730   3HG2  VAL  96          HG23      VAL  96  -1.838  -4.926  -0.174
  731    H    LYS  97           HN       LYS  97  -1.991  -7.416  -4.412
  732    HA   LYS  97           HA       LYS  97   0.637  -7.785  -5.434
  733   1HB   LYS  97          HB2       LYS  97  -2.070  -8.447  -6.614
  734   2HB   LYS  97          HB1       LYS  97  -0.546  -8.944  -7.353
  735   1HG   LYS  97          HG2       LYS  97   0.086 -10.113  -5.273
  736   2HG   LYS  97          HG1       LYS  97  -1.437  -9.620  -4.533
  737   1HD   LYS  97          HD2       LYS  97  -2.696 -10.874  -6.215
  738   2HD   LYS  97          HD1       LYS  97  -1.197 -11.318  -7.033
  739   1HE   LYS  97          HE2       LYS  97  -1.850 -12.031  -4.162
  740   2HE   LYS  97          HE1       LYS  97  -2.062 -13.122  -5.533
  741   1HZ   LYS  97          HZ1       LYS  97   0.324 -12.418  -4.134
  742   2HZ   LYS  97          HZ2       LYS  97   0.479 -12.155  -5.806
  743   3HZ   LYS  97          HZ3       LYS  97   0.049 -13.691  -5.219
  744    H    ASP  98           HN       ASP  98  -2.076  -5.871  -6.767
  745    HA   ASP  98           HA       ASP  98  -0.709  -4.980  -9.109
  746   1HB   ASP  98          HB2       ASP  98  -2.877  -3.683  -7.433
  747   2HB   ASP  98          HB1       ASP  98  -2.325  -3.029  -8.975
  748    H    LEU  99           HN       LEU  99  -0.854  -3.712  -5.819
  749    HA   LEU  99           HA       LEU  99   0.656  -1.330  -6.249
  750   1HB   LEU  99          HB2       LEU  99  -0.682  -1.746  -4.221
  751   2HB   LEU  99          HB1       LEU  99   0.403  -3.057  -3.765
  752    HG   LEU  99           HG       LEU  99   2.274  -1.461  -3.605
  753   1HD1  LEU  99          HD11      LEU  99   0.194   0.424  -4.678
  754   2HD1  LEU  99          HD12      LEU  99   1.909   0.307  -5.068
  755   3HD1  LEU  99          HD13      LEU  99   1.404   1.060  -3.558
  756   1HD2  LEU  99          HD21      LEU  99  -0.223  -0.681  -2.071
  757   2HD2  LEU  99          HD22      LEU  99   1.415  -0.205  -1.621
  758   3HD2  LEU  99          HD23      LEU  99   0.955  -1.907  -1.604
  759    H    LEU 100           HN       LEU 100   1.620  -4.658  -5.503
  760    HA   LEU 100           HA       LEU 100   4.352  -4.208  -4.959
  761   1HB   LEU 100          HB2       LEU 100   3.297  -6.370  -4.571
  762   2HB   LEU 100          HB1       LEU 100   3.026  -6.579  -6.299
  763    HG   LEU 100           HG       LEU 100   5.422  -6.675  -6.716
  764   1HD1  LEU 100          HD11      LEU 100   6.894  -6.783  -4.547
  765   2HD1  LEU 100          HD12      LEU 100   5.581  -5.855  -3.822
  766   3HD1  LEU 100          HD13      LEU 100   6.458  -5.213  -5.212
  767   1HD2  LEU 100          HD21      LEU 100   4.789  -8.395  -4.303
  768   2HD2  LEU 100          HD22      LEU 100   5.923  -8.761  -5.604
  769   3HD2  LEU 100          HD23      LEU 100   4.189  -8.730  -5.927
  770    H    LEU 101           HN       LEU 101   2.780  -4.733  -8.149
  771    HA   LEU 101           HA       LEU 101   5.219  -4.771  -9.635
  772   1HB   LEU 101          HB2       LEU 101   2.387  -4.021 -10.330
  773   2HB   LEU 101          HB1       LEU 101   3.666  -3.760 -11.508
  774    HG   LEU 101           HG       LEU 101   2.432  -5.983 -11.678
  775   1HD1  LEU 101          HD11      LEU 101   4.325  -7.097 -12.454
  776   2HD1  LEU 101          HD12      LEU 101   5.344  -6.523 -11.140
  777   3HD1  LEU 101          HD13      LEU 101   4.896  -5.432 -12.448
  778   1HD2  LEU 101          HD21      LEU 101   4.115  -6.797  -9.304
  779   2HD2  LEU 101          HD22      LEU 101   2.804  -7.687 -10.076
  780   3HD2  LEU 101          HD23      LEU 101   2.448  -6.254  -9.116
  781    H    HIS 102           HN       HIS 102   3.144  -2.029  -8.707
  782    HA   HIS 102           HA       HIS 102   4.808  -0.072 -10.010
  783   1HB   HIS 102          HB2       HIS 102   2.648   0.091  -7.910
  784   2HB   HIS 102          HB1       HIS 102   3.547   1.524  -8.407
  785    HD1  HIS 102           HD1      HIS 102   3.211   2.380 -10.824
  786    HD2  HIS 102           HD2      HIS 102   0.916  -0.971  -9.904
  787    HE1  HIS 102           HE1      HIS 102   1.547   2.124 -12.708
  788    H    LEU 103           HN       LEU 103   4.765  -1.317  -6.654
  789    HA   LEU 103           HA       LEU 103   6.524   0.619  -5.575
  790   1HB   LEU 103          HB2       LEU 103   6.164  -2.305  -4.896
  791   2HB   LEU 103          HB1       LEU 103   7.185  -1.224  -3.953
  792    HG   LEU 103           HG       LEU 103   4.258  -0.680  -4.524
  793   1HD1  LEU 103          HD11      LEU 103   4.029  -1.363  -2.051
  794   2HD1  LEU 103          HD12      LEU 103   5.612  -2.117  -2.234
  795   3HD1  LEU 103          HD13      LEU 103   4.256  -2.667  -3.215
  796   1HD2  LEU 103          HD21      LEU 103   5.185   1.375  -3.874
  797   2HD2  LEU 103          HD22      LEU 103   6.389   0.622  -2.829
  798   3HD2  LEU 103          HD23      LEU 103   4.705   0.713  -2.317
  799    H    LYS 104           HN       LYS 104   7.445  -2.588  -6.947
  800    HA   LYS 104           HA       LYS 104  10.253  -1.944  -6.755
  801   1HB   LYS 104          HB2       LYS 104  10.629  -3.929  -8.158
  802   2HB   LYS 104          HB1       LYS 104   9.510  -4.275  -6.845
  803   1HG   LYS 104          HG2       LYS 104   7.604  -4.004  -8.390
  804   2HG   LYS 104          HG1       LYS 104   8.727  -3.658  -9.709
  805   1HD   LYS 104          HD2       LYS 104   9.736  -5.861  -9.500
  806   2HD   LYS 104          HD1       LYS 104   8.759  -6.215  -8.077
  807   1HE   LYS 104          HE2       LYS 104   6.797  -6.454  -9.323
  808   2HE   LYS 104          HE1       LYS 104   7.411  -5.497 -10.674
  809   1HZ   LYS 104          HZ1       LYS 104   7.348  -8.160 -10.652
  810   2HZ   LYS 104          HZ2       LYS 104   8.913  -7.898 -10.043
  811   3HZ   LYS 104          HZ3       LYS 104   8.465  -7.259 -11.553
  812    H    LYS 105           HN       LYS 105   7.813  -1.092  -9.037
  813    HA   LYS 105           HA       LYS 105   9.476  -0.763 -11.347
  814   1HB   LYS 105          HB2       LYS 105   6.970  -0.782 -11.354
  815   2HB   LYS 105          HB1       LYS 105   7.001   0.833 -10.643
  816   1HG   LYS 105          HG2       LYS 105   8.304   1.657 -12.573
  817   2HG   LYS 105          HG1       LYS 105   8.267   0.043 -13.283
  818   1HD   LYS 105          HD2       LYS 105   5.801   0.136 -13.368
  819   2HD   LYS 105          HD1       LYS 105   5.842   1.752 -12.662
  820   1HE   LYS 105          HE2       LYS 105   5.654   2.086 -15.020
  821   2HE   LYS 105          HE1       LYS 105   7.339   2.422 -14.620
  822   1HZ   LYS 105          HZ1       LYS 105   7.808   0.937 -16.195
  823   2HZ   LYS 105          HZ2       LYS 105   6.223   0.326 -16.236
  824   3HZ   LYS 105          HZ3       LYS 105   7.328  -0.246 -15.079
  825    H    LEU 106           HN       LEU 106   8.502   1.635  -8.838
  826    HA   LEU 106           HA       LEU 106   9.892   3.827 -10.021
  827   1HB   LEU 106          HB2       LEU 106   9.063   3.222  -7.183
  828   2HB   LEU 106          HB1       LEU 106  10.010   4.657  -7.544
  829    HG   LEU 106           HG       LEU 106   7.463   4.956  -7.496
  830   1HD1  LEU 106          HD11      LEU 106   9.192   6.473  -8.689
  831   2HD1  LEU 106          HD12      LEU 106   7.504   6.621  -9.164
  832   3HD1  LEU 106          HD13      LEU 106   8.624   5.721 -10.178
  833   1HD2  LEU 106          HD21      LEU 106   7.108   2.800  -8.821
  834   2HD2  LEU 106          HD22      LEU 106   7.584   3.711 -10.248
  835   3HD2  LEU 106          HD23      LEU 106   6.159   4.191  -9.329
  836    H    PHE 107           HN       PHE 107  11.051   1.089  -8.227
  837    HA   PHE 107           HA       PHE 107  13.515   2.155  -7.299
  838   1HB   PHE 107          HB2       PHE 107  12.683  -0.084  -6.635
  839   2HB   PHE 107          HB1       PHE 107  12.980  -0.664  -8.277
  840    HD1  PHE 107           HD1      PHE 107  14.624   0.825  -5.294
  841    HD2  PHE 107           HD2      PHE 107  15.168  -1.281  -8.996
  842    HE1  PHE 107           HE1      PHE 107  17.008   0.471  -4.737
  843    HE2  PHE 107           HE2      PHE 107  17.558  -1.647  -8.434
  844    HZ   PHE 107           HZ       PHE 107  18.477  -0.770  -6.302
  845    H    ARG 108           HN       ARG 108  12.586   0.835 -10.442
  846    HA   ARG 108           HA       ARG 108  15.165   0.706 -11.625
  847   1HB   ARG 108          HB2       ARG 108  12.519   1.397 -12.940
  848   2HB   ARG 108          HB1       ARG 108  13.966   0.854 -13.780
  849   1HG   ARG 108          HG2       ARG 108  12.568  -0.780 -11.642
  850   2HG   ARG 108          HG1       ARG 108  12.232  -0.950 -13.361
  851   1HD   ARG 108          HD2       ARG 108  14.843  -1.514 -11.930
  852   2HD   ARG 108          HD1       ARG 108  13.824  -2.646 -12.808
  853    HE   ARG 108           HE       ARG 108  14.489  -0.778 -14.729
  854   1HH1  ARG 108          HH21      ARG 108  16.172  -2.754 -12.463
  855   2HH1  ARG 108          HH22      ARG 108  17.600  -2.884 -13.433
  856   1HH2  ARG 108          HH11      ARG 108  16.345  -0.930 -16.011
  857   2HH2  ARG 108          HH12      ARG 108  17.700  -1.848 -15.443
  858    H    GLU 109           HN       GLU 109  12.871   3.430 -11.380
  859    HA   GLU 109           HA       GLU 109  14.705   5.176 -12.889
  860   1HB   GLU 109          HB2       GLU 109  12.081   5.716 -11.469
  861   2HB   GLU 109          HB1       GLU 109  12.982   6.930 -12.372
  862   1HG   GLU 109          HG2       GLU 109  11.405   6.104 -13.934
  863   2HG   GLU 109          HG1       GLU 109  12.898   5.266 -14.348
  864    H    GLY 110           HN       GLY 110  14.389   4.192  -9.646
  865   1HA   GLY 110          HA2       GLY 110  15.551   4.877  -7.731
  866   2HA   GLY 110          HA1       GLY 110  16.535   5.891  -8.785
  867    H    ARG 111           HN       ARG 111  13.214   6.537  -9.158
  868    HA   ARG 111           HA       ARG 111  13.534   9.079  -7.639
  869   1HB   ARG 111          HB2       ARG 111  11.460   8.113  -9.634
  870   2HB   ARG 111          HB1       ARG 111  11.350   9.656  -8.785
  871   1HG   ARG 111          HG2       ARG 111  13.533  10.322  -9.713
  872   2HG   ARG 111          HG1       ARG 111  13.642   8.790 -10.573
  873   1HD   ARG 111          HD2       ARG 111  11.523   9.349 -11.759
  874   2HD   ARG 111          HD1       ARG 111  11.510  10.922 -10.972
  875    HE   ARG 111           HE       ARG 111  12.995  10.175 -13.328
  876   1HH1  ARG 111          HH21      ARG 111  13.354  11.953 -10.389
  877   2HH1  ARG 111          HH22      ARG 111  14.748  12.818 -10.943
  878   1HH2  ARG 111          HH11      ARG 111  14.790  11.300 -14.053
  879   2HH2  ARG 111          HH12      ARG 111  15.555  12.454 -13.012
  880    H    PHE 112           HN       PHE 112  13.258   8.366  -5.502
  881    HA   PHE 112           HA       PHE 112  10.896   6.743  -4.797
  882   1HB   PHE 112          HB2       PHE 112  13.035   7.957  -3.025
  883   2HB   PHE 112          HB1       PHE 112  11.877   6.703  -2.570
  884    HD1  PHE 112           HD1      PHE 112  11.958   4.463  -3.678
  885    HD2  PHE 112           HD2      PHE 112  14.993   7.433  -4.310
  886    HE1  PHE 112           HE1      PHE 112  13.464   2.734  -4.617
  887    HE2  PHE 112           HE2      PHE 112  16.497   5.697  -5.249
  888    HZ   PHE 112           HZ       PHE 112  15.733   3.346  -5.396
  889    H    ASN 113           HN       ASN 113   9.057   7.549  -3.889
  890    HA   ASN 113           HA       ASN 113   7.479   9.133  -3.198
  891   1HB   ASN 113          HB2       ASN 113   9.198   9.182  -1.289
  892   2HB   ASN 113          HB1       ASN 113   9.828  10.648  -2.039
  893   1HD2  ASN 113          HD21      ASN 113   9.059  12.327  -0.718
  894   2HD2  ASN 113          HD22      ASN 113   7.433  12.530  -0.274
  Start of MODEL    7
    1   1H    MET   1           HT1      MET   1  21.370   8.168  12.291
    2   2H    MET   1           HT2      MET   1  22.281   7.719  13.653
    3   3H    MET   1           HT3      MET   1  21.534   9.243  13.594
    4    HA   MET   1           HA       MET   1  20.278   6.589  13.935
    5   1HB   MET   1          HB2       MET   1  20.178   9.228  15.430
    6   2HB   MET   1          HB1       MET   1  19.162   7.838  15.812
    7   1HG   MET   1          HG2       MET   1  21.173   6.468  16.213
    8   2HG   MET   1          HG1       MET   1  22.195   7.853  15.828
    9   1HE   MET   1          HE1       MET   1  22.766   7.590  19.584
   10   2HE   MET   1          HE2       MET   1  23.324   7.229  17.952
   11   3HE   MET   1          HE3       MET   1  22.186   6.143  18.746
   12    H    GLY   2           HN       GLY   2  20.090   9.105  11.849
   13   1HA   GLY   2          HA2       GLY   2  17.298   9.805  11.990
   14   2HA   GLY   2          HA1       GLY   2  18.351  10.078  10.600
   15    HA   PRO   3           HA       PRO   3  15.143   6.439  10.141
   16   1HB   PRO   3          HB2       PRO   3  14.207   7.883   7.787
   17   2HB   PRO   3          HB1       PRO   3  13.295   7.403   9.221
   18   1HG   PRO   3          HG2       PRO   3  14.280  10.042   8.517
   19   2HG   PRO   3          HG1       PRO   3  13.255   9.583   9.882
   20   1HD   PRO   3          HD2       PRO   3  15.960  10.428  10.034
   21   2HD   PRO   3          HD1       PRO   3  15.030   9.660  11.345
   22    H    VAL   4           HN       VAL   4  14.952   5.186   7.950
   23    HA   VAL   4           HA       VAL   4  17.656   4.881   6.900
   24    HB   VAL   4           HB       VAL   4  16.438   3.065   5.497
   25   1HG1  VAL   4          HG11      VAL   4  16.335   2.961   8.528
   26   2HG1  VAL   4          HG12      VAL   4  17.751   2.596   7.542
   27   3HG1  VAL   4          HG13      VAL   4  16.324   1.565   7.451
   28   1HG2  VAL   4          HG21      VAL   4  14.262   3.563   7.538
   29   2HG2  VAL   4          HG22      VAL   4  14.215   2.497   6.134
   30   3HG2  VAL   4          HG23      VAL   4  14.189   4.247   5.914
   31    HA   PRO   5           HA       PRO   5  17.151   7.458   3.318
   32   1HB   PRO   5          HB2       PRO   5  18.364   5.707   1.400
   33   2HB   PRO   5          HB1       PRO   5  19.136   7.021   2.291
   34   1HG   PRO   5          HG2       PRO   5  19.376   4.132   2.707
   35   2HG   PRO   5          HG1       PRO   5  20.374   5.434   3.360
   36   1HD   PRO   5          HD2       PRO   5  18.503   3.885   4.817
   37   2HD   PRO   5          HD1       PRO   5  19.262   5.401   5.363
   38    HA   PRO   6           HA       PRO   6  13.555   6.210   1.041
   39   1HB   PRO   6          HB2       PRO   6  14.270   7.071  -1.563
   40   2HB   PRO   6          HB1       PRO   6  13.461   8.033  -0.321
   41   1HG   PRO   6          HG2       PRO   6  16.267   8.144  -1.232
   42   2HG   PRO   6          HG1       PRO   6  15.322   9.365  -0.371
   43   1HD   PRO   6          HD2       PRO   6  17.357   7.781   0.764
   44   2HD   PRO   6          HD1       PRO   6  16.120   8.684   1.675
   45    H    SER   7           HN       SER   7  16.395   5.563  -1.040
   46    HA   SER   7           HA       SER   7  15.227   3.429  -2.499
   47   1HB   SER   7          HB2       SER   7  17.477   2.877  -3.194
   48   2HB   SER   7          HB1       SER   7  17.349   4.630  -3.095
   49    HG   SER   7           HG       SER   7  18.122   4.208  -0.810
   50    H    THR   8           HN       THR   8  17.073   3.379   0.545
   51    HA   THR   8           HA       THR   8  17.141   0.495   0.714
   52    HB   THR   8           HB       THR   8  17.344   2.574   2.912
   53    HG1  THR   8           HG1      THR   8  18.922   2.116   0.926
   54   1HG2  THR   8          HG21      THR   8  17.912  -0.392   2.819
   55   2HG2  THR   8          HG22      THR   8  16.872   0.482   3.945
   56   3HG2  THR   8          HG23      THR   8  18.623   0.666   4.037
   57    H    ALA   9           HN       ALA   9  14.928   2.965   1.991
   58    HA   ALA   9           HA       ALA   9  13.334   1.216   3.577
   59   1HB   ALA   9          HB1       ALA   9  12.749   3.836   2.191
   60   2HB   ALA   9          HB2       ALA   9  13.018   3.548   3.910
   61   3HB   ALA   9          HB3       ALA   9  11.526   2.998   3.147
   62    H    LEU  10           HN       LEU  10  12.976   2.235   0.166
   63    HA   LEU  10           HA       LEU  10  10.561   0.814  -0.320
   64   1HB   LEU  10          HB2       LEU  10  11.465   2.492  -1.889
   65   2HB   LEU  10          HB1       LEU  10  12.818   1.425  -2.256
   66    HG   LEU  10           HG       LEU  10  11.239  -0.277  -3.126
   67   1HD1  LEU  10          HD11      LEU  10   8.839   0.727  -3.565
   68   2HD1  LEU  10          HD12      LEU  10   9.221   1.749  -2.181
   69   3HD1  LEU  10          HD13      LEU  10   9.206  -0.006  -2.005
   70   1HD2  LEU  10          HD21      LEU  10  10.344   1.194  -5.071
   71   2HD2  LEU  10          HD22      LEU  10  12.083   1.126  -4.817
   72   3HD2  LEU  10          HD23      LEU  10  11.169   2.524  -4.255
   73    H    ARG  11           HN       ARG  11  13.968  -0.216  -0.733
   74    HA   ARG  11           HA       ARG  11  13.387  -2.812  -1.754
   75   1HB   ARG  11          HB2       ARG  11  15.707  -1.804  -0.084
   76   2HB   ARG  11          HB1       ARG  11  15.650  -3.421  -0.787
   77   1HG   ARG  11          HG2       ARG  11  15.398  -2.429  -3.037
   78   2HG   ARG  11          HG1       ARG  11  15.483  -0.816  -2.329
   79   1HD   ARG  11          HD2       ARG  11  17.686  -1.364  -3.146
   80   2HD   ARG  11          HD1       ARG  11  17.742  -1.451  -1.384
   81    HE   ARG  11           HE       ARG  11  17.144  -4.040  -2.128
   82   1HH1  ARG  11          HH21      ARG  11  19.527  -1.706  -3.002
   83   2HH1  ARG  11          HH22      ARG  11  20.752  -2.886  -3.329
   84   1HH2  ARG  11          HH11      ARG  11  18.728  -5.591  -2.549
   85   2HH2  ARG  11          HH12      ARG  11  20.300  -5.085  -3.071
   86    H    GLU  12           HN       GLU  12  13.778  -1.644   1.579
   87    HA   GLU  12           HA       GLU  12  13.402  -4.173   2.862
   88   1HB   GLU  12          HB2       GLU  12  12.898  -1.333   3.781
   89   2HB   GLU  12          HB1       GLU  12  12.702  -2.732   4.839
   90   1HG   GLU  12          HG2       GLU  12  15.053  -3.365   4.435
   91   2HG   GLU  12          HG1       GLU  12  15.249  -1.963   3.383
   92    H    LEU  13           HN       LEU  13  11.138  -1.650   1.836
   93    HA   LEU  13           HA       LEU  13   8.810  -2.863   3.001
   94   1HB   LEU  13          HB2       LEU  13   8.911  -0.489   2.332
   95   2HB   LEU  13          HB1       LEU  13   9.072  -0.968   0.646
   96    HG   LEU  13           HG       LEU  13   6.849  -2.047   0.740
   97   1HD1  LEU  13          HD11      LEU  13   5.459  -1.320   2.847
   98   2HD1  LEU  13          HD12      LEU  13   7.036  -1.183   3.622
   99   3HD1  LEU  13          HD13      LEU  13   6.507  -2.730   2.962
  100   1HD2  LEU  13          HD21      LEU  13   5.531   0.065   0.997
  101   2HD2  LEU  13          HD22      LEU  13   6.987   0.282   0.026
  102   3HD2  LEU  13          HD23      LEU  13   6.957   0.827   1.703
  103    H    ILE  14           HN       ILE  14  10.187  -2.989  -0.301
  104    HA   ILE  14           HA       ILE  14   8.147  -4.612  -1.448
  105    HB   ILE  14           HB       ILE  14  11.106  -4.412  -2.085
  106   1HG1  ILE  14          HG12      ILE  14   8.699  -3.256  -3.521
  107   2HG1  ILE  14          HG11      ILE  14   9.632  -2.360  -2.321
  108   1HG2  ILE  14          HG21      ILE  14   8.835  -5.814  -3.508
  109   2HG2  ILE  14          HG22      ILE  14  10.380  -6.497  -3.003
  110   3HG2  ILE  14          HG23      ILE  14  10.319  -5.344  -4.335
  111   1HD1  ILE  14          HD11      ILE  14  10.389  -1.879  -4.643
  112   2HD1  ILE  14          HD12      ILE  14  10.783  -3.586  -4.845
  113   3HD1  ILE  14          HD13      ILE  14  11.662  -2.613  -3.667
  114    H    GLU  15           HN       GLU  15  11.255  -5.563   0.029
  115    HA   GLU  15           HA       GLU  15  10.931  -8.368  -0.250
  116   1HB   GLU  15          HB2       GLU  15  12.440  -6.717   1.786
  117   2HB   GLU  15          HB1       GLU  15  12.553  -8.475   1.697
  118   1HG   GLU  15          HG2       GLU  15  13.096  -6.661  -0.666
  119   2HG   GLU  15          HG1       GLU  15  14.360  -7.225   0.429
  120    H    GLU  16           HN       GLU  16   9.922  -6.210   2.410
  121    HA   GLU  16           HA       GLU  16   9.021  -8.362   4.101
  122   1HB   GLU  16          HB2       GLU  16   9.558  -6.094   4.945
  123   2HB   GLU  16          HB1       GLU  16   8.155  -5.458   4.088
  124   1HG   GLU  16          HG2       GLU  16   6.657  -6.853   5.407
  125   2HG   GLU  16          HG1       GLU  16   8.029  -7.625   6.204
  126    H    LEU  17           HN       LEU  17   7.301  -6.248   1.785
  127    HA   LEU  17           HA       LEU  17   4.686  -7.238   2.356
  128   1HB   LEU  17          HB2       LEU  17   5.867  -6.103  -0.191
  129   2HB   LEU  17          HB1       LEU  17   4.154  -6.458   0.009
  130    HG   LEU  17           HG       LEU  17   5.718  -4.629   1.853
  131   1HD1  LEU  17          HD11      LEU  17   3.937  -3.938  -0.503
  132   2HD1  LEU  17          HD12      LEU  17   5.682  -3.703  -0.421
  133   3HD1  LEU  17          HD13      LEU  17   4.618  -2.773   0.634
  134   1HD2  LEU  17          HD21      LEU  17   2.824  -5.441   1.600
  135   2HD2  LEU  17          HD22      LEU  17   3.209  -3.824   2.185
  136   3HD2  LEU  17          HD23      LEU  17   3.801  -5.235   3.053
  137    H    VAL  18           HN       VAL  18   7.143  -8.352   0.047
  138    HA   VAL  18           HA       VAL  18   5.543 -10.384  -1.178
  139    HB   VAL  18           HB       VAL  18   8.538 -10.099  -0.826
  140   1HG1  VAL  18          HG11      VAL  18   8.588 -11.746  -2.780
  141   2HG1  VAL  18          HG12      VAL  18   6.911 -12.116  -2.382
  142   3HG1  VAL  18          HG13      VAL  18   8.185 -12.426  -1.203
  143   1HG2  VAL  18          HG21      VAL  18   7.301  -8.381  -2.179
  144   2HG2  VAL  18          HG22      VAL  18   6.756  -9.679  -3.241
  145   3HG2  VAL  18          HG23      VAL  18   8.475  -9.306  -3.118
  146    H    ASN  19           HN       ASN  19   7.690 -10.440   1.642
  147    HA   ASN  19           HA       ASN  19   7.685 -13.232   2.117
  148   1HB   ASN  19          HB2       ASN  19   9.177 -11.661   3.271
  149   2HB   ASN  19          HB1       ASN  19   7.796 -10.953   4.109
  150   1HD2  ASN  19          HD21      ASN  19   8.637 -14.404   3.477
  151   2HD2  ASN  19          HD22      ASN  19   8.602 -14.861   5.111
  152    H    ILE  20           HN       ILE  20   5.443 -10.741   3.341
  153    HA   ILE  20           HA       ILE  20   3.888 -12.696   4.822
  154    HB   ILE  20           HB       ILE  20   2.372 -10.784   5.256
  155   1HG1  ILE  20          HG12      ILE  20   4.304  -9.216   3.521
  156   2HG1  ILE  20          HG11      ILE  20   2.717  -9.740   2.972
  157   1HG2  ILE  20          HG21      ILE  20   4.439 -11.160   6.595
  158   2HG2  ILE  20          HG22      ILE  20   4.021  -9.450   6.485
  159   3HG2  ILE  20          HG23      ILE  20   5.322 -10.108   5.491
  160   1HD1  ILE  20          HD11      ILE  20   1.587  -8.355   4.510
  161   2HD1  ILE  20          HD12      ILE  20   2.916  -7.350   3.937
  162   3HD1  ILE  20          HD13      ILE  20   3.023  -8.137   5.510
  163    H    THR  21           HN       THR  21   3.821 -11.669   1.503
  164    HA   THR  21           HA       THR  21   0.979 -12.542   1.223
  165    HB   THR  21           HB       THR  21   1.226 -11.700  -1.125
  166    HG1  THR  21           HG1      THR  21   3.086 -10.733  -1.714
  167   1HG2  THR  21          HG21      THR  21   0.901  -9.470  -0.539
  168   2HG2  THR  21          HG22      THR  21   2.112  -9.518   0.735
  169   3HG2  THR  21          HG23      THR  21   0.548 -10.289   0.982
  170    H    GLN  22           HN       GLN  22   4.198 -13.735   0.578
  171    HA   GLN  22           HA       GLN  22   3.368 -15.599  -1.496
  172   1HB   GLN  22          HB2       GLN  22   5.813 -15.472   0.275
  173   2HB   GLN  22          HB1       GLN  22   5.565 -16.750  -0.916
  174   1HG   GLN  22          HG2       GLN  22   5.481 -15.146  -2.719
  175   2HG   GLN  22          HG1       GLN  22   5.507 -13.799  -1.584
  176   1HE2  GLN  22          HE21      GLN  22   7.522 -14.708  -3.739
  177   2HE2  GLN  22          HE22      GLN  22   8.999 -14.788  -2.907
  178    H    ASN  23           HN       ASN  23   3.745 -15.812   2.023
  179    HA   ASN  23           HA       ASN  23   2.973 -18.665   1.976
  180   1HB   ASN  23          HB2       ASN  23   3.777 -16.782   4.201
  181   2HB   ASN  23          HB1       ASN  23   3.274 -18.450   4.480
  182   1HD2  ASN  23          HD21      ASN  23   5.944 -17.570   5.091
  183   2HD2  ASN  23          HD22      ASN  23   7.013 -18.349   4.028
  184    H    GLN  24           HN       GLN  24   1.223 -15.842   1.838
  185    HA   GLN  24           HA       GLN  24  -0.830 -16.599   3.804
  186   1HB   GLN  24          HB2       GLN  24  -1.914 -14.584   3.266
  187   2HB   GLN  24          HB1       GLN  24  -0.214 -14.191   3.035
  188   1HG   GLN  24          HG2       GLN  24  -1.181 -13.330   1.087
  189   2HG   GLN  24          HG1       GLN  24  -0.649 -14.916   0.550
  190   1HE2  GLN  24          HE21      GLN  24  -2.253 -15.835  -0.749
  191   2HE2  GLN  24          HE22      GLN  24  -3.921 -15.717  -0.458
  192    H    LYS  25           HN       LYS  25  -2.603 -17.850   3.389
  193    HA   LYS  25           HA       LYS  25  -2.892 -18.979   0.668
  194   1HB   LYS  25          HB2       LYS  25  -3.090 -20.424   2.726
  195   2HB   LYS  25          HB1       LYS  25  -4.554 -19.535   3.150
  196   1HG   LYS  25          HG2       LYS  25  -5.579 -20.191   1.002
  197   2HG   LYS  25          HG1       LYS  25  -4.118 -21.084   0.579
  198   1HD   LYS  25          HD2       LYS  25  -4.433 -22.508   2.592
  199   2HD   LYS  25          HD1       LYS  25  -5.932 -21.647   2.943
  200   1HE   LYS  25          HE2       LYS  25  -6.890 -22.373   0.815
  201   2HE   LYS  25          HE1       LYS  25  -5.375 -23.161   0.376
  202   1HZ   LYS  25          HZ1       LYS  25  -6.986 -24.733   1.268
  203   2HZ   LYS  25          HZ2       LYS  25  -7.061 -23.857   2.721
  204   3HZ   LYS  25          HZ3       LYS  25  -5.618 -24.630   2.266
  205    H    ALA  26           HN       ALA  26  -5.388 -17.951   2.961
  206    HA   ALA  26           HA       ALA  26  -6.909 -16.705   0.751
  207   1HB   ALA  26          HB1       ALA  26  -8.220 -16.364   3.299
  208   2HB   ALA  26          HB2       ALA  26  -7.574 -18.002   3.237
  209   3HB   ALA  26          HB3       ALA  26  -8.679 -17.447   1.983
  210    HA   PRO  27           HA       PRO  27  -5.845 -12.484   1.451
  211   1HB   PRO  27          HB2       PRO  27  -8.505 -11.815   2.565
  212   2HB   PRO  27          HB1       PRO  27  -7.719 -11.209   1.102
  213   1HG   PRO  27          HG2       PRO  27  -9.821 -13.107   1.213
  214   2HG   PRO  27          HG1       PRO  27  -8.862 -12.686  -0.210
  215   1HD   PRO  27          HD2       PRO  27  -8.842 -15.184   1.241
  216   2HD   PRO  27          HD1       PRO  27  -7.836 -14.739  -0.161
  217    H    LEU  28           HN       LEU  28  -5.005 -11.243   3.177
  218    HA   LEU  28           HA       LEU  28  -4.704 -12.527   5.710
  219   1HB   LEU  28          HB2       LEU  28  -4.318  -9.608   4.978
  220   2HB   LEU  28          HB1       LEU  28  -3.688 -10.383   6.429
  221    HG   LEU  28           HG       LEU  28  -3.018 -11.275   3.607
  222   1HD1  LEU  28          HD11      LEU  28  -1.609  -9.389   5.504
  223   2HD1  LEU  28          HD12      LEU  28  -2.071  -9.103   3.826
  224   3HD1  LEU  28          HD13      LEU  28  -0.758 -10.219   4.200
  225   1HD2  LEU  28          HD21      LEU  28  -1.026 -12.278   4.996
  226   2HD2  LEU  28          HD22      LEU  28  -2.579 -13.107   5.021
  227   3HD2  LEU  28          HD23      LEU  28  -2.106 -12.079   6.374
  228    H    CYS  29           HN       CYS  29  -6.862  -9.938   4.620
  229    HA   CYS  29           HA       CYS  29  -8.068  -9.663   7.285
  230   1HB   CYS  29          HB2       CYS  29  -8.737  -8.464   4.585
  231   2HB   CYS  29          HB1       CYS  29  -9.639  -8.113   6.060
  232    H    ASN  30           HN       ASN  30 -10.583  -9.763   7.321
  233    HA   ASN  30           HA       ASN  30 -11.377 -12.459   6.720
  234   1HB   ASN  30          HB2       ASN  30 -13.550 -11.790   7.577
  235   2HB   ASN  30          HB1       ASN  30 -12.303 -11.072   8.591
  236   1HD2  ASN  30          HD21      ASN  30 -14.855  -9.881   8.538
  237   2HD2  ASN  30          HD22      ASN  30 -14.767  -8.394   7.725
  238    H    GLY  31           HN       GLY  31 -10.473 -11.239   4.326
  239   1HA   GLY  31          HA2       GLY  31 -11.152 -11.308   2.067
  240   2HA   GLY  31          HA1       GLY  31 -12.776 -11.733   2.610
  241    H    SER  32           HN       SER  32 -11.196  -8.920   3.931
  242    HA   SER  32           HA       SER  32 -13.354  -7.191   3.184
  243   1HB   SER  32          HB2       SER  32 -10.536  -6.462   4.028
  244   2HB   SER  32          HB1       SER  32 -11.922  -5.376   4.025
  245    HG   SER  32           HG       SER  32 -12.367  -7.747   5.324
  246    H    MET  33           HN       MET  33 -13.455  -5.577   1.578
  247    HA   MET  33           HA       MET  33 -11.530  -5.906  -0.705
  248   1HB   MET  33          HB2       MET  33 -14.382  -4.852  -0.693
  249   2HB   MET  33          HB1       MET  33 -13.355  -5.037  -2.114
  250   1HG   MET  33          HG2       MET  33 -13.222  -7.465  -1.710
  251   2HG   MET  33          HG1       MET  33 -14.246  -7.287  -0.289
  252   1HE   MET  33          HE1       MET  33 -15.282  -6.975  -4.704
  253   2HE   MET  33          HE2       MET  33 -13.707  -6.937  -3.918
  254   3HE   MET  33          HE3       MET  33 -14.685  -5.474  -3.988
  255    H    VAL  34           HN       VAL  34 -10.960  -3.888  -1.861
  256    HA   VAL  34           HA       VAL  34 -11.270  -1.398  -0.210
  257    HB   VAL  34           HB       VAL  34  -8.865  -0.874  -0.981
  258   1HG1  VAL  34          HG11      VAL  34  -7.921  -2.417   0.858
  259   2HG1  VAL  34          HG12      VAL  34  -9.577  -2.995   1.049
  260   3HG1  VAL  34          HG13      VAL  34  -9.198  -1.295   1.323
  261   1HG2  VAL  34          HG21      VAL  34  -7.467  -2.774  -1.530
  262   2HG2  VAL  34          HG22      VAL  34  -8.830  -2.760  -2.650
  263   3HG2  VAL  34          HG23      VAL  34  -8.813  -3.890  -1.296
  264    H    TRP  35           HN       TRP  35 -10.951   0.585  -1.481
  265    HA   TRP  35           HA       TRP  35 -12.191   0.371  -4.107
  266   1HB   TRP  35          HB2       TRP  35 -11.054   2.736  -2.603
  267   2HB   TRP  35          HB1       TRP  35 -11.929   2.855  -4.130
  268    HD1  TRP  35           HD1      TRP  35 -12.421   1.918  -0.457
  269    HE1  TRP  35           HE1      TRP  35 -14.933   1.997   0.095
  270    HE3  TRP  35           HE3      TRP  35 -14.337   2.698  -5.136
  271    HZ2  TRP  35           HZ2      TRP  35 -17.424   2.346  -1.254
  272    HZ3  TRP  35           HZ3      TRP  35 -16.789   2.908  -5.457
  273    HH2  TRP  35           HH2      TRP  35 -18.328   2.727  -3.530
  274    H    SER  36           HN       SER  36 -11.182   0.275  -6.041
  275    HA   SER  36           HA       SER  36  -8.310   0.000  -6.166
  276   1HB   SER  36          HB2       SER  36  -8.625  -0.241  -8.554
  277   2HB   SER  36          HB1       SER  36  -9.951  -1.081  -7.755
  278    HG   SER  36           HG       SER  36 -10.381   1.598  -8.254
  279    H    ILE  37           HN       ILE  37  -6.814   1.471  -7.120
  280    HA   ILE  37           HA       ILE  37  -7.784   4.294  -7.467
  281    HB   ILE  37           HB       ILE  37  -5.660   5.019  -6.338
  282   1HG1  ILE  37          HG12      ILE  37  -5.494   2.170  -5.333
  283   2HG1  ILE  37          HG11      ILE  37  -4.568   2.710  -6.728
  284   1HG2  ILE  37          HG21      ILE  37  -6.443   4.311  -4.009
  285   2HG2  ILE  37          HG22      ILE  37  -7.683   3.358  -4.821
  286   3HG2  ILE  37          HG23      ILE  37  -7.650   5.110  -5.018
  287   1HD1  ILE  37          HD11      ILE  37  -4.451   3.922  -3.953
  288   2HD1  ILE  37          HD12      ILE  37  -3.551   4.502  -5.354
  289   3HD1  ILE  37          HD13      ILE  37  -3.215   2.903  -4.692
  290    H    ASN  38           HN       ASN  38  -6.066   5.644  -8.589
  291    HA   ASN  38           HA       ASN  38  -4.994   4.103 -10.881
  292   1HB   ASN  38          HB2       ASN  38  -5.044   7.091 -10.318
  293   2HB   ASN  38          HB1       ASN  38  -4.519   6.345 -11.828
  294   1HD2  ASN  38          HD21      ASN  38  -6.333   4.632 -12.644
  295   2HD2  ASN  38          HD22      ASN  38  -7.916   5.246 -12.633
  296    H    LEU  39           HN       LEU  39  -2.909   3.379 -10.773
  297    HA   LEU  39           HA       LEU  39  -1.172   4.291  -8.609
  298   1HB   LEU  39          HB2       LEU  39  -0.732   2.338 -10.886
  299   2HB   LEU  39          HB1       LEU  39   0.460   2.661  -9.632
  300    HG   LEU  39           HG       LEU  39  -0.825   0.636  -9.101
  301   1HD1  LEU  39          HD11      LEU  39  -1.900   2.645  -7.144
  302   2HD1  LEU  39          HD12      LEU  39  -0.154   2.477  -7.318
  303   3HD1  LEU  39          HD13      LEU  39  -1.129   1.088  -6.852
  304   1HD2  LEU  39          HD21      LEU  39  -3.155   0.540  -8.961
  305   2HD2  LEU  39          HD22      LEU  39  -2.927   1.620 -10.335
  306   3HD2  LEU  39          HD23      LEU  39  -3.324   2.281  -8.748
  307    H    THR  40           HN       THR  40   0.037   6.097  -8.776
  308    HA   THR  40           HA       THR  40   1.444   6.685 -11.326
  309    HB   THR  40           HB       THR  40   0.803   9.116 -11.074
  310    HG1  THR  40           HG1      THR  40  -0.347   9.647  -9.421
  311   1HG2  THR  40          HG21      THR  40  -0.291   7.549 -12.689
  312   2HG2  THR  40          HG22      THR  40  -1.360   8.842 -12.145
  313   3HG2  THR  40          HG23      THR  40  -1.524   7.219 -11.474
  314    H    ALA  41           HN       ALA  41   1.500   9.361  -9.325
  315    HA   ALA  41           HA       ALA  41   4.151   8.542  -8.223
  316   1HB   ALA  41          HB1       ALA  41   4.662  10.860  -8.085
  317   2HB   ALA  41          HB2       ALA  41   2.965  11.323  -8.215
  318   3HB   ALA  41          HB3       ALA  41   3.811  10.670  -9.618
  319    H    GLY  42           HN       GLY  42   1.028   9.921  -7.197
  320   1HA   GLY  42          HA2       GLY  42   1.870   9.899  -4.368
  321   2HA   GLY  42          HA1       GLY  42   0.307  10.439  -4.981
  322    H    MET  43           HN       MET  43   1.848   7.326  -5.687
  323    HA   MET  43           HA       MET  43  -0.518   5.819  -5.229
  324   1HB   MET  43          HB2       MET  43   2.350   4.873  -5.007
  325   2HB   MET  43          HB1       MET  43   0.940   3.853  -5.278
  326   1HG   MET  43          HG2       MET  43   0.496   5.245  -7.353
  327   2HG   MET  43          HG1       MET  43   2.097   5.937  -7.133
  328   1HE   MET  43          HE1       MET  43   4.573   3.275  -7.541
  329   2HE   MET  43          HE2       MET  43   3.738   3.049  -6.007
  330   3HE   MET  43          HE3       MET  43   4.034   4.677  -6.612
  331    H    TYR  44           HN       TYR  44   2.280   6.404  -3.097
  332    HA   TYR  44           HA       TYR  44   1.406   4.770  -0.944
  333   1HB   TYR  44          HB2       TYR  44   3.073   7.299  -0.866
  334   2HB   TYR  44          HB1       TYR  44   2.953   6.118   0.438
  335    HD1  TYR  44           HD1      TYR  44   3.942   3.884   0.214
  336    HD2  TYR  44           HD2      TYR  44   4.267   6.792  -2.931
  337    HE1  TYR  44           HE1      TYR  44   5.710   2.519  -0.866
  338    HE2  TYR  44           HE2      TYR  44   6.034   5.427  -4.010
  339    HH   TYR  44           HH       TYR  44   7.803   3.594  -3.011
  340    H    CYS  45           HN       CYS  45   0.769   8.230  -1.605
  341    HA   CYS  45           HA       CYS  45  -0.739   8.666   0.821
  342   1HB   CYS  45          HB2       CYS  45  -0.676  10.096  -1.847
  343   2HB   CYS  45          HB1       CYS  45  -1.723  10.610  -0.525
  344    H    ALA  46           HN       ALA  46  -1.785   8.139  -2.558
  345    HA   ALA  46           HA       ALA  46  -4.570   7.933  -2.035
  346   1HB   ALA  46          HB1       ALA  46  -3.798   8.206  -4.301
  347   2HB   ALA  46          HB2       ALA  46  -4.605   6.640  -4.214
  348   3HB   ALA  46          HB3       ALA  46  -2.843   6.725  -4.211
  349    H    ALA  47           HN       ALA  47  -2.090   5.376  -2.246
  350    HA   ALA  47           HA       ALA  47  -3.867   3.194  -1.806
  351   1HB   ALA  47          HB1       ALA  47  -1.633   2.763  -2.619
  352   2HB   ALA  47          HB2       ALA  47  -1.789   1.981  -1.047
  353   3HB   ALA  47          HB3       ALA  47  -0.918   3.506  -1.187
  354    H    LEU  48           HN       LEU  48  -2.112   5.277   0.467
  355    HA   LEU  48           HA       LEU  48  -2.622   3.773   2.808
  356   1HB   LEU  48          HB2       LEU  48  -1.045   5.656   2.736
  357   2HB   LEU  48          HB1       LEU  48  -2.382   6.778   2.497
  358    HG   LEU  48           HG       LEU  48  -3.314   6.146   4.698
  359   1HD1  LEU  48          HD11      LEU  48  -1.586   4.813   6.180
  360   2HD1  LEU  48          HD12      LEU  48  -1.008   4.203   4.629
  361   3HD1  LEU  48          HD13      LEU  48  -2.680   3.929   5.119
  362   1HD2  LEU  48          HD21      LEU  48  -1.500   7.147   6.079
  363   2HD2  LEU  48          HD22      LEU  48  -1.739   8.023   4.567
  364   3HD2  LEU  48          HD23      LEU  48  -0.377   6.915   4.739
  365    H    GLU  49           HN       GLU  49  -4.572   6.508   1.478
  366    HA   GLU  49           HA       GLU  49  -6.564   6.359   3.507
  367   1HB   GLU  49          HB2       GLU  49  -8.081   7.450   1.787
  368   2HB   GLU  49          HB1       GLU  49  -6.570   8.293   2.120
  369   1HG   GLU  49          HG2       GLU  49  -5.556   7.290   0.121
  370   2HG   GLU  49          HG1       GLU  49  -7.064   6.437  -0.223
  371    H    SER  50           HN       SER  50  -6.330   4.611   0.416
  372    HA   SER  50           HA       SER  50  -8.902   3.390   0.527
  373   1HB   SER  50          HB2       SER  50  -6.301   2.364  -0.639
  374   2HB   SER  50          HB1       SER  50  -7.867   1.610  -0.910
  375    HG   SER  50           HG       SER  50  -7.928   4.294  -1.337
  376    H    LEU  51           HN       LEU  51  -5.796   2.418   1.957
  377    HA   LEU  51           HA       LEU  51  -6.740  -0.100   2.992
  378   1HB   LEU  51          HB2       LEU  51  -4.451   1.689   3.846
  379   2HB   LEU  51          HB1       LEU  51  -4.721   0.069   4.485
  380    HG   LEU  51           HG       LEU  51  -4.324   0.718   1.546
  381   1HD1  LEU  51          HD11      LEU  51  -2.314   1.107   3.032
  382   2HD1  LEU  51          HD12      LEU  51  -2.079  -0.122   1.789
  383   3HD1  LEU  51          HD13      LEU  51  -2.381  -0.601   3.460
  384   1HD2  LEU  51          HD21      LEU  51  -4.839  -1.810   3.102
  385   2HD2  LEU  51          HD22      LEU  51  -3.800  -1.895   1.680
  386   3HD2  LEU  51          HD23      LEU  51  -5.457  -1.324   1.524
  387    H    ILE  52           HN       ILE  52  -6.646   3.184   4.319
  388    HA   ILE  52           HA       ILE  52  -7.287   2.619   7.003
  389    HB   ILE  52           HB       ILE  52  -8.097   4.933   5.224
  390   1HG1  ILE  52          HG12      ILE  52  -5.688   4.730   5.634
  391   2HG1  ILE  52          HG11      ILE  52  -6.332   6.132   6.465
  392   1HG2  ILE  52          HG21      ILE  52  -9.717   4.953   6.958
  393   2HG2  ILE  52          HG22      ILE  52  -8.499   6.141   7.420
  394   3HG2  ILE  52          HG23      ILE  52  -8.518   4.551   8.186
  395   1HD1  ILE  52          HD11      ILE  52  -5.241   3.594   7.588
  396   2HD1  ILE  52          HD12      ILE  52  -6.563   4.353   8.471
  397   3HD1  ILE  52          HD13      ILE  52  -5.073   5.245   8.177
  398    H    ASN  53           HN       ASN  53  -9.155   1.915   4.250
  399    HA   ASN  53           HA       ASN  53 -11.755   2.132   5.622
  400   1HB   ASN  53          HB2       ASN  53 -10.905   1.039   2.930
  401   2HB   ASN  53          HB1       ASN  53 -12.558   0.901   3.527
  402   1HD2  ASN  53          HD21      ASN  53 -11.552   2.535   1.210
  403   2HD2  ASN  53          HD22      ASN  53 -12.002   4.134   1.559
  404    H    VAL  54           HN       VAL  54  -9.233  -0.198   5.260
  405    HA   VAL  54           HA       VAL  54 -10.992  -2.473   5.969
  406    HB   VAL  54           HB       VAL  54  -7.997  -2.339   5.515
  407   1HG1  VAL  54          HG11      VAL  54  -8.430  -4.876   5.169
  408   2HG1  VAL  54          HG12      VAL  54  -9.929  -4.598   6.055
  409   3HG1  VAL  54          HG13      VAL  54  -8.376  -4.270   6.824
  410   1HG2  VAL  54          HG21      VAL  54  -9.546  -1.802   3.563
  411   2HG2  VAL  54          HG22      VAL  54 -10.157  -3.450   3.704
  412   3HG2  VAL  54          HG23      VAL  54  -8.461  -3.169   3.311
  413    H    SER  55           HN       SER  55 -11.425  -2.894   8.057
  414    HA   SER  55           HA       SER  55  -9.438  -2.071  10.159
  415   1HB   SER  55          HB2       SER  55 -12.460  -2.237  10.305
  416   2HB   SER  55          HB1       SER  55 -11.407  -1.897  11.675
  417    HG   SER  55           HG       SER  55 -10.665  -0.283   9.748
  418    H    GLY  56           HN       GLY  56  -9.117  -3.551  11.893
  419   1HA   GLY  56          HA2       GLY  56  -9.294  -5.632  13.034
  420   2HA   GLY  56          HA1       GLY  56 -10.501  -6.148  11.856
  421    H    CYS  57           HN       CYS  57  -7.214  -4.911  11.257
  422    HA   CYS  57           HA       CYS  57  -6.371  -7.618  10.339
  423   1HB   CYS  57          HB2       CYS  57  -6.235  -5.109   8.642
  424   2HB   CYS  57          HB1       CYS  57  -5.500  -6.657   8.225
  425    H    SER  58           HN       SER  58  -4.928  -7.573  12.148
  426    HA   SER  58           HA       SER  58  -3.047  -5.412  12.568
  427   1HB   SER  58          HB2       SER  58  -3.756  -7.053  14.336
  428   2HB   SER  58          HB1       SER  58  -2.833  -8.289  13.488
  429    HG   SER  58           HG       SER  58  -0.982  -7.242  13.957
  430    H    ALA  59           HN       ALA  59  -3.129  -8.193  10.506
  431    HA   ALA  59           HA       ALA  59  -0.388  -8.685  10.112
  432   1HB   ALA  59          HB1       ALA  59  -2.411  -8.706   7.869
  433   2HB   ALA  59          HB2       ALA  59  -2.389  -9.941   9.127
  434   3HB   ALA  59          HB3       ALA  59  -0.994  -9.736   8.067
  435    H    ILE  60           HN       ILE  60  -2.432  -6.167   8.612
  436    HA   ILE  60           HA       ILE  60  -0.034  -5.137   7.162
  437    HB   ILE  60           HB       ILE  60  -1.640  -3.763   5.910
  438   1HG1  ILE  60          HG12      ILE  60  -3.762  -5.161   7.579
  439   2HG1  ILE  60          HG11      ILE  60  -3.285  -3.478   7.793
  440   1HG2  ILE  60          HG21      ILE  60  -2.730  -5.594   4.733
  441   2HG2  ILE  60          HG22      ILE  60  -2.543  -6.648   6.133
  442   3HG2  ILE  60          HG23      ILE  60  -1.121  -6.117   5.238
  443   1HD1  ILE  60          HD11      ILE  60  -5.176  -3.350   6.390
  444   2HD1  ILE  60          HD12      ILE  60  -4.671  -4.741   5.433
  445   3HD1  ILE  60          HD13      ILE  60  -3.817  -3.206   5.274
  446    H    GLU  61           HN       GLU  61  -1.126  -4.640  10.196
  447    HA   GLU  61           HA       GLU  61  -1.513  -1.813  10.354
  448   1HB   GLU  61          HB2       GLU  61  -1.000  -2.008  12.700
  449   2HB   GLU  61          HB1       GLU  61  -1.854  -3.477  12.241
  450   1HG   GLU  61          HG2       GLU  61   0.487  -4.496  11.844
  451   2HG   GLU  61          HG1       GLU  61   1.101  -3.111  12.741
  452    H    LYS  62           HN       LYS  62   1.419  -3.796  10.486
  453    HA   LYS  62           HA       LYS  62   3.263  -1.634  10.867
  454   1HB   LYS  62          HB2       LYS  62   3.591  -4.365   9.598
  455   2HB   LYS  62          HB1       LYS  62   4.937  -3.257   9.870
  456   1HG   LYS  62          HG2       LYS  62   4.360  -3.183  12.285
  457   2HG   LYS  62          HG1       LYS  62   3.077  -4.355  12.000
  458   1HD   LYS  62          HD2       LYS  62   5.959  -4.902  11.257
  459   2HD   LYS  62          HD1       LYS  62   5.311  -5.291  12.848
  460   1HE   LYS  62          HE2       LYS  62   3.471  -6.592  11.607
  461   2HE   LYS  62          HE1       LYS  62   4.483  -6.429  10.172
  462   1HZ   LYS  62          HZ1       LYS  62   5.931  -7.296  12.491
  463   2HZ   LYS  62          HZ2       LYS  62   5.904  -7.946  10.921
  464   3HZ   LYS  62          HZ3       LYS  62   4.701  -8.373  12.042
  465    H    THR  63           HN       THR  63   1.875  -3.130   7.981
  466    HA   THR  63           HA       THR  63   3.419  -1.781   6.021
  467    HB   THR  63           HB       THR  63   0.505  -2.616   5.883
  468    HG1  THR  63           HG1      THR  63   2.286  -4.163   4.592
  469   1HG2  THR  63          HG21      THR  63   2.546  -1.958   3.743
  470   2HG2  THR  63          HG22      THR  63   1.045  -1.095   4.076
  471   3HG2  THR  63          HG23      THR  63   0.992  -2.732   3.424
  472    H    GLN  64           HN       GLN  64   0.524  -0.767   7.802
  473    HA   GLN  64           HA       GLN  64  -0.048   1.584   6.310
  474   1HB   GLN  64          HB2       GLN  64  -0.420   0.951   9.253
  475   2HB   GLN  64          HB1       GLN  64  -1.072   2.395   8.479
  476   1HG   GLN  64          HG2       GLN  64  -1.652  -0.419   7.520
  477   2HG   GLN  64          HG1       GLN  64  -2.699   0.467   8.628
  478   1HE2  GLN  64          HE21      GLN  64  -2.121  -0.123   5.343
  479   2HE2  GLN  64          HE22      GLN  64  -2.977   1.191   4.700
  480    H    ARG  65           HN       ARG  65   2.113   1.091   9.108
  481    HA   ARG  65           HA       ARG  65   2.904   3.831   9.361
  482   1HB   ARG  65          HB2       ARG  65   3.291   2.146  11.120
  483   2HB   ARG  65          HB1       ARG  65   4.440   1.317  10.073
  484   1HG   ARG  65          HG2       ARG  65   5.869   3.322  10.041
  485   2HG   ARG  65          HG1       ARG  65   4.720   4.169  11.073
  486   1HD   ARG  65          HD2       ARG  65   5.037   2.396  12.797
  487   2HD   ARG  65          HD1       ARG  65   6.272   1.654  11.788
  488    HE   ARG  65           HE       ARG  65   6.604   3.890  13.580
  489   1HH1  ARG  65          HH21      ARG  65   7.537   2.818  10.430
  490   2HH1  ARG  65          HH22      ARG  65   8.849   3.941  10.308
  491   1HH2  ARG  65          HH11      ARG  65   8.309   5.330  13.433
  492   2HH2  ARG  65          HH12      ARG  65   9.287   5.358  12.004
  493    H    MET  66           HN       MET  66   4.451   1.102   7.631
  494    HA   MET  66           HA       MET  66   6.670   2.609   6.672
  495   1HB   MET  66          HB2       MET  66   5.303   0.152   5.563
  496   2HB   MET  66          HB1       MET  66   6.792   0.815   4.889
  497   1HG   MET  66          HG2       MET  66   7.818   0.645   7.187
  498   2HG   MET  66          HG1       MET  66   6.369  -0.212   7.709
  499   1HE   MET  66          HE1       MET  66   5.587  -2.124   5.215
  500   2HE   MET  66          HE2       MET  66   5.540  -2.285   6.967
  501   3HE   MET  66          HE3       MET  66   6.347  -3.513   5.997
  502    H    LEU  67           HN       LEU  67   3.440   2.084   5.259
  503    HA   LEU  67           HA       LEU  67   3.976   3.377   2.766
  504   1HB   LEU  67          HB2       LEU  67   1.430   3.160   4.393
  505   2HB   LEU  67          HB1       LEU  67   1.484   3.841   2.772
  506    HG   LEU  67           HG       LEU  67   2.468   1.052   3.441
  507   1HD1  LEU  67          HD11      LEU  67  -0.231   2.022   2.466
  508   2HD1  LEU  67          HD12      LEU  67   0.111   1.092   3.925
  509   3HD1  LEU  67          HD13      LEU  67   0.295   0.344   2.339
  510   1HD2  LEU  67          HD21      LEU  67   1.928   0.869   0.869
  511   2HD2  LEU  67          HD22      LEU  67   3.427   1.640   1.371
  512   3HD2  LEU  67          HD23      LEU  67   2.048   2.628   0.895
  513    H    SER  68           HN       SER  68   2.963   4.603   5.924
  514    HA   SER  68           HA       SER  68   2.542   7.314   5.173
  515   1HB   SER  68          HB2       SER  68   3.576   6.199   7.798
  516   2HB   SER  68          HB1       SER  68   2.951   7.828   7.562
  517    HG   SER  68           HG       SER  68   1.336   6.430   8.342
  518    H    GLY  69           HN       GLY  69   5.479   5.560   6.128
  519   1HA   GLY  69          HA2       GLY  69   7.284   7.682   6.371
  520   2HA   GLY  69          HA1       GLY  69   7.734   6.107   5.712
  521    H    PHE  70           HN       PHE  70   5.817   6.369   3.443
  522    HA   PHE  70           HA       PHE  70   7.522   8.134   1.744
  523   1HB   PHE  70          HB2       PHE  70   5.455   6.021   1.072
  524   2HB   PHE  70          HB1       PHE  70   6.241   7.034  -0.138
  525    HD1  PHE  70           HD1      PHE  70   8.611   6.799  -0.641
  526    HD2  PHE  70           HD2      PHE  70   6.708   4.318   2.301
  527    HE1  PHE  70           HE1      PHE  70  10.562   5.276  -0.670
  528    HE2  PHE  70           HE2      PHE  70   8.662   2.790   2.277
  529    HZ   PHE  70           HZ       PHE  70  10.590   3.268   0.791
  530    H    CYS  71           HN       CYS  71   4.452   8.041   3.273
  531    HA   CYS  71           HA       CYS  71   3.691  10.567   1.891
  532   1HB   CYS  71          HB2       CYS  71   2.277   7.985   1.755
  533   2HB   CYS  71          HB1       CYS  71   1.235   9.323   2.236
  534    HA   PRO  72           HA       PRO  72   3.368  10.994   6.531
  535   1HB   PRO  72          HB2       PRO  72   3.469  13.866   5.794
  536   2HB   PRO  72          HB1       PRO  72   4.503  12.960   6.907
  537   1HG   PRO  72          HG2       PRO  72   5.350  13.869   4.463
  538   2HG   PRO  72          HG1       PRO  72   6.039  12.450   5.265
  539   1HD   PRO  72          HD2       PRO  72   4.212  12.573   2.913
  540   2HD   PRO  72          HD1       PRO  72   5.376  11.302   3.373
  541    H    HIS  73           HN       HIS  73   1.141  10.606   4.666
  542    HA   HIS  73           HA       HIS  73  -0.741  12.802   5.184
  543   1HB   HIS  73          HB2       HIS  73  -0.372  10.980   3.114
  544   2HB   HIS  73          HB1       HIS  73  -1.788  10.326   3.927
  545    HD1  HIS  73           HD1      HIS  73  -3.976  11.577   3.629
  546    HD2  HIS  73           HD2      HIS  73  -0.688  13.695   2.199
  547    HE1  HIS  73           HE1      HIS  73  -4.910  13.579   2.408
  548    H    LYS  74           HN       LYS  74  -1.458  12.780   7.287
  549    HA   LYS  74           HA       LYS  74  -2.139  10.258   8.632
  550   1HB   LYS  74          HB2       LYS  74  -2.494  13.175   9.388
  551   2HB   LYS  74          HB1       LYS  74  -2.999  11.839  10.420
  552   1HG   LYS  74          HG2       LYS  74  -0.692  10.968  10.440
  553   2HG   LYS  74          HG1       LYS  74  -0.173  12.298   9.409
  554   1HD   LYS  74          HD2       LYS  74  -1.568  12.895  12.016
  555   2HD   LYS  74          HD1       LYS  74   0.143  12.475  12.020
  556   1HE   LYS  74          HE2       LYS  74  -1.074  14.709  10.363
  557   2HE   LYS  74          HE1       LYS  74  -0.225  14.936  11.890
  558   1HZ   LYS  74          HZ1       LYS  74   0.828  14.228   9.265
  559   2HZ   LYS  74          HZ2       LYS  74   1.568  13.498  10.608
  560   3HZ   LYS  74          HZ3       LYS  74   1.508  15.192  10.483
  561    H    VAL  75           HN       VAL  75  -3.771   9.384   7.294
  562    HA   VAL  75           HA       VAL  75  -6.164  11.035   6.707
  563    HB   VAL  75           HB       VAL  75  -5.458   8.192   5.926
  564   1HG1  VAL  75          HG11      VAL  75  -7.666  10.052   4.999
  565   2HG1  VAL  75          HG12      VAL  75  -7.886   8.572   5.933
  566   3HG1  VAL  75          HG13      VAL  75  -7.298   8.491   4.280
  567   1HG2  VAL  75          HG21      VAL  75  -4.724   9.055   3.852
  568   2HG2  VAL  75          HG22      VAL  75  -4.044  10.175   5.031
  569   3HG2  VAL  75          HG23      VAL  75  -5.493  10.619   4.128
  570    H    SER  76           HN       SER  76  -8.091  10.765   7.764
  571    HA   SER  76           HA       SER  76  -8.216   8.720   9.947
  572   1HB   SER  76          HB2       SER  76  -9.972  11.153   9.518
  573   2HB   SER  76          HB1       SER  76  -9.922  10.124  10.946
  574    HG   SER  76           HG       SER  76  -8.399  12.232  10.335
  575    H    ALA  77           HN       ALA  77 -10.300   7.588  10.211
  576    HA   ALA  77           HA       ALA  77 -11.288   6.479   7.780
  577   1HB   ALA  77          HB1       ALA  77 -12.766   6.546  10.424
  578   2HB   ALA  77          HB2       ALA  77 -11.437   5.438  10.088
  579   3HB   ALA  77          HB3       ALA  77 -12.920   5.345   9.139
  580    H    GLY  78           HN       GLY  78 -11.784   9.539   8.990
  581   1HA   GLY  78          HA2       GLY  78 -14.524   9.785   7.791
  582   2HA   GLY  78          HA1       GLY  78 -13.825  10.911   8.954
  583    H    GLN  79           HN       GLN  79 -11.198  10.950   7.609
  584    HA   GLN  79           HA       GLN  79 -11.901  12.901   5.489
  585   1HB   GLN  79          HB2       GLN  79  -9.303  12.195   6.875
  586   2HB   GLN  79          HB1       GLN  79  -9.413  13.364   5.558
  587   1HG   GLN  79          HG2       GLN  79 -10.908  14.765   6.834
  588   2HG   GLN  79          HG1       GLN  79 -11.053  13.544   8.098
  589   1HE2  GLN  79          HE21      GLN  79 -10.033  16.303   8.450
  590   2HE2  GLN  79          HE22      GLN  79  -8.433  16.157   8.996
  591    H    PHE  80           HN       PHE  80 -11.884  12.311   3.379
  592    HA   PHE  80           HA       PHE  80 -10.060  10.093   2.504
  593   1HB   PHE  80          HB2       PHE  80 -12.943  10.533   1.684
  594   2HB   PHE  80          HB1       PHE  80 -11.843   9.377   0.941
  595    HD1  PHE  80           HD1      PHE  80 -14.018  10.049   3.761
  596    HD2  PHE  80           HD2      PHE  80 -10.842   7.534   2.333
  597    HE1  PHE  80           HE1      PHE  80 -14.524   8.398   5.540
  598    HE2  PHE  80           HE2      PHE  80 -11.344   5.888   4.112
  599    HZ   PHE  80           HZ       PHE  80 -13.187   6.314   5.716
  600    H    SER  81           HN       SER  81  -9.233  10.328   0.361
  601    HA   SER  81           HA       SER  81  -9.662  13.040  -0.865
  602   1HB   SER  81          HB2       SER  81  -7.111  11.416  -0.891
  603   2HB   SER  81          HB1       SER  81  -7.331  13.055  -1.499
  604    HG   SER  81           HG       SER  81  -7.839  12.294   1.186
  605    H    SER  82           HN       SER  82  -8.575   9.703  -1.689
  606    HA   SER  82           HA       SER  82  -9.272  10.245  -4.529
  607   1HB   SER  82          HB2       SER  82  -7.095   9.174  -3.922
  608   2HB   SER  82          HB1       SER  82  -7.991   7.783  -3.317
  609    HG   SER  82           HG       SER  82  -7.358   7.484  -5.483
  610    H    LEU  83           HN       LEU  83 -11.077   9.215  -1.981
  611    HA   LEU  83           HA       LEU  83 -12.332   6.907  -3.310
  612   1HB   LEU  83          HB2       LEU  83 -12.960   8.369  -0.757
  613   2HB   LEU  83          HB1       LEU  83 -13.918   7.025  -1.357
  614    HG   LEU  83           HG       LEU  83 -12.226   6.301   0.290
  615   1HD1  LEU  83          HD11      LEU  83 -12.953   4.952  -1.877
  616   2HD1  LEU  83          HD12      LEU  83 -11.706   4.337  -0.795
  617   3HD1  LEU  83          HD13      LEU  83 -11.248   5.146  -2.291
  618   1HD2  LEU  83          HD21      LEU  83 -10.068   6.894  -1.719
  619   2HD2  LEU  83          HD22      LEU  83  -9.918   6.577   0.008
  620   3HD2  LEU  83          HD23      LEU  83 -10.554   8.122  -0.550
  621    H    HIS  84           HN       HIS  84 -12.467   9.991  -4.145
  622    HA   HIS  84           HA       HIS  84 -15.342  10.482  -4.125
  623   1HB   HIS  84          HB2       HIS  84 -13.397  11.833  -5.999
  624   2HB   HIS  84          HB1       HIS  84 -14.853  12.492  -5.252
  625    HD1  HIS  84           HD1      HIS  84 -13.675  10.949  -2.468
  626    HD2  HIS  84           HD2      HIS  84 -12.107  14.137  -4.646
  627    HE1  HIS  84           HE1      HIS  84 -12.127  12.193  -0.902
  628    H    VAL  85           HN       VAL  85 -13.186   8.689  -6.120
  629    HA   VAL  85           HA       VAL  85 -14.771   8.843  -8.559
  630    HB   VAL  85           HB       VAL  85 -13.272   7.110  -9.386
  631   1HG1  VAL  85          HG11      VAL  85 -11.820   9.098  -7.613
  632   2HG1  VAL  85          HG12      VAL  85 -12.386   9.409  -9.255
  633   3HG1  VAL  85          HG13      VAL  85 -11.104   8.230  -8.969
  634   1HG2  VAL  85          HG21      VAL  85 -11.522   6.224  -7.739
  635   2HG2  VAL  85          HG22      VAL  85 -13.158   5.594  -7.538
  636   3HG2  VAL  85          HG23      VAL  85 -12.555   6.851  -6.457
  637    H    ARG  86           HN       ARG  86 -16.206   7.258  -9.364
  638    HA   ARG  86           HA       ARG  86 -17.443   5.532  -7.284
  639   1HB   ARG  86          HB2       ARG  86 -18.326   6.264 -10.094
  640   2HB   ARG  86          HB1       ARG  86 -19.253   5.261  -8.976
  641   1HG   ARG  86          HG2       ARG  86 -19.320   7.122  -7.364
  642   2HG   ARG  86          HG1       ARG  86 -18.406   8.132  -8.480
  643   1HD   ARG  86          HD2       ARG  86 -20.230   7.748 -10.180
  644   2HD   ARG  86          HD1       ARG  86 -21.175   6.964  -8.920
  645    HE   ARG  86           HE       ARG  86 -20.904   9.795  -9.369
  646   1HH1  ARG  86          HH21      ARG  86 -20.938   7.489  -6.798
  647   2HH1  ARG  86          HH22      ARG  86 -21.273   8.674  -5.582
  648   1HH2  ARG  86          HH11      ARG  86 -21.350  11.329  -7.803
  649   2HH2  ARG  86          HH12      ARG  86 -21.508  10.841  -6.149
  650    H    ASP  87           HN       ASP  87 -15.012   4.506  -7.943
  651    HA   ASP  87           HA       ASP  87 -15.261   2.577 -10.147
  652   1HB   ASP  87          HB2       ASP  87 -13.137   3.041  -8.039
  653   2HB   ASP  87          HB1       ASP  87 -13.029   1.774  -9.262
  654    H    THR  88           HN       THR  88 -14.690   0.205  -9.563
  655    HA   THR  88           HA       THR  88 -16.574  -0.641  -7.436
  656    HB   THR  88           HB       THR  88 -15.018  -2.416  -9.335
  657    HG1  THR  88           HG1      THR  88 -17.580  -1.244  -9.673
  658   1HG2  THR  88          HG21      THR  88 -16.132  -3.441  -7.352
  659   2HG2  THR  88          HG22      THR  88 -16.824  -3.986  -8.881
  660   3HG2  THR  88          HG23      THR  88 -17.666  -2.778  -7.911
  661    H    LYS  89           HN       LYS  89 -15.898  -2.026  -5.707
  662    HA   LYS  89           HA       LYS  89 -13.127  -1.568  -4.867
  663   1HB   LYS  89          HB2       LYS  89 -15.469  -2.967  -3.566
  664   2HB   LYS  89          HB1       LYS  89 -13.872  -2.888  -2.831
  665   1HG   LYS  89          HG2       LYS  89 -13.950  -0.431  -2.885
  666   2HG   LYS  89          HG1       LYS  89 -15.546  -0.488  -3.628
  667   1HD   LYS  89          HD2       LYS  89 -15.094  -1.947  -1.029
  668   2HD   LYS  89          HD1       LYS  89 -15.289  -0.197  -0.997
  669   1HE   LYS  89          HE2       LYS  89 -17.464  -0.315  -1.956
  670   2HE   LYS  89          HE1       LYS  89 -17.252  -2.002  -2.421
  671   1HZ   LYS  89          HZ1       LYS  89 -18.494  -1.227  -0.198
  672   2HZ   LYS  89          HZ2       LYS  89 -16.915  -1.422   0.401
  673   3HZ   LYS  89          HZ3       LYS  89 -17.708  -2.721  -0.356
  674    H    ILE  90           HN       ILE  90 -11.663  -3.298  -4.276
  675    HA   ILE  90           HA       ILE  90 -12.214  -5.923  -5.613
  676    HB   ILE  90           HB       ILE  90  -9.826  -5.937  -6.344
  677   1HG1  ILE  90          HG12      ILE  90  -9.905  -3.018  -5.505
  678   2HG1  ILE  90          HG11      ILE  90  -9.013  -4.285  -4.660
  679   1HG2  ILE  90          HG21      ILE  90 -11.778  -5.141  -7.777
  680   2HG2  ILE  90          HG22      ILE  90 -10.189  -4.551  -8.264
  681   3HG2  ILE  90          HG23      ILE  90 -11.288  -3.495  -7.376
  682   1HD1  ILE  90          HD11      ILE  90  -7.838  -4.755  -6.873
  683   2HD1  ILE  90          HD12      ILE  90  -7.435  -3.220  -6.104
  684   3HD1  ILE  90          HD13      ILE  90  -8.554  -3.254  -7.466
  685    H    GLU  91           HN       GLU  91 -10.815  -7.673  -4.784
  686    HA   GLU  91           HA       GLU  91 -10.810  -7.783  -1.930
  687   1HB   GLU  91          HB2       GLU  91  -9.426  -9.485  -4.020
  688   2HB   GLU  91          HB1       GLU  91  -9.439  -9.879  -2.300
  689   1HG   GLU  91          HG2       GLU  91 -11.897  -9.924  -2.313
  690   2HG   GLU  91          HG1       GLU  91 -11.904  -9.506  -4.027
  691    H    VAL  92           HN       VAL  92  -9.111  -7.598  -0.429
  692    HA   VAL  92           HA       VAL  92  -7.061  -5.707  -0.969
  693    HB   VAL  92           HB       VAL  92  -7.308  -7.808   1.202
  694   1HG1  VAL  92          HG11      VAL  92  -5.263  -5.615   0.799
  695   2HG1  VAL  92          HG12      VAL  92  -4.972  -7.328   1.100
  696   3HG1  VAL  92          HG13      VAL  92  -5.604  -6.304   2.388
  697   1HG2  VAL  92          HG21      VAL  92  -7.587  -4.807   1.445
  698   2HG2  VAL  92          HG22      VAL  92  -8.176  -6.055   2.541
  699   3HG2  VAL  92          HG23      VAL  92  -8.954  -5.820   0.977
  700    H    ALA  93           HN       ALA  93  -6.995  -9.266  -0.991
  701    HA   ALA  93           HA       ALA  93  -4.243  -9.701  -1.265
  702   1HB   ALA  93          HB1       ALA  93  -4.836 -11.758  -2.503
  703   2HB   ALA  93          HB2       ALA  93  -6.480 -11.154  -2.707
  704   3HB   ALA  93          HB3       ALA  93  -5.873 -11.534  -1.095
  705    H    GLN  94           HN       GLN  94  -6.578  -8.806  -3.810
  706    HA   GLN  94           HA       GLN  94  -4.576  -8.880  -5.919
  707   1HB   GLN  94          HB2       GLN  94  -7.318  -7.592  -5.754
  708   2HB   GLN  94          HB1       GLN  94  -6.324  -7.590  -7.210
  709   1HG   GLN  94          HG2       GLN  94  -6.291 -10.053  -7.199
  710   2HG   GLN  94          HG1       GLN  94  -7.283 -10.060  -5.740
  711   1HE2  GLN  94          HE21      GLN  94  -8.168 -11.256  -8.221
  712   2HE2  GLN  94          HE22      GLN  94  -9.503 -10.367  -8.778
  713    H    PHE  95           HN       PHE  95  -5.951  -6.409  -3.813
  714    HA   PHE  95           HA       PHE  95  -4.800  -4.115  -5.022
  715   1HB   PHE  95          HB2       PHE  95  -6.510  -4.015  -3.251
  716   2HB   PHE  95          HB1       PHE  95  -5.342  -4.653  -2.093
  717    HD1  PHE  95           HD1      PHE  95  -6.337  -1.723  -4.073
  718    HD2  PHE  95           HD2      PHE  95  -3.431  -3.331  -1.354
  719    HE1  PHE  95           HE1      PHE  95  -5.459   0.558  -3.660
  720    HE2  PHE  95           HE2      PHE  95  -2.549  -1.054  -0.940
  721    HZ   PHE  95           HZ       PHE  95  -3.567   0.892  -2.096
  722    H    VAL  96           HN       VAL  96  -3.536  -6.140  -2.347
  723    HA   VAL  96           HA       VAL  96  -1.110  -4.703  -1.997
  724    HB   VAL  96           HB       VAL  96  -1.627  -7.668  -1.608
  725   1HG1  VAL  96          HG11      VAL  96   0.603  -5.822  -0.743
  726   2HG1  VAL  96          HG12      VAL  96   0.727  -7.364  -1.590
  727   3HG1  VAL  96          HG13      VAL  96   0.258  -7.326   0.110
  728   1HG2  VAL  96          HG21      VAL  96  -3.116  -6.021  -0.361
  729   2HG2  VAL  96          HG22      VAL  96  -1.658  -5.453   0.452
  730   3HG2  VAL  96          HG23      VAL  96  -2.186  -7.123   0.655
  731    H    LYS  97           HN       LYS  97  -1.784  -7.588  -3.995
  732    HA   LYS  97           HA       LYS  97   0.850  -7.828  -5.045
  733   1HB   LYS  97          HB2       LYS  97  -1.841  -8.666  -6.137
  734   2HB   LYS  97          HB1       LYS  97  -0.309  -9.097  -6.900
  735   1HG   LYS  97          HG2       LYS  97   0.440 -10.242  -4.892
  736   2HG   LYS  97          HG1       LYS  97  -0.978  -9.690  -4.004
  737   1HD   LYS  97          HD2       LYS  97  -1.541 -11.897  -4.604
  738   2HD   LYS  97          HD1       LYS  97  -2.351 -10.925  -5.829
  739   1HE   LYS  97          HE2       LYS  97  -0.555 -11.342  -7.416
  740   2HE   LYS  97          HE1       LYS  97   0.386 -12.182  -6.185
  741   1HZ   LYS  97          HZ1       LYS  97  -1.694 -13.660  -6.007
  742   2HZ   LYS  97          HZ2       LYS  97  -0.632 -13.894  -7.312
  743   3HZ   LYS  97          HZ3       LYS  97  -2.084 -13.042  -7.538
  744    H    ASP  98           HN       ASP  98  -1.991  -6.058  -6.368
  745    HA   ASP  98           HA       ASP  98  -0.690  -5.229  -8.769
  746   1HB   ASP  98          HB2       ASP  98  -2.877  -3.918  -7.132
  747   2HB   ASP  98          HB1       ASP  98  -2.336  -3.286  -8.689
  748    H    LEU  99           HN       LEU  99  -0.783  -3.780  -5.538
  749    HA   LEU  99           HA       LEU  99   0.690  -1.416  -6.193
  750   1HB   LEU  99          HB2       LEU  99  -0.608  -1.679  -4.100
  751   2HB   LEU  99          HB1       LEU  99   0.524  -2.916  -3.560
  752    HG   LEU  99           HG       LEU  99   2.362  -1.248  -3.633
  753   1HD1  LEU  99          HD11      LEU  99   1.785   0.370  -5.226
  754   2HD1  LEU  99          HD12      LEU  99   1.443   1.223  -3.725
  755   3HD1  LEU  99          HD13      LEU  99   0.123   0.500  -4.645
  756   1HD2  LEU  99          HD21      LEU  99   1.403   0.223  -1.748
  757   2HD2  LEU  99          HD22      LEU  99   1.342  -1.521  -1.498
  758   3HD2  LEU  99          HD23      LEU  99  -0.110  -0.652  -1.992
  759    H    LEU 100           HN       LEU 100   1.663  -4.669  -5.212
  760    HA   LEU 100           HA       LEU 100   4.399  -4.226  -4.704
  761   1HB   LEU 100          HB2       LEU 100   3.407  -6.353  -4.180
  762   2HB   LEU 100          HB1       LEU 100   2.974  -6.630  -5.861
  763    HG   LEU 100           HG       LEU 100   5.318  -6.814  -6.489
  764   1HD1  LEU 100          HD11      LEU 100   6.459  -5.278  -5.098
  765   2HD1  LEU 100          HD12      LEU 100   7.000  -6.848  -4.514
  766   3HD1  LEU 100          HD13      LEU 100   5.763  -5.957  -3.627
  767   1HD2  LEU 100          HD21      LEU 100   4.173  -8.820  -5.608
  768   2HD2  LEU 100          HD22      LEU 100   4.734  -8.417  -3.985
  769   3HD2  LEU 100          HD23      LEU 100   5.897  -8.840  -5.243
  770    H    LEU 101           HN       LEU 101   2.848  -4.960  -7.868
  771    HA   LEU 101           HA       LEU 101   5.294  -5.039  -9.330
  772   1HB   LEU 101          HB2       LEU 101   2.450  -4.412 -10.090
  773   2HB   LEU 101          HB1       LEU 101   3.730  -4.229 -11.283
  774    HG   LEU 101           HG       LEU 101   2.550  -6.485 -11.271
  775   1HD1  LEU 101          HD11      LEU 101   4.474  -7.628 -11.914
  776   2HD1  LEU 101          HD12      LEU 101   5.463  -6.921 -10.640
  777   3HD1  LEU 101          HD13      LEU 101   5.016  -5.960 -12.049
  778   1HD2  LEU 101          HD21      LEU 101   4.204  -7.032  -8.802
  779   2HD2  LEU 101          HD22      LEU 101   2.943  -8.035  -9.517
  780   3HD2  LEU 101          HD23      LEU 101   2.518  -6.531  -8.709
  781    H    HIS 102           HN       HIS 102   3.225  -2.268  -8.478
  782    HA   HIS 102           HA       HIS 102   4.814  -0.388  -9.990
  783   1HB   HIS 102          HB2       HIS 102   2.738  -0.108  -7.825
  784   2HB   HIS 102          HB1       HIS 102   3.659   1.297  -8.359
  785    HD1  HIS 102           HD1      HIS 102   3.270   2.159 -10.752
  786    HD2  HIS 102           HD2      HIS 102   0.958  -1.168  -9.790
  787    HE1  HIS 102           HE1      HIS 102   1.568   1.925 -12.605
  788    H    LEU 103           HN       LEU 103   4.931  -1.456  -6.588
  789    HA   LEU 103           HA       LEU 103   6.774   0.514  -5.709
  790   1HB   LEU 103          HB2       LEU 103   6.429  -2.357  -4.810
  791   2HB   LEU 103          HB1       LEU 103   7.440  -1.185  -3.969
  792    HG   LEU 103           HG       LEU 103   4.483  -0.778  -4.523
  793   1HD1  LEU 103          HD11      LEU 103   4.806  -2.685  -3.013
  794   2HD1  LEU 103          HD12      LEU 103   4.172  -1.307  -2.116
  795   3HD1  LEU 103          HD13      LEU 103   5.882  -1.723  -2.001
  796   1HD2  LEU 103          HD21      LEU 103   4.909   0.867  -2.508
  797   2HD2  LEU 103          HD22      LEU 103   5.375   1.365  -4.128
  798   3HD2  LEU 103          HD23      LEU 103   6.593   0.759  -3.010
  799    H    LYS 104           HN       LYS 104   7.505  -2.735  -7.067
  800    HA   LYS 104           HA       LYS 104  10.354  -2.306  -6.955
  801   1HB   LYS 104          HB2       LYS 104  10.540  -4.277  -8.373
  802   2HB   LYS 104          HB1       LYS 104   9.311  -4.560  -7.143
  803   1HG   LYS 104          HG2       LYS 104   7.574  -3.865  -8.814
  804   2HG   LYS 104          HG1       LYS 104   8.840  -3.790 -10.034
  805   1HD   LYS 104          HD2       LYS 104   7.842  -5.958 -10.247
  806   2HD   LYS 104          HD1       LYS 104   9.398  -6.199  -9.459
  807   1HE   LYS 104          HE2       LYS 104   8.427  -6.704  -7.402
  808   2HE   LYS 104          HE1       LYS 104   6.962  -5.789  -7.748
  809   1HZ   LYS 104          HZ1       LYS 104   7.591  -8.527  -8.338
  810   2HZ   LYS 104          HZ2       LYS 104   6.966  -7.685  -9.675
  811   3HZ   LYS 104          HZ3       LYS 104   6.082  -7.763  -8.226
  812    H    LYS 105           HN       LYS 105   7.891  -1.312  -9.207
  813    HA   LYS 105           HA       LYS 105   9.565  -0.933 -11.505
  814   1HB   LYS 105          HB2       LYS 105   7.106  -0.996 -11.629
  815   2HB   LYS 105          HB1       LYS 105   7.019   0.517 -10.727
  816   1HG   LYS 105          HG2       LYS 105   8.260   1.672 -12.516
  817   2HG   LYS 105          HG1       LYS 105   8.391   0.159 -13.412
  818   1HD   LYS 105          HD2       LYS 105   5.918   0.043 -13.542
  819   2HD   LYS 105          HD1       LYS 105   5.814   1.583 -12.686
  820   1HE   LYS 105          HE2       LYS 105   7.028   2.708 -14.477
  821   2HE   LYS 105          HE1       LYS 105   7.270   1.175 -15.314
  822   1HZ   LYS 105          HZ1       LYS 105   4.622   2.369 -14.709
  823   2HZ   LYS 105          HZ2       LYS 105   4.915   0.961 -15.612
  824   3HZ   LYS 105          HZ3       LYS 105   5.407   2.473 -16.209
  825    H    LEU 106           HN       LEU 106   8.576   1.402  -8.946
  826    HA   LEU 106           HA       LEU 106   9.930   3.633 -10.088
  827   1HB   LEU 106          HB2       LEU 106   9.129   2.948  -7.262
  828   2HB   LEU 106          HB1       LEU 106  10.072   4.395  -7.585
  829    HG   LEU 106           HG       LEU 106   7.526   4.691  -7.521
  830   1HD1  LEU 106          HD11      LEU 106   9.270   6.212  -8.722
  831   2HD1  LEU 106          HD12      LEU 106   7.566   6.411  -9.112
  832   3HD1  LEU 106          HD13      LEU 106   8.620   5.521 -10.206
  833   1HD2  LEU 106          HD21      LEU 106   7.616   3.526 -10.307
  834   2HD2  LEU 106          HD22      LEU 106   6.203   3.956  -9.344
  835   3HD2  LEU 106          HD23      LEU 106   7.176   2.561  -8.904
  836    H    PHE 107           HN       PHE 107  11.131   0.933  -8.198
  837    HA   PHE 107           HA       PHE 107  13.636   2.029  -7.421
  838   1HB   PHE 107          HB2       PHE 107  12.765  -0.163  -6.610
  839   2HB   PHE 107          HB1       PHE 107  13.075  -0.845  -8.206
  840    HD1  PHE 107           HD1      PHE 107  14.700   0.847  -5.316
  841    HD2  PHE 107           HD2      PHE 107  15.262  -1.539  -8.844
  842    HE1  PHE 107           HE1      PHE 107  17.075   0.505  -4.705
  843    HE2  PHE 107           HE2      PHE 107  17.640  -1.886  -8.228
  844    HZ   PHE 107           HZ       PHE 107  18.547  -0.864  -6.159
  845    H    ARG 108           HN       ARG 108  12.611   0.512 -10.458
  846    HA   ARG 108           HA       ARG 108  15.176   0.269 -11.649
  847   1HB   ARG 108          HB2       ARG 108  12.456   0.761 -12.883
  848   2HB   ARG 108          HB1       ARG 108  13.904   0.433 -13.834
  849   1HG   ARG 108          HG2       ARG 108  14.202  -1.711 -12.647
  850   2HG   ARG 108          HG1       ARG 108  12.751  -1.387 -11.698
  851   1HD   ARG 108          HD2       ARG 108  11.445  -1.263 -13.832
  852   2HD   ARG 108          HD1       ARG 108  12.900  -1.735 -14.707
  853    HE   ARG 108           HE       ARG 108  12.576  -3.701 -12.755
  854   1HH1  ARG 108          HH21      ARG 108  10.723  -2.319 -15.314
  855   2HH1  ARG 108          HH22      ARG 108   9.811  -3.762 -15.610
  856   1HH2  ARG 108          HH11      ARG 108  11.395  -5.588 -13.124
  857   2HH2  ARG 108          HH12      ARG 108  10.192  -5.613 -14.370
  858    H    GLU 109           HN       GLU 109  12.937   3.041 -11.566
  859    HA   GLU 109           HA       GLU 109  14.795   4.663 -13.181
  860   1HB   GLU 109          HB2       GLU 109  12.156   5.277 -11.824
  861   2HB   GLU 109          HB1       GLU 109  13.088   6.479 -12.715
  862   1HG   GLU 109          HG2       GLU 109  11.512   5.613 -14.282
  863   2HG   GLU 109          HG1       GLU 109  13.042   4.840 -14.688
  864    H    GLY 110           HN       GLY 110  14.484   3.847  -9.896
  865   1HA   GLY 110          HA2       GLY 110  15.632   4.635  -8.012
  866   2HA   GLY 110          HA1       GLY 110  16.645   5.561  -9.120
  867    H    ARG 111           HN       ARG 111  13.311   6.197  -9.510
  868    HA   ARG 111           HA       ARG 111  13.678   8.858  -8.223
  869   1HB   ARG 111          HB2       ARG 111  11.520   7.755 -10.054
  870   2HB   ARG 111          HB1       ARG 111  11.504   9.382  -9.372
  871   1HG   ARG 111          HG2       ARG 111  13.668   9.866 -10.454
  872   2HG   ARG 111          HG1       ARG 111  13.688   8.240 -11.139
  873   1HD   ARG 111          HD2       ARG 111  11.518   8.756 -12.285
  874   2HD   ARG 111          HD1       ARG 111  11.653  10.414 -11.702
  875    HE   ARG 111           HE       ARG 111  14.059   9.971 -13.009
  876   1HH1  ARG 111          HH21      ARG 111  10.705   9.662 -13.747
  877   2HH1  ARG 111          HH22      ARG 111  10.908   9.992 -15.435
  878   1HH2  ARG 111          HH11      ARG 111  14.343  10.407 -15.213
  879   2HH2  ARG 111          HH12      ARG 111  12.967  10.417 -16.263
  880    H    PHE 112           HN       PHE 112  13.347   8.534  -6.041
  881    HA   PHE 112           HA       PHE 112  11.016   6.928  -5.148
  882   1HB   PHE 112          HB2       PHE 112  13.200   8.289  -3.540
  883   2HB   PHE 112          HB1       PHE 112  12.030   7.108  -2.939
  884    HD1  PHE 112           HD1      PHE 112  12.047   4.770  -3.811
  885    HD2  PHE 112           HD2      PHE 112  15.114   7.598  -4.825
  886    HE1  PHE 112           HE1      PHE 112  13.487   2.926  -4.620
  887    HE2  PHE 112           HE2      PHE 112  16.552   5.746  -5.637
  888    HZ   PHE 112           HZ       PHE 112  15.739   3.408  -5.530
  889    H    ASN 113           HN       ASN 113   9.199   7.835  -4.283
  890    HA   ASN 113           HA       ASN 113   7.620   9.521  -3.882
  891   1HB   ASN 113          HB2       ASN 113  10.097  10.611  -2.526
  892   2HB   ASN 113          HB1       ASN 113   8.514  11.381  -2.393
  893   1HD2  ASN 113          HD21      ASN 113  10.100   9.978  -0.243
  894   2HD2  ASN 113          HD22      ASN 113   9.077   8.755   0.337
  Start of MODEL    8
    1   1H    MET   1           HT1      MET   1  23.039   9.516  13.838
    2   2H    MET   1           HT2      MET   1  24.130  10.017  12.635
    3   3H    MET   1           HT3      MET   1  24.517   8.706  13.644
    4    HA   MET   1           HA       MET   1  23.690   8.231  11.269
    5   1HB   MET   1          HB2       MET   1  22.606   6.926  13.777
    6   2HB   MET   1          HB1       MET   1  22.439   6.226  12.167
    7   1HG   MET   1          HG2       MET   1  24.870   6.185  11.899
    8   2HG   MET   1          HG1       MET   1  25.077   6.956  13.470
    9   1HE   MET   1          HE1       MET   1  24.468   4.401  16.075
   10   2HE   MET   1          HE2       MET   1  23.387   5.707  15.602
   11   3HE   MET   1          HE3       MET   1  25.129   5.964  15.576
   12    H    GLY   2           HN       GLY   2  22.221   9.323  10.042
   13   1HA   GLY   2          HA2       GLY   2  19.716  10.315  11.131
   14   2HA   GLY   2          HA1       GLY   2  20.190  10.356   9.432
   15    HA   PRO   3           HA       PRO   3  16.839   7.054  10.462
   16   1HB   PRO   3          HB2       PRO   3  15.436   8.226   8.175
   17   2HB   PRO   3          HB1       PRO   3  14.878   8.041   9.840
   18   1HG   PRO   3          HG2       PRO   3  15.720  10.457   8.546
   19   2HG   PRO   3          HG1       PRO   3  15.229  10.256  10.230
   20   1HD   PRO   3          HD2       PRO   3  17.881  10.797   9.241
   21   2HD   PRO   3          HD1       PRO   3  17.398  10.501  10.930
   22    H    VAL   4           HN       VAL   4  15.752   5.750   8.382
   23    HA   VAL   4           HA       VAL   4  18.064   4.653   7.004
   24    HB   VAL   4           HB       VAL   4  16.329   3.105   6.006
   25   1HG1  VAL   4          HG11      VAL   4  15.933   1.940   8.114
   26   2HG1  VAL   4          HG12      VAL   4  16.242   3.421   9.020
   27   3HG1  VAL   4          HG13      VAL   4  17.552   2.639   8.134
   28   1HG2  VAL   4          HG21      VAL   4  14.442   4.759   6.137
   29   2HG2  VAL   4          HG22      VAL   4  14.474   4.594   7.890
   30   3HG2  VAL   4          HG23      VAL   4  14.057   3.211   6.883
   31    HA   PRO   5           HA       PRO   5  17.619   7.328   3.430
   32   1HB   PRO   5          HB2       PRO   5  18.477   5.324   1.525
   33   2HB   PRO   5          HB1       PRO   5  19.410   6.672   2.185
   34   1HG   PRO   5          HG2       PRO   5  19.663   3.863   2.805
   35   2HG   PRO   5          HG1       PRO   5  20.639   5.202   3.405
   36   1HD   PRO   5          HD2       PRO   5  18.703   3.663   4.881
   37   2HD   PRO   5          HD1       PRO   5  19.623   5.083   5.444
   38    HA   PRO   6           HA       PRO   6  13.747   6.323   1.521
   39   1HB   PRO   6          HB2       PRO   6  14.163   7.235  -1.099
   40   2HB   PRO   6          HB1       PRO   6  13.702   8.242   0.278
   41   1HG   PRO   6          HG2       PRO   6  16.343   7.976  -1.053
   42   2HG   PRO   6          HG1       PRO   6  15.677   9.337  -0.140
   43   1HD   PRO   6          HD2       PRO   6  17.626   7.560   0.822
   44   2HD   PRO   6          HD1       PRO   6  16.600   8.605   1.837
   45    H    SER   7           HN       SER   7  16.344   5.577  -0.829
   46    HA   SER   7           HA       SER   7  14.912   3.546  -2.215
   47   1HB   SER   7          HB2       SER   7  17.034   2.922  -3.177
   48   2HB   SER   7          HB1       SER   7  17.037   4.672  -2.988
   49    HG   SER   7           HG       SER   7  18.897   3.243  -2.176
   50    H    THR   8           HN       THR   8  16.952   3.386   0.688
   51    HA   THR   8           HA       THR   8  16.986   0.498   0.781
   52    HB   THR   8           HB       THR   8  17.361   2.511   3.017
   53    HG1  THR   8           HG1      THR   8  18.904   1.602   0.950
   54   1HG2  THR   8          HG21      THR   8  16.886   0.388   4.005
   55   2HG2  THR   8          HG22      THR   8  18.642   0.553   4.028
   56   3HG2  THR   8          HG23      THR   8  17.868  -0.461   2.812
   57    H    ALA   9           HN       ALA   9  14.883   2.956   2.278
   58    HA   ALA   9           HA       ALA   9  13.336   1.142   3.852
   59   1HB   ALA   9          HB1       ALA   9  13.161   3.556   4.188
   60   2HB   ALA   9          HB2       ALA   9  11.575   2.919   3.750
   61   3HB   ALA   9          HB3       ALA   9  12.547   3.768   2.548
   62    H    LEU  10           HN       LEU  10  13.001   2.259   0.496
   63    HA   LEU  10           HA       LEU  10  10.535   0.941  -0.052
   64   1HB   LEU  10          HB2       LEU  10  11.597   2.611  -1.577
   65   2HB   LEU  10          HB1       LEU  10  12.853   1.435  -1.953
   66    HG   LEU  10           HG       LEU  10  11.023  -0.144  -2.722
   67   1HD1  LEU  10          HD11      LEU  10   8.904   1.257  -3.432
   68   2HD1  LEU  10          HD12      LEU  10   9.375   2.296  -2.091
   69   3HD1  LEU  10          HD13      LEU  10   9.013   0.595  -1.804
   70   1HD2  LEU  10          HD21      LEU  10  11.249   2.515  -4.158
   71   2HD2  LEU  10          HD22      LEU  10  10.750   0.987  -4.886
   72   3HD2  LEU  10          HD23      LEU  10  12.394   1.180  -4.280
   73    H    ARG  11           HN       ARG  11  13.931  -0.148  -0.365
   74    HA   ARG  11           HA       ARG  11  13.366  -2.743  -1.405
   75   1HB   ARG  11          HB2       ARG  11  15.612  -1.769   0.385
   76   2HB   ARG  11          HB1       ARG  11  15.564  -3.386  -0.308
   77   1HG   ARG  11          HG2       ARG  11  15.606  -2.471  -2.563
   78   2HG   ARG  11          HG1       ARG  11  15.495  -0.825  -1.934
   79   1HD   ARG  11          HD2       ARG  11  17.662  -0.955  -0.937
   80   2HD   ARG  11          HD1       ARG  11  17.737  -2.703  -1.153
   81    HE   ARG  11           HE       ARG  11  17.519  -1.749  -3.738
   82   1HH1  ARG  11          HH21      ARG  11  19.514  -1.069  -1.011
   83   2HH1  ARG  11          HH22      ARG  11  20.918  -0.705  -1.957
   84   1HH2  ARG  11          HH11      ARG  11  19.347  -1.279  -4.990
   85   2HH2  ARG  11          HH12      ARG  11  20.820  -0.814  -4.208
   86    H    GLU  12           HN       GLU  12  13.667  -1.554   1.926
   87    HA   GLU  12           HA       GLU  12  13.227  -4.053   3.224
   88   1HB   GLU  12          HB2       GLU  12  12.647  -1.207   4.094
   89   2HB   GLU  12          HB1       GLU  12  12.456  -2.607   5.155
   90   1HG   GLU  12          HG2       GLU  12  14.828  -3.195   4.808
   91   2HG   GLU  12          HG1       GLU  12  15.018  -1.794   3.753
   92    H    LEU  13           HN       LEU  13  11.010  -1.558   2.054
   93    HA   LEU  13           HA       LEU  13   8.627  -2.781   3.102
   94   1HB   LEU  13          HB2       LEU  13   8.729  -0.408   2.477
   95   2HB   LEU  13          HB1       LEU  13   9.021  -0.850   0.796
   96    HG   LEU  13           HG       LEU  13   6.812  -1.952   0.689
   97   1HD1  LEU  13          HD11      LEU  13   6.764  -1.181   3.606
   98   2HD1  LEU  13          HD12      LEU  13   6.326  -2.718   2.857
   99   3HD1  LEU  13          HD13      LEU  13   5.254  -1.329   2.706
  100   1HD2  LEU  13          HD21      LEU  13   6.770   0.889   1.756
  101   2HD2  LEU  13          HD22      LEU  13   5.439   0.120   0.892
  102   3HD2  LEU  13          HD23      LEU  13   6.972   0.410   0.070
  103    H    ILE  14           HN       ILE  14  10.132  -2.875  -0.162
  104    HA   ILE  14           HA       ILE  14   8.118  -4.519  -1.346
  105    HB   ILE  14           HB       ILE  14  11.057  -4.191  -2.004
  106   1HG1  ILE  14          HG12      ILE  14   8.585  -3.136  -3.401
  107   2HG1  ILE  14          HG11      ILE  14   9.484  -2.213  -2.197
  108   1HG2  ILE  14          HG21      ILE  14   8.851  -5.633  -3.507
  109   2HG2  ILE  14          HG22      ILE  14  10.374  -6.318  -2.942
  110   3HG2  ILE  14          HG23      ILE  14  10.371  -5.139  -4.250
  111   1HD1  ILE  14          HD11      ILE  14  11.544  -2.504  -3.595
  112   2HD1  ILE  14          HD12      ILE  14  10.276  -1.585  -4.407
  113   3HD1  ILE  14          HD13      ILE  14  10.548  -3.274  -4.829
  114    H    GLU  15           HN       GLU  15  11.259  -5.471   0.089
  115    HA   GLU  15           HA       GLU  15  10.968  -8.251  -0.360
  116   1HB   GLU  15          HB2       GLU  15  12.482  -6.711   1.757
  117   2HB   GLU  15          HB1       GLU  15  12.624  -8.459   1.548
  118   1HG   GLU  15          HG2       GLU  15  13.383  -8.181  -0.744
  119   2HG   GLU  15          HG1       GLU  15  13.098  -6.443  -0.666
  120    H    GLU  16           HN       GLU  16   9.897  -6.296   2.426
  121    HA   GLU  16           HA       GLU  16   9.015  -8.591   3.940
  122   1HB   GLU  16          HB2       GLU  16   9.498  -6.343   4.932
  123   2HB   GLU  16          HB1       GLU  16   8.036  -5.738   4.156
  124   1HG   GLU  16          HG2       GLU  16   6.676  -7.377   5.389
  125   2HG   GLU  16          HG1       GLU  16   8.132  -8.026   6.146
  126    H    LEU  17           HN       LEU  17   7.353  -6.360   1.697
  127    HA   LEU  17           HA       LEU  17   4.732  -7.409   2.111
  128   1HB   LEU  17          HB2       LEU  17   5.998  -6.130  -0.325
  129   2HB   LEU  17          HB1       LEU  17   4.292  -6.560  -0.246
  130    HG   LEU  17           HG       LEU  17   5.664  -4.751   1.766
  131   1HD1  LEU  17          HD11      LEU  17   4.626  -2.878   0.571
  132   2HD1  LEU  17          HD12      LEU  17   3.939  -3.991  -0.611
  133   3HD1  LEU  17          HD13      LEU  17   5.687  -3.772  -0.520
  134   1HD2  LEU  17          HD21      LEU  17   3.724  -5.458   2.838
  135   2HD2  LEU  17          HD22      LEU  17   2.846  -5.713   1.331
  136   3HD2  LEU  17          HD23      LEU  17   3.084  -4.081   1.947
  137    H    VAL  18           HN       VAL  18   7.250  -8.349  -0.236
  138    HA   VAL  18           HA       VAL  18   5.730 -10.367  -1.545
  139    HB   VAL  18           HB       VAL  18   8.713 -10.094  -1.104
  140   1HG1  VAL  18          HG11      VAL  18   8.806 -11.648  -3.135
  141   2HG1  VAL  18          HG12      VAL  18   7.118 -12.028  -2.799
  142   3HG1  VAL  18          HG13      VAL  18   8.362 -12.403  -1.605
  143   1HG2  VAL  18          HG21      VAL  18   7.054  -9.591  -3.588
  144   2HG2  VAL  18          HG22      VAL  18   8.734  -9.134  -3.305
  145   3HG2  VAL  18          HG23      VAL  18   7.440  -8.325  -2.422
  146    H    ASN  19           HN       ASN  19   7.930 -10.634   1.267
  147    HA   ASN  19           HA       ASN  19   7.802 -13.451   1.545
  148   1HB   ASN  19          HB2       ASN  19   9.408 -12.056   2.783
  149   2HB   ASN  19          HB1       ASN  19   8.086 -11.366   3.727
  150   1HD2  ASN  19          HD21      ASN  19   8.247 -12.303   5.791
  151   2HD2  ASN  19          HD22      ASN  19   8.425 -13.965   6.082
  152    H    ILE  20           HN       ILE  20   5.679 -10.972   3.029
  153    HA   ILE  20           HA       ILE  20   4.166 -12.984   4.467
  154    HB   ILE  20           HB       ILE  20   2.665 -11.151   5.085
  155   1HG1  ILE  20          HG12      ILE  20   4.332  -9.437   3.216
  156   2HG1  ILE  20          HG11      ILE  20   2.702  -9.997   2.855
  157   1HG2  ILE  20          HG21      ILE  20   5.554 -10.234   5.112
  158   2HG2  ILE  20          HG22      ILE  20   4.890 -11.448   6.206
  159   3HG2  ILE  20          HG23      ILE  20   4.290  -9.791   6.260
  160   1HD1  ILE  20          HD11      ILE  20   2.466  -7.795   3.759
  161   2HD1  ILE  20          HD12      ILE  20   3.555  -8.161   5.096
  162   3HD1  ILE  20          HD13      ILE  20   1.962  -8.914   5.025
  163    H    THR  21           HN       THR  21   3.915 -11.752   1.216
  164    HA   THR  21           HA       THR  21   1.091 -12.706   1.024
  165    HB   THR  21           HB       THR  21   1.104 -11.658  -1.206
  166    HG1  THR  21           HG1      THR  21   2.923 -10.570  -1.884
  167   1HG2  THR  21          HG21      THR  21   0.801 -10.392   1.115
  168   2HG2  THR  21          HG22      THR  21   0.849  -9.496  -0.403
  169   3HG2  THR  21          HG23      THR  21   2.284  -9.590   0.607
  170    H    GLN  22           HN       GLN  22   4.276 -13.818   0.251
  171    HA   GLN  22           HA       GLN  22   3.377 -15.528  -1.949
  172   1HB   GLN  22          HB2       GLN  22   5.951 -15.364  -0.375
  173   2HB   GLN  22          HB1       GLN  22   5.668 -16.627  -1.572
  174   1HG   GLN  22          HG2       GLN  22   5.304 -14.959  -3.312
  175   2HG   GLN  22          HG1       GLN  22   5.447 -13.655  -2.134
  176   1HE2  GLN  22          HE21      GLN  22   7.197 -13.900  -4.429
  177   2HE2  GLN  22          HE22      GLN  22   8.765 -14.201  -3.853
  178    H    ASN  23           HN       ASN  23   3.726 -15.836   1.536
  179    HA   ASN  23           HA       ASN  23   3.177 -18.755   1.394
  180   1HB   ASN  23          HB2       ASN  23   3.804 -16.915   3.720
  181   2HB   ASN  23          HB1       ASN  23   3.505 -18.647   3.873
  182   1HD2  ASN  23          HD21      ASN  23   4.918 -18.689   0.986
  183   2HD2  ASN  23          HD22      ASN  23   6.561 -18.755   1.410
  184    H    GLN  24           HN       GLN  24   1.293 -15.968   1.413
  185    HA   GLN  24           HA       GLN  24  -0.745 -16.997   3.282
  186   1HB   GLN  24          HB2       GLN  24  -1.921 -14.983   2.938
  187   2HB   GLN  24          HB1       GLN  24  -0.237 -14.489   2.792
  188   1HG   GLN  24          HG2       GLN  24  -0.460 -14.753   0.291
  189   2HG   GLN  24          HG1       GLN  24  -2.186 -15.013   0.525
  190   1HE2  GLN  24          HE21      GLN  24  -2.630 -12.994  -0.672
  191   2HE2  GLN  24          HE22      GLN  24  -2.402 -11.489   0.081
  192    H    LYS  25           HN       LYS  25  -2.464 -18.245   2.711
  193    HA   LYS  25           HA       LYS  25  -2.685 -19.100  -0.107
  194   1HB   LYS  25          HB2       LYS  25  -2.813 -20.810   1.665
  195   2HB   LYS  25          HB1       LYS  25  -4.178 -19.971   2.392
  196   1HG   LYS  25          HG2       LYS  25  -4.944 -21.882   1.039
  197   2HG   LYS  25          HG1       LYS  25  -5.517 -20.367   0.351
  198   1HD   LYS  25          HD2       LYS  25  -3.937 -20.443  -1.420
  199   2HD   LYS  25          HD1       LYS  25  -2.958 -21.664  -0.602
  200   1HE   LYS  25          HE2       LYS  25  -5.798 -22.130  -1.551
  201   2HE   LYS  25          HE1       LYS  25  -4.370 -22.559  -2.493
  202   1HZ   LYS  25          HZ1       LYS  25  -4.177 -24.407  -1.322
  203   2HZ   LYS  25          HZ2       LYS  25  -5.583 -24.017  -0.453
  204   3HZ   LYS  25          HZ3       LYS  25  -4.063 -23.525   0.122
  205    H    ALA  26           HN       ALA  26  -5.303 -18.506   2.209
  206    HA   ALA  26           HA       ALA  26  -6.905 -17.218   0.134
  207   1HB   ALA  26          HB1       ALA  26  -7.301 -18.236   2.889
  208   2HB   ALA  26          HB2       ALA  26  -8.407 -18.284   1.518
  209   3HB   ALA  26          HB3       ALA  26  -8.286 -16.826   2.502
  210    HA   PRO  27           HA       PRO  27  -5.884 -12.939   0.715
  211   1HB   PRO  27          HB2       PRO  27  -8.594 -12.307   1.730
  212   2HB   PRO  27          HB1       PRO  27  -7.783 -11.730   0.268
  213   1HG   PRO  27          HG2       PRO  27  -9.837 -13.683   0.393
  214   2HG   PRO  27          HG1       PRO  27  -8.859 -13.276  -1.022
  215   1HD   PRO  27          HD2       PRO  27  -8.801 -15.731   0.500
  216   2HD   PRO  27          HD1       PRO  27  -7.771 -15.292  -0.886
  217    H    LEU  28           HN       LEU  28  -5.179 -11.578   2.449
  218    HA   LEU  28           HA       LEU  28  -4.834 -12.796   4.997
  219   1HB   LEU  28          HB2       LEU  28  -4.689  -9.867   4.225
  220   2HB   LEU  28          HB1       LEU  28  -4.066 -10.543   5.728
  221    HG   LEU  28           HG       LEU  28  -3.183 -11.469   2.976
  222   1HD1  LEU  28          HD11      LEU  28  -1.207 -10.097   3.262
  223   2HD1  LEU  28          HD12      LEU  28  -1.729  -9.602   4.872
  224   3HD1  LEU  28          HD13      LEU  28  -2.622  -9.062   3.450
  225   1HD2  LEU  28          HD21      LEU  28  -2.350 -12.084   5.811
  226   2HD2  LEU  28          HD22      LEU  28  -1.165 -12.200   4.511
  227   3HD2  LEU  28          HD23      LEU  28  -2.619 -13.190   4.467
  228    H    CYS  29           HN       CYS  29  -7.041 -10.145   4.058
  229    HA   CYS  29           HA       CYS  29  -8.378 -10.284   6.675
  230   1HB   CYS  29          HB2       CYS  29  -9.008  -8.690   4.178
  231   2HB   CYS  29          HB1       CYS  29  -9.845  -8.514   5.721
  232    H    ASN  30           HN       ASN  30 -10.902 -10.389   6.565
  233    HA   ASN  30           HA       ASN  30 -11.602 -12.963   5.462
  234   1HB   ASN  30          HB2       ASN  30 -12.626 -11.917   7.525
  235   2HB   ASN  30          HB1       ASN  30 -13.510 -10.829   6.451
  236   1HD2  ASN  30          HD21      ASN  30 -15.448 -12.033   7.479
  237   2HD2  ASN  30          HD22      ASN  30 -15.940 -13.481   6.743
  238    H    GLY  31           HN       GLY  31 -10.720 -11.777   3.251
  239   1HA   GLY  31          HA2       GLY  31 -11.390 -11.431   1.020
  240   2HA   GLY  31          HA1       GLY  31 -13.052 -11.720   1.533
  241    H    SER  32           HN       SER  32 -11.266  -9.289   3.248
  242    HA   SER  32           HA       SER  32 -13.172  -7.252   2.670
  243   1HB   SER  32          HB2       SER  32 -10.287  -6.882   3.516
  244   2HB   SER  32          HB1       SER  32 -11.570  -5.691   3.660
  245    HG   SER  32           HG       SER  32 -12.650  -7.540   4.868
  246    H    MET  33           HN       MET  33 -13.173  -5.588   1.165
  247    HA   MET  33           HA       MET  33 -11.201  -5.837  -1.087
  248   1HB   MET  33          HB2       MET  33 -14.065  -4.828  -1.111
  249   2HB   MET  33          HB1       MET  33 -13.003  -4.959  -2.515
  250   1HG   MET  33          HG2       MET  33 -12.823  -7.401  -2.144
  251   2HG   MET  33          HG1       MET  33 -13.897  -7.259  -0.755
  252   1HE   MET  33          HE1       MET  33 -14.298  -5.404  -4.460
  253   2HE   MET  33          HE2       MET  33 -14.760  -6.939  -5.188
  254   3HE   MET  33          HE3       MET  33 -13.230  -6.806  -4.328
  255    H    VAL  34           HN       VAL  34 -10.643  -3.761  -2.152
  256    HA   VAL  34           HA       VAL  34 -11.012  -1.360  -0.385
  257    HB   VAL  34           HB       VAL  34  -8.620  -0.756  -1.082
  258   1HG1  VAL  34          HG11      VAL  34  -9.193  -3.136   0.708
  259   2HG1  VAL  34          HG12      VAL  34  -9.140  -1.442   1.187
  260   3HG1  VAL  34          HG13      VAL  34  -7.660  -2.265   0.693
  261   1HG2  VAL  34          HG21      VAL  34  -7.184  -2.501  -1.851
  262   2HG2  VAL  34          HG22      VAL  34  -8.618  -2.605  -2.872
  263   3HG2  VAL  34          HG23      VAL  34  -8.398  -3.741  -1.540
  264    H    TRP  35           HN       TRP  35 -10.621   0.702  -1.566
  265    HA   TRP  35           HA       TRP  35 -12.017   0.686  -4.102
  266   1HB   TRP  35          HB2       TRP  35 -10.511   2.876  -2.653
  267   2HB   TRP  35          HB1       TRP  35 -11.453   3.130  -4.122
  268    HD1  TRP  35           HD1      TRP  35 -11.786   2.520  -0.409
  269    HE1  TRP  35           HE1      TRP  35 -14.254   2.792   0.278
  270    HE3  TRP  35           HE3      TRP  35 -13.954   2.871  -5.027
  271    HZ2  TRP  35           HZ2      TRP  35 -16.811   3.112  -0.965
  272    HZ3  TRP  35           HZ3      TRP  35 -16.410   3.155  -5.238
  273    HH2  TRP  35           HH2      TRP  35 -17.837   3.277  -3.218
  274    H    SER  36           HN       SER  36 -11.172   0.646  -6.141
  275    HA   SER  36           HA       SER  36  -8.324   0.218  -6.501
  276   1HB   SER  36          HB2       SER  36  -9.967  -0.786  -8.048
  277   2HB   SER  36          HB1       SER  36 -10.492   0.822  -8.543
  278    HG   SER  36           HG       SER  36  -7.769   0.346  -8.657
  279    H    ILE  37           HN       ILE  37  -6.812   1.734  -7.279
  280    HA   ILE  37           HA       ILE  37  -7.765   4.564  -7.597
  281    HB   ILE  37           HB       ILE  37  -5.680   5.258  -6.382
  282   1HG1  ILE  37          HG12      ILE  37  -5.565   2.429  -5.319
  283   2HG1  ILE  37          HG11      ILE  37  -4.649   2.867  -6.755
  284   1HG2  ILE  37          HG21      ILE  37  -6.584   4.748  -4.128
  285   2HG2  ILE  37          HG22      ILE  37  -7.643   3.530  -4.840
  286   3HG2  ILE  37          HG23      ILE  37  -7.859   5.232  -5.245
  287   1HD1  ILE  37          HD11      ILE  37  -4.449   4.259  -4.069
  288   2HD1  ILE  37          HD12      ILE  37  -3.521   4.663  -5.514
  289   3HD1  ILE  37          HD13      ILE  37  -3.278   3.109  -4.718
  290    H    ASN  38           HN       ASN  38  -5.989   5.915  -8.620
  291    HA   ASN  38           HA       ASN  38  -4.837   4.402 -10.888
  292   1HB   ASN  38          HB2       ASN  38  -5.995   6.615 -11.227
  293   2HB   ASN  38          HB1       ASN  38  -4.703   7.374 -10.295
  294   1HD2  ASN  38          HD21      ASN  38  -4.274   8.561 -12.427
  295   2HD2  ASN  38          HD22      ASN  38  -3.310   7.788 -13.591
  296    H    LEU  39           HN       LEU  39  -2.783   3.627 -10.711
  297    HA   LEU  39           HA       LEU  39  -1.102   4.480  -8.477
  298   1HB   LEU  39          HB2       LEU  39  -0.655   2.547 -10.764
  299   2HB   LEU  39          HB1       LEU  39   0.533   2.842  -9.499
  300    HG   LEU  39           HG       LEU  39  -0.805   0.837  -8.995
  301   1HD1  LEU  39          HD11      LEU  39  -1.074   1.271  -6.747
  302   2HD1  LEU  39          HD12      LEU  39  -1.842   2.834  -7.016
  303   3HD1  LEU  39          HD13      LEU  39  -0.095   2.664  -7.197
  304   1HD2  LEU  39          HD21      LEU  39  -2.867   1.878 -10.233
  305   2HD2  LEU  39          HD22      LEU  39  -3.258   2.542  -8.645
  306   3HD2  LEU  39          HD23      LEU  39  -3.131   0.799  -8.864
  307    H    THR  40           HN       THR  40   0.184   6.237  -8.584
  308    HA   THR  40           HA       THR  40   1.571   6.869 -11.137
  309    HB   THR  40           HB       THR  40   0.939   9.306 -10.791
  310    HG1  THR  40           HG1      THR  40  -1.270   8.410  -9.356
  311   1HG2  THR  40          HG21      THR  40  -0.148   7.760 -12.463
  312   2HG2  THR  40          HG22      THR  40  -1.183   9.080 -11.919
  313   3HG2  THR  40          HG23      THR  40  -1.411   7.456 -11.270
  314    H    ALA  41           HN       ALA  41   1.450   9.337  -8.751
  315    HA   ALA  41           HA       ALA  41   4.182   8.552  -7.771
  316   1HB   ALA  41          HB1       ALA  41   3.012  11.340  -7.736
  317   2HB   ALA  41          HB2       ALA  41   3.893  10.712  -9.130
  318   3HB   ALA  41          HB3       ALA  41   4.702  10.862  -7.571
  319    H    GLY  42           HN       GLY  42   1.390  10.519  -6.698
  320   1HA   GLY  42          HA2       GLY  42   2.011  10.234  -3.901
  321   2HA   GLY  42          HA1       GLY  42   0.475  10.805  -4.555
  322    H    MET  43           HN       MET  43   1.950   7.687  -5.269
  323    HA   MET  43           HA       MET  43  -0.444   6.218  -4.830
  324   1HB   MET  43          HB2       MET  43   2.441   5.322  -4.879
  325   2HB   MET  43          HB1       MET  43   1.059   4.233  -4.947
  326   1HG   MET  43          HG2       MET  43   0.263   5.476  -6.963
  327   2HG   MET  43          HG1       MET  43   1.758   6.402  -6.940
  328   1HE   MET  43          HE1       MET  43   4.538   4.061  -7.592
  329   2HE   MET  43          HE2       MET  43   3.892   3.842  -5.969
  330   3HE   MET  43          HE3       MET  43   3.926   5.451  -6.685
  331    H    TYR  44           HN       TYR  44   2.359   6.801  -2.712
  332    HA   TYR  44           HA       TYR  44   1.679   4.954  -0.681
  333   1HB   TYR  44          HB2       TYR  44   3.050   7.646  -0.471
  334   2HB   TYR  44          HB1       TYR  44   2.994   6.455   0.825
  335    HD1  TYR  44           HD1      TYR  44   4.171   4.289   0.607
  336    HD2  TYR  44           HD2      TYR  44   4.423   7.302  -2.446
  337    HE1  TYR  44           HE1      TYR  44   6.114   3.114  -0.396
  338    HE2  TYR  44           HE2      TYR  44   6.365   6.128  -3.447
  339    HH   TYR  44           HH       TYR  44   7.124   3.082  -2.953
  340    H    CYS  45           HN       CYS  45   0.792   8.429  -0.891
  341    HA   CYS  45           HA       CYS  45  -0.852   8.333   1.483
  342   1HB   CYS  45          HB2       CYS  45  -0.782  10.277  -0.836
  343   2HB   CYS  45          HB1       CYS  45  -1.779  10.502   0.600
  344    H    ALA  46           HN       ALA  46  -1.620   8.196  -2.004
  345    HA   ALA  46           HA       ALA  46  -4.444   8.038  -1.722
  346   1HB   ALA  46          HB1       ALA  46  -4.407   6.979  -3.968
  347   2HB   ALA  46          HB2       ALA  46  -2.659   6.794  -3.833
  348   3HB   ALA  46          HB3       ALA  46  -3.373   8.406  -3.896
  349    H    ALA  47           HN       ALA  47  -2.028   5.420  -1.956
  350    HA   ALA  47           HA       ALA  47  -3.890   3.282  -1.680
  351   1HB   ALA  47          HB1       ALA  47  -0.944   3.547  -1.086
  352   2HB   ALA  47          HB2       ALA  47  -1.721   2.676  -2.406
  353   3HB   ALA  47          HB3       ALA  47  -1.806   2.045  -0.760
  354    H    LEU  48           HN       LEU  48  -2.158   5.217   0.741
  355    HA   LEU  48           HA       LEU  48  -2.841   3.669   3.012
  356   1HB   LEU  48          HB2       LEU  48  -1.165   5.429   3.120
  357   2HB   LEU  48          HB1       LEU  48  -2.386   6.654   2.783
  358    HG   LEU  48           HG       LEU  48  -3.535   6.118   4.897
  359   1HD1  LEU  48          HD11      LEU  48  -2.124   4.595   6.500
  360   2HD1  LEU  48          HD12      LEU  48  -1.433   3.955   5.011
  361   3HD1  LEU  48          HD13      LEU  48  -3.168   3.829   5.304
  362   1HD2  LEU  48          HD21      LEU  48  -1.845   7.830   5.029
  363   2HD2  LEU  48          HD22      LEU  48  -0.555   6.629   5.099
  364   3HD2  LEU  48          HD23      LEU  48  -1.664   6.810   6.457
  365    H    GLU  49           HN       GLU  49  -4.623   6.507   1.659
  366    HA   GLU  49           HA       GLU  49  -6.674   6.420   3.625
  367   1HB   GLU  49          HB2       GLU  49  -8.112   7.529   1.830
  368   2HB   GLU  49          HB1       GLU  49  -6.611   8.350   2.249
  369   1HG   GLU  49          HG2       GLU  49  -5.501   7.416   0.302
  370   2HG   GLU  49          HG1       GLU  49  -6.947   6.489  -0.114
  371    H    SER  50           HN       SER  50  -6.317   4.610   0.590
  372    HA   SER  50           HA       SER  50  -8.939   3.423   0.682
  373   1HB   SER  50          HB2       SER  50  -8.114   1.877  -0.969
  374   2HB   SER  50          HB1       SER  50  -7.361   3.432  -1.312
  375    HG   SER  50           HG       SER  50  -5.480   2.709  -0.490
  376    H    LEU  51           HN       LEU  51  -5.777   2.402   1.992
  377    HA   LEU  51           HA       LEU  51  -6.771  -0.111   3.032
  378   1HB   LEU  51          HB2       LEU  51  -4.344   1.522   3.842
  379   2HB   LEU  51          HB1       LEU  51  -4.661  -0.134   4.350
  380    HG   LEU  51           HG       LEU  51  -4.435   0.715   1.447
  381   1HD1  LEU  51          HD11      LEU  51  -2.173  -0.224   1.503
  382   2HD1  LEU  51          HD12      LEU  51  -2.353  -0.603   3.217
  383   3HD1  LEU  51          HD13      LEU  51  -2.313   1.077   2.686
  384   1HD2  LEU  51          HD21      LEU  51  -5.592  -1.330   1.462
  385   2HD2  LEU  51          HD22      LEU  51  -4.736  -1.923   2.885
  386   3HD2  LEU  51          HD23      LEU  51  -3.918  -1.860   1.326
  387    H    ILE  52           HN       ILE  52  -6.622   3.178   4.261
  388    HA   ILE  52           HA       ILE  52  -6.990   2.660   7.012
  389    HB   ILE  52           HB       ILE  52  -7.842   4.946   5.228
  390   1HG1  ILE  52          HG12      ILE  52  -5.411   4.478   6.014
  391   2HG1  ILE  52          HG11      ILE  52  -6.037   6.111   6.198
  392   1HG2  ILE  52          HG21      ILE  52  -8.359   6.183   7.407
  393   2HG2  ILE  52          HG22      ILE  52  -8.424   4.598   8.178
  394   3HG2  ILE  52          HG23      ILE  52  -9.558   4.998   6.889
  395   1HD1  ILE  52          HD11      ILE  52  -6.070   5.988   8.491
  396   2HD1  ILE  52          HD12      ILE  52  -4.801   4.802   8.204
  397   3HD1  ILE  52          HD13      ILE  52  -6.450   4.268   8.518
  398    H    ASN  53           HN       ASN  53  -9.176   2.204   4.364
  399    HA   ASN  53           HA       ASN  53 -11.572   2.199   6.061
  400   1HB   ASN  53          HB2       ASN  53 -11.084   1.352   3.190
  401   2HB   ASN  53          HB1       ASN  53 -12.658   1.257   3.980
  402   1HD2  ASN  53          HD21      ASN  53 -11.435   3.109   1.749
  403   2HD2  ASN  53          HD22      ASN  53 -11.898   4.662   2.256
  404    H    VAL  54           HN       VAL  54  -9.039   0.026   5.376
  405    HA   VAL  54           HA       VAL  54 -10.664  -2.404   5.873
  406    HB   VAL  54           HB       VAL  54  -7.662  -2.113   5.530
  407   1HG1  VAL  54          HG11      VAL  54  -9.554  -4.462   5.674
  408   2HG1  VAL  54          HG12      VAL  54  -8.077  -4.184   6.595
  409   3HG1  VAL  54          HG13      VAL  54  -7.983  -4.598   4.883
  410   1HG2  VAL  54          HG21      VAL  54  -9.244  -1.427   3.560
  411   2HG2  VAL  54          HG22      VAL  54  -9.573  -3.155   3.434
  412   3HG2  VAL  54          HG23      VAL  54  -7.929  -2.553   3.229
  413    H    SER  55           HN       SER  55 -11.064  -3.000   7.948
  414    HA   SER  55           HA       SER  55  -9.018  -2.368  10.056
  415   1HB   SER  55          HB2       SER  55 -12.032  -2.102  10.202
  416   2HB   SER  55          HB1       SER  55 -10.985  -2.077  11.617
  417    HG   SER  55           HG       SER  55 -10.405  -0.114  11.119
  418    H    GLY  56           HN       GLY  56  -8.881  -3.937  11.750
  419   1HA   GLY  56          HA2       GLY  56  -9.385  -6.021  12.818
  420   2HA   GLY  56          HA1       GLY  56 -10.517  -6.393  11.518
  421    H    CYS  57           HN       CYS  57  -7.278  -5.264  10.790
  422    HA   CYS  57           HA       CYS  57  -6.384  -8.051  10.189
  423   1HB   CYS  57          HB2       CYS  57  -6.324  -5.736   8.226
  424   2HB   CYS  57          HB1       CYS  57  -5.548  -7.298   7.972
  425    H    SER  58           HN       SER  58  -4.903  -7.853  11.914
  426    HA   SER  58           HA       SER  58  -3.115  -5.648  12.291
  427   1HB   SER  58          HB2       SER  58  -3.607  -7.390  14.020
  428   2HB   SER  58          HB1       SER  58  -2.681  -8.544  13.065
  429    HG   SER  58           HG       SER  58  -1.749  -6.907  14.852
  430    H    ALA  59           HN       ALA  59  -2.897  -8.608  10.404
  431    HA   ALA  59           HA       ALA  59  -0.177  -8.701   9.819
  432   1HB   ALA  59          HB1       ALA  59  -1.927 -10.348   9.086
  433   2HB   ALA  59          HB2       ALA  59  -0.768  -9.929   7.827
  434   3HB   ALA  59          HB3       ALA  59  -2.382  -9.219   7.808
  435    H    ILE  60           HN       ILE  60  -2.495  -6.331   8.619
  436    HA   ILE  60           HA       ILE  60  -0.405  -5.292   6.728
  437    HB   ILE  60           HB       ILE  60  -2.245  -4.081   5.640
  438   1HG1  ILE  60          HG12      ILE  60  -4.060  -5.565   7.565
  439   2HG1  ILE  60          HG11      ILE  60  -3.663  -3.855   7.713
  440   1HG2  ILE  60          HG21      ILE  60  -2.740  -7.042   6.056
  441   2HG2  ILE  60          HG22      ILE  60  -1.680  -6.318   4.846
  442   3HG2  ILE  60          HG23      ILE  60  -3.423  -6.081   4.745
  443   1HD1  ILE  60          HD11      ILE  60  -4.519  -3.544   5.355
  444   2HD1  ILE  60          HD12      ILE  60  -5.751  -3.983   6.537
  445   3HD1  ILE  60          HD13      ILE  60  -5.119  -5.200   5.429
  446    H    GLU  61           HN       GLU  61  -1.624  -4.677   9.814
  447    HA   GLU  61           HA       GLU  61  -1.838  -1.830   9.788
  448   1HB   GLU  61          HB2       GLU  61  -0.990  -3.776  11.947
  449   2HB   GLU  61          HB1       GLU  61  -1.117  -2.041  12.241
  450   1HG   GLU  61          HG2       GLU  61  -3.382  -3.685  11.091
  451   2HG   GLU  61          HG1       GLU  61  -3.195  -3.380  12.819
  452    H    LYS  62           HN       LYS  62   0.976  -3.979  10.149
  453    HA   LYS  62           HA       LYS  62   2.907  -1.919  10.623
  454   1HB   LYS  62          HB2       LYS  62   3.132  -4.646   9.326
  455   2HB   LYS  62          HB1       LYS  62   4.527  -3.611   9.645
  456   1HG   LYS  62          HG2       LYS  62   3.950  -3.560  12.037
  457   2HG   LYS  62          HG1       LYS  62   2.557  -4.598  11.724
  458   1HD   LYS  62          HD2       LYS  62   3.997  -6.398  10.971
  459   2HD   LYS  62          HD1       LYS  62   5.419  -5.361  11.085
  460   1HE   LYS  62          HE2       LYS  62   3.669  -5.879  13.491
  461   2HE   LYS  62          HE1       LYS  62   4.972  -6.984  13.050
  462   1HZ   LYS  62          HZ1       LYS  62   6.163  -4.574  12.870
  463   2HZ   LYS  62          HZ2       LYS  62   6.248  -5.599  14.222
  464   3HZ   LYS  62          HZ3       LYS  62   5.112  -4.337  14.180
  465    H    THR  63           HN       THR  63   1.593  -3.341   7.646
  466    HA   THR  63           HA       THR  63   3.305  -1.984   5.824
  467    HB   THR  63           HB       THR  63   0.409  -2.803   5.459
  468    HG1  THR  63           HG1      THR  63   1.359  -4.673   5.681
  469   1HG2  THR  63          HG21      THR  63   2.578  -1.964   3.532
  470   2HG2  THR  63          HG22      THR  63   0.952  -1.306   3.699
  471   3HG2  THR  63          HG23      THR  63   1.183  -2.913   3.022
  472    H    GLN  64           HN       GLN  64   0.256  -0.995   7.362
  473    HA   GLN  64           HA       GLN  64  -0.039   1.463   5.939
  474   1HB   GLN  64          HB2       GLN  64  -0.879   0.650   8.735
  475   2HB   GLN  64          HB1       GLN  64  -1.341   2.180   7.988
  476   1HG   GLN  64          HG2       GLN  64  -2.496   1.035   6.196
  477   2HG   GLN  64          HG1       GLN  64  -1.893  -0.528   6.746
  478   1HE2  GLN  64          HE21      GLN  64  -4.741   0.378   6.524
  479   2HE2  GLN  64          HE22      GLN  64  -5.394   0.213   8.081
  480    H    ARG  65           HN       ARG  65   1.732   0.641   8.920
  481    HA   ARG  65           HA       ARG  65   2.574   3.291   9.560
  482   1HB   ARG  65          HB2       ARG  65   2.803   1.406  11.127
  483   2HB   ARG  65          HB1       ARG  65   4.002   0.665  10.069
  484   1HG   ARG  65          HG2       ARG  65   5.548   2.476  10.417
  485   2HG   ARG  65          HG1       ARG  65   4.320   3.439  11.244
  486   1HD   ARG  65          HD2       ARG  65   4.252   1.889  13.098
  487   2HD   ARG  65          HD1       ARG  65   5.318   0.761  12.255
  488    HE   ARG  65           HE       ARG  65   6.853   3.024  12.378
  489   1HH1  ARG  65          HH21      ARG  65   4.952   1.254  14.649
  490   2HH1  ARG  65          HH22      ARG  65   5.977   1.623  15.997
  491   1HH2  ARG  65          HH11      ARG  65   8.199   3.517  14.132
  492   2HH2  ARG  65          HH12      ARG  65   7.810   2.900  15.705
  493    H    MET  66           HN       MET  66   4.221   0.745   7.636
  494    HA   MET  66           HA       MET  66   6.469   2.385   6.975
  495   1HB   MET  66          HB2       MET  66   5.238   0.013   5.541
  496   2HB   MET  66          HB1       MET  66   6.735   0.787   5.018
  497   1HG   MET  66          HG2       MET  66   7.706   0.383   7.271
  498   2HG   MET  66          HG1       MET  66   6.232  -0.456   7.741
  499   1HE   MET  66          HE1       MET  66   6.185  -3.726   6.102
  500   2HE   MET  66          HE2       MET  66   5.486  -2.434   5.130
  501   3HE   MET  66          HE3       MET  66   5.330  -2.392   6.885
  502    H    LEU  67           HN       LEU  67   3.318   1.924   5.383
  503    HA   LEU  67           HA       LEU  67   3.896   3.559   3.096
  504   1HB   LEU  67          HB2       LEU  67   1.285   2.901   4.481
  505   2HB   LEU  67          HB1       LEU  67   1.373   3.816   2.980
  506    HG   LEU  67           HG       LEU  67   2.558   1.049   3.342
  507   1HD1  LEU  67          HD11      LEU  67   0.161   0.869   3.584
  508   2HD1  LEU  67          HD12      LEU  67   0.578   0.325   1.959
  509   3HD1  LEU  67          HD13      LEU  67  -0.107   1.932   2.204
  510   1HD2  LEU  67          HD21      LEU  67   3.661   1.950   1.485
  511   2HD2  LEU  67          HD22      LEU  67   2.291   2.963   1.029
  512   3HD2  LEU  67          HD23      LEU  67   2.252   1.231   0.712
  513    H    SER  68           HN       SER  68   2.642   4.276   6.322
  514    HA   SER  68           HA       SER  68   1.986   7.007   5.916
  515   1HB   SER  68          HB2       SER  68   3.061   5.600   8.378
  516   2HB   SER  68          HB1       SER  68   2.424   7.242   8.381
  517    HG   SER  68           HG       SER  68   1.045   4.890   7.576
  518    H    GLY  69           HN       GLY  69   5.065   5.421   6.659
  519   1HA   GLY  69          HA2       GLY  69   6.663   7.681   7.182
  520   2HA   GLY  69          HA1       GLY  69   7.265   6.215   6.409
  521    H    PHE  70           HN       PHE  70   5.391   6.512   4.118
  522    HA   PHE  70           HA       PHE  70   6.983   8.531   2.613
  523   1HB   PHE  70          HB2       PHE  70   5.112   6.323   1.718
  524   2HB   PHE  70          HB1       PHE  70   5.894   7.452   0.614
  525    HD1  PHE  70           HD1      PHE  70   8.342   7.393   0.277
  526    HD2  PHE  70           HD2      PHE  70   6.365   4.600   2.870
  527    HE1  PHE  70           HE1      PHE  70  10.369   5.964   0.285
  528    HE2  PHE  70           HE2      PHE  70   8.393   3.173   2.882
  529    HZ   PHE  70           HZ       PHE  70  10.396   3.853   1.587
  530    H    CYS  71           HN       CYS  71   4.224   8.528   4.381
  531    HA   CYS  71           HA       CYS  71   2.954  10.651   2.681
  532   1HB   CYS  71          HB2       CYS  71   1.723   8.419   2.670
  533   2HB   CYS  71          HB1       CYS  71   1.418   8.684   4.386
  534    HA   PRO  72           HA       PRO  72   4.138  12.154   6.985
  535   1HB   PRO  72          HB2       PRO  72   4.093  14.738   5.524
  536   2HB   PRO  72          HB1       PRO  72   5.355  14.052   6.558
  537   1HG   PRO  72          HG2       PRO  72   5.554  14.198   3.823
  538   2HG   PRO  72          HG1       PRO  72   6.396  12.988   4.802
  539   1HD   PRO  72          HD2       PRO  72   4.070  12.635   2.990
  540   2HD   PRO  72          HD1       PRO  72   5.234  11.417   3.577
  541    H    HIS  73           HN       HIS  73   1.341  12.095   5.314
  542    HA   HIS  73           HA       HIS  73  -0.060  13.774   7.353
  543   1HB   HIS  73          HB2       HIS  73  -1.402  14.879   5.781
  544   2HB   HIS  73          HB1       HIS  73   0.155  14.845   4.963
  545    HD1  HIS  73           HD1      HIS  73  -3.287  13.364   4.859
  546    HD2  HIS  73           HD2      HIS  73   0.264  13.106   2.696
  547    HE1  HIS  73           HE1      HIS  73  -3.842  12.153   2.705
  548    H    LYS  74           HN       LYS  74  -1.152  12.303   8.526
  549    HA   LYS  74           HA       LYS  74  -1.940   9.735   7.401
  550   1HB   LYS  74          HB2       LYS  74  -2.468  11.033  10.082
  551   2HB   LYS  74          HB1       LYS  74  -2.952   9.384   9.674
  552   1HG   LYS  74          HG2       LYS  74  -0.587   8.834   9.155
  553   2HG   LYS  74          HG1       LYS  74  -0.113  10.462   9.629
  554   1HD   LYS  74          HD2       LYS  74  -1.458   8.424  11.432
  555   2HD   LYS  74          HD1       LYS  74   0.253   8.842  11.461
  556   1HE   LYS  74          HE2       LYS  74  -2.109  10.507  12.304
  557   2HE   LYS  74          HE1       LYS  74  -0.624  10.166  13.182
  558   1HZ   LYS  74          HZ1       LYS  74  -1.149  12.164  11.136
  559   2HZ   LYS  74          HZ2       LYS  74   0.369  11.405  11.066
  560   3HZ   LYS  74          HZ3       LYS  74  -0.110  12.227  12.475
  561    H    VAL  75           HN       VAL  75  -4.043   9.014   6.999
  562    HA   VAL  75           HA       VAL  75  -6.104  11.175   6.710
  563    HB   VAL  75           HB       VAL  75  -5.872   8.522   5.259
  564   1HG1  VAL  75          HG11      VAL  75  -7.595   9.751   3.772
  565   2HG1  VAL  75          HG12      VAL  75  -7.806  10.844   5.133
  566   3HG1  VAL  75          HG13      VAL  75  -8.168   9.127   5.313
  567   1HG2  VAL  75          HG21      VAL  75  -5.042   9.751   3.396
  568   2HG2  VAL  75          HG22      VAL  75  -4.132  10.374   4.773
  569   3HG2  VAL  75          HG23      VAL  75  -5.484  11.296   4.120
  570    H    SER  76           HN       SER  76  -7.934  10.994   7.928
  571    HA   SER  76           HA       SER  76  -8.235   8.613   9.658
  572   1HB   SER  76          HB2       SER  76 -10.049   9.951  10.715
  573   2HB   SER  76          HB1       SER  76  -8.509  10.804  10.693
  574    HG   SER  76           HG       SER  76  -9.623  11.423   8.443
  575    H    ALA  77           HN       ALA  77 -10.407   7.605   9.849
  576    HA   ALA  77           HA       ALA  77 -11.378   6.712   7.325
  577   1HB   ALA  77          HB1       ALA  77 -12.686   6.612  10.061
  578   2HB   ALA  77          HB2       ALA  77 -11.651   5.373   9.349
  579   3HB   ALA  77          HB3       ALA  77 -13.235   5.706   8.650
  580    H    GLY  78           HN       GLY  78 -11.940   9.656   8.922
  581   1HA   GLY  78          HA2       GLY  78 -14.635  10.023   7.709
  582   2HA   GLY  78          HA1       GLY  78 -13.852  11.127   8.839
  583    H    GLN  79           HN       GLN  79 -11.338  11.357   7.546
  584    HA   GLN  79           HA       GLN  79 -12.115  13.141   5.321
  585   1HB   GLN  79          HB2       GLN  79  -9.438  12.633   6.658
  586   2HB   GLN  79          HB1       GLN  79  -9.727  13.849   5.414
  587   1HG   GLN  79          HG2       GLN  79 -11.158  13.735   8.090
  588   2HG   GLN  79          HG1       GLN  79  -9.812  14.810   7.711
  589   1HE2  GLN  79          HE21      GLN  79 -13.119  14.815   7.915
  590   2HE2  GLN  79          HE22      GLN  79 -13.478  16.021   6.776
  591    H    PHE  80           HN       PHE  80 -11.877  12.605   3.216
  592    HA   PHE  80           HA       PHE  80 -10.081  10.315   2.477
  593   1HB   PHE  80          HB2       PHE  80 -12.902  10.888   1.518
  594   2HB   PHE  80          HB1       PHE  80 -11.816   9.744   0.725
  595    HD1  PHE  80           HD1      PHE  80 -14.140  10.240   3.432
  596    HD2  PHE  80           HD2      PHE  80 -10.821   7.845   2.132
  597    HE1  PHE  80           HE1      PHE  80 -14.752   8.499   5.085
  598    HE2  PHE  80           HE2      PHE  80 -11.429   6.103   3.791
  599    HZ   PHE  80           HZ       PHE  80 -13.394   6.429   5.267
  600    H    SER  81           HN       SER  81  -8.996  10.588   0.461
  601    HA   SER  81           HA       SER  81  -9.267  13.326  -0.765
  602   1HB   SER  81          HB2       SER  81  -6.821  11.636  -0.239
  603   2HB   SER  81          HB1       SER  81  -6.807  13.027  -1.317
  604    HG   SER  81           HG       SER  81  -6.514  13.037   1.273
  605    H    SER  82           HN       SER  82  -8.230   9.966  -1.487
  606    HA   SER  82           HA       SER  82  -8.524  10.536  -4.382
  607   1HB   SER  82          HB2       SER  82  -6.509   9.355  -3.630
  608   2HB   SER  82          HB1       SER  82  -7.505   8.078  -2.941
  609    HG   SER  82           HG       SER  82  -8.194   8.580  -5.500
  610    H    LEU  83           HN       LEU  83 -10.595   9.420  -1.991
  611    HA   LEU  83           HA       LEU  83 -11.897   7.371  -3.683
  612   1HB   LEU  83          HB2       LEU  83 -12.838   8.598  -1.070
  613   2HB   LEU  83          HB1       LEU  83 -13.484   7.151  -1.837
  614    HG   LEU  83           HG       LEU  83 -10.743   7.523  -0.599
  615   1HD1  LEU  83          HD11      LEU  83 -11.432   5.911   0.974
  616   2HD1  LEU  83          HD12      LEU  83 -12.735   5.321  -0.056
  617   3HD1  LEU  83          HD13      LEU  83 -12.885   6.885   0.746
  618   1HD2  LEU  83          HD21      LEU  83 -10.235   6.251  -2.536
  619   2HD2  LEU  83          HD22      LEU  83 -11.770   5.384  -2.476
  620   3HD2  LEU  83          HD23      LEU  83 -10.507   5.026  -1.300
  621    H    HIS  84           HN       HIS  84 -11.655  10.245  -4.537
  622    HA   HIS  84           HA       HIS  84 -14.339  11.360  -4.432
  623   1HB   HIS  84          HB2       HIS  84 -12.053  11.997  -6.320
  624   2HB   HIS  84          HB1       HIS  84 -13.485  12.992  -6.052
  625    HD1  HIS  84           HD1      HIS  84 -12.901  11.754  -2.852
  626    HD2  HIS  84           HD2      HIS  84 -10.892  14.580  -5.164
  627    HE1  HIS  84           HE1      HIS  84 -11.544  13.157  -1.250
  628    H    VAL  85           HN       VAL  85 -12.473   9.491  -6.810
  629    HA   VAL  85           HA       VAL  85 -14.596   9.583  -8.803
  630    HB   VAL  85           HB       VAL  85 -13.266   7.878  -9.986
  631   1HG1  VAL  85          HG11      VAL  85 -11.136   9.191 -10.153
  632   2HG1  VAL  85          HG12      VAL  85 -11.663  10.145  -8.765
  633   3HG1  VAL  85          HG13      VAL  85 -12.584  10.190 -10.268
  634   1HG2  VAL  85          HG21      VAL  85 -12.501   6.489  -8.191
  635   2HG2  VAL  85          HG22      VAL  85 -11.717   7.848  -7.383
  636   3HG2  VAL  85          HG23      VAL  85 -11.058   7.219  -8.893
  637    H    ARG  86           HN       ARG  86 -16.078   7.913  -9.293
  638    HA   ARG  86           HA       ARG  86 -16.691   6.127  -7.008
  639   1HB   ARG  86          HB2       ARG  86 -18.185   6.862  -9.541
  640   2HB   ARG  86          HB1       ARG  86 -18.788   5.703  -8.352
  641   1HG   ARG  86          HG2       ARG  86 -18.797   7.391  -6.616
  642   2HG   ARG  86          HG1       ARG  86 -17.998   8.549  -7.675
  643   1HD   ARG  86          HD2       ARG  86 -20.367   9.073  -7.604
  644   2HD   ARG  86          HD1       ARG  86 -19.982   8.435  -9.205
  645    HE   ARG  86           HE       ARG  86 -20.771   6.191  -7.813
  646   1HH1  ARG  86          HH21      ARG  86 -22.049   9.349  -8.351
  647   2HH1  ARG  86          HH22      ARG  86 -23.703   8.840  -8.267
  648   1HH2  ARG  86          HH11      ARG  86 -22.925   5.506  -7.701
  649   2HH2  ARG  86          HH12      ARG  86 -24.199   6.661  -7.902
  650    H    ASP  87           HN       ASP  87 -14.529   5.038  -7.798
  651    HA   ASP  87           HA       ASP  87 -14.856   3.240 -10.102
  652   1HB   ASP  87          HB2       ASP  87 -12.666   3.559  -8.025
  653   2HB   ASP  87          HB1       ASP  87 -12.605   2.379  -9.335
  654    H    THR  88           HN       THR  88 -14.368   0.814  -9.644
  655    HA   THR  88           HA       THR  88 -16.242  -0.051  -7.525
  656    HB   THR  88           HB       THR  88 -16.239  -2.166  -8.609
  657    HG1  THR  88           HG1      THR  88 -13.995  -1.369 -10.126
  658   1HG2  THR  88          HG21      THR  88 -16.606  -1.627 -10.970
  659   2HG2  THR  88          HG22      THR  88 -15.752  -0.097 -10.772
  660   3HG2  THR  88          HG23      THR  88 -17.289  -0.362  -9.949
  661    H    LYS  89           HN       LYS  89 -15.597  -1.785  -6.005
  662    HA   LYS  89           HA       LYS  89 -12.891  -1.299  -4.947
  663   1HB   LYS  89          HB2       LYS  89 -15.152  -3.049  -3.933
  664   2HB   LYS  89          HB1       LYS  89 -13.643  -2.740  -3.072
  665   1HG   LYS  89          HG2       LYS  89 -14.149  -0.327  -3.038
  666   2HG   LYS  89          HG1       LYS  89 -15.659  -0.631  -3.898
  667   1HD   LYS  89          HD2       LYS  89 -16.434  -2.060  -2.039
  668   2HD   LYS  89          HD1       LYS  89 -14.925  -1.756  -1.179
  669   1HE   LYS  89          HE2       LYS  89 -15.422   0.547  -0.911
  670   2HE   LYS  89          HE1       LYS  89 -16.742   0.483  -2.079
  671   1HZ   LYS  89          HZ1       LYS  89 -17.474  -1.374  -0.283
  672   2HZ   LYS  89          HZ2       LYS  89 -18.003   0.241  -0.265
  673   3HZ   LYS  89          HZ3       LYS  89 -16.702  -0.241   0.716
  674    H    ILE  90           HN       ILE  90 -11.436  -3.103  -4.437
  675    HA   ILE  90           HA       ILE  90 -11.855  -5.551  -6.106
  676    HB   ILE  90           HB       ILE  90  -9.474  -5.440  -6.785
  677   1HG1  ILE  90          HG12      ILE  90  -9.550  -2.671  -5.542
  678   2HG1  ILE  90          HG11      ILE  90  -8.699  -4.052  -4.852
  679   1HG2  ILE  90          HG21      ILE  90  -9.748  -3.673  -8.442
  680   2HG2  ILE  90          HG22      ILE  90 -11.003  -2.912  -7.465
  681   3HG2  ILE  90          HG23      ILE  90 -11.297  -4.485  -8.205
  682   1HD1  ILE  90          HD11      ILE  90  -7.399  -4.237  -6.987
  683   2HD1  ILE  90          HD12      ILE  90  -7.107  -2.735  -6.109
  684   3HD1  ILE  90          HD13      ILE  90  -8.159  -2.741  -7.525
  685    H    GLU  91           HN       GLU  91 -10.385  -7.328  -5.428
  686    HA   GLU  91           HA       GLU  91 -10.498  -7.738  -2.602
  687   1HB   GLU  91          HB2       GLU  91  -8.975  -9.170  -4.792
  688   2HB   GLU  91          HB1       GLU  91  -9.018  -9.728  -3.119
  689   1HG   GLU  91          HG2       GLU  91 -11.476  -9.853  -3.218
  690   2HG   GLU  91          HG1       GLU  91 -11.441  -9.294  -4.890
  691    H    VAL  92           HN       VAL  92  -8.953  -7.495  -1.007
  692    HA   VAL  92           HA       VAL  92  -6.901  -5.554  -1.306
  693    HB   VAL  92           HB       VAL  92  -7.291  -7.757   0.741
  694   1HG1  VAL  92          HG11      VAL  92  -5.732  -6.224   2.128
  695   2HG1  VAL  92          HG12      VAL  92  -5.235  -5.549   0.576
  696   3HG1  VAL  92          HG13      VAL  92  -4.981  -7.260   0.913
  697   1HG2  VAL  92          HG21      VAL  92  -7.637  -4.786   1.139
  698   2HG2  VAL  92          HG22      VAL  92  -8.350  -6.112   2.054
  699   3HG2  VAL  92          HG23      VAL  92  -8.936  -5.747   0.432
  700    H    ALA  93           HN       ALA  93  -6.753  -9.111  -1.423
  701    HA   ALA  93           HA       ALA  93  -3.961  -9.433  -1.576
  702   1HB   ALA  93          HB1       ALA  93  -6.201 -10.975  -2.899
  703   2HB   ALA  93          HB2       ALA  93  -5.337 -11.385  -1.417
  704   3HB   ALA  93          HB3       ALA  93  -4.514 -11.486  -2.973
  705    H    GLN  94           HN       GLN  94  -6.274  -8.611  -4.133
  706    HA   GLN  94           HA       GLN  94  -4.300  -8.645  -6.260
  707   1HB   GLN  94          HB2       GLN  94  -7.031  -7.342  -6.029
  708   2HB   GLN  94          HB1       GLN  94  -6.064  -7.327  -7.501
  709   1HG   GLN  94          HG2       GLN  94  -6.091  -9.762  -7.588
  710   2HG   GLN  94          HG1       GLN  94  -6.961  -9.830  -6.054
  711   1HE2  GLN  94          HE21      GLN  94  -7.956 -10.843  -8.661
  712   2HE2  GLN  94          HE22      GLN  94  -9.371  -9.968  -9.000
  713    H    PHE  95           HN       PHE  95  -5.672  -6.206  -4.123
  714    HA   PHE  95           HA       PHE  95  -4.553  -3.883  -5.302
  715   1HB   PHE  95          HB2       PHE  95  -6.263  -3.826  -3.546
  716   2HB   PHE  95          HB1       PHE  95  -5.118  -4.507  -2.393
  717    HD1  PHE  95           HD1      PHE  95  -6.127  -1.508  -4.240
  718    HD2  PHE  95           HD2      PHE  95  -3.186  -3.200  -1.606
  719    HE1  PHE  95           HE1      PHE  95  -5.283   0.763  -3.716
  720    HE2  PHE  95           HE2      PHE  95  -2.341  -0.931  -1.087
  721    HZ   PHE  95           HZ       PHE  95  -3.396   1.051  -2.144
  722    H    VAL  96           HN       VAL  96  -3.257  -5.946  -2.679
  723    HA   VAL  96           HA       VAL  96  -0.841  -4.494  -2.305
  724    HB   VAL  96           HB       VAL  96  -1.389  -7.453  -1.938
  725   1HG1  VAL  96          HG11      VAL  96   0.934  -5.684  -1.164
  726   2HG1  VAL  96          HG12      VAL  96   0.968  -7.246  -1.981
  727   3HG1  VAL  96          HG13      VAL  96   0.564  -7.158  -0.268
  728   1HG2  VAL  96          HG21      VAL  96  -1.635  -5.019  -0.163
  729   2HG2  VAL  96          HG22      VAL  96  -1.463  -6.639   0.514
  730   3HG2  VAL  96          HG23      VAL  96  -2.849  -6.253  -0.505
  731    H    LYS  97           HN       LYS  97  -1.494  -7.354  -4.362
  732    HA   LYS  97           HA       LYS  97   1.149  -7.516  -5.428
  733   1HB   LYS  97          HB2       LYS  97  -1.515  -8.414  -6.521
  734   2HB   LYS  97          HB1       LYS  97   0.020  -8.783  -7.309
  735   1HG   LYS  97          HG2       LYS  97   0.807  -9.803  -5.148
  736   2HG   LYS  97          HG1       LYS  97  -0.813  -9.567  -4.499
  737   1HD   LYS  97          HD2       LYS  97  -0.331 -11.085  -7.067
  738   2HD   LYS  97          HD1       LYS  97  -0.278 -11.878  -5.495
  739   1HE   LYS  97          HE2       LYS  97  -2.592 -10.962  -5.048
  740   2HE   LYS  97          HE1       LYS  97  -2.631 -10.419  -6.725
  741   1HZ   LYS  97          HZ1       LYS  97  -1.804 -13.005  -6.886
  742   2HZ   LYS  97          HZ2       LYS  97  -3.374 -12.438  -7.197
  743   3HZ   LYS  97          HZ3       LYS  97  -2.976 -13.047  -5.662
  744    H    ASP  98           HN       ASP  98  -1.735  -5.790  -6.696
  745    HA   ASP  98           HA       ASP  98  -0.473  -4.901  -9.099
  746   1HB   ASP  98          HB2       ASP  98  -2.617  -3.617  -7.382
  747   2HB   ASP  98          HB1       ASP  98  -2.127  -2.984  -8.954
  748    H    LEU  99           HN       LEU  99  -0.537  -3.602  -5.810
  749    HA   LEU  99           HA       LEU  99   0.923  -1.205  -6.346
  750   1HB   LEU  99          HB2       LEU  99  -0.317  -1.577  -4.241
  751   2HB   LEU  99          HB1       LEU  99   0.798  -2.867  -3.805
  752    HG   LEU  99           HG       LEU  99   2.667  -1.248  -3.786
  753   1HD1  LEU  99          HD11      LEU  99   2.173   0.460  -5.294
  754   2HD1  LEU  99          HD12      LEU  99   1.799   1.260  -3.771
  755   3HD1  LEU  99          HD13      LEU  99   0.499   0.596  -4.761
  756   1HD2  LEU  99          HD21      LEU  99   1.755   0.181  -1.844
  757   2HD2  LEU  99          HD22      LEU  99   1.647  -1.571  -1.659
  758   3HD2  LEU  99          HD23      LEU  99   0.220  -0.642  -2.117
  759    H    LEU 100           HN       LEU 100   1.971  -4.502  -5.505
  760    HA   LEU 100           HA       LEU 100   4.711  -4.022  -5.070
  761   1HB   LEU 100          HB2       LEU 100   3.808  -6.211  -4.658
  762   2HB   LEU 100          HB1       LEU 100   3.307  -6.387  -6.335
  763    HG   LEU 100           HG       LEU 100   5.628  -6.468  -7.072
  764   1HD1  LEU 100          HD11      LEU 100   7.411  -6.584  -5.207
  765   2HD1  LEU 100          HD12      LEU 100   6.193  -5.840  -4.170
  766   3HD1  LEU 100          HD13      LEU 100   6.772  -4.991  -5.598
  767   1HD2  LEU 100          HD21      LEU 100   4.604  -8.570  -6.314
  768   2HD2  LEU 100          HD22      LEU 100   5.153  -8.249  -4.669
  769   3HD2  LEU 100          HD23      LEU 100   6.329  -8.548  -5.948
  770    H    LEU 101           HN       LEU 101   3.046  -4.518  -8.205
  771    HA   LEU 101           HA       LEU 101   5.419  -4.502  -9.788
  772   1HB   LEU 101          HB2       LEU 101   2.549  -3.778 -10.338
  773   2HB   LEU 101          HB1       LEU 101   3.770  -3.523 -11.579
  774    HG   LEU 101           HG       LEU 101   2.536  -5.762 -11.664
  775   1HD1  LEU 101          HD11      LEU 101   5.475  -6.281 -11.273
  776   2HD1  LEU 101          HD12      LEU 101   4.956  -5.203 -12.565
  777   3HD1  LEU 101          HD13      LEU 101   4.392  -6.869 -12.531
  778   1HD2  LEU 101          HD21      LEU 101   3.056  -7.460 -10.073
  779   2HD2  LEU 101          HD22      LEU 101   2.666  -6.029  -9.129
  780   3HD2  LEU 101          HD23      LEU 101   4.344  -6.499  -9.349
  781    H    HIS 102           HN       HIS 102   3.422  -1.804  -8.595
  782    HA   HIS 102           HA       HIS 102   4.964   0.194 -10.004
  783   1HB   HIS 102          HB2       HIS 102   3.013   0.337  -7.705
  784   2HB   HIS 102          HB1       HIS 102   3.869   1.769  -8.284
  785    HD1  HIS 102           HD1      HIS 102   3.345   2.599 -10.685
  786    HD2  HIS 102           HD2      HIS 102   1.065  -0.679  -9.509
  787    HE1  HIS 102           HE1      HIS 102   1.524   2.345 -12.421
  788    H    LEU 103           HN       LEU 103   5.196  -1.127  -6.683
  789    HA   LEU 103           HA       LEU 103   7.081   0.770  -5.733
  790   1HB   LEU 103          HB2       LEU 103   6.932  -2.179  -5.042
  791   2HB   LEU 103          HB1       LEU 103   7.782  -0.950  -4.107
  792    HG   LEU 103           HG       LEU 103   4.806  -0.954  -4.677
  793   1HD1  LEU 103          HD11      LEU 103   5.533  -2.765  -3.145
  794   2HD1  LEU 103          HD12      LEU 103   4.563  -1.549  -2.312
  795   3HD1  LEU 103          HD13      LEU 103   6.316  -1.563  -2.120
  796   1HD2  LEU 103          HD21      LEU 103   5.331   1.307  -4.330
  797   2HD2  LEU 103          HD22      LEU 103   6.648   0.932  -3.221
  798   3HD2  LEU 103          HD23      LEU 103   4.979   0.769  -2.690
  799    H    LYS 104           HN       LYS 104   7.740  -2.370  -7.345
  800    HA   LYS 104           HA       LYS 104  10.589  -1.978  -7.338
  801   1HB   LYS 104          HB2       LYS 104  10.667  -3.812  -8.964
  802   2HB   LYS 104          HB1       LYS 104   9.521  -4.198  -7.682
  803   1HG   LYS 104          HG2       LYS 104   7.677  -3.363  -9.141
  804   2HG   LYS 104          HG1       LYS 104   8.844  -3.130 -10.438
  805   1HD   LYS 104          HD2       LYS 104   7.734  -5.278 -10.747
  806   2HD   LYS 104          HD1       LYS 104   9.418  -5.558 -10.310
  807   1HE   LYS 104          HE2       LYS 104   8.875  -6.380  -8.209
  808   2HE   LYS 104          HE1       LYS 104   7.400  -5.422  -8.097
  809   1HZ   LYS 104          HZ1       LYS 104   6.483  -6.865  -9.892
  810   2HZ   LYS 104          HZ2       LYS 104   6.765  -7.663  -8.421
  811   3HZ   LYS 104          HZ3       LYS 104   7.842  -7.864  -9.722
  812    H    LYS 105           HN       LYS 105   8.023  -0.877  -9.466
  813    HA   LYS 105           HA       LYS 105   9.671  -0.221 -11.725
  814   1HB   LYS 105          HB2       LYS 105   7.163  -0.403 -11.738
  815   2HB   LYS 105          HB1       LYS 105   7.100   1.140 -10.886
  816   1HG   LYS 105          HG2       LYS 105   8.376   2.194 -12.740
  817   2HG   LYS 105          HG1       LYS 105   8.366   0.653 -13.599
  818   1HD   LYS 105          HD2       LYS 105   5.858   0.694 -13.516
  819   2HD   LYS 105          HD1       LYS 105   5.955   2.316 -12.833
  820   1HE   LYS 105          HE2       LYS 105   5.640   2.549 -15.218
  821   2HE   LYS 105          HE1       LYS 105   7.305   3.001 -14.847
  822   1HZ   LYS 105          HZ1       LYS 105   8.110   1.260 -15.969
  823   2HZ   LYS 105          HZ2       LYS 105   6.582   1.200 -16.708
  824   3HZ   LYS 105          HZ3       LYS 105   6.928   0.193 -15.385
  825    H    LEU 106           HN       LEU 106   8.519   1.825  -8.998
  826    HA   LEU 106           HA       LEU 106   9.813   4.213  -9.895
  827   1HB   LEU 106          HB2       LEU 106   8.906   3.249  -7.187
  828   2HB   LEU 106          HB1       LEU 106   9.840   4.731  -7.317
  829    HG   LEU 106           HG       LEU 106   7.263   4.937  -7.338
  830   1HD1  LEU 106          HD11      LEU 106   7.345   6.862  -8.721
  831   2HD1  LEU 106          HD12      LEU 106   8.615   6.186  -9.733
  832   3HD1  LEU 106          HD13      LEU 106   8.979   6.694  -8.086
  833   1HD2  LEU 106          HD21      LEU 106   7.074   3.051  -9.091
  834   2HD2  LEU 106          HD22      LEU 106   7.550   4.264 -10.270
  835   3HD2  LEU 106          HD23      LEU 106   6.078   4.478  -9.330
  836    H    PHE 107           HN       PHE 107  10.991   1.432  -8.109
  837    HA   PHE 107           HA       PHE 107  13.435   2.536  -7.180
  838   1HB   PHE 107          HB2       PHE 107  12.634   0.338  -6.443
  839   2HB   PHE 107          HB1       PHE 107  12.861  -0.303  -8.072
  840    HD1  PHE 107           HD1      PHE 107  14.615   1.164  -5.150
  841    HD2  PHE 107           HD2      PHE 107  15.018  -0.916  -8.882
  842    HE1  PHE 107           HE1      PHE 107  17.009   0.760  -4.666
  843    HE2  PHE 107           HE2      PHE 107  17.412  -1.332  -8.395
  844    HZ   PHE 107           HZ       PHE 107  18.408  -0.492  -6.288
  845    H    ARG 108           HN       ARG 108  12.632   1.058 -10.327
  846    HA   ARG 108           HA       ARG 108  15.283   1.018 -11.369
  847   1HB   ARG 108          HB2       ARG 108  12.621   1.369 -12.776
  848   2HB   ARG 108          HB1       ARG 108  14.152   1.158 -13.623
  849   1HG   ARG 108          HG2       ARG 108  14.491  -1.002 -12.464
  850   2HG   ARG 108          HG1       ARG 108  12.937  -0.798 -11.652
  851   1HD   ARG 108          HD2       ARG 108  11.846  -0.639 -13.905
  852   2HD   ARG 108          HD1       ARG 108  13.400  -1.015 -14.641
  853    HE   ARG 108           HE       ARG 108  12.969  -3.095 -12.840
  854   1HH1  ARG 108          HH21      ARG 108  11.275  -1.602 -15.450
  855   2HH1  ARG 108          HH22      ARG 108  10.442  -3.048 -15.916
  856   1HH2  ARG 108          HH11      ARG 108  11.896  -5.003 -13.447
  857   2HH2  ARG 108          HH12      ARG 108  10.801  -4.975 -14.788
  858    H    GLU 109           HN       GLU 109  12.885   3.623 -11.176
  859    HA   GLU 109           HA       GLU 109  14.536   5.432 -12.793
  860   1HB   GLU 109          HB2       GLU 109  12.022   5.859 -11.152
  861   2HB   GLU 109          HB1       GLU 109  12.811   7.138 -12.074
  862   1HG   GLU 109          HG2       GLU 109  12.550   5.816 -14.140
  863   2HG   GLU 109          HG1       GLU 109  11.764   4.535 -13.219
  864    H    GLY 110           HN       GLY 110  14.415   4.475  -9.494
  865   1HA   GLY 110          HA2       GLY 110  15.720   5.175  -7.679
  866   2HA   GLY 110          HA1       GLY 110  16.641   6.165  -8.812
  867    H    ARG 111           HN       ARG 111  13.426   6.947  -9.208
  868    HA   ARG 111           HA       ARG 111  13.778   9.429  -7.613
  869   1HB   ARG 111          HB2       ARG 111  11.653   8.583  -9.608
  870   2HB   ARG 111          HB1       ARG 111  11.657  10.129  -8.759
  871   1HG   ARG 111          HG2       ARG 111  13.893  10.624  -9.730
  872   2HG   ARG 111          HG1       ARG 111  13.806   9.115 -10.643
  873   1HD   ARG 111          HD2       ARG 111  11.836  11.415 -10.843
  874   2HD   ARG 111          HD1       ARG 111  13.076  11.023 -12.034
  875    HE   ARG 111           HE       ARG 111  11.618   8.680 -11.809
  876   1HH1  ARG 111          HH21      ARG 111  10.952  12.010 -12.411
  877   2HH1  ARG 111          HH22      ARG 111   9.548  11.694 -13.375
  878   1HH2  ARG 111          HH11      ARG 111   9.784   8.249 -13.068
  879   2HH2  ARG 111          HH12      ARG 111   8.887   9.567 -13.744
  880    H    PHE 112           HN       PHE 112  13.395   8.799  -5.499
  881    HA   PHE 112           HA       PHE 112  10.958   7.241  -4.862
  882   1HB   PHE 112          HB2       PHE 112  13.094   8.344  -3.016
  883   2HB   PHE 112          HB1       PHE 112  11.890   7.110  -2.629
  884    HD1  PHE 112           HD1      PHE 112  11.912   4.921  -3.884
  885    HD2  PHE 112           HD2      PHE 112  15.113   7.772  -4.166
  886    HE1  PHE 112           HE1      PHE 112  13.391   3.174  -4.828
  887    HE2  PHE 112           HE2      PHE 112  16.591   6.012  -5.109
  888    HZ   PHE 112           HZ       PHE 112  15.728   3.713  -5.430
  889    H    ASN 113           HN       ASN 113   9.170   8.127  -3.854
  890    HA   ASN 113           HA       ASN 113   7.655   9.852  -3.342
  891   1HB   ASN 113          HB2       ASN 113   9.156   9.694  -1.294
  892   2HB   ASN 113          HB1       ASN 113  10.051  11.068  -1.947
  893   1HD2  ASN 113          HD21      ASN 113   9.172  12.072   0.191
  894   2HD2  ASN 113          HD22      ASN 113   7.646  12.812   0.115
  Start of MODEL    9
    1   1H    MET   1           HT1      MET   1  24.889   5.754  13.583
    2   2H    MET   1           HT2      MET   1  23.621   6.277  14.584
    3   3H    MET   1           HT3      MET   1  24.073   7.197  13.229
    4    HA   MET   1           HA       MET   1  23.496   5.085  11.894
    5   1HB   MET   1          HB2       MET   1  22.035   4.687  14.521
    6   2HB   MET   1          HB1       MET   1  21.594   3.866  13.028
    7   1HG   MET   1          HG2       MET   1  24.350   3.735  14.283
    8   2HG   MET   1          HG1       MET   1  23.105   2.510  14.512
    9   1HE   MET   1          HE1       MET   1  22.036   1.210  12.904
   10   2HE   MET   1          HE2       MET   1  22.670   0.694  11.344
   11   3HE   MET   1          HE3       MET   1  21.740   2.184  11.457
   12    H    GLY   2           HN       GLY   2  22.982   7.220  10.895
   13   1HA   GLY   2          HA2       GLY   2  20.618   8.671  11.692
   14   2HA   GLY   2          HA1       GLY   2  21.453   8.846  10.146
   15    HA   PRO   3           HA       PRO   3  17.285   6.321   9.991
   16   1HB   PRO   3          HB2       PRO   3  16.329   8.354   8.141
   17   2HB   PRO   3          HB1       PRO   3  15.644   7.879   9.699
   18   1HG   PRO   3          HG2       PRO   3  17.179  10.261   9.057
   19   2HG   PRO   3          HG1       PRO   3  16.366   9.855  10.573
   20   1HD   PRO   3          HD2       PRO   3  19.174   9.938  10.149
   21   2HD   PRO   3          HD1       PRO   3  18.347   9.237  11.563
   22    H    VAL   4           HN       VAL   4  16.598   5.190   7.994
   23    HA   VAL   4           HA       VAL   4  18.813   4.845   6.145
   24    HB   VAL   4           HB       VAL   4  17.388   3.087   5.163
   25   1HG1  VAL   4          HG11      VAL   4  18.691   2.588   7.205
   26   2HG1  VAL   4          HG12      VAL   4  17.170   1.696   7.185
   27   3HG1  VAL   4          HG13      VAL   4  17.334   3.132   8.193
   28   1HG2  VAL   4          HG21      VAL   4  15.223   4.137   5.285
   29   2HG2  VAL   4          HG22      VAL   4  15.331   4.274   7.040
   30   3HG2  VAL   4          HG23      VAL   4  15.157   2.688   6.287
   31    HA   PRO   5           HA       PRO   5  17.252   7.730   3.101
   32   1HB   PRO   5          HB2       PRO   5  18.283   6.580   0.784
   33   2HB   PRO   5          HB1       PRO   5  19.210   7.577   1.914
   34   1HG   PRO   5          HG2       PRO   5  19.217   4.620   1.567
   35   2HG   PRO   5          HG1       PRO   5  20.524   5.693   2.085
   36   1HD   PRO   5          HD2       PRO   5  19.028   4.063   3.805
   37   2HD   PRO   5          HD1       PRO   5  19.950   5.504   4.312
   38    HA   PRO   6           HA       PRO   6  13.419   6.294   1.369
   39   1HB   PRO   6          HB2       PRO   6  13.813   7.349  -1.296
   40   2HB   PRO   6          HB1       PRO   6  12.854   8.037   0.019
   41   1HG   PRO   6          HG2       PRO   6  15.466   8.886  -0.969
   42   2HG   PRO   6          HG1       PRO   6  14.398   9.704   0.177
   43   1HD   PRO   6          HD2       PRO   6  16.854   8.444   0.811
   44   2HD   PRO   6          HD1       PRO   6  15.607   8.947   1.981
   45    H    SER   7           HN       SER   7  16.126   5.879  -0.932
   46    HA   SER   7           HA       SER   7  14.943   3.793  -2.468
   47   1HB   SER   7          HB2       SER   7  17.160   3.312  -3.272
   48   2HB   SER   7          HB1       SER   7  17.051   5.057  -3.050
   49    HG   SER   7           HG       SER   7  17.804   4.080  -0.747
   50    H    THR   8           HN       THR   8  16.862   3.695   0.505
   51    HA   THR   8           HA       THR   8  17.006   0.818   0.626
   52    HB   THR   8           HB       THR   8  17.163   2.880   2.841
   53    HG1  THR   8           HG1      THR   8  19.331   2.790   2.479
   54   1HG2  THR   8          HG21      THR   8  17.699  -0.085   2.738
   55   2HG2  THR   8          HG22      THR   8  16.804   0.838   3.947
   56   3HG2  THR   8          HG23      THR   8  18.562   0.948   3.879
   57    H    ALA   9           HN       ALA   9  14.755   3.233   1.919
   58    HA   ALA   9           HA       ALA   9  13.175   1.450   3.486
   59   1HB   ALA   9          HB1       ALA   9  11.411   3.166   3.316
   60   2HB   ALA   9          HB2       ALA   9  12.297   3.952   2.008
   61   3HB   ALA   9          HB3       ALA   9  12.976   3.913   3.635
   62    H    LEU  10           HN       LEU  10  12.905   2.434   0.060
   63    HA   LEU  10           HA       LEU  10  10.490   1.037  -0.475
   64   1HB   LEU  10          HB2       LEU  10  11.488   2.655  -2.065
   65   2HB   LEU  10          HB1       LEU  10  12.816   1.537  -2.362
   66    HG   LEU  10           HG       LEU  10  11.092  -0.172  -3.125
   67   1HD1  LEU  10          HD11      LEU  10   8.907   0.985  -3.909
   68   2HD1  LEU  10          HD12      LEU  10   9.303   2.223  -2.717
   69   3HD1  LEU  10          HD13      LEU  10   9.045   0.555  -2.207
   70   1HD2  LEU  10          HD21      LEU  10  10.819   0.856  -5.327
   71   2HD2  LEU  10          HD22      LEU  10  12.422   1.203  -4.691
   72   3HD2  LEU  10          HD23      LEU  10  11.169   2.445  -4.648
   73    H    ARG  11           HN       ARG  11  13.892  -0.033  -0.753
   74    HA   ARG  11           HA       ARG  11  13.334  -2.654  -1.729
   75   1HB   ARG  11          HB2       ARG  11  15.587  -1.629   0.027
   76   2HB   ARG  11          HB1       ARG  11  15.547  -3.254  -0.653
   77   1HG   ARG  11          HG2       ARG  11  15.447  -2.306  -2.926
   78   2HG   ARG  11          HG1       ARG  11  15.490  -0.677  -2.247
   79   1HD   ARG  11          HD2       ARG  11  17.668  -1.301  -1.125
   80   2HD   ARG  11          HD1       ARG  11  17.651  -2.793  -2.068
   81    HE   ARG  11           HE       ARG  11  17.362  -0.851  -3.994
   82   1HH1  ARG  11          HH21      ARG  11  19.491  -1.368  -1.334
   83   2HH1  ARG  11          HH22      ARG  11  20.853  -0.626  -2.104
   84   1HH2  ARG  11          HH11      ARG  11  19.126   0.138  -5.011
   85   2HH2  ARG  11          HH12      ARG  11  20.645   0.233  -4.185
   86    H    GLU  12           HN       GLU  12  13.587  -1.352   1.562
   87    HA   GLU  12           HA       GLU  12  13.155  -3.831   2.932
   88   1HB   GLU  12          HB2       GLU  12  12.620  -0.950   3.712
   89   2HB   GLU  12          HB1       GLU  12  12.411  -2.303   4.826
   90   1HG   GLU  12          HG2       GLU  12  14.771  -2.932   4.524
   91   2HG   GLU  12          HG1       GLU  12  14.990  -1.609   3.383
   92    H    LEU  13           HN       LEU  13  10.935  -1.345   1.694
   93    HA   LEU  13           HA       LEU  13   8.561  -2.578   2.775
   94   1HB   LEU  13          HB2       LEU  13   8.627  -0.200   2.117
   95   2HB   LEU  13          HB1       LEU  13   8.886  -0.669   0.439
   96    HG   LEU  13           HG       LEU  13   6.686  -1.832   0.436
   97   1HD1  LEU  13          HD11      LEU  13   6.269  -2.479   2.660
   98   2HD1  LEU  13          HD12      LEU  13   5.164  -1.127   2.442
   99   3HD1  LEU  13          HD13      LEU  13   6.686  -0.888   3.301
  100   1HD2  LEU  13          HD21      LEU  13   6.686   0.429  -0.370
  101   2HD2  LEU  13          HD22      LEU  13   6.747   1.079   1.269
  102   3HD2  LEU  13          HD23      LEU  13   5.287   0.275   0.693
  103    H    ILE  14           HN       ILE  14  10.055  -2.652  -0.488
  104    HA   ILE  14           HA       ILE  14   8.087  -4.324  -1.690
  105    HB   ILE  14           HB       ILE  14  11.054  -4.079  -2.296
  106   1HG1  ILE  14          HG12      ILE  14   8.635  -2.914  -3.714
  107   2HG1  ILE  14          HG11      ILE  14   9.604  -2.023  -2.540
  108   1HG2  ILE  14          HG21      ILE  14  10.277  -6.181  -3.219
  109   2HG2  ILE  14          HG22      ILE  14  10.349  -5.021  -4.541
  110   3HG2  ILE  14          HG23      ILE  14   8.799  -5.426  -3.809
  111   1HD1  ILE  14          HD11      ILE  14  10.683  -3.271  -5.085
  112   2HD1  ILE  14          HD12      ILE  14  11.601  -2.302  -3.934
  113   3HD1  ILE  14          HD13      ILE  14  10.312  -1.560  -4.882
  114    H    GLU  15           HN       GLU  15  11.179  -5.230  -0.139
  115    HA   GLU  15           HA       GLU  15  10.920  -8.026  -0.504
  116   1HB   GLU  15          HB2       GLU  15  12.327  -6.419   1.642
  117   2HB   GLU  15          HB1       GLU  15  12.475  -8.170   1.496
  118   1HG   GLU  15          HG2       GLU  15  13.323  -7.912  -0.808
  119   2HG   GLU  15          HG1       GLU  15  13.175  -6.160  -0.668
  120    H    GLU  16           HN       GLU  16   9.729  -5.984   2.183
  121    HA   GLU  16           HA       GLU  16   8.807  -8.243   3.729
  122   1HB   GLU  16          HB2       GLU  16   9.225  -6.044   4.752
  123   2HB   GLU  16          HB1       GLU  16   7.898  -5.358   3.815
  124   1HG   GLU  16          HG2       GLU  16   6.287  -6.778   4.928
  125   2HG   GLU  16          HG1       GLU  16   7.572  -7.672   5.743
  126    H    LEU  17           HN       LEU  17   7.090  -5.990   1.527
  127    HA   LEU  17           HA       LEU  17   4.509  -7.120   1.903
  128   1HB   LEU  17          HB2       LEU  17   5.711  -5.771  -0.525
  129   2HB   LEU  17          HB1       LEU  17   4.004  -6.178  -0.378
  130    HG   LEU  17           HG       LEU  17   5.510  -4.421   1.582
  131   1HD1  LEU  17          HD11      LEU  17   5.350  -3.440  -0.709
  132   2HD1  LEU  17          HD12      LEU  17   4.426  -2.531   0.487
  133   3HD1  LEU  17          HD13      LEU  17   3.598  -3.615  -0.630
  134   1HD2  LEU  17          HD21      LEU  17   2.976  -3.744   1.996
  135   2HD2  LEU  17          HD22      LEU  17   3.637  -5.182   2.762
  136   3HD2  LEU  17          HD23      LEU  17   2.647  -5.338   1.312
  137    H    VAL  18           HN       VAL  18   7.056  -7.975  -0.429
  138    HA   VAL  18           HA       VAL  18   5.523  -9.948  -1.831
  139    HB   VAL  18           HB       VAL  18   8.507  -9.581  -1.451
  140   1HG1  VAL  18          HG11      VAL  18   8.641 -11.070  -3.516
  141   2HG1  VAL  18          HG12      VAL  18   6.973 -11.532  -3.179
  142   3HG1  VAL  18          HG13      VAL  18   8.242 -11.892  -2.007
  143   1HG2  VAL  18          HG21      VAL  18   8.356  -8.758  -3.798
  144   2HG2  VAL  18          HG22      VAL  18   7.399  -7.784  -2.682
  145   3HG2  VAL  18          HG23      VAL  18   6.605  -8.960  -3.729
  146    H    ASN  19           HN       ASN  19   7.744 -10.215   0.944
  147    HA   ASN  19           HA       ASN  19   7.752 -13.045   1.136
  148   1HB   ASN  19          HB2       ASN  19   9.300 -11.609   2.398
  149   2HB   ASN  19          HB1       ASN  19   7.958 -11.006   3.371
  150   1HD2  ASN  19          HD21      ASN  19   9.631 -14.075   2.506
  151   2HD2  ASN  19          HD22      ASN  19   9.280 -14.855   3.973
  152    H    ILE  20           HN       ILE  20   5.466 -10.694   2.561
  153    HA   ILE  20           HA       ILE  20   4.028 -12.792   3.972
  154    HB   ILE  20           HB       ILE  20   2.414 -11.008   4.535
  155   1HG1  ILE  20          HG12      ILE  20   4.185  -9.231   2.835
  156   2HG1  ILE  20          HG11      ILE  20   2.590  -9.797   2.342
  157   1HG2  ILE  20          HG21      ILE  20   4.498 -11.300   5.839
  158   2HG2  ILE  20          HG22      ILE  20   3.987  -9.612   5.803
  159   3HG2  ILE  20          HG23      ILE  20   5.315 -10.156   4.775
  160   1HD1  ILE  20          HD11      ILE  20   3.225  -8.088   4.764
  161   2HD1  ILE  20          HD12      ILE  20   1.630  -8.747   4.400
  162   3HD1  ILE  20          HD13      ILE  20   2.367  -7.572   3.311
  163    H    THR  21           HN       THR  21   3.864 -11.616   0.714
  164    HA   THR  21           HA       THR  21   1.075 -12.654   0.412
  165    HB   THR  21           HB       THR  21   1.231 -11.669  -1.884
  166    HG1  THR  21           HG1      THR  21   3.126 -10.081  -1.876
  167   1HG2  THR  21          HG21      THR  21   2.035  -9.488   0.006
  168   2HG2  THR  21          HG22      THR  21   0.566 -10.397   0.363
  169   3HG2  THR  21          HG23      THR  21   0.717  -9.526  -1.162
  170    H    GLN  22           HN       GLN  22   4.353 -13.591  -0.230
  171    HA   GLN  22           HA       GLN  22   3.652 -15.391  -2.426
  172   1HB   GLN  22          HB2       GLN  22   6.134 -15.048  -0.733
  173   2HB   GLN  22          HB1       GLN  22   5.993 -16.326  -1.942
  174   1HG   GLN  22          HG2       GLN  22   5.533 -14.639  -3.681
  175   2HG   GLN  22          HG1       GLN  22   5.674 -13.355  -2.482
  176   1HE2  GLN  22          HE21      GLN  22   7.900 -15.343  -1.297
  177   2HE2  GLN  22          HE22      GLN  22   9.269 -14.894  -2.195
  178    H    ASN  23           HN       ASN  23   3.683 -15.570   1.049
  179    HA   ASN  23           HA       ASN  23   3.383 -18.539   0.967
  180   1HB   ASN  23          HB2       ASN  23   3.855 -16.590   3.232
  181   2HB   ASN  23          HB1       ASN  23   3.538 -18.310   3.475
  182   1HD2  ASN  23          HD21      ASN  23   6.075 -16.971   4.124
  183   2HD2  ASN  23          HD22      ASN  23   7.268 -17.678   3.146
  184    H    GLN  24           HN       GLN  24   1.338 -15.917   0.735
  185    HA   GLN  24           HA       GLN  24  -0.711 -16.953   2.588
  186   1HB   GLN  24          HB2       GLN  24  -1.958 -15.016   2.108
  187   2HB   GLN  24          HB1       GLN  24  -0.292 -14.459   2.009
  188   1HG   GLN  24          HG2       GLN  24  -0.430 -14.901  -0.500
  189   2HG   GLN  24          HG1       GLN  24  -2.168 -15.101  -0.275
  190   1HE2  GLN  24          HE21      GLN  24  -1.990 -13.052  -1.817
  191   2HE2  GLN  24          HE22      GLN  24  -1.961 -11.553  -1.021
  192    H    LYS  25           HN       LYS  25  -2.067 -18.565   2.023
  193    HA   LYS  25           HA       LYS  25  -2.231 -19.474  -0.743
  194   1HB   LYS  25          HB2       LYS  25  -2.289 -21.095   1.129
  195   2HB   LYS  25          HB1       LYS  25  -3.771 -20.354   1.724
  196   1HG   LYS  25          HG2       LYS  25  -4.273 -22.396   0.447
  197   2HG   LYS  25          HG1       LYS  25  -4.933 -20.981  -0.367
  198   1HD   LYS  25          HD2       LYS  25  -3.248 -21.015  -2.038
  199   2HD   LYS  25          HD1       LYS  25  -2.209 -22.075  -1.083
  200   1HE   LYS  25          HE2       LYS  25  -3.667 -23.948  -1.437
  201   2HE   LYS  25          HE1       LYS  25  -4.928 -22.913  -2.109
  202   1HZ   LYS  25          HZ1       LYS  25  -3.950 -22.889  -4.099
  203   2HZ   LYS  25          HZ2       LYS  25  -3.073 -24.238  -3.552
  204   3HZ   LYS  25          HZ3       LYS  25  -2.396 -22.684  -3.451
  205    H    ALA  26           HN       ALA  26  -4.175 -17.591   1.477
  206    HA   ALA  26           HA       ALA  26  -5.999 -16.861  -0.762
  207   1HB   ALA  26          HB1       ALA  26  -7.729 -18.032   0.165
  208   2HB   ALA  26          HB2       ALA  26  -7.598 -17.040   1.616
  209   3HB   ALA  26          HB3       ALA  26  -6.690 -18.544   1.492
  210    HA   PRO  27           HA       PRO  27  -5.708 -12.657   0.532
  211   1HB   PRO  27          HB2       PRO  27  -8.502 -12.630   1.547
  212   2HB   PRO  27          HB1       PRO  27  -7.754 -11.637   0.288
  213   1HG   PRO  27          HG2       PRO  27  -9.499 -13.788  -0.166
  214   2HG   PRO  27          HG1       PRO  27  -8.440 -13.051  -1.375
  215   1HD   PRO  27          HD2       PRO  27  -8.236 -15.704  -0.203
  216   2HD   PRO  27          HD1       PRO  27  -7.213 -14.988  -1.470
  217    H    LEU  28           HN       LEU  28  -4.848 -11.785   2.389
  218    HA   LEU  28           HA       LEU  28  -4.742 -13.281   4.816
  219   1HB   LEU  28          HB2       LEU  28  -4.176 -10.342   4.327
  220   2HB   LEU  28          HB1       LEU  28  -3.697 -11.234   5.768
  221    HG   LEU  28           HG       LEU  28  -2.865 -12.057   2.971
  222   1HD1  LEU  28          HD11      LEU  28  -1.536 -10.201   4.955
  223   2HD1  LEU  28          HD12      LEU  28  -1.901  -9.898   3.257
  224   3HD1  LEU  28          HD13      LEU  28  -0.625 -11.034   3.694
  225   1HD2  LEU  28          HD21      LEU  28  -0.976 -13.120   4.410
  226   2HD2  LEU  28          HD22      LEU  28  -2.558 -13.891   4.451
  227   3HD2  LEU  28          HD23      LEU  28  -2.052 -12.848   5.778
  228    H    CYS  29           HN       CYS  29  -6.744 -10.510   3.847
  229    HA   CYS  29           HA       CYS  29  -8.043 -10.402   6.478
  230   1HB   CYS  29          HB2       CYS  29  -8.572  -8.981   3.860
  231   2HB   CYS  29          HB1       CYS  29  -9.544  -8.734   5.312
  232    H    ASN  30           HN       ASN  30 -10.474 -10.589   6.595
  233    HA   ASN  30           HA       ASN  30 -11.303 -13.153   5.562
  234   1HB   ASN  30          HB2       ASN  30 -12.823 -10.932   6.958
  235   2HB   ASN  30          HB1       ASN  30 -13.535 -12.494   6.549
  236   1HD2  ASN  30          HD21      ASN  30 -13.192 -11.582   9.282
  237   2HD2  ASN  30          HD22      ASN  30 -12.082 -12.622  10.036
  238    H    GLY  31           HN       GLY  31 -10.658 -12.015   3.265
  239   1HA   GLY  31          HA2       GLY  31 -11.538 -11.637   1.117
  240   2HA   GLY  31          HA1       GLY  31 -13.147 -11.892   1.792
  241    H    SER  32           HN       SER  32 -11.164  -9.513   3.340
  242    HA   SER  32           HA       SER  32 -13.056  -7.423   2.939
  243   1HB   SER  32          HB2       SER  32 -10.112  -7.247   3.626
  244   2HB   SER  32          HB1       SER  32 -11.244  -5.907   3.740
  245    HG   SER  32           HG       SER  32 -11.628  -6.683   5.654
  246    H    MET  33           HN       MET  33 -13.184  -5.792   1.416
  247    HA   MET  33           HA       MET  33 -11.325  -5.971  -0.932
  248   1HB   MET  33          HB2       MET  33 -14.215  -5.050  -0.825
  249   2HB   MET  33          HB1       MET  33 -13.208  -5.099  -2.274
  250   1HG   MET  33          HG2       MET  33 -12.939  -7.545  -1.993
  251   2HG   MET  33          HG1       MET  33 -13.956  -7.486  -0.557
  252   1HE   MET  33          HE1       MET  33 -13.445  -6.793  -4.111
  253   2HE   MET  33          HE2       MET  33 -14.642  -5.505  -4.189
  254   3HE   MET  33          HE3       MET  33 -14.986  -7.062  -4.935
  255    H    VAL  34           HN       VAL  34 -10.780  -3.884  -1.938
  256    HA   VAL  34           HA       VAL  34 -11.153  -1.522  -0.114
  257    HB   VAL  34           HB       VAL  34  -8.807  -0.847  -0.886
  258   1HG1  VAL  34          HG11      VAL  34  -9.164  -1.596   1.377
  259   2HG1  VAL  34          HG12      VAL  34  -7.719  -2.404   0.771
  260   3HG1  VAL  34          HG13      VAL  34  -9.247  -3.281   0.862
  261   1HG2  VAL  34          HG21      VAL  34  -8.733  -2.509  -2.757
  262   2HG2  VAL  34          HG22      VAL  34  -8.685  -3.802  -1.558
  263   3HG2  VAL  34          HG23      VAL  34  -7.356  -2.647  -1.664
  264    H    TRP  35           HN       TRP  35 -10.875   0.555  -1.230
  265    HA   TRP  35           HA       TRP  35 -12.271   0.569  -3.773
  266   1HB   TRP  35          HB2       TRP  35 -10.891   2.800  -2.248
  267   2HB   TRP  35          HB1       TRP  35 -11.949   3.027  -3.642
  268    HD1  TRP  35           HD1      TRP  35 -11.982   2.174   0.047
  269    HE1  TRP  35           HE1      TRP  35 -14.412   2.153   0.892
  270    HE3  TRP  35           HE3      TRP  35 -14.460   2.612  -4.405
  271    HZ2  TRP  35           HZ2      TRP  35 -17.062   2.306  -0.173
  272    HZ3  TRP  35           HZ3      TRP  35 -16.936   2.674  -4.452
  273    HH2  TRP  35           HH2      TRP  35 -18.238   2.519  -2.347
  274    H    SER  36           HN       SER  36 -11.382   0.640  -5.795
  275    HA   SER  36           HA       SER  36  -8.529   0.285  -6.131
  276   1HB   SER  36          HB2       SER  36  -9.013   0.395  -8.535
  277   2HB   SER  36          HB1       SER  36 -10.199  -0.627  -7.730
  278    HG   SER  36           HG       SER  36 -11.270   1.668  -7.569
  279    H    ILE  37           HN       ILE  37  -7.037   1.807  -7.069
  280    HA   ILE  37           HA       ILE  37  -7.945   4.666  -7.147
  281    HB   ILE  37           HB       ILE  37  -5.766   5.285  -6.062
  282   1HG1  ILE  37          HG12      ILE  37  -5.613   2.404  -5.150
  283   2HG1  ILE  37          HG11      ILE  37  -4.781   2.927  -6.610
  284   1HG2  ILE  37          HG21      ILE  37  -7.801   5.288  -4.744
  285   2HG2  ILE  37          HG22      ILE  37  -6.505   4.606  -3.762
  286   3HG2  ILE  37          HG23      ILE  37  -7.700   3.544  -4.506
  287   1HD1  ILE  37          HD11      ILE  37  -4.422   4.233  -3.899
  288   2HD1  ILE  37          HD12      ILE  37  -3.507   4.578  -5.366
  289   3HD1  ILE  37          HD13      ILE  37  -3.334   3.016  -4.567
  290    H    ASN  38           HN       ASN  38  -6.374   6.062  -8.329
  291    HA   ASN  38           HA       ASN  38  -5.310   4.627 -10.688
  292   1HB   ASN  38          HB2       ASN  38  -5.399   7.597 -10.037
  293   2HB   ASN  38          HB1       ASN  38  -4.932   6.899 -11.589
  294   1HD2  ASN  38          HD21      ASN  38  -7.459   8.472 -10.324
  295   2HD2  ASN  38          HD22      ASN  38  -8.753   7.678 -11.082
  296    H    LEU  39           HN       LEU  39  -3.182   4.008 -10.709
  297    HA   LEU  39           HA       LEU  39  -1.423   4.891  -8.546
  298   1HB   LEU  39          HB2       LEU  39  -0.957   3.068 -10.922
  299   2HB   LEU  39          HB1       LEU  39   0.245   3.385  -9.676
  300    HG   LEU  39           HG       LEU  39  -0.944   1.281  -9.218
  301   1HD1  LEU  39          HD11      LEU  39  -1.219   1.606  -6.943
  302   2HD1  LEU  39          HD12      LEU  39  -2.056   3.144  -7.145
  303   3HD1  LEU  39          HD13      LEU  39  -0.308   3.056  -7.360
  304   1HD2  LEU  39          HD21      LEU  39  -3.502   2.784  -8.727
  305   2HD2  LEU  39          HD22      LEU  39  -3.259   1.069  -9.050
  306   3HD2  LEU  39          HD23      LEU  39  -3.111   2.239 -10.359
  307    H    THR  40           HN       THR  40  -0.460   6.848  -8.692
  308    HA   THR  40           HA       THR  40   0.977   7.543 -11.192
  309    HB   THR  40           HB       THR  40   0.047   9.879 -11.071
  310    HG1  THR  40           HG1      THR  40  -0.929   8.953  -8.812
  311   1HG2  THR  40          HG21      THR  40  -0.819   8.072 -12.606
  312   2HG2  THR  40          HG22      THR  40  -1.998   9.327 -12.219
  313   3HG2  THR  40          HG23      THR  40  -2.083   7.758 -11.417
  314    H    ALA  41           HN       ALA  41   0.450  10.116  -9.013
  315    HA   ALA  41           HA       ALA  41   3.267   9.955  -8.129
  316   1HB   ALA  41          HB1       ALA  41   2.391  12.075  -9.014
  317   2HB   ALA  41          HB2       ALA  41   2.891  12.254  -7.332
  318   3HB   ALA  41          HB3       ALA  41   1.179  12.114  -7.733
  319    H    GLY  42           HN       GLY  42   0.540  11.220  -6.243
  320   1HA   GLY  42          HA2       GLY  42   1.645  10.311  -3.762
  321   2HA   GLY  42          HA1       GLY  42   0.011  10.930  -3.979
  322    H    MET  43           HN       MET  43   1.604   8.019  -5.329
  323    HA   MET  43           HA       MET  43  -0.718   6.386  -5.026
  324   1HB   MET  43          HB2       MET  43   2.199   5.573  -5.116
  325   2HB   MET  43          HB1       MET  43   0.832   4.492  -5.376
  326   1HG   MET  43          HG2       MET  43   0.109   6.016  -7.251
  327   2HG   MET  43          HG1       MET  43   1.640   6.864  -7.073
  328   1HE   MET  43          HE1       MET  43   3.744   5.802  -6.853
  329   2HE   MET  43          HE2       MET  43   4.346   4.532  -7.917
  330   3HE   MET  43          HE3       MET  43   3.644   4.107  -6.357
  331    H    TYR  44           HN       TYR  44   2.106   6.895  -2.921
  332    HA   TYR  44           HA       TYR  44   1.498   4.907  -0.977
  333   1HB   TYR  44          HB2       TYR  44   2.922   7.572  -0.728
  334   2HB   TYR  44          HB1       TYR  44   2.846   6.387   0.576
  335    HD1  TYR  44           HD1      TYR  44   4.022   4.257   0.422
  336    HD2  TYR  44           HD2      TYR  44   4.221   7.133  -2.766
  337    HE1  TYR  44           HE1      TYR  44   5.920   3.016  -0.574
  338    HE2  TYR  44           HE2      TYR  44   6.123   5.883  -3.765
  339    HH   TYR  44           HH       TYR  44   7.905   3.642  -2.136
  340    H    CYS  45           HN       CYS  45   0.640   8.365  -1.061
  341    HA   CYS  45           HA       CYS  45  -0.878   8.328   1.377
  342   1HB   CYS  45          HB2       CYS  45  -1.004  10.169  -1.026
  343   2HB   CYS  45          HB1       CYS  45  -1.818  10.480   0.506
  344    H    ALA  46           HN       ALA  46  -1.942   8.181  -2.045
  345    HA   ALA  46           HA       ALA  46  -4.717   7.939  -1.471
  346   1HB   ALA  46          HB1       ALA  46  -3.389   6.552  -3.803
  347   2HB   ALA  46          HB2       ALA  46  -3.542   8.308  -3.748
  348   3HB   ALA  46          HB3       ALA  46  -4.986   7.296  -3.732
  349    H    ALA  47           HN       ALA  47  -2.250   5.417  -1.969
  350    HA   ALA  47           HA       ALA  47  -4.006   3.198  -1.613
  351   1HB   ALA  47          HB1       ALA  47  -1.025   3.546  -1.275
  352   2HB   ALA  47          HB2       ALA  47  -1.889   2.713  -2.567
  353   3HB   ALA  47          HB3       ALA  47  -1.811   2.000  -0.956
  354    H    LEU  48           HN       LEU  48  -2.118   5.103   0.714
  355    HA   LEU  48           HA       LEU  48  -2.509   3.437   2.967
  356   1HB   LEU  48          HB2       LEU  48  -0.912   5.303   2.949
  357   2HB   LEU  48          HB1       LEU  48  -2.240   6.456   2.858
  358    HG   LEU  48           HG       LEU  48  -3.066   5.703   5.055
  359   1HD1  LEU  48          HD11      LEU  48  -2.503   3.445   5.289
  360   2HD1  LEU  48          HD12      LEU  48  -1.317   4.206   6.346
  361   3HD1  LEU  48          HD13      LEU  48  -0.850   3.689   4.726
  362   1HD2  LEU  48          HD21      LEU  48  -1.308   6.675   6.397
  363   2HD2  LEU  48          HD22      LEU  48  -1.293   7.497   4.837
  364   3HD2  LEU  48          HD23      LEU  48  -0.088   6.260   5.194
  365    H    GLU  49           HN       GLU  49  -4.515   6.252   1.932
  366    HA   GLU  49           HA       GLU  49  -6.381   6.005   4.062
  367   1HB   GLU  49          HB2       GLU  49  -8.013   7.130   2.460
  368   2HB   GLU  49          HB1       GLU  49  -6.508   7.994   2.760
  369   1HG   GLU  49          HG2       GLU  49  -5.563   7.133   0.681
  370   2HG   GLU  49          HG1       GLU  49  -7.023   6.186   0.382
  371    H    SER  50           HN       SER  50  -6.293   4.387   0.891
  372    HA   SER  50           HA       SER  50  -8.833   3.110   1.110
  373   1HB   SER  50          HB2       SER  50  -6.286   2.193  -0.254
  374   2HB   SER  50          HB1       SER  50  -7.842   1.387  -0.434
  375    HG   SER  50           HG       SER  50  -8.658   3.471  -1.128
  376    H    LEU  51           HN       LEU  51  -5.627   2.170   2.314
  377    HA   LEU  51           HA       LEU  51  -6.466  -0.393   3.334
  378   1HB   LEU  51          HB2       LEU  51  -4.134   1.402   4.051
  379   2HB   LEU  51          HB1       LEU  51  -4.348  -0.220   4.707
  380    HG   LEU  51           HG       LEU  51  -4.200   0.423   1.746
  381   1HD1  LEU  51          HD11      LEU  51  -2.081  -0.716   3.594
  382   2HD1  LEU  51          HD12      LEU  51  -2.076   0.909   2.911
  383   3HD1  LEU  51          HD13      LEU  51  -1.919  -0.492   1.851
  384   1HD2  LEU  51          HD21      LEU  51  -3.598  -2.182   1.870
  385   2HD2  LEU  51          HD22      LEU  51  -5.271  -1.644   1.811
  386   3HD2  LEU  51          HD23      LEU  51  -4.548  -2.099   3.353
  387    H    ILE  52           HN       ILE  52  -6.256   2.849   4.779
  388    HA   ILE  52           HA       ILE  52  -6.758   2.155   7.468
  389    HB   ILE  52           HB       ILE  52  -7.604   4.586   5.872
  390   1HG1  ILE  52          HG12      ILE  52  -5.182   4.281   6.076
  391   2HG1  ILE  52          HG11      ILE  52  -5.699   5.658   7.035
  392   1HG2  ILE  52          HG21      ILE  52  -7.799   5.676   8.163
  393   2HG2  ILE  52          HG22      ILE  52  -7.801   4.046   8.839
  394   3HG2  ILE  52          HG23      ILE  52  -9.086   4.547   7.739
  395   1HD1  ILE  52          HD11      ILE  52  -4.358   4.623   8.599
  396   2HD1  ILE  52          HD12      ILE  52  -4.617   3.020   7.915
  397   3HD1  ILE  52          HD13      ILE  52  -5.849   3.747   8.942
  398    H    ASN  53           HN       ASN  53  -8.842   1.833   4.756
  399    HA   ASN  53           HA       ASN  53 -11.317   1.915   6.356
  400   1HB   ASN  53          HB2       ASN  53 -10.754   1.161   3.471
  401   2HB   ASN  53          HB1       ASN  53 -12.363   1.130   4.195
  402   1HD2  ASN  53          HD21      ASN  53 -10.651   3.042   2.209
  403   2HD2  ASN  53          HD22      ASN  53 -11.172   4.578   2.712
  404    H    VAL  54           HN       VAL  54  -8.889  -0.367   5.582
  405    HA   VAL  54           HA       VAL  54 -10.660  -2.712   5.973
  406    HB   VAL  54           HB       VAL  54  -7.650  -2.619   5.604
  407   1HG1  VAL  54          HG11      VAL  54  -7.961  -4.955   4.895
  408   2HG1  VAL  54          HG12      VAL  54  -9.695  -4.819   5.183
  409   3HG1  VAL  54          HG13      VAL  54  -8.567  -4.719   6.535
  410   1HG2  VAL  54          HG21      VAL  54  -8.193  -3.175   3.220
  411   2HG2  VAL  54          HG22      VAL  54  -8.717  -1.557   3.685
  412   3HG2  VAL  54          HG23      VAL  54  -9.892  -2.867   3.574
  413    H    SER  55           HN       SER  55 -11.065  -3.391   8.018
  414    HA   SER  55           HA       SER  55  -9.016  -2.881  10.160
  415   1HB   SER  55          HB2       SER  55 -12.034  -3.005  10.416
  416   2HB   SER  55          HB1       SER  55 -10.899  -2.762  11.741
  417    HG   SER  55           HG       SER  55 -10.598  -1.084   9.567
  418    H    GLY  56           HN       GLY  56  -8.738  -4.556  11.712
  419   1HA   GLY  56          HA2       GLY  56  -9.027  -6.740  12.619
  420   2HA   GLY  56          HA1       GLY  56 -10.209  -7.089  11.358
  421    H    CYS  57           HN       CYS  57  -6.964  -5.794  10.781
  422    HA   CYS  57           HA       CYS  57  -6.044  -8.456   9.828
  423   1HB   CYS  57          HB2       CYS  57  -6.192  -5.972   8.094
  424   2HB   CYS  57          HB1       CYS  57  -5.290  -7.428   7.671
  425    H    SER  58           HN       SER  58  -4.532  -8.323  11.558
  426    HA   SER  58           HA       SER  58  -2.840  -6.084  12.067
  427   1HB   SER  58          HB2       SER  58  -3.200  -8.038  13.610
  428   2HB   SER  58          HB1       SER  58  -2.181  -9.000  12.543
  429    HG   SER  58           HG       SER  58  -0.499  -8.060  13.376
  430    H    ALA  59           HN       ALA  59  -2.501  -8.854   9.906
  431    HA   ALA  59           HA       ALA  59   0.192  -8.695   9.221
  432   1HB   ALA  59          HB1       ALA  59  -2.095  -9.250   7.319
  433   2HB   ALA  59          HB2       ALA  59  -1.382 -10.427   8.421
  434   3HB   ALA  59          HB3       ALA  59  -0.417  -9.751   7.109
  435    H    ILE  60           HN       ILE  60  -2.321  -6.392   8.307
  436    HA   ILE  60           HA       ILE  60  -0.404  -5.108   6.388
  437    HB   ILE  60           HB       ILE  60  -2.335  -3.855   5.545
  438   1HG1  ILE  60          HG12      ILE  60  -4.006  -5.531   7.426
  439   2HG1  ILE  60          HG11      ILE  60  -3.592  -3.854   7.755
  440   1HG2  ILE  60          HG21      ILE  60  -3.331  -5.661   4.372
  441   2HG2  ILE  60          HG22      ILE  60  -3.103  -6.771   5.723
  442   3HG2  ILE  60          HG23      ILE  60  -1.712  -6.233   4.781
  443   1HD1  ILE  60          HD11      ILE  60  -5.777  -3.932   6.691
  444   2HD1  ILE  60          HD12      ILE  60  -5.127  -4.892   5.361
  445   3HD1  ILE  60          HD13      ILE  60  -4.616  -3.217   5.573
  446    H    GLU  61           HN       GLU  61  -1.534  -4.774   9.579
  447    HA   GLU  61           HA       GLU  61  -1.664  -1.931   9.794
  448   1HB   GLU  61          HB2       GLU  61  -0.842  -4.053  11.796
  449   2HB   GLU  61          HB1       GLU  61  -1.001  -2.344  12.211
  450   1HG   GLU  61          HG2       GLU  61  -3.342  -2.358  11.473
  451   2HG   GLU  61          HG1       GLU  61  -3.200  -4.052  11.008
  452    H    LYS  62           HN       LYS  62   1.083  -4.183   9.911
  453    HA   LYS  62           HA       LYS  62   3.101  -2.259  10.554
  454   1HB   LYS  62          HB2       LYS  62   3.226  -4.839   8.963
  455   2HB   LYS  62          HB1       LYS  62   4.652  -3.894   9.394
  456   1HG   LYS  62          HG2       LYS  62   4.083  -4.109  11.781
  457   2HG   LYS  62          HG1       LYS  62   2.657  -5.055  11.356
  458   1HD   LYS  62          HD2       LYS  62   4.099  -6.764  10.306
  459   2HD   LYS  62          HD1       LYS  62   5.527  -5.821  10.732
  460   1HE   LYS  62          HE2       LYS  62   5.214  -7.560  12.403
  461   2HE   LYS  62          HE1       LYS  62   4.857  -5.998  13.139
  462   1HZ   LYS  62          HZ1       LYS  62   3.219  -8.153  13.143
  463   2HZ   LYS  62          HZ2       LYS  62   2.579  -7.206  11.885
  464   3HZ   LYS  62          HZ3       LYS  62   2.741  -6.555  13.446
  465    H    THR  63           HN       THR  63   1.679  -3.323   7.503
  466    HA   THR  63           HA       THR  63   3.390  -1.919   5.731
  467    HB   THR  63           HB       THR  63   0.435  -2.530   5.401
  468    HG1  THR  63           HG1      THR  63   2.599  -4.091   5.524
  469   1HG2  THR  63          HG21      THR  63   1.145  -0.901   3.765
  470   2HG2  THR  63          HG22      THR  63   1.062  -2.468   2.959
  471   3HG2  THR  63          HG23      THR  63   2.624  -1.805   3.438
  472    H    GLN  64           HN       GLN  64   0.463  -0.874   7.454
  473    HA   GLN  64           HA       GLN  64   0.162   1.656   6.192
  474   1HB   GLN  64          HB2       GLN  64  -0.469   0.752   9.012
  475   2HB   GLN  64          HB1       GLN  64  -0.943   2.324   8.368
  476   1HG   GLN  64          HG2       GLN  64  -2.271   1.288   6.634
  477   2HG   GLN  64          HG1       GLN  64  -1.684  -0.316   7.080
  478   1HE2  GLN  64          HE21      GLN  64  -4.513   0.612   7.133
  479   2HE2  GLN  64          HE22      GLN  64  -5.026   0.450   8.742
  480    H    ARG  65           HN       ARG  65   2.173   0.675   8.963
  481    HA   ARG  65           HA       ARG  65   3.051   3.298   9.666
  482   1HB   ARG  65          HB2       ARG  65   4.400   0.599   9.971
  483   2HB   ARG  65          HB1       ARG  65   5.024   2.088  10.680
  484   1HG   ARG  65          HG2       ARG  65   2.863   2.382  11.887
  485   2HG   ARG  65          HG1       ARG  65   2.318   0.837  11.234
  486   1HD   ARG  65          HD2       ARG  65   4.738   1.262  13.012
  487   2HD   ARG  65          HD1       ARG  65   3.215   0.516  13.494
  488    HE   ARG  65           HE       ARG  65   4.064  -0.999  11.327
  489   1HH1  ARG  65          HH21      ARG  65   5.371   0.045  14.339
  490   2HH1  ARG  65          HH22      ARG  65   6.375  -1.351  14.540
  491   1HH2  ARG  65          HH11      ARG  65   5.380  -2.830  11.569
  492   2HH2  ARG  65          HH12      ARG  65   6.385  -2.978  12.972
  493    H    MET  66           HN       MET  66   4.485   0.863   7.473
  494    HA   MET  66           HA       MET  66   6.753   2.450   6.744
  495   1HB   MET  66          HB2       MET  66   5.324   0.260   5.207
  496   2HB   MET  66          HB1       MET  66   6.900   0.925   4.775
  497   1HG   MET  66          HG2       MET  66   7.624   0.322   7.176
  498   2HG   MET  66          HG1       MET  66   6.153  -0.645   7.248
  499   1HE   MET  66          HE1       MET  66   5.909  -2.912   6.460
  500   2HE   MET  66          HE2       MET  66   6.589  -3.530   4.957
  501   3HE   MET  66          HE3       MET  66   5.542  -2.117   4.924
  502    H    LEU  67           HN       LEU  67   3.498   2.174   5.338
  503    HA   LEU  67           HA       LEU  67   3.985   3.820   3.049
  504   1HB   LEU  67          HB2       LEU  67   1.459   3.345   4.653
  505   2HB   LEU  67          HB1       LEU  67   1.491   4.215   3.124
  506    HG   LEU  67           HG       LEU  67   2.507   1.375   3.460
  507   1HD1  LEU  67          HD11      LEU  67   0.325   0.851   2.191
  508   2HD1  LEU  67          HD12      LEU  67  -0.210   2.455   2.695
  509   3HD1  LEU  67          HD13      LEU  67   0.183   1.235   3.905
  510   1HD2  LEU  67          HD21      LEU  67   1.996   1.476   0.892
  511   2HD2  LEU  67          HD22      LEU  67   3.471   2.231   1.482
  512   3HD2  LEU  67          HD23      LEU  67   2.060   3.223   1.113
  513    H    SER  68           HN       SER  68   2.994   4.588   6.364
  514    HA   SER  68           HA       SER  68   2.435   7.336   6.034
  515   1HB   SER  68          HB2       SER  68   3.650   5.844   8.372
  516   2HB   SER  68          HB1       SER  68   3.145   7.529   8.456
  517    HG   SER  68           HG       SER  68   1.080   6.933   8.243
  518    H    GLY  69           HN       GLY  69   5.528   5.649   6.292
  519   1HA   GLY  69          HA2       GLY  69   7.230   7.854   6.785
  520   2HA   GLY  69          HA1       GLY  69   7.703   6.421   5.871
  521    H    PHE  70           HN       PHE  70   5.647   6.812   3.807
  522    HA   PHE  70           HA       PHE  70   7.072   8.889   2.229
  523   1HB   PHE  70          HB2       PHE  70   4.972   6.835   1.460
  524   2HB   PHE  70          HB1       PHE  70   5.743   7.947   0.332
  525    HD1  PHE  70           HD1      PHE  70   8.111   7.689  -0.278
  526    HD2  PHE  70           HD2      PHE  70   6.202   4.977   2.447
  527    HE1  PHE  70           HE1      PHE  70   9.996   6.104  -0.542
  528    HE2  PHE  70           HE2      PHE  70   8.091   3.394   2.191
  529    HZ   PHE  70           HZ       PHE  70   9.984   3.956   0.694
  530    H    CYS  71           HN       CYS  71   4.242   8.529   4.091
  531    HA   CYS  71           HA       CYS  71   3.094  11.046   2.928
  532   1HB   CYS  71          HB2       CYS  71   1.630   8.524   3.741
  533   2HB   CYS  71          HB1       CYS  71   0.826  10.075   3.500
  534    HA   PRO  72           HA       PRO  72   4.056  11.364   7.512
  535   1HB   PRO  72          HB2       PRO  72   4.259  14.229   6.761
  536   2HB   PRO  72          HB1       PRO  72   5.420  13.212   7.628
  537   1HG   PRO  72          HG2       PRO  72   5.779  14.051   5.036
  538   2HG   PRO  72          HG1       PRO  72   6.497  12.573   5.694
  539   1HD   PRO  72          HD2       PRO  72   4.241  12.867   3.780
  540   2HD   PRO  72          HD1       PRO  72   5.322  11.473   4.039
  541    H    HIS  73           HN       HIS  73   1.521  12.250   5.509
  542    HA   HIS  73           HA       HIS  73   0.057  13.738   7.648
  543   1HB   HIS  73          HB2       HIS  73  -1.508  14.386   5.958
  544   2HB   HIS  73          HB1       HIS  73   0.091  14.582   5.246
  545    HD1  HIS  73           HD1      HIS  73  -2.996  12.460   5.065
  546    HD2  HIS  73           HD2      HIS  73   0.704  12.728   3.165
  547    HE1  HIS  73           HE1      HIS  73  -3.128  10.961   3.028
  548    H    LYS  74           HN       LYS  74  -1.173  12.539   8.983
  549    HA   LYS  74           HA       LYS  74  -1.781   9.753   8.381
  550   1HB   LYS  74          HB2       LYS  74  -2.566  11.560  10.678
  551   2HB   LYS  74          HB1       LYS  74  -2.967   9.845  10.596
  552   1HG   LYS  74          HG2       LYS  74  -0.567   9.292  10.450
  553   2HG   LYS  74          HG1       LYS  74  -0.167  11.008  10.541
  554   1HD   LYS  74          HD2       LYS  74  -1.259  11.147  12.753
  555   2HD   LYS  74          HD1       LYS  74  -1.649   9.429  12.661
  556   1HE   LYS  74          HE2       LYS  74   0.743   8.874  12.552
  557   2HE   LYS  74          HE1       LYS  74   1.151  10.588  12.608
  558   1HZ   LYS  74          HZ1       LYS  74  -0.067   8.922  14.723
  559   2HZ   LYS  74          HZ2       LYS  74  -0.177  10.617  14.755
  560   3HZ   LYS  74          HZ3       LYS  74   1.343   9.861  14.798
  561    H    VAL  75           HN       VAL  75  -3.648   8.954   7.544
  562    HA   VAL  75           HA       VAL  75  -5.927  10.842   7.075
  563    HB   VAL  75           HB       VAL  75  -6.553   8.786   5.473
  564   1HG1  VAL  75          HG11      VAL  75  -5.124   9.895   3.671
  565   2HG1  VAL  75          HG12      VAL  75  -4.507  10.949   4.945
  566   3HG1  VAL  75          HG13      VAL  75  -6.225  10.958   4.547
  567   1HG2  VAL  75          HG21      VAL  75  -4.469   7.563   6.423
  568   2HG2  VAL  75          HG22      VAL  75  -3.539   8.643   5.385
  569   3HG2  VAL  75          HG23      VAL  75  -4.717   7.538   4.677
  570    H    SER  76           HN       SER  76  -7.659  10.536   8.381
  571    HA   SER  76           HA       SER  76  -7.888   8.008   9.923
  572   1HB   SER  76          HB2       SER  76  -9.628   9.212  11.187
  573   2HB   SER  76          HB1       SER  76  -8.147  10.161  11.114
  574    HG   SER  76           HG       SER  76  -9.058  11.474   9.622
  575    H    ALA  77           HN       ALA  77 -10.159   7.077  10.097
  576    HA   ALA  77           HA       ALA  77 -11.121   6.359   7.507
  577   1HB   ALA  77          HB1       ALA  77 -12.958   5.269   8.695
  578   2HB   ALA  77          HB2       ALA  77 -12.604   6.199  10.150
  579   3HB   ALA  77          HB3       ALA  77 -11.454   4.994   9.574
  580    H    GLY  78           HN       GLY  78 -11.416   9.261   9.095
  581   1HA   GLY  78          HA2       GLY  78 -14.120   9.877   7.982
  582   2HA   GLY  78          HA1       GLY  78 -13.250  10.857   9.163
  583    H    GLN  79           HN       GLN  79 -10.704  10.818   7.766
  584    HA   GLN  79           HA       GLN  79 -11.343  12.859   5.712
  585   1HB   GLN  79          HB2       GLN  79  -8.750  11.990   7.019
  586   2HB   GLN  79          HB1       GLN  79  -8.840  13.205   5.743
  587   1HG   GLN  79          HG2       GLN  79 -10.242  14.633   7.098
  588   2HG   GLN  79          HG1       GLN  79 -10.411  13.380   8.327
  589   1HE2  GLN  79          HE21      GLN  79  -9.361  15.957   8.995
  590   2HE2  GLN  79          HE22      GLN  79  -7.722  15.781   9.403
  591    H    PHE  80           HN       PHE  80 -11.347  12.368   3.594
  592    HA   PHE  80           HA       PHE  80  -9.743  10.027   2.615
  593   1HB   PHE  80          HB2       PHE  80 -12.574  10.804   1.851
  594   2HB   PHE  80          HB1       PHE  80 -11.602   9.610   0.994
  595    HD1  PHE  80           HD1      PHE  80 -13.770  10.200   3.799
  596    HD2  PHE  80           HD2      PHE  80 -10.666   7.623   2.324
  597    HE1  PHE  80           HE1      PHE  80 -14.432   8.467   5.438
  598    HE2  PHE  80           HE2      PHE  80 -11.320   5.892   3.973
  599    HZ   PHE  80           HZ       PHE  80 -13.202   6.311   5.533
  600    H    SER  81           HN       SER  81  -8.886  10.302   0.491
  601    HA   SER  81           HA       SER  81  -9.087  13.097  -0.603
  602   1HB   SER  81          HB2       SER  81  -6.675  11.268  -0.525
  603   2HB   SER  81          HB1       SER  81  -6.732  12.843  -1.310
  604    HG   SER  81           HG       SER  81  -7.467  12.530   1.398
  605    H    SER  82           HN       SER  82  -8.275   9.715  -1.535
  606    HA   SER  82           HA       SER  82  -8.950  10.406  -4.358
  607   1HB   SER  82          HB2       SER  82  -6.770   9.280  -3.750
  608   2HB   SER  82          HB1       SER  82  -7.710   7.853  -3.326
  609    HG   SER  82           HG       SER  82  -8.303   8.999  -5.769
  610    H    LEU  83           HN       LEU  83 -10.664   9.113  -1.788
  611    HA   LEU  83           HA       LEU  83 -11.989   6.976  -3.345
  612   1HB   LEU  83          HB2       LEU  83 -12.341   8.083  -0.561
  613   2HB   LEU  83          HB1       LEU  83 -13.555   7.020  -1.257
  614    HG   LEU  83           HG       LEU  83 -11.723   5.348  -1.719
  615   1HD1  LEU  83          HD11      LEU  83  -9.733   6.624  -1.732
  616   2HD1  LEU  83          HD12      LEU  83  -9.650   5.743  -0.207
  617   3HD1  LEU  83          HD13      LEU  83 -10.135   7.438  -0.220
  618   1HD2  LEU  83          HD21      LEU  83 -11.417   4.802   0.787
  619   2HD2  LEU  83          HD22      LEU  83 -13.069   4.905   0.183
  620   3HD2  LEU  83          HD23      LEU  83 -12.379   6.248   1.094
  621    H    HIS  84           HN       HIS  84 -12.083  10.022  -4.005
  622    HA   HIS  84           HA       HIS  84 -14.904  10.700  -3.708
  623   1HB   HIS  84          HB2       HIS  84 -12.981  11.939  -5.692
  624   2HB   HIS  84          HB1       HIS  84 -14.401  12.674  -4.949
  625    HD1  HIS  84           HD1      HIS  84 -13.239  11.157  -2.131
  626    HD2  HIS  84           HD2      HIS  84 -11.596  14.240  -4.410
  627    HE1  HIS  84           HE1      HIS  84 -11.631  12.386  -0.621
  628    H    VAL  85           HN       VAL  85 -13.014   8.874  -5.952
  629    HA   VAL  85           HA       VAL  85 -14.850   9.143  -8.197
  630    HB   VAL  85           HB       VAL  85 -13.547   7.310  -9.189
  631   1HG1  VAL  85          HG11      VAL  85 -11.768   9.281  -7.728
  632   2HG1  VAL  85          HG12      VAL  85 -12.672   9.650  -9.197
  633   3HG1  VAL  85          HG13      VAL  85 -11.388   8.440  -9.231
  634   1HG2  VAL  85          HG21      VAL  85 -13.172   5.865  -7.317
  635   2HG2  VAL  85          HG22      VAL  85 -12.398   7.149  -6.390
  636   3HG2  VAL  85          HG23      VAL  85 -11.579   6.456  -7.789
  637    H    ARG  86           HN       ARG  86 -16.424   7.648  -8.847
  638    HA   ARG  86           HA       ARG  86 -17.501   5.958  -6.667
  639   1HB   ARG  86          HB2       ARG  86 -18.590   6.707  -9.398
  640   2HB   ARG  86          HB1       ARG  86 -19.436   5.675  -8.243
  641   1HG   ARG  86          HG2       ARG  86 -19.379   7.504  -6.584
  642   2HG   ARG  86          HG1       ARG  86 -18.555   8.534  -7.750
  643   1HD   ARG  86          HD2       ARG  86 -20.514   8.166  -9.311
  644   2HD   ARG  86          HD1       ARG  86 -21.356   7.392  -7.973
  645    HE   ARG  86           HE       ARG  86 -21.102  10.220  -8.434
  646   1HH1  ARG  86          HH21      ARG  86 -20.926   7.903  -5.873
  647   2HH1  ARG  86          HH22      ARG  86 -21.105   9.092  -4.629
  648   1HH2  ARG  86          HH11      ARG  86 -21.348  11.756  -6.826
  649   2HH2  ARG  86          HH12      ARG  86 -21.349  11.265  -5.165
  650    H    ASP  87           HN       ASP  87 -15.102   4.969  -7.609
  651    HA   ASP  87           HA       ASP  87 -15.571   2.980  -9.698
  652   1HB   ASP  87          HB2       ASP  87 -13.278   3.459  -7.776
  653   2HB   ASP  87          HB1       ASP  87 -13.280   2.168  -8.979
  654    H    THR  88           HN       THR  88 -15.070   0.624  -9.148
  655    HA   THR  88           HA       THR  88 -16.742  -0.153  -6.839
  656    HB   THR  88           HB       THR  88 -16.768  -2.351  -7.840
  657    HG1  THR  88           HG1      THR  88 -14.773  -1.334  -9.588
  658   1HG2  THR  88          HG21      THR  88 -18.148  -0.579  -8.927
  659   2HG2  THR  88          HG22      THR  88 -17.662  -1.847 -10.052
  660   3HG2  THR  88          HG23      THR  88 -16.831  -0.291 -10.062
  661    H    LYS  89           HN       LYS  89 -15.895  -2.065  -5.517
  662    HA   LYS  89           HA       LYS  89 -13.116  -1.439  -4.688
  663   1HB   LYS  89          HB2       LYS  89 -15.260  -3.146  -3.393
  664   2HB   LYS  89          HB1       LYS  89 -13.680  -2.788  -2.693
  665   1HG   LYS  89          HG2       LYS  89 -14.194  -0.367  -2.786
  666   2HG   LYS  89          HG1       LYS  89 -15.773  -0.736  -3.470
  667   1HD   LYS  89          HD2       LYS  89 -16.303  -0.498  -1.210
  668   2HD   LYS  89          HD1       LYS  89 -16.052  -2.239  -1.321
  669   1HE   LYS  89          HE2       LYS  89 -13.709  -1.935  -0.548
  670   2HE   LYS  89          HE1       LYS  89 -13.993  -0.200  -0.415
  671   1HZ   LYS  89          HZ1       LYS  89 -15.993  -0.998   1.028
  672   2HZ   LYS  89          HZ2       LYS  89 -14.438  -0.876   1.701
  673   3HZ   LYS  89          HZ3       LYS  89 -15.044  -2.389   1.224
  674    H    ILE  90           HN       ILE  90 -11.603  -3.194  -4.268
  675    HA   ILE  90           HA       ILE  90 -12.075  -5.654  -5.924
  676    HB   ILE  90           HB       ILE  90  -9.656  -5.492  -6.576
  677   1HG1  ILE  90          HG12      ILE  90  -9.876  -2.702  -5.396
  678   2HG1  ILE  90          HG11      ILE  90  -9.004  -4.028  -4.629
  679   1HG2  ILE  90          HG21      ILE  90 -10.006  -3.824  -8.280
  680   2HG2  ILE  90          HG22      ILE  90 -11.223  -3.003  -7.302
  681   3HG2  ILE  90          HG23      ILE  90 -11.565  -4.595  -7.980
  682   1HD1  ILE  90          HD11      ILE  90  -7.566  -4.226  -6.634
  683   2HD1  ILE  90          HD12      ILE  90  -7.452  -2.622  -5.908
  684   3HD1  ILE  90          HD13      ILE  90  -8.416  -2.866  -7.365
  685    H    GLU  91           HN       GLU  91 -10.595  -7.468  -5.276
  686    HA   GLU  91           HA       GLU  91 -10.626  -7.876  -2.433
  687   1HB   GLU  91          HB2       GLU  91  -9.085  -9.363  -4.585
  688   2HB   GLU  91          HB1       GLU  91  -9.334  -9.931  -2.935
  689   1HG   GLU  91          HG2       GLU  91 -11.037 -11.007  -4.183
  690   2HG   GLU  91          HG1       GLU  91 -11.857  -9.654  -3.406
  691    H    VAL  92           HN       VAL  92  -8.956  -7.714  -0.912
  692    HA   VAL  92           HA       VAL  92  -6.938  -5.753  -1.318
  693    HB   VAL  92           HB       VAL  92  -7.195  -7.966   0.737
  694   1HG1  VAL  92          HG11      VAL  92  -5.557  -6.574   2.067
  695   2HG1  VAL  92          HG12      VAL  92  -5.224  -5.668   0.592
  696   3HG1  VAL  92          HG13      VAL  92  -4.847  -7.388   0.673
  697   1HG2  VAL  92          HG21      VAL  92  -8.173  -6.319   2.121
  698   2HG2  VAL  92          HG22      VAL  92  -8.874  -5.992   0.537
  699   3HG2  VAL  92          HG23      VAL  92  -7.551  -4.993   1.137
  700    H    ALA  93           HN       ALA  93  -6.750  -9.311  -1.505
  701    HA   ALA  93           HA       ALA  93  -3.979  -9.622  -1.752
  702   1HB   ALA  93          HB1       ALA  93  -4.539 -11.609  -3.220
  703   2HB   ALA  93          HB2       ALA  93  -6.225 -11.096  -3.149
  704   3HB   ALA  93          HB3       ALA  93  -5.384 -11.572  -1.674
  705    H    GLN  94           HN       GLN  94  -6.310  -8.748  -4.295
  706    HA   GLN  94           HA       GLN  94  -4.262  -8.651  -6.359
  707   1HB   GLN  94          HB2       GLN  94  -6.658  -9.076  -6.865
  708   2HB   GLN  94          HB1       GLN  94  -7.046  -7.442  -6.327
  709   1HG   GLN  94          HG2       GLN  94  -5.574  -6.511  -8.077
  710   2HG   GLN  94          HG1       GLN  94  -5.182  -8.145  -8.614
  711   1HE2  GLN  94          HE21      GLN  94  -6.396  -6.374 -10.442
  712   2HE2  GLN  94          HE22      GLN  94  -7.990  -6.877 -10.739
  713    H    PHE  95           HN       PHE  95  -5.750  -6.337  -4.152
  714    HA   PHE  95           HA       PHE  95  -4.800  -3.929  -5.341
  715   1HB   PHE  95          HB2       PHE  95  -6.431  -3.931  -3.504
  716   2HB   PHE  95          HB1       PHE  95  -5.221  -4.610  -2.415
  717    HD1  PHE  95           HD1      PHE  95  -6.438  -1.589  -4.055
  718    HD2  PHE  95           HD2      PHE  95  -3.197  -3.285  -1.801
  719    HE1  PHE  95           HE1      PHE  95  -5.602   0.689  -3.538
  720    HE2  PHE  95           HE2      PHE  95  -2.362  -1.007  -1.285
  721    HZ   PHE  95           HZ       PHE  95  -3.564   0.977  -2.156
  722    H    VAL  96           HN       VAL  96  -3.300  -6.085  -2.920
  723    HA   VAL  96           HA       VAL  96  -0.923  -4.534  -2.568
  724    HB   VAL  96           HB       VAL  96  -1.322  -7.529  -2.298
  725   1HG1  VAL  96          HG11      VAL  96   1.027  -7.091  -2.415
  726   2HG1  VAL  96          HG12      VAL  96   0.645  -7.249  -0.700
  727   3HG1  VAL  96          HG13      VAL  96   0.876  -5.652  -1.409
  728   1HG2  VAL  96          HG21      VAL  96  -1.562  -6.981   0.118
  729   2HG2  VAL  96          HG22      VAL  96  -2.837  -6.251  -0.857
  730   3HG2  VAL  96          HG23      VAL  96  -1.492  -5.265  -0.281
  731    H    LYS  97           HN       LYS  97  -1.569  -7.340  -4.709
  732    HA   LYS  97           HA       LYS  97   1.030  -7.457  -5.848
  733   1HB   LYS  97          HB2       LYS  97  -1.680  -8.205  -6.965
  734   2HB   LYS  97          HB1       LYS  97  -0.160  -8.589  -7.775
  735   1HG   LYS  97          HG2       LYS  97   0.599  -9.820  -5.778
  736   2HG   LYS  97          HG1       LYS  97  -0.921  -9.443  -4.965
  737   1HD   LYS  97          HD2       LYS  97  -2.158 -10.632  -6.750
  738   2HD   LYS  97          HD1       LYS  97  -0.628 -11.038  -7.527
  739   1HE   LYS  97          HE2       LYS  97  -1.596 -11.927  -4.802
  740   2HE   LYS  97          HE1       LYS  97  -1.283 -12.943  -6.208
  741   1HZ   LYS  97          HZ1       LYS  97   0.641 -13.203  -5.024
  742   2HZ   LYS  97          HZ2       LYS  97   0.619 -11.621  -4.405
  743   3HZ   LYS  97          HZ3       LYS  97   1.076 -11.899  -6.018
  744    H    ASP  98           HN       ASP  98  -1.863  -5.652  -7.016
  745    HA   ASP  98           HA       ASP  98  -0.587  -4.571  -9.332
  746   1HB   ASP  98          HB2       ASP  98  -2.828  -3.521  -7.586
  747   2HB   ASP  98          HB1       ASP  98  -2.315  -2.710  -9.068
  748    H    LEU  99           HN       LEU  99  -0.723  -3.430  -5.980
  749    HA   LEU  99           HA       LEU  99   0.648  -0.961  -6.405
  750   1HB   LEU  99          HB2       LEU  99  -0.576  -1.443  -4.327
  751   2HB   LEU  99          HB1       LEU  99   0.555  -2.737  -3.942
  752    HG   LEU  99           HG       LEU  99   2.395  -1.091  -3.830
  753   1HD1  LEU  99          HD11      LEU  99   0.197   0.799  -4.652
  754   2HD1  LEU  99          HD12      LEU  99   1.837   0.661  -5.288
  755   3HD1  LEU  99          HD13      LEU  99   1.567   1.388  -3.707
  756   1HD2  LEU  99          HD21      LEU  99   1.790  -0.142  -1.723
  757   2HD2  LEU  99          HD22      LEU  99   0.893  -1.657  -1.843
  758   3HD2  LEU  99          HD23      LEU  99   0.080  -0.122  -2.149
  759    H    LEU 100           HN       LEU 100   1.781  -4.257  -5.807
  760    HA   LEU 100           HA       LEU 100   4.506  -3.753  -5.289
  761   1HB   LEU 100          HB2       LEU 100   3.464  -5.974  -5.068
  762   2HB   LEU 100          HB1       LEU 100   3.283  -6.068  -6.815
  763    HG   LEU 100           HG       LEU 100   5.768  -5.918  -7.047
  764   1HD1  LEU 100          HD11      LEU 100   6.552  -4.819  -5.126
  765   2HD1  LEU 100          HD12      LEU 100   6.995  -6.494  -4.814
  766   3HD1  LEU 100          HD13      LEU 100   5.569  -5.803  -4.041
  767   1HD2  LEU 100          HD21      LEU 100   6.208  -8.204  -6.234
  768   2HD2  LEU 100          HD22      LEU 100   4.625  -8.096  -7.004
  769   3HD2  LEU 100          HD23      LEU 100   4.749  -8.132  -5.245
  770    H    LEU 101           HN       LEU 101   2.903  -4.143  -8.485
  771    HA   LEU 101           HA       LEU 101   5.324  -4.029  -9.993
  772   1HB   LEU 101          HB2       LEU 101   2.482  -3.263 -10.655
  773   2HB   LEU 101          HB1       LEU 101   3.772  -3.020 -11.826
  774    HG   LEU 101           HG       LEU 101   2.507  -5.219 -12.029
  775   1HD1  LEU 101          HD11      LEU 101   4.383  -6.375 -12.772
  776   2HD1  LEU 101          HD12      LEU 101   5.387  -5.843 -11.429
  777   3HD1  LEU 101          HD13      LEU 101   5.004  -4.729 -12.736
  778   1HD2  LEU 101          HD21      LEU 101   4.093  -5.977  -9.564
  779   2HD2  LEU 101          HD22      LEU 101   2.916  -6.965 -10.429
  780   3HD2  LEU 101          HD23      LEU 101   2.386  -5.547  -9.532
  781    H    HIS 102           HN       HIS 102   3.209  -1.389  -8.849
  782    HA   HIS 102           HA       HIS 102   4.801   0.671 -10.094
  783   1HB   HIS 102          HB2       HIS 102   2.710   0.707  -7.912
  784   2HB   HIS 102          HB1       HIS 102   3.580   2.168  -8.381
  785    HD1  HIS 102           HD1      HIS 102   3.131   3.138 -10.744
  786    HD2  HIS 102           HD2      HIS 102   0.916  -0.282  -9.889
  787    HE1  HIS 102           HE1      HIS 102   1.383   2.952 -12.565
  788    H    LEU 103           HN       LEU 103   4.935  -0.857  -6.868
  789    HA   LEU 103           HA       LEU 103   6.671   1.058  -5.692
  790   1HB   LEU 103          HB2       LEU 103   6.503  -1.932  -5.255
  791   2HB   LEU 103          HB1       LEU 103   7.510  -0.871  -4.275
  792    HG   LEU 103           HG       LEU 103   4.514  -0.529  -4.626
  793   1HD1  LEU 103          HD11      LEU 103   5.959  -1.570  -2.177
  794   2HD1  LEU 103          HD12      LEU 103   5.288  -2.644  -3.401
  795   3HD1  LEU 103          HD13      LEU 103   4.227  -1.573  -2.491
  796   1HD2  LEU 103          HD21      LEU 103   5.291   1.579  -3.959
  797   2HD2  LEU 103          HD22      LEU 103   6.643   0.909  -3.046
  798   3HD2  LEU 103          HD23      LEU 103   5.007   0.820  -2.397
  799    H    LYS 104           HN       LYS 104   7.654  -2.010  -7.332
  800    HA   LYS 104           HA       LYS 104  10.431  -1.230  -7.256
  801   1HB   LYS 104          HB2       LYS 104  10.836  -3.127  -8.771
  802   2HB   LYS 104          HB1       LYS 104   9.826  -3.582  -7.402
  803   1HG   LYS 104          HG2       LYS 104   7.812  -3.363  -8.814
  804   2HG   LYS 104          HG1       LYS 104   8.829  -2.914 -10.187
  805   1HD   LYS 104          HD2       LYS 104   9.970  -5.063 -10.108
  806   2HD   LYS 104          HD1       LYS 104   9.082  -5.518  -8.653
  807   1HE   LYS 104          HE2       LYS 104   8.211  -6.440 -10.889
  808   2HE   LYS 104          HE1       LYS 104   7.035  -5.682  -9.818
  809   1HZ   LYS 104          HZ1       LYS 104   8.433  -4.155 -11.932
  810   2HZ   LYS 104          HZ2       LYS 104   7.009  -3.746 -11.100
  811   3HZ   LYS 104          HZ3       LYS 104   6.997  -5.000 -12.246
  812    H    LYS 105           HN       LYS 105   7.877  -0.420  -9.475
  813    HA   LYS 105           HA       LYS 105   9.507   0.073 -11.786
  814   1HB   LYS 105          HB2       LYS 105   7.049  -0.081 -11.871
  815   2HB   LYS 105          HB1       LYS 105   6.921   1.408 -10.940
  816   1HG   LYS 105          HG2       LYS 105   8.079   2.640 -12.734
  817   2HG   LYS 105          HG1       LYS 105   8.223   1.150 -13.670
  818   1HD   LYS 105          HD2       LYS 105   5.736   0.946 -13.651
  819   2HD   LYS 105          HD1       LYS 105   5.642   2.498 -12.819
  820   1HE   LYS 105          HE2       LYS 105   6.686   3.630 -14.701
  821   2HE   LYS 105          HE1       LYS 105   6.968   2.090 -15.516
  822   1HZ   LYS 105          HZ1       LYS 105   5.020   2.583 -16.495
  823   2HZ   LYS 105          HZ2       LYS 105   4.525   3.632 -15.252
  824   3HZ   LYS 105          HZ3       LYS 105   4.348   1.952 -15.070
  825    H    LEU 106           HN       LEU 106   8.496   2.233  -9.125
  826    HA   LEU 106           HA       LEU 106   9.761   4.589 -10.147
  827   1HB   LEU 106          HB2       LEU 106   8.944   3.682  -7.384
  828   2HB   LEU 106          HB1       LEU 106   9.822   5.190  -7.594
  829    HG   LEU 106           HG       LEU 106   7.226   5.272  -7.527
  830   1HD1  LEU 106          HD11      LEU 106   7.227   7.034  -9.395
  831   2HD1  LEU 106          HD12      LEU 106   8.925   6.627  -9.624
  832   3HD1  LEU 106          HD13      LEU 106   8.373   7.258  -8.078
  833   1HD2  LEU 106          HD21      LEU 106   7.031   3.396  -9.262
  834   2HD2  LEU 106          HD22      LEU 106   7.504   4.590 -10.462
  835   3HD2  LEU 106          HD23      LEU 106   6.029   4.813  -9.531
  836    H    PHE 107           HN       PHE 107  11.012   1.782  -8.527
  837    HA   PHE 107           HA       PHE 107  13.426   2.858  -7.500
  838   1HB   PHE 107          HB2       PHE 107  12.648   0.594  -6.939
  839   2HB   PHE 107          HB1       PHE 107  12.940   0.080  -8.601
  840    HD1  PHE 107           HD1      PHE 107  14.597   1.416  -5.545
  841    HD2  PHE 107           HD2      PHE 107  15.116  -0.495  -9.359
  842    HE1  PHE 107           HE1      PHE 107  16.981   0.999  -5.014
  843    HE2  PHE 107           HE2      PHE 107  17.497  -0.920  -8.823
  844    HZ   PHE 107           HZ       PHE 107  18.431  -0.175  -6.649
  845    H    ARG 108           HN       ARG 108  12.682   1.646 -10.770
  846    HA   ARG 108           HA       ARG 108  15.345   1.716 -11.757
  847   1HB   ARG 108          HB2       ARG 108  12.709   2.157 -13.181
  848   2HB   ARG 108          HB1       ARG 108  14.256   2.045 -14.020
  849   1HG   ARG 108          HG2       ARG 108  14.618  -0.198 -13.049
  850   2HG   ARG 108          HG1       ARG 108  13.058  -0.089 -12.230
  851   1HD   ARG 108          HD2       ARG 108  11.996   0.261 -14.500
  852   2HD   ARG 108          HD1       ARG 108  13.560  -0.113 -15.218
  853    HE   ARG 108           HE       ARG 108  13.029  -2.249 -13.502
  854   1HH1  ARG 108          HH21      ARG 108  11.530  -0.667 -16.175
  855   2HH1  ARG 108          HH22      ARG 108  10.676  -2.078 -16.703
  856   1HH2  ARG 108          HH11      ARG 108  11.915  -4.099 -14.173
  857   2HH2  ARG 108          HH12      ARG 108  10.887  -4.019 -15.564
  858    H    GLU 109           HN       GLU 109  12.902   4.295 -11.537
  859    HA   GLU 109           HA       GLU 109  14.711   6.216 -12.836
  860   1HB   GLU 109          HB2       GLU 109  12.031   6.532 -11.453
  861   2HB   GLU 109          HB1       GLU 109  12.907   7.861 -12.212
  862   1HG   GLU 109          HG2       GLU 109  12.871   6.650 -14.367
  863   2HG   GLU 109          HG1       GLU 109  11.971   5.336 -13.608
  864    H    GLY 110           HN       GLY 110  14.327   4.962  -9.684
  865   1HA   GLY 110          HA2       GLY 110  15.386   5.554  -7.680
  866   2HA   GLY 110          HA1       GLY 110  16.367   6.682  -8.619
  867    H    ARG 111           HN       ARG 111  13.098   7.202  -9.196
  868    HA   ARG 111           HA       ARG 111  13.137   9.654  -7.520
  869   1HB   ARG 111          HB2       ARG 111  11.267   8.672  -9.699
  870   2HB   ARG 111          HB1       ARG 111  11.008  10.160  -8.788
  871   1HG   ARG 111          HG2       ARG 111  13.193  11.014  -9.541
  872   2HG   ARG 111          HG1       ARG 111  13.464   9.525 -10.448
  873   1HD   ARG 111          HD2       ARG 111  12.626  11.245 -11.966
  874   2HD   ARG 111          HD1       ARG 111  11.401   9.996 -11.772
  875    HE   ARG 111           HE       ARG 111  10.786  11.897  -9.826
  876   1HH1  ARG 111          HH21      ARG 111  11.281  11.819 -13.240
  877   2HH1  ARG 111          HH22      ARG 111  10.195  13.130 -13.562
  878   1HH2  ARG 111          HH11      ARG 111   9.356  13.599 -10.227
  879   2HH2  ARG 111          HH12      ARG 111   9.106  14.139 -11.854
  880    H    PHE 112           HN       PHE 112  12.703   8.910  -5.454
  881    HA   PHE 112           HA       PHE 112  10.426   7.082  -4.992
  882   1HB   PHE 112          HB2       PHE 112  12.331   8.375  -3.021
  883   2HB   PHE 112          HB1       PHE 112  11.260   7.002  -2.714
  884    HD1  PHE 112           HD1      PHE 112  11.622   4.839  -3.920
  885    HD2  PHE 112           HD2      PHE 112  14.399   8.100  -4.210
  886    HE1  PHE 112           HE1      PHE 112  13.329   3.311  -4.866
  887    HE2  PHE 112           HE2      PHE 112  16.104   6.564  -5.156
  888    HZ   PHE 112           HZ       PHE 112  15.569   4.169  -5.478
  889    H    ASN 113           HN       ASN 113   8.549   7.684  -3.858
  890    HA   ASN 113           HA       ASN 113   7.824  10.512  -4.028
  891   1HB   ASN 113          HB2       ASN 113   6.350   8.076  -3.008
  892   2HB   ASN 113          HB1       ASN 113   5.649   9.693  -3.059
  893   1HD2  ASN 113          HD21      ASN 113   4.737   7.361  -4.643
  894   2HD2  ASN 113          HD22      ASN 113   4.932   7.787  -6.275
  Start of MODEL   10
    1   1H    MET   1           HT1      MET   1  23.549   6.592  13.936
    2   2H    MET   1           HT2      MET   1  23.066   5.215  13.066
    3   3H    MET   1           HT3      MET   1  21.925   6.400  13.490
    4    HA   MET   1           HA       MET   1  23.880   7.749  12.089
    5   1HB   MET   1          HB2       MET   1  23.099   5.104  10.827
    6   2HB   MET   1          HB1       MET   1  23.831   6.441   9.940
    7   1HG   MET   1          HG2       MET   1  25.793   6.362  11.434
    8   2HG   MET   1          HG1       MET   1  25.064   5.021  12.320
    9   1HE   MET   1          HE1       MET   1  27.278   3.186  11.652
   10   2HE   MET   1          HE2       MET   1  27.692   4.895  11.523
   11   3HE   MET   1          HE3       MET   1  28.140   3.787  10.229
   12    H    GLY   2           HN       GLY   2  22.708   7.986   9.641
   13   1HA   GLY   2          HA2       GLY   2  20.154   9.205  10.295
   14   2HA   GLY   2          HA1       GLY   2  20.880   9.131   8.687
   15    HA   PRO   3           HA       PRO   3  17.195   6.056   9.421
   16   1HB   PRO   3          HB2       PRO   3  16.035   7.291   7.048
   17   2HB   PRO   3          HB1       PRO   3  15.365   7.193   8.680
   18   1HG   PRO   3          HG2       PRO   3  16.564   9.487   7.367
   19   2HG   PRO   3          HG1       PRO   3  15.779   9.417   8.949
   20   1HD   PRO   3          HD2       PRO   3  18.557   9.782   8.477
   21   2HD   PRO   3          HD1       PRO   3  17.801   9.395  10.044
   22    H    VAL   4           HN       VAL   4  16.248   4.781   7.295
   23    HA   VAL   4           HA       VAL   4  18.613   3.625   6.066
   24    HB   VAL   4           HB       VAL   4  16.883   2.154   4.920
   25   1HG1  VAL   4          HG11      VAL   4  16.302   0.976   7.004
   26   2HG1  VAL   4          HG12      VAL   4  16.730   2.409   7.939
   27   3HG1  VAL   4          HG13      VAL   4  17.976   1.530   7.050
   28   1HG2  VAL   4          HG21      VAL   4  14.944   3.497   6.812
   29   2HG2  VAL   4          HG22      VAL   4  14.588   2.354   5.517
   30   3HG2  VAL   4          HG23      VAL   4  15.095   3.996   5.128
   31    HA   PRO   5           HA       PRO   5  18.592   6.159   2.392
   32   1HB   PRO   5          HB2       PRO   5  19.161   3.999   0.554
   33   2HB   PRO   5          HB1       PRO   5  20.284   5.195   1.209
   34   1HG   PRO   5          HG2       PRO   5  20.032   2.389   1.910
   35   2HG   PRO   5          HG1       PRO   5  21.249   3.548   2.447
   36   1HD   PRO   5          HD2       PRO   5  19.131   2.444   4.023
   37   2HD   PRO   5          HD1       PRO   5  20.236   3.764   4.486
   38    HA   PRO   6           HA       PRO   6  14.627   5.725   0.437
   39   1HB   PRO   6          HB2       PRO   6  15.314   6.337  -2.243
   40   2HB   PRO   6          HB1       PRO   6  14.860   7.495  -0.987
   41   1HG   PRO   6          HG2       PRO   6  17.530   6.906  -2.109
   42   2HG   PRO   6          HG1       PRO   6  16.973   8.341  -1.237
   43   1HD   PRO   6          HD2       PRO   6  18.659   6.341  -0.183
   44   2HD   PRO   6          HD1       PRO   6  17.757   7.545   0.773
   45    H    SER   7           HN       SER   7  17.105   4.412  -1.771
   46    HA   SER   7           HA       SER   7  15.407   2.528  -3.056
   47   1HB   SER   7          HB2       SER   7  17.456   1.502  -3.870
   48   2HB   SER   7          HB1       SER   7  17.640   3.254  -3.900
   49    HG   SER   7           HG       SER   7  18.519   2.843  -1.647
   50    H    THR   8           HN       THR   8  17.457   2.201  -0.170
   51    HA   THR   8           HA       THR   8  16.996  -0.635   0.092
   52    HB   THR   8           HB       THR   8  17.832   1.413   2.160
   53    HG1  THR   8           HG1      THR   8  19.827  -0.030   1.610
   54   1HG2  THR   8          HG21      THR   8  18.819  -0.786   3.186
   55   2HG2  THR   8          HG22      THR   8  17.568  -1.586   2.235
   56   3HG2  THR   8          HG23      THR   8  17.121  -0.398   3.461
   57    H    ALA   9           HN       ALA   9  15.350   2.202   1.511
   58    HA   ALA   9           HA       ALA   9  13.656   0.742   3.275
   59   1HB   ALA   9          HB1       ALA   9  13.941   3.277   3.153
   60   2HB   ALA   9          HB2       ALA   9  12.287   2.706   3.366
   61   3HB   ALA   9          HB3       ALA   9  12.836   3.244   1.779
   62    H    LEU  10           HN       LEU  10  13.290   1.593  -0.154
   63    HA   LEU  10           HA       LEU  10  10.645   0.557  -0.470
   64   1HB   LEU  10          HB2       LEU  10  11.845   2.007  -2.138
   65   2HB   LEU  10          HB1       LEU  10  12.866   0.630  -2.538
   66    HG   LEU  10           HG       LEU  10  10.732  -0.663  -3.061
   67   1HD1  LEU  10          HD11      LEU  10   9.592   2.083  -2.566
   68   2HD1  LEU  10          HD12      LEU  10   8.966   0.513  -2.069
   69   3HD1  LEU  10          HD13      LEU  10   8.838   1.020  -3.751
   70   1HD2  LEU  10          HD21      LEU  10  11.287   1.812  -4.717
   71   2HD2  LEU  10          HD22      LEU  10  10.530   0.328  -5.284
   72   3HD2  LEU  10          HD23      LEU  10  12.217   0.315  -4.786
   73    H    ARG  11           HN       ARG  11  13.836  -0.953  -1.088
   74    HA   ARG  11           HA       ARG  11  12.846  -3.499  -1.876
   75   1HB   ARG  11          HB2       ARG  11  15.432  -2.698  -0.517
   76   2HB   ARG  11          HB1       ARG  11  15.116  -4.327  -1.115
   77   1HG   ARG  11          HG2       ARG  11  14.740  -3.426  -3.381
   78   2HG   ARG  11          HG1       ARG  11  15.062  -1.798  -2.781
   79   1HD   ARG  11          HD2       ARG  11  17.039  -4.083  -2.571
   80   2HD   ARG  11          HD1       ARG  11  17.049  -2.897  -3.877
   81    HE   ARG  11           HE       ARG  11  17.092  -1.343  -1.588
   82   1HH1  ARG  11          HH21      ARG  11  18.909  -4.011  -2.806
   83   2HH1  ARG  11          HH22      ARG  11  20.392  -3.510  -2.064
   84   1HH2  ARG  11          HH11      ARG  11  19.017  -0.675  -0.614
   85   2HH2  ARG  11          HH12      ARG  11  20.453  -1.622  -0.824
   86    H    GLU  12           HN       GLU  12  13.709  -2.255   1.346
   87    HA   GLU  12           HA       GLU  12  13.251  -4.702   2.739
   88   1HB   GLU  12          HB2       GLU  12  13.070  -1.811   3.615
   89   2HB   GLU  12          HB1       GLU  12  12.901  -3.170   4.730
   90   1HG   GLU  12          HG2       GLU  12  15.130  -3.992   4.086
   91   2HG   GLU  12          HG1       GLU  12  15.301  -2.659   2.945
   92    H    LEU  13           HN       LEU  13  11.062  -2.044   1.851
   93    HA   LEU  13           HA       LEU  13   8.787  -3.144   3.242
   94   1HB   LEU  13          HB2       LEU  13   8.920  -0.768   2.595
   95   2HB   LEU  13          HB1       LEU  13   8.913  -1.230   0.896
   96    HG   LEU  13           HG       LEU  13   6.675  -2.223   1.160
   97   1HD1  LEU  13          HD11      LEU  13   7.152  -1.488   4.042
   98   2HD1  LEU  13          HD12      LEU  13   6.470  -2.969   3.369
   99   3HD1  LEU  13          HD13      LEU  13   5.504  -1.496   3.413
  100   1HD2  LEU  13          HD21      LEU  13   6.732   0.072   0.466
  101   2HD2  LEU  13          HD22      LEU  13   7.046   0.626   2.111
  102   3HD2  LEU  13          HD23      LEU  13   5.470  -0.047   1.692
  103    H    ILE  14           HN       ILE  14   9.936  -3.371  -0.131
  104    HA   ILE  14           HA       ILE  14   7.707  -4.834  -1.148
  105    HB   ILE  14           HB       ILE  14  10.626  -4.832  -1.967
  106   1HG1  ILE  14          HG12      ILE  14   8.206  -3.569  -3.290
  107   2HG1  ILE  14          HG11      ILE  14   9.244  -2.707  -2.156
  108   1HG2  ILE  14          HG21      ILE  14   9.822  -6.867  -2.862
  109   2HG2  ILE  14          HG22      ILE  14   9.570  -5.721  -4.177
  110   3HG2  ILE  14          HG23      ILE  14   8.214  -6.209  -3.160
  111   1HD1  ILE  14          HD11      ILE  14  10.228  -4.037  -4.696
  112   2HD1  ILE  14          HD12      ILE  14  11.176  -3.032  -3.600
  113   3HD1  ILE  14          HD13      ILE  14   9.872  -2.316  -4.547
  114    H    GLU  15           HN       GLU  15  10.776  -5.986   0.262
  115    HA   GLU  15           HA       GLU  15  10.273  -8.762  -0.055
  116   1HB   GLU  15          HB2       GLU  15  11.870  -7.254   2.031
  117   2HB   GLU  15          HB1       GLU  15  11.867  -9.011   1.900
  118   1HG   GLU  15          HG2       GLU  15  12.568  -7.177  -0.404
  119   2HG   GLU  15          HG1       GLU  15  13.770  -7.874   0.681
  120    H    GLU  16           HN       GLU  16   9.369  -6.534   2.564
  121    HA   GLU  16           HA       GLU  16   8.253  -8.585   4.255
  122   1HB   GLU  16          HB2       GLU  16   8.955  -6.343   5.073
  123   2HB   GLU  16          HB1       GLU  16   7.624  -5.622   4.173
  124   1HG   GLU  16          HG2       GLU  16   6.938  -5.907   6.489
  125   2HG   GLU  16          HG1       GLU  16   6.029  -7.042   5.493
  126    H    LEU  17           HN       LEU  17   6.764  -6.280   1.949
  127    HA   LEU  17           HA       LEU  17   4.071  -7.135   2.366
  128   1HB   LEU  17          HB2       LEU  17   5.391  -5.979  -0.103
  129   2HB   LEU  17          HB1       LEU  17   3.651  -6.173   0.089
  130    HG   LEU  17           HG       LEU  17   5.411  -4.537   1.943
  131   1HD1  LEU  17          HD11      LEU  17   3.544  -3.663  -0.284
  132   2HD1  LEU  17          HD12      LEU  17   5.305  -3.578  -0.331
  133   3HD1  LEU  17          HD13      LEU  17   4.403  -2.584   0.815
  134   1HD2  LEU  17          HD21      LEU  17   3.496  -5.101   3.198
  135   2HD2  LEU  17          HD22      LEU  17   2.448  -5.094   1.780
  136   3HD2  LEU  17          HD23      LEU  17   3.026  -3.575   2.459
  137    H    VAL  18           HN       VAL  18   6.564  -8.282   0.120
  138    HA   VAL  18           HA       VAL  18   4.850 -10.114  -1.278
  139    HB   VAL  18           HB       VAL  18   7.855 -10.021  -0.913
  140   1HG1  VAL  18          HG11      VAL  18   7.321 -12.302  -1.462
  141   2HG1  VAL  18          HG12      VAL  18   7.845 -11.528  -2.957
  142   3HG1  VAL  18          HG13      VAL  18   6.129 -11.793  -2.658
  143   1HG2  VAL  18          HG21      VAL  18   6.591  -8.162  -2.151
  144   2HG2  VAL  18          HG22      VAL  18   6.194  -9.384  -3.360
  145   3HG2  VAL  18          HG23      VAL  18   7.879  -8.964  -3.051
  146    H    ASN  19           HN       ASN  19   7.036 -10.523   1.500
  147    HA   ASN  19           HA       ASN  19   6.798 -13.336   1.759
  148   1HB   ASN  19          HB2       ASN  19   8.460 -11.991   2.979
  149   2HB   ASN  19          HB1       ASN  19   7.172 -11.249   3.928
  150   1HD2  ASN  19          HD21      ASN  19   9.468 -13.093   4.757
  151   2HD2  ASN  19          HD22      ASN  19   8.711 -14.357   5.599
  152    H    ILE  20           HN       ILE  20   4.743 -10.753   3.124
  153    HA   ILE  20           HA       ILE  20   3.100 -12.650   4.590
  154    HB   ILE  20           HB       ILE  20   1.637 -10.698   5.011
  155   1HG1  ILE  20          HG12      ILE  20   3.596  -9.264   3.194
  156   2HG1  ILE  20          HG11      ILE  20   1.923  -9.625   2.789
  157   1HG2  ILE  20          HG21      ILE  20   4.589 -10.055   5.289
  158   2HG2  ILE  20          HG22      ILE  20   3.693 -11.127   6.365
  159   3HG2  ILE  20          HG23      ILE  20   3.277  -9.416   6.281
  160   1HD1  ILE  20          HD11      ILE  20   1.255  -8.322   4.865
  161   2HD1  ILE  20          HD12      ILE  20   1.960  -7.358   3.566
  162   3HD1  ILE  20          HD13      ILE  20   2.934  -7.790   4.971
  163    H    THR  21           HN       THR  21   3.091 -11.542   1.304
  164    HA   THR  21           HA       THR  21   0.235 -12.316   0.961
  165    HB   THR  21           HB       THR  21   0.589 -11.446  -1.378
  166    HG1  THR  21           HG1      THR  21   2.905 -10.192  -0.541
  167   1HG2  THR  21          HG21      THR  21   1.465  -9.085   0.032
  168   2HG2  THR  21          HG22      THR  21   0.354  -9.974   1.071
  169   3HG2  THR  21          HG23      THR  21  -0.156  -9.468  -0.539
  170    H    GLN  22           HN       GLN  22   3.445 -13.528   0.304
  171    HA   GLN  22           HA       GLN  22   2.587 -15.384  -1.771
  172   1HB   GLN  22          HB2       GLN  22   5.094 -15.162  -0.097
  173   2HB   GLN  22          HB1       GLN  22   4.849 -16.466  -1.259
  174   1HG   GLN  22          HG2       GLN  22   4.514 -14.816  -3.055
  175   2HG   GLN  22          HG1       GLN  22   4.759 -13.508  -1.901
  176   1HE2  GLN  22          HE21      GLN  22   6.846 -15.495  -0.585
  177   2HE2  GLN  22          HE22      GLN  22   8.236 -15.238  -1.525
  178    H    ASN  23           HN       ASN  23   2.980 -15.553   1.738
  179    HA   ASN  23           HA       ASN  23   2.312 -18.448   1.705
  180   1HB   ASN  23          HB2       ASN  23   2.853 -18.395   4.079
  181   2HB   ASN  23          HB1       ASN  23   4.145 -17.624   3.160
  182   1HD2  ASN  23          HD21      ASN  23   3.916 -16.936   5.854
  183   2HD2  ASN  23          HD22      ASN  23   3.308 -15.359   6.002
  184    H    GLN  24           HN       GLN  24   0.449 -15.782   1.474
  185    HA   GLN  24           HA       GLN  24  -1.457 -16.401   3.626
  186   1HB   GLN  24          HB2       GLN  24  -2.674 -14.515   2.896
  187   2HB   GLN  24          HB1       GLN  24  -1.000 -14.072   2.575
  188   1HG   GLN  24          HG2       GLN  24  -1.380 -15.019   0.209
  189   2HG   GLN  24          HG1       GLN  24  -3.099 -14.988   0.604
  190   1HE2  GLN  24          HE21      GLN  24  -2.386 -12.501   2.388
  191   2HE2  GLN  24          HE22      GLN  24  -2.355 -11.232   1.262
  192    H    LYS  25           HN       LYS  25  -3.023 -17.944   3.455
  193    HA   LYS  25           HA       LYS  25  -3.508 -19.213   0.822
  194   1HB   LYS  25          HB2       LYS  25  -3.232 -20.618   2.872
  195   2HB   LYS  25          HB1       LYS  25  -4.686 -19.879   3.544
  196   1HG   LYS  25          HG2       LYS  25  -6.002 -20.713   1.630
  197   2HG   LYS  25          HG1       LYS  25  -4.551 -21.448   0.948
  198   1HD   LYS  25          HD2       LYS  25  -4.320 -22.858   2.968
  199   2HD   LYS  25          HD1       LYS  25  -5.785 -22.134   3.632
  200   1HE   LYS  25          HE2       LYS  25  -7.161 -23.116   1.972
  201   2HE   LYS  25          HE1       LYS  25  -5.786 -23.482   0.929
  202   1HZ   LYS  25          HZ1       LYS  25  -6.442 -24.748   3.530
  203   2HZ   LYS  25          HZ2       LYS  25  -4.989 -25.007   2.689
  204   3HZ   LYS  25          HZ3       LYS  25  -6.468 -25.480   2.000
  205    H    ALA  26           HN       ALA  26  -5.893 -18.514   3.372
  206    HA   ALA  26           HA       ALA  26  -7.782 -17.581   1.322
  207   1HB   ALA  26          HB1       ALA  26  -9.313 -18.293   2.859
  208   2HB   ALA  26          HB2       ALA  26  -8.722 -17.123   4.037
  209   3HB   ALA  26          HB3       ALA  26  -7.984 -18.720   3.932
  210    HA   PRO  27           HA       PRO  27  -7.186 -13.198   1.549
  211   1HB   PRO  27          HB2       PRO  27  -9.766 -12.788   2.973
  212   2HB   PRO  27          HB1       PRO  27  -9.230 -12.145   1.415
  213   1HG   PRO  27          HG2       PRO  27 -11.084 -14.190   1.720
  214   2HG   PRO  27          HG1       PRO  27 -10.152 -13.890   0.248
  215   1HD   PRO  27          HD2       PRO  27  -9.904 -16.128   2.138
  216   2HD   PRO  27          HD1       PRO  27  -9.158 -15.934   0.531
  217    H    LEU  28           HN       LEU  28  -5.992 -11.979   3.016
  218    HA   LEU  28           HA       LEU  28  -5.524 -12.889   5.676
  219   1HB   LEU  28          HB2       LEU  28  -5.100 -10.143   4.462
  220   2HB   LEU  28          HB1       LEU  28  -4.430 -10.667   6.005
  221    HG   LEU  28           HG       LEU  28  -3.899 -12.044   3.354
  222   1HD1  LEU  28          HD11      LEU  28  -1.614 -11.000   3.628
  223   2HD1  LEU  28          HD12      LEU  28  -2.290 -10.015   4.926
  224   3HD1  LEU  28          HD13      LEU  28  -2.905  -9.849   3.282
  225   1HD2  LEU  28          HD21      LEU  28  -2.994 -12.485   6.198
  226   2HD2  LEU  28          HD22      LEU  28  -1.890 -12.873   4.880
  227   3HD2  LEU  28          HD23      LEU  28  -3.456 -13.671   4.977
  228    H    CYS  29           HN       CYS  29  -7.481 -10.165   4.487
  229    HA   CYS  29           HA       CYS  29  -8.573  -9.644   7.161
  230   1HB   CYS  29          HB2       CYS  29  -9.135  -8.505   4.412
  231   2HB   CYS  29          HB1       CYS  29 -10.031  -8.010   5.848
  232    H    ASN  30           HN       ASN  30 -11.036  -9.606   7.393
  233    HA   ASN  30           HA       ASN  30 -12.100 -12.206   6.737
  234   1HB   ASN  30          HB2       ASN  30 -13.436  -9.691   7.783
  235   2HB   ASN  30          HB1       ASN  30 -14.242 -11.255   7.655
  236   1HD2  ASN  30          HD21      ASN  30 -11.743 -12.762   8.403
  237   2HD2  ASN  30          HD22      ASN  30 -11.547 -12.512  10.070
  238    H    GLY  31           HN       GLY  31 -11.269 -10.903   4.345
  239   1HA   GLY  31          HA2       GLY  31 -12.143 -10.851   2.141
  240   2HA   GLY  31          HA1       GLY  31 -13.765 -11.048   2.810
  241    H    SER  32           HN       SER  32 -11.738  -8.598   4.172
  242    HA   SER  32           HA       SER  32 -13.599  -6.501   3.675
  243   1HB   SER  32          HB2       SER  32 -10.631  -6.308   4.272
  244   2HB   SER  32          HB1       SER  32 -11.787  -4.986   4.411
  245    HG   SER  32           HG       SER  32 -12.177  -7.451   5.734
  246    H    MET  33           HN       MET  33 -13.679  -4.908   2.100
  247    HA   MET  33           HA       MET  33 -11.914  -5.298  -0.296
  248   1HB   MET  33          HB2       MET  33 -14.736  -4.191  -0.112
  249   2HB   MET  33          HB1       MET  33 -13.780  -4.301  -1.591
  250   1HG   MET  33          HG2       MET  33 -13.637  -6.755  -1.313
  251   2HG   MET  33          HG1       MET  33 -14.604  -6.636   0.155
  252   1HE   MET  33          HE1       MET  33 -15.619  -6.311  -4.183
  253   2HE   MET  33          HE2       MET  33 -14.147  -5.807  -3.362
  254   3HE   MET  33          HE3       MET  33 -15.471  -4.664  -3.558
  255    H    VAL  34           HN       VAL  34 -11.209  -3.322  -1.362
  256    HA   VAL  34           HA       VAL  34 -11.377  -0.851   0.342
  257    HB   VAL  34           HB       VAL  34  -8.982  -0.437  -0.392
  258   1HG1  VAL  34          HG11      VAL  34  -9.736  -2.755   1.398
  259   2HG1  VAL  34          HG12      VAL  34  -9.337  -1.102   1.868
  260   3HG1  VAL  34          HG13      VAL  34  -8.076  -2.174   1.260
  261   1HG2  VAL  34          HG21      VAL  34  -9.148  -3.387  -1.076
  262   2HG2  VAL  34          HG22      VAL  34  -7.694  -2.390  -1.119
  263   3HG2  VAL  34          HG23      VAL  34  -9.008  -2.084  -2.255
  264    H    TRP  35           HN       TRP  35 -10.975   1.150  -0.872
  265    HA   TRP  35           HA       TRP  35 -12.342   1.164  -3.427
  266   1HB   TRP  35          HB2       TRP  35 -10.754   3.295  -1.968
  267   2HB   TRP  35          HB1       TRP  35 -11.637   3.586  -3.462
  268    HD1  TRP  35           HD1      TRP  35 -12.116   3.030   0.251
  269    HE1  TRP  35           HE1      TRP  35 -14.568   3.517   0.867
  270    HE3  TRP  35           HE3      TRP  35 -14.119   3.497  -4.419
  271    HZ2  TRP  35           HZ2      TRP  35 -17.058   4.023  -0.447
  272    HZ3  TRP  35           HZ3      TRP  35 -16.534   3.972  -4.707
  273    HH2  TRP  35           HH2      TRP  35 -18.004   4.239  -2.731
  274    H    SER  36           HN       SER  36 -11.435   0.986  -5.448
  275    HA   SER  36           HA       SER  36  -8.608   0.406  -5.726
  276   1HB   SER  36          HB2       SER  36  -9.064   0.140  -8.056
  277   2HB   SER  36          HB1       SER  36 -10.507  -0.439  -7.228
  278    HG   SER  36           HG       SER  36 -10.094   1.856  -8.756
  279    H    ILE  37           HN       ILE  37  -7.014   1.761  -6.754
  280    HA   ILE  37           HA       ILE  37  -7.764   4.640  -7.116
  281    HB   ILE  37           HB       ILE  37  -5.569   5.228  -6.015
  282   1HG1  ILE  37          HG12      ILE  37  -5.695   2.434  -4.870
  283   2HG1  ILE  37          HG11      ILE  37  -4.717   2.804  -6.284
  284   1HG2  ILE  37          HG21      ILE  37  -6.445   4.671  -3.655
  285   2HG2  ILE  37          HG22      ILE  37  -7.795   3.887  -4.475
  286   3HG2  ILE  37          HG23      ILE  37  -7.506   5.611  -4.703
  287   1HD1  ILE  37          HD11      ILE  37  -3.428   4.439  -5.045
  288   2HD1  ILE  37          HD12      ILE  37  -3.443   2.935  -4.124
  289   3HD1  ILE  37          HD13      ILE  37  -4.487   4.272  -3.644
  290    H    ASN  38           HN       ASN  38  -6.019   5.832  -8.317
  291    HA   ASN  38           HA       ASN  38  -5.006   4.137 -10.521
  292   1HB   ASN  38          HB2       ASN  38  -4.941   7.145 -10.088
  293   2HB   ASN  38          HB1       ASN  38  -4.381   6.322 -11.545
  294   1HD2  ASN  38          HD21      ASN  38  -6.330   4.463 -12.089
  295   2HD2  ASN  38          HD22      ASN  38  -7.843   5.205 -12.288
  296    H    LEU  39           HN       LEU  39  -2.954   3.349 -10.425
  297    HA   LEU  39           HA       LEU  39  -1.165   4.218  -8.285
  298   1HB   LEU  39          HB2       LEU  39  -0.866   2.214 -10.535
  299   2HB   LEU  39          HB1       LEU  39   0.378   2.496  -9.322
  300    HG   LEU  39           HG       LEU  39  -0.975   0.549  -8.710
  301   1HD1  LEU  39          HD11      LEU  39  -0.225   2.406  -6.975
  302   2HD1  LEU  39          HD12      LEU  39  -1.236   1.060  -6.467
  303   3HD1  LEU  39          HD13      LEU  39  -1.963   2.633  -6.787
  304   1HD2  LEU  39          HD21      LEU  39  -3.050   1.568  -9.947
  305   2HD2  LEU  39          HD22      LEU  39  -3.405   2.300  -8.381
  306   3HD2  LEU  39          HD23      LEU  39  -3.307   0.547  -8.534
  307    H    THR  40           HN       THR  40   0.153   5.948  -8.498
  308    HA   THR  40           HA       THR  40   1.505   6.433 -11.105
  309    HB   THR  40           HB       THR  40   1.042   8.898 -10.829
  310    HG1  THR  40           HG1      THR  40  -0.283   7.858  -8.645
  311   1HG2  THR  40          HG21      THR  40  -1.389   7.113 -11.133
  312   2HG2  THR  40          HG22      THR  40  -0.239   7.499 -12.412
  313   3HG2  THR  40          HG23      THR  40  -1.247   8.770 -11.720
  314    H    ALA  41           HN       ALA  41   1.586   8.933  -8.734
  315    HA   ALA  41           HA       ALA  41   4.266   7.962  -7.762
  316   1HB   ALA  41          HB1       ALA  41   3.314  10.807  -8.227
  317   2HB   ALA  41          HB2       ALA  41   4.471   9.929  -9.229
  318   3HB   ALA  41          HB3       ALA  41   4.884  10.351  -7.567
  319    H    GLY  42           HN       GLY  42   1.498  10.068  -6.879
  320   1HA   GLY  42          HA2       GLY  42   2.212  10.059  -4.060
  321   2HA   GLY  42          HA1       GLY  42   0.693  10.651  -4.737
  322    H    MET  43           HN       MET  43   1.939   7.433  -5.337
  323    HA   MET  43           HA       MET  43  -0.486   6.110  -4.701
  324   1HB   MET  43          HB2       MET  43   2.330   4.997  -4.686
  325   2HB   MET  43          HB1       MET  43   0.851   4.048  -4.798
  326   1HG   MET  43          HG2       MET  43   0.273   5.322  -6.871
  327   2HG   MET  43          HG1       MET  43   1.854   6.089  -6.796
  328   1HE   MET  43          HE1       MET  43   3.661   3.311  -5.691
  329   2HE   MET  43          HE2       MET  43   3.911   4.894  -6.424
  330   3HE   MET  43          HE3       MET  43   4.397   3.443  -7.295
  331    H    TYR  44           HN       TYR  44   2.410   6.714  -2.730
  332    HA   TYR  44           HA       TYR  44   1.698   5.099  -0.505
  333   1HB   TYR  44          HB2       TYR  44   3.218   7.726  -0.553
  334   2HB   TYR  44          HB1       TYR  44   3.213   6.577   0.786
  335    HD1  TYR  44           HD1      TYR  44   4.250   4.349   0.543
  336    HD2  TYR  44           HD2      TYR  44   4.459   7.279  -2.593
  337    HE1  TYR  44           HE1      TYR  44   6.058   3.052  -0.550
  338    HE2  TYR  44           HE2      TYR  44   6.269   5.981  -3.683
  339    HH   TYR  44           HH       TYR  44   7.772   4.303  -3.369
  340    H    CYS  45           HN       CYS  45   0.873   8.485  -1.255
  341    HA   CYS  45           HA       CYS  45  -0.582   8.925   1.206
  342   1HB   CYS  45          HB2       CYS  45  -1.067  10.388  -1.389
  343   2HB   CYS  45          HB1       CYS  45  -1.206  11.001   0.260
  344    H    ALA  46           HN       ALA  46  -1.703   8.386  -2.150
  345    HA   ALA  46           HA       ALA  46  -4.474   8.175  -1.538
  346   1HB   ALA  46          HB1       ALA  46  -2.807   7.033  -3.790
  347   2HB   ALA  46          HB2       ALA  46  -3.790   8.497  -3.818
  348   3HB   ALA  46          HB3       ALA  46  -4.566   6.915  -3.741
  349    H    ALA  47           HN       ALA  47  -1.978   5.642  -1.794
  350    HA   ALA  47           HA       ALA  47  -3.767   3.452  -1.384
  351   1HB   ALA  47          HB1       ALA  47  -1.492   3.138  -2.254
  352   2HB   ALA  47          HB2       ALA  47  -1.737   2.167  -0.802
  353   3HB   ALA  47          HB3       ALA  47  -0.818   3.670  -0.712
  354    H    LEU  48           HN       LEU  48  -1.944   5.467   0.921
  355    HA   LEU  48           HA       LEU  48  -2.472   3.922   3.241
  356   1HB   LEU  48          HB2       LEU  48  -0.862   5.783   3.209
  357   2HB   LEU  48          HB1       LEU  48  -2.180   6.932   3.001
  358    HG   LEU  48           HG       LEU  48  -3.123   6.238   5.192
  359   1HD1  LEU  48          HD11      LEU  48  -1.416   4.885   6.651
  360   2HD1  LEU  48          HD12      LEU  48  -0.789   4.330   5.099
  361   3HD1  LEU  48          HD13      LEU  48  -2.467   4.010   5.541
  362   1HD2  LEU  48          HD21      LEU  48  -1.506   8.116   5.047
  363   2HD2  LEU  48          HD22      LEU  48  -0.183   6.984   5.328
  364   3HD2  LEU  48          HD23      LEU  48  -1.386   7.265   6.587
  365    H    GLU  49           HN       GLU  49  -4.362   6.699   1.941
  366    HA   GLU  49           HA       GLU  49  -6.361   6.615   3.961
  367   1HB   GLU  49          HB2       GLU  49  -7.846   7.716   2.196
  368   2HB   GLU  49          HB1       GLU  49  -6.325   8.537   2.552
  369   1HG   GLU  49          HG2       GLU  49  -5.284   7.511   0.593
  370   2HG   GLU  49          HG1       GLU  49  -6.776   6.634   0.240
  371    H    SER  50           HN       SER  50  -6.088   4.767   0.939
  372    HA   SER  50           HA       SER  50  -8.721   3.629   1.070
  373   1HB   SER  50          HB2       SER  50  -7.228   3.525  -0.938
  374   2HB   SER  50          HB1       SER  50  -6.219   2.362  -0.084
  375    HG   SER  50           HG       SER  50  -8.542   1.376   0.200
  376    H    LEU  51           HN       LEU  51  -5.599   2.621   2.441
  377    HA   LEU  51           HA       LEU  51  -6.529   0.119   3.519
  378   1HB   LEU  51          HB2       LEU  51  -4.264   1.929   4.413
  379   2HB   LEU  51          HB1       LEU  51  -4.516   0.285   4.991
  380    HG   LEU  51           HG       LEU  51  -4.117   1.021   2.078
  381   1HD1  LEU  51          HD11      LEU  51  -2.125   1.504   3.473
  382   2HD1  LEU  51          HD12      LEU  51  -1.838   0.170   2.354
  383   3HD1  LEU  51          HD13      LEU  51  -2.150  -0.159   4.059
  384   1HD2  LEU  51          HD21      LEU  51  -3.498  -1.551   2.127
  385   2HD2  LEU  51          HD22      LEU  51  -5.187  -1.064   2.055
  386   3HD2  LEU  51          HD23      LEU  51  -4.483  -1.564   3.591
  387    H    ILE  52           HN       ILE  52  -6.399   3.415   4.819
  388    HA   ILE  52           HA       ILE  52  -7.021   2.895   7.505
  389    HB   ILE  52           HB       ILE  52  -7.803   5.192   5.699
  390   1HG1  ILE  52          HG12      ILE  52  -5.402   4.943   6.156
  391   2HG1  ILE  52          HG11      ILE  52  -6.033   6.385   6.934
  392   1HG2  ILE  52          HG21      ILE  52  -9.451   5.264   7.395
  393   2HG2  ILE  52          HG22      ILE  52  -8.222   6.436   7.871
  394   3HG2  ILE  52          HG23      ILE  52  -8.286   4.856   8.654
  395   1HD1  ILE  52          HD11      ILE  52  -6.344   4.638   8.978
  396   2HD1  ILE  52          HD12      ILE  52  -4.851   5.530   8.712
  397   3HD1  ILE  52          HD13      ILE  52  -4.993   3.869   8.148
  398    H    ASN  53           HN       ASN  53  -9.018   2.329   4.758
  399    HA   ASN  53           HA       ASN  53 -11.527   2.488   6.295
  400   1HB   ASN  53          HB2       ASN  53 -10.909   1.461   3.510
  401   2HB   ASN  53          HB1       ASN  53 -12.526   1.492   4.213
  402   1HD2  ASN  53          HD21      ASN  53 -10.837   3.180   2.040
  403   2HD2  ASN  53          HD22      ASN  53 -11.359   4.761   2.374
  404    H    VAL  54           HN       VAL  54  -9.011   0.241   5.886
  405    HA   VAL  54           HA       VAL  54 -10.726  -2.128   6.389
  406    HB   VAL  54           HB       VAL  54  -7.703  -1.946   6.193
  407   1HG1  VAL  54          HG11      VAL  54  -7.999  -4.389   5.598
  408   2HG1  VAL  54          HG12      VAL  54  -9.687  -4.235   6.084
  409   3HG1  VAL  54          HG13      VAL  54  -8.402  -3.989   7.266
  410   1HG2  VAL  54          HG21      VAL  54  -8.111  -2.828   3.861
  411   2HG2  VAL  54          HG22      VAL  54  -8.643  -1.165   4.107
  412   3HG2  VAL  54          HG23      VAL  54  -9.823  -2.475   4.091
  413    H    SER  55           HN       SER  55 -11.147  -2.773   8.443
  414    HA   SER  55           HA       SER  55  -9.284  -1.911  10.639
  415   1HB   SER  55          HB2       SER  55 -12.310  -2.009  10.606
  416   2HB   SER  55          HB1       SER  55 -11.360  -1.845  12.080
  417    HG   SER  55           HG       SER  55 -11.116  -0.137   9.826
  418    H    GLY  56           HN       GLY  56  -8.912  -3.440  12.269
  419   1HA   GLY  56          HA2       GLY  56  -9.213  -5.520  13.420
  420   2HA   GLY  56          HA1       GLY  56 -10.312  -6.045  12.146
  421    H    CYS  57           HN       CYS  57  -7.924  -4.857  10.355
  422    HA   CYS  57           HA       CYS  57  -6.577  -7.507  10.133
  423   1HB   CYS  57          HB2       CYS  57  -6.459  -5.093   8.300
  424   2HB   CYS  57          HB1       CYS  57  -5.777  -6.685   7.970
  425    H    SER  58           HN       SER  58  -5.148  -7.329  11.928
  426    HA   SER  58           HA       SER  58  -3.436  -5.059  12.361
  427   1HB   SER  58          HB2       SER  58  -3.948  -6.667  14.144
  428   2HB   SER  58          HB1       SER  58  -3.110  -7.934  13.252
  429    HG   SER  58           HG       SER  58  -2.030  -5.536  14.319
  430    H    ALA  59           HN       ALA  59  -3.038  -8.088  10.599
  431    HA   ALA  59           HA       ALA  59  -0.311  -8.132  10.112
  432   1HB   ALA  59          HB1       ALA  59  -2.541  -8.717   8.150
  433   2HB   ALA  59          HB2       ALA  59  -1.798  -9.862   9.267
  434   3HB   ALA  59          HB3       ALA  59  -0.860  -9.200   7.930
  435    H    ILE  60           HN       ILE  60  -2.677  -5.938   8.606
  436    HA   ILE  60           HA       ILE  60  -0.510  -4.828   6.878
  437    HB   ILE  60           HB       ILE  60  -2.323  -3.621   5.738
  438   1HG1  ILE  60          HG12      ILE  60  -4.147  -5.036   7.715
  439   2HG1  ILE  60          HG11      ILE  60  -3.786  -3.312   7.740
  440   1HG2  ILE  60          HG21      ILE  60  -1.705  -6.019   5.189
  441   2HG2  ILE  60          HG22      ILE  60  -3.333  -5.545   4.705
  442   3HG2  ILE  60          HG23      ILE  60  -3.093  -6.521   6.154
  443   1HD1  ILE  60          HD11      ILE  60  -5.826  -3.439   6.560
  444   2HD1  ILE  60          HD12      ILE  60  -5.320  -4.871   5.663
  445   3HD1  ILE  60          HD13      ILE  60  -4.613  -3.298   5.287
  446    H    GLU  61           HN       GLU  61  -1.820  -4.177   9.940
  447    HA   GLU  61           HA       GLU  61  -1.970  -1.324   9.871
  448   1HB   GLU  61          HB2       GLU  61  -1.326  -3.292  12.072
  449   2HB   GLU  61          HB1       GLU  61  -1.294  -1.553  12.366
  450   1HG   GLU  61          HG2       GLU  61  -3.616  -1.348  11.645
  451   2HG   GLU  61          HG1       GLU  61  -3.669  -3.060  11.232
  452    H    LYS  62           HN       LYS  62   0.771  -3.525  10.374
  453    HA   LYS  62           HA       LYS  62   2.747  -1.529  10.916
  454   1HB   LYS  62          HB2       LYS  62   2.928  -4.258   9.608
  455   2HB   LYS  62          HB1       LYS  62   4.343  -3.288  10.024
  456   1HG   LYS  62          HG2       LYS  62   3.636  -3.239  12.376
  457   2HG   LYS  62          HG1       LYS  62   2.211  -4.197  11.982
  458   1HD   LYS  62          HD2       LYS  62   5.049  -5.133  11.461
  459   2HD   LYS  62          HD1       LYS  62   4.159  -5.519  12.932
  460   1HE   LYS  62          HE2       LYS  62   2.310  -6.396  11.303
  461   2HE   LYS  62          HE1       LYS  62   3.608  -6.414  10.109
  462   1HZ   LYS  62          HZ1       LYS  62   3.268  -8.035  12.513
  463   2HZ   LYS  62          HZ2       LYS  62   4.853  -7.611  12.069
  464   3HZ   LYS  62          HZ3       LYS  62   3.865  -8.470  10.986
  465    H    THR  63           HN       THR  63   1.489  -2.916   7.915
  466    HA   THR  63           HA       THR  63   3.275  -1.649   6.102
  467    HB   THR  63           HB       THR  63   0.360  -2.395   5.718
  468    HG1  THR  63           HG1      THR  63   2.552  -3.838   6.079
  469   1HG2  THR  63          HG21      THR  63   2.558  -1.663   3.785
  470   2HG2  THR  63          HG22      THR  63   0.964  -0.930   3.947
  471   3HG2  THR  63          HG23      THR  63   1.119  -2.558   3.297
  472    H    GLN  64           HN       GLN  64   0.221  -0.502   7.543
  473    HA   GLN  64           HA       GLN  64  -0.019   1.883   6.008
  474   1HB   GLN  64          HB2       GLN  64  -0.851   1.257   8.856
  475   2HB   GLN  64          HB1       GLN  64  -1.292   2.746   8.020
  476   1HG   GLN  64          HG2       GLN  64  -2.472   1.508   6.303
  477   2HG   GLN  64          HG1       GLN  64  -1.907  -0.027   6.965
  478   1HE2  GLN  64          HE21      GLN  64  -4.741   0.894   6.689
  479   2HE2  GLN  64          HE22      GLN  64  -5.386   0.876   8.259
  480    H    ARG  65           HN       ARG  65   1.690   1.269   9.076
  481    HA   ARG  65           HA       ARG  65   2.577   3.948   9.484
  482   1HB   ARG  65          HB2       ARG  65   2.671   2.128  11.191
  483   2HB   ARG  65          HB1       ARG  65   3.984   1.384  10.281
  484   1HG   ARG  65          HG2       ARG  65   5.336   3.423  10.566
  485   2HG   ARG  65          HG1       ARG  65   4.027   4.170  11.480
  486   1HD   ARG  65          HD2       ARG  65   4.149   2.305  13.117
  487   2HD   ARG  65          HD1       ARG  65   5.521   1.635  12.245
  488    HE   ARG  65           HE       ARG  65   5.561   3.761  14.199
  489   1HH1  ARG  65          HH21      ARG  65   6.929   2.898  11.147
  490   2HH1  ARG  65          HH22      ARG  65   8.254   4.001  11.297
  491   1HH2  ARG  65          HH11      ARG  65   7.280   5.175  14.405
  492   2HH2  ARG  65          HH12      ARG  65   8.458   5.282  13.139
  493    H    MET  66           HN       MET  66   4.189   1.183   7.867
  494    HA   MET  66           HA       MET  66   6.517   2.669   7.124
  495   1HB   MET  66          HB2       MET  66   5.249   0.192   5.927
  496   2HB   MET  66          HB1       MET  66   6.793   0.850   5.379
  497   1HG   MET  66          HG2       MET  66   7.647   0.701   7.719
  498   2HG   MET  66          HG1       MET  66   6.136  -0.067   8.195
  499   1HE   MET  66          HE1       MET  66   5.200  -2.023   7.386
  500   2HE   MET  66          HE2       MET  66   6.058  -3.450   6.821
  501   3HE   MET  66          HE3       MET  66   5.527  -2.237   5.662
  502    H    LEU  67           HN       LEU  67   3.403   2.158   5.427
  503    HA   LEU  67           HA       LEU  67   4.173   3.470   2.998
  504   1HB   LEU  67          HB2       LEU  67   1.475   3.259   4.364
  505   2HB   LEU  67          HB1       LEU  67   1.693   3.969   2.771
  506    HG   LEU  67           HG       LEU  67   2.558   1.148   3.468
  507   1HD1  LEU  67          HD11      LEU  67   0.480   0.509   2.172
  508   2HD1  LEU  67          HD12      LEU  67  -0.017   2.198   2.271
  509   3HD1  LEU  67          HD13      LEU  67   0.167   1.247   3.744
  510   1HD2  LEU  67          HD21      LEU  67   2.268   1.009   0.873
  511   2HD2  LEU  67          HD22      LEU  67   3.710   1.792   1.507
  512   3HD2  LEU  67          HD23      LEU  67   2.364   2.768   0.925
  513    H    SER  68           HN       SER  68   2.864   4.658   6.055
  514    HA   SER  68           HA       SER  68   2.511   7.378   5.303
  515   1HB   SER  68          HB2       SER  68   3.174   6.117   7.975
  516   2HB   SER  68          HB1       SER  68   2.800   7.828   7.777
  517    HG   SER  68           HG       SER  68   1.093   5.909   8.105
  518    H    GLY  69           HN       GLY  69   5.341   5.613   6.516
  519   1HA   GLY  69          HA2       GLY  69   7.120   7.737   6.942
  520   2HA   GLY  69          HA1       GLY  69   7.622   6.163   6.321
  521    H    PHE  70           HN       PHE  70   5.729   6.613   3.970
  522    HA   PHE  70           HA       PHE  70   7.674   8.155   2.326
  523   1HB   PHE  70          HB2       PHE  70   5.431   6.234   1.675
  524   2HB   PHE  70          HB1       PHE  70   6.192   7.223   0.432
  525    HD1  PHE  70           HD1      PHE  70   8.525   6.868  -0.222
  526    HD2  PHE  70           HD2      PHE  70   6.670   4.437   2.793
  527    HE1  PHE  70           HE1      PHE  70  10.372   5.229  -0.412
  528    HE2  PHE  70           HE2      PHE  70   8.522   2.798   2.606
  529    HZ   PHE  70           HZ       PHE  70  10.372   3.191   1.000
  530    H    CYS  71           HN       CYS  71   4.479   8.420   3.687
  531    HA   CYS  71           HA       CYS  71   4.154  11.052   2.307
  532   1HB   CYS  71          HB2       CYS  71   2.757   9.201   1.212
  533   2HB   CYS  71          HB1       CYS  71   1.809   9.191   2.702
  534    HA   PRO  72           HA       PRO  72   3.634  11.649   6.906
  535   1HB   PRO  72          HB2       PRO  72   3.680  14.487   6.010
  536   2HB   PRO  72          HB1       PRO  72   4.662  13.684   7.242
  537   1HG   PRO  72          HG2       PRO  72   5.663  14.444   4.828
  538   2HG   PRO  72          HG1       PRO  72   6.284  13.047   5.723
  539   1HD   PRO  72          HD2       PRO  72   4.591  13.101   3.269
  540   2HD   PRO  72          HD1       PRO  72   5.719  11.840   3.836
  541    H    HIS  73           HN       HIS  73   1.381  11.157   5.074
  542    HA   HIS  73           HA       HIS  73  -0.506  13.368   5.532
  543   1HB   HIS  73          HB2       HIS  73  -0.158  11.434   3.550
  544   2HB   HIS  73          HB1       HIS  73  -1.602  10.879   4.380
  545    HD1  HIS  73           HD1      HIS  73  -3.705  12.358   4.217
  546    HD2  HIS  73           HD2      HIS  73  -0.392  13.955   2.273
  547    HE1  HIS  73           HE1      HIS  73  -4.579  14.262   2.814
  548    H    LYS  74           HN       LYS  74  -1.429  13.468   7.532
  549    HA   LYS  74           HA       LYS  74  -2.005  11.016   9.067
  550   1HB   LYS  74          HB2       LYS  74  -2.617  13.950   9.565
  551   2HB   LYS  74          HB1       LYS  74  -3.047  12.656  10.684
  552   1HG   LYS  74          HG2       LYS  74  -0.655  12.007  10.824
  553   2HG   LYS  74          HG1       LYS  74  -0.239  13.353   9.767
  554   1HD   LYS  74          HD2       LYS  74  -1.599  13.589  12.472
  555   2HD   LYS  74          HD1       LYS  74   0.095  13.945  12.145
  556   1HE   LYS  74          HE2       LYS  74  -2.354  15.469  11.294
  557   2HE   LYS  74          HE1       LYS  74  -0.869  16.073  12.023
  558   1HZ   LYS  74          HZ1       LYS  74   0.244  15.310   9.893
  559   2HZ   LYS  74          HZ2       LYS  74  -0.739  16.692   9.796
  560   3HZ   LYS  74          HZ3       LYS  74  -1.315  15.196   9.235
  561    H    VAL  75           HN       VAL  75  -3.552   9.937   7.731
  562    HA   VAL  75           HA       VAL  75  -5.985  11.446   6.926
  563    HB   VAL  75           HB       VAL  75  -5.348   8.549   6.356
  564   1HG1  VAL  75          HG11      VAL  75  -7.694   9.688   6.014
  565   2HG1  VAL  75          HG12      VAL  75  -7.024   8.699   4.728
  566   3HG1  VAL  75          HG13      VAL  75  -6.921  10.454   4.626
  567   1HG2  VAL  75          HG21      VAL  75  -3.478  10.000   5.583
  568   2HG2  VAL  75          HG22      VAL  75  -4.639  10.991   4.701
  569   3HG2  VAL  75          HG23      VAL  75  -4.377   9.315   4.229
  570    H    SER  76           HN       SER  76  -7.846  11.291   8.047
  571    HA   SER  76           HA       SER  76  -8.049   9.288  10.246
  572   1HB   SER  76          HB2       SER  76  -8.474  11.638  10.832
  573   2HB   SER  76          HB1       SER  76  -9.726  11.735   9.598
  574    HG   SER  76           HG       SER  76 -10.119  11.094  12.031
  575    H    ALA  77           HN       ALA  77 -10.194   8.200  10.488
  576    HA   ALA  77           HA       ALA  77 -10.974   6.835   8.128
  577   1HB   ALA  77          HB1       ALA  77 -12.940   6.077   9.508
  578   2HB   ALA  77          HB2       ALA  77 -12.403   7.184  10.773
  579   3HB   ALA  77          HB3       ALA  77 -11.376   5.835  10.285
  580    H    GLY  78           HN       GLY  78 -12.146   9.847   9.495
  581   1HA   GLY  78          HA2       GLY  78 -14.487   9.853   7.668
  582   2HA   GLY  78          HA1       GLY  78 -14.136  11.062   8.903
  583    H    GLN  79           HN       GLN  79 -11.268  11.185   7.909
  584    HA   GLN  79           HA       GLN  79 -11.797  13.193   5.801
  585   1HB   GLN  79          HB2       GLN  79  -9.238  12.404   7.221
  586   2HB   GLN  79          HB1       GLN  79  -9.389  13.728   6.068
  587   1HG   GLN  79          HG2       GLN  79 -11.058  13.527   8.587
  588   2HG   GLN  79          HG1       GLN  79  -9.543  14.428   8.497
  589   1HE2  GLN  79          HE21      GLN  79 -12.545  15.283   8.722
  590   2HE2  GLN  79          HE22      GLN  79 -12.692  16.478   7.525
  591    H    PHE  80           HN       PHE  80 -11.608  12.708   3.692
  592    HA   PHE  80           HA       PHE  80  -9.790  10.474   2.855
  593   1HB   PHE  80          HB2       PHE  80 -12.604  11.068   1.907
  594   2HB   PHE  80          HB1       PHE  80 -11.500   9.974   1.071
  595    HD1  PHE  80           HD1      PHE  80 -13.875  10.290   3.741
  596    HD2  PHE  80           HD2      PHE  80 -10.439   8.064   2.444
  597    HE1  PHE  80           HE1      PHE  80 -14.454   8.472   5.326
  598    HE2  PHE  80           HE2      PHE  80 -11.019   6.246   4.027
  599    HZ   PHE  80           HZ       PHE  80 -13.026   6.449   5.469
  600    H    SER  81           HN       SER  81  -8.654  10.866   0.932
  601    HA   SER  81           HA       SER  81  -8.945  13.631  -0.215
  602   1HB   SER  81          HB2       SER  81  -6.441  11.955   0.081
  603   2HB   SER  81          HB1       SER  81  -6.525  13.576  -0.603
  604    HG   SER  81           HG       SER  81  -6.150  14.082   1.427
  605    H    SER  82           HN       SER  82  -8.006  10.257  -1.013
  606    HA   SER  82           HA       SER  82  -8.180  10.937  -3.907
  607   1HB   SER  82          HB2       SER  82  -6.247   9.615  -3.014
  608   2HB   SER  82          HB1       SER  82  -7.376   8.320  -2.627
  609    HG   SER  82           HG       SER  82  -7.636   7.905  -4.704
  610    H    LEU  83           HN       LEU  83 -10.283   9.725  -1.552
  611    HA   LEU  83           HA       LEU  83 -11.633   7.815  -3.335
  612   1HB   LEU  83          HB2       LEU  83 -12.647   9.014  -0.742
  613   2HB   LEU  83          HB1       LEU  83 -13.239   7.561  -1.539
  614    HG   LEU  83           HG       LEU  83 -10.578   7.974  -0.171
  615   1HD1  LEU  83          HD11      LEU  83 -11.301   6.235   1.278
  616   2HD1  LEU  83          HD12      LEU  83 -12.597   5.756   0.181
  617   3HD1  LEU  83          HD13      LEU  83 -12.714   7.273   1.073
  618   1HD2  LEU  83          HD21      LEU  83 -10.193   5.526  -0.908
  619   2HD2  LEU  83          HD22      LEU  83  -9.944   6.776  -2.125
  620   3HD2  LEU  83          HD23      LEU  83 -11.433   5.829  -2.125
  621    H    HIS  84           HN       HIS  84 -11.285  10.619  -4.216
  622    HA   HIS  84           HA       HIS  84 -13.941  11.840  -4.128
  623   1HB   HIS  84          HB2       HIS  84 -11.550  12.460  -5.895
  624   2HB   HIS  84          HB1       HIS  84 -12.980  13.476  -5.700
  625    HD1  HIS  84           HD1      HIS  84 -12.456  12.096  -2.497
  626    HD2  HIS  84           HD2      HIS  84 -10.556  15.122  -4.641
  627    HE1  HIS  84           HE1      HIS  84 -11.202  13.491  -0.803
  628    H    VAL  85           HN       VAL  85 -12.116   9.767  -6.291
  629    HA   VAL  85           HA       VAL  85 -13.946  10.036  -8.530
  630    HB   VAL  85           HB       VAL  85 -12.725   7.974  -9.369
  631   1HG1  VAL  85          HG11      VAL  85 -11.974  10.265  -9.904
  632   2HG1  VAL  85          HG12      VAL  85 -10.600   9.176  -9.711
  633   3HG1  VAL  85          HG13      VAL  85 -11.024  10.300  -8.419
  634   1HG2  VAL  85          HG21      VAL  85 -12.194   7.058  -7.107
  635   2HG2  VAL  85          HG22      VAL  85 -11.099   8.414  -6.840
  636   3HG2  VAL  85          HG23      VAL  85 -10.754   7.240  -8.108
  637    H    ARG  86           HN       ARG  86 -15.537   8.501  -9.200
  638    HA   ARG  86           HA       ARG  86 -16.711   6.971  -6.947
  639   1HB   ARG  86          HB2       ARG  86 -17.711   7.616  -9.737
  640   2HB   ARG  86          HB1       ARG  86 -18.601   6.618  -8.586
  641   1HG   ARG  86          HG2       ARG  86 -18.585   8.475  -6.972
  642   2HG   ARG  86          HG1       ARG  86 -17.722   9.483  -8.128
  643   1HD   ARG  86          HD2       ARG  86 -19.627   9.077  -9.745
  644   2HD   ARG  86          HD1       ARG  86 -20.519   8.341  -8.418
  645    HE   ARG  86           HE       ARG  86 -20.246  11.148  -8.946
  646   1HH1  ARG  86          HH21      ARG  86 -20.127   8.912  -6.308
  647   2HH1  ARG  86          HH22      ARG  86 -20.315  10.143  -5.107
  648   1HH2  ARG  86          HH11      ARG  86 -20.508  12.729  -7.399
  649   2HH2  ARG  86          HH12      ARG  86 -20.547  12.297  -5.723
  650    H    ASP  87           HN       ASP  87 -14.483   5.698  -7.430
  651    HA   ASP  87           HA       ASP  87 -14.726   3.696  -9.560
  652   1HB   ASP  87          HB2       ASP  87 -12.750   4.075  -7.294
  653   2HB   ASP  87          HB1       ASP  87 -12.651   2.750  -8.455
  654    H    THR  88           HN       THR  88 -14.461   1.313  -8.870
  655    HA   THR  88           HA       THR  88 -16.533   0.738  -6.817
  656    HB   THR  88           HB       THR  88 -16.893  -0.388  -8.909
  657    HG1  THR  88           HG1      THR  88 -16.902  -2.461  -8.195
  658   1HG2  THR  88          HG21      THR  88 -14.694  -0.163  -9.890
  659   2HG2  THR  88          HG22      THR  88 -15.107  -1.878  -9.860
  660   3HG2  THR  88          HG23      THR  88 -13.991  -1.218  -8.663
  661    H    LYS  89           HN       LYS  89 -16.103  -1.069  -5.294
  662    HA   LYS  89           HA       LYS  89 -13.397  -0.825  -4.141
  663   1HB   LYS  89          HB2       LYS  89 -15.852  -2.341  -3.202
  664   2HB   LYS  89          HB1       LYS  89 -14.355  -2.162  -2.290
  665   1HG   LYS  89          HG2       LYS  89 -14.635   0.280  -2.277
  666   2HG   LYS  89          HG1       LYS  89 -16.136   0.114  -3.192
  667   1HD   LYS  89          HD2       LYS  89 -17.101  -1.237  -1.365
  668   2HD   LYS  89          HD1       LYS  89 -15.605  -1.068  -0.449
  669   1HE   LYS  89          HE2       LYS  89 -17.048   1.393  -1.404
  670   2HE   LYS  89          HE1       LYS  89 -17.607   0.558   0.045
  671   1HZ   LYS  89          HZ1       LYS  89 -15.378   0.734   0.962
  672   2HZ   LYS  89          HZ2       LYS  89 -16.007   2.269   0.598
  673   3HZ   LYS  89          HZ3       LYS  89 -14.849   1.558  -0.423
  674    H    ILE  90           HN       ILE  90 -12.039  -2.665  -3.739
  675    HA   ILE  90           HA       ILE  90 -12.697  -5.156  -5.269
  676    HB   ILE  90           HB       ILE  90 -10.278  -5.218  -5.963
  677   1HG1  ILE  90          HG12      ILE  90 -10.306  -2.323  -5.050
  678   2HG1  ILE  90          HG11      ILE  90  -9.508  -3.628  -4.171
  679   1HG2  ILE  90          HG21      ILE  90 -10.575  -3.722  -7.816
  680   2HG2  ILE  90          HG22      ILE  90 -11.688  -2.708  -6.899
  681   3HG2  ILE  90          HG23      ILE  90 -12.179  -4.326  -7.400
  682   1HD1  ILE  90          HD11      ILE  90  -7.816  -2.607  -5.524
  683   2HD1  ILE  90          HD12      ILE  90  -8.864  -2.599  -6.943
  684   3HD1  ILE  90          HD13      ILE  90  -8.232  -4.124  -6.322
  685    H    GLU  91           HN       GLU  91 -11.385  -7.030  -4.520
  686    HA   GLU  91           HA       GLU  91 -11.353  -7.225  -1.661
  687   1HB   GLU  91          HB2       GLU  91 -10.121  -8.968  -3.816
  688   2HB   GLU  91          HB1       GLU  91 -10.120  -9.395  -2.105
  689   1HG   GLU  91          HG2       GLU  91 -12.588  -9.279  -2.068
  690   2HG   GLU  91          HG1       GLU  91 -12.589  -8.854  -3.781
  691    H    VAL  92           HN       VAL  92  -9.608  -7.157  -0.207
  692    HA   VAL  92           HA       VAL  92  -7.474  -5.368  -0.762
  693    HB   VAL  92           HB       VAL  92  -7.759  -7.509   1.365
  694   1HG1  VAL  92          HG11      VAL  92  -5.654  -5.380   0.942
  695   2HG1  VAL  92          HG12      VAL  92  -5.421  -7.100   1.258
  696   3HG1  VAL  92          HG13      VAL  92  -5.997  -6.038   2.543
  697   1HG2  VAL  92          HG21      VAL  92  -7.959  -4.508   1.681
  698   2HG2  VAL  92          HG22      VAL  92  -8.562  -5.768   2.757
  699   3HG2  VAL  92          HG23      VAL  92  -9.356  -5.474   1.213
  700    H    ALA  93           HN       ALA  93  -7.590  -8.921  -0.874
  701    HA   ALA  93           HA       ALA  93  -4.904  -9.562  -1.183
  702   1HB   ALA  93          HB1       ALA  93  -7.355 -10.683  -2.554
  703   2HB   ALA  93          HB2       ALA  93  -6.478 -11.347  -1.175
  704   3HB   ALA  93          HB3       ALA  93  -5.753 -11.385  -2.783
  705    H    GLN  94           HN       GLN  94  -7.100  -8.450  -3.778
  706    HA   GLN  94           HA       GLN  94  -4.978  -8.467  -5.766
  707   1HB   GLN  94          HB2       GLN  94  -7.352  -8.748  -6.387
  708   2HB   GLN  94          HB1       GLN  94  -7.689  -7.111  -5.822
  709   1HG   GLN  94          HG2       GLN  94  -6.172  -6.178  -7.487
  710   2HG   GLN  94          HG1       GLN  94  -5.699  -7.797  -8.004
  711   1HE2  GLN  94          HE21      GLN  94  -6.672  -8.207  -9.978
  712   2HE2  GLN  94          HE22      GLN  94  -8.283  -7.842 -10.366
  713    H    PHE  95           HN       PHE  95  -6.342  -6.072  -3.570
  714    HA   PHE  95           HA       PHE  95  -5.260  -3.725  -4.779
  715   1HB   PHE  95          HB2       PHE  95  -6.869  -3.639  -2.912
  716   2HB   PHE  95          HB1       PHE  95  -5.667  -4.355  -1.837
  717    HD1  PHE  95           HD1      PHE  95  -6.732  -1.314  -3.574
  718    HD2  PHE  95           HD2      PHE  95  -3.623  -3.113  -1.221
  719    HE1  PHE  95           HE1      PHE  95  -5.772   0.924  -3.127
  720    HE2  PHE  95           HE2      PHE  95  -2.663  -0.872  -0.776
  721    HZ   PHE  95           HZ       PHE  95  -3.736   1.147  -1.732
  722    H    VAL  96           HN       VAL  96  -3.895  -5.869  -2.271
  723    HA   VAL  96           HA       VAL  96  -1.412  -4.496  -2.026
  724    HB   VAL  96           HB       VAL  96  -2.014  -7.445  -1.658
  725   1HG1  VAL  96          HG11      VAL  96  -0.019  -7.182  -0.033
  726   2HG1  VAL  96          HG12      VAL  96   0.339  -5.701  -0.920
  727   3HG1  VAL  96          HG13      VAL  96   0.342  -7.253  -1.758
  728   1HG2  VAL  96          HG21      VAL  96  -1.843  -5.284   0.453
  729   2HG2  VAL  96          HG22      VAL  96  -2.468  -6.924   0.627
  730   3HG2  VAL  96          HG23      VAL  96  -3.365  -5.734  -0.316
  731    H    LYS  97           HN       LYS  97  -2.363  -7.248  -4.106
  732    HA   LYS  97           HA       LYS  97   0.193  -7.636  -5.297
  733   1HB   LYS  97          HB2       LYS  97  -2.597  -8.141  -6.361
  734   2HB   LYS  97          HB1       LYS  97  -1.127  -8.683  -7.174
  735   1HG   LYS  97          HG2       LYS  97  -0.473  -9.952  -5.159
  736   2HG   LYS  97          HG1       LYS  97  -1.942  -9.413  -4.345
  737   1HD   LYS  97          HD2       LYS  97  -3.312 -10.519  -6.068
  738   2HD   LYS  97          HD1       LYS  97  -1.848 -11.062  -6.888
  739   1HE   LYS  97          HE2       LYS  97  -2.509 -11.752  -4.012
  740   2HE   LYS  97          HE1       LYS  97  -2.895 -12.795  -5.381
  741   1HZ   LYS  97          HZ1       LYS  97  -0.667 -13.143  -5.851
  742   2HZ   LYS  97          HZ2       LYS  97  -0.700 -13.171  -4.152
  743   3HZ   LYS  97          HZ3       LYS  97  -0.153 -11.786  -4.972
  744    H    ASP  98           HN       ASP  98  -2.542  -5.572  -6.372
  745    HA   ASP  98           HA       ASP  98  -1.302  -4.648  -8.771
  746   1HB   ASP  98          HB2       ASP  98  -3.278  -3.309  -6.899
  747   2HB   ASP  98          HB1       ASP  98  -2.809  -2.630  -8.458
  748    H    LEU  99           HN       LEU  99  -1.145  -3.453  -5.440
  749    HA   LEU  99           HA       LEU  99   0.448  -1.139  -5.990
  750   1HB   LEU  99          HB2       LEU  99  -0.779  -1.467  -3.875
  751   2HB   LEU  99          HB1       LEU  99   0.266  -2.827  -3.476
  752    HG   LEU  99           HG       LEU  99   2.228  -1.325  -3.454
  753   1HD1  LEU  99          HD11      LEU  99   0.159   0.697  -4.302
  754   2HD1  LEU  99          HD12      LEU  99   1.779   0.429  -4.950
  755   3HD1  LEU  99          HD13      LEU  99   1.576   1.218  -3.389
  756   1HD2  LEU  99          HD21      LEU  99   1.449   0.098  -1.468
  757   2HD2  LEU  99          HD22      LEU  99   1.186  -1.641  -1.332
  758   3HD2  LEU  99          HD23      LEU  99  -0.156  -0.576  -1.750
  759    H    LEU 100           HN       LEU 100   1.251  -4.505  -5.293
  760    HA   LEU 100           HA       LEU 100   4.031  -4.243  -4.876
  761   1HB   LEU 100          HB2       LEU 100   2.872  -6.302  -4.385
  762   2HB   LEU 100          HB1       LEU 100   2.426  -6.509  -6.076
  763    HG   LEU 100           HG       LEU 100   4.742  -6.848  -6.705
  764   1HD1  LEU 100          HD11      LEU 100   6.431  -7.006  -4.714
  765   2HD1  LEU 100          HD12      LEU 100   5.268  -5.991  -3.861
  766   3HD1  LEU 100          HD13      LEU 100   6.022  -5.414  -5.346
  767   1HD2  LEU 100          HD21      LEU 100   4.058  -8.407  -4.196
  768   2HD2  LEU 100          HD22      LEU 100   5.208  -8.908  -5.436
  769   3HD2  LEU 100          HD23      LEU 100   3.493  -8.786  -5.823
  770    H    LEU 101           HN       LEU 101   2.316  -4.702  -8.018
  771    HA   LEU 101           HA       LEU 101   4.707  -4.953  -9.562
  772   1HB   LEU 101          HB2       LEU 101   1.923  -4.018 -10.222
  773   2HB   LEU 101          HB1       LEU 101   3.193  -3.905 -11.435
  774    HG   LEU 101           HG       LEU 101   1.785  -6.034 -11.484
  775   1HD1  LEU 101          HD11      LEU 101   3.568  -7.339 -12.228
  776   2HD1  LEU 101          HD12      LEU 101   4.672  -6.746 -10.991
  777   3HD1  LEU 101          HD13      LEU 101   4.239  -5.717 -12.356
  778   1HD2  LEU 101          HD21      LEU 101   3.464  -6.866  -9.114
  779   2HD2  LEU 101          HD22      LEU 101   2.084  -7.699  -9.826
  780   3HD2  LEU 101          HD23      LEU 101   1.842  -6.208  -8.925
  781    H    HIS 102           HN       HIS 102   2.915  -2.047  -8.585
  782    HA   HIS 102           HA       HIS 102   4.625  -0.250 -10.049
  783   1HB   HIS 102          HB2       HIS 102   2.657   0.117  -7.790
  784   2HB   HIS 102          HB1       HIS 102   3.640   1.466  -8.366
  785    HD1  HIS 102           HD1      HIS 102   3.212   2.343 -10.750
  786    HD2  HIS 102           HD2      HIS 102   0.699  -0.796  -9.660
  787    HE1  HIS 102           HE1      HIS 102   1.429   2.211 -12.535
  788    H    LEU 103           HN       LEU 103   4.720  -1.434  -6.684
  789    HA   LEU 103           HA       LEU 103   6.738   0.340  -5.782
  790   1HB   LEU 103          HB2       LEU 103   6.149  -2.532  -5.019
  791   2HB   LEU 103          HB1       LEU 103   7.314  -1.529  -4.163
  792    HG   LEU 103           HG       LEU 103   4.407  -0.747  -4.559
  793   1HD1  LEU 103          HD11      LEU 103   4.346  -1.338  -2.018
  794   2HD1  LEU 103          HD12      LEU 103   5.773  -2.312  -2.368
  795   3HD1  LEU 103          HD13      LEU 103   4.250  -2.654  -3.187
  796   1HD2  LEU 103          HD21      LEU 103   6.738   0.391  -3.011
  797   2HD2  LEU 103          HD22      LEU 103   5.096   0.661  -2.439
  798   3HD2  LEU 103          HD23      LEU 103   5.573   1.231  -4.033
  799    H    LYS 104           HN       LYS 104   7.140  -2.920  -7.233
  800    HA   LYS 104           HA       LYS 104  10.018  -2.719  -7.266
  801   1HB   LYS 104          HB2       LYS 104   9.931  -4.668  -8.784
  802   2HB   LYS 104          HB1       LYS 104   8.898  -4.894  -7.375
  803   1HG   LYS 104          HG2       LYS 104   6.924  -4.255  -8.690
  804   2HG   LYS 104          HG1       LYS 104   7.938  -3.938 -10.093
  805   1HD   LYS 104          HD2       LYS 104   7.201  -6.103 -10.558
  806   2HD   LYS 104          HD1       LYS 104   8.729  -6.433  -9.744
  807   1HE   LYS 104          HE2       LYS 104   7.249  -6.477  -7.567
  808   2HE   LYS 104          HE1       LYS 104   5.925  -6.728  -8.699
  809   1HZ   LYS 104          HZ1       LYS 104   7.192  -8.748  -7.750
  810   2HZ   LYS 104          HZ2       LYS 104   8.356  -8.361  -8.927
  811   3HZ   LYS 104          HZ3       LYS 104   6.764  -8.729  -9.391
  812    H    LYS 105           HN       LYS 105   7.527  -1.506  -9.351
  813    HA   LYS 105           HA       LYS 105   9.024  -1.278 -11.775
  814   1HB   LYS 105          HB2       LYS 105   6.556  -1.041 -11.599
  815   2HB   LYS 105          HB1       LYS 105   6.784   0.500 -10.772
  816   1HG   LYS 105          HG2       LYS 105   7.937   1.413 -12.736
  817   2HG   LYS 105          HG1       LYS 105   7.781  -0.137 -13.566
  818   1HD   LYS 105          HD2       LYS 105   5.326   0.040 -13.457
  819   2HD   LYS 105          HD1       LYS 105   5.469   1.585 -12.618
  820   1HE   LYS 105          HE2       LYS 105   5.064   1.952 -15.014
  821   2HE   LYS 105          HE1       LYS 105   6.671   2.524 -14.570
  822   1HZ   LYS 105          HZ1       LYS 105   6.192  -0.196 -15.636
  823   2HZ   LYS 105          HZ2       LYS 105   7.669   0.632 -15.501
  824   3HZ   LYS 105          HZ3       LYS 105   6.514   1.129 -16.644
  825    H    LEU 106           HN       LEU 106   8.499   1.156  -9.174
  826    HA   LEU 106           HA       LEU 106  10.108   3.166 -10.419
  827   1HB   LEU 106          HB2       LEU 106   9.237   2.687  -7.577
  828   2HB   LEU 106          HB1       LEU 106  10.364   3.988  -7.947
  829    HG   LEU 106           HG       LEU 106   7.943   4.686  -7.904
  830   1HD1  LEU 106          HD11      LEU 106   8.227   6.254  -9.577
  831   2HD1  LEU 106          HD12      LEU 106   8.871   5.091 -10.730
  832   3HD1  LEU 106          HD13      LEU 106   9.889   5.695  -9.424
  833   1HD2  LEU 106          HD21      LEU 106   7.675   3.253 -10.544
  834   2HD2  LEU 106          HD22      LEU 106   6.407   3.946  -9.533
  835   3HD2  LEU 106          HD23      LEU 106   7.231   2.474  -9.028
  836    H    PHE 107           HN       PHE 107  10.992   0.379  -8.454
  837    HA   PHE 107           HA       PHE 107  13.593   1.230  -7.691
  838   1HB   PHE 107          HB2       PHE 107  12.557  -0.829  -6.800
  839   2HB   PHE 107          HB1       PHE 107  12.687  -1.580  -8.393
  840    HD1  PHE 107           HD1      PHE 107  14.673  -0.056  -5.642
  841    HD2  PHE 107           HD2      PHE 107  14.732  -2.571  -9.124
  842    HE1  PHE 107           HE1      PHE 107  17.008  -0.694  -5.137
  843    HE2  PHE 107           HE2      PHE 107  17.075  -3.216  -8.617
  844    HZ   PHE 107           HZ       PHE 107  18.215  -2.276  -6.623
  845    H    ARG 108           HN       ARG 108  12.458  -0.319 -10.681
  846    HA   ARG 108           HA       ARG 108  15.011  -0.728 -11.865
  847   1HB   ARG 108          HB2       ARG 108  12.301  -0.185 -13.101
  848   2HB   ARG 108          HB1       ARG 108  13.730  -0.612 -14.046
  849   1HG   ARG 108          HG2       ARG 108  13.970  -2.687 -12.744
  850   2HG   ARG 108          HG1       ARG 108  12.538  -2.274 -11.808
  851   1HD   ARG 108          HD2       ARG 108  11.259  -2.184 -13.985
  852   2HD   ARG 108          HD1       ARG 108  12.674  -2.859 -14.785
  853    HE   ARG 108           HE       ARG 108  10.684  -4.316 -13.314
  854   1HH1  ARG 108          HH21      ARG 108  14.112  -4.141 -13.695
  855   2HH1  ARG 108          HH22      ARG 108  14.392  -5.693 -12.982
  856   1HH2  ARG 108          HH11      ARG 108  11.034  -6.334 -12.418
  857   2HH2  ARG 108          HH12      ARG 108  12.651  -6.935 -12.265
  858    H    GLU 109           HN       GLU 109  12.900   2.121 -11.792
  859    HA   GLU 109           HA       GLU 109  14.736   3.650 -13.510
  860   1HB   GLU 109          HB2       GLU 109  12.235   4.409 -11.977
  861   2HB   GLU 109          HB1       GLU 109  13.135   5.525 -13.007
  862   1HG   GLU 109          HG2       GLU 109  12.802   4.011 -14.933
  863   2HG   GLU 109          HG1       GLU 109  11.895   2.905 -13.901
  864    H    GLY 110           HN       GLY 110  14.560   2.849 -10.216
  865   1HA   GLY 110          HA2       GLY 110  15.755   3.616  -8.357
  866   2HA   GLY 110          HA1       GLY 110  16.858   4.365  -9.511
  867    H    ARG 111           HN       ARG 111  13.672   5.423  -9.996
  868    HA   ARG 111           HA       ARG 111  14.344   8.044  -8.756
  869   1HB   ARG 111          HB2       ARG 111  12.131   7.159 -10.638
  870   2HB   ARG 111          HB1       ARG 111  12.248   8.784  -9.961
  871   1HG   ARG 111          HG2       ARG 111  14.488   9.048 -10.957
  872   2HG   ARG 111          HG1       ARG 111  14.376   7.424 -11.637
  873   1HD   ARG 111          HD2       ARG 111  12.400   8.090 -12.940
  874   2HD   ARG 111          HD1       ARG 111  12.486   9.712 -12.252
  875    HE   ARG 111           HE       ARG 111  14.986   9.341 -13.385
  876   1HH1  ARG 111          HH21      ARG 111  11.710   9.041 -14.409
  877   2HH1  ARG 111          HH22      ARG 111  12.042   9.486 -16.050
  878   1HH2  ARG 111          HH11      ARG 111  15.440   9.932 -15.516
  879   2HH2  ARG 111          HH12      ARG 111  14.155   9.992 -16.676
  880    H    PHE 112           HN       PHE 112  14.005   7.631  -6.572
  881    HA   PHE 112           HA       PHE 112  11.471   6.421  -5.670
  882   1HB   PHE 112          HB2       PHE 112  13.782   7.546  -4.066
  883   2HB   PHE 112          HB1       PHE 112  12.494   6.495  -3.466
  884    HD1  PHE 112           HD1      PHE 112  12.283   4.160  -4.333
  885    HD2  PHE 112           HD2      PHE 112  15.642   6.651  -5.301
  886    HE1  PHE 112           HE1      PHE 112  13.551   2.169  -5.094
  887    HE2  PHE 112           HE2      PHE 112  16.904   4.653  -6.065
  888    HZ   PHE 112           HZ       PHE 112  15.854   2.413  -5.956
  889    H    ASN 113           HN       ASN 113   9.805   7.544  -4.730
  890    HA   ASN 113           HA       ASN 113   8.451   9.395  -4.250
  891   1HB   ASN 113          HB2       ASN 113  11.091  10.546  -3.290
  892   2HB   ASN 113          HB1       ASN 113   9.483  11.097  -2.820
  893   1HD2  ASN 113          HD21      ASN 113  11.876   9.570  -1.386
  894   2HD2  ASN 113          HD22      ASN 113  11.062   8.349  -0.531
  Start of MODEL   11
    1   1H    MET   1           HT1      MET   1  22.934   6.652  13.944
    2   2H    MET   1           HT2      MET   1  21.311   7.132  14.093
    3   3H    MET   1           HT3      MET   1  22.558   8.181  14.572
    4    HA   MET   1           HA       MET   1  22.997   8.873  12.495
    5   1HB   MET   1          HB2       MET   1  22.244   6.063  11.651
    6   2HB   MET   1          HB1       MET   1  22.679   7.334  10.508
    7   1HG   MET   1          HG2       MET   1  24.856   7.608  11.660
    8   2HG   MET   1          HG1       MET   1  24.427   6.299  12.761
    9   1HE   MET   1          HE1       MET   1  22.953   4.080  10.632
   10   2HE   MET   1          HE2       MET   1  23.783   4.120  12.185
   11   3HE   MET   1          HE3       MET   1  24.438   3.149  10.870
   12    H    GLY   2           HN       GLY   2  21.648   9.514  10.559
   13   1HA   GLY   2          HA2       GLY   2  18.976  10.184  11.423
   14   2HA   GLY   2          HA1       GLY   2  19.656  10.525   9.832
   15    HA   PRO   3           HA       PRO   3  16.300   7.007   9.956
   16   1HB   PRO   3          HB2       PRO   3  15.271   8.630   7.704
   17   2HB   PRO   3          HB1       PRO   3  14.409   7.992   9.110
   18   1HG   PRO   3          HG2       PRO   3  15.189  10.681   8.708
   19   2HG   PRO   3          HG1       PRO   3  14.588   9.981  10.215
   20   1HD   PRO   3          HD2       PRO   3  17.271  10.922   9.649
   21   2HD   PRO   3          HD1       PRO   3  16.661  10.211  11.165
   22    H    VAL   4           HN       VAL   4  15.738   5.712   7.844
   23    HA   VAL   4           HA       VAL   4  18.247   5.202   6.461
   24    HB   VAL   4           HB       VAL   4  16.842   3.449   5.271
   25   1HG1  VAL   4          HG11      VAL   4  16.687   3.437   8.298
   26   2HG1  VAL   4          HG12      VAL   4  18.131   3.026   7.373
   27   3HG1  VAL   4          HG13      VAL   4  16.685   2.026   7.241
   28   1HG2  VAL   4          HG21      VAL   4  14.583   3.084   5.993
   29   2HG2  VAL   4          HG22      VAL   4  14.701   4.799   5.603
   30   3HG2  VAL   4          HG23      VAL   4  14.739   4.274   7.285
   31    HA   PRO   5           HA       PRO   5  17.416   7.861   2.981
   32   1HB   PRO   5          HB2       PRO   5  18.530   6.259   0.936
   33   2HB   PRO   5          HB1       PRO   5  19.402   7.424   1.941
   34   1HG   PRO   5          HG2       PRO   5  19.358   4.466   2.109
   35   2HG   PRO   5          HG1       PRO   5  20.602   5.599   2.647
   36   1HD   PRO   5          HD2       PRO   5  18.842   4.243   4.349
   37   2HD   PRO   5          HD1       PRO   5  19.714   5.739   4.772
   38    HA   PRO   6           HA       PRO   6  13.675   6.610   0.947
   39   1HB   PRO   6          HB2       PRO   6  14.289   7.433  -1.716
   40   2HB   PRO   6          HB1       PRO   6  13.460   8.376  -0.472
   41   1HG   PRO   6          HG2       PRO   6  16.219   8.631  -1.458
   42   2HG   PRO   6          HG1       PRO   6  15.259   9.781  -0.519
   43   1HD   PRO   6          HD2       PRO   6  17.416   8.252   0.469
   44   2HD   PRO   6          HD1       PRO   6  16.203   9.096   1.462
   45    H    SER   7           HN       SER   7  16.455   5.880  -1.183
   46    HA   SER   7           HA       SER   7  15.200   3.763  -2.603
   47   1HB   SER   7          HB2       SER   7  17.443   3.112  -3.290
   48   2HB   SER   7          HB1       SER   7  17.321   4.869  -3.295
   49    HG   SER   7           HG       SER   7  19.150   4.466  -2.191
   50    H    THR   8           HN       THR   8  17.083   3.708   0.416
   51    HA   THR   8           HA       THR   8  17.092   0.828   0.611
   52    HB   THR   8           HB       THR   8  17.399   2.943   2.763
   53    HG1  THR   8           HG1      THR   8  18.942   2.781   0.972
   54   1HG2  THR   8          HG21      THR   8  17.934  -0.042   2.795
   55   2HG2  THR   8          HG22      THR   8  16.773   0.831   3.795
   56   3HG2  THR   8          HG23      THR   8  18.502   1.081   4.030
   57    H    ALA   9           HN       ALA   9  14.945   3.328   1.995
   58    HA   ALA   9           HA       ALA   9  13.326   1.558   3.531
   59   1HB   ALA   9          HB1       ALA   9  12.506   4.112   2.111
   60   2HB   ALA   9          HB2       ALA   9  13.205   4.022   3.727
   61   3HB   ALA   9          HB3       ALA   9  11.614   3.328   3.415
   62    H    LEU  10           HN       LEU  10  13.128   2.552   0.129
   63    HA   LEU  10           HA       LEU  10  10.660   1.265  -0.460
   64   1HB   LEU  10          HB2       LEU  10  12.195   2.888  -1.881
   65   2HB   LEU  10          HB1       LEU  10  12.901   1.395  -2.471
   66    HG   LEU  10           HG       LEU  10  11.189   1.955  -4.029
   67   1HD1  LEU  10          HD11      LEU  10  11.227  -0.437  -3.170
   68   2HD1  LEU  10          HD12      LEU  10   9.734   0.080  -3.950
   69   3HD1  LEU  10          HD13      LEU  10   9.819  -0.015  -2.194
   70   1HD2  LEU  10          HD21      LEU  10   9.072   2.105  -1.884
   71   2HD2  LEU  10          HD22      LEU  10   9.045   2.755  -3.519
   72   3HD2  LEU  10          HD23      LEU  10  10.034   3.527  -2.285
   73    H    ARG  11           HN       ARG  11  14.024   0.088  -0.783
   74    HA   ARG  11           HA       ARG  11  13.389  -2.534  -1.696
   75   1HB   ARG  11          HB2       ARG  11  15.729  -1.494  -0.079
   76   2HB   ARG  11          HB1       ARG  11  15.648  -3.133  -0.726
   77   1HG   ARG  11          HG2       ARG  11  15.389  -2.216  -3.007
   78   2HG   ARG  11          HG1       ARG  11  15.497  -0.580  -2.354
   79   1HD   ARG  11          HD2       ARG  11  17.682  -1.289  -3.220
   80   2HD   ARG  11          HD1       ARG  11  17.754  -1.102  -1.466
   81    HE   ARG  11           HE       ARG  11  17.135  -3.769  -1.785
   82   1HH1  ARG  11          HH21      ARG  11  19.514  -1.615  -3.041
   83   2HH1  ARG  11          HH22      ARG  11  20.728  -2.839  -3.204
   84   1HH2  ARG  11          HH11      ARG  11  18.701  -5.380  -1.994
   85   2HH2  ARG  11          HH12      ARG  11  20.268  -4.972  -2.608
   86    H    GLU  12           HN       GLU  12  13.794  -1.259   1.606
   87    HA   GLU  12           HA       GLU  12  13.500  -3.737   2.982
   88   1HB   GLU  12          HB2       GLU  12  12.836  -0.897   3.797
   89   2HB   GLU  12          HB1       GLU  12  12.739  -2.268   4.905
   90   1HG   GLU  12          HG2       GLU  12  15.117  -2.764   4.517
   91   2HG   GLU  12          HG1       GLU  12  15.224  -1.414   3.390
   92    H    LEU  13           HN       LEU  13  11.094  -1.382   1.862
   93    HA   LEU  13           HA       LEU  13   8.850  -2.700   3.082
   94   1HB   LEU  13          HB2       LEU  13   8.795  -0.346   2.356
   95   2HB   LEU  13          HB1       LEU  13   8.980  -0.854   0.681
   96    HG   LEU  13           HG       LEU  13   6.828  -2.071   0.810
   97   1HD1  LEU  13          HD11      LEU  13   6.545  -2.708   3.061
   98   2HD1  LEU  13          HD12      LEU  13   5.382  -1.399   2.880
   99   3HD1  LEU  13          HD13      LEU  13   6.933  -1.098   3.663
  100   1HD2  LEU  13          HD21      LEU  13   6.695   0.161  -0.021
  101   2HD2  LEU  13          HD22      LEU  13   6.880   0.850   1.592
  102   3HD2  LEU  13          HD23      LEU  13   5.388   0.018   1.155
  103    H    ILE  14           HN       ILE  14  10.265  -2.895  -0.207
  104    HA   ILE  14           HA       ILE  14   8.279  -4.631  -1.287
  105    HB   ILE  14           HB       ILE  14  11.229  -4.380  -1.949
  106   1HG1  ILE  14          HG12      ILE  14   8.763  -3.381  -3.411
  107   2HG1  ILE  14          HG11      ILE  14   9.711  -2.391  -2.302
  108   1HG2  ILE  14          HG21      ILE  14   9.018  -6.019  -3.187
  109   2HG2  ILE  14          HG22      ILE  14  10.660  -6.514  -2.790
  110   3HG2  ILE  14          HG23      ILE  14  10.368  -5.455  -4.167
  111   1HD1  ILE  14          HD11      ILE  14  11.706  -2.692  -3.697
  112   2HD1  ILE  14          HD12      ILE  14  10.388  -2.038  -4.668
  113   3HD1  ILE  14          HD13      ILE  14  10.805  -3.746  -4.786
  114    H    GLU  15           HN       GLU  15  11.375  -5.399   0.310
  115    HA   GLU  15           HA       GLU  15  11.156  -8.220   0.137
  116   1HB   GLU  15          HB2       GLU  15  12.549  -6.438   2.142
  117   2HB   GLU  15          HB1       GLU  15  12.710  -8.195   2.143
  118   1HG   GLU  15          HG2       GLU  15  13.569  -8.151  -0.146
  119   2HG   GLU  15          HG1       GLU  15  13.343  -6.403  -0.221
  120    H    GLU  16           HN       GLU  16   9.933  -6.012   2.680
  121    HA   GLU  16           HA       GLU  16   9.054  -8.183   4.374
  122   1HB   GLU  16          HB2       GLU  16   9.461  -5.864   5.202
  123   2HB   GLU  16          HB1       GLU  16   8.025  -5.333   4.323
  124   1HG   GLU  16          HG2       GLU  16   6.615  -6.833   5.621
  125   2HG   GLU  16          HG1       GLU  16   8.026  -7.515   6.429
  126    H    LEU  17           HN       LEU  17   7.351  -6.152   1.972
  127    HA   LEU  17           HA       LEU  17   4.755  -7.231   2.449
  128   1HB   LEU  17          HB2       LEU  17   5.998  -6.064  -0.053
  129   2HB   LEU  17          HB1       LEU  17   4.296  -6.503   0.062
  130    HG   LEU  17           HG       LEU  17   5.676  -4.579   1.957
  131   1HD1  LEU  17          HD11      LEU  17   4.593  -2.789   0.676
  132   2HD1  LEU  17          HD12      LEU  17   3.910  -3.976  -0.435
  133   3HD1  LEU  17          HD13      LEU  17   5.655  -3.729  -0.373
  134   1HD2  LEU  17          HD21      LEU  17   2.860  -5.596   1.628
  135   2HD2  LEU  17          HD22      LEU  17   3.088  -3.926   2.145
  136   3HD2  LEU  17          HD23      LEU  17   3.759  -5.241   3.103
  137    H    VAL  18           HN       VAL  18   7.301  -8.263   0.183
  138    HA   VAL  18           HA       VAL  18   5.789 -10.367  -1.026
  139    HB   VAL  18           HB       VAL  18   8.776 -10.018  -0.680
  140   1HG1  VAL  18          HG11      VAL  18   8.845 -11.617  -2.663
  141   2HG1  VAL  18          HG12      VAL  18   7.157 -11.987  -2.315
  142   3HG1  VAL  18          HG13      VAL  18   8.404 -12.348  -1.120
  143   1HG2  VAL  18          HG21      VAL  18   6.998  -9.552  -3.091
  144   2HG2  VAL  18          HG22      VAL  18   8.702  -9.128  -2.927
  145   3HG2  VAL  18          HG23      VAL  18   7.486  -8.275  -1.977
  146    H    ASN  19           HN       ASN  19   7.945 -10.342   1.801
  147    HA   ASN  19           HA       ASN  19   8.053 -13.138   2.236
  148   1HB   ASN  19          HB2       ASN  19   9.463 -11.502   3.441
  149   2HB   ASN  19          HB1       ASN  19   8.040 -10.921   4.306
  150   1HD2  ASN  19          HD21      ASN  19   8.387 -11.688   6.429
  151   2HD2  ASN  19          HD22      ASN  19   8.679 -13.315   6.815
  152    H    ILE  20           HN       ILE  20   5.761 -10.766   3.630
  153    HA   ILE  20           HA       ILE  20   4.237 -12.870   4.936
  154    HB   ILE  20           HB       ILE  20   2.749 -11.067   5.648
  155   1HG1  ILE  20          HG12      ILE  20   4.409  -9.360   3.760
  156   2HG1  ILE  20          HG11      ILE  20   2.704  -9.765   3.567
  157   1HG2  ILE  20          HG21      ILE  20   5.586 -10.027   5.758
  158   2HG2  ILE  20          HG22      ILE  20   5.089 -11.464   6.650
  159   3HG2  ILE  20          HG23      ILE  20   4.331  -9.909   6.991
  160   1HD1  ILE  20          HD11      ILE  20   3.966  -8.046   5.705
  161   2HD1  ILE  20          HD12      ILE  20   2.334  -8.695   5.861
  162   3HD1  ILE  20          HD13      ILE  20   2.722  -7.592   4.541
  163    H    THR  21           HN       THR  21   4.152 -11.624   1.718
  164    HA   THR  21           HA       THR  21   1.280 -12.371   1.399
  165    HB   THR  21           HB       THR  21   1.633 -11.520  -0.955
  166    HG1  THR  21           HG1      THR  21   4.169 -11.503  -0.032
  167   1HG2  THR  21          HG21      THR  21   2.292  -9.607   1.294
  168   2HG2  THR  21          HG22      THR  21   0.672 -10.121   0.835
  169   3HG2  THR  21          HG23      THR  21   1.643  -9.163  -0.282
  170    H    GLN  22           HN       GLN  22   4.441 -13.684   0.840
  171    HA   GLN  22           HA       GLN  22   3.561 -15.529  -1.262
  172   1HB   GLN  22          HB2       GLN  22   6.092 -15.300   0.372
  173   2HB   GLN  22          HB1       GLN  22   5.824 -16.619  -0.767
  174   1HG   GLN  22          HG2       GLN  22   5.543 -15.030  -2.599
  175   2HG   GLN  22          HG1       GLN  22   5.697 -13.675  -1.483
  176   1HE2  GLN  22          HE21      GLN  22   7.504 -14.274  -3.758
  177   2HE2  GLN  22          HE22      GLN  22   9.045 -14.525  -3.090
  178    H    ASN  23           HN       ASN  23   4.111 -15.691   2.234
  179    HA   ASN  23           HA       ASN  23   3.429 -18.570   2.281
  180   1HB   ASN  23          HB2       ASN  23   4.217 -16.608   4.448
  181   2HB   ASN  23          HB1       ASN  23   3.838 -18.303   4.752
  182   1HD2  ASN  23          HD21      ASN  23   6.472 -16.462   4.589
  183   2HD2  ASN  23          HD22      ASN  23   7.558 -17.498   3.797
  184    H    GLN  24           HN       GLN  24   1.518 -15.966   1.955
  185    HA   GLN  24           HA       GLN  24  -0.352 -16.500   4.154
  186   1HB   GLN  24          HB2       GLN  24  -1.639 -14.696   3.310
  187   2HB   GLN  24          HB1       GLN  24   0.034 -14.223   3.029
  188   1HG   GLN  24          HG2       GLN  24  -0.206 -15.174   0.686
  189   2HG   GLN  24          HG1       GLN  24  -1.936 -15.313   1.006
  190   1HE2  GLN  24          HE21      GLN  24  -1.740 -13.629  -0.960
  191   2HE2  GLN  24          HE22      GLN  24  -1.713 -11.998  -0.493
  192    H    LYS  25           HN       LYS  25  -1.948 -17.984   4.112
  193    HA   LYS  25           HA       LYS  25  -2.411 -19.547   1.646
  194   1HB   LYS  25          HB2       LYS  25  -2.157 -20.617   3.914
  195   2HB   LYS  25          HB1       LYS  25  -3.674 -19.865   4.390
  196   1HG   LYS  25          HG2       LYS  25  -4.809 -21.022   2.494
  197   2HG   LYS  25          HG1       LYS  25  -3.293 -21.836   2.113
  198   1HD   LYS  25          HD2       LYS  25  -4.485 -22.009   4.885
  199   2HD   LYS  25          HD1       LYS  25  -5.022 -23.092   3.603
  200   1HE   LYS  25          HE2       LYS  25  -2.632 -23.773   3.249
  201   2HE   LYS  25          HE1       LYS  25  -2.189 -22.795   4.647
  202   1HZ   LYS  25          HZ1       LYS  25  -2.900 -25.373   4.770
  203   2HZ   LYS  25          HZ2       LYS  25  -4.385 -24.613   5.095
  204   3HZ   LYS  25          HZ3       LYS  25  -3.028 -24.283   6.063
  205    H    ALA  26           HN       ALA  26  -4.826 -18.554   4.053
  206    HA   ALA  26           HA       ALA  26  -6.730 -17.915   1.918
  207   1HB   ALA  26          HB1       ALA  26  -7.982 -18.759   3.667
  208   2HB   ALA  26          HB2       ALA  26  -7.936 -17.100   4.265
  209   3HB   ALA  26          HB3       ALA  26  -6.781 -18.287   4.865
  210    HA   PRO  27           HA       PRO  27  -5.976 -13.563   1.536
  211   1HB   PRO  27          HB2       PRO  27  -8.643 -12.854   2.611
  212   2HB   PRO  27          HB1       PRO  27  -7.973 -12.558   1.002
  213   1HG   PRO  27          HG2       PRO  27  -9.912 -14.501   1.657
  214   2HG   PRO  27          HG1       PRO  27  -9.008 -14.405   0.141
  215   1HD   PRO  27          HD2       PRO  27  -8.773 -16.414   2.229
  216   2HD   PRO  27          HD1       PRO  27  -7.905 -16.341   0.677
  217    H    LEU  28           HN       LEU  28  -5.024 -12.047   2.957
  218    HA   LEU  28           HA       LEU  28  -4.691 -12.736   5.696
  219   1HB   LEU  28          HB2       LEU  28  -4.338 -10.086   4.273
  220   2HB   LEU  28          HB1       LEU  28  -3.822 -10.377   5.931
  221    HG   LEU  28           HG       LEU  28  -2.899 -12.034   3.565
  222   1HD1  LEU  28          HD11      LEU  28  -2.116  -9.753   3.268
  223   2HD1  LEU  28          HD12      LEU  28  -0.764 -10.747   3.810
  224   3HD1  LEU  28          HD13      LEU  28  -1.584  -9.678   4.948
  225   1HD2  LEU  28          HD21      LEU  28  -2.230 -11.950   6.507
  226   2HD2  LEU  28          HD22      LEU  28  -0.986 -12.430   5.354
  227   3HD2  LEU  28          HD23      LEU  28  -2.483 -13.347   5.461
  228    H    CYS  29           HN       CYS  29  -6.763 -10.255   4.200
  229    HA   CYS  29           HA       CYS  29  -8.048  -9.689   6.781
  230   1HB   CYS  29          HB2       CYS  29  -8.453  -8.697   3.958
  231   2HB   CYS  29          HB1       CYS  29  -9.583  -8.292   5.252
  232    H    ASN  30           HN       ASN  30 -10.437  -9.950   7.010
  233    HA   ASN  30           HA       ASN  30 -11.253 -12.628   6.347
  234   1HB   ASN  30          HB2       ASN  30 -12.782 -10.245   7.423
  235   2HB   ASN  30          HB1       ASN  30 -13.492 -11.850   7.238
  236   1HD2  ASN  30          HD21      ASN  30 -10.311 -12.465   7.884
  237   2HD2  ASN  30          HD22      ASN  30 -10.375 -12.593   9.575
  238    H    GLY  31           HN       GLY  31 -10.558 -11.324   3.945
  239   1HA   GLY  31          HA2       GLY  31 -11.452 -11.414   1.748
  240   2HA   GLY  31          HA1       GLY  31 -13.053 -11.681   2.438
  241    H    SER  32           HN       SER  32 -11.259  -9.056   3.765
  242    HA   SER  32           HA       SER  32 -13.236  -7.123   3.086
  243   1HB   SER  32          HB2       SER  32 -10.324  -6.656   3.784
  244   2HB   SER  32          HB1       SER  32 -11.598  -5.444   3.827
  245    HG   SER  32           HG       SER  32 -12.466  -6.392   5.555
  246    H    MET  33           HN       MET  33 -13.352  -5.630   1.440
  247    HA   MET  33           HA       MET  33 -11.432  -5.966  -0.843
  248   1HB   MET  33          HB2       MET  33 -14.322  -5.025  -0.867
  249   2HB   MET  33          HB1       MET  33 -13.278  -5.203  -2.275
  250   1HG   MET  33          HG2       MET  33 -13.076  -7.610  -1.860
  251   2HG   MET  33          HG1       MET  33 -14.073  -7.457  -0.413
  252   1HE   MET  33          HE1       MET  33 -13.618  -6.746  -3.973
  253   2HE   MET  33          HE2       MET  33 -15.203  -6.641  -4.731
  254   3HE   MET  33          HE3       MET  33 -14.492  -8.219  -4.408
  255    H    VAL  34           HN       VAL  34 -10.805  -3.954  -1.911
  256    HA   VAL  34           HA       VAL  34 -11.291  -1.477  -0.282
  257    HB   VAL  34           HB       VAL  34  -8.910  -0.870  -0.690
  258   1HG1  VAL  34          HG11      VAL  34  -7.967  -2.458   0.931
  259   2HG1  VAL  34          HG12      VAL  34  -9.290  -3.582   0.622
  260   3HG1  VAL  34          HG13      VAL  34  -9.613  -2.031   1.398
  261   1HG2  VAL  34          HG21      VAL  34  -8.644  -2.306  -2.740
  262   2HG2  VAL  34          HG22      VAL  34  -8.673  -3.726  -1.695
  263   3HG2  VAL  34          HG23      VAL  34  -7.367  -2.552  -1.551
  264    H    TRP  35           HN       TRP  35 -10.974   0.537  -1.519
  265    HA   TRP  35           HA       TRP  35 -12.196   0.372  -4.135
  266   1HB   TRP  35          HB2       TRP  35 -10.810   2.689  -2.752
  267   2HB   TRP  35          HB1       TRP  35 -11.728   2.826  -4.245
  268    HD1  TRP  35           HD1      TRP  35 -12.110   2.447  -0.507
  269    HE1  TRP  35           HE1      TRP  35 -14.587   2.739   0.127
  270    HE3  TRP  35           HE3      TRP  35 -14.214   2.463  -5.160
  271    HZ2  TRP  35           HZ2      TRP  35 -17.134   2.933  -1.165
  272    HZ3  TRP  35           HZ3      TRP  35 -16.670   2.695  -5.424
  273    HH2  TRP  35           HH2      TRP  35 -18.129   2.934  -3.437
  274    H    SER  36           HN       SER  36 -11.225   0.334  -6.130
  275    HA   SER  36           HA       SER  36  -8.372  -0.150  -6.298
  276   1HB   SER  36          HB2       SER  36  -8.736  -0.143  -8.732
  277   2HB   SER  36          HB1       SER  36  -9.986  -1.099  -7.938
  278    HG   SER  36           HG       SER  36 -11.371   0.672  -8.107
  279    H    ILE  37           HN       ILE  37  -6.817   1.295  -7.302
  280    HA   ILE  37           HA       ILE  37  -7.665   4.153  -7.538
  281    HB   ILE  37           HB       ILE  37  -5.603   4.824  -6.295
  282   1HG1  ILE  37          HG12      ILE  37  -5.463   1.955  -5.338
  283   2HG1  ILE  37          HG11      ILE  37  -4.504   2.508  -6.705
  284   1HG2  ILE  37          HG21      ILE  37  -7.564   3.049  -4.809
  285   2HG2  ILE  37          HG22      ILE  37  -7.747   4.774  -5.128
  286   3HG2  ILE  37          HG23      ILE  37  -6.479   4.208  -4.041
  287   1HD1  ILE  37          HD11      ILE  37  -4.470   3.954  -4.056
  288   2HD1  ILE  37          HD12      ILE  37  -3.315   4.083  -5.383
  289   3HD1  ILE  37          HD13      ILE  37  -3.376   2.615  -4.406
  290    H    ASN  38           HN       ASN  38  -5.987   5.459  -8.693
  291    HA   ASN  38           HA       ASN  38  -4.827   3.859 -10.897
  292   1HB   ASN  38          HB2       ASN  38  -6.062   6.019 -11.322
  293   2HB   ASN  38          HB1       ASN  38  -4.764   6.865 -10.479
  294   1HD2  ASN  38          HD21      ASN  38  -5.366   7.276 -13.295
  295   2HD2  ASN  38          HD22      ASN  38  -4.024   6.740 -14.186
  296    H    LEU  39           HN       LEU  39  -2.768   3.109 -10.657
  297    HA   LEU  39           HA       LEU  39  -1.051   4.182  -8.549
  298   1HB   LEU  39          HB2       LEU  39  -0.562   2.082 -10.682
  299   2HB   LEU  39          HB1       LEU  39   0.594   2.492  -9.420
  300    HG   LEU  39           HG       LEU  39  -0.712   0.491  -8.811
  301   1HD1  LEU  39          HD11      LEU  39  -1.763   2.641  -6.993
  302   2HD1  LEU  39          HD12      LEU  39  -0.024   2.377  -7.115
  303   3HD1  LEU  39          HD13      LEU  39  -1.078   1.067  -6.593
  304   1HD2  LEU  39          HD21      LEU  39  -3.193   2.177  -8.590
  305   2HD2  LEU  39          HD22      LEU  39  -3.043   0.426  -8.680
  306   3HD2  LEU  39          HD23      LEU  39  -2.786   1.404 -10.122
  307    H    THR  40           HN       THR  40   0.187   5.972  -8.863
  308    HA   THR  40           HA       THR  40   1.532   6.352 -11.484
  309    HB   THR  40           HB       THR  40   0.799   8.761 -11.508
  310    HG1  THR  40           HG1      THR  40  -1.348   8.789 -10.199
  311   1HG2  THR  40          HG21      THR  40  -0.344   6.822 -12.776
  312   2HG2  THR  40          HG22      THR  40  -1.258   8.317 -12.589
  313   3HG2  THR  40          HG23      THR  40  -1.604   6.938 -11.547
  314    H    ALA  41           HN       ALA  41   1.040   8.651  -8.808
  315    HA   ALA  41           HA       ALA  41   3.948   8.359  -8.105
  316   1HB   ALA  41          HB1       ALA  41   3.369  10.418  -9.517
  317   2HB   ALA  41          HB2       ALA  41   4.202  10.724  -7.993
  318   3HB   ALA  41          HB3       ALA  41   2.463  10.993  -8.118
  319    H    GLY  42           HN       GLY  42   1.136  10.225  -6.882
  320   1HA   GLY  42          HA2       GLY  42   1.939   9.845  -4.135
  321   2HA   GLY  42          HA1       GLY  42   0.378  10.475  -4.667
  322    H    MET  43           HN       MET  43   1.824   7.336  -5.465
  323    HA   MET  43           HA       MET  43  -0.582   5.880  -5.055
  324   1HB   MET  43          HB2       MET  43   2.268   4.868  -4.837
  325   2HB   MET  43          HB1       MET  43   0.836   3.890  -5.159
  326   1HG   MET  43          HG2       MET  43   0.450   5.304  -7.214
  327   2HG   MET  43          HG1       MET  43   2.025   6.034  -6.932
  328   1HE   MET  43          HE1       MET  43   3.774   3.379  -5.816
  329   2HE   MET  43          HE2       MET  43   4.063   4.921  -6.619
  330   3HE   MET  43          HE3       MET  43   4.589   3.426  -7.385
  331    H    TYR  44           HN       TYR  44   2.171   6.508  -2.909
  332    HA   TYR  44           HA       TYR  44   1.415   4.806  -0.772
  333   1HB   TYR  44          HB2       TYR  44   2.943   7.417  -0.829
  334   2HB   TYR  44          HB1       TYR  44   2.798   6.414   0.616
  335    HD1  TYR  44           HD1      TYR  44   3.890   4.242   0.762
  336    HD2  TYR  44           HD2      TYR  44   4.176   6.628  -2.796
  337    HE1  TYR  44           HE1      TYR  44   5.709   2.778  -0.072
  338    HE2  TYR  44           HE2      TYR  44   5.998   5.166  -3.630
  339    HH   TYR  44           HH       TYR  44   6.778   2.821  -3.273
  340    H    CYS  45           HN       CYS  45   0.682   8.288  -1.229
  341    HA   CYS  45           HA       CYS  45  -0.960   8.422   1.135
  342   1HB   CYS  45          HB2       CYS  45  -0.810  10.185  -1.322
  343   2HB   CYS  45          HB1       CYS  45  -1.801  10.562   0.088
  344    H    ALA  46           HN       ALA  46  -1.787   8.120  -2.339
  345    HA   ALA  46           HA       ALA  46  -4.604   7.968  -1.949
  346   1HB   ALA  46          HB1       ALA  46  -2.750   6.981  -4.107
  347   2HB   ALA  46          HB2       ALA  46  -3.942   8.276  -4.183
  348   3HB   ALA  46          HB3       ALA  46  -4.470   6.594  -4.166
  349    H    ALA  47           HN       ALA  47  -2.142   5.392  -2.107
  350    HA   ALA  47           HA       ALA  47  -3.960   3.223  -1.726
  351   1HB   ALA  47          HB1       ALA  47  -1.915   1.989  -0.900
  352   2HB   ALA  47          HB2       ALA  47  -1.024   3.504  -1.011
  353   3HB   ALA  47          HB3       ALA  47  -1.693   2.766  -2.467
  354    H    LEU  48           HN       LEU  48  -2.257   5.345   0.517
  355    HA   LEU  48           HA       LEU  48  -2.806   3.946   2.909
  356   1HB   LEU  48          HB2       LEU  48  -1.217   5.813   2.772
  357   2HB   LEU  48          HB1       LEU  48  -2.541   6.932   2.461
  358    HG   LEU  48           HG       LEU  48  -3.500   6.450   4.673
  359   1HD1  LEU  48          HD11      LEU  48  -1.860   5.116   6.246
  360   2HD1  LEU  48          HD12      LEU  48  -1.272   4.418   4.737
  361   3HD1  LEU  48          HD13      LEU  48  -2.963   4.226   5.199
  362   1HD2  LEU  48          HD21      LEU  48  -1.906   8.266   4.580
  363   2HD2  LEU  48          HD22      LEU  48  -0.548   7.142   4.641
  364   3HD2  LEU  48          HD23      LEU  48  -1.582   7.353   6.054
  365    H    GLU  49           HN       GLU  49  -4.743   6.604   1.411
  366    HA   GLU  49           HA       GLU  49  -6.751   6.595   3.423
  367   1HB   GLU  49          HB2       GLU  49  -8.279   7.487   1.557
  368   2HB   GLU  49          HB1       GLU  49  -6.828   8.420   1.919
  369   1HG   GLU  49          HG2       GLU  49  -5.662   7.387   0.045
  370   2HG   GLU  49          HG1       GLU  49  -7.073   6.386  -0.309
  371    H    SER  50           HN       SER  50  -6.436   4.575   0.508
  372    HA   SER  50           HA       SER  50  -9.018   3.371   0.701
  373   1HB   SER  50          HB2       SER  50  -6.412   2.209  -0.326
  374   2HB   SER  50          HB1       SER  50  -7.997   1.482  -0.575
  375    HG   SER  50           HG       SER  50  -7.937   4.132  -1.204
  376    H    LEU  51           HN       LEU  51  -5.927   2.536   2.254
  377    HA   LEU  51           HA       LEU  51  -6.918   0.142   3.536
  378   1HB   LEU  51          HB2       LEU  51  -4.581   1.941   4.240
  379   2HB   LEU  51          HB1       LEU  51  -4.881   0.362   4.961
  380    HG   LEU  51           HG       LEU  51  -4.548   0.804   1.979
  381   1HD1  LEU  51          HD11      LEU  51  -2.266  -0.173   2.341
  382   2HD1  LEU  51          HD12      LEU  51  -2.526  -0.029   4.080
  383   3HD1  LEU  51          HD13      LEU  51  -2.472   1.418   3.073
  384   1HD2  LEU  51          HD21      LEU  51  -4.808  -1.618   3.772
  385   2HD2  LEU  51          HD22      LEU  51  -3.944  -1.741   2.240
  386   3HD2  LEU  51          HD23      LEU  51  -5.638  -1.270   2.255
  387    H    ILE  52           HN       ILE  52  -6.746   3.548   4.511
  388    HA   ILE  52           HA       ILE  52  -7.322   3.320   7.242
  389    HB   ILE  52           HB       ILE  52  -8.284   5.363   5.220
  390   1HG1  ILE  52          HG12      ILE  52  -5.854   5.304   5.575
  391   2HG1  ILE  52          HG11      ILE  52  -6.531   6.779   6.240
  392   1HG2  ILE  52          HG21      ILE  52  -9.853   5.526   7.008
  393   2HG2  ILE  52          HG22      ILE  52  -8.676   6.811   7.276
  394   3HG2  ILE  52          HG23      ILE  52  -8.593   5.328   8.226
  395   1HD1  ILE  52          HD11      ILE  52  -5.196   6.163   8.013
  396   2HD1  ILE  52          HD12      ILE  52  -5.305   4.446   7.639
  397   3HD1  ILE  52          HD13      ILE  52  -6.637   5.254   8.461
  398    H    ASN  53           HN       ASN  53  -9.405   2.643   4.525
  399    HA   ASN  53           HA       ASN  53 -11.849   2.645   6.152
  400   1HB   ASN  53          HB2       ASN  53 -11.219   1.766   3.326
  401   2HB   ASN  53          HB1       ASN  53 -12.806   1.526   4.056
  402   1HD2  ASN  53          HD21      ASN  53 -13.148   3.901   5.501
  403   2HD2  ASN  53          HD22      ASN  53 -13.161   5.223   4.436
  404    H    VAL  54           HN       VAL  54  -9.266   0.472   5.548
  405    HA   VAL  54           HA       VAL  54 -10.879  -1.945   6.134
  406    HB   VAL  54           HB       VAL  54  -7.887  -1.622   5.714
  407   1HG1  VAL  54          HG11      VAL  54  -8.070  -4.111   5.254
  408   2HG1  VAL  54          HG12      VAL  54  -9.704  -4.038   5.915
  409   3HG1  VAL  54          HG13      VAL  54  -8.320  -3.647   6.937
  410   1HG2  VAL  54          HG21      VAL  54 -10.072  -2.554   3.820
  411   2HG2  VAL  54          HG22      VAL  54  -8.344  -2.528   3.464
  412   3HG2  VAL  54          HG23      VAL  54  -9.216  -1.015   3.715
  413    H    SER  55           HN       SER  55 -11.271  -2.472   8.225
  414    HA   SER  55           HA       SER  55  -9.229  -1.751  10.312
  415   1HB   SER  55          HB2       SER  55 -12.250  -1.731  10.599
  416   2HB   SER  55          HB1       SER  55 -11.090  -1.376  11.876
  417    HG   SER  55           HG       SER  55 -11.288   0.025   9.411
  418    H    GLY  56           HN       GLY  56  -8.952  -3.303  11.972
  419   1HA   GLY  56          HA2       GLY  56  -9.429  -5.368  13.119
  420   2HA   GLY  56          HA1       GLY  56 -10.513  -5.828  11.807
  421    H    CYS  57           HN       CYS  57  -8.006  -4.718  10.122
  422    HA   CYS  57           HA       CYS  57  -6.793  -7.430   9.876
  423   1HB   CYS  57          HB2       CYS  57  -6.767  -4.973   8.111
  424   2HB   CYS  57          HB1       CYS  57  -5.768  -6.391   7.792
  425    H    SER  58           HN       SER  58  -5.392  -7.342  11.732
  426    HA   SER  58           HA       SER  58  -3.485  -5.164  12.063
  427   1HB   SER  58          HB2       SER  58  -4.288  -6.541  13.977
  428   2HB   SER  58          HB1       SER  58  -3.468  -7.939  13.286
  429    HG   SER  58           HG       SER  58  -2.296  -5.489  14.129
  430    H    ALA  59           HN       ALA  59  -3.443  -8.352  10.571
  431    HA   ALA  59           HA       ALA  59  -0.741  -8.883  10.269
  432   1HB   ALA  59          HB1       ALA  59  -2.758  -9.127   8.024
  433   2HB   ALA  59          HB2       ALA  59  -2.650 -10.259   9.371
  434   3HB   ALA  59          HB3       ALA  59  -1.299 -10.090   8.250
  435    H    ILE  60           HN       ILE  60  -2.334  -6.083   9.156
  436    HA   ILE  60           HA       ILE  60   0.034  -5.389   7.447
  437    HB   ILE  60           HB       ILE  60  -1.483  -4.127   5.970
  438   1HG1  ILE  60          HG12      ILE  60  -3.682  -5.372   7.654
  439   2HG1  ILE  60          HG11      ILE  60  -3.257  -3.662   7.642
  440   1HG2  ILE  60          HG21      ILE  60  -0.916  -6.542   5.546
  441   2HG2  ILE  60          HG22      ILE  60  -2.450  -6.036   4.838
  442   3HG2  ILE  60          HG23      ILE  60  -2.435  -6.983   6.326
  443   1HD1  ILE  60          HD11      ILE  60  -4.367  -5.288   5.345
  444   2HD1  ILE  60          HD12      ILE  60  -3.703  -3.666   5.150
  445   3HD1  ILE  60          HD13      ILE  60  -5.129  -3.920   6.158
  446    H    GLU  61           HN       GLU  61  -1.109  -4.793  10.336
  447    HA   GLU  61           HA       GLU  61  -1.699  -2.005  10.446
  448   1HB   GLU  61          HB2       GLU  61  -1.763  -3.795  12.348
  449   2HB   GLU  61          HB1       GLU  61  -0.065  -3.418  12.570
  450   1HG   GLU  61          HG2       GLU  61  -0.639  -1.043  12.877
  451   2HG   GLU  61          HG1       GLU  61  -2.346  -1.433  12.666
  452    H    LYS  62           HN       LYS  62   1.350  -3.777  10.713
  453    HA   LYS  62           HA       LYS  62   3.056  -1.503  10.965
  454   1HB   LYS  62          HB2       LYS  62   3.562  -4.274   9.854
  455   2HB   LYS  62          HB1       LYS  62   4.835  -3.072  10.075
  456   1HG   LYS  62          HG2       LYS  62   4.280  -2.917  12.475
  457   2HG   LYS  62          HG1       LYS  62   3.009  -4.122  12.259
  458   1HD   LYS  62          HD2       LYS  62   4.689  -5.768  11.516
  459   2HD   LYS  62          HD1       LYS  62   5.962  -4.566  11.733
  460   1HE   LYS  62          HE2       LYS  62   5.927  -5.951  13.712
  461   2HE   LYS  62          HE1       LYS  62   5.260  -4.379  14.150
  462   1HZ   LYS  62          HZ1       LYS  62   3.026  -5.328  13.754
  463   2HZ   LYS  62          HZ2       LYS  62   3.858  -6.076  15.032
  464   3HZ   LYS  62          HZ3       LYS  62   3.739  -6.850  13.524
  465    H    THR  63           HN       THR  63   1.755  -3.173   8.117
  466    HA   THR  63           HA       THR  63   3.299  -1.838   6.139
  467    HB   THR  63           HB       THR  63   0.421  -2.762   5.979
  468    HG1  THR  63           HG1      THR  63   1.470  -4.596   4.989
  469   1HG2  THR  63          HG21      THR  63   2.446  -1.976   3.883
  470   2HG2  THR  63          HG22      THR  63   0.822  -1.329   4.125
  471   3HG2  THR  63          HG23      THR  63   1.035  -2.968   3.510
  472    H    GLN  64           HN       GLN  64   0.282  -0.879   7.765
  473    HA   GLN  64           HA       GLN  64  -0.211   1.457   6.213
  474   1HB   GLN  64          HB2       GLN  64  -0.830   0.812   9.108
  475   2HB   GLN  64          HB1       GLN  64  -1.416   2.262   8.293
  476   1HG   GLN  64          HG2       GLN  64  -2.639   0.952   6.679
  477   2HG   GLN  64          HG1       GLN  64  -1.901  -0.543   7.256
  478   1HE2  GLN  64          HE21      GLN  64  -4.817   0.170   7.224
  479   2HE2  GLN  64          HE22      GLN  64  -5.329   0.060   8.838
  480    H    ARG  65           HN       ARG  65   1.800   0.924   9.087
  481    HA   ARG  65           HA       ARG  65   2.533   3.655   9.503
  482   1HB   ARG  65          HB2       ARG  65   2.900   1.891  11.181
  483   2HB   ARG  65          HB1       ARG  65   4.095   1.135  10.128
  484   1HG   ARG  65          HG2       ARG  65   5.539   3.067  10.263
  485   2HG   ARG  65          HG1       ARG  65   4.314   3.982  11.134
  486   1HD   ARG  65          HD2       ARG  65   5.712   1.485  12.115
  487   2HD   ARG  65          HD1       ARG  65   5.993   3.117  12.709
  488    HE   ARG  65           HE       ARG  65   3.903   1.300  13.533
  489   1HH1  ARG  65          HH21      ARG  65   4.470   4.630  12.833
  490   2HH1  ARG  65          HH22      ARG  65   3.005   5.165  13.586
  491   1HH2  ARG  65          HH11      ARG  65   1.995   1.980  14.499
  492   2HH2  ARG  65          HH12      ARG  65   1.604   3.668  14.522
  493    H    MET  66           HN       MET  66   4.233   1.048   7.717
  494    HA   MET  66           HA       MET  66   6.412   2.676   6.883
  495   1HB   MET  66          HB2       MET  66   5.149   0.234   5.616
  496   2HB   MET  66          HB1       MET  66   6.630   0.979   5.009
  497   1HG   MET  66          HG2       MET  66   7.627   0.720   7.300
  498   2HG   MET  66          HG1       MET  66   6.185  -0.171   7.781
  499   1HE   MET  66          HE1       MET  66   5.449  -2.051   5.259
  500   2HE   MET  66          HE2       MET  66   5.412  -2.237   7.010
  501   3HE   MET  66          HE3       MET  66   6.242  -3.435   6.022
  502    H    LEU  67           HN       LEU  67   3.221   2.120   5.397
  503    HA   LEU  67           HA       LEU  67   3.740   3.612   3.009
  504   1HB   LEU  67          HB2       LEU  67   1.150   3.175   4.525
  505   2HB   LEU  67          HB1       LEU  67   1.243   3.913   2.928
  506    HG   LEU  67           HG       LEU  67   2.331   1.158   3.568
  507   1HD1  LEU  67          HD11      LEU  67   0.314   0.272   2.481
  508   2HD1  LEU  67          HD12      LEU  67  -0.302   1.911   2.266
  509   3HD1  LEU  67          HD13      LEU  67  -0.122   1.242   3.887
  510   1HD2  LEU  67          HD21      LEU  67   3.399   1.840   1.594
  511   2HD2  LEU  67          HD22      LEU  67   2.018   2.795   1.054
  512   3HD2  LEU  67          HD23      LEU  67   1.967   1.036   0.960
  513    H    SER  68           HN       SER  68   2.617   4.550   6.231
  514    HA   SER  68           HA       SER  68   2.082   7.289   5.662
  515   1HB   SER  68          HB2       SER  68   3.096   6.009   8.220
  516   2HB   SER  68          HB1       SER  68   2.475   7.651   8.099
  517    HG   SER  68           HG       SER  68   0.779   5.926   6.935
  518    H    GLY  69           HN       GLY  69   5.079   5.584   6.515
  519   1HA   GLY  69          HA2       GLY  69   6.801   7.764   6.909
  520   2HA   GLY  69          HA1       GLY  69   7.313   6.246   6.167
  521    H    PHE  70           HN       PHE  70   5.409   6.523   3.927
  522    HA   PHE  70           HA       PHE  70   6.996   8.447   2.298
  523   1HB   PHE  70          HB2       PHE  70   5.055   6.236   1.565
  524   2HB   PHE  70          HB1       PHE  70   5.771   7.330   0.382
  525    HD1  PHE  70           HD1      PHE  70   8.190   7.299  -0.068
  526    HD2  PHE  70           HD2      PHE  70   6.387   4.520   2.667
  527    HE1  PHE  70           HE1      PHE  70  10.233   5.897  -0.149
  528    HE2  PHE  70           HE2      PHE  70   8.432   3.116   2.589
  529    HZ   PHE  70           HZ       PHE  70  10.357   3.804   1.179
  530    H    CYS  71           HN       CYS  71   4.191   8.385   4.071
  531    HA   CYS  71           HA       CYS  71   3.066  10.711   2.571
  532   1HB   CYS  71          HB2       CYS  71   1.835   8.532   2.045
  533   2HB   CYS  71          HB1       CYS  71   1.345   8.508   3.738
  534    HA   PRO  72           HA       PRO  72   3.817  11.366   7.155
  535   1HB   PRO  72          HB2       PRO  72   4.036  14.190   6.313
  536   2HB   PRO  72          HB1       PRO  72   5.197  13.190   7.195
  537   1HG   PRO  72          HG2       PRO  72   5.509  13.982   4.562
  538   2HG   PRO  72          HG1       PRO  72   6.301  12.573   5.280
  539   1HD   PRO  72          HD2       PRO  72   4.055  12.664   3.344
  540   2HD   PRO  72          HD1       PRO  72   5.175  11.325   3.704
  541    H    HIS  73           HN       HIS  73   1.531  12.807   4.916
  542    HA   HIS  73           HA       HIS  73  -0.032  13.997   7.129
  543   1HB   HIS  73          HB2       HIS  73  -1.293  15.094   5.488
  544   2HB   HIS  73          HB1       HIS  73   0.291  14.990   4.731
  545    HD1  HIS  73           HD1      HIS  73  -3.206  13.740   4.466
  546    HD2  HIS  73           HD2      HIS  73   0.449  13.066   2.579
  547    HE1  HIS  73           HE1      HIS  73  -3.720  12.445   2.352
  548    H    LYS  74           HN       LYS  74  -1.204  12.599   8.317
  549    HA   LYS  74           HA       LYS  74  -2.085  10.029   7.274
  550   1HB   LYS  74          HB2       LYS  74  -2.615  11.493   9.872
  551   2HB   LYS  74          HB1       LYS  74  -3.242   9.881   9.525
  552   1HG   LYS  74          HG2       LYS  74  -0.939   9.058   9.177
  553   2HG   LYS  74          HG1       LYS  74  -0.312  10.669   9.530
  554   1HD   LYS  74          HD2       LYS  74  -1.311  10.571  11.783
  555   2HD   LYS  74          HD1       LYS  74  -1.939   8.959  11.436
  556   1HE   LYS  74          HE2       LYS  74   0.282   8.050  11.246
  557   2HE   LYS  74          HE1       LYS  74   1.005   9.657  11.299
  558   1HZ   LYS  74          HZ1       LYS  74  -0.484   9.583  13.554
  559   2HZ   LYS  74          HZ2       LYS  74   1.186   9.284  13.475
  560   3HZ   LYS  74          HZ3       LYS  74   0.087   7.989  13.454
  561    H    VAL  75           HN       VAL  75  -4.215   9.401   6.805
  562    HA   VAL  75           HA       VAL  75  -6.172  11.642   6.388
  563    HB   VAL  75           HB       VAL  75  -5.956   8.984   4.938
  564   1HG1  VAL  75          HG11      VAL  75  -7.614  10.035   3.403
  565   2HG1  VAL  75          HG12      VAL  75  -7.721  11.411   4.497
  566   3HG1  VAL  75          HG13      VAL  75  -8.256   9.818   5.030
  567   1HG2  VAL  75          HG21      VAL  75  -5.132  11.803   4.194
  568   2HG2  VAL  75          HG22      VAL  75  -5.335  10.517   3.004
  569   3HG2  VAL  75          HG23      VAL  75  -4.111  10.366   4.264
  570    H    SER  76           HN       SER  76  -8.114  11.482   7.449
  571    HA   SER  76           HA       SER  76  -8.534   9.133   9.208
  572   1HB   SER  76          HB2       SER  76 -10.029  11.759   8.946
  573   2HB   SER  76          HB1       SER  76 -10.413  10.504  10.120
  574    HG   SER  76           HG       SER  76  -8.158  12.174   9.930
  575    H    ALA  77           HN       ALA  77 -10.823   8.251   9.306
  576    HA   ALA  77           HA       ALA  77 -11.618   7.270   6.741
  577   1HB   ALA  77          HB1       ALA  77 -12.150   5.994   8.723
  578   2HB   ALA  77          HB2       ALA  77 -13.673   6.481   7.979
  579   3HB   ALA  77          HB3       ALA  77 -13.072   7.337   9.398
  580    H    GLY  78           HN       GLY  78 -12.194  10.269   8.242
  581   1HA   GLY  78          HA2       GLY  78 -14.752  10.752   6.828
  582   2HA   GLY  78          HA1       GLY  78 -13.943  11.875   7.922
  583    H    GLN  79           HN       GLN  79 -11.343  11.679   6.659
  584    HA   GLN  79           HA       GLN  79 -11.856  13.479   4.365
  585   1HB   GLN  79          HB2       GLN  79  -9.264  12.675   5.717
  586   2HB   GLN  79          HB1       GLN  79  -9.434  13.920   4.479
  587   1HG   GLN  79          HG2       GLN  79 -10.914  13.974   7.120
  588   2HG   GLN  79          HG1       GLN  79  -9.384  14.806   6.843
  589   1HE2  GLN  79          HE21      GLN  79 -12.662  15.355   6.850
  590   2HE2  GLN  79          HE22      GLN  79 -12.733  16.645   5.749
  591    H    PHE  80           HN       PHE  80 -11.695  12.795   2.293
  592    HA   PHE  80           HA       PHE  80 -10.107  10.323   1.683
  593   1HB   PHE  80          HB2       PHE  80 -12.846  11.093   0.632
  594   2HB   PHE  80          HB1       PHE  80 -11.850   9.810  -0.058
  595    HD1  PHE  80           HD1      PHE  80 -14.201  10.670   2.518
  596    HD2  PHE  80           HD2      PHE  80 -11.056   7.922   1.508
  597    HE1  PHE  80           HE1      PHE  80 -15.020   9.095   4.249
  598    HE2  PHE  80           HE2      PHE  80 -11.874   6.350   3.241
  599    HZ   PHE  80           HZ       PHE  80 -13.857   6.934   4.609
  600    H    SER  81           HN       SER  81  -8.990  10.418  -0.316
  601    HA   SER  81           HA       SER  81  -9.033  13.099  -1.680
  602   1HB   SER  81          HB2       SER  81  -6.668  11.249  -1.314
  603   2HB   SER  81          HB1       SER  81  -6.645  12.853  -2.042
  604    HG   SER  81           HG       SER  81  -7.539  13.554   0.063
  605    H    SER  82           HN       SER  82  -8.261   9.621  -2.232
  606    HA   SER  82           HA       SER  82  -8.556  10.098  -5.158
  607   1HB   SER  82          HB2       SER  82  -6.553   8.894  -4.282
  608   2HB   SER  82          HB1       SER  82  -7.619   7.605  -3.730
  609    HG   SER  82           HG       SER  82  -6.557   7.720  -6.037
  610    H    LEU  83           HN       LEU  83 -10.540   8.969  -2.634
  611    HA   LEU  83           HA       LEU  83 -11.918   6.945  -4.272
  612   1HB   LEU  83          HB2       LEU  83 -12.880   8.255  -1.714
  613   2HB   LEU  83          HB1       LEU  83 -13.454   6.746  -2.416
  614    HG   LEU  83           HG       LEU  83 -10.731   7.289  -1.214
  615   1HD1  LEU  83          HD11      LEU  83 -12.845   6.701   0.195
  616   2HD1  LEU  83          HD12      LEU  83 -11.362   5.796   0.485
  617   3HD1  LEU  83          HD13      LEU  83 -12.653   5.085  -0.483
  618   1HD2  LEU  83          HD21      LEU  83 -10.226   5.907  -3.071
  619   2HD2  LEU  83          HD22      LEU  83 -11.731   5.001  -2.914
  620   3HD2  LEU  83          HD23      LEU  83 -10.432   4.767  -1.743
  621    H    HIS  84           HN       HIS  84 -11.676   9.747  -5.274
  622    HA   HIS  84           HA       HIS  84 -14.324  10.943  -5.099
  623   1HB   HIS  84          HB2       HIS  84 -12.084  11.426  -7.090
  624   2HB   HIS  84          HB1       HIS  84 -13.503  12.450  -6.876
  625    HD1  HIS  84           HD1      HIS  84 -12.785  11.386  -3.606
  626    HD2  HIS  84           HD2      HIS  84 -10.972  14.148  -6.148
  627    HE1  HIS  84           HE1      HIS  84 -11.419  12.924  -2.136
  628    H    VAL  85           HN       VAL  85 -12.609   8.913  -7.438
  629    HA   VAL  85           HA       VAL  85 -14.794   8.942  -9.363
  630    HB   VAL  85           HB       VAL  85 -13.467   7.107 -10.452
  631   1HG1  VAL  85          HG11      VAL  85 -13.030   9.522 -10.899
  632   2HG1  VAL  85          HG12      VAL  85 -11.571   8.541 -11.039
  633   3HG1  VAL  85          HG13      VAL  85 -11.839   9.523  -9.599
  634   1HG2  VAL  85          HG21      VAL  85 -11.569   7.605  -8.133
  635   2HG2  VAL  85          HG22      VAL  85 -11.293   6.516  -9.492
  636   3HG2  VAL  85          HG23      VAL  85 -12.563   6.161  -8.322
  637    H    ARG  86           HN       ARG  86 -16.306   7.250  -9.737
  638    HA   ARG  86           HA       ARG  86 -16.847   5.584  -7.350
  639   1HB   ARG  86          HB2       ARG  86 -18.388   6.105  -9.907
  640   2HB   ARG  86          HB1       ARG  86 -18.936   4.993  -8.651
  641   1HG   ARG  86          HG2       ARG  86 -19.047   6.768  -7.024
  642   2HG   ARG  86          HG1       ARG  86 -18.258   7.898  -8.127
  643   1HD   ARG  86          HD2       ARG  86 -20.149   7.838  -9.639
  644   2HD   ARG  86          HD1       ARG  86 -20.919   6.566  -8.689
  645    HE   ARG  86           HE       ARG  86 -20.620   8.603  -6.863
  646   1HH1  ARG  86          HH21      ARG  86 -21.885   8.311 -10.055
  647   2HH1  ARG  86          HH22      ARG  86 -23.082   9.543  -9.838
  648   1HH2  ARG  86          HH11      ARG  86 -22.185  10.204  -6.554
  649   2HH2  ARG  86          HH12      ARG  86 -23.257  10.611  -7.851
  650    H    ASP  87           HN       ASP  87 -14.721   4.442  -7.994
  651    HA   ASP  87           HA       ASP  87 -14.964   2.523 -10.213
  652   1HB   ASP  87          HB2       ASP  87 -12.833   3.006  -8.113
  653   2HB   ASP  87          HB1       ASP  87 -12.726   1.732  -9.329
  654    H    THR  88           HN       THR  88 -14.458   0.142  -9.616
  655    HA   THR  88           HA       THR  88 -16.345  -0.637  -7.472
  656    HB   THR  88           HB       THR  88 -16.087  -2.903  -8.394
  657    HG1  THR  88           HG1      THR  88 -14.728  -2.609 -10.537
  658   1HG2  THR  88          HG21      THR  88 -16.364  -0.857 -10.611
  659   2HG2  THR  88          HG22      THR  88 -17.646  -1.273  -9.473
  660   3HG2  THR  88          HG23      THR  88 -17.032  -2.488 -10.595
  661    H    LYS  89           HN       LYS  89 -15.677  -2.285  -5.877
  662    HA   LYS  89           HA       LYS  89 -12.979  -1.708  -4.847
  663   1HB   LYS  89          HB2       LYS  89 -15.202  -3.453  -3.745
  664   2HB   LYS  89          HB1       LYS  89 -13.709  -3.050  -2.904
  665   1HG   LYS  89          HG2       LYS  89 -14.290  -0.661  -2.978
  666   2HG   LYS  89          HG1       LYS  89 -15.790  -1.052  -3.824
  667   1HD   LYS  89          HD2       LYS  89 -16.513  -2.435  -1.907
  668   2HD   LYS  89          HD1       LYS  89 -15.017  -2.039  -1.061
  669   1HE   LYS  89          HE2       LYS  89 -16.951  -0.624  -0.346
  670   2HE   LYS  89          HE1       LYS  89 -15.613   0.313  -1.005
  671   1HZ   LYS  89          HZ1       LYS  89 -17.732  -0.602  -2.816
  672   2HZ   LYS  89          HZ2       LYS  89 -16.754   0.784  -2.913
  673   3HZ   LYS  89          HZ3       LYS  89 -18.043   0.726  -1.808
  674    H    ILE  90           HN       ILE  90 -11.462  -3.417  -4.314
  675    HA   ILE  90           HA       ILE  90 -11.829  -5.970  -5.842
  676    HB   ILE  90           HB       ILE  90  -9.435  -5.853  -6.471
  677   1HG1  ILE  90          HG12      ILE  90  -9.580  -3.061  -5.281
  678   2HG1  ILE  90          HG11      ILE  90  -8.694  -4.415  -4.581
  679   1HG2  ILE  90          HG21      ILE  90  -9.682  -4.128  -8.184
  680   2HG2  ILE  90          HG22      ILE  90 -10.983  -3.368  -7.267
  681   3HG2  ILE  90          HG23      ILE  90 -11.219  -4.966  -7.973
  682   1HD1  ILE  90          HD11      ILE  90  -7.146  -3.036  -5.851
  683   2HD1  ILE  90          HD12      ILE  90  -8.182  -3.130  -7.276
  684   3HD1  ILE  90          HD13      ILE  90  -7.360  -4.574  -6.686
  685    H    GLU  91           HN       GLU  91 -10.425  -7.737  -4.983
  686    HA   GLU  91           HA       GLU  91 -10.600  -7.905  -2.124
  687   1HB   GLU  91          HB2       GLU  91  -9.087  -9.583  -4.143
  688   2HB   GLU  91          HB1       GLU  91  -9.206  -9.989  -2.431
  689   1HG   GLU  91          HG2       GLU  91 -11.667 -10.033  -2.607
  690   2HG   GLU  91          HG1       GLU  91 -11.550  -9.631  -4.321
  691    H    VAL  92           HN       VAL  92  -8.972  -7.754  -0.526
  692    HA   VAL  92           HA       VAL  92  -6.912  -5.842  -0.940
  693    HB   VAL  92           HB       VAL  92  -7.258  -7.960   1.199
  694   1HG1  VAL  92          HG11      VAL  92  -4.908  -7.503   1.196
  695   2HG1  VAL  92          HG12      VAL  92  -5.586  -6.486   2.467
  696   3HG1  VAL  92          HG13      VAL  92  -5.171  -5.784   0.902
  697   1HG2  VAL  92          HG21      VAL  92  -8.112  -6.164   2.521
  698   2HG2  VAL  92          HG22      VAL  92  -8.872  -5.976   0.942
  699   3HG2  VAL  92          HG23      VAL  92  -7.514  -4.950   1.391
  700    H    ALA  93           HN       ALA  93  -6.794  -9.402  -1.026
  701    HA   ALA  93           HA       ALA  93  -4.018  -9.773  -1.215
  702   1HB   ALA  93          HB1       ALA  93  -6.231 -11.240  -2.682
  703   2HB   ALA  93          HB2       ALA  93  -5.544 -11.668  -1.114
  704   3HB   ALA  93          HB3       ALA  93  -4.563 -11.805  -2.573
  705    H    GLN  94           HN       GLN  94  -6.312  -8.852  -3.773
  706    HA   GLN  94           HA       GLN  94  -4.280  -8.840  -5.858
  707   1HB   GLN  94          HB2       GLN  94  -7.056  -7.627  -5.689
  708   2HB   GLN  94          HB1       GLN  94  -6.054  -7.573  -7.139
  709   1HG   GLN  94          HG2       GLN  94  -5.993 -10.011  -7.236
  710   2HG   GLN  94          HG1       GLN  94  -6.893 -10.118  -5.722
  711   1HE2  GLN  94          HE21      GLN  94  -7.884 -11.245  -8.202
  712   2HE2  GLN  94          HE22      GLN  94  -9.282 -10.386  -8.637
  713    H    PHE  95           HN       PHE  95  -5.703  -6.479  -3.666
  714    HA   PHE  95           HA       PHE  95  -4.641  -4.107  -4.813
  715   1HB   PHE  95          HB2       PHE  95  -6.341  -4.161  -3.004
  716   2HB   PHE  95          HB1       PHE  95  -5.107  -4.742  -1.887
  717    HD1  PHE  95           HD1      PHE  95  -6.306  -1.874  -3.843
  718    HD2  PHE  95           HD2      PHE  95  -3.304  -3.292  -1.120
  719    HE1  PHE  95           HE1      PHE  95  -5.591   0.461  -3.417
  720    HE2  PHE  95           HE2      PHE  95  -2.585  -0.961  -0.694
  721    HZ   PHE  95           HZ       PHE  95  -3.736   0.915  -1.844
  722    H    VAL  96           HN       VAL  96  -3.270  -6.203  -2.248
  723    HA   VAL  96           HA       VAL  96  -0.873  -4.687  -1.927
  724    HB   VAL  96           HB       VAL  96  -1.232  -7.669  -1.508
  725   1HG1  VAL  96          HG11      VAL  96   0.773  -5.619  -0.548
  726   2HG1  VAL  96          HG12      VAL  96   1.083  -7.137  -1.391
  727   3HG1  VAL  96          HG13      VAL  96   0.535  -7.155   0.285
  728   1HG2  VAL  96          HG21      VAL  96  -1.690  -6.967   0.869
  729   2HG2  VAL  96          HG22      VAL  96  -2.950  -6.490  -0.270
  730   3HG2  VAL  96          HG23      VAL  96  -1.782  -5.299   0.302
  731    H    LYS  97           HN       LYS  97  -1.535  -7.571  -3.941
  732    HA   LYS  97           HA       LYS  97   1.102  -7.826  -4.976
  733   1HB   LYS  97          HB2       LYS  97  -1.582  -8.580  -6.151
  734   2HB   LYS  97          HB1       LYS  97  -0.039  -9.034  -6.878
  735   1HG   LYS  97          HG2       LYS  97   0.619 -10.163  -4.788
  736   2HG   LYS  97          HG1       LYS  97  -0.922  -9.714  -4.059
  737   1HD   LYS  97          HD2       LYS  97  -2.105 -10.987  -5.839
  738   2HD   LYS  97          HD1       LYS  97  -0.541 -11.493  -6.484
  739   1HE   LYS  97          HE2       LYS  97  -1.507 -13.216  -4.982
  740   2HE   LYS  97          HE1       LYS  97   0.011 -12.576  -4.351
  741   1HZ   LYS  97          HZ1       LYS  97  -2.372 -12.664  -3.023
  742   2HZ   LYS  97          HZ2       LYS  97  -2.246 -11.040  -3.509
  743   3HZ   LYS  97          HZ3       LYS  97  -1.014 -11.749  -2.578
  744    H    ASP  98           HN       ASP  98  -1.693  -6.000  -6.287
  745    HA   ASP  98           HA       ASP  98  -0.378  -5.141  -8.663
  746   1HB   ASP  98          HB2       ASP  98  -2.533  -3.816  -6.993
  747   2HB   ASP  98          HB1       ASP  98  -2.004  -3.202  -8.561
  748    H    LEU  99           HN       LEU  99  -0.452  -3.778  -5.400
  749    HA   LEU  99           HA       LEU  99   1.003  -1.393  -5.971
  750   1HB   LEU  99          HB2       LEU  99  -0.244  -1.778  -3.861
  751   2HB   LEU  99          HB1       LEU  99   0.917  -3.021  -3.409
  752    HG   LEU  99           HG       LEU  99   2.734  -1.294  -3.510
  753   1HD1  LEU  99          HD11      LEU  99   1.953   0.423  -4.914
  754   2HD1  LEU  99          HD12      LEU  99   1.754   1.131  -3.315
  755   3HD1  LEU  99          HD13      LEU  99   0.361   0.454  -4.156
  756   1HD2  LEU  99          HD21      LEU  99   2.168  -0.293  -1.373
  757   2HD2  LEU  99          HD22      LEU  99   1.538  -1.940  -1.403
  758   3HD2  LEU  99          HD23      LEU  99   0.449  -0.575  -1.655
  759    H    LEU 100           HN       LEU 100   2.031  -4.673  -5.138
  760    HA   LEU 100           HA       LEU 100   4.791  -4.226  -4.742
  761   1HB   LEU 100          HB2       LEU 100   3.762  -6.356  -4.219
  762   2HB   LEU 100          HB1       LEU 100   3.339  -6.613  -5.904
  763    HG   LEU 100           HG       LEU 100   5.699  -6.768  -6.519
  764   1HD1  LEU 100          HD11      LEU 100   7.334  -6.895  -4.501
  765   2HD1  LEU 100          HD12      LEU 100   6.092  -5.997  -3.626
  766   3HD1  LEU 100          HD13      LEU 100   6.839  -5.301  -5.065
  767   1HD2  LEU 100          HD21      LEU 100   6.253  -8.832  -5.252
  768   2HD2  LEU 100          HD22      LEU 100   4.566  -8.813  -5.766
  769   3HD2  LEU 100          HD23      LEU 100   4.982  -8.444  -4.092
  770    H    LEU 101           HN       LEU 101   3.042  -4.804  -7.822
  771    HA   LEU 101           HA       LEU 101   5.377  -4.943  -9.463
  772   1HB   LEU 101          HB2       LEU 101   2.526  -4.117  -9.992
  773   2HB   LEU 101          HB1       LEU 101   3.734  -3.944 -11.256
  774    HG   LEU 101           HG       LEU 101   2.354  -6.122 -11.222
  775   1HD1  LEU 101          HD11      LEU 101   4.589  -5.712 -12.425
  776   2HD1  LEU 101          HD12      LEU 101   4.143  -7.386 -12.116
  777   3HD1  LEU 101          HD13      LEU 101   5.334  -6.592 -11.091
  778   1HD2  LEU 101          HD21      LEU 101   2.708  -6.392  -8.698
  779   2HD2  LEU 101          HD22      LEU 101   4.328  -6.953  -9.089
  780   3HD2  LEU 101          HD23      LEU 101   2.922  -7.832  -9.682
  781    H    HIS 102           HN       HIS 102   3.423  -2.154  -8.459
  782    HA   HIS 102           HA       HIS 102   5.025  -0.250  -9.905
  783   1HB   HIS 102          HB2       HIS 102   3.033   0.006  -7.652
  784   2HB   HIS 102          HB1       HIS 102   3.874   1.405  -8.324
  785    HD1  HIS 102           HD1      HIS 102   3.399   2.008 -10.817
  786    HD2  HIS 102           HD2      HIS 102   1.066  -1.121  -9.359
  787    HE1  HIS 102           HE1      HIS 102   1.571   1.631 -12.522
  788    H    LEU 103           HN       LEU 103   5.198  -1.433  -6.528
  789    HA   LEU 103           HA       LEU 103   7.029   0.530  -5.609
  790   1HB   LEU 103          HB2       LEU 103   6.733  -2.380  -4.833
  791   2HB   LEU 103          HB1       LEU 103   7.786  -1.254  -3.980
  792    HG   LEU 103           HG       LEU 103   4.818  -0.817  -4.402
  793   1HD1  LEU 103          HD11      LEU 103   4.584  -1.431  -2.017
  794   2HD1  LEU 103          HD12      LEU 103   6.304  -1.814  -1.951
  795   3HD1  LEU 103          HD13      LEU 103   5.225  -2.775  -2.961
  796   1HD2  LEU 103          HD21      LEU 103   5.631   1.316  -3.963
  797   2HD2  LEU 103          HD22      LEU 103   7.011   0.723  -3.039
  798   3HD2  LEU 103          HD23      LEU 103   5.406   0.749  -2.312
  799    H    LYS 104           HN       LYS 104   7.811  -2.694  -7.025
  800    HA   LYS 104           HA       LYS 104  10.640  -2.084  -7.024
  801   1HB   LYS 104          HB2       LYS 104  10.873  -4.056  -8.511
  802   2HB   LYS 104          HB1       LYS 104   9.923  -4.414  -7.072
  803   1HG   LYS 104          HG2       LYS 104   7.849  -4.177  -8.349
  804   2HG   LYS 104          HG1       LYS 104   8.767  -3.736  -9.792
  805   1HD   LYS 104          HD2       LYS 104   9.883  -5.924  -9.778
  806   2HD   LYS 104          HD1       LYS 104   9.023  -6.371  -8.306
  807   1HE   LYS 104          HE2       LYS 104   6.982  -6.602  -9.408
  808   2HE   LYS 104          HE1       LYS 104   7.444  -5.516 -10.720
  809   1HZ   LYS 104          HZ1       LYS 104   9.234  -7.395 -11.088
  810   2HZ   LYS 104          HZ2       LYS 104   7.678  -7.497 -11.763
  811   3HZ   LYS 104          HZ3       LYS 104   8.047  -8.349 -10.341
  812    H    LYS 105           HN       LYS 105   8.018  -1.261  -9.122
  813    HA   LYS 105           HA       LYS 105   9.514  -0.848 -11.539
  814   1HB   LYS 105          HB2       LYS 105   7.000  -0.935 -11.366
  815   2HB   LYS 105          HB1       LYS 105   7.055   0.672 -10.640
  816   1HG   LYS 105          HG2       LYS 105   8.185   1.548 -12.650
  817   2HG   LYS 105          HG1       LYS 105   8.136  -0.057 -13.379
  818   1HD   LYS 105          HD2       LYS 105   5.635  -0.009 -13.180
  819   2HD   LYS 105          HD1       LYS 105   5.756   1.659 -12.618
  820   1HE   LYS 105          HE2       LYS 105   6.802   2.338 -14.711
  821   2HE   LYS 105          HE1       LYS 105   6.845   0.666 -15.269
  822   1HZ   LYS 105          HZ1       LYS 105   4.891   2.339 -15.881
  823   2HZ   LYS 105          HZ2       LYS 105   4.251   1.695 -14.445
  824   3HZ   LYS 105          HZ3       LYS 105   4.653   0.666 -15.736
  825    H    LEU 106           HN       LEU 106   8.500   1.481  -9.015
  826    HA   LEU 106           HA       LEU 106   9.923   3.685 -10.141
  827   1HB   LEU 106          HB2       LEU 106   8.910   3.053  -7.376
  828   2HB   LEU 106          HB1       LEU 106   9.889   4.489  -7.645
  829    HG   LEU 106           HG       LEU 106   7.346   4.796  -7.772
  830   1HD1  LEU 106          HD11      LEU 106   8.670   5.590 -10.364
  831   2HD1  LEU 106          HD12      LEU 106   9.165   6.310  -8.835
  832   3HD1  LEU 106          HD13      LEU 106   7.506   6.486  -9.394
  833   1HD2  LEU 106          HD21      LEU 106   7.641   3.589 -10.528
  834   2HD2  LEU 106          HD22      LEU 106   6.162   4.060  -9.694
  835   3HD2  LEU 106          HD23      LEU 106   7.069   2.656  -9.150
  836    H    PHE 107           HN       PHE 107  10.945   1.055  -8.022
  837    HA   PHE 107           HA       PHE 107  13.428   2.173  -7.200
  838   1HB   PHE 107          HB2       PHE 107  12.543   0.098  -6.218
  839   2HB   PHE 107          HB1       PHE 107  12.775  -0.736  -7.758
  840    HD1  PHE 107           HD1      PHE 107  14.600   1.191  -5.128
  841    HD2  PHE 107           HD2      PHE 107  14.870  -1.675  -8.313
  842    HE1  PHE 107           HE1      PHE 107  16.971   0.780  -4.552
  843    HE2  PHE 107           HE2      PHE 107  17.243  -2.096  -7.732
  844    HZ   PHE 107           HZ       PHE 107  18.295  -0.869  -5.851
  845    H    ARG 108           HN       ARG 108  12.554   0.368 -10.143
  846    HA   ARG 108           HA       ARG 108  15.212   0.180 -11.172
  847   1HB   ARG 108          HB2       ARG 108  12.523   0.231 -12.561
  848   2HB   ARG 108          HB1       ARG 108  14.043   0.003 -13.426
  849   1HG   ARG 108          HG2       ARG 108  14.532  -1.932 -11.852
  850   2HG   ARG 108          HG1       ARG 108  12.887  -1.762 -11.254
  851   1HD   ARG 108          HD2       ARG 108  13.312  -2.024 -14.213
  852   2HD   ARG 108          HD1       ARG 108  13.464  -3.467 -13.228
  853    HE   ARG 108           HE       ARG 108  11.026  -2.154 -14.054
  854   1HH1  ARG 108          HH21      ARG 108  12.455  -3.598 -11.255
  855   2HH1  ARG 108          HH22      ARG 108  10.929  -3.986 -10.533
  856   1HH2  ARG 108          HH11      ARG 108   9.054  -2.683 -13.132
  857   2HH2  ARG 108          HH12      ARG 108   9.014  -3.474 -11.592
  858    H    GLU 109           HN       GLU 109  12.822   2.785 -11.294
  859    HA   GLU 109           HA       GLU 109  14.469   4.343 -13.169
  860   1HB   GLU 109          HB2       GLU 109  11.959   5.007 -11.602
  861   2HB   GLU 109          HB1       GLU 109  12.743   6.124 -12.722
  862   1HG   GLU 109          HG2       GLU 109  11.849   3.340 -13.509
  863   2HG   GLU 109          HG1       GLU 109  10.851   4.777 -13.734
  864    H    GLY 110           HN       GLY 110  14.417   3.810  -9.794
  865   1HA   GLY 110          HA2       GLY 110  15.734   4.736  -8.090
  866   2HA   GLY 110          HA1       GLY 110  16.626   5.592  -9.347
  867    H    ARG 111           HN       ARG 111  13.396   6.327  -9.740
  868    HA   ARG 111           HA       ARG 111  13.779   8.961  -8.405
  869   1HB   ARG 111          HB2       ARG 111  11.738   7.927 -10.396
  870   2HB   ARG 111          HB1       ARG 111  11.664   9.535  -9.673
  871   1HG   ARG 111          HG2       ARG 111  13.906  10.038 -10.564
  872   2HG   ARG 111          HG1       ARG 111  13.980   8.440 -11.298
  873   1HD   ARG 111          HD2       ARG 111  11.892   9.008 -12.572
  874   2HD   ARG 111          HD1       ARG 111  12.001  10.650 -11.950
  875    HE   ARG 111           HE       ARG 111  13.453   9.539 -14.180
  876   1HH1  ARG 111          HH21      ARG 111  13.915  11.576 -11.428
  877   2HH1  ARG 111          HH22      ARG 111  15.373  12.277 -12.043
  878   1HH2  ARG 111          HH11      ARG 111  15.328  10.452 -14.986
  879   2HH2  ARG 111          HH12      ARG 111  16.171  11.644 -14.054
  880    H    PHE 112           HN       PHE 112  13.319   8.607  -6.244
  881    HA   PHE 112           HA       PHE 112  10.919   7.041  -5.503
  882   1HB   PHE 112          HB2       PHE 112  13.029   8.376  -3.779
  883   2HB   PHE 112          HB1       PHE 112  11.783   7.255  -3.220
  884    HD1  PHE 112           HD1      PHE 112  11.743   4.903  -4.102
  885    HD2  PHE 112           HD2      PHE 112  15.014   7.579  -4.851
  886    HE1  PHE 112           HE1      PHE 112  13.163   2.983  -4.753
  887    HE2  PHE 112           HE2      PHE 112  16.437   5.655  -5.506
  888    HZ   PHE 112           HZ       PHE 112  15.512   3.356  -5.453
  889    H    ASN 113           HN       ASN 113   9.085   7.921  -4.633
  890    HA   ASN 113           HA       ASN 113   7.503   9.556  -4.092
  891   1HB   ASN 113          HB2       ASN 113   9.811  11.363  -3.363
  892   2HB   ASN 113          HB1       ASN 113   8.204  11.286  -2.640
  893   1HD2  ASN 113          HD21      ASN 113  10.925  10.881  -1.341
  894   2HD2  ASN 113          HD22      ASN 113  10.833   9.351  -0.613
  Start of MODEL   12
    1   1H    MET   1           HT1      MET   1  20.654   3.847  12.436
    2   2H    MET   1           HT2      MET   1  19.401   2.900  13.083
    3   3H    MET   1           HT3      MET   1  20.982   2.751  13.688
    4    HA   MET   1           HA       MET   1  19.425   4.059  15.126
    5   1HB   MET   1          HB2       MET   1  21.943   5.312  14.006
    6   2HB   MET   1          HB1       MET   1  21.107   5.928  15.430
    7   1HG   MET   1          HG2       MET   1  21.364   3.719  16.524
    8   2HG   MET   1          HG1       MET   1  22.247   3.136  15.113
    9   1HE   MET   1          HE1       MET   1  24.056   4.268  14.078
   10   2HE   MET   1          HE2       MET   1  25.450   4.916  14.937
   11   3HE   MET   1          HE3       MET   1  24.146   5.996  14.448
   12    H    GLY   2           HN       GLY   2  20.818   6.307  12.747
   13   1HA   GLY   2          HA2       GLY   2  18.563   8.086  12.948
   14   2HA   GLY   2          HA1       GLY   2  19.867   8.221  11.768
   15    HA   PRO   3           HA       PRO   3  15.651   6.551  10.020
   16   1HB   PRO   3          HB2       PRO   3  15.693   8.835   8.222
   17   2HB   PRO   3          HB1       PRO   3  14.478   8.418   9.435
   18   1HG   PRO   3          HG2       PRO   3  16.525  10.483   9.564
   19   2HG   PRO   3          HG1       PRO   3  15.201  10.175  10.694
   20   1HD   PRO   3          HD2       PRO   3  17.958   9.714  11.188
   21   2HD   PRO   3          HD1       PRO   3  16.603   9.114  12.177
   22    H    VAL   4           HN       VAL   4  15.740   5.291   8.132
   23    HA   VAL   4           HA       VAL   4  18.328   5.111   6.810
   24    HB   VAL   4           HB       VAL   4  17.067   3.339   5.434
   25   1HG1  VAL   4          HG11      VAL   4  16.862   1.825   7.504
   26   2HG1  VAL   4          HG12      VAL   4  17.346   3.238   8.442
   27   3HG1  VAL   4          HG13      VAL   4  18.434   2.573   7.223
   28   1HG2  VAL   4          HG21      VAL   4  14.973   3.750   7.579
   29   2HG2  VAL   4          HG22      VAL   4  14.887   2.685   6.176
   30   3HG2  VAL   4          HG23      VAL   4  14.820   4.435   5.961
   31    HA   PRO   5           HA       PRO   5  17.452   7.928   3.490
   32   1HB   PRO   5          HB2       PRO   5  18.479   6.299   1.358
   33   2HB   PRO   5          HB1       PRO   5  19.320   7.585   2.231
   34   1HG   PRO   5          HG2       PRO   5  19.631   4.678   2.486
   35   2HG   PRO   5          HG1       PRO   5  20.691   5.963   3.070
   36   1HD   PRO   5          HD2       PRO   5  19.042   4.342   4.685
   37   2HD   PRO   5          HD1       PRO   5  19.785   5.883   5.184
   38    HA   PRO   6           HA       PRO   6  13.628   6.818   1.570
   39   1HB   PRO   6          HB2       PRO   6  14.112   7.714  -1.088
   40   2HB   PRO   6          HB1       PRO   6  13.410   8.651   0.236
   41   1HG   PRO   6          HG2       PRO   6  16.134   8.777  -0.898
   42   2HG   PRO   6          HG1       PRO   6  15.264   9.983   0.058
   43   1HD   PRO   6          HD2       PRO   6  17.382   8.408   1.002
   44   2HD   PRO   6          HD1       PRO   6  16.195   9.244   2.034
   45    H    SER   7           HN       SER   7  16.255   6.125  -0.756
   46    HA   SER   7           HA       SER   7  14.895   4.036  -2.129
   47   1HB   SER   7          HB2       SER   7  17.042   3.470  -3.064
   48   2HB   SER   7          HB1       SER   7  16.982   5.222  -2.898
   49    HG   SER   7           HG       SER   7  18.744   4.951  -1.786
   50    H    THR   8           HN       THR   8  17.011   3.929   0.732
   51    HA   THR   8           HA       THR   8  17.101   1.052   0.863
   52    HB   THR   8           HB       THR   8  17.453   3.109   3.061
   53    HG1  THR   8           HG1      THR   8  18.924   3.248   1.313
   54   1HG2  THR   8          HG21      THR   8  18.046   0.147   2.921
   55   2HG2  THR   8          HG22      THR   8  17.017   0.984   4.082
   56   3HG2  THR   8          HG23      THR   8  18.764   1.217   4.125
   57    H    ALA   9           HN       ALA   9  14.930   3.457   2.333
   58    HA   ALA   9           HA       ALA   9  13.471   1.637   3.979
   59   1HB   ALA   9          HB1       ALA   9  11.698   3.348   3.957
   60   2HB   ALA   9          HB2       ALA   9  12.473   4.147   2.589
   61   3HB   ALA   9          HB3       ALA   9  13.277   4.108   4.159
   62    H    LEU  10           HN       LEU  10  12.982   2.698   0.624
   63    HA   LEU  10           HA       LEU  10  10.555   1.311   0.143
   64   1HB   LEU  10          HB2       LEU  10  11.509   3.019  -1.380
   65   2HB   LEU  10          HB1       LEU  10  12.804   1.903  -1.802
   66    HG   LEU  10           HG       LEU  10  11.046   0.274  -2.606
   67   1HD1  LEU  10          HD11      LEU  10   8.817   1.534  -3.181
   68   2HD1  LEU  10          HD12      LEU  10   9.279   2.602  -1.857
   69   3HD1  LEU  10          HD13      LEU  10   9.036   0.882  -1.559
   70   1HD2  LEU  10          HD21      LEU  10  11.184   3.020  -3.873
   71   2HD2  LEU  10          HD22      LEU  10  10.564   1.582  -4.680
   72   3HD2  LEU  10          HD23      LEU  10  12.251   1.651  -4.184
   73    H    ARG  11           HN       ARG  11  13.926   0.259  -0.482
   74    HA   ARG  11           HA       ARG  11  13.262  -2.308  -1.507
   75   1HB   ARG  11          HB2       ARG  11  15.695  -1.384   0.055
   76   2HB   ARG  11          HB1       ARG  11  15.592  -2.932  -0.780
   77   1HG   ARG  11          HG2       ARG  11  15.002  -0.403  -2.308
   78   2HG   ARG  11          HG1       ARG  11  16.673  -0.836  -1.988
   79   1HD   ARG  11          HD2       ARG  11  14.670  -2.694  -3.290
   80   2HD   ARG  11          HD1       ARG  11  15.791  -1.690  -4.196
   81    HE   ARG  11           HE       ARG  11  16.348  -4.230  -2.933
   82   1HH1  ARG  11          HH21      ARG  11  17.751  -1.114  -3.447
   83   2HH1  ARG  11          HH22      ARG  11  19.356  -1.645  -3.072
   84   1HH2  ARG  11          HH11      ARG  11  18.423  -4.920  -2.455
   85   2HH2  ARG  11          HH12      ARG  11  19.736  -3.791  -2.515
   86    H    GLU  12           HN       GLU  12  13.821  -1.190   1.810
   87    HA   GLU  12           HA       GLU  12  13.592  -3.754   3.066
   88   1HB   GLU  12          HB2       GLU  12  13.057  -0.942   4.062
   89   2HB   GLU  12          HB1       GLU  12  12.994  -2.365   5.106
   90   1HG   GLU  12          HG2       GLU  12  15.404  -1.642   3.420
   91   2HG   GLU  12          HG1       GLU  12  15.219  -1.153   5.105
   92    H    LEU  13           HN       LEU  13  11.200  -1.271   2.213
   93    HA   LEU  13           HA       LEU  13   8.982  -2.620   3.459
   94   1HB   LEU  13          HB2       LEU  13   8.922  -0.220   2.945
   95   2HB   LEU  13          HB1       LEU  13   9.048  -0.569   1.223
   96    HG   LEU  13           HG       LEU  13   6.883  -1.751   1.292
   97   1HD1  LEU  13          HD11      LEU  13   5.531  -1.319   3.491
   98   2HD1  LEU  13          HD12      LEU  13   7.119  -1.136   4.236
   99   3HD1  LEU  13          HD13      LEU  13   6.678  -2.655   3.454
  100   1HD2  LEU  13          HD21      LEU  13   5.497   0.202   1.520
  101   2HD2  LEU  13          HD22      LEU  13   7.070   0.762   0.950
  102   3HD2  LEU  13          HD23      LEU  13   6.630   0.947   2.648
  103    H    ILE  14           HN       ILE  14  10.256  -2.600   0.124
  104    HA   ILE  14           HA       ILE  14   8.180  -4.196  -1.019
  105    HB   ILE  14           HB       ILE  14  11.095  -3.863  -1.778
  106   1HG1  ILE  14          HG12      ILE  14   8.578  -2.829  -3.113
  107   2HG1  ILE  14          HG11      ILE  14   9.485  -1.899  -1.920
  108   1HG2  ILE  14          HG21      ILE  14   8.853  -5.383  -3.129
  109   2HG2  ILE  14          HG22      ILE  14  10.468  -5.964  -2.724
  110   3HG2  ILE  14          HG23      ILE  14  10.253  -4.791  -4.022
  111   1HD1  ILE  14          HD11      ILE  14  10.168  -1.310  -4.224
  112   2HD1  ILE  14          HD12      ILE  14  10.615  -2.991  -4.514
  113   3HD1  ILE  14          HD13      ILE  14  11.500  -2.035  -3.325
  114    H    GLU  15           HN       GLU  15  11.314  -5.139   0.409
  115    HA   GLU  15           HA       GLU  15  11.095  -7.921  -0.093
  116   1HB   GLU  15          HB2       GLU  15  12.475  -6.420   2.146
  117   2HB   GLU  15          HB1       GLU  15  12.672  -8.150   1.863
  118   1HG   GLU  15          HG2       GLU  15  13.209  -6.042  -0.246
  119   2HG   GLU  15          HG1       GLU  15  14.459  -6.715   0.800
  120    H    GLU  16           HN       GLU  16   9.895  -6.005   2.675
  121    HA   GLU  16           HA       GLU  16   8.992  -8.327   4.137
  122   1HB   GLU  16          HB2       GLU  16   9.393  -6.074   5.162
  123   2HB   GLU  16          HB1       GLU  16   7.955  -5.485   4.331
  124   1HG   GLU  16          HG2       GLU  16   7.334  -6.104   6.596
  125   2HG   GLU  16          HG1       GLU  16   6.624  -7.274   5.487
  126    H    LEU  17           HN       LEU  17   7.400  -6.115   1.842
  127    HA   LEU  17           HA       LEU  17   4.758  -7.148   2.120
  128   1HB   LEU  17          HB2       LEU  17   6.183  -5.937  -0.264
  129   2HB   LEU  17          HB1       LEU  17   4.466  -6.327  -0.266
  130    HG   LEU  17           HG       LEU  17   5.774  -4.514   1.782
  131   1HD1  LEU  17          HD11      LEU  17   4.757  -2.656   0.477
  132   2HD1  LEU  17          HD12      LEU  17   4.273  -3.816  -0.760
  133   3HD1  LEU  17          HD13      LEU  17   5.984  -3.523  -0.447
  134   1HD2  LEU  17          HD21      LEU  17   2.951  -5.394   1.197
  135   2HD2  LEU  17          HD22      LEU  17   3.216  -3.769   1.825
  136   3HD2  LEU  17          HD23      LEU  17   3.752  -5.166   2.750
  137    H    VAL  18           HN       VAL  18   7.403  -8.113  -0.048
  138    HA   VAL  18           HA       VAL  18   5.959 -10.187  -1.389
  139    HB   VAL  18           HB       VAL  18   8.926  -9.800  -0.897
  140   1HG1  VAL  18          HG11      VAL  18   8.627 -12.123  -1.394
  141   2HG1  VAL  18          HG12      VAL  18   9.118 -11.356  -2.904
  142   3HG1  VAL  18          HG13      VAL  18   7.426 -11.769  -2.635
  143   1HG2  VAL  18          HG21      VAL  18   7.645  -8.066  -2.229
  144   2HG2  VAL  18          HG22      VAL  18   7.272  -9.337  -3.393
  145   3HG2  VAL  18          HG23      VAL  18   8.947  -8.860  -3.116
  146    H    ASN  19           HN       ASN  19   7.983 -10.195   1.528
  147    HA   ASN  19           HA       ASN  19   8.083 -12.997   1.953
  148   1HB   ASN  19          HB2       ASN  19   8.119 -10.662   3.874
  149   2HB   ASN  19          HB1       ASN  19   8.366 -12.328   4.397
  150   1HD2  ASN  19          HD21      ASN  19  10.332 -10.041   4.375
  151   2HD2  ASN  19          HD22      ASN  19  11.643 -10.591   3.447
  152    H    ILE  20           HN       ILE  20   5.664 -10.627   3.117
  153    HA   ILE  20           HA       ILE  20   4.157 -12.703   4.494
  154    HB   ILE  20           HB       ILE  20   2.549 -10.914   4.983
  155   1HG1  ILE  20          HG12      ILE  20   4.318  -9.120   3.298
  156   2HG1  ILE  20          HG11      ILE  20   2.794  -9.780   2.718
  157   1HG2  ILE  20          HG21      ILE  20   4.520 -11.077   6.394
  158   2HG2  ILE  20          HG22      ILE  20   4.163  -9.371   6.125
  159   3HG2  ILE  20          HG23      ILE  20   5.471 -10.149   5.235
  160   1HD1  ILE  20          HD11      ILE  20   2.543  -7.489   3.668
  161   2HD1  ILE  20          HD12      ILE  20   3.087  -8.110   5.226
  162   3HD1  ILE  20          HD13      ILE  20   1.578  -8.693   4.523
  163    H    THR  21           HN       THR  21   4.077 -11.438   1.236
  164    HA   THR  21           HA       THR  21   1.332 -12.517   0.817
  165    HB   THR  21           HB       THR  21   1.578 -11.531  -1.471
  166    HG1  THR  21           HG1      THR  21   3.407 -10.326  -1.893
  167   1HG2  THR  21          HG21      THR  21   1.108  -9.370  -0.770
  168   2HG2  THR  21          HG22      THR  21   2.366  -9.378   0.461
  169   3HG2  THR  21          HG23      THR  21   0.857 -10.247   0.737
  170    H    GLN  22           HN       GLN  22   4.602 -13.503   0.395
  171    HA   GLN  22           HA       GLN  22   4.113 -15.273  -1.862
  172   1HB   GLN  22          HB2       GLN  22   6.351 -14.973   0.138
  173   2HB   GLN  22          HB1       GLN  22   6.330 -16.329  -0.990
  174   1HG   GLN  22          HG2       GLN  22   5.994 -13.483  -1.949
  175   2HG   GLN  22          HG1       GLN  22   7.592 -14.194  -1.722
  176   1HE2  GLN  22          HE21      GLN  22   7.603 -16.628  -2.747
  177   2HE2  GLN  22          HE22      GLN  22   6.996 -16.702  -4.331
  178    H    ASN  23           HN       ASN  23   4.158 -15.657   1.662
  179    HA   ASN  23           HA       ASN  23   3.438 -18.531   1.378
  180   1HB   ASN  23          HB2       ASN  23   4.181 -16.818   3.761
  181   2HB   ASN  23          HB1       ASN  23   3.692 -18.508   3.887
  182   1HD2  ASN  23          HD21      ASN  23   6.326 -17.581   4.635
  183   2HD2  ASN  23          HD22      ASN  23   7.445 -18.285   3.571
  184    H    GLN  24           HN       GLN  24   1.642 -15.838   1.167
  185    HA   GLN  24           HA       GLN  24  -0.344 -16.425   3.237
  186   1HB   GLN  24          HB2       GLN  24  -1.515 -14.529   2.475
  187   2HB   GLN  24          HB1       GLN  24   0.170 -14.114   2.183
  188   1HG   GLN  24          HG2       GLN  24  -0.145 -14.959  -0.196
  189   2HG   GLN  24          HG1       GLN  24  -1.872 -15.060   0.152
  190   1HE2  GLN  24          HE21      GLN  24  -1.207 -13.299  -1.847
  191   2HE2  GLN  24          HE22      GLN  24  -1.321 -11.695  -1.301
  192    H    LYS  25           HN       LYS  25  -1.932 -17.895   3.078
  193    HA   LYS  25           HA       LYS  25  -2.411 -19.260   0.495
  194   1HB   LYS  25          HB2       LYS  25  -2.218 -20.599   2.584
  195   2HB   LYS  25          HB1       LYS  25  -3.614 -19.747   3.244
  196   1HG   LYS  25          HG2       LYS  25  -5.011 -20.586   1.387
  197   2HG   LYS  25          HG1       LYS  25  -3.617 -21.438   0.725
  198   1HD   LYS  25          HD2       LYS  25  -3.446 -22.769   2.798
  199   2HD   LYS  25          HD1       LYS  25  -4.843 -21.916   3.457
  200   1HE   LYS  25          HE2       LYS  25  -4.970 -23.404   0.829
  201   2HE   LYS  25          HE1       LYS  25  -5.312 -24.192   2.369
  202   1HZ   LYS  25          HZ1       LYS  25  -7.377 -23.461   1.715
  203   2HZ   LYS  25          HZ2       LYS  25  -6.783 -22.026   1.026
  204   3HZ   LYS  25          HZ3       LYS  25  -6.874 -22.188   2.715
  205    H    ALA  26           HN       ALA  26  -4.748 -18.335   3.002
  206    HA   ALA  26           HA       ALA  26  -6.683 -17.540   0.965
  207   1HB   ALA  26          HB1       ALA  26  -7.702 -16.694   3.426
  208   2HB   ALA  26          HB2       ALA  26  -6.657 -18.038   3.875
  209   3HB   ALA  26          HB3       ALA  26  -7.963 -18.291   2.721
  210    HA   PRO  27           HA       PRO  27  -5.793 -13.229   0.549
  211   1HB   PRO  27          HB2       PRO  27  -8.341 -12.417   1.821
  212   2HB   PRO  27          HB1       PRO  27  -7.774 -12.136   0.171
  213   1HG   PRO  27          HG2       PRO  27  -9.735 -14.008   0.950
  214   2HG   PRO  27          HG1       PRO  27  -8.932 -13.936  -0.624
  215   1HD   PRO  27          HD2       PRO  27  -8.637 -15.969   1.431
  216   2HD   PRO  27          HD1       PRO  27  -7.866 -15.911  -0.173
  217    H    LEU  28           HN       LEU  28  -5.324 -11.256   1.867
  218    HA   LEU  28           HA       LEU  28  -4.311 -11.931   4.485
  219   1HB   LEU  28          HB2       LEU  28  -4.726  -9.211   3.207
  220   2HB   LEU  28          HB1       LEU  28  -3.751  -9.524   4.639
  221    HG   LEU  28           HG       LEU  28  -3.242 -10.827   1.947
  222   1HD1  LEU  28          HD11      LEU  28  -1.816  -8.460   3.197
  223   2HD1  LEU  28          HD12      LEU  28  -2.992  -8.335   1.888
  224   3HD1  LEU  28          HD13      LEU  28  -1.470  -9.189   1.629
  225   1HD2  LEU  28          HD21      LEU  28  -1.786 -10.742   4.599
  226   2HD2  LEU  28          HD22      LEU  28  -0.908 -11.045   3.101
  227   3HD2  LEU  28          HD23      LEU  28  -2.187 -12.143   3.607
  228    H    CYS  29           HN       CYS  29  -7.417 -11.313   3.469
  229    HA   CYS  29           HA       CYS  29  -8.281 -10.723   6.253
  230   1HB   CYS  29          HB2       CYS  29  -9.131  -9.113   3.822
  231   2HB   CYS  29          HB1       CYS  29  -9.849  -8.974   5.426
  232    H    ASN  30           HN       ASN  30 -10.853 -10.812   6.210
  233    HA   ASN  30           HA       ASN  30 -11.560 -13.422   5.232
  234   1HB   ASN  30          HB2       ASN  30 -13.887 -12.730   5.932
  235   2HB   ASN  30          HB1       ASN  30 -12.672 -12.573   7.198
  236   1HD2  ASN  30          HD21      ASN  30 -13.371 -10.743   8.353
  237   2HD2  ASN  30          HD22      ASN  30 -13.678  -9.230   7.648
  238    H    GLY  31           HN       GLY  31 -10.607 -11.901   3.057
  239   1HA   GLY  31          HA2       GLY  31 -11.223 -11.739   0.781
  240   2HA   GLY  31          HA1       GLY  31 -12.878 -12.152   1.233
  241    H    SER  32           HN       SER  32 -11.351  -9.606   3.011
  242    HA   SER  32           HA       SER  32 -13.367  -7.705   2.312
  243   1HB   SER  32          HB2       SER  32 -10.600  -7.205   3.447
  244   2HB   SER  32          HB1       SER  32 -11.928  -6.048   3.439
  245    HG   SER  32           HG       SER  32 -11.416  -7.938   5.213
  246    H    MET  33           HN       MET  33 -13.276  -5.907   0.920
  247    HA   MET  33           HA       MET  33 -11.124  -6.004  -1.174
  248   1HB   MET  33          HB2       MET  33 -14.003  -5.115  -1.510
  249   2HB   MET  33          HB1       MET  33 -12.794  -5.261  -2.783
  250   1HG   MET  33          HG2       MET  33 -12.661  -7.781  -1.823
  251   2HG   MET  33          HG1       MET  33 -14.323  -7.409  -1.371
  252   1HE   MET  33          HE1       MET  33 -15.568  -5.741  -4.484
  253   2HE   MET  33          HE2       MET  33 -15.718  -6.030  -2.755
  254   3HE   MET  33          HE3       MET  33 -16.416  -7.174  -3.894
  255    H    VAL  34           HN       VAL  34 -10.659  -3.875  -2.160
  256    HA   VAL  34           HA       VAL  34 -11.284  -1.562  -0.350
  257    HB   VAL  34           HB       VAL  34  -8.923  -0.778  -0.873
  258   1HG1  VAL  34          HG11      VAL  34  -9.291  -3.364   0.670
  259   2HG1  VAL  34          HG12      VAL  34  -9.530  -1.735   1.300
  260   3HG1  VAL  34          HG13      VAL  34  -7.916  -2.272   0.836
  261   1HG2  VAL  34          HG21      VAL  34  -8.606  -3.685  -1.690
  262   2HG2  VAL  34          HG22      VAL  34  -7.322  -2.480  -1.602
  263   3HG2  VAL  34          HG23      VAL  34  -8.597  -2.323  -2.811
  264    H    TRP  35           HN       TRP  35 -11.062   0.536  -1.425
  265    HA   TRP  35           HA       TRP  35 -12.280   0.533  -4.043
  266   1HB   TRP  35          HB2       TRP  35 -11.011   2.760  -2.423
  267   2HB   TRP  35          HB1       TRP  35 -11.942   3.008  -3.900
  268    HD1  TRP  35           HD1      TRP  35 -12.299   2.134  -0.230
  269    HE1  TRP  35           HE1      TRP  35 -14.794   2.181   0.407
  270    HE3  TRP  35           HE3      TRP  35 -14.390   2.611  -4.870
  271    HZ2  TRP  35           HZ2      TRP  35 -17.341   2.383  -0.873
  272    HZ3  TRP  35           HZ3      TRP  35 -16.857   2.728  -5.124
  273    HH2  TRP  35           HH2      TRP  35 -18.330   2.613  -3.137
  274    H    SER  36           HN       SER  36 -11.311   0.728  -6.038
  275    HA   SER  36           HA       SER  36  -8.459   0.313  -6.264
  276   1HB   SER  36          HB2       SER  36  -8.819   0.394  -8.648
  277   2HB   SER  36          HB1       SER  36 -10.196  -0.447  -7.942
  278    HG   SER  36           HG       SER  36 -10.561   1.357  -9.530
  279    H    ILE  37           HN       ILE  37  -6.894   1.810  -7.091
  280    HA   ILE  37           HA       ILE  37  -7.700   4.699  -7.071
  281    HB   ILE  37           HB       ILE  37  -5.514   5.162  -5.899
  282   1HG1  ILE  37          HG12      ILE  37  -5.570   2.237  -5.131
  283   2HG1  ILE  37          HG11      ILE  37  -4.636   2.794  -6.512
  284   1HG2  ILE  37          HG21      ILE  37  -6.371   4.265  -3.646
  285   2HG2  ILE  37          HG22      ILE  37  -7.696   3.552  -4.565
  286   3HG2  ILE  37          HG23      ILE  37  -7.470   5.301  -4.557
  287   1HD1  ILE  37          HD11      ILE  37  -4.355   4.006  -3.756
  288   2HD1  ILE  37          HD12      ILE  37  -3.294   4.237  -5.146
  289   3HD1  ILE  37          HD13      ILE  37  -3.349   2.675  -4.328
  290    H    ASN  38           HN       ASN  38  -6.110   6.081  -8.209
  291    HA   ASN  38           HA       ASN  38  -5.023   4.685 -10.577
  292   1HB   ASN  38          HB2       ASN  38  -6.265   6.864 -10.781
  293   2HB   ASN  38          HB1       ASN  38  -4.962   7.642  -9.880
  294   1HD2  ASN  38          HD21      ASN  38  -4.865   5.158 -12.498
  295   2HD2  ASN  38          HD22      ASN  38  -3.853   6.062 -13.517
  296    H    LEU  39           HN       LEU  39  -2.968   3.894 -10.453
  297    HA   LEU  39           HA       LEU  39  -1.193   4.750  -8.306
  298   1HB   LEU  39          HB2       LEU  39  -0.796   2.857 -10.639
  299   2HB   LEU  39          HB1       LEU  39   0.428   3.159  -9.411
  300    HG   LEU  39           HG       LEU  39  -0.875   1.111  -8.923
  301   1HD1  LEU  39          HD11      LEU  39  -1.041   1.474  -6.642
  302   2HD1  LEU  39          HD12      LEU  39  -1.756   3.073  -6.826
  303   3HD1  LEU  39          HD13      LEU  39  -0.032   2.838  -7.111
  304   1HD2  LEU  39          HD21      LEU  39  -3.009   2.158  -9.988
  305   2HD2  LEU  39          HD22      LEU  39  -3.282   2.834  -8.383
  306   3HD2  LEU  39          HD23      LEU  39  -3.195   1.089  -8.599
  307    H    THR  40           HN       THR  40  -0.050   6.591  -8.448
  308    HA   THR  40           HA       THR  40   1.333   7.252 -10.997
  309    HB   THR  40           HB       THR  40   0.631   9.602 -10.839
  310    HG1  THR  40           HG1      THR  40  -0.755  10.251  -9.262
  311   1HG2  THR  40          HG21      THR  40  -0.817   7.714 -11.960
  312   2HG2  THR  40          HG22      THR  40  -1.508   9.322 -11.747
  313   3HG2  THR  40          HG23      THR  40  -1.923   8.030 -10.622
  314    H    ALA  41           HN       ALA  41   1.083   9.591  -8.436
  315    HA   ALA  41           HA       ALA  41   3.891   8.933  -7.584
  316   1HB   ALA  41          HB1       ALA  41   2.440  11.592  -7.684
  317   2HB   ALA  41          HB2       ALA  41   3.767  11.080  -8.727
  318   3HB   ALA  41          HB3       ALA  41   4.051  11.356  -7.008
  319    H    GLY  42           HN       GLY  42   1.046  10.699  -6.282
  320   1HA   GLY  42          HA2       GLY  42   1.803  10.177  -3.542
  321   2HA   GLY  42          HA1       GLY  42   0.241  10.804  -4.071
  322    H    MET  43           HN       MET  43   1.756   7.757  -5.042
  323    HA   MET  43           HA       MET  43  -0.621   6.226  -4.740
  324   1HB   MET  43          HB2       MET  43   2.259   5.277  -4.655
  325   2HB   MET  43          HB1       MET  43   0.846   4.272  -4.983
  326   1HG   MET  43          HG2       MET  43   0.330   5.787  -6.926
  327   2HG   MET  43          HG1       MET  43   1.883   6.568  -6.659
  328   1HE   MET  43          HE1       MET  43   4.535   4.144  -7.345
  329   2HE   MET  43          HE2       MET  43   3.759   3.773  -5.808
  330   3HE   MET  43          HE3       MET  43   3.922   5.450  -6.322
  331    H    TYR  44           HN       TYR  44   2.111   6.768  -2.549
  332    HA   TYR  44           HA       TYR  44   1.414   4.879  -0.553
  333   1HB   TYR  44          HB2       TYR  44   2.773   7.577  -0.295
  334   2HB   TYR  44          HB1       TYR  44   2.732   6.350   0.970
  335    HD1  TYR  44           HD1      TYR  44   4.006   4.274   0.762
  336    HD2  TYR  44           HD2      TYR  44   4.057   7.226  -2.355
  337    HE1  TYR  44           HE1      TYR  44   5.935   3.127  -0.290
  338    HE2  TYR  44           HE2      TYR  44   5.991   6.083  -3.406
  339    HH   TYR  44           HH       TYR  44   7.462   3.204  -1.904
  340    H    CYS  45           HN       CYS  45   0.548   8.357  -0.751
  341    HA   CYS  45           HA       CYS  45  -1.094   8.290   1.611
  342   1HB   CYS  45          HB2       CYS  45  -1.047  10.174  -0.760
  343   2HB   CYS  45          HB1       CYS  45  -2.045  10.433   0.672
  344    H    ALA  46           HN       ALA  46  -1.924   8.142  -1.867
  345    HA   ALA  46           HA       ALA  46  -4.734   7.863  -1.510
  346   1HB   ALA  46          HB1       ALA  46  -2.933   6.785  -3.699
  347   2HB   ALA  46          HB2       ALA  46  -3.776   8.334  -3.703
  348   3HB   ALA  46          HB3       ALA  46  -4.695   6.830  -3.785
  349    H    ALA  47           HN       ALA  47  -2.142   5.432  -1.635
  350    HA   ALA  47           HA       ALA  47  -3.865   3.148  -1.500
  351   1HB   ALA  47          HB1       ALA  47  -0.969   3.606  -0.774
  352   2HB   ALA  47          HB2       ALA  47  -1.621   2.749  -2.170
  353   3HB   ALA  47          HB3       ALA  47  -1.738   2.034  -0.562
  354    H    LEU  48           HN       LEU  48  -2.278   5.090   1.018
  355    HA   LEU  48           HA       LEU  48  -2.966   3.461   3.230
  356   1HB   LEU  48          HB2       LEU  48  -1.346   5.301   3.374
  357   2HB   LEU  48          HB1       LEU  48  -2.638   6.471   3.117
  358    HG   LEU  48           HG       LEU  48  -3.728   5.744   5.211
  359   1HD1  LEU  48          HD11      LEU  48  -1.477   3.735   5.182
  360   2HD1  LEU  48          HD12      LEU  48  -3.187   3.482   5.533
  361   3HD1  LEU  48          HD13      LEU  48  -2.154   4.269   6.722
  362   1HD2  LEU  48          HD21      LEU  48  -2.117   7.569   5.332
  363   2HD2  LEU  48          HD22      LEU  48  -0.781   6.423   5.452
  364   3HD2  LEU  48          HD23      LEU  48  -1.946   6.561   6.769
  365    H    GLU  49           HN       GLU  49  -4.780   6.277   1.894
  366    HA   GLU  49           HA       GLU  49  -6.909   6.136   3.766
  367   1HB   GLU  49          HB2       GLU  49  -8.301   7.210   1.924
  368   2HB   GLU  49          HB1       GLU  49  -6.819   8.064   2.357
  369   1HG   GLU  49          HG2       GLU  49  -5.657   7.066   0.462
  370   2HG   GLU  49          HG1       GLU  49  -7.097   6.137   0.036
  371    H    SER  50           HN       SER  50  -6.433   4.370   0.708
  372    HA   SER  50           HA       SER  50  -9.012   3.090   0.767
  373   1HB   SER  50          HB2       SER  50  -8.080   1.546  -0.861
  374   2HB   SER  50          HB1       SER  50  -7.486   3.162  -1.232
  375    HG   SER  50           HG       SER  50  -5.766   1.725  -1.252
  376    H    LEU  51           HN       LEU  51  -5.822   2.192   2.066
  377    HA   LEU  51           HA       LEU  51  -6.683  -0.361   3.114
  378   1HB   LEU  51          HB2       LEU  51  -4.341   1.432   3.804
  379   2HB   LEU  51          HB1       LEU  51  -4.578  -0.163   4.510
  380    HG   LEU  51           HG       LEU  51  -4.400   0.357   1.526
  381   1HD1  LEU  51          HD11      LEU  51  -2.266  -0.750   3.374
  382   2HD1  LEU  51          HD12      LEU  51  -2.295   0.911   2.782
  383   3HD1  LEU  51          HD13      LEU  51  -2.109  -0.426   1.647
  384   1HD2  LEU  51          HD21      LEU  51  -4.661  -2.106   3.250
  385   2HD2  LEU  51          HD22      LEU  51  -3.772  -2.215   1.732
  386   3HD2  LEU  51          HD23      LEU  51  -5.460  -1.722   1.725
  387    H    ILE  52           HN       ILE  52  -6.516   2.916   4.438
  388    HA   ILE  52           HA       ILE  52  -6.972   2.349   7.153
  389    HB   ILE  52           HB       ILE  52  -7.748   4.672   5.391
  390   1HG1  ILE  52          HG12      ILE  52  -5.348   4.183   6.157
  391   2HG1  ILE  52          HG11      ILE  52  -5.957   5.802   6.460
  392   1HG2  ILE  52          HG21      ILE  52  -8.264   5.887   7.585
  393   2HG2  ILE  52          HG22      ILE  52  -8.405   4.288   8.314
  394   3HG2  ILE  52          HG23      ILE  52  -9.489   4.758   7.005
  395   1HD1  ILE  52          HD11      ILE  52  -5.777   5.564   8.705
  396   2HD1  ILE  52          HD12      ILE  52  -4.775   4.162   8.348
  397   3HD1  ILE  52          HD13      ILE  52  -6.485   3.950   8.701
  398    H    ASN  53           HN       ASN  53  -9.065   1.789   4.498
  399    HA   ASN  53           HA       ASN  53 -11.535   1.916   6.101
  400   1HB   ASN  53          HB2       ASN  53 -10.946   0.985   3.278
  401   2HB   ASN  53          HB1       ASN  53 -12.553   0.928   4.002
  402   1HD2  ASN  53          HD21      ASN  53 -11.354   3.567   5.479
  403   2HD2  ASN  53          HD22      ASN  53 -11.762   4.772   4.358
  404    H    VAL  54           HN       VAL  54  -9.072  -0.392   5.390
  405    HA   VAL  54           HA       VAL  54 -10.801  -2.709   6.063
  406    HB   VAL  54           HB       VAL  54  -7.820  -2.635   5.503
  407   1HG1  VAL  54          HG11      VAL  54  -8.599  -4.654   6.671
  408   2HG1  VAL  54          HG12      VAL  54  -8.173  -5.038   5.003
  409   3HG1  VAL  54          HG13      VAL  54  -9.867  -4.874   5.466
  410   1HG2  VAL  54          HG21      VAL  54 -10.219  -2.930   3.683
  411   2HG2  VAL  54          HG22      VAL  54  -8.623  -3.528   3.229
  412   3HG2  VAL  54          HG23      VAL  54  -8.868  -1.808   3.531
  413    H    SER  55           HN       SER  55 -11.073  -3.245   8.168
  414    HA   SER  55           HA       SER  55  -8.868  -2.632  10.119
  415   1HB   SER  55          HB2       SER  55 -11.860  -2.508  10.595
  416   2HB   SER  55          HB1       SER  55 -10.616  -2.238  11.812
  417    HG   SER  55           HG       SER  55 -10.016  -0.712   9.757
  418    H    GLY  56           HN       GLY  56  -8.571  -4.180  11.786
  419   1HA   GLY  56          HA2       GLY  56  -9.029  -6.243  12.937
  420   2HA   GLY  56          HA1       GLY  56 -10.178  -6.677  11.671
  421    H    CYS  57           HN       CYS  57  -7.734  -5.588   9.885
  422    HA   CYS  57           HA       CYS  57  -6.549  -8.311   9.589
  423   1HB   CYS  57          HB2       CYS  57  -6.466  -5.873   7.785
  424   2HB   CYS  57          HB1       CYS  57  -5.691  -7.417   7.428
  425    H    SER  58           HN       SER  58  -5.097  -8.209  11.369
  426    HA   SER  58           HA       SER  58  -3.277  -6.089  11.911
  427   1HB   SER  58          HB2       SER  58  -3.685  -7.858  13.535
  428   2HB   SER  58          HB1       SER  58  -3.039  -9.067  12.428
  429    HG   SER  58           HG       SER  58  -1.731  -7.095  13.924
  430    H    ALA  59           HN       ALA  59  -3.028  -8.885   9.768
  431    HA   ALA  59           HA       ALA  59  -0.335  -8.928   9.137
  432   1HB   ALA  59          HB1       ALA  59  -0.927  -9.938   7.067
  433   2HB   ALA  59          HB2       ALA  59  -2.468  -9.082   7.006
  434   3HB   ALA  59          HB3       ALA  59  -2.220 -10.367   8.188
  435    H    ILE  60           HN       ILE  60  -2.715  -6.548   7.950
  436    HA   ILE  60           HA       ILE  60  -0.545  -5.228   6.374
  437    HB   ILE  60           HB       ILE  60  -2.369  -3.979   5.300
  438   1HG1  ILE  60          HG12      ILE  60  -4.234  -5.673   6.989
  439   2HG1  ILE  60          HG11      ILE  60  -3.878  -3.988   7.344
  440   1HG2  ILE  60          HG21      ILE  60  -2.873  -6.967   5.467
  441   2HG2  ILE  60          HG22      ILE  60  -1.677  -6.190   4.429
  442   3HG2  ILE  60          HG23      ILE  60  -3.397  -5.905   4.159
  443   1HD1  ILE  60          HD11      ILE  60  -4.859  -3.237   5.312
  444   2HD1  ILE  60          HD12      ILE  60  -5.988  -4.421   5.969
  445   3HD1  ILE  60          HD13      ILE  60  -4.914  -4.868   4.646
  446    H    GLU  61           HN       GLU  61  -1.948  -4.901   9.445
  447    HA   GLU  61           HA       GLU  61  -2.211  -2.065   9.632
  448   1HB   GLU  61          HB2       GLU  61  -1.524  -4.183  11.675
  449   2HB   GLU  61          HB1       GLU  61  -1.609  -2.476  12.112
  450   1HG   GLU  61          HG2       GLU  61  -3.921  -2.368  11.256
  451   2HG   GLU  61          HG1       GLU  61  -3.841  -4.076  10.825
  452    H    LYS  62           HN       LYS  62   0.637  -4.156  10.201
  453    HA   LYS  62           HA       LYS  62   2.439  -2.042  10.870
  454   1HB   LYS  62          HB2       LYS  62   2.920  -4.719   9.533
  455   2HB   LYS  62          HB1       LYS  62   4.219  -3.635  10.031
  456   1HG   LYS  62          HG2       LYS  62   3.395  -3.704  12.350
  457   2HG   LYS  62          HG1       LYS  62   2.096  -4.792  11.856
  458   1HD   LYS  62          HD2       LYS  62   3.765  -6.451  11.110
  459   2HD   LYS  62          HD1       LYS  62   5.064  -5.365  11.610
  460   1HE   LYS  62          HE2       LYS  62   2.926  -6.446  13.466
  461   2HE   LYS  62          HE1       LYS  62   4.554  -7.109  13.324
  462   1HZ   LYS  62          HZ1       LYS  62   3.803  -4.377  14.201
  463   2HZ   LYS  62          HZ2       LYS  62   5.399  -4.860  13.878
  464   3HZ   LYS  62          HZ3       LYS  62   4.526  -5.592  15.138
  465    H    THR  63           HN       THR  63   1.454  -3.439   7.774
  466    HA   THR  63           HA       THR  63   3.279  -2.031   6.118
  467    HB   THR  63           HB       THR  63   0.430  -2.892   5.510
  468    HG1  THR  63           HG1      THR  63   1.344  -4.764   5.777
  469   1HG2  THR  63          HG21      THR  63   1.288  -1.310   3.850
  470   2HG2  THR  63          HG22      THR  63   1.240  -2.931   3.162
  471   3HG2  THR  63          HG23      THR  63   2.774  -2.246   3.699
  472    H    GLN  64           HN       GLN  64   0.074  -1.109   7.383
  473    HA   GLN  64           HA       GLN  64  -0.175   1.344   5.953
  474   1HB   GLN  64          HB2       GLN  64  -1.185   0.524   8.688
  475   2HB   GLN  64          HB1       GLN  64  -1.630   2.040   7.905
  476   1HG   GLN  64          HG2       GLN  64  -2.635   0.857   6.047
  477   2HG   GLN  64          HG1       GLN  64  -2.045  -0.690   6.657
  478   1HE2  GLN  64          HE21      GLN  64  -4.899   0.186   6.248
  479   2HE2  GLN  64          HE22      GLN  64  -5.640   0.024   7.766
  480    H    ARG  65           HN       ARG  65   1.412   0.587   9.045
  481    HA   ARG  65           HA       ARG  65   2.099   3.273   9.725
  482   1HB   ARG  65          HB2       ARG  65   3.467   0.645  10.373
  483   2HB   ARG  65          HB1       ARG  65   3.911   2.183  11.105
  484   1HG   ARG  65          HG2       ARG  65   1.069   1.156  11.196
  485   2HG   ARG  65          HG1       ARG  65   2.255   0.668  12.402
  486   1HD   ARG  65          HD2       ARG  65   1.267   3.478  11.826
  487   2HD   ARG  65          HD1       ARG  65   1.075   2.552  13.309
  488    HE   ARG  65           HE       ARG  65   3.804   2.709  13.059
  489   1HH1  ARG  65          HH21      ARG  65   1.193   4.955  12.912
  490   2HH1  ARG  65          HH22      ARG  65   2.112   6.269  13.566
  491   1HH2  ARG  65          HH11      ARG  65   5.018   4.411  13.918
  492   2HH2  ARG  65          HH12      ARG  65   4.278   5.961  14.136
  493    H    MET  66           HN       MET  66   3.965   0.775   7.973
  494    HA   MET  66           HA       MET  66   6.221   2.458   7.465
  495   1HB   MET  66          HB2       MET  66   5.167   0.013   6.020
  496   2HB   MET  66          HB1       MET  66   6.689   0.803   5.599
  497   1HG   MET  66          HG2       MET  66   7.439   0.517   7.970
  498   2HG   MET  66          HG1       MET  66   5.965  -0.389   8.295
  499   1HE   MET  66          HE1       MET  66   6.240  -3.657   6.599
  500   2HE   MET  66          HE2       MET  66   5.549  -2.329   5.675
  501   3HE   MET  66          HE3       MET  66   5.271  -2.420   7.410
  502    H    LEU  67           HN       LEU  67   3.232   1.878   5.619
  503    HA   LEU  67           HA       LEU  67   3.963   3.404   3.313
  504   1HB   LEU  67          HB2       LEU  67   1.259   2.852   4.562
  505   2HB   LEU  67          HB1       LEU  67   1.454   3.683   3.023
  506    HG   LEU  67           HG       LEU  67   2.581   0.927   3.587
  507   1HD1  LEU  67          HD11      LEU  67   0.182   0.744   3.728
  508   2HD1  LEU  67          HD12      LEU  67   0.656   0.157   2.134
  509   3HD1  LEU  67          HD13      LEU  67  -0.032   1.771   2.313
  510   1HD2  LEU  67          HD21      LEU  67   2.419   0.933   0.967
  511   2HD2  LEU  67          HD22      LEU  67   3.755   1.785   1.729
  512   3HD2  LEU  67          HD23      LEU  67   2.356   2.684   1.143
  513    H    SER  68           HN       SER  68   2.513   4.332   6.408
  514    HA   SER  68           HA       SER  68   1.874   7.012   5.793
  515   1HB   SER  68          HB2       SER  68   2.859   5.790   8.382
  516   2HB   SER  68          HB1       SER  68   2.251   7.437   8.251
  517    HG   SER  68           HG       SER  68   0.604   5.979   8.850
  518    H    GLY  69           HN       GLY  69   4.970   5.538   6.663
  519   1HA   GLY  69          HA2       GLY  69   6.521   7.824   7.152
  520   2HA   GLY  69          HA1       GLY  69   7.151   6.375   6.367
  521    H    PHE  70           HN       PHE  70   5.202   6.659   4.124
  522    HA   PHE  70           HA       PHE  70   6.733   8.698   2.580
  523   1HB   PHE  70          HB2       PHE  70   4.912   6.429   1.730
  524   2HB   PHE  70          HB1       PHE  70   5.683   7.549   0.607
  525    HD1  PHE  70           HD1      PHE  70   8.114   7.507   0.256
  526    HD2  PHE  70           HD2      PHE  70   6.209   4.786   2.978
  527    HE1  PHE  70           HE1      PHE  70  10.178   6.140   0.329
  528    HE2  PHE  70           HE2      PHE  70   8.275   3.417   3.053
  529    HZ   PHE  70           HZ       PHE  70  10.260   4.094   1.729
  530    H    CYS  71           HN       CYS  71   4.072   8.734   4.420
  531    HA   CYS  71           HA       CYS  71   2.656  10.725   2.677
  532   1HB   CYS  71          HB2       CYS  71   1.494   8.438   2.917
  533   2HB   CYS  71          HB1       CYS  71   1.227   8.887   4.599
  534    HA   PRO  72           HA       PRO  72   4.162  12.538   6.747
  535   1HB   PRO  72          HB2       PRO  72   3.691  15.007   5.152
  536   2HB   PRO  72          HB1       PRO  72   5.105  14.534   6.105
  537   1HG   PRO  72          HG2       PRO  72   5.083  14.482   3.379
  538   2HG   PRO  72          HG1       PRO  72   6.067  13.378   4.352
  539   1HD   PRO  72          HD2       PRO  72   3.608  12.803   2.782
  540   2HD   PRO  72          HD1       PRO  72   4.901  11.687   3.295
  541    H    HIS  73           HN       HIS  73   1.154  12.249   5.430
  542    HA   HIS  73           HA       HIS  73  -0.061  13.885   7.626
  543   1HB   HIS  73          HB2       HIS  73  -1.630  14.907   6.229
  544   2HB   HIS  73          HB1       HIS  73  -0.199  14.905   5.204
  545    HD1  HIS  73           HD1      HIS  73  -3.614  13.456   5.520
  546    HD2  HIS  73           HD2      HIS  73  -0.284  12.946   3.070
  547    HE1  HIS  73           HE1      HIS  73  -4.393  12.106   3.524
  548    H    LYS  74           HN       LYS  74  -1.384  12.652   8.874
  549    HA   LYS  74           HA       LYS  74  -1.945   9.898   8.079
  550   1HB   LYS  74          HB2       LYS  74  -2.862  11.508  10.483
  551   2HB   LYS  74          HB1       LYS  74  -3.174   9.787  10.254
  552   1HG   LYS  74          HG2       LYS  74  -0.736   9.365  10.152
  553   2HG   LYS  74          HG1       LYS  74  -0.439  11.084  10.416
  554   1HD   LYS  74          HD2       LYS  74  -1.612  10.965  12.583
  555   2HD   LYS  74          HD1       LYS  74  -1.912   9.246  12.325
  556   1HE   LYS  74          HE2       LYS  74   0.640   9.012  12.074
  557   2HE   LYS  74          HE1       LYS  74   0.735  10.631  12.769
  558   1HZ   LYS  74          HZ1       LYS  74   0.290   9.844  14.784
  559   2HZ   LYS  74          HZ2       LYS  74   0.550   8.287  14.155
  560   3HZ   LYS  74          HZ3       LYS  74  -1.024   8.922  14.236
  561    H    VAL  75           HN       VAL  75  -4.083   9.017   7.768
  562    HA   VAL  75           HA       VAL  75  -6.253  11.004   7.256
  563    HB   VAL  75           HB       VAL  75  -4.980  10.368   5.130
  564   1HG1  VAL  75          HG11      VAL  75  -4.830   7.912   5.920
  565   2HG1  VAL  75          HG12      VAL  75  -5.221   8.198   4.224
  566   3HG1  VAL  75          HG13      VAL  75  -6.498   7.774   5.362
  567   1HG2  VAL  75          HG21      VAL  75  -7.132   9.957   3.869
  568   2HG2  VAL  75          HG22      VAL  75  -7.184  11.331   4.973
  569   3HG2  VAL  75          HG23      VAL  75  -7.942   9.805   5.429
  570    H    SER  76           HN       SER  76  -8.163  10.342   8.099
  571    HA   SER  76           HA       SER  76  -8.308   7.591   9.223
  572   1HB   SER  76          HB2       SER  76  -8.811   9.590  10.664
  573   2HB   SER  76          HB1       SER  76 -10.204   9.918   9.637
  574    HG   SER  76           HG       SER  76 -11.153   8.583  10.969
  575    H    ALA  77           HN       ALA  77 -10.579   6.594   9.123
  576    HA   ALA  77           HA       ALA  77 -11.291   6.127   6.400
  577   1HB   ALA  77          HB1       ALA  77 -11.759   4.522   8.226
  578   2HB   ALA  77          HB2       ALA  77 -13.224   4.912   7.325
  579   3HB   ALA  77          HB3       ALA  77 -12.938   5.646   8.903
  580    H    GLY  78           HN       GLY  78 -11.851   8.847   8.245
  581   1HA   GLY  78          HA2       GLY  78 -14.506   9.454   7.054
  582   2HA   GLY  78          HA1       GLY  78 -13.667  10.426   8.264
  583    H    GLN  79           HN       GLN  79 -11.120  10.478   6.871
  584    HA   GLN  79           HA       GLN  79 -11.788  12.570   4.879
  585   1HB   GLN  79          HB2       GLN  79  -9.196  11.686   6.170
  586   2HB   GLN  79          HB1       GLN  79  -9.289  12.943   4.935
  587   1HG   GLN  79          HG2       GLN  79 -10.841  14.232   6.357
  588   2HG   GLN  79          HG1       GLN  79 -10.745  12.980   7.596
  589   1HE2  GLN  79          HE21      GLN  79  -9.607  14.109   9.237
  590   2HE2  GLN  79          HE22      GLN  79  -8.058  14.769   9.019
  591    H    PHE  80           HN       PHE  80 -11.736  12.158   2.729
  592    HA   PHE  80           HA       PHE  80 -10.122   9.831   1.726
  593   1HB   PHE  80          HB2       PHE  80 -12.915  10.691   0.924
  594   2HB   PHE  80          HB1       PHE  80 -11.940   9.543   0.010
  595    HD1  PHE  80           HD1      PHE  80 -14.143   9.984   2.819
  596    HD2  PHE  80           HD2      PHE  80 -11.050   7.463   1.224
  597    HE1  PHE  80           HE1      PHE  80 -14.839   8.162   4.349
  598    HE2  PHE  80           HE2      PHE  80 -11.745   5.642   2.757
  599    HZ   PHE  80           HZ       PHE  80 -13.639   5.991   4.320
  600    H    SER  81           HN       SER  81  -9.059  10.201  -0.251
  601    HA   SER  81           HA       SER  81  -9.231  13.005  -1.324
  602   1HB   SER  81          HB2       SER  81  -6.772  11.247  -1.185
  603   2HB   SER  81          HB1       SER  81  -6.844  12.917  -1.738
  604    HG   SER  81           HG       SER  81  -6.171  12.744   0.449
  605    H    SER  82           HN       SER  82  -8.229   9.671  -2.229
  606    HA   SER  82           HA       SER  82  -8.627  10.395  -5.085
  607   1HB   SER  82          HB2       SER  82  -6.546   9.236  -4.371
  608   2HB   SER  82          HB1       SER  82  -7.515   7.852  -3.873
  609    HG   SER  82           HG       SER  82  -8.333   8.331  -6.259
  610    H    LEU  83           HN       LEU  83 -10.518   8.966  -2.659
  611    HA   LEU  83           HA       LEU  83 -11.824   7.013  -4.443
  612   1HB   LEU  83          HB2       LEU  83 -12.290   7.927  -1.604
  613   2HB   LEU  83          HB1       LEU  83 -13.489   6.945  -2.436
  614    HG   LEU  83           HG       LEU  83 -11.673   5.271  -2.929
  615   1HD1  LEU  83          HD11      LEU  83 -10.133   7.168  -1.142
  616   2HD1  LEU  83          HD12      LEU  83  -9.685   6.582  -2.744
  617   3HD1  LEU  83          HD13      LEU  83  -9.658   5.484  -1.364
  618   1HD2  LEU  83          HD21      LEU  83 -11.534   4.492  -0.508
  619   2HD2  LEU  83          HD22      LEU  83 -13.162   4.811  -1.108
  620   3HD2  LEU  83          HD23      LEU  83 -12.360   5.987  -0.070
  621    H    HIS  84           HN       HIS  84 -11.781   9.941  -5.135
  622    HA   HIS  84           HA       HIS  84 -14.508  10.906  -4.786
  623   1HB   HIS  84          HB2       HIS  84 -12.394  11.791  -6.777
  624   2HB   HIS  84          HB1       HIS  84 -13.850  12.685  -6.340
  625    HD1  HIS  84           HD1      HIS  84 -13.067  11.377  -3.253
  626    HD2  HIS  84           HD2      HIS  84 -11.167  14.273  -5.571
  627    HE1  HIS  84           HE1      HIS  84 -11.623  12.723  -1.679
  628    H    VAL  85           HN       VAL  85 -12.755   9.045  -7.187
  629    HA   VAL  85           HA       VAL  85 -14.840   9.223  -9.212
  630    HB   VAL  85           HB       VAL  85 -13.541   7.439 -10.344
  631   1HG1  VAL  85          HG11      VAL  85 -11.778   9.592  -9.135
  632   2HG1  VAL  85          HG12      VAL  85 -12.847   9.825 -10.518
  633   3HG1  VAL  85          HG13      VAL  85 -11.477   8.722 -10.639
  634   1HG2  VAL  85          HG21      VAL  85 -11.917   7.497  -7.780
  635   2HG2  VAL  85          HG22      VAL  85 -11.439   6.652  -9.252
  636   3HG2  VAL  85          HG23      VAL  85 -12.880   6.143  -8.373
  637    H    ARG  86           HN       ARG  86 -16.283   7.471  -9.801
  638    HA   ARG  86           HA       ARG  86 -17.152   5.893  -7.450
  639   1HB   ARG  86          HB2       ARG  86 -18.338   6.305 -10.210
  640   2HB   ARG  86          HB1       ARG  86 -19.056   5.260  -8.985
  641   1HG   ARG  86          HG2       ARG  86 -19.218   7.180  -7.447
  642   2HG   ARG  86          HG1       ARG  86 -18.515   8.227  -8.677
  643   1HD   ARG  86          HD2       ARG  86 -20.383   7.645 -10.204
  644   2HD   ARG  86          HD1       ARG  86 -21.117   6.676  -8.934
  645    HE   ARG  86           HE       ARG  86 -21.319   9.534  -9.280
  646   1HH1  ARG  86          HH21      ARG  86 -20.878   7.154  -6.814
  647   2HH1  ARG  86          HH22      ARG  86 -21.353   8.221  -5.536
  648   1HH2  ARG  86          HH11      ARG  86 -21.946  10.910  -7.632
  649   2HH2  ARG  86          HH12      ARG  86 -21.959  10.338  -5.997
  650    H    ASP  87           HN       ASP  87 -14.817   4.821  -8.023
  651    HA   ASP  87           HA       ASP  87 -15.010   2.744 -10.091
  652   1HB   ASP  87          HB2       ASP  87 -12.943   3.333  -7.951
  653   2HB   ASP  87          HB1       ASP  87 -12.799   2.014  -9.114
  654    H    THR  88           HN       THR  88 -14.725   0.409  -9.445
  655    HA   THR  88           HA       THR  88 -16.512  -0.199  -7.164
  656    HB   THR  88           HB       THR  88 -16.460  -2.505  -8.044
  657    HG1  THR  88           HG1      THR  88 -15.308  -2.651 -10.152
  658   1HG2  THR  88          HG21      THR  88 -17.394  -1.993 -10.334
  659   2HG2  THR  88          HG22      THR  88 -16.902  -0.317 -10.089
  660   3HG2  THR  88          HG23      THR  88 -18.106  -1.047  -9.026
  661    H    LYS  89           HN       LYS  89 -15.804  -2.133  -5.773
  662    HA   LYS  89           HA       LYS  89 -13.117  -1.542  -4.720
  663   1HB   LYS  89          HB2       LYS  89 -15.224  -3.520  -3.792
  664   2HB   LYS  89          HB1       LYS  89 -13.755  -3.097  -2.915
  665   1HG   LYS  89          HG2       LYS  89 -14.506  -0.753  -2.768
  666   2HG   LYS  89          HG1       LYS  89 -15.980  -1.173  -3.646
  667   1HD   LYS  89          HD2       LYS  89 -16.591  -2.771  -1.866
  668   2HD   LYS  89          HD1       LYS  89 -15.122  -2.353  -0.986
  669   1HE   LYS  89          HE2       LYS  89 -17.087  -0.205  -1.765
  670   2HE   LYS  89          HE1       LYS  89 -17.351  -1.178  -0.318
  671   1HZ   LYS  89          HZ1       LYS  89 -15.312  -0.474   0.592
  672   2HZ   LYS  89          HZ2       LYS  89 -16.068   0.932   0.010
  673   3HZ   LYS  89          HZ3       LYS  89 -14.799   0.220  -0.867
  674    H    ILE  90           HN       ILE  90 -11.513  -3.232  -4.401
  675    HA   ILE  90           HA       ILE  90 -11.833  -5.627  -6.176
  676    HB   ILE  90           HB       ILE  90  -9.473  -5.378  -6.855
  677   1HG1  ILE  90          HG12      ILE  90  -9.612  -2.725  -5.379
  678   2HG1  ILE  90          HG11      ILE  90  -8.699  -4.133  -4.838
  679   1HG2  ILE  90          HG21      ILE  90  -9.795  -3.435  -8.338
  680   2HG2  ILE  90          HG22      ILE  90 -11.134  -2.885  -7.332
  681   3HG2  ILE  90          HG23      ILE  90 -11.270  -4.393  -8.235
  682   1HD1  ILE  90          HD11      ILE  90  -8.251  -2.533  -7.368
  683   2HD1  ILE  90          HD12      ILE  90  -7.453  -4.069  -7.028
  684   3HD1  ILE  90          HD13      ILE  90  -7.162  -2.675  -5.988
  685    H    GLU  91           HN       GLU  91 -10.420  -7.421  -5.527
  686    HA   GLU  91           HA       GLU  91 -10.510  -7.884  -2.713
  687   1HB   GLU  91          HB2       GLU  91  -9.005  -9.298  -4.924
  688   2HB   GLU  91          HB1       GLU  91  -9.110  -9.899  -3.268
  689   1HG   GLU  91          HG2       GLU  91 -11.536  -9.255  -4.961
  690   2HG   GLU  91          HG1       GLU  91 -10.834 -10.869  -4.845
  691    H    VAL  92           HN       VAL  92  -8.927  -7.782  -1.126
  692    HA   VAL  92           HA       VAL  92  -6.893  -5.824  -1.354
  693    HB   VAL  92           HB       VAL  92  -7.207  -8.151   0.563
  694   1HG1  VAL  92          HG11      VAL  92  -5.601  -6.768   1.995
  695   2HG1  VAL  92          HG12      VAL  92  -5.199  -5.885   0.522
  696   3HG1  VAL  92          HG13      VAL  92  -4.875  -7.616   0.629
  697   1HG2  VAL  92          HG21      VAL  92  -8.174  -6.555   2.032
  698   2HG2  VAL  92          HG22      VAL  92  -8.885  -6.191   0.461
  699   3HG2  VAL  92          HG23      VAL  92  -7.573  -5.194   1.085
  700    H    ALA  93           HN       ALA  93  -6.748  -9.354  -1.774
  701    HA   ALA  93           HA       ALA  93  -3.962  -9.684  -1.996
  702   1HB   ALA  93          HB1       ALA  93  -6.241 -11.072  -3.422
  703   2HB   ALA  93          HB2       ALA  93  -5.340 -11.638  -2.015
  704   3HB   ALA  93          HB3       ALA  93  -4.561 -11.580  -3.597
  705    H    GLN  94           HN       GLN  94  -6.290  -8.595  -4.461
  706    HA   GLN  94           HA       GLN  94  -4.273  -8.437  -6.555
  707   1HB   GLN  94          HB2       GLN  94  -7.057  -7.260  -6.301
  708   2HB   GLN  94          HB1       GLN  94  -6.051  -7.071  -7.737
  709   1HG   GLN  94          HG2       GLN  94  -5.926  -9.522  -7.975
  710   2HG   GLN  94          HG1       GLN  94  -6.935  -9.712  -6.541
  711   1HE2  GLN  94          HE21      GLN  94  -7.447 -10.363  -9.516
  712   2HE2  GLN  94          HE22      GLN  94  -8.931  -9.607  -9.849
  713    H    PHE  95           HN       PHE  95  -5.719  -6.206  -4.236
  714    HA   PHE  95           HA       PHE  95  -4.631  -3.780  -5.231
  715   1HB   PHE  95          HB2       PHE  95  -6.338  -3.842  -3.472
  716   2HB   PHE  95          HB1       PHE  95  -5.195  -4.617  -2.375
  717    HD1  PHE  95           HD1      PHE  95  -6.102  -1.479  -4.072
  718    HD2  PHE  95           HD2      PHE  95  -3.327  -3.395  -1.413
  719    HE1  PHE  95           HE1      PHE  95  -5.224   0.735  -3.387
  720    HE2  PHE  95           HE2      PHE  95  -2.449  -1.180  -0.731
  721    HZ   PHE  95           HZ       PHE  95  -3.398   0.882  -1.721
  722    H    VAL  96           HN       VAL  96  -3.302  -5.999  -2.739
  723    HA   VAL  96           HA       VAL  96  -0.911  -4.513  -2.301
  724    HB   VAL  96           HB       VAL  96  -1.332  -7.509  -2.084
  725   1HG1  VAL  96          HG11      VAL  96   0.847  -5.636  -1.153
  726   2HG1  VAL  96          HG12      VAL  96   1.005  -7.154  -2.035
  727   3HG1  VAL  96          HG13      VAL  96   0.547  -7.167  -0.332
  728   1HG2  VAL  96          HG21      VAL  96  -2.892  -6.052  -0.735
  729   2HG2  VAL  96          HG22      VAL  96  -1.474  -5.380   0.070
  730   3HG2  VAL  96          HG23      VAL  96  -1.856  -7.094   0.239
  731    H    LYS  97           HN       LYS  97  -1.502  -7.317  -4.444
  732    HA   LYS  97           HA       LYS  97   1.122  -7.422  -5.520
  733   1HB   LYS  97          HB2       LYS  97  -1.552  -8.233  -6.681
  734   2HB   LYS  97          HB1       LYS  97  -0.010  -8.581  -7.469
  735   1HG   LYS  97          HG2       LYS  97   0.757  -9.779  -5.452
  736   2HG   LYS  97          HG1       LYS  97  -0.782  -9.437  -4.663
  737   1HD   LYS  97          HD2       LYS  97  -1.968 -10.698  -6.420
  738   2HD   LYS  97          HD1       LYS  97  -0.429 -11.045  -7.209
  739   1HE   LYS  97          HE2       LYS  97  -0.932 -11.791  -4.325
  740   2HE   LYS  97          HE1       LYS  97  -1.373 -12.866  -5.652
  741   1HZ   LYS  97          HZ1       LYS  97   1.141 -12.136  -6.294
  742   2HZ   LYS  97          HZ2       LYS  97   0.722 -13.573  -5.490
  743   3HZ   LYS  97          HZ3       LYS  97   1.228 -12.215  -4.603
  744    H    ASP  98           HN       ASP  98  -1.754  -5.630  -6.707
  745    HA   ASP  98           HA       ASP  98  -0.488  -4.561  -9.032
  746   1HB   ASP  98          HB2       ASP  98  -2.680  -3.436  -7.262
  747   2HB   ASP  98          HB1       ASP  98  -2.185  -2.692  -8.784
  748    H    LEU  99           HN       LEU  99  -0.661  -3.379  -5.694
  749    HA   LEU  99           HA       LEU  99   0.769  -0.942  -6.133
  750   1HB   LEU  99          HB2       LEU  99  -0.577  -1.396  -4.102
  751   2HB   LEU  99          HB1       LEU  99   0.578  -2.636  -3.620
  752    HG   LEU  99           HG       LEU  99   2.363  -0.918  -3.526
  753   1HD1  LEU  99          HD11      LEU  99   1.801   0.801  -5.007
  754   2HD1  LEU  99          HD12      LEU  99   1.355   1.532  -3.469
  755   3HD1  LEU  99          HD13      LEU  99   0.111   0.827  -4.501
  756   1HD2  LEU  99          HD21      LEU  99   1.045  -1.475  -1.509
  757   2HD2  LEU  99          HD22      LEU  99  -0.119  -0.218  -1.928
  758   3HD2  LEU  99          HD23      LEU  99   1.535   0.220  -1.501
  759    H    LEU 100           HN       LEU 100   1.814  -4.247  -5.433
  760    HA   LEU 100           HA       LEU 100   4.522  -3.757  -4.799
  761   1HB   LEU 100          HB2       LEU 100   3.506  -5.958  -4.527
  762   2HB   LEU 100          HB1       LEU 100   3.292  -6.103  -6.268
  763    HG   LEU 100           HG       LEU 100   5.742  -6.058  -6.586
  764   1HD1  LEU 100          HD11      LEU 100   7.088  -6.393  -4.374
  765   2HD1  LEU 100          HD12      LEU 100   5.695  -5.640  -3.596
  766   3HD1  LEU 100          HD13      LEU 100   6.608  -4.757  -4.820
  767   1HD2  LEU 100          HD21      LEU 100   6.211  -8.253  -5.620
  768   2HD2  LEU 100          HD22      LEU 100   4.545  -8.207  -6.197
  769   3HD2  LEU 100          HD23      LEU 100   4.885  -8.057  -4.473
  770    H    LEU 101           HN       LEU 101   3.036  -4.203  -8.033
  771    HA   LEU 101           HA       LEU 101   5.490  -4.133  -9.489
  772   1HB   LEU 101          HB2       LEU 101   2.649  -3.405 -10.186
  773   2HB   LEU 101          HB1       LEU 101   3.936  -3.104 -11.344
  774    HG   LEU 101           HG       LEU 101   2.683  -5.337 -11.551
  775   1HD1  LEU 101          HD11      LEU 101   5.647  -5.731 -11.150
  776   2HD1  LEU 101          HD12      LEU 101   5.026  -4.760 -12.482
  777   3HD1  LEU 101          HD13      LEU 101   4.591  -6.460 -12.354
  778   1HD2  LEU 101          HD21      LEU 101   3.169  -7.098 -10.043
  779   2HD2  LEU 101          HD22      LEU 101   2.803  -5.717  -9.020
  780   3HD2  LEU 101          HD23      LEU 101   4.475  -6.198  -9.276
  781    H    HIS 102           HN       HIS 102   3.355  -1.495  -8.433
  782    HA   HIS 102           HA       HIS 102   4.938   0.566  -9.673
  783   1HB   HIS 102          HB2       HIS 102   2.831   0.585  -7.512
  784   2HB   HIS 102          HB1       HIS 102   3.663   2.061  -8.007
  785    HD1  HIS 102           HD1      HIS 102   3.255   2.917 -10.429
  786    HD2  HIS 102           HD2      HIS 102   1.025  -0.464  -9.447
  787    HE1  HIS 102           HE1      HIS 102   1.530   2.647 -12.259
  788    H    LEU 103           HN       LEU 103   4.968  -0.805  -6.363
  789    HA   LEU 103           HA       LEU 103   6.700   1.124  -5.239
  790   1HB   LEU 103          HB2       LEU 103   6.456  -1.839  -4.677
  791   2HB   LEU 103          HB1       LEU 103   7.450  -0.756  -3.706
  792    HG   LEU 103           HG       LEU 103   4.494  -0.319  -4.218
  793   1HD1  LEU 103          HD11      LEU 103   4.641  -2.346  -2.957
  794   2HD1  LEU 103          HD12      LEU 103   4.296  -1.076  -1.786
  795   3HD1  LEU 103          HD13      LEU 103   5.935  -1.707  -1.947
  796   1HD2  LEU 103          HD21      LEU 103   6.601   1.063  -2.564
  797   2HD2  LEU 103          HD22      LEU 103   4.940   1.042  -1.974
  798   3HD2  LEU 103          HD23      LEU 103   5.307   1.762  -3.536
  799    H    LYS 104           HN       LYS 104   7.698  -2.000  -6.751
  800    HA   LYS 104           HA       LYS 104  10.487  -1.251  -6.624
  801   1HB   LYS 104          HB2       LYS 104  10.883  -3.182  -8.109
  802   2HB   LYS 104          HB1       LYS 104   9.845  -3.604  -6.749
  803   1HG   LYS 104          HG2       LYS 104   7.856  -3.350  -8.182
  804   2HG   LYS 104          HG1       LYS 104   8.895  -2.931  -9.547
  805   1HD   LYS 104          HD2       LYS 104  10.013  -5.122  -9.379
  806   2HD   LYS 104          HD1       LYS 104   8.986  -5.548  -8.012
  807   1HE   LYS 104          HE2       LYS 104   7.098  -5.812  -9.339
  808   2HE   LYS 104          HE1       LYS 104   7.674  -4.695 -10.578
  809   1HZ   LYS 104          HZ1       LYS 104   8.185  -7.528 -10.252
  810   2HZ   LYS 104          HZ2       LYS 104   9.538  -6.597 -10.688
  811   3HZ   LYS 104          HZ3       LYS 104   8.146  -6.584 -11.661
  812    H    LYS 105           HN       LYS 105   7.959  -0.439  -8.856
  813    HA   LYS 105           HA       LYS 105   9.603  -0.009 -11.171
  814   1HB   LYS 105          HB2       LYS 105   7.112  -0.141 -11.214
  815   2HB   LYS 105          HB1       LYS 105   7.049   1.437 -10.429
  816   1HG   LYS 105          HG2       LYS 105   8.289   2.436 -12.308
  817   2HG   LYS 105          HG1       LYS 105   8.376   0.859 -13.095
  818   1HD   LYS 105          HD2       LYS 105   5.943   0.767 -13.263
  819   2HD   LYS 105          HD1       LYS 105   5.799   2.288 -12.382
  820   1HE   LYS 105          HE2       LYS 105   5.588   2.702 -14.786
  821   2HE   LYS 105          HE1       LYS 105   7.079   3.426 -14.184
  822   1HZ   LYS 105          HZ1       LYS 105   7.353   0.690 -15.051
  823   2HZ   LYS 105          HZ2       LYS 105   8.329   2.040 -15.384
  824   3HZ   LYS 105          HZ3       LYS 105   6.919   1.762 -16.291
  825    H    LEU 106           HN       LEU 106   8.527   2.273  -8.610
  826    HA   LEU 106           HA       LEU 106   9.861   4.549  -9.708
  827   1HB   LEU 106          HB2       LEU 106   8.968   3.815  -6.925
  828   2HB   LEU 106          HB1       LEU 106   9.907   5.280  -7.187
  829    HG   LEU 106           HG       LEU 106   7.372   5.565  -7.221
  830   1HD1  LEU 106          HD11      LEU 106   8.468   6.381  -9.904
  831   2HD1  LEU 106          HD12      LEU 106   9.182   7.052  -8.439
  832   3HD1  LEU 106          HD13      LEU 106   7.472   7.294  -8.773
  833   1HD2  LEU 106          HD21      LEU 106   7.549   4.359  -9.985
  834   2HD2  LEU 106          HD22      LEU 106   6.106   4.781  -9.066
  835   3HD2  LEU 106          HD23      LEU 106   7.087   3.407  -8.580
  836    H    PHE 107           HN       PHE 107  11.028   1.821  -7.858
  837    HA   PHE 107           HA       PHE 107  13.501   2.913  -6.961
  838   1HB   PHE 107          HB2       PHE 107  12.640   0.686  -6.251
  839   2HB   PHE 107          HB1       PHE 107  12.944   0.073  -7.874
  840    HD1  PHE 107           HD1      PHE 107  14.672   1.852  -5.079
  841    HD2  PHE 107           HD2      PHE 107  15.040  -0.875  -8.371
  842    HE1  PHE 107           HE1      PHE 107  17.033   1.452  -4.473
  843    HE2  PHE 107           HE2      PHE 107  17.410  -1.287  -7.761
  844    HZ   PHE 107           HZ       PHE 107  18.407  -0.123  -5.810
  845    H    ARG 108           HN       ARG 108  12.548   1.431 -10.029
  846    HA   ARG 108           HA       ARG 108  15.122   1.379 -11.251
  847   1HB   ARG 108          HB2       ARG 108  12.393   1.765 -12.527
  848   2HB   ARG 108          HB1       ARG 108  13.861   1.310 -13.389
  849   1HG   ARG 108          HG2       ARG 108  12.870  -0.332 -11.058
  850   2HG   ARG 108          HG1       ARG 108  12.217  -0.578 -12.675
  851   1HD   ARG 108          HD2       ARG 108  14.550  -0.929 -13.514
  852   2HD   ARG 108          HD1       ARG 108  15.128  -0.822 -11.853
  853    HE   ARG 108           HE       ARG 108  13.183  -2.778 -11.728
  854   1HH1  ARG 108          HH21      ARG 108  15.970  -2.158 -13.661
  855   2HH1  ARG 108          HH22      ARG 108  16.335  -3.833 -13.909
  856   1HH2  ARG 108          HH11      ARG 108  13.643  -4.969 -12.041
  857   2HH2  ARG 108          HH12      ARG 108  15.017  -5.424 -12.992
  858    H    GLU 109           HN       GLU 109  12.724   3.956 -10.916
  859    HA   GLU 109           HA       GLU 109  14.236   5.764 -12.678
  860   1HB   GLU 109          HB2       GLU 109  11.794   6.137 -10.926
  861   2HB   GLU 109          HB1       GLU 109  12.504   7.434 -11.887
  862   1HG   GLU 109          HG2       GLU 109  12.135   6.193 -13.939
  863   2HG   GLU 109          HG1       GLU 109  11.581   4.785 -13.032
  864    H    GLY 110           HN       GLY 110  14.256   4.915  -9.335
  865   1HA   GLY 110          HA2       GLY 110  15.629   5.706  -7.601
  866   2HA   GLY 110          HA1       GLY 110  16.463   6.696  -8.800
  867    H    ARG 111           HN       ARG 111  13.210   7.348  -9.087
  868    HA   ARG 111           HA       ARG 111  13.519   9.874  -7.541
  869   1HB   ARG 111          HB2       ARG 111  11.425   8.955  -9.538
  870   2HB   ARG 111          HB1       ARG 111  11.394  10.514  -8.715
  871   1HG   ARG 111          HG2       ARG 111  13.596  11.071  -9.684
  872   2HG   ARG 111          HG1       ARG 111  13.620   9.516 -10.516
  873   1HD   ARG 111          HD2       ARG 111  11.451  10.177 -11.630
  874   2HD   ARG 111          HD1       ARG 111  11.658  11.784 -10.937
  875    HE   ARG 111           HE       ARG 111  14.054  11.298 -12.259
  876   1HH1  ARG 111          HH21      ARG 111  10.693  11.240 -13.023
  877   2HH1  ARG 111          HH22      ARG 111  10.924  11.687 -14.680
  878   1HH2  ARG 111          HH11      ARG 111  14.376  11.885 -14.421
  879   2HH2  ARG 111          HH12      ARG 111  13.009  12.054 -15.471
  880    H    PHE 112           HN       PHE 112  13.136   9.278  -5.413
  881    HA   PHE 112           HA       PHE 112  10.772   7.623  -4.759
  882   1HB   PHE 112          HB2       PHE 112  12.852   8.872  -2.939
  883   2HB   PHE 112          HB1       PHE 112  11.690   7.612  -2.508
  884    HD1  PHE 112           HD1      PHE 112  11.810   5.373  -3.605
  885    HD2  PHE 112           HD2      PHE 112  14.854   8.347  -4.162
  886    HE1  PHE 112           HE1      PHE 112  13.340   3.649  -4.500
  887    HE2  PHE 112           HE2      PHE 112  16.386   6.612  -5.058
  888    HZ   PHE 112           HZ       PHE 112  15.626   4.258  -5.224
  889    H    ASN 113           HN       ASN 113   8.931   8.425  -3.798
  890    HA   ASN 113           HA       ASN 113   7.323  10.042  -3.248
  891   1HB   ASN 113          HB2       ASN 113   8.877  10.156  -1.260
  892   2HB   ASN 113          HB1       ASN 113   9.690  11.508  -2.051
  893   1HD2  ASN 113          HD21      ASN 113   6.409  10.479  -0.969
  894   2HD2  ASN 113          HD22      ASN 113   5.865  12.052  -0.634
  Start of MODEL   13
    1   1H    MET   1           HT1      MET   1  20.121   6.208  13.528
    2   2H    MET   1           HT2      MET   1  21.740   6.572  13.162
    3   3H    MET   1           HT3      MET   1  20.570   6.565  11.931
    4    HA   MET   1           HA       MET   1  20.403   8.403  14.242
    5   1HB   MET   1          HB2       MET   1  21.837   8.753  11.599
    6   2HB   MET   1          HB1       MET   1  21.377  10.103  12.638
    7   1HG   MET   1          HG2       MET   1  22.712   9.215  14.466
    8   2HG   MET   1          HG1       MET   1  23.083   7.763  13.538
    9   1HE   MET   1          HE1       MET   1  23.358  11.428  14.055
   10   2HE   MET   1          HE2       MET   1  23.069  11.680  12.333
   11   3HE   MET   1          HE3       MET   1  24.659  12.017  13.012
   12    H    GLY   2           HN       GLY   2  20.149   9.505  10.996
   13   1HA   GLY   2          HA2       GLY   2  17.394  10.234  11.380
   14   2HA   GLY   2          HA1       GLY   2  18.284  10.386   9.864
   15    HA   PRO   3           HA       PRO   3  15.004   6.790  10.020
   16   1HB   PRO   3          HB2       PRO   3  14.050   8.132   7.568
   17   2HB   PRO   3          HB1       PRO   3  13.135   7.614   8.988
   18   1HG   PRO   3          HG2       PRO   3  13.835  10.274   8.330
   19   2HG   PRO   3          HG1       PRO   3  13.171   9.716   9.870
   20   1HD   PRO   3          HD2       PRO   3  15.856  10.691   9.342
   21   2HD   PRO   3          HD1       PRO   3  15.163  10.162  10.896
   22    H    VAL   4           HN       VAL   4  14.459   5.544   7.740
   23    HA   VAL   4           HA       VAL   4  17.065   4.720   6.755
   24    HB   VAL   4           HB       VAL   4  15.574   3.189   5.297
   25   1HG1  VAL   4          HG11      VAL   4  14.875   1.863   7.385
   26   2HG1  VAL   4          HG12      VAL   4  15.569   3.188   8.319
   27   3HG1  VAL   4          HG13      VAL   4  16.589   2.247   7.233
   28   1HG2  VAL   4          HG21      VAL   4  13.251   3.062   5.846
   29   2HG2  VAL   4          HG22      VAL   4  13.581   4.776   5.596
   30   3HG2  VAL   4          HG23      VAL   4  13.449   4.133   7.233
   31    HA   PRO   5           HA       PRO   5  17.213   7.489   3.235
   32   1HB   PRO   5          HB2       PRO   5  18.190   5.429   1.421
   33   2HB   PRO   5          HB1       PRO   5  19.084   6.769   2.145
   34   1HG   PRO   5          HG2       PRO   5  19.216   3.973   2.841
   35   2HG   PRO   5          HG1       PRO   5  20.131   5.312   3.538
   36   1HD   PRO   5          HD2       PRO   5  18.036   3.812   4.806
   37   2HD   PRO   5          HD1       PRO   5  18.860   5.258   5.441
   38    HA   PRO   6           HA       PRO   6  13.580   6.690   0.811
   39   1HB   PRO   6          HB2       PRO   6  14.375   7.533  -1.745
   40   2HB   PRO   6          HB1       PRO   6  13.785   8.579  -0.448
   41   1HG   PRO   6          HG2       PRO   6  16.553   8.202  -1.437
   42   2HG   PRO   6          HG1       PRO   6  15.848   9.577  -0.578
   43   1HD   PRO   6          HD2       PRO   6  17.585   7.661   0.554
   44   2HD   PRO   6          HD1       PRO   6  16.548   8.785   1.466
   45    H    SER   7           HN       SER   7  16.269   5.831  -1.396
   46    HA   SER   7           HA       SER   7  14.871   3.792  -2.793
   47   1HB   SER   7          HB2       SER   7  17.042   3.105  -3.611
   48   2HB   SER   7          HB1       SER   7  17.047   4.862  -3.478
   49    HG   SER   7           HG       SER   7  17.791   3.477  -1.206
   50    H    THR   8           HN       THR   8  16.934   3.605   0.102
   51    HA   THR   8           HA       THR   8  16.888   0.742   0.277
   52    HB   THR   8           HB       THR   8  17.227   2.783   2.495
   53    HG1  THR   8           HG1      THR   8  19.004   1.512   0.700
   54   1HG2  THR   8          HG21      THR   8  18.502   0.841   3.535
   55   2HG2  THR   8          HG22      THR   8  17.775  -0.182   2.299
   56   3HG2  THR   8          HG23      THR   8  16.750   0.652   3.468
   57    H    ALA   9           HN       ALA   9  14.782   3.265   1.643
   58    HA   ALA   9           HA       ALA   9  13.214   1.558   3.288
   59   1HB   ALA   9          HB1       ALA   9  13.030   3.993   3.445
   60   2HB   ALA   9          HB2       ALA   9  11.451   3.311   3.059
   61   3HB   ALA   9          HB3       ALA   9  12.413   4.076   1.796
   62    H    LEU  10           HN       LEU  10  12.829   2.470  -0.142
   63    HA   LEU  10           HA       LEU  10  10.395   1.048  -0.538
   64   1HB   LEU  10          HB2       LEU  10  11.205   2.685  -2.176
   65   2HB   LEU  10          HB1       LEU  10  12.603   1.671  -2.535
   66    HG   LEU  10           HG       LEU  10  11.073  -0.117  -3.336
   67   1HD1  LEU  10          HD11      LEU  10   9.053   0.157  -2.170
   68   2HD1  LEU  10          HD12      LEU  10   8.651   0.724  -3.786
   69   3HD1  LEU  10          HD13      LEU  10   8.986   1.889  -2.505
   70   1HD2  LEU  10          HD21      LEU  10  11.848   1.218  -5.101
   71   2HD2  LEU  10          HD22      LEU  10  10.940   2.631  -4.564
   72   3HD2  LEU  10          HD23      LEU  10  10.100   1.274  -5.317
   73    H    ARG  11           HN       ARG  11  13.794  -0.003  -1.014
   74    HA   ARG  11           HA       ARG  11  13.166  -2.636  -1.919
   75   1HB   ARG  11          HB2       ARG  11  15.566  -1.570  -0.407
   76   2HB   ARG  11          HB1       ARG  11  15.469  -3.218  -1.036
   77   1HG   ARG  11          HG2       ARG  11  15.173  -2.382  -3.303
   78   2HG   ARG  11          HG1       ARG  11  15.141  -0.718  -2.719
   79   1HD   ARG  11          HD2       ARG  11  17.363  -1.280  -3.610
   80   2HD   ARG  11          HD1       ARG  11  17.453  -0.984  -1.875
   81    HE   ARG  11           HE       ARG  11  17.081  -3.715  -2.036
   82   1HH1  ARG  11          HH21      ARG  11  19.237  -1.411  -3.429
   83   2HH1  ARG  11          HH22      ARG  11  20.556  -2.524  -3.553
   84   1HH2  ARG  11          HH11      ARG  11  18.798  -5.180  -2.188
   85   2HH2  ARG  11          HH12      ARG  11  20.311  -4.654  -2.845
   86    H    GLU  12           HN       GLU  12  13.618  -1.345   1.352
   87    HA   GLU  12           HA       GLU  12  13.361  -3.862   2.706
   88   1HB   GLU  12          HB2       GLU  12  12.852  -1.008   3.596
   89   2HB   GLU  12          HB1       GLU  12  12.788  -2.396   4.690
   90   1HG   GLU  12          HG2       GLU  12  15.112  -2.965   4.133
   91   2HG   GLU  12          HG1       GLU  12  15.185  -1.615   3.002
   92    H    LEU  13           HN       LEU  13  11.011  -1.421   1.663
   93    HA   LEU  13           HA       LEU  13   8.744  -2.661   2.945
   94   1HB   LEU  13          HB2       LEU  13   8.727  -0.302   2.218
   95   2HB   LEU  13          HB1       LEU  13   8.862  -0.813   0.539
   96    HG   LEU  13           HG       LEU  13   6.700  -2.002   0.732
   97   1HD1  LEU  13          HD11      LEU  13   6.933  -1.059   3.575
   98   2HD1  LEU  13          HD12      LEU  13   6.434  -2.637   2.968
   99   3HD1  LEU  13          HD13      LEU  13   5.336  -1.266   2.859
  100   1HD2  LEU  13          HD21      LEU  13   6.745   0.337  -0.035
  101   2HD2  LEU  13          HD22      LEU  13   6.606   0.890   1.634
  102   3HD2  LEU  13          HD23      LEU  13   5.274   0.009   0.882
  103    H    ILE  14           HN       ILE  14  10.080  -2.849  -0.362
  104    HA   ILE  14           HA       ILE  14   8.019  -4.522  -1.409
  105    HB   ILE  14           HB       ILE  14  10.915  -4.165  -2.225
  106   1HG1  ILE  14          HG12      ILE  14   8.344  -3.243  -3.548
  107   2HG1  ILE  14          HG11      ILE  14   9.261  -2.244  -2.421
  108   1HG2  ILE  14          HG21      ILE  14   8.690  -5.812  -3.446
  109   2HG2  ILE  14          HG22      ILE  14  10.344  -6.310  -3.082
  110   3HG2  ILE  14          HG23      ILE  14  10.029  -5.203  -4.419
  111   1HD1  ILE  14          HD11      ILE  14  10.380  -3.437  -4.976
  112   2HD1  ILE  14          HD12      ILE  14  11.229  -2.355  -3.874
  113   3HD1  ILE  14          HD13      ILE  14   9.846  -1.765  -4.798
  114    H    GLU  15           HN       GLU  15  11.195  -5.397   0.002
  115    HA   GLU  15           HA       GLU  15  10.940  -8.199  -0.356
  116   1HB   GLU  15          HB2       GLU  15  12.409  -6.622   1.772
  117   2HB   GLU  15          HB1       GLU  15  12.574  -8.362   1.548
  118   1HG   GLU  15          HG2       GLU  15  13.330  -8.005  -0.768
  119   2HG   GLU  15          HG1       GLU  15  13.163  -6.261  -0.558
  120    H    GLU  16           HN       GLU  16   9.817  -6.150   2.366
  121    HA   GLU  16           HA       GLU  16   8.963  -8.414   3.953
  122   1HB   GLU  16          HB2       GLU  16   9.404  -6.111   4.869
  123   2HB   GLU  16          HB1       GLU  16   7.910  -5.579   4.100
  124   1HG   GLU  16          HG2       GLU  16   6.609  -7.168   5.415
  125   2HG   GLU  16          HG1       GLU  16   8.081  -7.854   6.102
  126    H    LEU  17           HN       LEU  17   7.211  -6.200   1.755
  127    HA   LEU  17           HA       LEU  17   4.632  -7.307   2.218
  128   1HB   LEU  17          HB2       LEU  17   5.771  -6.004  -0.267
  129   2HB   LEU  17          HB1       LEU  17   4.066  -6.390  -0.048
  130    HG   LEU  17           HG       LEU  17   5.656  -4.628   1.839
  131   1HD1  LEU  17          HD11      LEU  17   5.497  -3.629  -0.412
  132   2HD1  LEU  17          HD12      LEU  17   4.505  -2.740   0.743
  133   3HD1  LEU  17          HD13      LEU  17   3.750  -3.858  -0.393
  134   1HD2  LEU  17          HD21      LEU  17   2.780  -5.513   1.664
  135   2HD2  LEU  17          HD22      LEU  17   3.134  -3.904   2.289
  136   3HD2  LEU  17          HD23      LEU  17   3.806  -5.321   3.085
  137    H    VAL  18           HN       VAL  18   7.119  -8.188  -0.186
  138    HA   VAL  18           HA       VAL  18   5.544 -10.188  -1.495
  139    HB   VAL  18           HB       VAL  18   8.551  -9.912  -1.204
  140   1HG1  VAL  18          HG11      VAL  18   6.848 -11.777  -2.859
  141   2HG1  VAL  18          HG12      VAL  18   8.161 -12.193  -1.759
  142   3HG1  VAL  18          HG13      VAL  18   8.514 -11.394  -3.292
  143   1HG2  VAL  18          HG21      VAL  18   6.739  -9.294  -3.554
  144   2HG2  VAL  18          HG22      VAL  18   8.452  -8.904  -3.391
  145   3HG2  VAL  18          HG23      VAL  18   7.262  -8.084  -2.384
  146    H    ASN  19           HN       ASN  19   7.835 -10.407   1.218
  147    HA   ASN  19           HA       ASN  19   7.822 -13.226   1.509
  148   1HB   ASN  19          HB2       ASN  19   9.398 -11.762   2.689
  149   2HB   ASN  19          HB1       ASN  19   8.075 -11.096   3.647
  150   1HD2  ASN  19          HD21      ASN  19   9.408 -14.357   2.813
  151   2HD2  ASN  19          HD22      ASN  19   9.192 -14.998   4.372
  152    H    ILE  20           HN       ILE  20   5.672 -10.797   3.030
  153    HA   ILE  20           HA       ILE  20   4.185 -12.872   4.434
  154    HB   ILE  20           HB       ILE  20   2.791 -11.082   5.263
  155   1HG1  ILE  20          HG12      ILE  20   4.158  -9.371   3.162
  156   2HG1  ILE  20          HG11      ILE  20   2.459  -9.835   3.179
  157   1HG2  ILE  20          HG21      ILE  20   4.481  -9.746   6.338
  158   2HG2  ILE  20          HG22      ILE  20   5.617 -10.019   5.020
  159   3HG2  ILE  20          HG23      ILE  20   5.172 -11.349   6.090
  160   1HD1  ILE  20          HD11      ILE  20   2.362  -8.721   5.509
  161   2HD1  ILE  20          HD12      ILE  20   2.439  -7.664   4.099
  162   3HD1  ILE  20          HD13      ILE  20   3.890  -7.963   5.056
  163    H    THR  21           HN       THR  21   3.969 -11.623   1.218
  164    HA   THR  21           HA       THR  21   1.088 -12.387   1.003
  165    HB   THR  21           HB       THR  21   1.311 -11.511  -1.336
  166    HG1  THR  21           HG1      THR  21   3.815 -11.866  -0.895
  167   1HG2  THR  21          HG21      THR  21   1.668  -9.121  -0.676
  168   2HG2  THR  21          HG22      THR  21   2.168  -9.685   0.914
  169   3HG2  THR  21          HG23      THR  21   0.526  -9.980   0.357
  170    H    GLN  22           HN       GLN  22   4.291 -13.516   0.075
  171    HA   GLN  22           HA       GLN  22   3.325 -15.433  -1.882
  172   1HB   GLN  22          HB2       GLN  22   5.961 -15.142  -0.425
  173   2HB   GLN  22          HB1       GLN  22   5.657 -16.406  -1.616
  174   1HG   GLN  22          HG2       GLN  22   5.147 -14.722  -3.318
  175   2HG   GLN  22          HG1       GLN  22   5.373 -13.434  -2.137
  176   1HE2  GLN  22          HE21      GLN  22   7.699 -15.164  -0.968
  177   2HE2  GLN  22          HE22      GLN  22   8.989 -14.833  -2.020
  178    H    ASN  23           HN       ASN  23   4.064 -15.573   1.580
  179    HA   ASN  23           HA       ASN  23   3.463 -18.481   1.631
  180   1HB   ASN  23          HB2       ASN  23   4.217 -18.424   3.927
  181   2HB   ASN  23          HB1       ASN  23   5.371 -17.504   2.963
  182   1HD2  ASN  23          HD21      ASN  23   5.376 -16.853   5.627
  183   2HD2  ASN  23          HD22      ASN  23   4.582 -15.378   5.900
  184    H    GLN  24           HN       GLN  24   1.507 -15.893   1.466
  185    HA   GLN  24           HA       GLN  24  -0.184 -16.443   3.797
  186   1HB   GLN  24          HB2       GLN  24  -1.542 -14.655   3.077
  187   2HB   GLN  24          HB1       GLN  24   0.077 -14.175   2.583
  188   1HG   GLN  24          HG2       GLN  24  -0.487 -15.268   0.313
  189   2HG   GLN  24          HG1       GLN  24  -2.159 -15.261   0.866
  190   1HE2  GLN  24          HE21      GLN  24  -1.569 -13.702  -1.365
  191   2HE2  GLN  24          HE22      GLN  24  -1.607 -12.055  -0.950
  192    H    LYS  25           HN       LYS  25  -1.638 -18.047   3.908
  193    HA   LYS  25           HA       LYS  25  -2.373 -19.561   1.485
  194   1HB   LYS  25          HB2       LYS  25  -1.884 -20.755   3.620
  195   2HB   LYS  25          HB1       LYS  25  -3.247 -19.925   4.376
  196   1HG   LYS  25          HG2       LYS  25  -4.788 -20.946   2.733
  197   2HG   LYS  25          HG1       LYS  25  -3.427 -21.775   1.977
  198   1HD   LYS  25          HD2       LYS  25  -2.968 -22.884   4.192
  199   2HD   LYS  25          HD1       LYS  25  -4.465 -22.172   4.798
  200   1HE   LYS  25          HE2       LYS  25  -4.941 -24.432   4.038
  201   2HE   LYS  25          HE1       LYS  25  -5.693 -23.294   2.917
  202   1HZ   LYS  25          HZ1       LYS  25  -4.633 -24.618   1.435
  203   2HZ   LYS  25          HZ2       LYS  25  -3.403 -25.064   2.524
  204   3HZ   LYS  25          HZ3       LYS  25  -3.351 -23.551   1.752
  205    H    ALA  26           HN       ALA  26  -4.410 -18.492   4.196
  206    HA   ALA  26           HA       ALA  26  -6.625 -17.937   2.353
  207   1HB   ALA  26          HB1       ALA  26  -7.519 -17.062   4.785
  208   2HB   ALA  26          HB2       ALA  26  -6.231 -18.148   5.304
  209   3HB   ALA  26          HB3       ALA  26  -7.550 -18.761   4.309
  210    HA   PRO  27           HA       PRO  27  -5.950 -13.614   1.632
  211   1HB   PRO  27          HB2       PRO  27  -8.434 -12.865   3.065
  212   2HB   PRO  27          HB1       PRO  27  -8.005 -12.628   1.367
  213   1HG   PRO  27          HG2       PRO  27  -9.807 -14.554   2.365
  214   2HG   PRO  27          HG1       PRO  27  -9.128 -14.512   0.735
  215   1HD   PRO  27          HD2       PRO  27  -8.583 -16.442   2.834
  216   2HD   PRO  27          HD1       PRO  27  -7.928 -16.413   1.177
  217    H    LEU  28           HN       LEU  28  -4.983 -11.864   2.797
  218    HA   LEU  28           HA       LEU  28  -4.120 -12.411   5.459
  219   1HB   LEU  28          HB2       LEU  28  -4.217  -9.813   3.906
  220   2HB   LEU  28          HB1       LEU  28  -3.413  -9.989   5.463
  221    HG   LEU  28           HG       LEU  28  -2.777 -11.677   3.026
  222   1HD1  LEU  28          HD11      LEU  28  -2.194  -9.357   2.573
  223   2HD1  LEU  28          HD12      LEU  28  -0.718 -10.271   2.881
  224   3HD1  LEU  28          HD13      LEU  28  -1.384  -9.224   4.133
  225   1HD2  LEU  28          HD21      LEU  28  -1.973 -12.924   4.825
  226   2HD2  LEU  28          HD22      LEU  28  -1.694 -11.503   5.832
  227   3HD2  LEU  28          HD23      LEU  28  -0.579 -11.891   4.522
  228    H    CYS  29           HN       CYS  29  -6.580 -10.101   4.290
  229    HA   CYS  29           HA       CYS  29  -7.510  -9.654   7.057
  230   1HB   CYS  29          HB2       CYS  29  -8.322  -8.559   4.360
  231   2HB   CYS  29          HB1       CYS  29  -9.260  -8.233   5.819
  232    H    ASN  30           HN       ASN  30  -9.987  -9.834   7.395
  233    HA   ASN  30           HA       ASN  30 -10.794 -12.562   6.894
  234   1HB   ASN  30          HB2       ASN  30 -12.460 -10.200   7.823
  235   2HB   ASN  30          HB1       ASN  30 -12.931 -11.896   7.924
  236   1HD2  ASN  30          HD21      ASN  30 -10.397 -12.994   8.707
  237   2HD2  ASN  30          HD22      ASN  30 -10.045 -12.441  10.271
  238    H    GLY  31           HN       GLY  31 -10.205 -11.250   4.425
  239   1HA   GLY  31          HA2       GLY  31 -11.189 -11.417   2.269
  240   2HA   GLY  31          HA1       GLY  31 -12.756 -11.696   3.032
  241    H    SER  32           HN       SER  32 -10.916  -9.035   4.229
  242    HA   SER  32           HA       SER  32 -12.961  -7.128   3.602
  243   1HB   SER  32          HB2       SER  32 -10.052  -6.643   4.312
  244   2HB   SER  32          HB1       SER  32 -11.329  -5.433   4.354
  245    HG   SER  32           HG       SER  32 -11.413  -6.158   6.361
  246    H    MET  33           HN       MET  33 -12.958  -5.425   2.053
  247    HA   MET  33           HA       MET  33 -11.084  -5.789  -0.270
  248   1HB   MET  33          HB2       MET  33 -13.982  -4.879  -0.364
  249   2HB   MET  33          HB1       MET  33 -12.918  -5.132  -1.745
  250   1HG   MET  33          HG2       MET  33 -12.688  -7.575  -0.619
  251   2HG   MET  33          HG1       MET  33 -14.286  -7.152  -0.013
  252   1HE   MET  33          HE1       MET  33 -15.299  -5.198  -2.378
  253   2HE   MET  33          HE2       MET  33 -16.170  -6.336  -1.361
  254   3HE   MET  33          HE3       MET  33 -16.352  -6.413  -3.111
  255    H    VAL  34           HN       VAL  34 -10.648  -3.729  -1.447
  256    HA   VAL  34           HA       VAL  34 -11.088  -1.283   0.241
  257    HB   VAL  34           HB       VAL  34  -8.730  -0.618  -0.459
  258   1HG1  VAL  34          HG11      VAL  34  -7.708  -2.008   1.321
  259   2HG1  VAL  34          HG12      VAL  34  -9.112  -3.077   1.278
  260   3HG1  VAL  34          HG13      VAL  34  -9.294  -1.406   1.804
  261   1HG2  VAL  34          HG21      VAL  34  -7.227  -2.464  -1.089
  262   2HG2  VAL  34          HG22      VAL  34  -8.513  -2.300  -2.286
  263   3HG2  VAL  34          HG23      VAL  34  -8.585  -3.588  -1.086
  264    H    TRP  35           HN       TRP  35 -10.714   0.758  -0.991
  265    HA   TRP  35           HA       TRP  35 -12.175   0.684  -3.492
  266   1HB   TRP  35          HB2       TRP  35 -10.632   2.923  -2.147
  267   2HB   TRP  35          HB1       TRP  35 -11.644   3.131  -3.572
  268    HD1  TRP  35           HD1      TRP  35 -11.804   2.611   0.174
  269    HE1  TRP  35           HE1      TRP  35 -14.232   2.934   0.964
  270    HE3  TRP  35           HE3      TRP  35 -14.171   2.832  -4.338
  271    HZ2  TRP  35           HZ2      TRP  35 -16.843   3.239  -0.173
  272    HZ3  TRP  35           HZ3      TRP  35 -16.626   3.132  -4.461
  273    HH2  TRP  35           HH2      TRP  35 -17.965   3.337  -2.382
  274    H    SER  36           HN       SER  36 -11.354   0.523  -5.532
  275    HA   SER  36           HA       SER  36  -8.523   0.073  -5.933
  276   1HB   SER  36          HB2       SER  36  -9.105  -0.091  -8.302
  277   2HB   SER  36          HB1       SER  36 -10.310  -0.951  -7.350
  278    HG   SER  36           HG       SER  36 -11.689   0.787  -7.573
  279    H    ILE  37           HN       ILE  37  -7.052   1.484  -7.080
  280    HA   ILE  37           HA       ILE  37  -7.937   4.315  -7.453
  281    HB   ILE  37           HB       ILE  37  -5.787   5.059  -6.367
  282   1HG1  ILE  37          HG12      ILE  37  -5.684   2.286  -5.159
  283   2HG1  ILE  37          HG11      ILE  37  -4.780   2.674  -6.621
  284   1HG2  ILE  37          HG21      ILE  37  -8.076   4.917  -5.206
  285   2HG2  ILE  37          HG22      ILE  37  -6.662   4.983  -4.154
  286   3HG2  ILE  37          HG23      ILE  37  -7.474   3.445  -4.443
  287   1HD1  ILE  37          HD11      ILE  37  -3.453   2.961  -4.504
  288   2HD1  ILE  37          HD12      ILE  37  -4.562   4.251  -4.041
  289   3HD1  ILE  37          HD13      ILE  37  -3.557   4.425  -5.483
  290    H    ASN  38           HN       ASN  38  -6.224   5.561  -8.704
  291    HA   ASN  38           HA       ASN  38  -5.218   3.855 -10.899
  292   1HB   ASN  38          HB2       ASN  38  -6.325   6.065 -11.356
  293   2HB   ASN  38          HB1       ASN  38  -4.990   6.863 -10.528
  294   1HD2  ASN  38          HD21      ASN  38  -4.297   3.980 -12.430
  295   2HD2  ASN  38          HD22      ASN  38  -3.533   4.785 -13.711
  296    H    LEU  39           HN       LEU  39  -3.159   3.038 -10.801
  297    HA   LEU  39           HA       LEU  39  -1.347   3.949  -8.703
  298   1HB   LEU  39          HB2       LEU  39  -1.047   1.919 -10.930
  299   2HB   LEU  39          HB1       LEU  39   0.237   2.271  -9.783
  300    HG   LEU  39           HG       LEU  39  -1.158   0.263  -9.181
  301   1HD1  LEU  39          HD11      LEU  39  -1.149   0.684  -6.878
  302   2HD1  LEU  39          HD12      LEU  39  -1.560   2.384  -7.079
  303   3HD1  LEU  39          HD13      LEU  39   0.054   1.810  -7.496
  304   1HD2  LEU  39          HD21      LEU  39  -3.415   0.475  -8.508
  305   2HD2  LEU  39          HD22      LEU  39  -3.305   1.377 -10.020
  306   3HD2  LEU  39          HD23      LEU  39  -3.327   2.234  -8.476
  307    H    THR  40           HN       THR  40  -0.205   5.793  -8.959
  308    HA   THR  40           HA       THR  40   1.213   6.261 -11.529
  309    HB   THR  40           HB       THR  40   0.465   8.618 -11.554
  310    HG1  THR  40           HG1      THR  40  -1.276   7.782  -9.478
  311   1HG2  THR  40          HG21      THR  40  -1.936   6.788 -11.378
  312   2HG2  THR  40          HG22      THR  40  -0.803   6.745 -12.730
  313   3HG2  THR  40          HG23      THR  40  -1.734   8.208 -12.404
  314    H    ALA  41           HN       ALA  41   0.924   8.870  -9.275
  315    HA   ALA  41           HA       ALA  41   3.695   8.295  -8.252
  316   1HB   ALA  41          HB1       ALA  41   4.069  10.671  -8.186
  317   2HB   ALA  41          HB2       ALA  41   2.374  11.005  -8.547
  318   3HB   ALA  41          HB3       ALA  41   3.414  10.290  -9.779
  319    H    GLY  42           HN       GLY  42   0.712  10.083  -7.345
  320   1HA   GLY  42          HA2       GLY  42   1.405  10.094  -4.530
  321   2HA   GLY  42          HA1       GLY  42  -0.175  10.501  -5.200
  322    H    MET  43           HN       MET  43   1.487   7.452  -5.789
  323    HA   MET  43           HA       MET  43  -0.800   5.874  -5.157
  324   1HB   MET  43          HB2       MET  43   2.118   5.063  -5.239
  325   2HB   MET  43          HB1       MET  43   0.739   3.964  -5.327
  326   1HG   MET  43          HG2       MET  43  -0.040   5.271  -7.336
  327   2HG   MET  43          HG1       MET  43   1.502   6.113  -7.316
  328   1HE   MET  43          HE1       MET  43   3.638   4.966  -7.004
  329   2HE   MET  43          HE2       MET  43   4.141   3.538  -7.907
  330   3HE   MET  43          HE3       MET  43   3.434   3.352  -6.303
  331    H    TYR  44           HN       TYR  44   2.100   6.649  -3.207
  332    HA   TYR  44           HA       TYR  44   1.540   4.871  -1.067
  333   1HB   TYR  44          HB2       TYR  44   2.946   7.550  -1.070
  334   2HB   TYR  44          HB1       TYR  44   2.894   6.470   0.322
  335    HD1  TYR  44           HD1      TYR  44   4.054   4.303   0.299
  336    HD2  TYR  44           HD2      TYR  44   4.212   6.980  -3.058
  337    HE1  TYR  44           HE1      TYR  44   5.955   3.011  -0.644
  338    HE2  TYR  44           HE2      TYR  44   6.107   5.688  -3.998
  339    HH   TYR  44           HH       TYR  44   6.873   2.699  -3.201
  340    H    CYS  45           HN       CYS  45   0.713   8.350  -1.315
  341    HA   CYS  45           HA       CYS  45  -0.799   8.326   1.131
  342   1HB   CYS  45          HB2       CYS  45  -0.722  10.223  -1.222
  343   2HB   CYS  45          HB1       CYS  45  -1.755  10.500   0.183
  344    H    ALA  46           HN       ALA  46  -1.759   8.106  -2.307
  345    HA   ALA  46           HA       ALA  46  -4.567   7.960  -1.853
  346   1HB   ALA  46          HB1       ALA  46  -4.741   7.104  -4.077
  347   2HB   ALA  46          HB2       ALA  46  -3.111   6.430  -4.024
  348   3HB   ALA  46          HB3       ALA  46  -3.342   8.177  -4.102
  349    H    ALA  47           HN       ALA  47  -2.089   5.403  -2.012
  350    HA   ALA  47           HA       ALA  47  -3.895   3.233  -1.568
  351   1HB   ALA  47          HB1       ALA  47  -0.937   3.547  -0.985
  352   2HB   ALA  47          HB2       ALA  47  -1.676   2.739  -2.368
  353   3HB   ALA  47          HB3       ALA  47  -1.809   2.031  -0.760
  354    H    LEU  48           HN       LEU  48  -2.090   5.330   0.657
  355    HA   LEU  48           HA       LEU  48  -2.628   3.913   3.047
  356   1HB   LEU  48          HB2       LEU  48  -0.984   5.734   2.915
  357   2HB   LEU  48          HB1       LEU  48  -2.279   6.897   2.649
  358    HG   LEU  48           HG       LEU  48  -3.215   6.342   4.885
  359   1HD1  LEU  48          HD11      LEU  48  -2.549   4.111   5.324
  360   2HD1  LEU  48          HD12      LEU  48  -1.562   5.070   6.423
  361   3HD1  LEU  48          HD13      LEU  48  -0.863   4.451   4.925
  362   1HD2  LEU  48          HD21      LEU  48  -0.265   6.999   5.040
  363   2HD2  LEU  48          HD22      LEU  48  -1.531   7.519   6.151
  364   3HD2  LEU  48          HD23      LEU  48  -1.488   8.151   4.506
  365    H    GLU  49           HN       GLU  49  -4.514   6.646   1.628
  366    HA   GLU  49           HA       GLU  49  -6.476   6.689   3.683
  367   1HB   GLU  49          HB2       GLU  49  -8.008   7.638   1.868
  368   2HB   GLU  49          HB1       GLU  49  -6.498   8.508   2.150
  369   1HG   GLU  49          HG2       GLU  49  -5.464   7.411   0.235
  370   2HG   GLU  49          HG1       GLU  49  -6.904   6.426  -0.017
  371    H    SER  50           HN       SER  50  -6.288   4.723   0.724
  372    HA   SER  50           HA       SER  50  -8.868   3.508   1.031
  373   1HB   SER  50          HB2       SER  50  -6.328   2.526  -0.302
  374   2HB   SER  50          HB1       SER  50  -7.874   1.686  -0.408
  375    HG   SER  50           HG       SER  50  -8.506   3.116  -1.813
  376    H    LEU  51           HN       LEU  51  -5.650   2.658   2.250
  377    HA   LEU  51           HA       LEU  51  -6.474   0.187   3.495
  378   1HB   LEU  51          HB2       LEU  51  -4.105   2.016   3.925
  379   2HB   LEU  51          HB1       LEU  51  -4.300   0.486   4.778
  380    HG   LEU  51           HG       LEU  51  -4.341   0.753   1.757
  381   1HD1  LEU  51          HD11      LEU  51  -2.058  -0.006   1.746
  382   2HD1  LEU  51          HD12      LEU  51  -2.066  -0.227   3.495
  383   3HD1  LEU  51          HD13      LEU  51  -2.156   1.395   2.811
  384   1HD2  LEU  51          HD21      LEU  51  -4.618  -1.522   3.692
  385   2HD2  LEU  51          HD22      LEU  51  -3.663  -1.829   2.244
  386   3HD2  LEU  51          HD23      LEU  51  -5.336  -1.302   2.099
  387    H    ILE  52           HN       ILE  52  -6.412   3.552   4.555
  388    HA   ILE  52           HA       ILE  52  -6.682   3.187   7.339
  389    HB   ILE  52           HB       ILE  52  -7.777   5.290   5.455
  390   1HG1  ILE  52          HG12      ILE  52  -5.261   5.027   6.022
  391   2HG1  ILE  52          HG11      ILE  52  -5.973   6.627   6.159
  392   1HG2  ILE  52          HG21      ILE  52  -8.156   6.661   7.570
  393   2HG2  ILE  52          HG22      ILE  52  -8.057   5.138   8.459
  394   3HG2  ILE  52          HG23      ILE  52  -9.325   5.377   7.255
  395   1HD1  ILE  52          HD11      ILE  52  -6.012   4.925   8.618
  396   2HD1  ILE  52          HD12      ILE  52  -5.792   6.661   8.453
  397   3HD1  ILE  52          HD13      ILE  52  -4.456   5.571   8.107
  398    H    ASN  53           HN       ASN  53  -8.931   2.527   4.779
  399    HA   ASN  53           HA       ASN  53 -11.292   2.505   6.505
  400   1HB   ASN  53          HB2       ASN  53 -10.773   1.496   3.695
  401   2HB   ASN  53          HB1       ASN  53 -12.344   1.381   4.490
  402   1HD2  ASN  53          HD21      ASN  53 -13.128   3.617   5.436
  403   2HD2  ASN  53          HD22      ASN  53 -12.843   4.977   4.460
  404    H    VAL  54           HN       VAL  54  -8.707   0.344   5.868
  405    HA   VAL  54           HA       VAL  54 -10.294  -2.052   6.625
  406    HB   VAL  54           HB       VAL  54  -7.346  -1.808   5.969
  407   1HG1  VAL  54          HG11      VAL  54  -7.754  -3.785   7.266
  408   2HG1  VAL  54          HG12      VAL  54  -7.666  -4.305   5.582
  409   3HG1  VAL  54          HG13      VAL  54  -9.235  -4.139   6.374
  410   1HG2  VAL  54          HG21      VAL  54  -9.702  -2.684   4.262
  411   2HG2  VAL  54          HG22      VAL  54  -8.009  -2.734   3.771
  412   3HG2  VAL  54          HG23      VAL  54  -8.797  -1.183   4.066
  413    H    SER  55           HN       SER  55 -10.475  -2.599   8.719
  414    HA   SER  55           HA       SER  55  -8.273  -1.873  10.627
  415   1HB   SER  55          HB2       SER  55 -11.266  -1.673  11.073
  416   2HB   SER  55          HB1       SER  55 -10.060  -1.531  12.351
  417    HG   SER  55           HG       SER  55  -9.200   0.255  11.251
  418    H    GLY  56           HN       GLY  56  -7.974  -3.392  12.346
  419   1HA   GLY  56          HA2       GLY  56  -8.417  -5.431  13.534
  420   2HA   GLY  56          HA1       GLY  56  -9.585  -5.883  12.294
  421    H    CYS  57           HN       CYS  57  -7.159  -4.904  10.426
  422    HA   CYS  57           HA       CYS  57  -6.046  -7.655  10.196
  423   1HB   CYS  57          HB2       CYS  57  -5.783  -5.234   8.379
  424   2HB   CYS  57          HB1       CYS  57  -5.114  -6.832   8.046
  425    H    SER  58           HN       SER  58  -4.609  -7.658  11.969
  426    HA   SER  58           HA       SER  58  -2.671  -5.571  12.457
  427   1HB   SER  58          HB2       SER  58  -3.437  -7.210  14.187
  428   2HB   SER  58          HB1       SER  58  -2.589  -8.479  13.311
  429    HG   SER  58           HG       SER  58  -1.370  -7.507  15.043
  430    H    ALA  59           HN       ALA  59  -2.765  -8.368  10.399
  431    HA   ALA  59           HA       ALA  59  -0.026  -8.864   9.993
  432   1HB   ALA  59          HB1       ALA  59  -0.730  -9.639   7.709
  433   2HB   ALA  59          HB2       ALA  59  -2.331  -8.971   8.030
  434   3HB   ALA  59          HB3       ALA  59  -1.717 -10.297   9.014
  435    H    ILE  60           HN       ILE  60  -2.088  -6.357   8.502
  436    HA   ILE  60           HA       ILE  60   0.284  -5.310   7.026
  437    HB   ILE  60           HB       ILE  60  -1.343  -3.916   5.818
  438   1HG1  ILE  60          HG12      ILE  60  -3.425  -5.317   7.527
  439   2HG1  ILE  60          HG11      ILE  60  -2.958  -3.629   7.705
  440   1HG2  ILE  60          HG21      ILE  60  -0.847  -6.315   5.161
  441   2HG2  ILE  60          HG22      ILE  60  -2.386  -5.682   4.579
  442   3HG2  ILE  60          HG23      ILE  60  -2.348  -6.764   5.968
  443   1HD1  ILE  60          HD11      ILE  60  -4.319  -4.930   5.342
  444   2HD1  ILE  60          HD12      ILE  60  -3.567  -3.338   5.244
  445   3HD1  ILE  60          HD13      ILE  60  -4.917  -3.610   6.349
  446    H    GLU  61           HN       GLU  61  -0.782  -4.815  10.087
  447    HA   GLU  61           HA       GLU  61  -1.158  -1.984  10.235
  448   1HB   GLU  61          HB2       GLU  61  -0.587  -2.159  12.575
  449   2HB   GLU  61          HB1       GLU  61  -1.457  -3.630  12.158
  450   1HG   GLU  61          HG2       GLU  61   0.850  -4.680  11.719
  451   2HG   GLU  61          HG1       GLU  61   1.522  -3.272  12.532
  452    H    LYS  62           HN       LYS  62   1.745  -3.994  10.287
  453    HA   LYS  62           HA       LYS  62   3.660  -1.922  10.691
  454   1HB   LYS  62          HB2       LYS  62   3.836  -4.541   9.184
  455   2HB   LYS  62          HB1       LYS  62   5.231  -3.515   9.529
  456   1HG   LYS  62          HG2       LYS  62   4.731  -3.659  11.943
  457   2HG   LYS  62          HG1       LYS  62   3.359  -4.711  11.585
  458   1HD   LYS  62          HD2       LYS  62   4.875  -6.357  10.560
  459   2HD   LYS  62          HD1       LYS  62   6.252  -5.313  10.920
  460   1HE   LYS  62          HE2       LYS  62   4.360  -6.439  13.001
  461   2HE   LYS  62          HE1       LYS  62   5.953  -7.098  12.630
  462   1HZ   LYS  62          HZ1       LYS  62   6.542  -5.697  14.279
  463   2HZ   LYS  62          HZ2       LYS  62   5.236  -4.641  14.026
  464   3HZ   LYS  62          HZ3       LYS  62   6.597  -4.575  13.011
  465    H    THR  63           HN       THR  63   2.179  -3.219   7.755
  466    HA   THR  63           HA       THR  63   3.693  -1.759   5.858
  467    HB   THR  63           HB       THR  63   0.798  -2.623   5.725
  468    HG1  THR  63           HG1      THR  63   3.239  -3.868   5.026
  469   1HG2  THR  63          HG21      THR  63   1.277  -1.003   4.000
  470   2HG2  THR  63          HG22      THR  63   1.219  -2.598   3.259
  471   3HG2  THR  63          HG23      THR  63   2.776  -1.825   3.575
  472    H    GLN  64           HN       GLN  64   0.757  -0.901   7.647
  473    HA   GLN  64           HA       GLN  64   0.216   1.534   6.297
  474   1HB   GLN  64          HB2       GLN  64  -0.306   0.680   9.152
  475   2HB   GLN  64          HB1       GLN  64  -0.923   2.182   8.457
  476   1HG   GLN  64          HG2       GLN  64  -2.106   0.931   6.722
  477   2HG   GLN  64          HG1       GLN  64  -1.440  -0.584   7.330
  478   1HE2  GLN  64          HE21      GLN  64  -4.287  -0.047   7.206
  479   2HE2  GLN  64          HE22      GLN  64  -4.873  -0.012   8.800
  480    H    ARG  65           HN       ARG  65   2.330   0.857   9.078
  481    HA   ARG  65           HA       ARG  65   2.990   3.590   9.606
  482   1HB   ARG  65          HB2       ARG  65   4.499   1.017  10.111
  483   2HB   ARG  65          HB1       ARG  65   5.035   2.590  10.702
  484   1HG   ARG  65          HG2       ARG  65   2.825   2.860  11.846
  485   2HG   ARG  65          HG1       ARG  65   2.415   1.214  11.350
  486   1HD   ARG  65          HD2       ARG  65   4.776   2.018  13.066
  487   2HD   ARG  65          HD1       ARG  65   3.320   1.191  13.625
  488    HE   ARG  65           HE       ARG  65   4.275  -0.456  11.617
  489   1HH1  ARG  65          HH21      ARG  65   5.530   1.004  14.469
  490   2HH1  ARG  65          HH22      ARG  65   6.687  -0.250  14.763
  491   1HH2  ARG  65          HH11      ARG  65   5.766  -2.106  11.982
  492   2HH2  ARG  65          HH12      ARG  65   6.819  -2.017  13.353
  493    H    MET  66           HN       MET  66   4.689   1.109   7.681
  494    HA   MET  66           HA       MET  66   6.819   2.785   6.829
  495   1HB   MET  66          HB2       MET  66   5.539   0.355   5.564
  496   2HB   MET  66          HB1       MET  66   6.977   1.125   4.899
  497   1HG   MET  66          HG2       MET  66   8.014   0.849   7.238
  498   2HG   MET  66          HG1       MET  66   6.660  -0.219   7.595
  499   1HE   MET  66          HE1       MET  66   6.501  -2.607   6.977
  500   2HE   MET  66          HE2       MET  66   7.076  -3.258   5.447
  501   3HE   MET  66          HE3       MET  66   5.930  -1.929   5.451
  502    H    LEU  67           HN       LEU  67   3.600   2.215   5.419
  503    HA   LEU  67           HA       LEU  67   4.048   3.735   3.035
  504   1HB   LEU  67          HB2       LEU  67   1.516   3.157   4.579
  505   2HB   LEU  67          HB1       LEU  67   1.524   3.988   3.030
  506    HG   LEU  67           HG       LEU  67   2.738   1.242   3.460
  507   1HD1  LEU  67          HD11      LEU  67   0.680   0.424   2.284
  508   2HD1  LEU  67          HD12      LEU  67   0.014   2.047   2.421
  509   3HD1  LEU  67          HD13      LEU  67   0.340   1.110   3.876
  510   1HD2  LEU  67          HD21      LEU  67   3.679   2.129   1.472
  511   2HD2  LEU  67          HD22      LEU  67   2.199   2.988   1.050
  512   3HD2  LEU  67          HD23      LEU  67   2.283   1.237   0.877
  513    H    SER  68           HN       SER  68   2.984   4.704   6.293
  514    HA   SER  68           HA       SER  68   2.275   7.386   5.678
  515   1HB   SER  68          HB2       SER  68   3.538   6.285   8.208
  516   2HB   SER  68          HB1       SER  68   2.809   7.881   8.059
  517    HG   SER  68           HG       SER  68   1.418   5.517   7.379
  518    H    GLY  69           HN       GLY  69   5.420   5.901   6.342
  519   1HA   GLY  69          HA2       GLY  69   7.017   8.203   6.564
  520   2HA   GLY  69          HA1       GLY  69   7.573   6.698   5.827
  521    H    PHE  70           HN       PHE  70   5.474   6.806   3.744
  522    HA   PHE  70           HA       PHE  70   6.850   8.708   1.918
  523   1HB   PHE  70          HB2       PHE  70   4.893   6.448   1.441
  524   2HB   PHE  70          HB1       PHE  70   5.541   7.471   0.162
  525    HD1  PHE  70           HD1      PHE  70   7.905   7.321  -0.494
  526    HD2  PHE  70           HD2      PHE  70   6.286   4.850   2.620
  527    HE1  PHE  70           HE1      PHE  70   9.911   5.863  -0.605
  528    HE2  PHE  70           HE2      PHE  70   8.289   3.394   2.514
  529    HZ   PHE  70           HZ       PHE  70  10.101   3.899   0.900
  530    H    CYS  71           HN       CYS  71   4.312   8.851   3.989
  531    HA   CYS  71           HA       CYS  71   2.831  10.822   2.278
  532   1HB   CYS  71          HB2       CYS  71   1.718   8.493   2.671
  533   2HB   CYS  71          HB1       CYS  71   1.433   9.082   4.307
  534    HA   PRO  72           HA       PRO  72   4.487  12.614   6.304
  535   1HB   PRO  72          HB2       PRO  72   4.499  15.084   4.678
  536   2HB   PRO  72          HB1       PRO  72   5.811  14.335   5.595
  537   1HG   PRO  72          HG2       PRO  72   5.645  14.339   2.834
  538   2HG   PRO  72          HG1       PRO  72   6.577  13.169   3.776
  539   1HD   PRO  72          HD2       PRO  72   4.043  12.771   2.300
  540   2HD   PRO  72          HD1       PRO  72   5.218  11.558   2.861
  541    H    HIS  73           HN       HIS  73   1.541  12.413   5.191
  542    HA   HIS  73           HA       HIS  73   0.527  14.613   6.947
  543   1HB   HIS  73          HB2       HIS  73  -1.046  15.400   5.425
  544   2HB   HIS  73          HB1       HIS  73   0.318  15.065   4.369
  545    HD1  HIS  73           HD1      HIS  73  -3.088  13.773   5.327
  546    HD2  HIS  73           HD2      HIS  73  -0.109  12.968   2.523
  547    HE1  HIS  73           HE1      HIS  73  -4.130  12.249   3.592
  548    H    LYS  74           HN       LYS  74  -1.118  14.046   8.266
  549    HA   LYS  74           HA       LYS  74  -1.665  11.189   8.533
  550   1HB   LYS  74          HB2       LYS  74  -2.639  13.605  10.081
  551   2HB   LYS  74          HB1       LYS  74  -3.032  11.935  10.500
  552   1HG   LYS  74          HG2       LYS  74  -0.629  11.416  10.709
  553   2HG   LYS  74          HG1       LYS  74  -0.242  13.086  10.296
  554   1HD   LYS  74          HD2       LYS  74  -1.479  13.874  12.277
  555   2HD   LYS  74          HD1       LYS  74  -1.876  12.206  12.694
  556   1HE   LYS  74          HE2       LYS  74   0.147  13.227  13.901
  557   2HE   LYS  74          HE1       LYS  74   0.396  11.662  13.131
  558   1HZ   LYS  74          HZ1       LYS  74   1.017  14.253  11.833
  559   2HZ   LYS  74          HZ2       LYS  74   1.419  12.701  11.276
  560   3HZ   LYS  74          HZ3       LYS  74   2.160  13.323  12.672
  561    H    VAL  75           HN       VAL  75  -3.680  10.191   8.332
  562    HA   VAL  75           HA       VAL  75  -5.890  11.787   7.116
  563    HB   VAL  75           HB       VAL  75  -4.902  10.769   5.214
  564   1HG1  VAL  75          HG11      VAL  75  -3.353   9.231   6.088
  565   2HG1  VAL  75          HG12      VAL  75  -4.524   8.214   5.253
  566   3HG1  VAL  75          HG13      VAL  75  -4.586   8.369   7.009
  567   1HG2  VAL  75          HG21      VAL  75  -6.616   9.283   4.428
  568   2HG2  VAL  75          HG22      VAL  75  -7.402  10.420   5.524
  569   3HG2  VAL  75          HG23      VAL  75  -7.027   8.785   6.069
  570    H    SER  76           HN       SER  76  -7.806  11.384   8.037
  571    HA   SER  76           HA       SER  76  -7.996   9.145  10.008
  572   1HB   SER  76          HB2       SER  76  -9.605  11.694   9.682
  573   2HB   SER  76          HB1       SER  76  -9.990  10.430  10.845
  574    HG   SER  76           HG       SER  76  -8.608  11.428  12.067
  575    H    ALA  77           HN       ALA  77 -10.198   8.115  10.127
  576    HA   ALA  77           HA       ALA  77 -10.933   7.029   7.593
  577   1HB   ALA  77          HB1       ALA  77 -12.830   6.014   8.820
  578   2HB   ALA  77          HB2       ALA  77 -12.474   7.047  10.204
  579   3HB   ALA  77          HB3       ALA  77 -11.310   5.823   9.692
  580    H    GLY  78           HN       GLY  78 -11.601  10.081   8.807
  581   1HA   GLY  78          HA2       GLY  78 -14.210  10.291   7.344
  582   2HA   GLY  78          HA1       GLY  78 -13.631  11.437   8.553
  583    H    GLN  79           HN       GLN  79 -10.866  11.304   7.278
  584    HA   GLN  79           HA       GLN  79 -11.416  13.367   5.212
  585   1HB   GLN  79          HB2       GLN  79  -8.879  12.487   6.614
  586   2HB   GLN  79          HB1       GLN  79  -8.933  13.731   5.360
  587   1HG   GLN  79          HG2       GLN  79 -10.516  15.045   6.712
  588   2HG   GLN  79          HG1       GLN  79 -10.488  13.803   7.962
  589   1HE2  GLN  79          HE21      GLN  79  -9.610  16.621   8.259
  590   2HE2  GLN  79          HE22      GLN  79  -7.971  16.561   8.697
  591    H    PHE  80           HN       PHE  80 -11.449  12.776   3.109
  592    HA   PHE  80           HA       PHE  80  -9.691  10.517   2.202
  593   1HB   PHE  80          HB2       PHE  80 -12.572  11.076   1.446
  594   2HB   PHE  80          HB1       PHE  80 -11.535   9.918   0.606
  595    HD1  PHE  80           HD1      PHE  80 -13.756  10.407   3.364
  596    HD2  PHE  80           HD2      PHE  80 -10.365   8.111   2.066
  597    HE1  PHE  80           HE1      PHE  80 -14.258   8.694   5.088
  598    HE2  PHE  80           HE2      PHE  80 -10.861   6.403   3.797
  599    HZ   PHE  80           HZ       PHE  80 -12.806   6.694   5.306
  600    H    SER  81           HN       SER  81  -8.778  10.804   0.119
  601    HA   SER  81           HA       SER  81  -9.178  13.524  -1.097
  602   1HB   SER  81          HB2       SER  81  -6.626  11.895  -0.977
  603   2HB   SER  81          HB1       SER  81  -6.803  13.502  -1.677
  604    HG   SER  81           HG       SER  81  -6.915  12.679   1.017
  605    H    SER  82           HN       SER  82  -8.652  10.069  -1.754
  606    HA   SER  82           HA       SER  82  -9.012  10.626  -4.686
  607   1HB   SER  82          HB2       SER  82  -6.892   9.479  -3.928
  608   2HB   SER  82          HB1       SER  82  -7.892   8.128  -3.399
  609    HG   SER  82           HG       SER  82  -8.544   8.896  -5.905
  610    H    LEU  83           HN       LEU  83 -10.798   9.549  -2.073
  611    HA   LEU  83           HA       LEU  83 -12.221   7.416  -3.549
  612   1HB   LEU  83          HB2       LEU  83 -12.895   8.685  -0.876
  613   2HB   LEU  83          HB1       LEU  83 -13.585   7.204  -1.529
  614    HG   LEU  83           HG       LEU  83 -10.737   7.673  -0.622
  615   1HD1  LEU  83          HD11      LEU  83 -12.703   7.048   0.975
  616   2HD1  LEU  83          HD12      LEU  83 -11.206   6.123   1.080
  617   3HD1  LEU  83          HD13      LEU  83 -12.596   5.455   0.224
  618   1HD2  LEU  83          HD21      LEU  83 -10.413   6.348  -2.550
  619   2HD2  LEU  83          HD22      LEU  83 -11.919   5.464  -2.306
  620   3HD2  LEU  83          HD23      LEU  83 -10.533   5.155  -1.258
  621    H    HIS  84           HN       HIS  84 -12.200  10.350  -4.428
  622    HA   HIS  84           HA       HIS  84 -14.934  11.278  -4.008
  623   1HB   HIS  84          HB2       HIS  84 -13.078  12.138  -6.245
  624   2HB   HIS  84          HB1       HIS  84 -14.410  13.049  -5.540
  625    HD1  HIS  84           HD1      HIS  84 -13.418  12.120  -2.534
  626    HD2  HIS  84           HD2      HIS  84 -11.269  14.219  -5.422
  627    HE1  HIS  84           HE1      HIS  84 -11.593  13.370  -1.308
  628    H    VAL  85           HN       VAL  85 -13.202   9.547  -6.550
  629    HA   VAL  85           HA       VAL  85 -15.440   9.514  -8.400
  630    HB   VAL  85           HB       VAL  85 -12.962   7.771  -8.275
  631   1HG1  VAL  85          HG11      VAL  85 -14.476   6.672  -9.713
  632   2HG1  VAL  85          HG12      VAL  85 -13.494   7.645 -10.808
  633   3HG1  VAL  85          HG13      VAL  85 -15.111   8.188 -10.355
  634   1HG2  VAL  85          HG21      VAL  85 -11.969   9.342  -9.813
  635   2HG2  VAL  85          HG22      VAL  85 -12.587  10.271  -8.446
  636   3HG2  VAL  85          HG23      VAL  85 -13.483  10.233  -9.965
  637    H    ARG  86           HN       ARG  86 -16.812   7.693  -8.858
  638    HA   ARG  86           HA       ARG  86 -17.250   5.953  -6.503
  639   1HB   ARG  86          HB2       ARG  86 -18.809   6.386  -9.065
  640   2HB   ARG  86          HB1       ARG  86 -19.269   5.202  -7.841
  641   1HG   ARG  86          HG2       ARG  86 -19.380   7.015  -6.151
  642   2HG   ARG  86          HG1       ARG  86 -18.975   8.190  -7.403
  643   1HD   ARG  86          HD2       ARG  86 -20.999   7.547  -8.666
  644   2HD   ARG  86          HD1       ARG  86 -21.407   6.378  -7.408
  645    HE   ARG  86           HE       ARG  86 -21.196   8.739  -6.009
  646   1HH1  ARG  86          HH21      ARG  86 -22.845   7.711  -8.863
  647   2HH1  ARG  86          HH22      ARG  86 -24.185   8.786  -8.633
  648   1HH2  ARG  86          HH11      ARG  86 -22.932  10.155  -5.705
  649   2HH2  ARG  86          HH12      ARG  86 -24.233  10.169  -6.850
  650    H    ASP  87           HN       ASP  87 -15.055   4.953  -7.089
  651    HA   ASP  87           HA       ASP  87 -15.059   3.081  -9.351
  652   1HB   ASP  87          HB2       ASP  87 -13.128   3.580  -7.065
  653   2HB   ASP  87          HB1       ASP  87 -12.863   2.351  -8.304
  654    H    THR  88           HN       THR  88 -14.587   0.694  -8.835
  655    HA   THR  88           HA       THR  88 -16.514  -0.189  -6.755
  656    HB   THR  88           HB       THR  88 -16.633  -1.151  -9.059
  657    HG1  THR  88           HG1      THR  88 -16.679  -3.322  -8.327
  658   1HG2  THR  88          HG21      THR  88 -14.004  -2.479  -8.359
  659   2HG2  THR  88          HG22      THR  88 -14.136  -1.081  -9.425
  660   3HG2  THR  88          HG23      THR  88 -14.897  -2.607  -9.874
  661    H    LYS  89           HN       LYS  89 -15.880  -1.841  -5.199
  662    HA   LYS  89           HA       LYS  89 -13.136  -1.421  -4.213
  663   1HB   LYS  89          HB2       LYS  89 -15.472  -3.023  -3.130
  664   2HB   LYS  89          HB1       LYS  89 -13.923  -2.844  -2.307
  665   1HG   LYS  89          HG2       LYS  89 -14.232  -0.400  -2.260
  666   2HG   LYS  89          HG1       LYS  89 -15.783  -0.580  -3.080
  667   1HD   LYS  89          HD2       LYS  89 -16.599  -1.973  -1.194
  668   2HD   LYS  89          HD1       LYS  89 -15.059  -1.734  -0.370
  669   1HE   LYS  89          HE2       LYS  89 -15.434   0.609  -0.136
  670   2HE   LYS  89          HE1       LYS  89 -16.793   0.576  -1.260
  671   1HZ   LYS  89          HZ1       LYS  89 -16.711  -0.050   1.546
  672   2HZ   LYS  89          HZ2       LYS  89 -17.509  -1.228   0.615
  673   3HZ   LYS  89          HZ3       LYS  89 -18.027   0.388   0.569
  674    H    ILE  90           HN       ILE  90 -11.623  -3.152  -3.920
  675    HA   ILE  90           HA       ILE  90 -12.229  -5.675  -5.432
  676    HB   ILE  90           HB       ILE  90  -9.838  -5.629  -6.187
  677   1HG1  ILE  90          HG12      ILE  90  -9.939  -2.816  -5.043
  678   2HG1  ILE  90          HG11      ILE  90  -8.972  -4.148  -4.415
  679   1HG2  ILE  90          HG21      ILE  90 -11.658  -4.845  -7.655
  680   2HG2  ILE  90          HG22      ILE  90 -10.189  -3.912  -7.929
  681   3HG2  ILE  90          HG23      ILE  90 -11.509  -3.223  -6.984
  682   1HD1  ILE  90          HD11      ILE  90  -7.454  -2.922  -5.747
  683   2HD1  ILE  90          HD12      ILE  90  -8.647  -2.662  -7.020
  684   3HD1  ILE  90          HD13      ILE  90  -7.942  -4.262  -6.786
  685    H    GLU  91           HN       GLU  91 -10.842  -7.502  -4.743
  686    HA   GLU  91           HA       GLU  91 -10.784  -7.778  -1.907
  687   1HB   GLU  91          HB2       GLU  91  -9.292  -9.351  -4.029
  688   2HB   GLU  91          HB1       GLU  91  -9.445  -9.835  -2.341
  689   1HG   GLU  91          HG2       GLU  91 -11.897  -9.895  -2.568
  690   2HG   GLU  91          HG1       GLU  91 -11.753  -9.412  -4.258
  691    H    VAL  92           HN       VAL  92  -9.094  -7.560  -0.413
  692    HA   VAL  92           HA       VAL  92  -7.076  -5.632  -0.953
  693    HB   VAL  92           HB       VAL  92  -7.259  -7.773   1.187
  694   1HG1  VAL  92          HG11      VAL  92  -5.227  -5.581   0.730
  695   2HG1  VAL  92          HG12      VAL  92  -4.941  -7.283   1.089
  696   3HG1  VAL  92          HG13      VAL  92  -5.548  -6.210   2.348
  697   1HG2  VAL  92          HG21      VAL  92  -7.549  -4.786   1.527
  698   2HG2  VAL  92          HG22      VAL  92  -8.152  -6.079   2.564
  699   3HG2  VAL  92          HG23      VAL  92  -8.919  -5.767   1.009
  700    H    ALA  93           HN       ALA  93  -7.007  -9.173  -1.003
  701    HA   ALA  93           HA       ALA  93  -4.278  -9.653  -1.380
  702   1HB   ALA  93          HB1       ALA  93  -6.662 -10.993  -2.688
  703   2HB   ALA  93          HB2       ALA  93  -5.870 -11.479  -1.190
  704   3HB   ALA  93          HB3       ALA  93  -5.023 -11.642  -2.730
  705    H    GLN  94           HN       GLN  94  -6.701  -8.699  -3.799
  706    HA   GLN  94           HA       GLN  94  -4.815  -8.701  -6.000
  707   1HB   GLN  94          HB2       GLN  94  -7.577  -7.507  -5.631
  708   2HB   GLN  94          HB1       GLN  94  -6.665  -7.350  -7.134
  709   1HG   GLN  94          HG2       GLN  94  -6.527  -9.786  -7.336
  710   2HG   GLN  94          HG1       GLN  94  -7.367  -9.982  -5.800
  711   1HE2  GLN  94          HE21      GLN  94  -9.208 -11.071  -6.770
  712   2HE2  GLN  94          HE22      GLN  94 -10.308 -10.248  -7.765
  713    H    PHE  95           HN       PHE  95  -6.058  -6.273  -3.755
  714    HA   PHE  95           HA       PHE  95  -4.973  -3.955  -4.982
  715   1HB   PHE  95          HB2       PHE  95  -6.573  -3.892  -3.097
  716   2HB   PHE  95          HB1       PHE  95  -5.330  -4.553  -2.036
  717    HD1  PHE  95           HD1      PHE  95  -6.470  -1.580  -3.862
  718    HD2  PHE  95           HD2      PHE  95  -3.361  -3.245  -1.411
  719    HE1  PHE  95           HE1      PHE  95  -5.569   0.696  -3.453
  720    HE2  PHE  95           HE2      PHE  95  -2.461  -0.975  -1.004
  721    HZ   PHE  95           HZ       PHE  95  -3.564   0.994  -2.024
  722    H    VAL  96           HN       VAL  96  -3.533  -6.060  -2.453
  723    HA   VAL  96           HA       VAL  96  -1.080  -4.614  -2.223
  724    HB   VAL  96           HB       VAL  96  -1.627  -7.562  -1.758
  725   1HG1  VAL  96          HG11      VAL  96   0.686  -5.757  -1.019
  726   2HG1  VAL  96          HG12      VAL  96   0.745  -7.294  -1.881
  727   3HG1  VAL  96          HG13      VAL  96   0.356  -7.260  -0.159
  728   1HG2  VAL  96          HG21      VAL  96  -1.584  -5.211   0.156
  729   2HG2  VAL  96          HG22      VAL  96  -1.909  -6.891   0.581
  730   3HG2  VAL  96          HG23      VAL  96  -3.041  -6.003  -0.439
  731    H    LYS  97           HN       LYS  97  -1.885  -7.488  -4.180
  732    HA   LYS  97           HA       LYS  97   0.706  -7.814  -5.315
  733   1HB   LYS  97          HB2       LYS  97  -2.026  -8.525  -6.407
  734   2HB   LYS  97          HB1       LYS  97  -0.502  -9.091  -7.090
  735   1HG   LYS  97          HG2       LYS  97   0.082 -10.162  -4.955
  736   2HG   LYS  97          HG1       LYS  97  -1.403  -9.551  -4.233
  737   1HD   LYS  97          HD2       LYS  97  -2.012 -11.736  -4.827
  738   2HD   LYS  97          HD1       LYS  97  -2.594 -10.802  -6.201
  739   1HE   LYS  97          HE2       LYS  97  -0.605 -11.379  -7.487
  740   2HE   LYS  97          HE1       LYS  97   0.091 -12.208  -6.095
  741   1HZ   LYS  97          HZ1       LYS  97  -0.923 -14.010  -6.872
  742   2HZ   LYS  97          HZ2       LYS  97  -1.870 -13.122  -7.967
  743   3HZ   LYS  97          HZ3       LYS  97  -2.379 -13.312  -6.356
  744    H    ASP  98           HN       ASP  98  -2.128  -5.982  -6.549
  745    HA   ASP  98           HA       ASP  98  -0.897  -5.189  -9.001
  746   1HB   ASP  98          HB2       ASP  98  -2.951  -3.759  -7.282
  747   2HB   ASP  98          HB1       ASP  98  -2.504  -3.254  -8.911
  748    H    LEU  99           HN       LEU  99  -0.926  -3.738  -5.793
  749    HA   LEU  99           HA       LEU  99   0.569  -1.400  -6.416
  750   1HB   LEU  99          HB2       LEU  99  -0.702  -1.696  -4.328
  751   2HB   LEU  99          HB1       LEU  99   0.397  -2.981  -3.832
  752    HG   LEU  99           HG       LEU  99   2.266  -1.373  -3.823
  753   1HD1  LEU  99          HD11      LEU  99   0.105   0.485  -4.815
  754   2HD1  LEU  99          HD12      LEU  99   1.758   0.291  -5.409
  755   3HD1  LEU  99          HD13      LEU  99   1.463   1.128  -3.888
  756   1HD2  LEU  99          HD21      LEU  99   1.537  -0.113  -1.843
  757   2HD2  LEU  99          HD22      LEU  99   0.911  -1.761  -1.787
  758   3HD2  LEU  99          HD23      LEU  99  -0.148  -0.433  -2.251
  759    H    LEU 100           HN       LEU 100   1.540  -4.665  -5.459
  760    HA   LEU 100           HA       LEU 100   4.288  -4.242  -5.043
  761   1HB   LEU 100          HB2       LEU 100   3.299  -6.345  -4.466
  762   2HB   LEU 100          HB1       LEU 100   2.782  -6.631  -6.118
  763    HG   LEU 100           HG       LEU 100   5.067  -6.905  -6.853
  764   1HD1  LEU 100          HD11      LEU 100   6.879  -6.893  -5.017
  765   2HD1  LEU 100          HD12      LEU 100   5.714  -6.000  -4.043
  766   3HD1  LEU 100          HD13      LEU 100   6.295  -5.325  -5.560
  767   1HD2  LEU 100          HD21      LEU 100   5.644  -8.917  -5.623
  768   2HD2  LEU 100          HD22      LEU 100   3.888  -8.828  -5.750
  769   3HD2  LEU 100          HD23      LEU 100   4.686  -8.391  -4.239
  770    H    LEU 101           HN       LEU 101   2.621  -4.890  -8.178
  771    HA   LEU 101           HA       LEU 101   5.050  -4.977  -9.697
  772   1HB   LEU 101          HB2       LEU 101   2.194  -4.324 -10.392
  773   2HB   LEU 101          HB1       LEU 101   3.459  -4.104 -11.599
  774    HG   LEU 101           HG       LEU 101   2.339  -6.354 -11.690
  775   1HD1  LEU 101          HD11      LEU 101   5.148  -6.997 -10.906
  776   2HD1  LEU 101          HD12      LEU 101   4.952  -5.770 -12.156
  777   3HD1  LEU 101          HD13      LEU 101   4.267  -7.376 -12.385
  778   1HD2  LEU 101          HD21      LEU 101   2.069  -6.515  -9.193
  779   2HD2  LEU 101          HD22      LEU 101   3.791  -6.861  -9.079
  780   3HD2  LEU 101          HD23      LEU 101   2.723  -7.967  -9.940
  781    H    HIS 102           HN       HIS 102   2.979  -2.223  -8.781
  782    HA   HIS 102           HA       HIS 102   4.537  -0.294 -10.252
  783   1HB   HIS 102          HB2       HIS 102   2.489  -0.092  -8.048
  784   2HB   HIS 102          HB1       HIS 102   3.367   1.340  -8.586
  785    HD1  HIS 102           HD1      HIS 102   3.001   2.118 -11.048
  786    HD2  HIS 102           HD2      HIS 102   0.612  -1.095  -9.908
  787    HE1  HIS 102           HE1      HIS 102   1.243   1.880 -12.844
  788    H    LEU 103           HN       LEU 103   4.697  -1.415  -6.866
  789    HA   LEU 103           HA       LEU 103   6.542   0.551  -5.969
  790   1HB   LEU 103          HB2       LEU 103   6.248  -2.349  -5.144
  791   2HB   LEU 103          HB1       LEU 103   7.252  -1.183  -4.286
  792    HG   LEU 103           HG       LEU 103   4.291  -0.829  -4.792
  793   1HD1  LEU 103          HD11      LEU 103   5.813  -1.908  -2.413
  794   2HD1  LEU 103          HD12      LEU 103   4.518  -2.694  -3.312
  795   3HD1  LEU 103          HD13      LEU 103   4.161  -1.305  -2.289
  796   1HD2  LEU 103          HD21      LEU 103   6.398   0.773  -3.363
  797   2HD2  LEU 103          HD22      LEU 103   4.753   0.798  -2.741
  798   3HD2  LEU 103          HD23      LEU 103   5.078   1.332  -4.385
  799    H    LYS 104           HN       LYS 104   7.218  -2.657  -7.410
  800    HA   LYS 104           HA       LYS 104  10.073  -2.287  -7.317
  801   1HB   LYS 104          HB2       LYS 104  10.172  -4.230  -8.829
  802   2HB   LYS 104          HB1       LYS 104   9.046  -4.518  -7.503
  803   1HG   LYS 104          HG2       LYS 104   7.150  -3.965  -8.951
  804   2HG   LYS 104          HG1       LYS 104   8.244  -3.584 -10.277
  805   1HD   LYS 104          HD2       LYS 104   7.557  -5.802 -10.735
  806   2HD   LYS 104          HD1       LYS 104   9.149  -5.983 -10.002
  807   1HE   LYS 104          HE2       LYS 104   8.237  -6.669  -7.927
  808   2HE   LYS 104          HE1       LYS 104   6.624  -6.102  -8.353
  809   1HZ   LYS 104          HZ1       LYS 104   6.180  -7.960  -9.490
  810   2HZ   LYS 104          HZ2       LYS 104   7.467  -8.640  -8.615
  811   3HZ   LYS 104          HZ3       LYS 104   7.726  -8.040 -10.182
  812    H    LYS 105           HN       LYS 105   7.616  -1.253  -9.543
  813    HA   LYS 105           HA       LYS 105   9.265  -0.869 -11.852
  814   1HB   LYS 105          HB2       LYS 105   6.774  -0.927 -11.809
  815   2HB   LYS 105          HB1       LYS 105   6.784   0.660 -11.044
  816   1HG   LYS 105          HG2       LYS 105   8.126   1.501 -13.027
  817   2HG   LYS 105          HG1       LYS 105   7.832  -0.054 -13.800
  818   1HD   LYS 105          HD2       LYS 105   5.569   1.655 -12.748
  819   2HD   LYS 105          HD1       LYS 105   6.207   1.862 -14.375
  820   1HE   LYS 105          HE2       LYS 105   4.972  -0.658 -13.220
  821   2HE   LYS 105          HE1       LYS 105   4.305   0.365 -14.487
  822   1HZ   LYS 105          HZ1       LYS 105   6.525  -0.144 -15.667
  823   2HZ   LYS 105          HZ2       LYS 105   5.294  -1.315 -15.677
  824   3HZ   LYS 105          HZ3       LYS 105   6.605  -1.466 -14.608
  825    H    LEU 106           HN       LEU 106   8.300   1.451  -9.285
  826    HA   LEU 106           HA       LEU 106   9.675   3.690 -10.391
  827   1HB   LEU 106          HB2       LEU 106   8.830   2.956  -7.592
  828   2HB   LEU 106          HB1       LEU 106   9.766   4.415  -7.881
  829    HG   LEU 106           HG       LEU 106   7.175   4.612  -7.839
  830   1HD1  LEU 106          HD11      LEU 106   7.207   6.408  -9.439
  831   2HD1  LEU 106          HD12      LEU 106   8.585   5.711 -10.285
  832   3HD1  LEU 106          HD13      LEU 106   8.786   6.364  -8.662
  833   1HD2  LEU 106          HD21      LEU 106   6.898   2.630  -9.442
  834   2HD2  LEU 106          HD22      LEU 106   7.432   3.713 -10.723
  835   3HD2  LEU 106          HD23      LEU 106   5.963   4.071  -9.821
  836    H    PHE 107           HN       PHE 107  10.842   0.958  -8.535
  837    HA   PHE 107           HA       PHE 107  13.338   2.047  -7.705
  838   1HB   PHE 107          HB2       PHE 107  12.462  -0.157  -6.933
  839   2HB   PHE 107          HB1       PHE 107  12.779  -0.816  -8.542
  840    HD1  PHE 107           HD1      PHE 107  14.456   1.006  -5.743
  841    HD2  PHE 107           HD2      PHE 107  14.909  -1.700  -9.046
  842    HE1  PHE 107           HE1      PHE 107  16.823   0.650  -5.122
  843    HE2  PHE 107           HE2      PHE 107  17.283  -2.063  -8.422
  844    HZ   PHE 107           HZ       PHE 107  18.241  -0.884  -6.458
  845    H    ARG 108           HN       ARG 108  12.368   0.527 -10.766
  846    HA   ARG 108           HA       ARG 108  14.960   0.423 -11.956
  847   1HB   ARG 108          HB2       ARG 108  12.192   0.659 -13.158
  848   2HB   ARG 108          HB1       ARG 108  13.647   0.491 -14.142
  849   1HG   ARG 108          HG2       ARG 108  14.201  -1.599 -12.976
  850   2HG   ARG 108          HG1       ARG 108  12.755  -1.446 -11.984
  851   1HD   ARG 108          HD2       ARG 108  11.391  -1.460 -14.088
  852   2HD   ARG 108          HD1       ARG 108  12.857  -1.785 -15.005
  853    HE   ARG 108           HE       ARG 108  11.254  -3.696 -13.542
  854   1HH1  ARG 108          HH21      ARG 108  14.525  -2.854 -14.195
  855   2HH1  ARG 108          HH22      ARG 108  15.155  -4.384 -13.686
  856   1HH2  ARG 108          HH11      ARG 108  12.047  -5.697 -12.902
  857   2HH2  ARG 108          HH12      ARG 108  13.752  -5.997 -12.968
  858    H    GLU 109           HN       GLU 109  12.531   3.029 -11.877
  859    HA   GLU 109           HA       GLU 109  14.178   4.758 -13.571
  860   1HB   GLU 109          HB2       GLU 109  11.662   5.229 -11.951
  861   2HB   GLU 109          HB1       GLU 109  12.441   6.481 -12.919
  862   1HG   GLU 109          HG2       GLU 109  12.184   5.129 -14.938
  863   2HG   GLU 109          HG1       GLU 109  11.480   3.815 -13.996
  864    H    GLY 110           HN       GLY 110  14.176   3.903 -10.269
  865   1HA   GLY 110          HA2       GLY 110  15.435   4.718  -8.469
  866   2HA   GLY 110          HA1       GLY 110  16.359   5.644  -9.656
  867    H    ARG 111           HN       ARG 111  13.050   6.281  -9.897
  868    HA   ARG 111           HA       ARG 111  13.447   8.937  -8.613
  869   1HB   ARG 111          HB2       ARG 111  11.268   7.824 -10.404
  870   2HB   ARG 111          HB1       ARG 111  11.265   9.457  -9.740
  871   1HG   ARG 111          HG2       ARG 111  13.412   9.925 -10.853
  872   2HG   ARG 111          HG1       ARG 111  13.437   8.291 -11.511
  873   1HD   ARG 111          HD2       ARG 111  11.194   8.815 -12.573
  874   2HD   ARG 111          HD1       ARG 111  11.445  10.496 -12.119
  875    HE   ARG 111           HE       ARG 111  12.566   9.131 -14.394
  876   1HH1  ARG 111          HH21      ARG 111  13.499  11.333 -11.887
  877   2HH1  ARG 111          HH22      ARG 111  14.881  11.911 -12.756
  878   1HH2  ARG 111          HH11      ARG 111  14.340   9.892 -15.516
  879   2HH2  ARG 111          HH12      ARG 111  15.353  11.104 -14.802
  880    H    PHE 112           HN       PHE 112  13.162   8.618  -6.425
  881    HA   PHE 112           HA       PHE 112  10.822   7.064  -5.460
  882   1HB   PHE 112          HB2       PHE 112  13.065   8.404  -3.915
  883   2HB   PHE 112          HB1       PHE 112  11.909   7.223  -3.286
  884    HD1  PHE 112           HD1      PHE 112  11.869   4.896  -4.229
  885    HD2  PHE 112           HD2      PHE 112  14.955   7.716  -5.202
  886    HE1  PHE 112           HE1      PHE 112  13.267   3.056  -5.125
  887    HE2  PHE 112           HE2      PHE 112  16.358   5.874  -6.095
  888    HZ   PHE 112           HZ       PHE 112  15.516   3.543  -6.053
  889    H    ASN 113           HN       ASN 113   8.995   8.080  -4.754
  890    HA   ASN 113           HA       ASN 113   7.527   9.811  -4.174
  891   1HB   ASN 113          HB2       ASN 113   9.942  11.347  -3.198
  892   2HB   ASN 113          HB1       ASN 113   8.304  11.353  -2.548
  893   1HD2  ASN 113          HD21      ASN 113   8.523   8.219  -3.116
  894   2HD2  ASN 113          HD22      ASN 113   9.285   7.659  -1.704
  Start of MODEL   14
    1   1H    MET   1           HT1      MET   1  22.279   4.446  11.817
    2   2H    MET   1           HT2      MET   1  23.491   3.955  12.902
    3   3H    MET   1           HT3      MET   1  23.887   4.315  11.290
    4    HA   MET   1           HA       MET   1  23.725   6.045  13.527
    5   1HB   MET   1          HB2       MET   1  25.562   5.879  11.843
    6   2HB   MET   1          HB1       MET   1  24.483   6.570  10.634
    7   1HG   MET   1          HG2       MET   1  24.188   8.573  12.093
    8   2HG   MET   1          HG1       MET   1  25.353   7.888  13.225
    9   1HE   MET   1          HE1       MET   1  27.716   6.632  11.470
   10   2HE   MET   1          HE2       MET   1  27.671   7.577  12.956
   11   3HE   MET   1          HE3       MET   1  28.710   8.086  11.629
   12    H    GLY   2           HN       GLY   2  23.031   7.567  10.487
   13   1HA   GLY   2          HA2       GLY   2  20.651   8.807  11.658
   14   2HA   GLY   2          HA1       GLY   2  21.315   9.147  10.059
   15    HA   PRO   3           HA       PRO   3  17.303   6.430  10.039
   16   1HB   PRO   3          HB2       PRO   3  16.508   8.383   7.980
   17   2HB   PRO   3          HB1       PRO   3  15.644   7.892   9.441
   18   1HG   PRO   3          HG2       PRO   3  17.043  10.343   9.019
   19   2HG   PRO   3          HG1       PRO   3  16.313   9.783  10.528
   20   1HD   PRO   3          HD2       PRO   3  19.124  10.057   9.945
   21   2HD   PRO   3          HD1       PRO   3  18.388   9.416  11.434
   22    H    VAL   4           HN       VAL   4  16.521   5.302   7.984
   23    HA   VAL   4           HA       VAL   4  18.823   4.612   6.339
   24    HB   VAL   4           HB       VAL   4  17.270   2.963   5.318
   25   1HG1  VAL   4          HG11      VAL   4  18.470   2.433   7.428
   26   2HG1  VAL   4          HG12      VAL   4  16.909   1.620   7.322
   27   3HG1  VAL   4          HG13      VAL   4  17.090   3.049   8.339
   28   1HG2  VAL   4          HG21      VAL   4  15.204   4.191   5.335
   29   2HG2  VAL   4          HG22      VAL   4  15.267   4.382   7.086
   30   3HG2  VAL   4          HG23      VAL   4  14.980   2.791   6.382
   31    HA   PRO   5           HA       PRO   5  17.780   7.408   3.007
   32   1HB   PRO   5          HB2       PRO   5  18.663   5.826   0.831
   33   2HB   PRO   5          HB1       PRO   5  19.649   6.956   1.768
   34   1HG   PRO   5          HG2       PRO   5  19.633   4.010   1.834
   35   2HG   PRO   5          HG1       PRO   5  20.874   5.134   2.397
   36   1HD   PRO   5          HD2       PRO   5  19.106   3.651   4.046
   37   2HD   PRO   5          HD1       PRO   5  20.121   5.024   4.556
   38    HA   PRO   6           HA       PRO   6  13.825   6.281   1.366
   39   1HB   PRO   6          HB2       PRO   6  14.165   7.162  -1.325
   40   2HB   PRO   6          HB1       PRO   6  13.472   8.074   0.020
   41   1HG   PRO   6          HG2       PRO   6  16.117   8.350  -1.233
   42   2HG   PRO   6          HG1       PRO   6  15.266   9.472  -0.164
   43   1HD   PRO   6          HD2       PRO   6  17.505   7.910   0.548
   44   2HD   PRO   6          HD1       PRO   6  16.402   8.720   1.690
   45    H    SER   7           HN       SER   7  16.465   5.437  -0.890
   46    HA   SER   7           HA       SER   7  15.022   3.412  -2.299
   47   1HB   SER   7          HB2       SER   7  17.174   2.664  -3.101
   48   2HB   SER   7          HB1       SER   7  17.220   4.422  -3.002
   49    HG   SER   7           HG       SER   7  19.063   3.578  -2.039
   50    H    THR   8           HN       THR   8  16.915   3.328   0.682
   51    HA   THR   8           HA       THR   8  16.824   0.452   0.989
   52    HB   THR   8           HB       THR   8  17.228   2.661   3.023
   53    HG1  THR   8           HG1      THR   8  19.028   0.999   1.599
   54   1HG2  THR   8          HG21      THR   8  16.538   0.623   4.161
   55   2HG2  THR   8          HG22      THR   8  18.270   0.847   4.395
   56   3HG2  THR   8          HG23      THR   8  17.685  -0.329   3.218
   57    H    ALA   9           HN       ALA   9  14.785   3.123   2.171
   58    HA   ALA   9           HA       ALA   9  13.088   1.547   3.837
   59   1HB   ALA   9          HB1       ALA   9  11.394   3.424   3.306
   60   2HB   ALA   9          HB2       ALA   9  12.675   4.134   2.323
   61   3HB   ALA   9          HB3       ALA   9  12.914   3.911   4.056
   62    H    LEU  10           HN       LEU  10  12.921   2.371   0.375
   63    HA   LEU  10           HA       LEU  10  10.440   1.054  -0.172
   64   1HB   LEU  10          HB2       LEU  10  11.560   2.638  -1.746
   65   2HB   LEU  10          HB1       LEU  10  12.817   1.434  -2.025
   66    HG   LEU  10           HG       LEU  10  11.122  -0.144  -2.893
   67   1HD1  LEU  10          HD11      LEU  10   9.067   0.312  -1.911
   68   2HD1  LEU  10          HD12      LEU  10   8.837   1.107  -3.466
   69   3HD1  LEU  10          HD13      LEU  10   9.263   2.058  -2.042
   70   1HD2  LEU  10          HD21      LEU  10  12.176   1.159  -4.570
   71   2HD2  LEU  10          HD22      LEU  10  11.290   2.615  -4.121
   72   3HD2  LEU  10          HD23      LEU  10  10.458   1.288  -4.930
   73    H    ARG  11           HN       ARG  11  13.823  -0.109  -0.425
   74    HA   ARG  11           HA       ARG  11  13.195  -2.731  -1.344
   75   1HB   ARG  11          HB2       ARG  11  15.496  -1.701   0.333
   76   2HB   ARG  11          HB1       ARG  11  15.411  -3.355  -0.274
   77   1HG   ARG  11          HG2       ARG  11  15.270  -2.512  -2.580
   78   2HG   ARG  11          HG1       ARG  11  15.338  -0.852  -1.986
   79   1HD   ARG  11          HD2       ARG  11  17.576  -1.463  -2.663
   80   2HD   ARG  11          HD1       ARG  11  17.546  -1.424  -0.900
   81    HE   ARG  11           HE       ARG  11  16.966  -4.062  -1.502
   82   1HH1  ARG  11          HH21      ARG  11  19.440  -1.825  -2.419
   83   2HH1  ARG  11          HH22      ARG  11  20.669  -3.041  -2.531
   84   1HH2  ARG  11          HH11      ARG  11  18.573  -5.643  -1.634
   85   2HH2  ARG  11          HH12      ARG  11  20.183  -5.190  -2.083
   86    H    GLU  12           HN       GLU  12  13.552  -1.448   1.949
   87    HA   GLU  12           HA       GLU  12  13.131  -3.917   3.313
   88   1HB   GLU  12          HB2       GLU  12  12.627  -1.034   4.108
   89   2HB   GLU  12          HB1       GLU  12  12.405  -2.388   5.222
   90   1HG   GLU  12          HG2       GLU  12  14.750  -3.064   4.884
   91   2HG   GLU  12          HG1       GLU  12  14.979  -1.730   3.755
   92    H    LEU  13           HN       LEU  13  10.894  -1.439   2.131
   93    HA   LEU  13           HA       LEU  13   8.546  -2.655   3.252
   94   1HB   LEU  13          HB2       LEU  13   8.630  -0.284   2.579
   95   2HB   LEU  13          HB1       LEU  13   8.856  -0.764   0.901
   96    HG   LEU  13           HG       LEU  13   6.649  -1.864   0.911
   97   1HD1  LEU  13          HD11      LEU  13   6.290  -2.565   3.145
   98   2HD1  LEU  13          HD12      LEU  13   5.165  -1.226   2.955
   99   3HD1  LEU  13          HD13      LEU  13   6.692  -0.974   3.793
  100   1HD2  LEU  13          HD21      LEU  13   6.855   0.527   0.282
  101   2HD2  LEU  13          HD22      LEU  13   6.578   0.980   1.964
  102   3HD2  LEU  13          HD23      LEU  13   5.299   0.192   1.040
  103    H    ILE  14           HN       ILE  14   9.965  -2.760  -0.049
  104    HA   ILE  14           HA       ILE  14   7.955  -4.442  -1.164
  105    HB   ILE  14           HB       ILE  14  10.888  -4.139  -1.883
  106   1HG1  ILE  14          HG12      ILE  14   8.353  -3.146  -3.227
  107   2HG1  ILE  14          HG11      ILE  14   9.354  -2.169  -2.154
  108   1HG2  ILE  14          HG21      ILE  14  10.167  -5.209  -4.072
  109   2HG2  ILE  14          HG22      ILE  14   8.669  -5.662  -3.272
  110   3HG2  ILE  14          HG23      ILE  14  10.199  -6.318  -2.704
  111   1HD1  ILE  14          HD11      ILE  14  11.297  -2.573  -3.683
  112   2HD1  ILE  14          HD12      ILE  14   9.979  -1.691  -4.457
  113   3HD1  ILE  14          HD13      ILE  14  10.205  -3.408  -4.785
  114    H    GLU  15           HN       GLU  15  11.062  -5.310   0.370
  115    HA   GLU  15           HA       GLU  15  10.789  -8.102  -0.008
  116   1HB   GLU  15          HB2       GLU  15  12.166  -6.531   2.177
  117   2HB   GLU  15          HB1       GLU  15  12.306  -8.280   2.001
  118   1HG   GLU  15          HG2       GLU  15  13.187  -7.976  -0.291
  119   2HG   GLU  15          HG1       GLU  15  13.068  -6.225  -0.094
  120    H    GLU  16           HN       GLU  16   9.617  -6.044   2.676
  121    HA   GLU  16           HA       GLU  16   8.636  -8.273   4.222
  122   1HB   GLU  16          HB2       GLU  16   9.124  -6.098   5.246
  123   2HB   GLU  16          HB1       GLU  16   7.820  -5.356   4.316
  124   1HG   GLU  16          HG2       GLU  16   6.167  -6.768   5.420
  125   2HG   GLU  16          HG1       GLU  16   7.442  -7.651   6.261
  126    H    LEU  17           HN       LEU  17   7.064  -6.105   1.878
  127    HA   LEU  17           HA       LEU  17   4.403  -7.044   2.264
  128   1HB   LEU  17          HB2       LEU  17   5.809  -5.994  -0.200
  129   2HB   LEU  17          HB1       LEU  17   4.081  -6.325  -0.143
  130    HG   LEU  17           HG       LEU  17   5.502  -4.457   1.774
  131   1HD1  LEU  17          HD11      LEU  17   5.676  -3.607  -0.521
  132   2HD1  LEU  17          HD12      LEU  17   4.521  -2.639   0.397
  133   3HD1  LEU  17          HD13      LEU  17   3.945  -3.842  -0.755
  134   1HD2  LEU  17          HD21      LEU  17   2.636  -5.264   1.304
  135   2HD2  LEU  17          HD22      LEU  17   2.977  -3.623   1.847
  136   3HD2  LEU  17          HD23      LEU  17   3.485  -4.995   2.825
  137    H    VAL  18           HN       VAL  18   7.044  -8.225   0.222
  138    HA   VAL  18           HA       VAL  18   5.524 -10.260  -1.109
  139    HB   VAL  18           HB       VAL  18   8.493 -10.033  -0.527
  140   1HG1  VAL  18          HG11      VAL  18   8.104 -12.339  -0.990
  141   2HG1  VAL  18          HG12      VAL  18   8.629 -11.640  -2.522
  142   3HG1  VAL  18          HG13      VAL  18   6.919 -11.965  -2.240
  143   1HG2  VAL  18          HG21      VAL  18   7.297  -8.276  -1.967
  144   2HG2  VAL  18          HG22      VAL  18   7.027  -9.572  -3.132
  145   3HG2  VAL  18          HG23      VAL  18   8.672  -9.096  -2.710
  146    H    ASN  19           HN       ASN  19   7.570 -10.325   1.810
  147    HA   ASN  19           HA       ASN  19   7.413 -13.109   2.319
  148   1HB   ASN  19          HB2       ASN  19   8.952 -11.582   3.514
  149   2HB   ASN  19          HB1       ASN  19   7.573 -10.865   4.349
  150   1HD2  ASN  19          HD21      ASN  19   9.331 -13.975   3.952
  151   2HD2  ASN  19          HD22      ASN  19   8.819 -14.628   5.432
  152    H    ILE  20           HN       ILE  20   5.180 -10.503   3.361
  153    HA   ILE  20           HA       ILE  20   3.575 -12.358   4.926
  154    HB   ILE  20           HB       ILE  20   2.035 -10.466   5.214
  155   1HG1  ILE  20          HG12      ILE  20   3.863  -9.078   3.230
  156   2HG1  ILE  20          HG11      ILE  20   2.198  -9.556   2.913
  157   1HG2  ILE  20          HG21      ILE  20   4.168 -10.656   6.525
  158   2HG2  ILE  20          HG22      ILE  20   3.602  -8.995   6.349
  159   3HG2  ILE  20          HG23      ILE  20   4.933  -9.584   5.352
  160   1HD1  ILE  20          HD11      ILE  20   1.468  -8.099   4.815
  161   2HD1  ILE  20          HD12      ILE  20   2.225  -7.199   3.501
  162   3HD1  ILE  20          HD13      ILE  20   3.135  -7.540   4.972
  163    H    THR  21           HN       THR  21   3.610 -11.546   1.549
  164    HA   THR  21           HA       THR  21   0.798 -12.513   1.224
  165    HB   THR  21           HB       THR  21   1.121 -11.833  -1.159
  166    HG1  THR  21           HG1      THR  21   3.082 -11.537  -1.774
  167   1HG2  THR  21          HG21      THR  21   1.944  -9.507   0.552
  168   2HG2  THR  21          HG22      THR  21   0.371 -10.259   0.798
  169   3HG2  THR  21          HG23      THR  21   0.778  -9.561  -0.768
  170    H    GLN  22           HN       GLN  22   4.125 -13.494   0.573
  171    HA   GLN  22           HA       GLN  22   3.430 -15.583  -1.302
  172   1HB   GLN  22          HB2       GLN  22   5.879 -15.103   0.400
  173   2HB   GLN  22          HB1       GLN  22   5.744 -16.458  -0.719
  174   1HG   GLN  22          HG2       GLN  22   5.306 -13.587  -1.571
  175   2HG   GLN  22          HG1       GLN  22   6.880 -14.380  -1.657
  176   1HE2  GLN  22          HE21      GLN  22   4.188 -13.725  -3.522
  177   2HE2  GLN  22          HE22      GLN  22   4.298 -15.010  -4.625
  178    H    ASN  23           HN       ASN  23   3.924 -15.550   2.214
  179    HA   ASN  23           HA       ASN  23   3.270 -18.455   2.337
  180   1HB   ASN  23          HB2       ASN  23   4.283 -16.487   4.405
  181   2HB   ASN  23          HB1       ASN  23   3.889 -18.170   4.761
  182   1HD2  ASN  23          HD21      ASN  23   4.981 -19.728   2.953
  183   2HD2  ASN  23          HD22      ASN  23   6.622 -19.406   2.667
  184    H    GLN  24           HN       GLN  24   1.308 -16.096   1.857
  185    HA   GLN  24           HA       GLN  24  -0.362 -16.166   4.268
  186   1HB   GLN  24          HB2       GLN  24  -1.760 -14.594   3.164
  187   2HB   GLN  24          HB1       GLN  24  -0.127 -14.182   2.647
  188   1HG   GLN  24          HG2       GLN  24  -0.592 -15.733   0.618
  189   2HG   GLN  24          HG1       GLN  24  -2.287 -15.607   1.090
  190   1HE2  GLN  24          HE21      GLN  24  -1.670 -12.748   2.123
  191   2HE2  GLN  24          HE22      GLN  24  -1.674 -11.808   0.709
  192    H    LYS  25           HN       LYS  25  -1.795 -17.776   4.692
  193    HA   LYS  25           HA       LYS  25  -2.488 -19.710   2.569
  194   1HB   LYS  25          HB2       LYS  25  -1.987 -20.468   4.902
  195   2HB   LYS  25          HB1       LYS  25  -3.410 -19.592   5.464
  196   1HG   LYS  25          HG2       LYS  25  -4.827 -20.971   3.952
  197   2HG   LYS  25          HG1       LYS  25  -3.392 -21.872   3.461
  198   1HD   LYS  25          HD2       LYS  25  -3.022 -22.538   5.825
  199   2HD   LYS  25          HD1       LYS  25  -4.500 -21.689   6.279
  200   1HE   LYS  25          HE2       LYS  25  -5.062 -24.020   6.005
  201   2HE   LYS  25          HE1       LYS  25  -5.739 -23.147   4.628
  202   1HZ   LYS  25          HZ1       LYS  25  -4.158 -25.307   4.433
  203   2HZ   LYS  25          HZ2       LYS  25  -3.025 -24.054   4.262
  204   3HZ   LYS  25          HZ3       LYS  25  -4.354 -24.148   3.208
  205    H    ALA  26           HN       ALA  26  -4.606 -18.268   5.038
  206    HA   ALA  26           HA       ALA  26  -6.781 -18.069   3.085
  207   1HB   ALA  26          HB1       ALA  26  -7.761 -18.575   5.114
  208   2HB   ALA  26          HB2       ALA  26  -7.743 -16.825   5.332
  209   3HB   ALA  26          HB3       ALA  26  -6.463 -17.816   6.034
  210    HA   PRO  27           HA       PRO  27  -6.168 -13.937   1.641
  211   1HB   PRO  27          HB2       PRO  27  -8.696 -13.044   2.922
  212   2HB   PRO  27          HB1       PRO  27  -8.226 -12.998   1.219
  213   1HG   PRO  27          HG2       PRO  27 -10.023 -14.824   2.340
  214   2HG   PRO  27          HG1       PRO  27  -9.202 -15.024   0.787
  215   1HD   PRO  27          HD2       PRO  27  -8.786 -16.543   3.250
  216   2HD   PRO  27          HD1       PRO  27  -8.063 -16.816   1.643
  217    H    LEU  28           HN       LEU  28  -5.724 -11.702   2.460
  218    HA   LEU  28           HA       LEU  28  -4.416 -11.734   5.005
  219   1HB   LEU  28          HB2       LEU  28  -5.246  -9.435   3.208
  220   2HB   LEU  28          HB1       LEU  28  -4.263  -9.226   4.655
  221    HG   LEU  28           HG       LEU  28  -3.529 -11.089   2.377
  222   1HD1  LEU  28          HD11      LEU  28  -1.885  -9.345   1.728
  223   2HD1  LEU  28          HD12      LEU  28  -2.577  -8.262   2.936
  224   3HD1  LEU  28          HD13      LEU  28  -3.547  -8.783   1.557
  225   1HD2  LEU  28          HD21      LEU  28  -2.209 -10.245   4.951
  226   2HD2  LEU  28          HD22      LEU  28  -1.191 -10.603   3.558
  227   3HD2  LEU  28          HD23      LEU  28  -2.271 -11.836   4.193
  228    H    CYS  29           HN       CYS  29  -7.696 -11.037   4.083
  229    HA   CYS  29           HA       CYS  29  -8.351 -10.629   6.950
  230   1HB   CYS  29          HB2       CYS  29  -9.202  -8.704   4.764
  231   2HB   CYS  29          HB1       CYS  29  -9.777  -8.673   6.431
  232    H    ASN  30           HN       ASN  30 -10.943 -10.302   6.962
  233    HA   ASN  30           HA       ASN  30 -11.997 -12.802   6.037
  234   1HB   ASN  30          HB2       ASN  30 -12.831 -11.488   8.018
  235   2HB   ASN  30          HB1       ASN  30 -13.564 -10.353   6.882
  236   1HD2  ASN  30          HD21      ASN  30 -15.759 -10.932   7.470
  237   2HD2  ASN  30          HD22      ASN  30 -16.426 -12.436   7.058
  238    H    GLY  31           HN       GLY  31 -10.951 -11.682   3.745
  239   1HA   GLY  31          HA2       GLY  31 -11.589 -11.361   1.503
  240   2HA   GLY  31          HA1       GLY  31 -13.252 -11.678   2.002
  241    H    SER  32           HN       SER  32 -11.431  -9.173   3.610
  242    HA   SER  32           HA       SER  32 -13.405  -7.185   3.074
  243   1HB   SER  32          HB2       SER  32 -10.495  -6.768   3.801
  244   2HB   SER  32          HB1       SER  32 -11.785  -5.581   3.965
  245    HG   SER  32           HG       SER  32 -12.276  -8.045   5.111
  246    H    MET  33           HN       MET  33 -13.606  -5.712   1.441
  247    HA   MET  33           HA       MET  33 -11.619  -5.858  -0.804
  248   1HB   MET  33          HB2       MET  33 -14.545  -5.051  -0.832
  249   2HB   MET  33          HB1       MET  33 -13.478  -5.122  -2.236
  250   1HG   MET  33          HG2       MET  33 -13.129  -7.535  -1.858
  251   2HG   MET  33          HG1       MET  33 -14.193  -7.470  -0.454
  252   1HE   MET  33          HE1       MET  33 -15.169  -7.131  -4.877
  253   2HE   MET  33          HE2       MET  33 -13.633  -6.904  -4.049
  254   3HE   MET  33          HE3       MET  33 -14.804  -5.588  -4.091
  255    H    VAL  34           HN       VAL  34 -11.002  -3.851  -1.779
  256    HA   VAL  34           HA       VAL  34 -11.598  -1.394  -0.152
  257    HB   VAL  34           HB       VAL  34  -9.217  -0.720  -0.778
  258   1HG1  VAL  34          HG11      VAL  34  -9.628  -1.363   1.488
  259   2HG1  VAL  34          HG12      VAL  34  -8.210  -2.280   0.981
  260   3HG1  VAL  34          HG13      VAL  34  -9.788  -3.065   1.050
  261   1HG2  VAL  34          HG21      VAL  34  -9.104  -2.550  -2.565
  262   2HG2  VAL  34          HG22      VAL  34  -8.884  -3.693  -1.240
  263   3HG2  VAL  34          HG23      VAL  34  -7.698  -2.415  -1.511
  264    H    TRP  35           HN       TRP  35 -11.263   0.630  -1.402
  265    HA   TRP  35           HA       TRP  35 -12.514   0.488  -4.013
  266   1HB   TRP  35          HB2       TRP  35 -11.197   2.781  -2.534
  267   2HB   TRP  35          HB1       TRP  35 -12.082   2.958  -4.049
  268    HD1  TRP  35           HD1      TRP  35 -12.546   2.300  -0.350
  269    HE1  TRP  35           HE1      TRP  35 -15.048   2.458   0.236
  270    HE3  TRP  35           HE3      TRP  35 -14.523   2.651  -5.048
  271    HZ2  TRP  35           HZ2      TRP  35 -17.561   2.708  -1.113
  272    HZ3  TRP  35           HZ3      TRP  35 -16.972   2.852  -5.361
  273    HH2  TRP  35           HH2      TRP  35 -18.493   2.882  -3.404
  274    H    SER  36           HN       SER  36 -11.565   0.608  -6.020
  275    HA   SER  36           HA       SER  36  -8.734   0.053  -6.243
  276   1HB   SER  36          HB2       SER  36  -9.137  -0.078  -8.593
  277   2HB   SER  36          HB1       SER  36 -10.596  -0.694  -7.826
  278    HG   SER  36           HG       SER  36 -10.138   1.737  -9.144
  279    H    ILE  37           HN       ILE  37  -7.112   1.444  -7.123
  280    HA   ILE  37           HA       ILE  37  -7.801   4.361  -7.274
  281    HB   ILE  37           HB       ILE  37  -5.614   4.813  -6.127
  282   1HG1  ILE  37          HG12      ILE  37  -5.700   1.910  -5.274
  283   2HG1  ILE  37          HG11      ILE  37  -4.746   2.434  -6.658
  284   1HG2  ILE  37          HG21      ILE  37  -7.850   4.757  -4.941
  285   2HG2  ILE  37          HG22      ILE  37  -6.457   4.452  -3.903
  286   3HG2  ILE  37          HG23      ILE  37  -7.467   3.110  -4.442
  287   1HD1  ILE  37          HD11      ILE  37  -3.543   2.348  -4.387
  288   2HD1  ILE  37          HD12      ILE  37  -4.486   3.778  -3.968
  289   3HD1  ILE  37          HD13      ILE  37  -3.365   3.828  -5.329
  290    H    ASN  38           HN       ASN  38  -6.148   5.603  -8.512
  291    HA   ASN  38           HA       ASN  38  -5.135   3.982 -10.771
  292   1HB   ASN  38          HB2       ASN  38  -5.152   6.976 -10.248
  293   2HB   ASN  38          HB1       ASN  38  -4.493   6.231 -11.704
  294   1HD2  ASN  38          HD21      ASN  38  -6.934   8.028 -11.378
  295   2HD2  ASN  38          HD22      ASN  38  -8.216   7.139 -12.048
  296    H    LEU  39           HN       LEU  39  -3.031   3.306 -10.847
  297    HA   LEU  39           HA       LEU  39  -1.253   4.031  -8.641
  298   1HB   LEU  39          HB2       LEU  39  -0.918   2.202 -11.033
  299   2HB   LEU  39          HB1       LEU  39   0.339   2.453  -9.829
  300    HG   LEU  39           HG       LEU  39  -1.099   0.402  -9.451
  301   1HD1  LEU  39          HD11      LEU  39  -1.469   2.295  -7.137
  302   2HD1  LEU  39          HD12      LEU  39   0.143   1.780  -7.626
  303   3HD1  LEU  39          HD13      LEU  39  -1.045   0.584  -7.123
  304   1HD2  LEU  39          HD21      LEU  39  -3.242   1.626 -10.152
  305   2HD2  LEU  39          HD22      LEU  39  -3.235   2.332  -8.532
  306   3HD2  LEU  39          HD23      LEU  39  -3.351   0.586  -8.734
  307    H    THR  40           HN       THR  40   0.083   5.733  -8.698
  308    HA   THR  40           HA       THR  40   1.399   6.560 -11.219
  309    HB   THR  40           HB       THR  40   0.728   8.913 -10.884
  310    HG1  THR  40           HG1      THR  40   0.222   9.226  -8.843
  311   1HG2  THR  40          HG21      THR  40  -1.531   8.693 -11.665
  312   2HG2  THR  40          HG22      THR  40  -1.721   7.140 -10.852
  313   3HG2  THR  40          HG23      THR  40  -0.653   7.280 -12.248
  314    H    ALA  41           HN       ALA  41   1.632   9.101  -9.161
  315    HA   ALA  41           HA       ALA  41   4.155   8.045  -7.934
  316   1HB   ALA  41          HB1       ALA  41   4.876  10.341  -7.804
  317   2HB   ALA  41          HB2       ALA  41   3.266  10.927  -8.222
  318   3HB   ALA  41          HB3       ALA  41   4.238  10.087  -9.430
  319    H    GLY  42           HN       GLY  42   1.212   9.909  -7.196
  320   1HA   GLY  42          HA2       GLY  42   1.818  10.058  -4.341
  321   2HA   GLY  42          HA1       GLY  42   0.301  10.534  -5.108
  322    H    MET  43           HN       MET  43   1.757   7.372  -5.576
  323    HA   MET  43           HA       MET  43  -0.664   5.996  -4.989
  324   1HB   MET  43          HB2       MET  43   2.171   4.933  -4.932
  325   2HB   MET  43          HB1       MET  43   0.709   3.952  -5.011
  326   1HG   MET  43          HG2       MET  43   0.092   5.067  -7.113
  327   2HG   MET  43          HG1       MET  43   1.578   6.005  -7.056
  328   1HE   MET  43          HE1       MET  43   3.738   3.499  -5.951
  329   2HE   MET  43          HE2       MET  43   3.753   5.087  -6.715
  330   3HE   MET  43          HE3       MET  43   4.400   3.696  -7.579
  331    H    TYR  44           HN       TYR  44   2.183   6.633  -2.948
  332    HA   TYR  44           HA       TYR  44   1.362   4.994  -0.781
  333   1HB   TYR  44          HB2       TYR  44   2.946   7.580  -0.678
  334   2HB   TYR  44          HB1       TYR  44   2.888   6.353   0.587
  335    HD1  TYR  44           HD1      TYR  44   3.994   4.179   0.297
  336    HD2  TYR  44           HD2      TYR  44   4.124   7.162  -2.792
  337    HE1  TYR  44           HE1      TYR  44   5.791   2.911  -0.851
  338    HE2  TYR  44           HE2      TYR  44   5.924   5.897  -3.937
  339    HH   TYR  44           HH       TYR  44   7.819   3.897  -2.758
  340    H    CYS  45           HN       CYS  45   0.620   8.408  -1.519
  341    HA   CYS  45           HA       CYS  45  -0.948   8.847   0.868
  342   1HB   CYS  45          HB2       CYS  45  -0.819  10.232  -1.816
  343   2HB   CYS  45          HB1       CYS  45  -1.957  10.733  -0.565
  344    H    ALA  46           HN       ALA  46  -1.935   8.198  -2.528
  345    HA   ALA  46           HA       ALA  46  -4.725   7.908  -1.971
  346   1HB   ALA  46          HB1       ALA  46  -4.921   7.048  -4.183
  347   2HB   ALA  46          HB2       ALA  46  -3.262   6.451  -4.179
  348   3HB   ALA  46          HB3       ALA  46  -3.575   8.186  -4.252
  349    H    ALA  47           HN       ALA  47  -2.107   5.510  -2.158
  350    HA   ALA  47           HA       ALA  47  -3.736   3.209  -1.764
  351   1HB   ALA  47          HB1       ALA  47  -1.646   2.102  -1.034
  352   2HB   ALA  47          HB2       ALA  47  -0.860   3.675  -0.924
  353   3HB   ALA  47          HB3       ALA  47  -1.385   3.060  -2.492
  354    H    LEU  48           HN       LEU  48  -2.124   5.363   0.556
  355    HA   LEU  48           HA       LEU  48  -2.658   3.836   2.875
  356   1HB   LEU  48          HB2       LEU  48  -1.109   5.693   2.946
  357   2HB   LEU  48          HB1       LEU  48  -2.381   6.834   2.516
  358    HG   LEU  48           HG       LEU  48  -3.535   6.408   4.628
  359   1HD1  LEU  48          HD11      LEU  48  -3.190   4.148   5.144
  360   2HD1  LEU  48          HD12      LEU  48  -2.149   4.945   6.322
  361   3HD1  LEU  48          HD13      LEU  48  -1.453   4.239   4.862
  362   1HD2  LEU  48          HD21      LEU  48  -0.578   6.772   5.180
  363   2HD2  LEU  48          HD22      LEU  48  -1.926   7.382   6.140
  364   3HD2  LEU  48          HD23      LEU  48  -1.615   8.045   4.536
  365    H    GLU  49           HN       GLU  49  -4.640   6.512   1.494
  366    HA   GLU  49           HA       GLU  49  -6.670   6.313   3.472
  367   1HB   GLU  49          HB2       GLU  49  -8.158   7.414   1.773
  368   2HB   GLU  49          HB1       GLU  49  -6.620   8.238   2.034
  369   1HG   GLU  49          HG2       GLU  49  -5.684   7.260   0.039
  370   2HG   GLU  49          HG1       GLU  49  -7.112   6.251  -0.197
  371    H    SER  50           HN       SER  50  -6.163   4.398   0.538
  372    HA   SER  50           HA       SER  50  -8.771   3.183   0.536
  373   1HB   SER  50          HB2       SER  50  -7.762   1.440  -0.862
  374   2HB   SER  50          HB1       SER  50  -7.198   3.023  -1.388
  375    HG   SER  50           HG       SER  50  -5.299   2.158  -1.107
  376    H    LEU  51           HN       LEU  51  -5.723   2.348   2.150
  377    HA   LEU  51           HA       LEU  51  -6.693  -0.127   3.278
  378   1HB   LEU  51          HB2       LEU  51  -4.410   1.701   4.056
  379   2HB   LEU  51          HB1       LEU  51  -4.694   0.127   4.795
  380    HG   LEU  51           HG       LEU  51  -4.350   0.542   1.810
  381   1HD1  LEU  51          HD11      LEU  51  -2.308  -0.369   3.858
  382   2HD1  LEU  51          HD12      LEU  51  -2.291   1.178   3.009
  383   3HD1  LEU  51          HD13      LEU  51  -2.066  -0.325   2.113
  384   1HD2  LEU  51          HD21      LEU  51  -3.708  -2.002   2.116
  385   2HD2  LEU  51          HD22      LEU  51  -5.404  -1.541   2.061
  386   3HD2  LEU  51          HD23      LEU  51  -4.631  -1.863   3.612
  387    H    ILE  52           HN       ILE  52  -6.780   3.223   4.332
  388    HA   ILE  52           HA       ILE  52  -7.408   2.829   7.061
  389    HB   ILE  52           HB       ILE  52  -8.310   4.951   5.092
  390   1HG1  ILE  52          HG12      ILE  52  -5.903   4.909   5.519
  391   2HG1  ILE  52          HG11      ILE  52  -6.615   6.331   6.257
  392   1HG2  ILE  52          HG21      ILE  52  -8.684   4.841   8.092
  393   2HG2  ILE  52          HG22      ILE  52  -9.943   4.967   6.863
  394   3HG2  ILE  52          HG23      ILE  52  -8.841   6.314   7.137
  395   1HD1  ILE  52          HD11      ILE  52  -5.392   3.936   7.535
  396   2HD1  ILE  52          HD12      ILE  52  -6.768   4.656   8.367
  397   3HD1  ILE  52          HD13      ILE  52  -5.336   5.625   8.032
  398    H    ASN  53           HN       ASN  53  -9.226   2.077   4.244
  399    HA   ASN  53           HA       ASN  53 -11.823   2.060   5.619
  400   1HB   ASN  53          HB2       ASN  53 -10.920   1.109   2.885
  401   2HB   ASN  53          HB1       ASN  53 -12.578   0.954   3.462
  402   1HD2  ASN  53          HD21      ASN  53 -13.238   3.286   4.611
  403   2HD2  ASN  53          HD22      ASN  53 -12.973   4.615   3.589
  404    H    VAL  54           HN       VAL  54  -9.146  -0.062   5.325
  405    HA   VAL  54           HA       VAL  54 -10.764  -2.498   5.795
  406    HB   VAL  54           HB       VAL  54  -7.751  -2.157   5.717
  407   1HG1  VAL  54          HG11      VAL  54  -9.582  -4.571   5.607
  408   2HG1  VAL  54          HG12      VAL  54  -8.402  -4.193   6.862
  409   3HG1  VAL  54          HG13      VAL  54  -7.859  -4.628   5.241
  410   1HG2  VAL  54          HG21      VAL  54  -8.592  -1.524   3.572
  411   2HG2  VAL  54          HG22      VAL  54  -9.798  -2.810   3.585
  412   3HG2  VAL  54          HG23      VAL  54  -8.088  -3.206   3.407
  413    H    SER  55           HN       SER  55 -11.246  -3.174   7.808
  414    HA   SER  55           HA       SER  55  -9.562  -2.242  10.114
  415   1HB   SER  55          HB2       SER  55 -12.582  -2.420   9.935
  416   2HB   SER  55          HB1       SER  55 -11.696  -2.171  11.435
  417    HG   SER  55           HG       SER  55 -10.964  -0.237  10.670
  418    H    GLY  56           HN       GLY  56  -9.317  -3.757  11.796
  419   1HA   GLY  56          HA2       GLY  56  -9.646  -5.837  12.918
  420   2HA   GLY  56          HA1       GLY  56 -10.698  -6.363  11.604
  421    H    CYS  57           HN       CYS  57  -7.542  -4.985  10.955
  422    HA   CYS  57           HA       CYS  57  -6.381  -7.696  10.514
  423   1HB   CYS  57          HB2       CYS  57  -6.383  -5.489   8.434
  424   2HB   CYS  57          HB1       CYS  57  -5.598  -7.060   8.276
  425    H    SER  58           HN       SER  58  -4.949  -7.304  12.246
  426    HA   SER  58           HA       SER  58  -3.434  -4.873  12.522
  427   1HB   SER  58          HB2       SER  58  -3.861  -6.448  14.400
  428   2HB   SER  58          HB1       SER  58  -2.811  -7.627  13.619
  429    HG   SER  58           HG       SER  58  -2.135  -5.044  14.588
  430    H    ALA  59           HN       ALA  59  -2.711  -8.012  11.029
  431    HA   ALA  59           HA       ALA  59   0.004  -7.789  10.524
  432   1HB   ALA  59          HB1       ALA  59  -0.316  -9.244   8.636
  433   2HB   ALA  59          HB2       ALA  59  -1.992  -8.726   8.453
  434   3HB   ALA  59          HB3       ALA  59  -1.514  -9.687   9.852
  435    H    ILE  60           HN       ILE  60  -2.534  -5.851   8.985
  436    HA   ILE  60           HA       ILE  60  -0.510  -4.759   7.057
  437    HB   ILE  60           HB       ILE  60  -2.448  -3.730   5.908
  438   1HG1  ILE  60          HG12      ILE  60  -4.158  -5.254   7.888
  439   2HG1  ILE  60          HG11      ILE  60  -3.861  -3.522   8.003
  440   1HG2  ILE  60          HG21      ILE  60  -1.754  -5.962   5.209
  441   2HG2  ILE  60          HG22      ILE  60  -3.512  -5.853   5.151
  442   3HG2  ILE  60          HG23      ILE  60  -2.727  -6.694   6.486
  443   1HD1  ILE  60          HD11      ILE  60  -5.205  -4.976   5.704
  444   2HD1  ILE  60          HD12      ILE  60  -4.774  -3.265   5.676
  445   3HD1  ILE  60          HD13      ILE  60  -5.965  -3.855   6.832
  446    H    GLU  61           HN       GLU  61  -1.895  -3.972  10.078
  447    HA   GLU  61           HA       GLU  61  -2.135  -1.139   9.819
  448   1HB   GLU  61          HB2       GLU  61  -1.408  -2.874  12.190
  449   2HB   GLU  61          HB1       GLU  61  -1.582  -1.123  12.312
  450   1HG   GLU  61          HG2       GLU  61  -3.887  -1.244  11.556
  451   2HG   GLU  61          HG1       GLU  61  -3.737  -2.972  11.249
  452    H    LYS  62           HN       LYS  62   0.699  -3.188  10.560
  453    HA   LYS  62           HA       LYS  62   2.528  -1.025  10.998
  454   1HB   LYS  62          HB2       LYS  62   2.986  -3.837   9.949
  455   2HB   LYS  62          HB1       LYS  62   4.287  -2.715  10.346
  456   1HG   LYS  62          HG2       LYS  62   3.476  -2.557  12.660
  457   2HG   LYS  62          HG1       LYS  62   2.144  -3.649  12.280
  458   1HD   LYS  62          HD2       LYS  62   3.785  -5.418  11.686
  459   2HD   LYS  62          HD1       LYS  62   5.100  -4.327  12.120
  460   1HE   LYS  62          HE2       LYS  62   4.369  -4.260  14.428
  461   2HE   LYS  62          HE1       LYS  62   2.904  -5.160  14.036
  462   1HZ   LYS  62          HZ1       LYS  62   4.054  -7.104  13.762
  463   2HZ   LYS  62          HZ2       LYS  62   4.978  -6.379  14.992
  464   3HZ   LYS  62          HZ3       LYS  62   5.515  -6.332  13.381
  465    H    THR  63           HN       THR  63   1.527  -2.756   8.066
  466    HA   THR  63           HA       THR  63   3.307  -1.501   6.248
  467    HB   THR  63           HB       THR  63   0.482  -2.474   5.800
  468    HG1  THR  63           HG1      THR  63   1.653  -4.164   6.479
  469   1HG2  THR  63          HG21      THR  63   1.144  -1.089   3.940
  470   2HG2  THR  63          HG22      THR  63   1.288  -2.774   3.438
  471   3HG2  THR  63          HG23      THR  63   2.730  -1.858   3.874
  472    H    GLN  64           HN       GLN  64   0.107  -0.496   7.448
  473    HA   GLN  64           HA       GLN  64  -0.283   1.759   5.763
  474   1HB   GLN  64          HB2       GLN  64  -1.144   1.213   8.611
  475   2HB   GLN  64          HB1       GLN  64  -1.686   2.624   7.698
  476   1HG   GLN  64          HG2       GLN  64  -2.596   1.138   5.949
  477   2HG   GLN  64          HG1       GLN  64  -2.063  -0.269   6.870
  478   1HE2  GLN  64          HE21      GLN  64  -2.847   1.626   9.347
  479   2HE2  GLN  64          HE22      GLN  64  -4.509   1.315   9.497
  480    H    ARG  65           HN       ARG  65   1.216   1.624   9.020
  481    HA   ARG  65           HA       ARG  65   1.899   4.403   9.114
  482   1HB   ARG  65          HB2       ARG  65   1.960   2.941  11.105
  483   2HB   ARG  65          HB1       ARG  65   3.292   2.028  10.400
  484   1HG   ARG  65          HG2       ARG  65   4.697   4.053  10.406
  485   2HG   ARG  65          HG1       ARG  65   3.363   4.983  11.089
  486   1HD   ARG  65          HD2       ARG  65   4.806   4.358  12.913
  487   2HD   ARG  65          HD1       ARG  65   3.355   3.359  13.031
  488    HE   ARG  65           HE       ARG  65   5.068   1.797  11.538
  489   1HH1  ARG  65          HH21      ARG  65   5.193   3.480  14.544
  490   2HH1  ARG  65          HH22      ARG  65   6.364   2.415  15.247
  491   1HH2  ARG  65          HH11      ARG  65   6.578   0.380  12.445
  492   2HH2  ARG  65          HH12      ARG  65   7.136   0.648  14.062
  493    H    MET  66           HN       MET  66   3.573   1.555   7.891
  494    HA   MET  66           HA       MET  66   6.033   2.831   7.202
  495   1HB   MET  66          HB2       MET  66   4.614   0.397   6.095
  496   2HB   MET  66          HB1       MET  66   6.254   0.850   5.637
  497   1HG   MET  66          HG2       MET  66   7.138   0.266   7.696
  498   2HG   MET  66          HG1       MET  66   5.677   0.712   8.577
  499   1HE   MET  66          HE1       MET  66   7.647  -2.544   7.255
  500   2HE   MET  66          HE2       MET  66   7.191  -1.407   5.998
  501   3HE   MET  66          HE3       MET  66   6.424  -2.991   6.056
  502    H    LEU  67           HN       LEU  67   2.975   2.384   5.412
  503    HA   LEU  67           HA       LEU  67   3.935   3.543   2.953
  504   1HB   LEU  67          HB2       LEU  67   1.136   3.300   4.093
  505   2HB   LEU  67          HB1       LEU  67   1.471   3.947   2.491
  506    HG   LEU  67           HG       LEU  67   2.436   1.210   3.371
  507   1HD1  LEU  67          HD11      LEU  67  -0.149   2.008   2.003
  508   2HD1  LEU  67          HD12      LEU  67   0.028   1.134   3.523
  509   3HD1  LEU  67          HD13      LEU  67   0.481   0.361   2.005
  510   1HD2  LEU  67          HD21      LEU  67   2.286   0.937   0.772
  511   2HD2  LEU  67          HD22      LEU  67   3.635   1.851   1.434
  512   3HD2  LEU  67          HD23      LEU  67   2.252   2.698   0.743
  513    H    SER  68           HN       SER  68   2.456   4.886   5.870
  514    HA   SER  68           HA       SER  68   2.082   7.557   4.952
  515   1HB   SER  68          HB2       SER  68   2.805   6.535   7.714
  516   2HB   SER  68          HB1       SER  68   2.256   8.172   7.366
  517    HG   SER  68           HG       SER  68   0.765   5.964   6.474
  518    H    GLY  69           HN       GLY  69   4.899   5.871   6.283
  519   1HA   GLY  69          HA2       GLY  69   6.666   7.999   6.688
  520   2HA   GLY  69          HA1       GLY  69   7.183   6.418   6.097
  521    H    PHE  70           HN       PHE  70   5.535   6.610   3.667
  522    HA   PHE  70           HA       PHE  70   7.358   8.333   2.067
  523   1HB   PHE  70          HB2       PHE  70   5.348   6.180   1.359
  524   2HB   PHE  70          HB1       PHE  70   6.104   7.196   0.134
  525    HD1  PHE  70           HD1      PHE  70   8.479   7.015  -0.371
  526    HD2  PHE  70           HD2      PHE  70   6.638   4.537   2.613
  527    HE1  PHE  70           HE1      PHE  70  10.459   5.526  -0.393
  528    HE2  PHE  70           HE2      PHE  70   8.619   3.046   2.599
  529    HZ   PHE  70           HZ       PHE  70  10.530   3.537   1.093
  530    H    CYS  71           HN       CYS  71   4.248   8.422   3.467
  531    HA   CYS  71           HA       CYS  71   3.567  10.816   1.834
  532   1HB   CYS  71          HB2       CYS  71   2.185   8.256   1.747
  533   2HB   CYS  71          HB1       CYS  71   1.090   9.530   2.275
  534    HA   PRO  72           HA       PRO  72   3.036  11.720   6.366
  535   1HB   PRO  72          HB2       PRO  72   2.981  14.496   5.304
  536   2HB   PRO  72          HB1       PRO  72   4.022  13.798   6.551
  537   1HG   PRO  72          HG2       PRO  72   4.924  14.471   4.063
  538   2HG   PRO  72          HG1       PRO  72   5.646  13.177   5.031
  539   1HD   PRO  72          HD2       PRO  72   3.896  12.971   2.625
  540   2HD   PRO  72          HD1       PRO  72   5.115  11.822   3.240
  541    H    HIS  73           HN       HIS  73   0.877  11.062   4.416
  542    HA   HIS  73           HA       HIS  73  -1.132  13.183   4.770
  543   1HB   HIS  73          HB2       HIS  73  -0.590  11.353   2.765
  544   2HB   HIS  73          HB1       HIS  73  -1.978  10.610   3.548
  545    HD1  HIS  73           HD1      HIS  73  -4.246  11.740   3.245
  546    HD2  HIS  73           HD2      HIS  73  -1.082  13.959   1.689
  547    HE1  HIS  73           HE1      HIS  73  -5.296  13.627   1.930
  548    H    LYS  74           HN       LYS  74  -1.938  13.182   6.855
  549    HA   LYS  74           HA       LYS  74  -2.570  10.652   8.213
  550   1HB   LYS  74          HB2       LYS  74  -3.148  13.545   8.927
  551   2HB   LYS  74          HB1       LYS  74  -3.531  12.166   9.961
  552   1HG   LYS  74          HG2       LYS  74  -1.150  11.524   9.992
  553   2HG   LYS  74          HG1       LYS  74  -0.768  12.909   8.967
  554   1HD   LYS  74          HD2       LYS  74  -1.617  14.439  10.687
  555   2HD   LYS  74          HD1       LYS  74  -2.023  13.067  11.720
  556   1HE   LYS  74          HE2       LYS  74   0.384  12.387  11.670
  557   2HE   LYS  74          HE1       LYS  74   0.744  13.864  10.776
  558   1HZ   LYS  74          HZ1       LYS  74   1.106  14.504  12.937
  559   2HZ   LYS  74          HZ2       LYS  74  -0.152  13.547  13.560
  560   3HZ   LYS  74          HZ3       LYS  74  -0.505  14.984  12.723
  561    H    VAL  75           HN       VAL  75  -4.161   9.638   6.992
  562    HA   VAL  75           HA       VAL  75  -6.594  11.197   6.252
  563    HB   VAL  75           HB       VAL  75  -5.802   8.365   5.508
  564   1HG1  VAL  75          HG11      VAL  75  -8.322   9.283   5.428
  565   2HG1  VAL  75          HG12      VAL  75  -7.677   8.297   4.126
  566   3HG1  VAL  75          HG13      VAL  75  -7.748  10.046   3.949
  567   1HG2  VAL  75          HG21      VAL  75  -4.963   9.219   3.461
  568   2HG2  VAL  75          HG22      VAL  75  -4.310  10.310   4.681
  569   3HG2  VAL  75          HG23      VAL  75  -5.705  10.798   3.718
  570    H    SER  76           HN       SER  76  -8.428  10.948   7.370
  571    HA   SER  76           HA       SER  76  -8.561   8.853   9.494
  572   1HB   SER  76          HB2       SER  76 -10.317  10.226  10.471
  573   2HB   SER  76          HB1       SER  76  -8.926  11.251  10.131
  574    HG   SER  76           HG       SER  76 -10.990  10.888   8.242
  575    H    ALA  77           HN       ALA  77 -10.773   7.859   9.746
  576    HA   ALA  77           HA       ALA  77 -11.605   6.598   7.337
  577   1HB   ALA  77          HB1       ALA  77 -13.171   6.968   9.909
  578   2HB   ALA  77          HB2       ALA  77 -12.026   5.663   9.594
  579   3HB   ALA  77          HB3       ALA  77 -13.514   5.778   8.654
  580    H    GLY  78           HN       GLY  78 -12.160   9.750   8.399
  581   1HA   GLY  78          HA2       GLY  78 -14.735   9.996   6.897
  582   2HA   GLY  78          HA1       GLY  78 -14.117  11.166   8.058
  583    H    GLN  79           HN       GLN  79 -11.380  11.204   6.952
  584    HA   GLN  79           HA       GLN  79 -11.947  13.022   4.685
  585   1HB   GLN  79          HB2       GLN  79  -9.397  12.402   6.206
  586   2HB   GLN  79          HB1       GLN  79  -9.483  13.533   4.855
  587   1HG   GLN  79          HG2       GLN  79 -11.197  13.753   7.345
  588   2HG   GLN  79          HG1       GLN  79  -9.686  14.633   7.111
  589   1HE2  GLN  79          HE21      GLN  79 -12.992  14.986   6.768
  590   2HE2  GLN  79          HE22      GLN  79 -13.018  16.169   5.551
  591    H    PHE  80           HN       PHE  80 -11.732  12.428   2.598
  592    HA   PHE  80           HA       PHE  80  -9.958  10.103   1.920
  593   1HB   PHE  80          HB2       PHE  80 -12.737  10.691   0.877
  594   2HB   PHE  80          HB1       PHE  80 -11.648   9.488   0.188
  595    HD1  PHE  80           HD1      PHE  80 -13.930  10.267   2.899
  596    HD2  PHE  80           HD2      PHE  80 -10.869   7.555   1.593
  597    HE1  PHE  80           HE1      PHE  80 -14.655   8.627   4.610
  598    HE2  PHE  80           HE2      PHE  80 -11.596   5.910   3.302
  599    HZ   PHE  80           HZ       PHE  80 -13.491   6.447   4.810
  600    H    SER  81           HN       SER  81  -8.998  10.226  -0.197
  601    HA   SER  81           HA       SER  81  -9.049  12.985  -1.393
  602   1HB   SER  81          HB2       SER  81  -6.770  11.005  -1.217
  603   2HB   SER  81          HB1       SER  81  -6.700  12.571  -2.020
  604    HG   SER  81           HG       SER  81  -6.195  13.289  -0.115
  605    H    SER  82           HN       SER  82  -8.225   9.595  -2.317
  606    HA   SER  82           HA       SER  82  -8.856  10.306  -5.139
  607   1HB   SER  82          HB2       SER  82  -6.706   9.191  -4.615
  608   2HB   SER  82          HB1       SER  82  -7.597   7.798  -4.005
  609    HG   SER  82           HG       SER  82  -7.487   8.836  -6.636
  610    H    LEU  83           HN       LEU  83 -10.651   9.038  -2.620
  611    HA   LEU  83           HA       LEU  83 -11.968   6.925  -4.214
  612   1HB   LEU  83          HB2       LEU  83 -12.430   8.057  -1.450
  613   2HB   LEU  83          HB1       LEU  83 -13.592   6.964  -2.194
  614    HG   LEU  83           HG       LEU  83 -11.718   5.322  -2.557
  615   1HD1  LEU  83          HD11      LEU  83  -9.764   6.672  -2.502
  616   2HD1  LEU  83          HD12      LEU  83  -9.709   5.756  -0.997
  617   3HD1  LEU  83          HD13      LEU  83 -10.236   7.438  -0.985
  618   1HD2  LEU  83          HD21      LEU  83 -11.593   4.651  -0.158
  619   2HD2  LEU  83          HD22      LEU  83 -13.232   5.074  -0.653
  620   3HD2  LEU  83          HD23      LEU  83 -12.274   6.213   0.285
  621    H    HIS  84           HN       HIS  84 -11.954   9.864  -5.010
  622    HA   HIS  84           HA       HIS  84 -14.728  10.750  -4.773
  623   1HB   HIS  84          HB2       HIS  84 -12.621  11.667  -6.753
  624   2HB   HIS  84          HB1       HIS  84 -14.066  12.549  -6.259
  625    HD1  HIS  84           HD1      HIS  84 -13.205  11.239  -3.204
  626    HD2  HIS  84           HD2      HIS  84 -11.343  14.122  -5.572
  627    HE1  HIS  84           HE1      HIS  84 -11.707  12.577  -1.662
  628    H    VAL  85           HN       VAL  85 -12.837   8.807  -6.944
  629    HA   VAL  85           HA       VAL  85 -14.723   8.938  -9.153
  630    HB   VAL  85           HB       VAL  85 -13.351   7.058 -10.070
  631   1HG1  VAL  85          HG11      VAL  85 -11.759   9.375  -8.925
  632   2HG1  VAL  85          HG12      VAL  85 -12.683   9.416 -10.426
  633   3HG1  VAL  85          HG13      VAL  85 -11.274   8.365 -10.287
  634   1HG2  VAL  85          HG21      VAL  85 -11.358   6.353  -8.811
  635   2HG2  VAL  85          HG22      VAL  85 -12.821   5.995  -7.893
  636   3HG2  VAL  85          HG23      VAL  85 -11.828   7.390  -7.466
  637    H    ARG  86           HN       ARG  86 -16.207   7.300  -9.764
  638    HA   ARG  86           HA       ARG  86 -17.242   5.707  -7.491
  639   1HB   ARG  86          HB2       ARG  86 -18.285   6.269 -10.277
  640   2HB   ARG  86          HB1       ARG  86 -19.108   5.221  -9.123
  641   1HG   ARG  86          HG2       ARG  86 -19.256   7.079  -7.523
  642   2HG   ARG  86          HG1       ARG  86 -18.427   8.133  -8.662
  643   1HD   ARG  86          HD2       ARG  86 -21.058   6.726  -9.159
  644   2HD   ARG  86          HD1       ARG  86 -20.889   8.436  -8.784
  645    HE   ARG  86           HE       ARG  86 -20.607   7.186 -11.371
  646   1HH1  ARG  86          HH21      ARG  86 -19.119   9.596  -9.389
  647   2HH1  ARG  86          HH22      ARG  86 -18.300  10.348 -10.716
  648   1HH2  ARG  86          HH11      ARG  86 -19.542   8.161 -13.088
  649   2HH2  ARG  86          HH12      ARG  86 -18.537   9.541 -12.797
  650    H    ASP  87           HN       ASP  87 -14.876   4.603  -8.144
  651    HA   ASP  87           HA       ASP  87 -15.186   2.542 -10.208
  652   1HB   ASP  87          HB2       ASP  87 -13.050   3.054  -8.117
  653   2HB   ASP  87          HB1       ASP  87 -12.989   1.712  -9.259
  654    H    THR  88           HN       THR  88 -14.748   0.196  -9.474
  655    HA   THR  88           HA       THR  88 -16.668  -0.401  -7.304
  656    HB   THR  88           HB       THR  88 -16.494  -2.721  -8.115
  657    HG1  THR  88           HG1      THR  88 -14.171  -1.921  -8.969
  658   1HG2  THR  88          HG21      THR  88 -18.077  -1.268  -9.252
  659   2HG2  THR  88          HG22      THR  88 -17.312  -2.317 -10.445
  660   3HG2  THR  88          HG23      THR  88 -16.801  -0.636 -10.292
  661    H    LYS  89           HN       LYS  89 -16.038  -2.158  -5.744
  662    HA   LYS  89           HA       LYS  89 -13.387  -1.549  -4.621
  663   1HB   LYS  89          HB2       LYS  89 -15.592  -3.373  -3.614
  664   2HB   LYS  89          HB1       LYS  89 -14.143  -2.926  -2.718
  665   1HG   LYS  89          HG2       LYS  89 -14.818  -0.552  -2.792
  666   2HG   LYS  89          HG1       LYS  89 -16.273  -0.998  -3.687
  667   1HD   LYS  89          HD2       LYS  89 -17.009  -2.413  -1.812
  668   2HD   LYS  89          HD1       LYS  89 -15.555  -1.987  -0.910
  669   1HE   LYS  89          HE2       LYS  89 -16.225   0.297  -0.725
  670   2HE   LYS  89          HE1       LYS  89 -17.506   0.091  -1.921
  671   1HZ   LYS  89          HZ1       LYS  89 -18.879  -0.483  -0.301
  672   2HZ   LYS  89          HZ2       LYS  89 -17.645  -0.278   0.849
  673   3HZ   LYS  89          HZ3       LYS  89 -17.884  -1.791   0.114
  674    H    ILE  90           HN       ILE  90 -11.769  -3.170  -4.243
  675    HA   ILE  90           HA       ILE  90 -12.096  -5.705  -5.827
  676    HB   ILE  90           HB       ILE  90  -9.698  -5.476  -6.452
  677   1HG1  ILE  90          HG12      ILE  90  -9.910  -2.655  -5.364
  678   2HG1  ILE  90          HG11      ILE  90  -9.159  -3.962  -4.453
  679   1HG2  ILE  90          HG21      ILE  90 -11.495  -4.628  -7.951
  680   2HG2  ILE  90          HG22      ILE  90 -10.014  -3.683  -8.097
  681   3HG2  ILE  90          HG23      ILE  90 -11.374  -3.050  -7.172
  682   1HD1  ILE  90          HD11      ILE  90  -8.304  -2.892  -7.151
  683   2HD1  ILE  90          HD12      ILE  90  -7.647  -4.363  -6.432
  684   3HD1  ILE  90          HD13      ILE  90  -7.408  -2.807  -5.637
  685    H    GLU  91           HN       GLU  91 -10.637  -7.466  -5.074
  686    HA   GLU  91           HA       GLU  91 -10.737  -7.790  -2.231
  687   1HB   GLU  91          HB2       GLU  91  -9.216  -9.306  -4.370
  688   2HB   GLU  91          HB1       GLU  91  -9.298  -9.813  -2.682
  689   1HG   GLU  91          HG2       GLU  91 -11.712 -10.005  -2.794
  690   2HG   GLU  91          HG1       GLU  91 -11.728  -9.328  -4.422
  691    H    VAL  92           HN       VAL  92  -9.215  -7.476  -0.658
  692    HA   VAL  92           HA       VAL  92  -7.107  -5.599  -1.020
  693    HB   VAL  92           HB       VAL  92  -7.655  -7.648   1.146
  694   1HG1  VAL  92          HG11      VAL  92  -5.341  -7.250   1.404
  695   2HG1  VAL  92          HG12      VAL  92  -6.083  -6.076   2.490
  696   3HG1  VAL  92          HG13      VAL  92  -5.483  -5.562   0.913
  697   1HG2  VAL  92          HG21      VAL  92  -9.194  -5.596   0.645
  698   2HG2  VAL  92          HG22      VAL  92  -7.881  -4.640   1.333
  699   3HG2  VAL  92          HG23      VAL  92  -8.682  -5.871   2.309
  700    H    ALA  93           HN       ALA  93  -7.061  -9.155  -0.965
  701    HA   ALA  93           HA       ALA  93  -4.287  -9.584  -0.953
  702   1HB   ALA  93          HB1       ALA  93  -5.971 -11.395  -0.891
  703   2HB   ALA  93          HB2       ALA  93  -4.770 -11.684  -2.151
  704   3HB   ALA  93          HB3       ALA  93  -6.371 -11.076  -2.576
  705    H    GLN  94           HN       GLN  94  -6.395  -8.767  -3.720
  706    HA   GLN  94           HA       GLN  94  -4.187  -8.854  -5.630
  707   1HB   GLN  94          HB2       GLN  94  -6.558  -9.252  -6.295
  708   2HB   GLN  94          HB1       GLN  94  -6.926  -7.575  -5.898
  709   1HG   GLN  94          HG2       GLN  94  -5.354  -6.790  -7.599
  710   2HG   GLN  94          HG1       GLN  94  -4.878  -8.451  -7.955
  711   1HE2  GLN  94          HE21      GLN  94  -6.016  -6.752  -9.979
  712   2HE2  GLN  94          HE22      GLN  94  -7.535  -7.380 -10.404
  713    H    PHE  95           HN       PHE  95  -5.698  -6.460  -3.584
  714    HA   PHE  95           HA       PHE  95  -4.726  -4.076  -4.801
  715   1HB   PHE  95          HB2       PHE  95  -6.356  -4.082  -2.931
  716   2HB   PHE  95          HB1       PHE  95  -5.110  -4.701  -1.855
  717    HD1  PHE  95           HD1      PHE  95  -6.323  -1.769  -3.685
  718    HD2  PHE  95           HD2      PHE  95  -3.205  -3.318  -1.169
  719    HE1  PHE  95           HE1      PHE  95  -5.521   0.538  -3.250
  720    HE2  PHE  95           HE2      PHE  95  -2.407  -1.013  -0.734
  721    HZ   PHE  95           HZ       PHE  95  -3.563   0.911  -1.776
  722    H    VAL  96           HN       VAL  96  -3.311  -6.112  -2.231
  723    HA   VAL  96           HA       VAL  96  -0.892  -4.625  -1.983
  724    HB   VAL  96           HB       VAL  96  -1.309  -7.601  -1.579
  725   1HG1  VAL  96          HG11      VAL  96   1.032  -7.120  -1.612
  726   2HG1  VAL  96          HG12      VAL  96   0.580  -7.209   0.091
  727   3HG1  VAL  96          HG13      VAL  96   0.811  -5.640  -0.680
  728   1HG2  VAL  96          HG21      VAL  96  -2.913  -6.412  -0.242
  729   2HG2  VAL  96          HG22      VAL  96  -1.710  -5.217   0.238
  730   3HG2  VAL  96          HG23      VAL  96  -1.592  -6.873   0.832
  731    H    LYS  97           HN       LYS  97  -1.743  -7.449  -3.982
  732    HA   LYS  97           HA       LYS  97   0.823  -7.816  -5.136
  733   1HB   LYS  97          HB2       LYS  97  -1.947  -8.400  -6.207
  734   2HB   LYS  97          HB1       LYS  97  -0.470  -8.903  -7.029
  735   1HG   LYS  97          HG2       LYS  97   0.232 -10.142  -5.014
  736   2HG   LYS  97          HG1       LYS  97  -1.249  -9.648  -4.193
  737   1HD   LYS  97          HD2       LYS  97  -2.590 -10.793  -5.932
  738   2HD   LYS  97          HD1       LYS  97  -1.101 -11.311  -6.725
  739   1HE   LYS  97          HE2       LYS  97  -2.147 -12.126  -4.014
  740   2HE   LYS  97          HE1       LYS  97  -1.751 -13.162  -5.384
  741   1HZ   LYS  97          HZ1       LYS  97   0.581 -12.455  -5.133
  742   2HZ   LYS  97          HZ2       LYS  97  -0.005 -13.283  -3.771
  743   3HZ   LYS  97          HZ3       LYS  97   0.153 -11.592  -3.736
  744    H    ASP  98           HN       ASP  98  -1.944  -5.897  -6.436
  745    HA   ASP  98           HA       ASP  98  -0.534  -4.993  -8.743
  746   1HB   ASP  98          HB2       ASP  98  -2.790  -3.718  -7.177
  747   2HB   ASP  98          HB1       ASP  98  -2.181  -3.068  -8.699
  748    H    LEU  99           HN       LEU  99  -0.687  -3.698  -5.443
  749    HA   LEU  99           HA       LEU  99   0.765  -1.290  -5.957
  750   1HB   LEU  99          HB2       LEU  99  -0.472  -1.685  -3.842
  751   2HB   LEU  99          HB1       LEU  99   0.667  -2.959  -3.417
  752    HG   LEU  99           HG       LEU  99   2.506  -1.332  -3.368
  753   1HD1  LEU  99          HD11      LEU  99   0.364   0.518  -4.389
  754   2HD1  LEU  99          HD12      LEU  99   2.037   0.343  -4.923
  755   3HD1  LEU  99          HD13      LEU  99   1.679   1.173  -3.413
  756   1HD2  LEU  99          HD21      LEU  99   0.061  -0.504  -1.776
  757   2HD2  LEU  99          HD22      LEU  99   1.701   0.045  -1.429
  758   3HD2  LEU  99          HD23      LEU  99   1.292  -1.665  -1.282
  759    H    LEU 100           HN       LEU 100   1.774  -4.580  -5.201
  760    HA   LEU 100           HA       LEU 100   4.517  -4.142  -4.733
  761   1HB   LEU 100          HB2       LEU 100   3.462  -6.305  -4.339
  762   2HB   LEU 100          HB1       LEU 100   3.136  -6.486  -6.056
  763    HG   LEU 100           HG       LEU 100   5.483  -6.645  -6.571
  764   1HD1  LEU 100          HD11      LEU 100   5.818  -5.820  -3.690
  765   2HD1  LEU 100          HD12      LEU 100   6.578  -5.140  -5.131
  766   3HD1  LEU 100          HD13      LEU 100   7.086  -6.715  -4.527
  767   1HD2  LEU 100          HD21      LEU 100   6.030  -8.704  -5.374
  768   2HD2  LEU 100          HD22      LEU 100   4.303  -8.675  -5.728
  769   3HD2  LEU 100          HD23      LEU 100   4.876  -8.301  -4.102
  770    H    LEU 101           HN       LEU 101   2.850  -4.649  -7.873
  771    HA   LEU 101           HA       LEU 101   5.248  -4.724  -9.425
  772   1HB   LEU 101          HB2       LEU 101   2.401  -3.999 -10.087
  773   2HB   LEU 101          HB1       LEU 101   3.665  -3.794 -11.297
  774    HG   LEU 101           HG       LEU 101   2.485  -6.010 -11.418
  775   1HD1  LEU 101          HD11      LEU 101   5.094  -5.500 -11.911
  776   2HD1  LEU 101          HD12      LEU 101   4.390  -7.101 -12.106
  777   3HD1  LEU 101          HD13      LEU 101   5.286  -6.710 -10.643
  778   1HD2  LEU 101          HD21      LEU 101   3.953  -6.627  -8.846
  779   2HD2  LEU 101          HD22      LEU 101   2.774  -7.637  -9.686
  780   3HD2  LEU 101          HD23      LEU 101   2.261  -6.150  -8.895
  781    H    HIS 102           HN       HIS 102   3.176  -1.919  -8.585
  782    HA   HIS 102           HA       HIS 102   4.856  -0.071 -10.015
  783   1HB   HIS 102          HB2       HIS 102   2.728   0.273  -7.905
  784   2HB   HIS 102          HB1       HIS 102   3.688   1.651  -8.441
  785    HD1  HIS 102           HD1      HIS 102   3.415   2.419 -10.922
  786    HD2  HIS 102           HD2      HIS 102   0.904  -0.716  -9.818
  787    HE1  HIS 102           HE1      HIS 102   1.753   2.148 -12.807
  788    H    LEU 103           HN       LEU 103   4.839  -1.116  -6.597
  789    HA   LEU 103           HA       LEU 103   6.665   0.809  -5.646
  790   1HB   LEU 103          HB2       LEU 103   6.346  -2.094  -4.850
  791   2HB   LEU 103          HB1       LEU 103   7.388  -0.970  -3.985
  792    HG   LEU 103           HG       LEU 103   4.425  -0.501  -4.441
  793   1HD1  LEU 103          HD11      LEU 103   5.925  -1.811  -2.164
  794   2HD1  LEU 103          HD12      LEU 103   4.531  -2.427  -3.048
  795   3HD1  LEU 103          HD13      LEU 103   4.339  -1.076  -1.929
  796   1HD2  LEU 103          HD21      LEU 103   6.586   0.892  -2.852
  797   2HD2  LEU 103          HD22      LEU 103   4.895   1.030  -2.377
  798   3HD2  LEU 103          HD23      LEU 103   5.406   1.597  -3.958
  799    H    LYS 104           HN       LYS 104   7.596  -2.477  -6.836
  800    HA   LYS 104           HA       LYS 104  10.393  -1.823  -6.765
  801   1HB   LYS 104          HB2       LYS 104  10.772  -3.859  -7.978
  802   2HB   LYS 104          HB1       LYS 104   9.451  -4.158  -6.851
  803   1HG   LYS 104          HG2       LYS 104   7.883  -3.537  -8.794
  804   2HG   LYS 104          HG1       LYS 104   9.301  -3.709  -9.830
  805   1HD   LYS 104          HD2       LYS 104   9.628  -6.015  -8.822
  806   2HD   LYS 104          HD1       LYS 104   8.044  -5.825  -8.070
  807   1HE   LYS 104          HE2       LYS 104   7.517  -6.929 -10.060
  808   2HE   LYS 104          HE1       LYS 104   7.251  -5.241 -10.499
  809   1HZ   LYS 104          HZ1       LYS 104   8.682  -6.721 -12.022
  810   2HZ   LYS 104          HZ2       LYS 104   9.899  -6.476 -10.863
  811   3HZ   LYS 104          HZ3       LYS 104   9.215  -5.149 -11.676
  812    H    LYS 105           HN       LYS 105   7.925  -0.999  -9.039
  813    HA   LYS 105           HA       LYS 105   9.558  -0.753 -11.379
  814   1HB   LYS 105          HB2       LYS 105   7.027  -0.666 -11.288
  815   2HB   LYS 105          HB1       LYS 105   7.180   0.983 -10.678
  816   1HG   LYS 105          HG2       LYS 105   8.486   1.592 -12.697
  817   2HG   LYS 105          HG1       LYS 105   8.264  -0.047 -13.313
  818   1HD   LYS 105          HD2       LYS 105   5.816   0.265 -13.260
  819   2HD   LYS 105          HD1       LYS 105   6.044   1.908 -12.665
  820   1HE   LYS 105          HE2       LYS 105   7.409   2.375 -14.739
  821   2HE   LYS 105          HE1       LYS 105   6.900   0.799 -15.347
  822   1HZ   LYS 105          HZ1       LYS 105   4.904   2.732 -14.375
  823   2HZ   LYS 105          HZ2       LYS 105   4.709   1.454 -15.477
  824   3HZ   LYS 105          HZ3       LYS 105   5.523   2.869 -15.948
  825    H    LEU 106           HN       LEU 106   8.717   1.643  -8.837
  826    HA   LEU 106           HA       LEU 106  10.179   3.798 -10.025
  827   1HB   LEU 106          HB2       LEU 106   9.263   3.239  -7.208
  828   2HB   LEU 106          HB1       LEU 106  10.287   4.630  -7.547
  829    HG   LEU 106           HG       LEU 106   7.822   5.141  -7.582
  830   1HD1  LEU 106          HD11      LEU 106   8.019   6.697  -9.283
  831   2HD1  LEU 106          HD12      LEU 106   8.790   5.571 -10.394
  832   3HD1  LEU 106          HD13      LEU 106   9.716   6.279  -9.070
  833   1HD2  LEU 106          HD21      LEU 106   7.823   3.502 -10.135
  834   2HD2  LEU 106          HD22      LEU 106   6.450   4.332  -9.407
  835   3HD2  LEU 106          HD23      LEU 106   7.165   2.942  -8.599
  836    H    PHE 107           HN       PHE 107  11.207   1.086  -8.070
  837    HA   PHE 107           HA       PHE 107  13.735   2.069  -7.224
  838   1HB   PHE 107          HB2       PHE 107  12.742  -0.088  -6.450
  839   2HB   PHE 107          HB1       PHE 107  13.040  -0.769  -8.047
  840    HD1  PHE 107           HD1      PHE 107  14.755   0.895  -5.180
  841    HD2  PHE 107           HD2      PHE 107  15.148  -1.722  -8.563
  842    HE1  PHE 107           HE1      PHE 107  17.080   0.376  -4.505
  843    HE2  PHE 107           HE2      PHE 107  17.477  -2.245  -7.887
  844    HZ   PHE 107           HZ       PHE 107  18.445  -1.193  -5.859
  845    H    ARG 108           HN       ARG 108  12.710   0.584 -10.279
  846    HA   ARG 108           HA       ARG 108  15.288   0.272 -11.430
  847   1HB   ARG 108          HB2       ARG 108  12.593   0.799 -12.724
  848   2HB   ARG 108          HB1       ARG 108  14.054   0.421 -13.639
  849   1HG   ARG 108          HG2       ARG 108  14.289  -1.685 -12.338
  850   2HG   ARG 108          HG1       ARG 108  12.775  -1.328 -11.514
  851   1HD   ARG 108          HD2       ARG 108  11.723  -1.186 -13.850
  852   2HD   ARG 108          HD1       ARG 108  13.197  -1.933 -14.454
  853    HE   ARG 108           HE       ARG 108  10.993  -3.276 -13.194
  854   1HH1  ARG 108          HH21      ARG 108  14.444  -3.202 -13.145
  855   2HH1  ARG 108          HH22      ARG 108  14.587  -4.745 -12.378
  856   1HH2  ARG 108          HH11      ARG 108  11.173  -5.279 -12.195
  857   2HH2  ARG 108          HH12      ARG 108  12.744  -5.922 -11.847
  858    H    GLU 109           HN       GLU 109  13.149   3.088 -11.273
  859    HA   GLU 109           HA       GLU 109  14.966   4.695 -12.939
  860   1HB   GLU 109          HB2       GLU 109  12.467   5.373 -11.363
  861   2HB   GLU 109          HB1       GLU 109  13.332   6.517 -12.393
  862   1HG   GLU 109          HG2       GLU 109  12.993   5.036 -14.333
  863   2HG   GLU 109          HG1       GLU 109  12.139   3.881 -13.311
  864    H    GLY 110           HN       GLY 110  14.724   3.878  -9.587
  865   1HA   GLY 110          HA2       GLY 110  16.037   4.592  -7.774
  866   2HA   GLY 110          HA1       GLY 110  17.040   5.460  -8.938
  867    H    ARG 111           HN       ARG 111  13.940   6.468  -9.499
  868    HA   ARG 111           HA       ARG 111  14.391   8.978  -7.974
  869   1HB   ARG 111          HB2       ARG 111  12.413   8.207 -10.148
  870   2HB   ARG 111          HB1       ARG 111  12.395   9.771  -9.331
  871   1HG   ARG 111          HG2       ARG 111  14.721  10.178 -10.049
  872   2HG   ARG 111          HG1       ARG 111  14.745   8.617 -10.866
  873   1HD   ARG 111          HD2       ARG 111  12.823   9.385 -12.281
  874   2HD   ARG 111          HD1       ARG 111  12.958  10.976 -11.529
  875    HE   ARG 111           HE       ARG 111  15.508  10.526 -12.470
  876   1HH1  ARG 111          HH21      ARG 111  12.332  10.340 -13.809
  877   2HH1  ARG 111          HH22      ARG 111  12.835  10.799 -15.401
  878   1HH2  ARG 111          HH11      ARG 111  16.175  11.147 -14.543
  879   2HH2  ARG 111          HH12      ARG 111  15.007  11.260 -15.817
  880    H    PHE 112           HN       PHE 112  13.823   8.500  -5.868
  881    HA   PHE 112           HA       PHE 112  11.306   7.072  -5.286
  882   1HB   PHE 112          HB2       PHE 112  13.376   8.238  -3.395
  883   2HB   PHE 112          HB1       PHE 112  12.113   7.070  -2.995
  884    HD1  PHE 112           HD1      PHE 112  12.142   4.795  -4.004
  885    HD2  PHE 112           HD2      PHE 112  15.400   7.544  -4.525
  886    HE1  PHE 112           HE1      PHE 112  13.598   2.939  -4.761
  887    HE2  PHE 112           HE2      PHE 112  16.849   5.676  -5.285
  888    HZ   PHE 112           HZ       PHE 112  15.946   3.374  -5.398
  889    H    ASN 113           HN       ASN 113   9.484   8.015  -4.361
  890    HA   ASN 113           HA       ASN 113   7.954   9.762  -3.990
  891   1HB   ASN 113          HB2       ASN 113  10.419  10.732  -2.528
  892   2HB   ASN 113          HB1       ASN 113   8.855  11.541  -2.421
  893   1HD2  ASN 113          HD21      ASN 113  10.322  10.084  -0.252
  894   2HD2  ASN 113          HD22      ASN 113   9.264   8.864   0.271
  Start of MODEL   15
    1   1H    MET   1           HT1      MET   1  22.305   7.226  12.879
    2   2H    MET   1           HT2      MET   1  21.069   6.155  12.420
    3   3H    MET   1           HT3      MET   1  22.074   5.781  13.738
    4    HA   MET   1           HA       MET   1  20.217   6.531  14.826
    5   1HB   MET   1          HB2       MET   1  22.216   7.871  15.474
    6   2HB   MET   1          HB1       MET   1  21.799   9.057  14.244
    7   1HG   MET   1          HG2       MET   1  20.995   9.805  16.440
    8   2HG   MET   1          HG1       MET   1  19.633   9.471  15.377
    9   1HE   MET   1          HE1       MET   1  21.875   6.658  17.414
   10   2HE   MET   1          HE2       MET   1  21.173   7.118  18.961
   11   3HE   MET   1          HE3       MET   1  21.994   8.331  17.980
   12    H    GLY   2           HN       GLY   2  20.842   8.644  12.014
   13   1HA   GLY   2          HA2       GLY   2  18.206   9.806  12.049
   14   2HA   GLY   2          HA1       GLY   2  19.334   9.881  10.695
   15    HA   PRO   3           HA       PRO   3  15.595   6.774  10.169
   16   1HB   PRO   3          HB2       PRO   3  15.037   8.407   7.785
   17   2HB   PRO   3          HB1       PRO   3  13.947   7.937   9.093
   18   1HG   PRO   3          HG2       PRO   3  15.121  10.506   8.671
   19   2HG   PRO   3          HG1       PRO   3  14.136   9.995  10.047
   20   1HD   PRO   3          HD2       PRO   3  16.955  10.597  10.055
   21   2HD   PRO   3          HD1       PRO   3  15.980   9.979  11.413
   22    H    VAL   4           HN       VAL   4  15.457   5.326   8.232
   23    HA   VAL   4           HA       VAL   4  18.105   4.883   7.107
   24    HB   VAL   4           HB       VAL   4  16.872   2.938   5.967
   25   1HG1  VAL   4          HG11      VAL   4  18.105   2.470   7.958
   26   2HG1  VAL   4          HG12      VAL   4  16.503   1.787   8.232
   27   3HG1  VAL   4          HG13      VAL   4  16.942   3.330   8.966
   28   1HG2  VAL   4          HG21      VAL   4  14.671   3.777   7.872
   29   2HG2  VAL   4          HG22      VAL   4  14.633   2.456   6.707
   30   3HG2  VAL   4          HG23      VAL   4  14.628   4.128   6.144
   31    HA   PRO   5           HA       PRO   5  17.486   7.181   3.347
   32   1HB   PRO   5          HB2       PRO   5  18.566   5.175   1.567
   33   2HB   PRO   5          HB1       PRO   5  19.367   6.619   2.193
   34   1HG   PRO   5          HG2       PRO   5  19.759   3.843   2.980
   35   2HG   PRO   5          HG1       PRO   5  20.695   5.266   3.452
   36   1HD   PRO   5          HD2       PRO   5  18.921   3.786   5.119
   37   2HD   PRO   5          HD1       PRO   5  19.655   5.367   5.493
   38    HA   PRO   6           HA       PRO   6  13.728   5.754   1.436
   39   1HB   PRO   6          HB2       PRO   6  14.183   6.530  -1.238
   40   2HB   PRO   6          HB1       PRO   6  13.519   7.550   0.046
   41   1HG   PRO   6          HG2       PRO   6  16.230   7.567  -1.144
   42   2HG   PRO   6          HG1       PRO   6  15.370   8.855  -0.291
   43   1HD   PRO   6          HD2       PRO   6  17.486   7.337   0.776
   44   2HD   PRO   6          HD1       PRO   6  16.321   8.296   1.728
   45    H    SER   7           HN       SER   7  16.473   5.033  -0.754
   46    HA   SER   7           HA       SER   7  15.229   2.862  -2.100
   47   1HB   SER   7          HB2       SER   7  17.459   2.238  -2.826
   48   2HB   SER   7          HB1       SER   7  17.357   3.995  -2.814
   49    HG   SER   7           HG       SER   7  18.106   3.379  -0.419
   50    H    THR   8           HN       THR   8  17.156   2.932   0.889
   51    HA   THR   8           HA       THR   8  17.197   0.059   1.211
   52    HB   THR   8           HB       THR   8  17.488   2.241   3.304
   53    HG1  THR   8           HG1      THR   8  19.762   1.091   2.738
   54   1HG2  THR   8          HG21      THR   8  18.259  -0.692   3.328
   55   2HG2  THR   8          HG22      THR   8  16.998   0.053   4.310
   56   3HG2  THR   8          HG23      THR   8  18.688   0.476   4.576
   57    H    ALA   9           HN       ALA   9  15.095   2.622   2.529
   58    HA   ALA   9           HA       ALA   9  13.488   0.938   4.167
   59   1HB   ALA   9          HB1       ALA   9  12.544   3.394   2.667
   60   2HB   ALA   9          HB2       ALA   9  13.500   3.472   4.146
   61   3HB   ALA   9          HB3       ALA   9  11.894   2.746   4.171
   62    H    LEU  10           HN       LEU  10  13.168   1.886   0.751
   63    HA   LEU  10           HA       LEU  10  10.684   0.594   0.251
   64   1HB   LEU  10          HB2       LEU  10  11.733   2.179  -1.332
   65   2HB   LEU  10          HB1       LEU  10  13.024   1.020  -1.634
   66    HG   LEU  10           HG       LEU  10  11.278  -0.617  -2.431
   67   1HD1  LEU  10          HD11      LEU  10   9.096   0.608  -3.160
   68   2HD1  LEU  10          HD12      LEU  10   9.515   1.769  -1.902
   69   3HD1  LEU  10          HD13      LEU  10   9.242   0.076  -1.487
   70   1HD2  LEU  10          HD21      LEU  10  10.862   0.608  -4.583
   71   2HD2  LEU  10          HD22      LEU  10  12.541   0.622  -4.054
   72   3HD2  LEU  10          HD23      LEU  10  11.536   2.051  -3.828
   73    H    ARG  11           HN       ARG  11  14.027  -0.626  -0.154
   74    HA   ARG  11           HA       ARG  11  13.306  -3.213  -1.094
   75   1HB   ARG  11          HB2       ARG  11  15.697  -2.270   0.512
   76   2HB   ARG  11          HB1       ARG  11  15.546  -3.894  -0.161
   77   1HG   ARG  11          HG2       ARG  11  15.454  -3.045  -2.408
   78   2HG   ARG  11          HG1       ARG  11  15.303  -1.387  -1.834
   79   1HD   ARG  11          HD2       ARG  11  17.584  -1.762  -2.560
   80   2HD   ARG  11          HD1       ARG  11  17.579  -1.547  -0.820
   81    HE   ARG  11           HE       ARG  11  18.199  -3.985  -2.448
   82   1HH1  ARG  11          HH21      ARG  11  17.421  -2.749   0.670
   83   2HH1  ARG  11          HH22      ARG  11  17.887  -4.198   1.494
   84   1HH2  ARG  11          HH11      ARG  11  18.818  -5.864  -1.399
   85   2HH2  ARG  11          HH12      ARG  11  18.675  -5.960   0.325
   86    H    GLU  12           HN       GLU  12  13.792  -1.988   2.206
   87    HA   GLU  12           HA       GLU  12  13.346  -4.495   3.519
   88   1HB   GLU  12          HB2       GLU  12  12.997  -1.620   4.416
   89   2HB   GLU  12          HB1       GLU  12  12.796  -3.000   5.503
   90   1HG   GLU  12          HG2       GLU  12  15.094  -3.733   5.012
   91   2HG   GLU  12          HG1       GLU  12  15.299  -2.377   3.902
   92    H    LEU  13           HN       LEU  13  11.152  -1.882   2.523
   93    HA   LEU  13           HA       LEU  13   8.809  -3.064   3.714
   94   1HB   LEU  13          HB2       LEU  13   8.931  -0.678   3.147
   95   2HB   LEU  13          HB1       LEU  13   9.078  -1.076   1.438
   96    HG   LEU  13           HG       LEU  13   6.843  -2.119   1.484
   97   1HD1  LEU  13          HD11      LEU  13   6.495  -2.935   3.660
   98   2HD1  LEU  13          HD12      LEU  13   5.474  -1.500   3.650
   99   3HD1  LEU  13          HD13      LEU  13   7.062  -1.448   4.417
  100   1HD2  LEU  13          HD21      LEU  13   6.844   0.658   2.704
  101   2HD2  LEU  13          HD22      LEU  13   5.561  -0.050   1.722
  102   3HD2  LEU  13          HD23      LEU  13   7.128   0.314   0.999
  103    H    ILE  14           HN       ILE  14  10.112  -3.135   0.366
  104    HA   ILE  14           HA       ILE  14   7.989  -4.683  -0.740
  105    HB   ILE  14           HB       ILE  14  10.915  -4.483  -1.499
  106   1HG1  ILE  14          HG12      ILE  14   8.430  -3.395  -2.851
  107   2HG1  ILE  14          HG11      ILE  14   9.392  -2.468  -1.700
  108   1HG2  ILE  14          HG21      ILE  14  10.025  -5.440  -3.728
  109   2HG2  ILE  14          HG22      ILE  14   8.640  -5.995  -2.791
  110   3HG2  ILE  14          HG23      ILE  14  10.258  -6.576  -2.400
  111   1HD1  ILE  14          HD11      ILE  14  10.356  -3.628  -4.332
  112   2HD1  ILE  14          HD12      ILE  14  11.396  -2.828  -3.155
  113   3HD1  ILE  14          HD13      ILE  14  10.117  -1.920  -3.964
  114    H    GLU  15           HN       GLU  15  11.065  -5.740   0.755
  115    HA   GLU  15           HA       GLU  15  10.687  -8.525   0.325
  116   1HB   GLU  15          HB2       GLU  15  12.135  -7.030   2.524
  117   2HB   GLU  15          HB1       GLU  15  12.203  -8.783   2.335
  118   1HG   GLU  15          HG2       GLU  15  13.130  -8.545   0.089
  119   2HG   GLU  15          HG1       GLU  15  12.982  -6.789   0.187
  120    H    GLU  16           HN       GLU  16   9.594  -6.443   3.010
  121    HA   GLU  16           HA       GLU  16   8.467  -8.635   4.515
  122   1HB   GLU  16          HB2       GLU  16   9.052  -6.391   5.477
  123   2HB   GLU  16          HB1       GLU  16   7.675  -5.716   4.608
  124   1HG   GLU  16          HG2       GLU  16   6.158  -7.252   5.792
  125   2HG   GLU  16          HG1       GLU  16   7.531  -7.941   6.660
  126    H    LEU  17           HN       LEU  17   7.118  -6.323   2.152
  127    HA   LEU  17           HA       LEU  17   4.398  -7.194   2.386
  128   1HB   LEU  17          HB2       LEU  17   5.908  -5.987   0.053
  129   2HB   LEU  17          HB1       LEU  17   4.171  -6.266   0.045
  130    HG   LEU  17           HG       LEU  17   5.600  -4.588   2.126
  131   1HD1  LEU  17          HD11      LEU  17   5.845  -3.556  -0.071
  132   2HD1  LEU  17          HD12      LEU  17   4.653  -2.654   0.866
  133   3HD1  LEU  17          HD13      LEU  17   4.124  -3.770  -0.392
  134   1HD2  LEU  17          HD21      LEU  17   2.715  -5.255   1.537
  135   2HD2  LEU  17          HD22      LEU  17   3.113  -3.692   2.251
  136   3HD2  LEU  17          HD23      LEU  17   3.545  -5.176   3.092
  137    H    VAL  18           HN       VAL  18   7.077  -8.276   0.325
  138    HA   VAL  18           HA       VAL  18   5.529 -10.204  -1.148
  139    HB   VAL  18           HB       VAL  18   8.501  -9.971  -0.583
  140   1HG1  VAL  18          HG11      VAL  18   8.169 -12.287  -1.052
  141   2HG1  VAL  18          HG12      VAL  18   8.656 -11.569  -2.588
  142   3HG1  VAL  18          HG13      VAL  18   6.959 -11.937  -2.285
  143   1HG2  VAL  18          HG21      VAL  18   6.969  -9.527  -3.154
  144   2HG2  VAL  18          HG22      VAL  18   8.627  -9.051  -2.787
  145   3HG2  VAL  18          HG23      VAL  18   7.279  -8.231  -1.998
  146    H    ASN  19           HN       ASN  19   7.492 -10.410   1.805
  147    HA   ASN  19           HA       ASN  19   7.395 -13.218   2.155
  148   1HB   ASN  19          HB2       ASN  19   7.561 -10.949   4.145
  149   2HB   ASN  19          HB1       ASN  19   7.694 -12.641   4.620
  150   1HD2  ASN  19          HD21      ASN  19   9.879 -10.820   4.960
  151   2HD2  ASN  19          HD22      ASN  19  11.131 -11.285   3.911
  152    H    ILE  20           HN       ILE  20   5.069 -10.733   3.213
  153    HA   ILE  20           HA       ILE  20   3.445 -12.683   4.637
  154    HB   ILE  20           HB       ILE  20   1.903 -10.796   4.995
  155   1HG1  ILE  20          HG12      ILE  20   3.834  -9.281   3.214
  156   2HG1  ILE  20          HG11      ILE  20   2.197  -9.742   2.760
  157   1HG2  ILE  20          HG21      ILE  20   4.775  -9.888   5.299
  158   2HG2  ILE  20          HG22      ILE  20   4.059 -11.141   6.313
  159   3HG2  ILE  20          HG23      ILE  20   3.407  -9.503   6.343
  160   1HD1  ILE  20          HD11      ILE  20   2.196  -7.423   3.532
  161   2HD1  ILE  20          HD12      ILE  20   2.966  -7.904   5.044
  162   3HD1  ILE  20          HD13      ILE  20   1.322  -8.430   4.687
  163    H    THR  21           HN       THR  21   3.489 -11.623   1.304
  164    HA   THR  21           HA       THR  21   0.691 -12.591   0.920
  165    HB   THR  21           HB       THR  21   0.916 -11.709  -1.372
  166    HG1  THR  21           HG1      THR  21   3.488 -10.904  -0.488
  167   1HG2  THR  21          HG21      THR  21   0.706  -9.467  -0.780
  168   2HG2  THR  21          HG22      THR  21   1.960  -9.566   0.450
  169   3HG2  THR  21          HG23      THR  21   0.373 -10.274   0.750
  170    H    GLN  22           HN       GLN  22   3.965 -13.641   0.408
  171    HA   GLN  22           HA       GLN  22   3.299 -15.554  -1.675
  172   1HB   GLN  22          HB2       GLN  22   5.692 -15.218   0.139
  173   2HB   GLN  22          HB1       GLN  22   5.573 -16.523  -1.044
  174   1HG   GLN  22          HG2       GLN  22   5.261 -14.876  -2.847
  175   2HG   GLN  22          HG1       GLN  22   5.371 -13.564  -1.677
  176   1HE2  GLN  22          HE21      GLN  22   7.494 -15.563  -0.328
  177   2HE2  GLN  22          HE22      GLN  22   8.914 -15.171  -1.172
  178    H    ASN  23           HN       ASN  23   3.551 -15.699   1.851
  179    HA   ASN  23           HA       ASN  23   2.876 -18.598   1.802
  180   1HB   ASN  23          HB2       ASN  23   3.359 -18.494   4.223
  181   2HB   ASN  23          HB1       ASN  23   4.707 -17.888   3.260
  182   1HD2  ASN  23          HD21      ASN  23   4.867 -16.915   5.731
  183   2HD2  ASN  23          HD22      ASN  23   4.270 -15.332   5.861
  184    H    GLN  24           HN       GLN  24   0.994 -15.945   1.556
  185    HA   GLN  24           HA       GLN  24  -0.856 -16.532   3.761
  186   1HB   GLN  24          HB2       GLN  24  -2.172 -14.721   2.975
  187   2HB   GLN  24          HB1       GLN  24  -0.506 -14.225   2.709
  188   1HG   GLN  24          HG2       GLN  24  -0.740 -15.080   0.329
  189   2HG   GLN  24          HG1       GLN  24  -2.465 -15.269   0.647
  190   1HE2  GLN  24          HE21      GLN  24  -2.213 -13.519  -1.285
  191   2HE2  GLN  24          HE22      GLN  24  -2.267 -11.905  -0.763
  192    H    LYS  25           HN       LYS  25  -2.473 -18.002   3.697
  193    HA   LYS  25           HA       LYS  25  -2.962 -19.460   1.165
  194   1HB   LYS  25          HB2       LYS  25  -2.664 -20.732   3.279
  195   2HB   LYS  25          HB1       LYS  25  -4.070 -19.911   3.957
  196   1HG   LYS  25          HG2       LYS  25  -5.500 -20.858   2.202
  197   2HG   LYS  25          HG1       LYS  25  -4.103 -21.643   1.467
  198   1HD   LYS  25          HD2       LYS  25  -3.747 -22.898   3.609
  199   2HD   LYS  25          HD1       LYS  25  -5.243 -22.196   4.225
  200   1HE   LYS  25          HE2       LYS  25  -5.787 -24.368   3.330
  201   2HE   LYS  25          HE1       LYS  25  -6.422 -23.165   2.207
  202   1HZ   LYS  25          HZ1       LYS  25  -4.859 -23.651   0.651
  203   2HZ   LYS  25          HZ2       LYS  25  -4.975 -25.179   1.386
  204   3HZ   LYS  25          HZ3       LYS  25  -3.696 -24.134   1.787
  205    H    ALA  26           HN       ALA  26  -5.321 -18.600   3.679
  206    HA   ALA  26           HA       ALA  26  -7.246 -17.844   1.601
  207   1HB   ALA  26          HB1       ALA  26  -8.386 -18.866   3.351
  208   2HB   ALA  26          HB2       ALA  26  -8.532 -17.188   3.878
  209   3HB   ALA  26          HB3       ALA  26  -7.287 -18.226   4.569
  210    HA   PRO  27           HA       PRO  27  -6.385 -13.491   1.383
  211   1HB   PRO  27          HB2       PRO  27  -9.099 -12.790   2.329
  212   2HB   PRO  27          HB1       PRO  27  -8.335 -12.453   0.772
  213   1HG   PRO  27          HG2       PRO  27 -10.325 -14.393   1.250
  214   2HG   PRO  27          HG1       PRO  27  -9.327 -14.266  -0.202
  215   1HD   PRO  27          HD2       PRO  27  -9.238 -16.331   1.846
  216   2HD   PRO  27          HD1       PRO  27  -8.284 -16.228   0.346
  217    H    LEU  28           HN       LEU  28  -5.589 -11.919   2.834
  218    HA   LEU  28           HA       LEU  28  -5.363 -12.611   5.602
  219   1HB   LEU  28          HB2       LEU  28  -4.964  -9.919   4.261
  220   2HB   LEU  28          HB1       LEU  28  -4.387 -10.353   5.871
  221    HG   LEU  28           HG       LEU  28  -3.589 -11.759   3.303
  222   1HD1  LEU  28          HD11      LEU  28  -1.932  -9.923   5.054
  223   2HD1  LEU  28          HD12      LEU  28  -2.750  -9.388   3.585
  224   3HD1  LEU  28          HD13      LEU  28  -1.481 -10.610   3.493
  225   1HD2  LEU  28          HD21      LEU  28  -2.954 -12.176   6.222
  226   2HD2  LEU  28          HD22      LEU  28  -1.724 -12.551   5.016
  227   3HD2  LEU  28          HD23      LEU  28  -3.279 -13.374   4.969
  228    H    CYS  29           HN       CYS  29  -7.321 -10.105   3.984
  229    HA   CYS  29           HA       CYS  29  -8.753  -9.530   6.491
  230   1HB   CYS  29          HB2       CYS  29  -8.997  -8.501   3.655
  231   2HB   CYS  29          HB1       CYS  29 -10.145  -8.057   4.917
  232    H    ASN  30           HN       ASN  30 -11.180  -9.720   6.540
  233    HA   ASN  30           HA       ASN  30 -12.008 -12.377   5.774
  234   1HB   ASN  30          HB2       ASN  30 -13.693 -10.008   6.655
  235   2HB   ASN  30          HB1       ASN  30 -14.242 -11.682   6.575
  236   1HD2  ASN  30          HD21      ASN  30 -12.402 -13.201   7.763
  237   2HD2  ASN  30          HD22      ASN  30 -12.004 -12.662   9.322
  238    H    GLY  31           HN       GLY  31 -11.089 -11.168   3.454
  239   1HA   GLY  31          HA2       GLY  31 -11.781 -11.074   1.200
  240   2HA   GLY  31          HA1       GLY  31 -13.433 -11.394   1.736
  241    H    SER  32           HN       SER  32 -11.623  -8.802   3.196
  242    HA   SER  32           HA       SER  32 -13.632  -6.868   2.623
  243   1HB   SER  32          HB2       SER  32 -10.720  -6.417   3.344
  244   2HB   SER  32          HB1       SER  32 -11.996  -5.204   3.422
  245    HG   SER  32           HG       SER  32 -12.584  -6.025   5.256
  246    H    MET  33           HN       MET  33 -13.718  -5.212   1.123
  247    HA   MET  33           HA       MET  33 -12.008  -5.557  -1.319
  248   1HB   MET  33          HB2       MET  33 -14.765  -4.319  -0.981
  249   2HB   MET  33          HB1       MET  33 -13.904  -4.518  -2.503
  250   1HG   MET  33          HG2       MET  33 -14.593  -6.831  -0.683
  251   2HG   MET  33          HG1       MET  33 -15.623  -6.319  -2.019
  252   1HE   MET  33          HE1       MET  33 -15.074  -6.112  -4.256
  253   2HE   MET  33          HE2       MET  33 -13.967  -7.138  -5.162
  254   3HE   MET  33          HE3       MET  33 -13.394  -5.615  -4.493
  255    H    VAL  34           HN       VAL  34 -11.130  -3.602  -2.256
  256    HA   VAL  34           HA       VAL  34 -11.361  -1.126  -0.566
  257    HB   VAL  34           HB       VAL  34  -8.904  -0.739  -1.198
  258   1HG1  VAL  34          HG11      VAL  34  -8.108  -2.219   0.650
  259   2HG1  VAL  34          HG12      VAL  34  -9.684  -3.012   0.650
  260   3HG1  VAL  34          HG13      VAL  34  -9.555  -1.304   1.063
  261   1HG2  VAL  34          HG21      VAL  34  -8.824  -2.485  -2.958
  262   2HG2  VAL  34          HG22      VAL  34  -9.095  -3.723  -1.732
  263   3HG2  VAL  34          HG23      VAL  34  -7.613  -2.769  -1.710
  264    H    TRP  35           HN       TRP  35 -10.842   0.856  -1.744
  265    HA   TRP  35           HA       TRP  35 -12.032   0.897  -4.387
  266   1HB   TRP  35          HB2       TRP  35 -10.546   2.989  -2.781
  267   2HB   TRP  35          HB1       TRP  35 -11.279   3.318  -4.345
  268    HD1  TRP  35           HD1      TRP  35 -12.086   2.846  -0.696
  269    HE1  TRP  35           HE1      TRP  35 -14.586   3.320  -0.307
  270    HE3  TRP  35           HE3      TRP  35 -13.696   3.121  -5.537
  271    HZ2  TRP  35           HZ2      TRP  35 -16.962   3.746  -1.843
  272    HZ3  TRP  35           HZ3      TRP  35 -16.083   3.551  -6.041
  273    HH2  TRP  35           HH2      TRP  35 -17.716   3.871  -4.203
  274    H    SER  36           HN       SER  36 -10.999   0.845  -6.354
  275    HA   SER  36           HA       SER  36  -8.179   0.165  -6.449
  276   1HB   SER  36          HB2       SER  36  -8.471   0.093  -8.850
  277   2HB   SER  36          HB1       SER  36  -9.906  -0.617  -8.117
  278    HG   SER  36           HG       SER  36 -10.230   2.025  -8.320
  279    H    ILE  37           HN       ILE  37  -6.479   1.487  -7.317
  280    HA   ILE  37           HA       ILE  37  -7.093   4.407  -7.602
  281    HB   ILE  37           HB       ILE  37  -4.998   4.914  -6.357
  282   1HG1  ILE  37          HG12      ILE  37  -5.064   2.031  -5.435
  283   2HG1  ILE  37          HG11      ILE  37  -4.024   2.561  -6.753
  284   1HG2  ILE  37          HG21      ILE  37  -5.902   4.347  -4.102
  285   2HG2  ILE  37          HG22      ILE  37  -7.082   3.289  -4.876
  286   3HG2  ILE  37          HG23      ILE  37  -7.123   5.025  -5.179
  287   1HD1  ILE  37          HD11      ILE  37  -3.009   2.553  -4.382
  288   2HD1  ILE  37          HD12      ILE  37  -4.006   3.975  -4.087
  289   3HD1  ILE  37          HD13      ILE  37  -2.781   4.005  -5.355
  290    H    ASN  38           HN       ASN  38  -5.392   5.569  -8.802
  291    HA   ASN  38           HA       ASN  38  -4.256   3.846 -10.926
  292   1HB   ASN  38          HB2       ASN  38  -4.419   6.858 -10.569
  293   2HB   ASN  38          HB1       ASN  38  -3.614   6.078 -11.933
  294   1HD2  ASN  38          HD21      ASN  38  -6.011   7.762 -12.155
  295   2HD2  ASN  38          HD22      ASN  38  -7.254   6.774 -12.755
  296    H    LEU  39           HN       LEU  39  -2.180   3.121 -10.727
  297    HA   LEU  39           HA       LEU  39  -0.496   4.149  -8.567
  298   1HB   LEU  39          HB2       LEU  39   0.013   2.064 -10.715
  299   2HB   LEU  39          HB1       LEU  39   1.154   2.456  -9.434
  300    HG   LEU  39           HG       LEU  39  -0.186   0.451  -8.883
  301   1HD1  LEU  39          HD11      LEU  39   0.567   2.270  -7.152
  302   2HD1  LEU  39          HD12      LEU  39  -0.540   0.998  -6.649
  303   3HD1  LEU  39          HD13      LEU  39  -1.161   2.602  -7.018
  304   1HD2  LEU  39          HD21      LEU  39  -2.253   1.448 -10.156
  305   2HD2  LEU  39          HD22      LEU  39  -2.632   2.187  -8.598
  306   3HD2  LEU  39          HD23      LEU  39  -2.518   0.435  -8.739
  307    H    THR  40           HN       THR  40   0.551   6.060  -8.892
  308    HA   THR  40           HA       THR  40   2.244   6.333 -11.301
  309    HB   THR  40           HB       THR  40   1.352   8.741 -11.568
  310    HG1  THR  40           HG1      THR  40  -1.076   8.408 -10.905
  311   1HG2  THR  40          HG21      THR  40   0.910   6.834 -13.143
  312   2HG2  THR  40          HG22      THR  40  -0.387   8.025 -13.084
  313   3HG2  THR  40          HG23      THR  40  -0.561   6.491 -12.234
  314    H    ALA  41           HN       ALA  41   1.143   8.856  -9.057
  315    HA   ALA  41           HA       ALA  41   3.932   8.975  -7.935
  316   1HB   ALA  41          HB1       ALA  41   3.491  10.931  -9.316
  317   2HB   ALA  41          HB2       ALA  41   3.488  11.414  -7.619
  318   3HB   ALA  41          HB3       ALA  41   1.962  11.217  -8.481
  319    H    GLY  42           HN       GLY  42   0.650  10.174  -7.105
  320   1HA   GLY  42          HA2       GLY  42   1.187  10.085  -4.272
  321   2HA   GLY  42          HA1       GLY  42  -0.405  10.283  -5.004
  322    H    MET  43           HN       MET  43   1.802   7.570  -5.539
  323    HA   MET  43           HA       MET  43  -0.186   5.570  -5.250
  324   1HB   MET  43          HB2       MET  43   2.810   5.434  -4.864
  325   2HB   MET  43          HB1       MET  43   1.770   4.028  -5.030
  326   1HG   MET  43          HG2       MET  43   1.350   4.454  -7.281
  327   2HG   MET  43          HG1       MET  43   1.681   6.175  -7.133
  328   1HE   MET  43          HE1       MET  43   4.842   2.853  -6.873
  329   2HE   MET  43          HE2       MET  43   3.098   2.672  -6.698
  330   3HE   MET  43          HE3       MET  43   4.023   3.491  -5.443
  331    H    TYR  44           HN       TYR  44   2.366   6.533  -2.930
  332    HA   TYR  44           HA       TYR  44   1.482   4.821  -0.816
  333   1HB   TYR  44          HB2       TYR  44   3.048   7.415  -0.715
  334   2HB   TYR  44          HB1       TYR  44   2.891   6.278   0.623
  335    HD1  TYR  44           HD1      TYR  44   4.021   4.121   0.596
  336    HD2  TYR  44           HD2      TYR  44   4.326   6.818  -2.736
  337    HE1  TYR  44           HE1      TYR  44   5.878   2.769  -0.331
  338    HE2  TYR  44           HE2      TYR  44   6.187   5.463  -3.660
  339    HH   TYR  44           HH       TYR  44   6.841   2.756  -3.303
  340    H    CYS  45           HN       CYS  45   0.808   8.244  -1.516
  341    HA   CYS  45           HA       CYS  45  -0.826   8.695   0.808
  342   1HB   CYS  45          HB2       CYS  45  -1.165  10.148  -1.814
  343   2HB   CYS  45          HB1       CYS  45  -1.346  10.774  -0.173
  344    H    ALA  46           HN       ALA  46  -1.702   8.112  -2.607
  345    HA   ALA  46           HA       ALA  46  -4.511   7.912  -2.212
  346   1HB   ALA  46          HB1       ALA  46  -4.565   6.857  -4.390
  347   2HB   ALA  46          HB2       ALA  46  -2.863   6.409  -4.267
  348   3HB   ALA  46          HB3       ALA  46  -3.321   8.106  -4.428
  349    H    ALA  47           HN       ALA  47  -1.997   5.388  -2.235
  350    HA   ALA  47           HA       ALA  47  -3.785   3.204  -1.834
  351   1HB   ALA  47          HB1       ALA  47  -1.763   1.975  -1.049
  352   2HB   ALA  47          HB2       ALA  47  -0.873   3.496  -1.043
  353   3HB   ALA  47          HB3       ALA  47  -1.478   2.837  -2.562
  354    H    LEU  48           HN       LEU  48  -2.097   5.317   0.459
  355    HA   LEU  48           HA       LEU  48  -2.696   3.870   2.815
  356   1HB   LEU  48          HB2       LEU  48  -1.103   5.748   2.745
  357   2HB   LEU  48          HB1       LEU  48  -2.430   6.868   2.449
  358    HG   LEU  48           HG       LEU  48  -3.434   6.245   4.638
  359   1HD1  LEU  48          HD11      LEU  48  -1.710   4.995   6.188
  360   2HD1  LEU  48          HD12      LEU  48  -1.072   4.374   4.668
  361   3HD1  LEU  48          HD13      LEU  48  -2.748   4.057   5.118
  362   1HD2  LEU  48          HD21      LEU  48  -1.767   8.129   4.387
  363   2HD2  LEU  48          HD22      LEU  48  -0.509   7.011   4.913
  364   3HD2  LEU  48          HD23      LEU  48  -1.825   7.434   6.007
  365    H    GLU  49           HN       GLU  49  -4.585   6.570   1.332
  366    HA   GLU  49           HA       GLU  49  -6.658   6.549   3.277
  367   1HB   GLU  49          HB2       GLU  49  -8.102   7.495   1.378
  368   2HB   GLU  49          HB1       GLU  49  -6.646   8.400   1.791
  369   1HG   GLU  49          HG2       GLU  49  -5.438   7.310  -0.053
  370   2HG   GLU  49          HG1       GLU  49  -6.889   6.394  -0.467
  371    H    SER  50           HN       SER  50  -6.193   4.575   0.380
  372    HA   SER  50           HA       SER  50  -8.784   3.360   0.389
  373   1HB   SER  50          HB2       SER  50  -7.817   1.669  -1.023
  374   2HB   SER  50          HB1       SER  50  -7.019   3.184  -1.435
  375    HG   SER  50           HG       SER  50  -5.937   0.924  -0.554
  376    H    LEU  51           HN       LEU  51  -5.781   2.598   2.099
  377    HA   LEU  51           HA       LEU  51  -6.745   0.159   3.296
  378   1HB   LEU  51          HB2       LEU  51  -4.527   2.073   4.051
  379   2HB   LEU  51          HB1       LEU  51  -4.822   0.565   4.905
  380    HG   LEU  51           HG       LEU  51  -4.326   0.722   1.914
  381   1HD1  LEU  51          HD11      LEU  51  -2.030   0.063   2.386
  382   2HD1  LEU  51          HD12      LEU  51  -2.370   0.002   4.115
  383   3HD1  LEU  51          HD13      LEU  51  -2.388   1.547   3.268
  384   1HD2  LEU  51          HD21      LEU  51  -5.339  -1.367   2.329
  385   2HD2  LEU  51          HD22      LEU  51  -4.616  -1.515   3.930
  386   3HD2  LEU  51          HD23      LEU  51  -3.630  -1.754   2.489
  387    H    ILE  52           HN       ILE  52  -6.829   3.567   4.263
  388    HA   ILE  52           HA       ILE  52  -7.578   3.267   6.968
  389    HB   ILE  52           HB       ILE  52  -8.499   5.350   4.958
  390   1HG1  ILE  52          HG12      ILE  52  -6.086   5.355   5.204
  391   2HG1  ILE  52          HG11      ILE  52  -6.749   6.752   6.028
  392   1HG2  ILE  52          HG21      ILE  52  -8.649   5.299   7.982
  393   2HG2  ILE  52          HG22      ILE  52  -9.998   5.396   6.849
  394   3HG2  ILE  52          HG23      ILE  52  -8.881   6.750   7.009
  395   1HD1  ILE  52          HD11      ILE  52  -6.715   5.143   8.131
  396   2HD1  ILE  52          HD12      ILE  52  -5.246   5.967   7.618
  397   3HD1  ILE  52          HD13      ILE  52  -5.504   4.281   7.183
  398    H    ASN  53           HN       ASN  53  -9.403   2.560   4.093
  399    HA   ASN  53           HA       ASN  53 -12.002   2.608   5.448
  400   1HB   ASN  53          HB2       ASN  53 -11.085   1.509   2.777
  401   2HB   ASN  53          HB1       ASN  53 -12.755   1.426   3.335
  402   1HD2  ASN  53          HD21      ASN  53 -13.344   3.848   4.366
  403   2HD2  ASN  53          HD22      ASN  53 -13.044   5.102   3.260
  404    H    VAL  54           HN       VAL  54  -9.400   0.365   5.056
  405    HA   VAL  54           HA       VAL  54 -11.080  -1.976   5.745
  406    HB   VAL  54           HB       VAL  54  -8.123  -1.684   5.139
  407   1HG1  VAL  54          HG11      VAL  54  -8.330  -3.555   6.612
  408   2HG1  VAL  54          HG12      VAL  54  -8.274  -4.225   4.982
  409   3HG1  VAL  54          HG13      VAL  54  -9.816  -4.092   5.830
  410   1HG2  VAL  54          HG21      VAL  54 -10.190  -3.172   3.517
  411   2HG2  VAL  54          HG22      VAL  54  -8.631  -2.525   3.000
  412   3HG2  VAL  54          HG23      VAL  54  -9.980  -1.433   3.315
  413    H    SER  55           HN       SER  55 -11.449  -2.442   7.841
  414    HA   SER  55           HA       SER  55  -9.355  -1.764   9.887
  415   1HB   SER  55          HB2       SER  55 -12.364  -1.529  10.183
  416   2HB   SER  55          HB1       SER  55 -11.187  -1.262  11.466
  417    HG   SER  55           HG       SER  55 -11.162   0.130   8.994
  418    H    GLY  56           HN       GLY  56  -9.190  -3.270  11.612
  419   1HA   GLY  56          HA2       GLY  56  -9.800  -5.268  12.816
  420   2HA   GLY  56          HA1       GLY  56 -10.870  -5.721  11.489
  421    H    CYS  57           HN       CYS  57  -8.298  -4.776   9.821
  422    HA   CYS  57           HA       CYS  57  -7.166  -7.535   9.717
  423   1HB   CYS  57          HB2       CYS  57  -6.933  -5.164   7.841
  424   2HB   CYS  57          HB1       CYS  57  -6.117  -6.707   7.596
  425    H    SER  58           HN       SER  58  -5.832  -7.372  11.617
  426    HA   SER  58           HA       SER  58  -3.895  -5.243  11.949
  427   1HB   SER  58          HB2       SER  58  -4.780  -6.718  13.807
  428   2HB   SER  58          HB1       SER  58  -3.800  -8.025  13.147
  429    HG   SER  58           HG       SER  58  -2.041  -6.325  13.305
  430    H    ALA  59           HN       ALA  59  -3.868  -8.406  10.420
  431    HA   ALA  59           HA       ALA  59  -1.167  -8.954  10.121
  432   1HB   ALA  59          HB1       ALA  59  -1.758  -9.991   7.939
  433   2HB   ALA  59          HB2       ALA  59  -3.325  -9.184   8.004
  434   3HB   ALA  59          HB3       ALA  59  -2.911 -10.405   9.209
  435    H    ILE  60           HN       ILE  60  -2.748  -6.130   9.047
  436    HA   ILE  60           HA       ILE  60  -0.365  -5.413   7.366
  437    HB   ILE  60           HB       ILE  60  -1.885  -4.115   5.908
  438   1HG1  ILE  60          HG12      ILE  60  -4.107  -5.509   7.442
  439   2HG1  ILE  60          HG11      ILE  60  -3.701  -3.801   7.609
  440   1HG2  ILE  60          HG21      ILE  60  -2.678  -7.032   6.178
  441   2HG2  ILE  60          HG22      ILE  60  -1.239  -6.448   5.343
  442   3HG2  ILE  60          HG23      ILE  60  -2.839  -6.038   4.729
  443   1HD1  ILE  60          HD11      ILE  60  -5.468  -3.827   6.036
  444   2HD1  ILE  60          HD12      ILE  60  -4.808  -5.227   5.192
  445   3HD1  ILE  60          HD13      ILE  60  -4.013  -3.659   5.052
  446    H    GLU  61           HN       GLU  61  -1.512  -4.872  10.245
  447    HA   GLU  61           HA       GLU  61  -2.120  -2.089  10.419
  448   1HB   GLU  61          HB2       GLU  61  -2.229  -3.853  12.284
  449   2HB   GLU  61          HB1       GLU  61  -0.501  -3.619  12.476
  450   1HG   GLU  61          HG2       GLU  61  -0.909  -1.199  12.812
  451   2HG   GLU  61          HG1       GLU  61  -2.643  -1.499  12.705
  452    H    LYS  62           HN       LYS  62   0.927  -3.858  10.613
  453    HA   LYS  62           HA       LYS  62   2.656  -1.613  10.949
  454   1HB   LYS  62          HB2       LYS  62   3.110  -4.342   9.727
  455   2HB   LYS  62          HB1       LYS  62   4.406  -3.174   9.992
  456   1HG   LYS  62          HG2       LYS  62   3.848  -3.103  12.397
  457   2HG   LYS  62          HG1       LYS  62   2.564  -4.284  12.131
  458   1HD   LYS  62          HD2       LYS  62   4.218  -5.920  11.327
  459   2HD   LYS  62          HD1       LYS  62   5.509  -4.742  11.568
  460   1HE   LYS  62          HE2       LYS  62   4.956  -4.648  13.982
  461   2HE   LYS  62          HE1       LYS  62   3.699  -5.861  13.730
  462   1HZ   LYS  62          HZ1       LYS  62   6.014  -6.619  14.499
  463   2HZ   LYS  62          HZ2       LYS  62   6.473  -6.379  12.880
  464   3HZ   LYS  62          HZ3       LYS  62   5.247  -7.492  13.263
  465    H    THR  63           HN       THR  63   1.408  -3.215   8.038
  466    HA   THR  63           HA       THR  63   2.977  -1.808   6.139
  467    HB   THR  63           HB       THR  63   0.127  -2.802   5.868
  468    HG1  THR  63           HG1      THR  63   1.072  -4.671   5.174
  469   1HG2  THR  63          HG21      THR  63   0.740  -2.922   3.436
  470   2HG2  THR  63          HG22      THR  63   2.219  -2.043   3.817
  471   3HG2  THR  63          HG23      THR  63   0.650  -1.279   4.068
  472    H    GLN  64           HN       GLN  64  -0.143  -0.960   7.638
  473    HA   GLN  64           HA       GLN  64  -0.564   1.423   6.127
  474   1HB   GLN  64          HB2       GLN  64  -1.438   0.630   8.915
  475   2HB   GLN  64          HB1       GLN  64  -1.982   2.107   8.115
  476   1HG   GLN  64          HG2       GLN  64  -2.966   0.842   6.305
  477   2HG   GLN  64          HG1       GLN  64  -2.281  -0.663   6.920
  478   1HE2  GLN  64          HE21      GLN  64  -5.153  -0.129   6.542
  479   2HE2  GLN  64          HE22      GLN  64  -5.875  -0.239   8.074
  480    H    ARG  65           HN       ARG  65   1.235   0.841   9.143
  481    HA   ARG  65           HA       ARG  65   1.834   3.601   9.672
  482   1HB   ARG  65          HB2       ARG  65   3.271   1.048  10.452
  483   2HB   ARG  65          HB1       ARG  65   3.688   2.645  11.076
  484   1HG   ARG  65          HG2       ARG  65   1.440   2.907  12.003
  485   2HG   ARG  65          HG1       ARG  65   0.958   1.353  11.323
  486   1HD   ARG  65          HD2       ARG  65   1.561   1.185  13.735
  487   2HD   ARG  65          HD1       ARG  65   2.597   0.193  12.709
  488    HE   ARG  65           HE       ARG  65   3.977   2.580  12.902
  489   1HH1  ARG  65          HH21      ARG  65   2.521   0.374  15.112
  490   2HH1  ARG  65          HH22      ARG  65   3.683   0.654  16.366
  491   1HH2  ARG  65          HH11      ARG  65   5.502   2.963  14.522
  492   2HH2  ARG  65          HH12      ARG  65   5.373   2.119  16.031
  493    H    MET  66           HN       MET  66   3.744   1.042   8.055
  494    HA   MET  66           HA       MET  66   5.988   2.689   7.461
  495   1HB   MET  66          HB2       MET  66   4.951   0.180   6.129
  496   2HB   MET  66          HB1       MET  66   6.472   0.954   5.679
  497   1HG   MET  66          HG2       MET  66   7.251   0.775   8.021
  498   2HG   MET  66          HG1       MET  66   5.747  -0.033   8.455
  499   1HE   MET  66          HE1       MET  66   4.886  -2.016   7.618
  500   2HE   MET  66          HE2       MET  66   5.791  -3.410   7.038
  501   3HE   MET  66          HE3       MET  66   5.260  -2.178   5.898
  502    H    LEU  67           HN       LEU  67   3.023   2.079   5.582
  503    HA   LEU  67           HA       LEU  67   3.832   3.438   3.210
  504   1HB   LEU  67          HB2       LEU  67   1.103   3.119   4.478
  505   2HB   LEU  67          HB1       LEU  67   1.344   3.841   2.892
  506    HG   LEU  67           HG       LEU  67   2.308   1.064   3.631
  507   1HD1  LEU  67          HD11      LEU  67   0.335   0.272   2.331
  508   2HD1  LEU  67          HD12      LEU  67  -0.225   1.940   2.208
  509   3HD1  LEU  67          HD13      LEU  67  -0.136   1.153   3.784
  510   1HD2  LEU  67          HD21      LEU  67   2.207   2.690   1.088
  511   2HD2  LEU  67          HD22      LEU  67   2.131   0.933   1.005
  512   3HD2  LEU  67          HD23      LEU  67   3.530   1.716   1.727
  513    H    SER  68           HN       SER  68   2.384   4.629   6.213
  514    HA   SER  68           HA       SER  68   1.955   7.320   5.407
  515   1HB   SER  68          HB2       SER  68   2.702   6.207   8.130
  516   2HB   SER  68          HB1       SER  68   2.135   7.849   7.845
  517    HG   SER  68           HG       SER  68   0.176   7.108   7.695
  518    H    GLY  69           HN       GLY  69   4.836   5.692   6.686
  519   1HA   GLY  69          HA2       GLY  69   6.506   7.931   7.068
  520   2HA   GLY  69          HA1       GLY  69   7.093   6.333   6.610
  521    H    PHE  70           HN       PHE  70   5.373   6.495   4.091
  522    HA   PHE  70           HA       PHE  70   7.391   7.970   2.486
  523   1HB   PHE  70          HB2       PHE  70   5.208   5.989   1.808
  524   2HB   PHE  70          HB1       PHE  70   6.055   6.899   0.557
  525    HD1  PHE  70           HD1      PHE  70   8.445   6.556   0.142
  526    HD2  PHE  70           HD2      PHE  70   6.350   4.264   3.105
  527    HE1  PHE  70           HE1      PHE  70  10.323   4.956   0.217
  528    HE2  PHE  70           HE2      PHE  70   8.237   2.654   3.189
  529    HZ   PHE  70           HZ       PHE  70  10.225   3.000   1.747
  530    H    CYS  71           HN       CYS  71   4.179   8.378   3.680
  531    HA   CYS  71           HA       CYS  71   3.943  10.881   2.091
  532   1HB   CYS  71          HB2       CYS  71   2.665   9.027   0.940
  533   2HB   CYS  71          HB1       CYS  71   1.617   8.979   2.359
  534    HA   PRO  72           HA       PRO  72   3.091  11.688   6.615
  535   1HB   PRO  72          HB2       PRO  72   3.275  14.460   5.520
  536   2HB   PRO  72          HB1       PRO  72   4.089  13.751   6.923
  537   1HG   PRO  72          HG2       PRO  72   5.405  14.272   4.622
  538   2HG   PRO  72          HG1       PRO  72   5.825  12.890   5.647
  539   1HD   PRO  72          HD2       PRO  72   4.399  12.922   3.024
  540   2HD   PRO  72          HD1       PRO  72   5.413  11.640   3.742
  541    H    HIS  73           HN       HIS  73   0.959  11.134   4.649
  542    HA   HIS  73           HA       HIS  73  -0.925  13.384   4.928
  543   1HB   HIS  73          HB2       HIS  73  -0.492  11.375   3.015
  544   2HB   HIS  73          HB1       HIS  73  -2.023  10.925   3.747
  545    HD1  HIS  73           HD1      HIS  73  -3.995  12.581   3.498
  546    HD2  HIS  73           HD2      HIS  73  -0.512  13.805   1.578
  547    HE1  HIS  73           HE1      HIS  73  -4.670  14.481   1.987
  548    H    LYS  74           HN       LYS  74  -1.959  13.531   6.849
  549    HA   LYS  74           HA       LYS  74  -2.699  11.109   8.368
  550   1HB   LYS  74          HB2       LYS  74  -3.191  14.071   8.819
  551   2HB   LYS  74          HB1       LYS  74  -3.766  12.809   9.912
  552   1HG   LYS  74          HG2       LYS  74  -1.426  12.018  10.195
  553   2HG   LYS  74          HG1       LYS  74  -0.875  13.337   9.165
  554   1HD   LYS  74          HD2       LYS  74  -2.397  13.689  11.764
  555   2HD   LYS  74          HD1       LYS  74  -0.654  13.876  11.585
  556   1HE   LYS  74          HE2       LYS  74  -1.292  15.590   9.702
  557   2HE   LYS  74          HE1       LYS  74  -2.861  15.618  10.510
  558   1HZ   LYS  74          HZ1       LYS  74  -1.556  16.013  12.616
  559   2HZ   LYS  74          HZ2       LYS  74  -1.613  17.300  11.511
  560   3HZ   LYS  74          HZ3       LYS  74  -0.219  16.336  11.626
  561    H    VAL  75           HN       VAL  75  -4.205  10.079   6.991
  562    HA   VAL  75           HA       VAL  75  -6.500  11.668   5.970
  563    HB   VAL  75           HB       VAL  75  -7.002   9.238   4.983
  564   1HG1  VAL  75          HG11      VAL  75  -4.849  11.168   4.109
  565   2HG1  VAL  75          HG12      VAL  75  -6.500  11.043   3.508
  566   3HG1  VAL  75          HG13      VAL  75  -5.323   9.787   3.123
  567   1HG2  VAL  75          HG21      VAL  75  -5.099   7.843   4.769
  568   2HG2  VAL  75          HG22      VAL  75  -5.096   8.321   6.467
  569   3HG2  VAL  75          HG23      VAL  75  -4.001   9.102   5.328
  570    H    SER  76           HN       SER  76  -8.504  11.540   6.835
  571    HA   SER  76           HA       SER  76  -8.918   9.747   9.183
  572   1HB   SER  76          HB2       SER  76 -10.390  12.201   8.184
  573   2HB   SER  76          HB1       SER  76 -10.959  11.213   9.526
  574    HG   SER  76           HG       SER  76  -8.724  11.577  10.368
  575    H    ALA  77           HN       ALA  77 -10.971   8.556   9.306
  576    HA   ALA  77           HA       ALA  77 -11.573   7.107   6.934
  577   1HB   ALA  77          HB1       ALA  77 -13.462   7.399   9.275
  578   2HB   ALA  77          HB2       ALA  77 -12.001   6.415   9.361
  579   3HB   ALA  77          HB3       ALA  77 -13.267   6.013   8.201
  580    H    GLY  78           HN       GLY  78 -12.555  10.231   7.845
  581   1HA   GLY  78          HA2       GLY  78 -14.999  10.113   6.115
  582   2HA   GLY  78          HA1       GLY  78 -14.646  11.377   7.290
  583    H    GLN  79           HN       GLN  79 -11.842  11.661   6.467
  584    HA   GLN  79           HA       GLN  79 -12.314  13.384   4.108
  585   1HB   GLN  79          HB2       GLN  79  -9.947  13.010   5.966
  586   2HB   GLN  79          HB1       GLN  79  -9.927  14.099   4.578
  587   1HG   GLN  79          HG2       GLN  79 -11.982  14.238   6.802
  588   2HG   GLN  79          HG1       GLN  79 -10.526  15.231   6.747
  589   1HE2  GLN  79          HE21      GLN  79 -13.689  15.573   6.203
  590   2HE2  GLN  79          HE22      GLN  79 -13.686  16.619   4.866
  591    H    PHE  80           HN       PHE  80 -11.724  12.816   2.069
  592    HA   PHE  80           HA       PHE  80  -9.731  10.604   1.695
  593   1HB   PHE  80          HB2       PHE  80 -12.344  10.992   0.209
  594   2HB   PHE  80          HB1       PHE  80 -11.090   9.843  -0.255
  595    HD1  PHE  80           HD1      PHE  80 -13.807  10.566   2.057
  596    HD2  PHE  80           HD2      PHE  80 -10.485   7.963   1.270
  597    HE1  PHE  80           HE1      PHE  80 -14.708   8.925   3.686
  598    HE2  PHE  80           HE2      PHE  80 -11.386   6.318   2.898
  599    HZ   PHE  80           HZ       PHE  80 -13.496   6.803   4.102
  600    H    SER  81           HN       SER  81  -8.503  10.759  -0.259
  601    HA   SER  81           HA       SER  81  -8.576  13.472  -1.554
  602   1HB   SER  81          HB2       SER  81  -6.144  11.736  -1.093
  603   2HB   SER  81          HB1       SER  81  -6.171  13.381  -1.723
  604    HG   SER  81           HG       SER  81  -7.487  13.503   0.505
  605    H    SER  82           HN       SER  82  -7.844  10.006  -2.050
  606    HA   SER  82           HA       SER  82  -7.736  10.481  -4.988
  607   1HB   SER  82          HB2       SER  82  -5.944   9.149  -3.847
  608   2HB   SER  82          HB1       SER  82  -7.160   7.933  -3.462
  609    HG   SER  82           HG       SER  82  -6.064   7.450  -5.405
  610    H    LEU  83           HN       LEU  83 -10.081   9.530  -2.730
  611    HA   LEU  83           HA       LEU  83 -11.413   7.609  -4.539
  612   1HB   LEU  83          HB2       LEU  83 -12.464   8.906  -2.007
  613   2HB   LEU  83          HB1       LEU  83 -13.145   7.505  -2.826
  614    HG   LEU  83           HG       LEU  83 -10.495   7.688  -1.378
  615   1HD1  LEU  83          HD11      LEU  83 -12.754   7.241  -0.189
  616   2HD1  LEU  83          HD12      LEU  83 -11.422   6.131   0.132
  617   3HD1  LEU  83          HD13      LEU  83 -12.703   5.672  -0.988
  618   1HD2  LEU  83          HD21      LEU  83 -11.532   5.619  -3.319
  619   2HD2  LEU  83          HD22      LEU  83 -10.395   5.182  -2.045
  620   3HD2  LEU  83          HD23      LEU  83  -9.935   6.369  -3.260
  621    H    HIS  84           HN       HIS  84 -10.920  10.431  -5.424
  622    HA   HIS  84           HA       HIS  84 -13.518  11.753  -5.450
  623   1HB   HIS  84          HB2       HIS  84 -11.136  12.161  -7.285
  624   2HB   HIS  84          HB1       HIS  84 -12.488  13.274  -7.070
  625    HD1  HIS  84           HD1      HIS  84 -12.289  12.323  -3.827
  626    HD2  HIS  84           HD2      HIS  84  -9.564  14.408  -6.188
  627    HE1  HIS  84           HE1      HIS  84 -10.790  13.586  -2.235
  628    H    VAL  85           HN       VAL  85 -11.679   9.714  -7.673
  629    HA   VAL  85           HA       VAL  85 -13.704   9.845  -9.764
  630    HB   VAL  85           HB       VAL  85 -11.479   7.813  -9.426
  631   1HG1  VAL  85          HG11      VAL  85 -13.190   7.295 -11.132
  632   2HG1  VAL  85          HG12      VAL  85 -11.639   7.680 -11.879
  633   3HG1  VAL  85          HG13      VAL  85 -12.934   8.878 -11.866
  634   1HG2  VAL  85          HG21      VAL  85 -10.415   9.956  -9.310
  635   2HG2  VAL  85          HG22      VAL  85 -11.472  10.622 -10.555
  636   3HG2  VAL  85          HG23      VAL  85 -10.245   9.430 -10.985
  637    H    ARG  86           HN       ARG  86 -15.290   8.262 -10.198
  638    HA   ARG  86           HA       ARG  86 -15.961   6.540  -7.884
  639   1HB   ARG  86          HB2       ARG  86 -17.447   7.233 -10.433
  640   2HB   ARG  86          HB1       ARG  86 -18.059   6.098  -9.227
  641   1HG   ARG  86          HG2       ARG  86 -17.929   7.862  -7.500
  642   2HG   ARG  86          HG1       ARG  86 -17.331   8.997  -8.710
  643   1HD   ARG  86          HD2       ARG  86 -19.422   8.714 -10.002
  644   2HD   ARG  86          HD1       ARG  86 -20.019   7.598  -8.775
  645    HE   ARG  86           HE       ARG  86 -19.390   9.895  -7.346
  646   1HH1  ARG  86          HH21      ARG  86 -21.290   9.090 -10.107
  647   2HH1  ARG  86          HH22      ARG  86 -22.449  10.350  -9.844
  648   1HH2  ARG  86          HH11      ARG  86 -20.892  11.557  -6.993
  649   2HH2  ARG  86          HH12      ARG  86 -22.231  11.736  -8.076
  650    H    ASP  87           HN       ASP  87 -13.927   5.274  -8.455
  651    HA   ASP  87           HA       ASP  87 -14.131   3.447 -10.749
  652   1HB   ASP  87          HB2       ASP  87 -12.175   3.710  -8.452
  653   2HB   ASP  87          HB1       ASP  87 -12.056   2.440  -9.671
  654    H    THR  88           HN       THR  88 -13.734   1.003 -10.115
  655    HA   THR  88           HA       THR  88 -15.904   0.293  -8.211
  656    HB   THR  88           HB       THR  88 -15.916  -1.839  -9.257
  657    HG1  THR  88           HG1      THR  88 -14.088  -2.689  -9.768
  658   1HG2  THR  88          HG21      THR  88 -16.771  -0.022 -10.700
  659   2HG2  THR  88          HG22      THR  88 -16.049  -1.316 -11.656
  660   3HG2  THR  88          HG23      THR  88 -15.160   0.182 -11.387
  661    H    LYS  89           HN       LYS  89 -15.480  -1.472  -6.629
  662    HA   LYS  89           HA       LYS  89 -12.857  -1.091  -5.340
  663   1HB   LYS  89          HB2       LYS  89 -15.254  -2.755  -4.497
  664   2HB   LYS  89          HB1       LYS  89 -13.817  -2.462  -3.523
  665   1HG   LYS  89          HG2       LYS  89 -14.271  -0.048  -3.539
  666   2HG   LYS  89          HG1       LYS  89 -15.713  -0.317  -4.518
  667   1HD   LYS  89          HD2       LYS  89 -16.667  -1.728  -2.728
  668   2HD   LYS  89          HD1       LYS  89 -15.229  -1.452  -1.746
  669   1HE   LYS  89          HE2       LYS  89 -17.019   0.059  -1.043
  670   2HE   LYS  89          HE1       LYS  89 -15.709   0.982  -1.772
  671   1HZ   LYS  89          HZ1       LYS  89 -17.019   0.779  -3.912
  672   2HZ   LYS  89          HZ2       LYS  89 -17.655   1.815  -2.726
  673   3HZ   LYS  89          HZ3       LYS  89 -18.324   0.271  -2.956
  674    H    ILE  90           HN       ILE  90 -11.447  -2.886  -4.817
  675    HA   ILE  90           HA       ILE  90 -11.853  -5.366  -6.461
  676    HB   ILE  90           HB       ILE  90  -9.386  -5.352  -6.868
  677   1HG1  ILE  90          HG12      ILE  90  -9.582  -2.555  -5.699
  678   2HG1  ILE  90          HG11      ILE  90  -8.766  -3.924  -4.945
  679   1HG2  ILE  90          HG21      ILE  90  -9.452  -3.711  -8.637
  680   2HG2  ILE  90          HG22      ILE  90 -10.737  -2.815  -7.827
  681   3HG2  ILE  90          HG23      ILE  90 -11.064  -4.413  -8.498
  682   1HD1  ILE  90          HD11      ILE  90  -7.104  -2.570  -6.089
  683   2HD1  ILE  90          HD12      ILE  90  -8.039  -2.615  -7.581
  684   3HD1  ILE  90          HD13      ILE  90  -7.290  -4.088  -6.965
  685    H    GLU  91           HN       GLU  91 -10.632  -7.247  -5.605
  686    HA   GLU  91           HA       GLU  91 -10.909  -7.539  -2.766
  687   1HB   GLU  91          HB2       GLU  91  -9.379  -9.173  -4.810
  688   2HB   GLU  91          HB1       GLU  91  -9.539  -9.637  -3.118
  689   1HG   GLU  91          HG2       GLU  91 -11.919  -9.068  -4.896
  690   2HG   GLU  91          HG1       GLU  91 -11.240 -10.682  -4.688
  691    H    VAL  92           HN       VAL  92  -9.370  -7.395  -1.103
  692    HA   VAL  92           HA       VAL  92  -7.214  -5.576  -1.428
  693    HB   VAL  92           HB       VAL  92  -7.693  -7.704   0.672
  694   1HG1  VAL  92          HG11      VAL  92  -5.358  -7.284   0.799
  695   2HG1  VAL  92          HG12      VAL  92  -6.068  -6.222   2.015
  696   3HG1  VAL  92          HG13      VAL  92  -5.568  -5.566   0.455
  697   1HG2  VAL  92          HG21      VAL  92  -7.953  -4.697   0.895
  698   2HG2  VAL  92          HG22      VAL  92  -8.604  -5.930   1.979
  699   3HG2  VAL  92          HG23      VAL  92  -9.291  -5.718   0.369
  700    H    ALA  93           HN       ALA  93  -7.265  -9.131  -1.534
  701    HA   ALA  93           HA       ALA  93  -4.528  -9.685  -1.571
  702   1HB   ALA  93          HB1       ALA  93  -6.418 -11.365  -1.683
  703   2HB   ALA  93          HB2       ALA  93  -5.057 -11.714  -2.748
  704   3HB   ALA  93          HB3       ALA  93  -6.534 -11.013  -3.409
  705    H    GLN  94           HN       GLN  94  -6.550  -8.660  -4.324
  706    HA   GLN  94           HA       GLN  94  -4.286  -8.699  -6.160
  707   1HB   GLN  94          HB2       GLN  94  -7.028  -7.425  -6.438
  708   2HB   GLN  94          HB1       GLN  94  -5.854  -7.620  -7.741
  709   1HG   GLN  94          HG2       GLN  94  -6.919  -9.939  -6.114
  710   2HG   GLN  94          HG1       GLN  94  -7.631  -9.427  -7.646
  711   1HE2  GLN  94          HE21      GLN  94  -5.951 -11.914  -6.787
  712   2HE2  GLN  94          HE22      GLN  94  -4.756 -12.010  -7.987
  713    H    PHE  95           HN       PHE  95  -5.833  -6.353  -4.071
  714    HA   PHE  95           HA       PHE  95  -4.743  -3.965  -5.179
  715   1HB   PHE  95          HB2       PHE  95  -6.461  -3.969  -3.403
  716   2HB   PHE  95          HB1       PHE  95  -5.285  -4.640  -2.272
  717    HD1  PHE  95           HD1      PHE  95  -6.339  -1.647  -4.106
  718    HD2  PHE  95           HD2      PHE  95  -3.376  -3.327  -1.496
  719    HE1  PHE  95           HE1      PHE  95  -5.494   0.626  -3.602
  720    HE2  PHE  95           HE2      PHE  95  -2.532  -1.056  -0.988
  721    HZ   PHE  95           HZ       PHE  95  -3.594   0.919  -2.044
  722    H    VAL  96           HN       VAL  96  -3.486  -6.105  -2.610
  723    HA   VAL  96           HA       VAL  96  -1.038  -4.679  -2.220
  724    HB   VAL  96           HB       VAL  96  -1.631  -7.624  -1.803
  725   1HG1  VAL  96          HG11      VAL  96   0.736  -7.339  -1.757
  726   2HG1  VAL  96          HG12      VAL  96   0.229  -7.314  -0.067
  727   3HG1  VAL  96          HG13      VAL  96   0.609  -5.806  -0.895
  728   1HG2  VAL  96          HG21      VAL  96  -1.689  -5.341   0.185
  729   2HG2  VAL  96          HG22      VAL  96  -2.181  -7.011   0.466
  730   3HG2  VAL  96          HG23      VAL  96  -3.129  -5.981  -0.607
  731    H    LYS  97           HN       LYS  97  -1.816  -7.513  -4.255
  732    HA   LYS  97           HA       LYS  97   0.807  -7.935  -5.258
  733   1HB   LYS  97          HB2       LYS  97  -1.908  -8.458  -6.489
  734   2HB   LYS  97          HB1       LYS  97  -0.397  -9.004  -7.215
  735   1HG   LYS  97          HG2       LYS  97   0.140 -10.261  -5.155
  736   2HG   LYS  97          HG1       LYS  97  -1.377  -9.716  -4.434
  737   1HD   LYS  97          HD2       LYS  97  -2.643 -10.828  -6.240
  738   2HD   LYS  97          HD1       LYS  97  -1.127 -11.376  -6.960
  739   1HE   LYS  97          HE2       LYS  97  -0.616 -12.739  -5.047
  740   2HE   LYS  97          HE1       LYS  97  -1.946 -12.042  -4.123
  741   1HZ   LYS  97          HZ1       LYS  97  -3.000 -13.017  -6.507
  742   2HZ   LYS  97          HZ2       LYS  97  -3.258 -13.606  -4.935
  743   3HZ   LYS  97          HZ3       LYS  97  -1.995 -14.233  -5.884
  744    H    ASP  98           HN       ASP  98  -1.851  -5.962  -6.645
  745    HA   ASP  98           HA       ASP  98  -0.407  -5.085  -8.937
  746   1HB   ASP  98          HB2       ASP  98  -2.642  -3.808  -7.344
  747   2HB   ASP  98          HB1       ASP  98  -2.020  -3.113  -8.840
  748    H    LEU  99           HN       LEU  99  -0.615  -3.709  -5.659
  749    HA   LEU  99           HA       LEU  99   0.981  -1.393  -6.214
  750   1HB   LEU  99          HB2       LEU  99  -0.406  -1.571  -4.188
  751   2HB   LEU  99          HB1       LEU  99   0.583  -2.911  -3.614
  752    HG   LEU  99           HG       LEU  99   2.558  -1.416  -3.516
  753   1HD1  LEU  99          HD11      LEU  99   1.958   1.114  -3.673
  754   2HD1  LEU  99          HD12      LEU  99   0.575   0.573  -4.623
  755   3HD1  LEU  99          HD13      LEU  99   2.215   0.227  -5.172
  756   1HD2  LEU  99          HD21      LEU  99   0.150  -0.241  -2.093
  757   2HD2  LEU  99          HD22      LEU  99   1.836  -0.113  -1.587
  758   3HD2  LEU  99          HD23      LEU  99   1.024  -1.678  -1.563
  759    H    LEU 100           HN       LEU 100   1.784  -4.685  -5.221
  760    HA   LEU 100           HA       LEU 100   4.495  -4.342  -4.550
  761   1HB   LEU 100          HB2       LEU 100   3.354  -6.423  -4.116
  762   2HB   LEU 100          HB1       LEU 100   3.079  -6.689  -5.834
  763    HG   LEU 100           HG       LEU 100   5.466  -6.951  -6.226
  764   1HD1  LEU 100          HD11      LEU 100   6.539  -5.469  -4.739
  765   2HD1  LEU 100          HD12      LEU 100   6.930  -7.050  -4.063
  766   3HD1  LEU 100          HD13      LEU 100   5.648  -6.076  -3.343
  767   1HD2  LEU 100          HD21      LEU 100   4.777  -8.543  -3.753
  768   2HD2  LEU 100          HD22      LEU 100   5.780  -9.038  -5.117
  769   3HD2  LEU 100          HD23      LEU 100   4.037  -8.861  -5.322
  770    H    LEU 101           HN       LEU 101   3.154  -5.068  -7.834
  771    HA   LEU 101           HA       LEU 101   5.716  -5.220  -9.085
  772   1HB   LEU 101          HB2       LEU 101   3.068  -4.290 -10.251
  773   2HB   LEU 101          HB1       LEU 101   4.511  -4.577 -11.208
  774    HG   LEU 101           HG       LEU 101   3.169  -6.538 -11.409
  775   1HD1  LEU 101          HD11      LEU 101   4.651  -8.219 -10.772
  776   2HD1  LEU 101          HD12      LEU 101   5.070  -7.425  -9.254
  777   3HD1  LEU 101          HD13      LEU 101   5.684  -6.792 -10.784
  778   1HD2  LEU 101          HD21      LEU 101   2.129  -7.701  -9.613
  779   2HD2  LEU 101          HD22      LEU 101   1.799  -5.995  -9.328
  780   3HD2  LEU 101          HD23      LEU 101   3.054  -6.819  -8.401
  781    H    HIS 102           HN       HIS 102   3.646  -2.407  -8.450
  782    HA   HIS 102           HA       HIS 102   5.348  -0.559  -9.856
  783   1HB   HIS 102          HB2       HIS 102   3.183  -0.242  -7.780
  784   2HB   HIS 102          HB1       HIS 102   4.126   1.150  -8.309
  785    HD1  HIS 102           HD1      HIS 102   3.808   1.970 -10.736
  786    HD2  HIS 102           HD2      HIS 102   1.450  -1.327  -9.778
  787    HE1  HIS 102           HE1      HIS 102   2.146   1.715 -12.622
  788    H    LEU 103           HN       LEU 103   5.256  -1.586  -6.437
  789    HA   LEU 103           HA       LEU 103   7.074   0.359  -5.455
  790   1HB   LEU 103          HB2       LEU 103   6.635  -2.511  -4.594
  791   2HB   LEU 103          HB1       LEU 103   7.633  -1.368  -3.700
  792    HG   LEU 103           HG       LEU 103   4.711  -0.913  -4.369
  793   1HD1  LEU 103          HD11      LEU 103   4.461  -1.328  -1.852
  794   2HD1  LEU 103          HD12      LEU 103   6.078  -2.030  -1.916
  795   3HD1  LEU 103          HD13      LEU 103   4.767  -2.746  -2.854
  796   1HD2  LEU 103          HD21      LEU 103   5.132   0.731  -2.324
  797   2HD2  LEU 103          HD22      LEU 103   5.552   1.224  -3.959
  798   3HD2  LEU 103          HD23      LEU 103   6.805   0.642  -2.867
  799    H    LYS 104           HN       LYS 104   7.831  -2.926  -6.695
  800    HA   LYS 104           HA       LYS 104  10.681  -2.535  -6.452
  801   1HB   LYS 104          HB2       LYS 104  10.872  -4.568  -7.820
  802   2HB   LYS 104          HB1       LYS 104   9.642  -4.774  -6.574
  803   1HG   LYS 104          HG2       LYS 104   7.909  -4.110  -8.272
  804   2HG   LYS 104          HG1       LYS 104   9.175  -4.125  -9.496
  805   1HD   LYS 104          HD2       LYS 104   8.021  -6.264  -9.550
  806   2HD   LYS 104          HD1       LYS 104   9.646  -6.517  -8.917
  807   1HE   LYS 104          HE2       LYS 104   8.882  -6.949  -6.764
  808   2HE   LYS 104          HE1       LYS 104   7.429  -5.971  -6.966
  809   1HZ   LYS 104          HZ1       LYS 104   7.631  -8.702  -7.205
  810   2HZ   LYS 104          HZ2       LYS 104   7.474  -8.142  -8.802
  811   3HZ   LYS 104          HZ3       LYS 104   6.303  -7.742  -7.639
  812    H    LYS 105           HN       LYS 105   8.336  -1.608  -8.827
  813    HA   LYS 105           HA       LYS 105  10.068  -1.365 -11.088
  814   1HB   LYS 105          HB2       LYS 105   7.576  -1.347 -11.145
  815   2HB   LYS 105          HB1       LYS 105   7.604   0.269 -10.442
  816   1HG   LYS 105          HG2       LYS 105   8.999   1.038 -12.375
  817   2HG   LYS 105          HG1       LYS 105   8.823  -0.561 -13.095
  818   1HD   LYS 105          HD2       LYS 105   6.390   1.032 -12.291
  819   2HD   LYS 105          HD1       LYS 105   7.185   1.330 -13.834
  820   1HE   LYS 105          HE2       LYS 105   6.081  -1.337 -12.895
  821   2HE   LYS 105          HE1       LYS 105   5.366  -0.292 -14.116
  822   1HZ   LYS 105          HZ1       LYS 105   6.574  -1.511 -15.526
  823   2HZ   LYS 105          HZ2       LYS 105   7.620  -2.086 -14.318
  824   3HZ   LYS 105          HZ3       LYS 105   7.880  -0.559 -15.015
  825    H    LEU 106           HN       LEU 106   9.012   1.135  -8.723
  826    HA   LEU 106           HA       LEU 106  10.560   3.242  -9.856
  827   1HB   LEU 106          HB2       LEU 106   9.434   2.753  -7.106
  828   2HB   LEU 106          HB1       LEU 106  10.463   4.148  -7.398
  829    HG   LEU 106           HG       LEU 106   7.950   4.544  -7.635
  830   1HD1  LEU 106          HD11      LEU 106   9.318   5.143 -10.254
  831   2HD1  LEU 106          HD12      LEU 106   9.894   5.892  -8.767
  832   3HD1  LEU 106          HD13      LEU 106   8.239   6.156  -9.299
  833   1HD2  LEU 106          HD21      LEU 106   6.784   3.717  -9.522
  834   2HD2  LEU 106          HD22      LEU 106   7.657   2.325  -8.897
  835   3HD2  LEU 106          HD23      LEU 106   8.265   3.179 -10.310
  836    H    PHE 107           HN       PHE 107  11.509   0.559  -7.832
  837    HA   PHE 107           HA       PHE 107  13.885   1.635  -6.708
  838   1HB   PHE 107          HB2       PHE 107  12.959  -0.536  -6.017
  839   2HB   PHE 107          HB1       PHE 107  13.351  -1.211  -7.599
  840    HD1  PHE 107           HD1      PHE 107  14.975   0.642  -4.768
  841    HD2  PHE 107           HD2      PHE 107  15.423  -2.263  -7.898
  842    HE1  PHE 107           HE1      PHE 107  17.288   0.184  -4.011
  843    HE2  PHE 107           HE2      PHE 107  17.735  -2.729  -7.135
  844    HZ   PHE 107           HZ       PHE 107  18.670  -1.504  -5.190
  845    H    ARG 108           HN       ARG 108  13.402   0.081  -9.900
  846    HA   ARG 108           HA       ARG 108  16.187   0.071 -10.582
  847   1HB   ARG 108          HB2       ARG 108  13.712   0.070 -12.323
  848   2HB   ARG 108          HB1       ARG 108  15.346  -0.074 -12.970
  849   1HG   ARG 108          HG2       ARG 108  15.687  -2.042 -11.413
  850   2HG   ARG 108          HG1       ARG 108  13.969  -1.965 -11.048
  851   1HD   ARG 108          HD2       ARG 108  15.155  -2.308 -13.808
  852   2HD   ARG 108          HD1       ARG 108  14.478  -3.616 -12.847
  853    HE   ARG 108           HE       ARG 108  13.041  -1.749 -14.516
  854   1HH1  ARG 108          HH21      ARG 108  12.823  -3.288 -11.426
  855   2HH1  ARG 108          HH22      ARG 108  11.121  -3.009 -11.278
  856   1HH2  ARG 108          HH11      ARG 108  10.839  -1.405 -14.328
  857   2HH2  ARG 108          HH12      ARG 108  10.001  -1.958 -12.919
  858    H    GLU 109           HN       GLU 109  13.727   2.591 -10.829
  859    HA   GLU 109           HA       GLU 109  15.488   4.306 -12.453
  860   1HB   GLU 109          HB2       GLU 109  12.817   4.786 -11.099
  861   2HB   GLU 109          HB1       GLU 109  13.664   6.005 -12.053
  862   1HG   GLU 109          HG2       GLU 109  13.631   4.515 -14.012
  863   2HG   GLU 109          HG1       GLU 109  12.800   3.280 -13.065
  864    H    GLY 110           HN       GLY 110  15.110   3.581  -9.129
  865   1HA   GLY 110          HA2       GLY 110  16.198   4.471  -7.253
  866   2HA   GLY 110          HA1       GLY 110  17.195   5.402  -8.371
  867    H    ARG 111           HN       ARG 111  13.995   6.042  -9.098
  868    HA   ARG 111           HA       ARG 111  14.152   8.648  -7.667
  869   1HB   ARG 111          HB2       ARG 111  12.301   7.607  -9.836
  870   2HB   ARG 111          HB1       ARG 111  12.113   9.184  -9.070
  871   1HG   ARG 111          HG2       ARG 111  14.433   9.767  -9.759
  872   2HG   ARG 111          HG1       ARG 111  14.549   8.221 -10.599
  873   1HD   ARG 111          HD2       ARG 111  12.570   8.872 -11.982
  874   2HD   ARG 111          HD1       ARG 111  12.581  10.451 -11.196
  875    HE   ARG 111           HE       ARG 111  15.166  10.152 -12.176
  876   1HH1  ARG 111          HH21      ARG 111  11.955  10.028 -13.418
  877   2HH1  ARG 111          HH22      ARG 111  12.409  10.558 -15.004
  878   1HH2  ARG 111          HH11      ARG 111  15.777  10.829 -14.244
  879   2HH2  ARG 111          HH12      ARG 111  14.571  10.994 -15.477
  880    H    PHE 112           HN       PHE 112  13.623   8.080  -5.555
  881    HA   PHE 112           HA       PHE 112  11.187   6.504  -5.025
  882   1HB   PHE 112          HB2       PHE 112  13.103   7.823  -3.082
  883   2HB   PHE 112          HB1       PHE 112  11.915   6.566  -2.716
  884    HD1  PHE 112           HD1      PHE 112  12.122   4.312  -3.780
  885    HD2  PHE 112           HD2      PHE 112  15.225   7.265  -4.058
  886    HE1  PHE 112           HE1      PHE 112  13.724   2.565  -4.483
  887    HE2  PHE 112           HE2      PHE 112  16.833   5.507  -4.761
  888    HZ   PHE 112           HZ       PHE 112  16.082   3.154  -4.970
  889    H    ASN 113           HN       ASN 113   9.354   7.319  -3.959
  890    HA   ASN 113           HA       ASN 113   7.707   8.938  -3.582
  891   1HB   ASN 113          HB2       ASN 113  10.182  10.316  -2.504
  892   2HB   ASN 113          HB1       ASN 113   8.555  10.967  -2.310
  893   1HD2  ASN 113          HD21      ASN 113   7.005   8.794  -1.699
  894   2HD2  ASN 113          HD22      ASN 113   7.565   8.022  -0.296
  Start of MODEL   16
    1   1H    MET   1           HT1      MET   1  22.713   7.725  14.354
    2   2H    MET   1           HT2      MET   1  22.331   8.158  12.757
    3   3H    MET   1           HT3      MET   1  23.556   7.021  13.062
    4    HA   MET   1           HA       MET   1  21.945   5.542  12.598
    5   1HB   MET   1          HB2       MET   1  21.197   6.366  15.421
    6   2HB   MET   1          HB1       MET   1  20.782   4.830  14.659
    7   1HG   MET   1          HG2       MET   1  23.627   5.812  14.985
    8   2HG   MET   1          HG1       MET   1  22.835   4.742  16.139
    9   1HE   MET   1          HE1       MET   1  22.353   1.489  14.623
   10   2HE   MET   1          HE2       MET   1  21.104   2.590  14.050
   11   3HE   MET   1          HE3       MET   1  21.734   2.759  15.686
   12    H    GLY   2           HN       GLY   2  21.082   7.933  11.454
   13   1HA   GLY   2          HA2       GLY   2  18.383   8.600  12.302
   14   2HA   GLY   2          HA1       GLY   2  19.148   9.111  10.796
   15    HA   PRO   3           HA       PRO   3  15.672   5.796  10.250
   16   1HB   PRO   3          HB2       PRO   3  15.126   7.658   7.998
   17   2HB   PRO   3          HB1       PRO   3  14.001   6.948   9.164
   18   1HG   PRO   3          HG2       PRO   3  14.903   9.601   9.196
   19   2HG   PRO   3          HG1       PRO   3  14.136   8.763  10.551
   20   1HD   PRO   3          HD2       PRO   3  16.910   9.634  10.320
   21   2HD   PRO   3          HD1       PRO   3  16.108   8.879  11.721
   22    H    VAL   4           HN       VAL   4  15.422   4.530   8.113
   23    HA   VAL   4           HA       VAL   4  18.074   4.049   7.033
   24    HB   VAL   4           HB       VAL   4  16.822   2.327   5.634
   25   1HG1  VAL   4          HG11      VAL   4  16.256   0.937   7.673
   26   2HG1  VAL   4          HG12      VAL   4  16.582   2.367   8.652
   27   3HG1  VAL   4          HG13      VAL   4  17.872   1.642   7.692
   28   1HG2  VAL   4          HG21      VAL   4  14.644   3.614   5.734
   29   2HG2  VAL   4          HG22      VAL   4  14.516   3.135   7.426
   30   3HG2  VAL   4          HG23      VAL   4  14.502   1.909   6.160
   31    HA   PRO   5           HA       PRO   5  17.937   6.784   3.525
   32   1HB   PRO   5          HB2       PRO   5  18.752   4.704   1.637
   33   2HB   PRO   5          HB1       PRO   5  19.688   6.071   2.248
   34   1HG   PRO   5          HG2       PRO   5  19.941   3.303   2.985
   35   2HG   PRO   5          HG1       PRO   5  20.876   4.674   3.586
   36   1HD   PRO   5          HD2       PRO   5  18.942   3.145   5.046
   37   2HD   PRO   5          HD1       PRO   5  19.754   4.639   5.580
   38    HA   PRO   6           HA       PRO   6  14.117   6.105   1.365
   39   1HB   PRO   6          HB2       PRO   6  14.742   6.976  -1.228
   40   2HB   PRO   6          HB1       PRO   6  14.297   8.019   0.129
   41   1HG   PRO   6          HG2       PRO   6  16.962   7.554  -1.082
   42   2HG   PRO   6          HG1       PRO   6  16.374   8.946  -0.163
   43   1HD   PRO   6          HD2       PRO   6  18.119   6.964   0.815
   44   2HD   PRO   6          HD1       PRO   6  17.195   8.110   1.817
   45    H    SER   7           HN       SER   7  16.710   5.172  -0.919
   46    HA   SER   7           HA       SER   7  15.167   3.235  -2.325
   47   1HB   SER   7          HB2       SER   7  17.257   2.488  -3.266
   48   2HB   SER   7          HB1       SER   7  17.360   4.236  -3.076
   49    HG   SER   7           HG       SER   7  18.575   3.936  -1.231
   50    H    THR   8           HN       THR   8  17.204   2.949   0.562
   51    HA   THR   8           HA       THR   8  17.124   0.080   0.688
   52    HB   THR   8           HB       THR   8  17.447   2.096   2.929
   53    HG1  THR   8           HG1      THR   8  18.945   1.845   0.952
   54   1HG2  THR   8          HG21      THR   8  18.700   0.109   3.956
   55   2HG2  THR   8          HG22      THR   8  17.901  -0.883   2.736
   56   3HG2  THR   8          HG23      THR   8  16.940  -0.002   3.924
   57    H    ALA   9           HN       ALA   9  15.027   2.599   2.052
   58    HA   ALA   9           HA       ALA   9  13.379   0.903   3.632
   59   1HB   ALA   9          HB1       ALA   9  13.285   3.341   3.834
   60   2HB   ALA   9          HB2       ALA   9  11.688   2.726   3.410
   61   3HB   ALA   9          HB3       ALA   9  12.699   3.477   2.176
   62    H    LEU  10           HN       LEU  10  13.112   1.921   0.234
   63    HA   LEU  10           HA       LEU  10  10.627   0.672  -0.333
   64   1HB   LEU  10          HB2       LEU  10  11.718   2.275  -1.859
   65   2HB   LEU  10          HB1       LEU  10  13.000   1.108  -2.173
   66    HG   LEU  10           HG       LEU  10  11.264  -0.482  -3.061
   67   1HD1  LEU  10          HD11      LEU  10   9.218   0.154  -2.105
   68   2HD1  LEU  10          HD12      LEU  10   9.076   0.782  -3.743
   69   3HD1  LEU  10          HD13      LEU  10   9.488   1.868  -2.417
   70   1HD2  LEU  10          HD21      LEU  10  12.580   0.965  -4.546
   71   2HD2  LEU  10          HD22      LEU  10  11.374   2.242  -4.382
   72   3HD2  LEU  10          HD23      LEU  10  10.954   0.726  -5.181
   73    H    ARG  11           HN       ARG  11  13.950  -0.604  -0.776
   74    HA   ARG  11           HA       ARG  11  13.169  -3.140  -1.789
   75   1HB   ARG  11          HB2       ARG  11  15.583  -2.341  -0.142
   76   2HB   ARG  11          HB1       ARG  11  15.401  -3.913  -0.921
   77   1HG   ARG  11          HG2       ARG  11  15.189  -2.802  -3.116
   78   2HG   ARG  11          HG1       ARG  11  15.385  -1.231  -2.337
   79   1HD   ARG  11          HD2       ARG  11  17.541  -1.929  -3.226
   80   2HD   ARG  11          HD1       ARG  11  17.605  -2.001  -1.463
   81    HE   ARG  11           HE       ARG  11  16.812  -4.551  -2.210
   82   1HH1  ARG  11          HH21      ARG  11  19.400  -2.401  -2.966
   83   2HH1  ARG  11          HH22      ARG  11  20.530  -3.671  -3.299
   84   1HH2  ARG  11          HH11      ARG  11  18.268  -6.215  -2.641
   85   2HH2  ARG  11          HH12      ARG  11  19.889  -5.831  -3.115
   86    H    GLU  12           HN       GLU  12  13.777  -2.094   1.556
   87    HA   GLU  12           HA       GLU  12  13.286  -4.617   2.787
   88   1HB   GLU  12          HB2       GLU  12  12.973  -1.775   3.797
   89   2HB   GLU  12          HB1       GLU  12  12.775  -3.197   4.829
   90   1HG   GLU  12          HG2       GLU  12  15.050  -3.908   4.388
   91   2HG   GLU  12          HG1       GLU  12  15.258  -2.636   3.184
   92    H    LEU  13           HN       LEU  13  11.118  -1.993   1.825
   93    HA   LEU  13           HA       LEU  13   8.761  -3.100   3.056
   94   1HB   LEU  13          HB2       LEU  13   8.945  -0.729   2.397
   95   2HB   LEU  13          HB1       LEU  13   9.051  -1.204   0.704
   96    HG   LEU  13           HG       LEU  13   6.789  -2.192   0.838
   97   1HD1  LEU  13          HD11      LEU  13   6.456  -2.893   3.047
   98   2HD1  LEU  13          HD12      LEU  13   5.481  -1.428   2.991
   99   3HD1  LEU  13          HD13      LEU  13   7.083  -1.390   3.727
  100   1HD2  LEU  13          HD21      LEU  13   7.104   0.188   0.200
  101   2HD2  LEU  13          HD22      LEU  13   6.909   0.651   1.890
  102   3HD2  LEU  13          HD23      LEU  13   5.562  -0.075   1.014
  103    H    ILE  14           HN       ILE  14  10.055  -3.265  -0.276
  104    HA   ILE  14           HA       ILE  14   7.902  -4.783  -1.369
  105    HB   ILE  14           HB       ILE  14  10.832  -4.655  -2.143
  106   1HG1  ILE  14          HG12      ILE  14   8.388  -3.426  -3.450
  107   2HG1  ILE  14          HG11      ILE  14   9.391  -2.567  -2.281
  108   1HG2  ILE  14          HG21      ILE  14  10.015  -6.708  -3.059
  109   2HG2  ILE  14          HG22      ILE  14   9.911  -5.532  -4.368
  110   3HG2  ILE  14          HG23      ILE  14   8.461  -5.986  -3.474
  111   1HD1  ILE  14          HD11      ILE  14  10.121  -2.008  -4.545
  112   2HD1  ILE  14          HD12      ILE  14  10.313  -3.718  -4.931
  113   3HD1  ILE  14          HD13      ILE  14  11.371  -2.957  -3.742
  114    H    GLU  15           HN       GLU  15  10.964  -5.839   0.119
  115    HA   GLU  15           HA       GLU  15  10.632  -8.628  -0.296
  116   1HB   GLU  15          HB2       GLU  15  12.029  -7.083   1.903
  117   2HB   GLU  15          HB1       GLU  15  12.141  -8.835   1.728
  118   1HG   GLU  15          HG2       GLU  15  13.043  -8.562  -0.547
  119   2HG   GLU  15          HG1       GLU  15  12.920  -6.809  -0.391
  120    H    GLU  16           HN       GLU  16   9.491  -6.556   2.370
  121    HA   GLU  16           HA       GLU  16   8.450  -8.755   3.921
  122   1HB   GLU  16          HB2       GLU  16   9.005  -6.524   4.875
  123   2HB   GLU  16          HB1       GLU  16   7.632  -5.841   4.002
  124   1HG   GLU  16          HG2       GLU  16   6.077  -7.226   5.217
  125   2HG   GLU  16          HG1       GLU  16   7.391  -8.142   5.956
  126    H    LEU  17           HN       LEU  17   6.881  -6.441   1.679
  127    HA   LEU  17           HA       LEU  17   4.231  -7.422   2.055
  128   1HB   LEU  17          HB2       LEU  17   5.506  -6.169  -0.392
  129   2HB   LEU  17          HB1       LEU  17   3.775  -6.428  -0.196
  130    HG   LEU  17           HG       LEU  17   5.483  -4.784   1.697
  131   1HD1  LEU  17          HD11      LEU  17   4.345  -2.836   0.633
  132   2HD1  LEU  17          HD12      LEU  17   3.630  -3.932  -0.550
  133   3HD1  LEU  17          HD13      LEU  17   5.379  -3.713  -0.495
  134   1HD2  LEU  17          HD21      LEU  17   3.021  -3.920   2.200
  135   2HD2  LEU  17          HD22      LEU  17   3.609  -5.394   2.960
  136   3HD2  LEU  17          HD23      LEU  17   2.554  -5.493   1.551
  137    H    VAL  18           HN       VAL  18   6.779  -8.435  -0.208
  138    HA   VAL  18           HA       VAL  18   5.154 -10.325  -1.630
  139    HB   VAL  18           HB       VAL  18   8.147 -10.120  -1.208
  140   1HG1  VAL  18          HG11      VAL  18   8.211 -11.666  -3.247
  141   2HG1  VAL  18          HG12      VAL  18   6.524 -12.040  -2.892
  142   3HG1  VAL  18          HG13      VAL  18   7.779 -12.423  -1.714
  143   1HG2  VAL  18          HG21      VAL  18   6.481  -9.600  -3.682
  144   2HG2  VAL  18          HG22      VAL  18   8.162  -9.148  -3.399
  145   3HG2  VAL  18          HG23      VAL  18   6.870  -8.341  -2.511
  146    H    ASN  19           HN       ASN  19   7.306 -10.681   1.189
  147    HA   ASN  19           HA       ASN  19   7.119 -13.499   1.434
  148   1HB   ASN  19          HB2       ASN  19   8.735 -12.147   2.700
  149   2HB   ASN  19          HB1       ASN  19   7.417 -11.433   3.630
  150   1HD2  ASN  19          HD21      ASN  19   7.766 -12.356   5.696
  151   2HD2  ASN  19          HD22      ASN  19   7.809 -14.028   5.986
  152    H    ILE  20           HN       ILE  20   5.037 -10.979   2.906
  153    HA   ILE  20           HA       ILE  20   3.408 -12.983   4.236
  154    HB   ILE  20           HB       ILE  20   2.068 -11.155   5.034
  155   1HG1  ILE  20          HG12      ILE  20   3.511  -9.443   2.978
  156   2HG1  ILE  20          HG11      ILE  20   1.816  -9.916   2.910
  157   1HG2  ILE  20          HG21      ILE  20   4.954 -10.250   4.819
  158   2HG2  ILE  20          HG22      ILE  20   4.361 -11.449   5.967
  159   3HG2  ILE  20          HG23      ILE  20   3.801  -9.781   6.068
  160   1HD1  ILE  20          HD11      ILE  20   1.677  -7.787   3.857
  161   2HD1  ILE  20          HD12      ILE  20   3.153  -8.000   4.797
  162   3HD1  ILE  20          HD13      ILE  20   1.670  -8.822   5.285
  163    H    THR  21           HN       THR  21   3.406 -11.819   1.004
  164    HA   THR  21           HA       THR  21   0.503 -12.450   0.662
  165    HB   THR  21           HB       THR  21   0.854 -11.616  -1.663
  166    HG1  THR  21           HG1      THR  21   2.982 -10.395  -1.746
  167   1HG2  THR  21          HG21      THR  21   1.358  -9.229  -0.997
  168   2HG2  THR  21          HG22      THR  21   1.683  -9.831   0.624
  169   3HG2  THR  21          HG23      THR  21   0.076 -10.008  -0.071
  170    H    GLN  22           HN       GLN  22   3.697 -13.678  -0.140
  171    HA   GLN  22           HA       GLN  22   2.766 -15.602  -2.098
  172   1HB   GLN  22          HB2       GLN  22   5.335 -15.354  -0.525
  173   2HB   GLN  22          HB1       GLN  22   5.060 -16.613  -1.730
  174   1HG   GLN  22          HG2       GLN  22   4.642 -14.899  -3.445
  175   2HG   GLN  22          HG1       GLN  22   4.896 -13.629  -2.251
  176   1HE2  GLN  22          HE21      GLN  22   7.057 -15.736  -1.149
  177   2HE2  GLN  22          HE22      GLN  22   8.414 -15.359  -2.097
  178    H    ASN  23           HN       ASN  23   3.497 -15.799   1.379
  179    HA   ASN  23           HA       ASN  23   2.718 -18.671   1.377
  180   1HB   ASN  23          HB2       ASN  23   3.963 -16.875   3.469
  181   2HB   ASN  23          HB1       ASN  23   3.480 -18.542   3.785
  182   1HD2  ASN  23          HD21      ASN  23   6.262 -17.381   3.711
  183   2HD2  ASN  23          HD22      ASN  23   7.095 -18.291   2.544
  184    H    GLN  24           HN       GLN  24   0.796 -16.197   1.218
  185    HA   GLN  24           HA       GLN  24  -0.702 -16.481   3.733
  186   1HB   GLN  24          HB2       GLN  24  -2.161 -14.800   2.884
  187   2HB   GLN  24          HB1       GLN  24  -0.558 -14.337   2.325
  188   1HG   GLN  24          HG2       GLN  24  -1.127 -15.619   0.161
  189   2HG   GLN  24          HG1       GLN  24  -2.795 -15.606   0.738
  190   1HE2  GLN  24          HE21      GLN  24  -2.588 -14.232  -1.544
  191   2HE2  GLN  24          HE22      GLN  24  -2.530 -12.554  -1.290
  192    H    LYS  25           HN       LYS  25  -2.048 -18.185   4.076
  193    HA   LYS  25           HA       LYS  25  -2.878 -19.892   1.840
  194   1HB   LYS  25          HB2       LYS  25  -2.331 -20.860   4.061
  195   2HB   LYS  25          HB1       LYS  25  -3.670 -19.955   4.768
  196   1HG   LYS  25          HG2       LYS  25  -5.283 -21.157   3.424
  197   2HG   LYS  25          HG1       LYS  25  -3.998 -21.943   2.508
  198   1HD   LYS  25          HD2       LYS  25  -4.769 -23.538   4.139
  199   2HD   LYS  25          HD1       LYS  25  -3.192 -22.963   4.678
  200   1HE   LYS  25          HE2       LYS  25  -4.142 -21.582   6.355
  201   2HE   LYS  25          HE1       LYS  25  -5.750 -21.668   5.636
  202   1HZ   LYS  25          HZ1       LYS  25  -4.932 -24.272   6.153
  203   2HZ   LYS  25          HZ2       LYS  25  -6.164 -23.395   6.927
  204   3HZ   LYS  25          HZ3       LYS  25  -4.582 -23.371   7.546
  205    H    ALA  26           HN       ALA  26  -4.815 -18.441   4.458
  206    HA   ALA  26           HA       ALA  26  -7.122 -18.194   2.658
  207   1HB   ALA  26          HB1       ALA  26  -6.597 -17.780   5.588
  208   2HB   ALA  26          HB2       ALA  26  -7.845 -18.752   4.811
  209   3HB   ALA  26          HB3       ALA  26  -8.008 -16.997   4.877
  210    HA   PRO  27           HA       PRO  27  -6.382 -14.053   1.231
  211   1HB   PRO  27          HB2       PRO  27  -8.891 -13.052   2.422
  212   2HB   PRO  27          HB1       PRO  27  -8.432 -13.166   0.720
  213   1HG   PRO  27          HG2       PRO  27 -10.249 -14.860   2.098
  214   2HG   PRO  27          HG1       PRO  27  -9.615 -15.100   0.466
  215   1HD   PRO  27          HD2       PRO  27  -9.034 -16.671   2.822
  216   2HD   PRO  27          HD1       PRO  27  -8.364 -16.881   1.186
  217    H    LEU  28           HN       LEU  28  -5.936 -11.833   2.102
  218    HA   LEU  28           HA       LEU  28  -4.767 -11.950   4.731
  219   1HB   LEU  28          HB2       LEU  28  -5.360  -9.544   2.980
  220   2HB   LEU  28          HB1       LEU  28  -4.307  -9.540   4.394
  221    HG   LEU  28           HG       LEU  28  -3.887 -11.221   1.901
  222   1HD1  LEU  28          HD11      LEU  28  -1.951  -9.705   1.536
  223   2HD1  LEU  28          HD12      LEU  28  -2.463  -8.744   2.923
  224   3HD1  LEU  28          HD13      LEU  28  -3.486  -8.838   1.489
  225   1HD2  LEU  28          HD21      LEU  28  -2.478 -11.036   4.560
  226   2HD2  LEU  28          HD22      LEU  28  -1.526 -11.369   3.113
  227   3HD2  LEU  28          HD23      LEU  28  -2.827 -12.459   3.578
  228    H    CYS  29           HN       CYS  29  -7.941 -11.168   3.621
  229    HA   CYS  29           HA       CYS  29  -8.729 -10.557   6.421
  230   1HB   CYS  29          HB2       CYS  29  -9.417  -8.784   4.061
  231   2HB   CYS  29          HB1       CYS  29 -10.050  -8.597   5.696
  232    H    ASN  30           HN       ASN  30 -11.279 -10.387   6.435
  233    HA   ASN  30           HA       ASN  30 -12.266 -12.857   5.331
  234   1HB   ASN  30          HB2       ASN  30 -13.116 -11.748   7.431
  235   2HB   ASN  30          HB1       ASN  30 -13.914 -10.554   6.406
  236   1HD2  ASN  30          HD21      ASN  30 -16.010 -11.419   7.283
  237   2HD2  ASN  30          HD22      ASN  30 -16.651 -12.852   6.639
  238    H    GLY  31           HN       GLY  31 -11.450 -11.989   3.048
  239   1HA   GLY  31          HA2       GLY  31 -12.100 -11.434   0.864
  240   2HA   GLY  31          HA1       GLY  31 -13.759 -11.680   1.409
  241    H    SER  32           HN       SER  32 -11.669  -9.308   2.932
  242    HA   SER  32           HA       SER  32 -13.580  -7.203   2.557
  243   1HB   SER  32          HB2       SER  32 -10.632  -7.002   3.229
  244   2HB   SER  32          HB1       SER  32 -11.814  -5.716   3.423
  245    HG   SER  32           HG       SER  32 -12.679  -8.004   4.562
  246    H    MET  33           HN       MET  33 -13.476  -5.377   1.182
  247    HA   MET  33           HA       MET  33 -11.682  -5.646  -1.214
  248   1HB   MET  33          HB2       MET  33 -14.544  -4.628  -1.106
  249   2HB   MET  33          HB1       MET  33 -13.529  -4.706  -2.546
  250   1HG   MET  33          HG2       MET  33 -13.361  -7.156  -2.306
  251   2HG   MET  33          HG1       MET  33 -14.374  -7.084  -0.864
  252   1HE   MET  33          HE1       MET  33 -14.457  -7.684  -4.678
  253   2HE   MET  33          HE2       MET  33 -13.970  -6.009  -4.436
  254   3HE   MET  33          HE3       MET  33 -15.502  -6.367  -5.228
  255    H    VAL  34           HN       VAL  34 -11.035  -3.590  -2.151
  256    HA   VAL  34           HA       VAL  34 -11.407  -1.210  -0.355
  257    HB   VAL  34           HB       VAL  34  -9.015  -0.619  -0.993
  258   1HG1  VAL  34          HG11      VAL  34  -9.476  -1.403   1.234
  259   2HG1  VAL  34          HG12      VAL  34  -8.049  -2.270   0.666
  260   3HG1  VAL  34          HG13      VAL  34  -9.621  -3.070   0.678
  261   1HG2  VAL  34          HG21      VAL  34  -7.580  -2.485  -1.707
  262   2HG2  VAL  34          HG22      VAL  34  -8.848  -2.198  -2.898
  263   3HG2  VAL  34          HG23      VAL  34  -8.983  -3.552  -1.776
  264    H    TRP  35           HN       TRP  35 -11.085   0.843  -1.483
  265    HA   TRP  35           HA       TRP  35 -12.343   0.831  -4.094
  266   1HB   TRP  35          HB2       TRP  35 -11.038   3.042  -2.489
  267   2HB   TRP  35          HB1       TRP  35 -11.921   3.299  -3.993
  268    HD1  TRP  35           HD1      TRP  35 -12.414   2.313  -0.347
  269    HE1  TRP  35           HE1      TRP  35 -14.910   2.516   0.241
  270    HE3  TRP  35           HE3      TRP  35 -14.328   3.193  -4.994
  271    HZ2  TRP  35           HZ2      TRP  35 -17.406   2.987  -1.098
  272    HZ3  TRP  35           HZ3      TRP  35 -16.765   3.504  -5.314
  273    HH2  TRP  35           HH2      TRP  35 -18.305   3.407  -3.374
  274    H    SER  36           HN       SER  36 -11.361   0.970  -6.088
  275    HA   SER  36           HA       SER  36  -8.516   0.490  -6.279
  276   1HB   SER  36          HB2       SER  36  -8.851   0.552  -8.669
  277   2HB   SER  36          HB1       SER  36 -10.248  -0.259  -7.967
  278    HG   SER  36           HG       SER  36 -10.169   2.528  -8.474
  279    H    ILE  37           HN       ILE  37  -6.946   1.965  -7.225
  280    HA   ILE  37           HA       ILE  37  -7.710   4.858  -7.179
  281    HB   ILE  37           HB       ILE  37  -5.583   5.347  -5.976
  282   1HG1  ILE  37          HG12      ILE  37  -5.469   2.370  -5.411
  283   2HG1  ILE  37          HG11      ILE  37  -4.503   3.125  -6.673
  284   1HG2  ILE  37          HG21      ILE  37  -7.428   3.424  -4.527
  285   2HG2  ILE  37          HG22      ILE  37  -7.722   5.149  -4.748
  286   3HG2  ILE  37          HG23      ILE  37  -6.363   4.605  -3.764
  287   1HD1  ILE  37          HD11      ILE  37  -4.463   4.051  -3.795
  288   2HD1  ILE  37          HD12      ILE  37  -3.360   4.520  -5.089
  289   3HD1  ILE  37          HD13      ILE  37  -3.323   2.876  -4.451
  290    H    ASN  38           HN       ASN  38  -6.074   6.210  -8.307
  291    HA   ASN  38           HA       ASN  38  -5.028   4.778 -10.676
  292   1HB   ASN  38          HB2       ASN  38  -5.092   7.727  -9.943
  293   2HB   ASN  38          HB1       ASN  38  -4.499   7.087 -11.477
  294   1HD2  ASN  38          HD21      ASN  38  -6.318   5.235 -12.261
  295   2HD2  ASN  38          HD22      ASN  38  -7.882   5.886 -12.359
  296    H    LEU  39           HN       LEU  39  -2.959   4.019 -10.626
  297    HA   LEU  39           HA       LEU  39  -1.176   4.802  -8.449
  298   1HB   LEU  39          HB2       LEU  39  -0.783   2.982 -10.843
  299   2HB   LEU  39          HB1       LEU  39   0.432   3.230  -9.593
  300    HG   LEU  39           HG       LEU  39  -0.852   1.180  -9.158
  301   1HD1  LEU  39          HD11      LEU  39  -0.138   2.903  -7.282
  302   2HD1  LEU  39          HD12      LEU  39  -1.130   1.505  -6.880
  303   3HD1  LEU  39          HD13      LEU  39  -1.881   3.087  -7.074
  304   1HD2  LEU  39          HD21      LEU  39  -3.333   2.819  -8.673
  305   2HD2  LEU  39          HD22      LEU  39  -3.183   1.092  -8.983
  306   3HD2  LEU  39          HD23      LEU  39  -2.967   2.242 -10.300
  307    H    THR  40           HN       THR  40  -0.065   6.661  -8.552
  308    HA   THR  40           HA       THR  40   1.375   7.351 -11.056
  309    HB   THR  40           HB       THR  40   0.614   9.665 -10.985
  310    HG1  THR  40           HG1      THR  40  -1.280   9.054  -9.030
  311   1HG2  THR  40          HG21      THR  40  -1.864   7.964 -10.707
  312   2HG2  THR  40          HG22      THR  40  -0.788   7.818 -12.098
  313   3HG2  THR  40          HG23      THR  40  -1.602   9.347 -11.769
  314    H    ALA  41           HN       ALA  41   1.285   9.956  -8.961
  315    HA   ALA  41           HA       ALA  41   3.997   9.312  -7.973
  316   1HB   ALA  41          HB1       ALA  41   2.339  11.838  -7.725
  317   2HB   ALA  41          HB2       ALA  41   3.571  11.528  -8.949
  318   3HB   ALA  41          HB3       ALA  41   4.029  11.670  -7.252
  319    H    GLY  42           HN       GLY  42   1.408  11.064  -6.268
  320   1HA   GLY  42          HA2       GLY  42   2.243  10.157  -3.693
  321   2HA   GLY  42          HA1       GLY  42   0.698  10.925  -4.041
  322    H    MET  43           HN       MET  43   2.025   7.797  -5.189
  323    HA   MET  43           HA       MET  43  -0.469   6.427  -4.919
  324   1HB   MET  43          HB2       MET  43   2.347   5.311  -4.835
  325   2HB   MET  43          HB1       MET  43   0.887   4.360  -5.090
  326   1HG   MET  43          HG2       MET  43   0.398   5.804  -7.088
  327   2HG   MET  43          HG1       MET  43   1.986   6.534  -6.881
  328   1HE   MET  43          HE1       MET  43   4.510   3.880  -7.421
  329   2HE   MET  43          HE2       MET  43   3.693   3.694  -5.871
  330   3HE   MET  43          HE3       MET  43   4.000   5.307  -6.508
  331    H    TYR  44           HN       TYR  44   2.303   6.770  -2.738
  332    HA   TYR  44           HA       TYR  44   1.454   4.974  -0.703
  333   1HB   TYR  44          HB2       TYR  44   3.012   7.565  -0.441
  334   2HB   TYR  44          HB1       TYR  44   2.941   6.288   0.774
  335    HD1  TYR  44           HD1      TYR  44   4.092   4.158   0.434
  336    HD2  TYR  44           HD2      TYR  44   4.215   7.247  -2.547
  337    HE1  TYR  44           HE1      TYR  44   5.940   2.971  -0.721
  338    HE2  TYR  44           HE2      TYR  44   6.063   6.062  -3.700
  339    HH   TYR  44           HH       TYR  44   7.175   4.087  -3.835
  340    H    CYS  45           HN       CYS  45   0.757   8.417  -1.227
  341    HA   CYS  45           HA       CYS  45  -0.796   8.779   1.173
  342   1HB   CYS  45          HB2       CYS  45  -1.236  10.319  -1.386
  343   2HB   CYS  45          HB1       CYS  45  -1.356  10.887   0.281
  344    H    ALA  46           HN       ALA  46  -1.788   8.315  -2.236
  345    HA   ALA  46           HA       ALA  46  -4.578   8.028  -1.683
  346   1HB   ALA  46          HB1       ALA  46  -4.677   6.991  -3.946
  347   2HB   ALA  46          HB2       ALA  46  -2.914   6.941  -3.974
  348   3HB   ALA  46          HB3       ALA  46  -3.751   8.493  -3.939
  349    H    ALA  47           HN       ALA  47  -1.959   5.625  -1.926
  350    HA   ALA  47           HA       ALA  47  -3.699   3.361  -1.681
  351   1HB   ALA  47          HB1       ALA  47  -1.460   3.021  -2.517
  352   2HB   ALA  47          HB2       ALA  47  -1.599   2.144  -0.994
  353   3HB   ALA  47          HB3       ALA  47  -0.757   3.693  -1.045
  354    H    LEU  48           HN       LEU  48  -1.957   5.320   0.713
  355    HA   LEU  48           HA       LEU  48  -2.495   3.712   2.984
  356   1HB   LEU  48          HB2       LEU  48  -0.909   5.588   3.022
  357   2HB   LEU  48          HB1       LEU  48  -2.233   6.728   2.802
  358    HG   LEU  48           HG       LEU  48  -3.216   5.974   4.971
  359   1HD1  LEU  48          HD11      LEU  48  -2.484   3.761   5.298
  360   2HD1  LEU  48          HD12      LEU  48  -1.495   4.663   6.443
  361   3HD1  LEU  48          HD13      LEU  48  -0.812   4.153   4.899
  362   1HD2  LEU  48          HD21      LEU  48  -1.644   7.902   4.841
  363   2HD2  LEU  48          HD22      LEU  48  -0.304   6.804   5.169
  364   3HD2  LEU  48          HD23      LEU  48  -1.548   7.065   6.391
  365    H    GLU  49           HN       GLU  49  -4.390   6.511   1.754
  366    HA   GLU  49           HA       GLU  49  -6.396   6.356   3.752
  367   1HB   GLU  49          HB2       GLU  49  -7.871   7.554   2.059
  368   2HB   GLU  49          HB1       GLU  49  -6.344   8.336   2.444
  369   1HG   GLU  49          HG2       GLU  49  -6.457   8.471   0.102
  370   2HG   GLU  49          HG1       GLU  49  -5.403   7.097   0.385
  371    H    SER  50           HN       SER  50  -6.217   4.656   0.614
  372    HA   SER  50           HA       SER  50  -8.849   3.550   0.748
  373   1HB   SER  50          HB2       SER  50  -7.315   3.421  -1.251
  374   2HB   SER  50          HB1       SER  50  -6.400   2.180  -0.400
  375    HG   SER  50           HG       SER  50  -9.189   2.073  -0.930
  376    H    LEU  51           HN       LEU  51  -5.765   2.445   2.110
  377    HA   LEU  51           HA       LEU  51  -6.817  -0.033   3.144
  378   1HB   LEU  51          HB2       LEU  51  -4.384   1.611   3.883
  379   2HB   LEU  51          HB1       LEU  51  -4.733   0.031   4.580
  380    HG   LEU  51           HG       LEU  51  -4.460   0.562   1.605
  381   1HD1  LEU  51          HD11      LEU  51  -2.477  -0.679   3.537
  382   2HD1  LEU  51          HD12      LEU  51  -2.332   0.925   2.819
  383   3HD1  LEU  51          HD13      LEU  51  -2.258  -0.509   1.795
  384   1HD2  LEU  51          HD21      LEU  51  -4.049  -2.076   1.831
  385   2HD2  LEU  51          HD22      LEU  51  -5.675  -1.419   1.697
  386   3HD2  LEU  51          HD23      LEU  51  -5.038  -1.872   3.277
  387    H    ILE  52           HN       ILE  52  -6.704   3.265   4.392
  388    HA   ILE  52           HA       ILE  52  -7.153   2.763   7.134
  389    HB   ILE  52           HB       ILE  52  -8.179   4.988   5.350
  390   1HG1  ILE  52          HG12      ILE  52  -5.753   4.948   5.628
  391   2HG1  ILE  52          HG11      ILE  52  -6.431   6.316   6.484
  392   1HG2  ILE  52          HG21      ILE  52  -8.535   6.228   7.534
  393   2HG2  ILE  52          HG22      ILE  52  -8.413   4.665   8.342
  394   3HG2  ILE  52          HG23      ILE  52  -9.704   4.958   7.177
  395   1HD1  ILE  52          HD11      ILE  52  -5.134   3.855   7.562
  396   2HD1  ILE  52          HD12      ILE  52  -6.441   4.556   8.513
  397   3HD1  ILE  52          HD13      ILE  52  -5.020   5.521   8.122
  398    H    ASN  53           HN       ASN  53  -9.186   2.032   4.467
  399    HA   ASN  53           HA       ASN  53 -11.671   2.049   6.051
  400   1HB   ASN  53          HB2       ASN  53 -11.023   1.046   3.257
  401   2HB   ASN  53          HB1       ASN  53 -12.619   0.919   3.992
  402   1HD2  ASN  53          HD21      ASN  53 -11.821   2.551   1.619
  403   2HD2  ASN  53          HD22      ASN  53 -12.209   4.156   2.013
  404    H    VAL  54           HN       VAL  54  -9.108  -0.162   5.227
  405    HA   VAL  54           HA       VAL  54 -10.651  -2.532   6.111
  406    HB   VAL  54           HB       VAL  54  -7.716  -2.369   5.375
  407   1HG1  VAL  54          HG11      VAL  54  -9.739  -4.630   5.349
  408   2HG1  VAL  54          HG12      VAL  54  -8.437  -4.426   6.521
  409   3HG1  VAL  54          HG13      VAL  54  -8.058  -4.758   4.831
  410   1HG2  VAL  54          HG21      VAL  54  -8.437  -3.029   3.097
  411   2HG2  VAL  54          HG22      VAL  54  -9.078  -1.447   3.542
  412   3HG2  VAL  54          HG23      VAL  54 -10.122  -2.867   3.592
  413    H    SER  55           HN       SER  55 -10.747  -2.981   8.256
  414    HA   SER  55           HA       SER  55  -8.397  -2.284   9.992
  415   1HB   SER  55          HB2       SER  55 -11.341  -2.002  10.660
  416   2HB   SER  55          HB1       SER  55 -10.014  -1.745  11.791
  417    HG   SER  55           HG       SER  55 -10.889   0.162  10.648
  418    H    GLY  56           HN       GLY  56  -8.125  -3.686  11.837
  419   1HA   GLY  56          HA2       GLY  56  -8.535  -5.659  13.124
  420   2HA   GLY  56          HA1       GLY  56  -9.779  -6.134  11.970
  421    H    CYS  57           HN       CYS  57  -7.426  -5.329   9.930
  422    HA   CYS  57           HA       CYS  57  -6.387  -8.123   9.814
  423   1HB   CYS  57          HB2       CYS  57  -6.323  -5.856   7.800
  424   2HB   CYS  57          HB1       CYS  57  -5.605  -7.446   7.539
  425    H    SER  58           HN       SER  58  -4.667  -8.189  11.253
  426    HA   SER  58           HA       SER  58  -2.767  -6.054  11.614
  427   1HB   SER  58          HB2       SER  58  -3.108  -7.811  13.307
  428   2HB   SER  58          HB1       SER  58  -2.492  -9.022  12.186
  429    HG   SER  58           HG       SER  58  -0.534  -7.732  12.134
  430    H    ALA  59           HN       ALA  59  -2.857  -8.904   9.529
  431    HA   ALA  59           HA       ALA  59  -0.230  -9.029   8.620
  432   1HB   ALA  59          HB1       ALA  59  -2.599  -9.252   6.758
  433   2HB   ALA  59          HB2       ALA  59  -2.209 -10.494   7.948
  434   3HB   ALA  59          HB3       ALA  59  -1.061 -10.110   6.666
  435    H    ILE  60           HN       ILE  60  -2.430  -6.388   8.156
  436    HA   ILE  60           HA       ILE  60  -0.492  -5.165   6.207
  437    HB   ILE  60           HB       ILE  60  -2.403  -3.985   5.174
  438   1HG1  ILE  60          HG12      ILE  60  -4.124  -5.826   6.859
  439   2HG1  ILE  60          HG11      ILE  60  -3.893  -4.119   7.212
  440   1HG2  ILE  60          HG21      ILE  60  -3.248  -5.890   3.933
  441   2HG2  ILE  60          HG22      ILE  60  -2.817  -6.986   5.246
  442   3HG2  ILE  60          HG23      ILE  60  -1.552  -6.185   4.316
  443   1HD1  ILE  60          HD11      ILE  60  -4.687  -3.681   4.807
  444   2HD1  ILE  60          HD12      ILE  60  -5.909  -4.209   5.962
  445   3HD1  ILE  60          HD13      ILE  60  -5.234  -5.357   4.806
  446    H    GLU  61           HN       GLU  61  -1.885  -4.983   9.243
  447    HA   GLU  61           HA       GLU  61  -2.297  -2.184   9.552
  448   1HB   GLU  61          HB2       GLU  61  -2.999  -3.807  11.241
  449   2HB   GLU  61          HB1       GLU  61  -1.315  -4.226  11.571
  450   1HG   GLU  61          HG2       GLU  61  -0.871  -1.979  12.355
  451   2HG   GLU  61          HG1       GLU  61  -2.494  -1.462  11.897
  452    H    LYS  62           HN       LYS  62   0.647  -4.161  10.011
  453    HA   LYS  62           HA       LYS  62   2.356  -1.988  10.753
  454   1HB   LYS  62          HB2       LYS  62   2.951  -4.627   9.385
  455   2HB   LYS  62          HB1       LYS  62   4.201  -3.498   9.910
  456   1HG   LYS  62          HG2       LYS  62   3.402  -3.638  12.218
  457   2HG   LYS  62          HG1       LYS  62   2.087  -4.696  11.718
  458   1HD   LYS  62          HD2       LYS  62   3.708  -6.205  12.523
  459   2HD   LYS  62          HD1       LYS  62   3.953  -6.240  10.779
  460   1HE   LYS  62          HE2       LYS  62   5.851  -4.754  10.944
  461   2HE   LYS  62          HE1       LYS  62   5.529  -4.444  12.649
  462   1HZ   LYS  62          HZ1       LYS  62   5.966  -7.199  11.723
  463   2HZ   LYS  62          HZ2       LYS  62   6.238  -6.523  13.257
  464   3HZ   LYS  62          HZ3       LYS  62   7.298  -6.181  11.974
  465    H    THR  63           HN       THR  63   1.347  -3.287   7.636
  466    HA   THR  63           HA       THR  63   3.171  -1.882   5.977
  467    HB   THR  63           HB       THR  63   0.296  -2.652   5.384
  468    HG1  THR  63           HG1      THR  63   2.166  -4.208   6.005
  469   1HG2  THR  63          HG21      THR  63   1.096  -2.642   3.021
  470   2HG2  THR  63          HG22      THR  63   2.627  -1.965   3.575
  471   3HG2  THR  63          HG23      THR  63   1.136  -1.041   3.758
  472    H    GLN  64           HN       GLN  64   0.026  -0.875   7.331
  473    HA   GLN  64           HA       GLN  64  -0.209   1.569   5.894
  474   1HB   GLN  64          HB2       GLN  64  -1.142   0.799   8.672
  475   2HB   GLN  64          HB1       GLN  64  -1.584   2.316   7.887
  476   1HG   GLN  64          HG2       GLN  64  -2.591   1.072   6.021
  477   2HG   GLN  64          HG1       GLN  64  -2.129  -0.453   6.779
  478   1HE2  GLN  64          HE21      GLN  64  -4.811  -0.227   6.380
  479   2HE2  GLN  64          HE22      GLN  64  -5.629   0.145   7.820
  480    H    ARG  65           HN       ARG  65   1.483   0.837   8.949
  481    HA   ARG  65           HA       ARG  65   2.236   3.529   9.552
  482   1HB   ARG  65          HB2       ARG  65   2.472   1.591  11.124
  483   2HB   ARG  65          HB1       ARG  65   3.807   1.001  10.134
  484   1HG   ARG  65          HG2       ARG  65   5.039   3.100  10.533
  485   2HG   ARG  65          HG1       ARG  65   3.708   3.693  11.527
  486   1HD   ARG  65          HD2       ARG  65   4.015   1.700  13.021
  487   2HD   ARG  65          HD1       ARG  65   5.439   1.267  12.079
  488    HE   ARG  65           HE       ARG  65   5.873   3.915  12.844
  489   1HH1  ARG  65          HH21      ARG  65   5.188   0.899  14.372
  490   2HH1  ARG  65          HH22      ARG  65   6.009   1.307  15.841
  491   1HH2  ARG  65          HH11      ARG  65   6.944   4.464  14.756
  492   2HH2  ARG  65          HH12      ARG  65   6.999   3.326  16.060
  493    H    MET  66           HN       MET  66   3.954   0.951   7.775
  494    HA   MET  66           HA       MET  66   6.242   2.522   7.109
  495   1HB   MET  66          HB2       MET  66   4.999   0.115   5.758
  496   2HB   MET  66          HB1       MET  66   6.533   0.819   5.249
  497   1HG   MET  66          HG2       MET  66   7.341   0.532   7.640
  498   2HG   MET  66          HG1       MET  66   5.876  -0.398   7.946
  499   1HE   MET  66          HE1       MET  66   6.131  -3.556   5.994
  500   2HE   MET  66          HE2       MET  66   5.392  -2.130   5.274
  501   3HE   MET  66          HE3       MET  66   5.202  -2.435   6.998
  502    H    LEU  67           HN       LEU  67   3.153   2.036   5.388
  503    HA   LEU  67           HA       LEU  67   3.889   3.469   3.029
  504   1HB   LEU  67          HB2       LEU  67   1.203   3.089   4.373
  505   2HB   LEU  67          HB1       LEU  67   1.391   3.874   2.809
  506    HG   LEU  67           HG       LEU  67   2.399   1.077   3.414
  507   1HD1  LEU  67          HD11      LEU  67   0.399   0.371   2.031
  508   2HD1  LEU  67          HD12      LEU  67  -0.202   2.022   2.184
  509   3HD1  LEU  67          HD13      LEU  67   0.000   1.021   3.622
  510   1HD2  LEU  67          HD21      LEU  67   2.144   1.061   0.780
  511   2HD2  LEU  67          HD22      LEU  67   3.570   1.786   1.509
  512   3HD2  LEU  67          HD23      LEU  67   2.250   2.812   0.950
  513    H    SER  68           HN       SER  68   2.565   4.544   6.135
  514    HA   SER  68           HA       SER  68   2.178   7.281   5.433
  515   1HB   SER  68          HB2       SER  68   2.950   6.031   8.089
  516   2HB   SER  68          HB1       SER  68   2.444   7.706   7.889
  517    HG   SER  68           HG       SER  68   0.966   5.413   7.952
  518    H    GLY  69           HN       GLY  69   5.005   5.484   6.586
  519   1HA   GLY  69          HA2       GLY  69   6.809   7.588   7.014
  520   2HA   GLY  69          HA1       GLY  69   7.288   6.006   6.398
  521    H    PHE  70           HN       PHE  70   5.447   6.452   4.008
  522    HA   PHE  70           HA       PHE  70   7.435   7.989   2.411
  523   1HB   PHE  70          HB2       PHE  70   5.222   6.047   1.728
  524   2HB   PHE  70          HB1       PHE  70   5.939   7.071   0.485
  525    HD1  PHE  70           HD1      PHE  70   8.267   6.802  -0.189
  526    HD2  PHE  70           HD2      PHE  70   6.527   4.282   2.821
  527    HE1  PHE  70           HE1      PHE  70  10.180   5.243  -0.395
  528    HE2  PHE  70           HE2      PHE  70   8.443   2.719   2.618
  529    HZ   PHE  70           HZ       PHE  70  10.270   3.199   1.010
  530    H    CYS  71           HN       CYS  71   4.237   8.297   3.722
  531    HA   CYS  71           HA       CYS  71   3.960  10.921   2.322
  532   1HB   CYS  71          HB2       CYS  71   2.526   9.072   1.265
  533   2HB   CYS  71          HB1       CYS  71   1.573   9.128   2.748
  534    HA   PRO  72           HA       PRO  72   3.443  11.625   6.899
  535   1HB   PRO  72          HB2       PRO  72   3.366  14.444   5.943
  536   2HB   PRO  72          HB1       PRO  72   4.398  13.705   7.176
  537   1HG   PRO  72          HG2       PRO  72   5.324  14.452   4.723
  538   2HG   PRO  72          HG1       PRO  72   6.024  13.114   5.646
  539   1HD   PRO  72          HD2       PRO  72   4.308  13.019   3.213
  540   2HD   PRO  72          HD1       PRO  72   5.488  11.821   3.813
  541    H    HIS  73           HN       HIS  73   1.194  11.023   5.077
  542    HA   HIS  73           HA       HIS  73  -0.790  13.143   5.595
  543   1HB   HIS  73          HB2       HIS  73  -0.352  11.316   3.527
  544   2HB   HIS  73          HB1       HIS  73  -1.761  10.651   4.336
  545    HD1  HIS  73           HD1      HIS  73  -3.937  12.049   4.275
  546    HD2  HIS  73           HD2      HIS  73  -0.728  13.839   2.322
  547    HE1  HIS  73           HE1      HIS  73  -4.912  13.953   2.932
  548    H    LYS  74           HN       LYS  74  -1.497  13.070   7.720
  549    HA   LYS  74           HA       LYS  74  -2.072  10.489   9.017
  550   1HB   LYS  74          HB2       LYS  74  -2.564  13.373   9.844
  551   2HB   LYS  74          HB1       LYS  74  -3.012  11.984  10.837
  552   1HG   LYS  74          HG2       LYS  74  -0.682  11.242  10.910
  553   2HG   LYS  74          HG1       LYS  74  -0.208  12.559   9.840
  554   1HD   LYS  74          HD2       LYS  74   0.308  13.216  12.114
  555   2HD   LYS  74          HD1       LYS  74  -1.051  14.186  11.550
  556   1HE   LYS  74          HE2       LYS  74  -1.716  11.623  12.953
  557   2HE   LYS  74          HE1       LYS  74  -1.091  12.946  13.937
  558   1HZ   LYS  74          HZ1       LYS  74  -3.660  12.663  13.187
  559   2HZ   LYS  74          HZ2       LYS  74  -3.081  13.754  12.020
  560   3HZ   LYS  74          HZ3       LYS  74  -2.947  14.123  13.673
  561    H    VAL  75           HN       VAL  75  -3.663   9.568   7.683
  562    HA   VAL  75           HA       VAL  75  -6.092  11.155   7.054
  563    HB   VAL  75           HB       VAL  75  -5.324   8.334   6.244
  564   1HG1  VAL  75          HG11      VAL  75  -7.079   8.499   4.620
  565   2HG1  VAL  75          HG12      VAL  75  -7.326  10.208   4.961
  566   3HG1  VAL  75          HG13      VAL  75  -7.792   8.993   6.148
  567   1HG2  VAL  75          HG21      VAL  75  -3.792  10.246   5.473
  568   2HG2  VAL  75          HG22      VAL  75  -5.176  10.831   4.550
  569   3HG2  VAL  75          HG23      VAL  75  -4.494   9.243   4.205
  570    H    SER  76           HN       SER  76  -7.934  10.933   8.195
  571    HA   SER  76           HA       SER  76  -8.138   8.739  10.215
  572   1HB   SER  76          HB2       SER  76  -9.628  11.362   9.883
  573   2HB   SER  76          HB1       SER  76 -10.052  10.145  11.083
  574    HG   SER  76           HG       SER  76  -8.629  11.252  12.207
  575    H    ALA  77           HN       ALA  77 -10.289   7.641  10.345
  576    HA   ALA  77           HA       ALA  77 -11.158   6.652   7.835
  577   1HB   ALA  77          HB1       ALA  77 -12.623   6.736  10.488
  578   2HB   ALA  77          HB2       ALA  77 -11.609   5.423   9.889
  579   3HB   ALA  77          HB3       ALA  77 -13.140   5.787   9.094
  580    H    GLY  78           HN       GLY  78 -11.634   9.707   9.091
  581   1HA   GLY  78          HA2       GLY  78 -14.251  10.099   7.691
  582   2HA   GLY  78          HA1       GLY  78 -13.564  11.193   8.889
  583    H    GLN  79           HN       GLN  79 -10.852  10.993   7.617
  584    HA   GLN  79           HA       GLN  79 -11.343  13.045   5.533
  585   1HB   GLN  79          HB2       GLN  79  -8.836  12.087   6.938
  586   2HB   GLN  79          HB1       GLN  79  -8.825  13.288   5.644
  587   1HG   GLN  79          HG2       GLN  79 -10.339  14.727   6.945
  588   2HG   GLN  79          HG1       GLN  79 -10.385  13.526   8.235
  589   1HE2  GLN  79          HE21      GLN  79  -9.410  16.219   8.643
  590   2HE2  GLN  79          HE22      GLN  79  -7.754  16.121   9.005
  591    H    PHE  80           HN       PHE  80 -11.224  12.599   3.408
  592    HA   PHE  80           HA       PHE  80  -9.764  10.141   2.495
  593   1HB   PHE  80          HB2       PHE  80 -12.480  11.150   1.600
  594   2HB   PHE  80          HB1       PHE  80 -11.573   9.879   0.784
  595    HD1  PHE  80           HD1      PHE  80 -13.770  10.671   3.539
  596    HD2  PHE  80           HD2      PHE  80 -10.914   7.803   2.101
  597    HE1  PHE  80           HE1      PHE  80 -14.639   8.998   5.152
  598    HE2  PHE  80           HE2      PHE  80 -11.785   6.129   3.711
  599    HZ   PHE  80           HZ       PHE  80 -13.647   6.727   5.237
  600    H    SER  81           HN       SER  81  -8.773  10.358   0.409
  601    HA   SER  81           HA       SER  81  -8.679  13.172  -0.650
  602   1HB   SER  81          HB2       SER  81  -6.447  11.143  -0.433
  603   2HB   SER  81          HB1       SER  81  -6.317  12.692  -1.260
  604    HG   SER  81           HG       SER  81  -5.907  13.490   0.632
  605    H    SER  82           HN       SER  82  -8.106   9.749  -1.611
  606    HA   SER  82           HA       SER  82  -8.518  10.556  -4.447
  607   1HB   SER  82          HB2       SER  82  -6.549   9.174  -3.843
  608   2HB   SER  82          HB1       SER  82  -7.634   7.899  -3.297
  609    HG   SER  82           HG       SER  82  -6.749   8.255  -5.709
  610    H    LEU  83           HN       LEU  83 -10.492   9.361  -1.980
  611    HA   LEU  83           HA       LEU  83 -12.030   7.549  -3.741
  612   1HB   LEU  83          HB2       LEU  83 -12.207   8.373  -0.853
  613   2HB   LEU  83          HB1       LEU  83 -13.625   7.666  -1.624
  614    HG   LEU  83           HG       LEU  83 -12.294   5.704  -2.287
  615   1HD1  LEU  83          HD11      LEU  83 -10.114   6.688  -2.557
  616   2HD1  LEU  83          HD12      LEU  83  -9.988   5.487  -1.273
  617   3HD1  LEU  83          HD13      LEU  83 -10.079   7.202  -0.871
  618   1HD2  LEU  83          HD21      LEU  83 -11.820   6.247   0.649
  619   2HD2  LEU  83          HD22      LEU  83 -12.152   4.701  -0.124
  620   3HD2  LEU  83          HD23      LEU  83 -13.424   5.915   0.002
  621    H    HIS  84           HN       HIS  84 -11.751  10.513  -4.339
  622    HA   HIS  84           HA       HIS  84 -14.400  11.653  -3.897
  623   1HB   HIS  84          HB2       HIS  84 -12.354  12.461  -5.984
  624   2HB   HIS  84          HB1       HIS  84 -13.670  13.447  -5.348
  625    HD1  HIS  84           HD1      HIS  84 -12.860  12.079  -2.372
  626    HD2  HIS  84           HD2      HIS  84 -10.632  14.563  -4.867
  627    HE1  HIS  84           HE1      HIS  84 -11.102  13.167  -0.918
  628    H    VAL  85           HN       VAL  85 -12.729  10.017  -6.546
  629    HA   VAL  85           HA       VAL  85 -14.987  10.248  -8.369
  630    HB   VAL  85           HB       VAL  85 -12.603   8.381  -8.530
  631   1HG1  VAL  85          HG11      VAL  85 -14.544   9.466 -10.594
  632   2HG1  VAL  85          HG12      VAL  85 -14.416   7.792 -10.055
  633   3HG1  VAL  85          HG13      VAL  85 -13.102   8.524 -10.975
  634   1HG2  VAL  85          HG21      VAL  85 -11.898  10.741  -8.288
  635   2HG2  VAL  85          HG22      VAL  85 -12.972  11.195  -9.611
  636   3HG2  VAL  85          HG23      VAL  85 -11.583  10.154  -9.922
  637    H    ARG  86           HN       ARG  86 -16.363   8.510  -9.014
  638    HA   ARG  86           HA       ARG  86 -16.900   6.585  -6.832
  639   1HB   ARG  86          HB2       ARG  86 -18.370   7.239  -9.406
  640   2HB   ARG  86          HB1       ARG  86 -18.932   6.071  -8.210
  641   1HG   ARG  86          HG2       ARG  86 -18.984   7.849  -6.495
  642   2HG   ARG  86          HG1       ARG  86 -18.427   9.017  -7.695
  643   1HD   ARG  86          HD2       ARG  86 -20.449   8.460  -9.081
  644   2HD   ARG  86          HD1       ARG  86 -21.031   7.470  -7.741
  645    HE   ARG  86           HE       ARG  86 -20.560   9.914  -6.554
  646   1HH1  ARG  86          HH21      ARG  86 -22.272   8.806  -9.340
  647   2HH1  ARG  86          HH22      ARG  86 -23.475  10.050  -9.257
  648   1HH2  ARG  86          HH11      ARG  86 -22.120  11.546  -6.439
  649   2HH2  ARG  86          HH12      ARG  86 -23.387  11.601  -7.618
  650    H    ASP  87           HN       ASP  87 -14.724   5.548  -7.476
  651    HA   ASP  87           HA       ASP  87 -14.737   3.948  -9.934
  652   1HB   ASP  87          HB2       ASP  87 -12.843   4.099  -7.573
  653   2HB   ASP  87          HB1       ASP  87 -12.596   3.018  -8.945
  654    H    THR  88           HN       THR  88 -14.249   1.502  -9.656
  655    HA   THR  88           HA       THR  88 -16.331   0.394  -7.862
  656    HB   THR  88           HB       THR  88 -16.096  -1.633  -9.144
  657    HG1  THR  88           HG1      THR  88 -14.296  -2.124 -10.115
  658   1HG2  THR  88          HG21      THR  88 -17.253   0.282 -10.254
  659   2HG2  THR  88          HG22      THR  88 -16.512  -0.830 -11.404
  660   3HG2  THR  88          HG23      THR  88 -15.729   0.707 -11.034
  661    H    LYS  89           HN       LYS  89 -15.828  -1.410  -6.426
  662    HA   LYS  89           HA       LYS  89 -13.219  -1.069  -5.105
  663   1HB   LYS  89          HB2       LYS  89 -15.519  -2.929  -4.448
  664   2HB   LYS  89          HB1       LYS  89 -14.116  -2.626  -3.428
  665   1HG   LYS  89          HG2       LYS  89 -14.742  -0.251  -3.259
  666   2HG   LYS  89          HG1       LYS  89 -16.151  -0.552  -4.279
  667   1HD   LYS  89          HD2       LYS  89 -16.964  -2.217  -2.615
  668   2HD   LYS  89          HD1       LYS  89 -15.594  -1.816  -1.580
  669   1HE   LYS  89          HE2       LYS  89 -17.675  -0.594  -0.944
  670   2HE   LYS  89          HE1       LYS  89 -16.355   0.486  -1.392
  671   1HZ   LYS  89          HZ1       LYS  89 -17.519   1.263  -3.094
  672   2HZ   LYS  89          HZ2       LYS  89 -18.871   0.440  -2.481
  673   3HZ   LYS  89          HZ3       LYS  89 -17.887  -0.290  -3.659
  674    H    ILE  90           HN       ILE  90 -11.841  -2.919  -4.608
  675    HA   ILE  90           HA       ILE  90 -12.137  -5.267  -6.428
  676    HB   ILE  90           HB       ILE  90  -9.708  -5.133  -6.950
  677   1HG1  ILE  90          HG12      ILE  90  -9.913  -2.423  -5.590
  678   2HG1  ILE  90          HG11      ILE  90  -9.037  -3.817  -4.956
  679   1HG2  ILE  90          HG21      ILE  90  -9.904  -3.306  -8.564
  680   2HG2  ILE  90          HG22      ILE  90 -11.237  -2.606  -7.646
  681   3HG2  ILE  90          HG23      ILE  90 -11.443  -4.159  -8.457
  682   1HD1  ILE  90          HD11      ILE  90  -7.460  -2.343  -6.086
  683   2HD1  ILE  90          HD12      ILE  90  -8.452  -2.348  -7.543
  684   3HD1  ILE  90          HD13      ILE  90  -7.637  -3.824  -7.027
  685    H    GLU  91           HN       GLU  91 -10.831  -7.124  -5.669
  686    HA   GLU  91           HA       GLU  91 -11.064  -7.501  -2.838
  687   1HB   GLU  91          HB2       GLU  91  -9.570  -9.055  -4.967
  688   2HB   GLU  91          HB1       GLU  91  -9.717  -9.595  -3.294
  689   1HG   GLU  91          HG2       GLU  91 -12.175  -9.553  -3.488
  690   2HG   GLU  91          HG1       GLU  91 -12.036  -9.011  -5.161
  691    H    VAL  92           HN       VAL  92  -9.466  -7.487  -1.213
  692    HA   VAL  92           HA       VAL  92  -7.375  -5.583  -1.417
  693    HB   VAL  92           HB       VAL  92  -7.699  -7.947   0.456
  694   1HG1  VAL  92          HG11      VAL  92  -5.723  -5.659   0.448
  695   2HG1  VAL  92          HG12      VAL  92  -5.386  -7.387   0.549
  696   3HG1  VAL  92          HG13      VAL  92  -6.122  -6.551   1.916
  697   1HG2  VAL  92          HG21      VAL  92  -9.408  -5.998   0.385
  698   2HG2  VAL  92          HG22      VAL  92  -8.114  -5.018   1.073
  699   3HG2  VAL  92          HG23      VAL  92  -8.718  -6.424   1.950
  700    H    ALA  93           HN       ALA  93  -7.314  -9.115  -1.841
  701    HA   ALA  93           HA       ALA  93  -4.543  -9.523  -2.050
  702   1HB   ALA  93          HB1       ALA  93  -6.752 -10.835  -3.662
  703   2HB   ALA  93          HB2       ALA  93  -6.153 -11.371  -2.092
  704   3HB   ALA  93          HB3       ALA  93  -5.106 -11.451  -3.509
  705    H    GLN  94           HN       GLN  94  -6.807  -8.359  -4.535
  706    HA   GLN  94           HA       GLN  94  -4.779  -8.268  -6.614
  707   1HB   GLN  94          HB2       GLN  94  -7.510  -6.983  -6.354
  708   2HB   GLN  94          HB1       GLN  94  -6.498  -6.829  -7.791
  709   1HG   GLN  94          HG2       GLN  94  -6.462  -9.281  -8.034
  710   2HG   GLN  94          HG1       GLN  94  -7.475  -9.439  -6.598
  711   1HE2  GLN  94          HE21      GLN  94  -8.387 -10.420  -9.111
  712   2HE2  GLN  94          HE22      GLN  94  -9.686  -9.459  -9.631
  713    H    PHE  95           HN       PHE  95  -6.131  -5.971  -4.300
  714    HA   PHE  95           HA       PHE  95  -4.933  -3.600  -5.307
  715   1HB   PHE  95          HB2       PHE  95  -6.649  -3.599  -3.543
  716   2HB   PHE  95          HB1       PHE  95  -5.519  -4.380  -2.435
  717    HD1  PHE  95           HD1      PHE  95  -6.403  -1.258  -4.151
  718    HD2  PHE  95           HD2      PHE  95  -3.560  -3.186  -1.574
  719    HE1  PHE  95           HE1      PHE  95  -5.453   0.950  -3.541
  720    HE2  PHE  95           HE2      PHE  95  -2.611  -0.985  -0.964
  721    HZ   PHE  95           HZ       PHE  95  -3.556   1.081  -1.948
  722    H    VAL  96           HN       VAL  96  -3.715  -5.906  -2.857
  723    HA   VAL  96           HA       VAL  96  -1.253  -4.544  -2.388
  724    HB   VAL  96           HB       VAL  96  -1.882  -7.504  -2.196
  725   1HG1  VAL  96          HG11      VAL  96   0.488  -7.288  -2.200
  726   2HG1  VAL  96          HG12      VAL  96   0.035  -7.375  -0.497
  727   3HG1  VAL  96          HG13      VAL  96   0.432  -5.819  -1.225
  728   1HG2  VAL  96          HG21      VAL  96  -2.059  -5.202  -0.237
  729   2HG2  VAL  96          HG22      VAL  96  -2.050  -6.890   0.272
  730   3HG2  VAL  96          HG23      VAL  96  -3.354  -6.284  -0.750
  731    H    LYS  97           HN       LYS  97  -1.993  -7.276  -4.580
  732    HA   LYS  97           HA       LYS  97   0.635  -7.514  -5.648
  733   1HB   LYS  97          HB2       LYS  97  -2.077  -8.196  -6.812
  734   2HB   LYS  97          HB1       LYS  97  -0.552  -8.621  -7.595
  735   1HG   LYS  97          HG2       LYS  97   0.144  -9.862  -5.578
  736   2HG   LYS  97          HG1       LYS  97  -1.378  -9.441  -4.795
  737   1HD   LYS  97          HD2       LYS  97  -2.624 -10.632  -6.561
  738   2HD   LYS  97          HD1       LYS  97  -1.102 -11.057  -7.345
  739   1HE   LYS  97          HE2       LYS  97  -1.903 -12.925  -5.957
  740   2HE   LYS  97          HE1       LYS  97  -0.397 -12.274  -5.309
  741   1HZ   LYS  97          HZ1       LYS  97  -1.786 -10.889  -3.803
  742   2HZ   LYS  97          HZ2       LYS  97  -1.904 -12.559  -3.514
  743   3HZ   LYS  97          HZ3       LYS  97  -3.150 -11.746  -4.335
  744    H    ASP  98           HN       ASP  98  -2.144  -5.558  -6.783
  745    HA   ASP  98           HA       ASP  98  -0.912  -4.600  -9.167
  746   1HB   ASP  98          HB2       ASP  98  -2.957  -3.326  -7.330
  747   2HB   ASP  98          HB1       ASP  98  -2.483  -2.633  -8.882
  748    H    LEU  99           HN       LEU  99  -0.812  -3.395  -5.838
  749    HA   LEU  99           HA       LEU  99   0.736  -1.050  -6.398
  750   1HB   LEU  99          HB2       LEU  99  -0.506  -1.356  -4.288
  751   2HB   LEU  99          HB1       LEU  99   0.551  -2.698  -3.855
  752    HG   LEU  99           HG       LEU  99   2.496  -1.178  -3.837
  753   1HD1  LEU  99          HD11      LEU  99   2.076   0.538  -5.373
  754   2HD1  LEU  99          HD12      LEU  99   1.797   1.367  -3.844
  755   3HD1  LEU  99          HD13      LEU  99   0.428   0.793  -4.797
  756   1HD2  LEU  99          HD21      LEU  99   1.045  -1.524  -1.800
  757   2HD2  LEU  99          HD22      LEU  99   0.212  -0.025  -2.210
  758   3HD2  LEU  99          HD23      LEU  99   1.928   0.003  -1.803
  759    H    LEU 100           HN       LEU 100   1.586  -4.396  -5.685
  760    HA   LEU 100           HA       LEU 100   4.346  -4.085  -5.214
  761   1HB   LEU 100          HB2       LEU 100   3.239  -6.196  -4.806
  762   2HB   LEU 100          HB1       LEU 100   2.835  -6.364  -6.509
  763    HG   LEU 100           HG       LEU 100   5.167  -6.613  -7.106
  764   1HD1  LEU 100          HD11      LEU 100   6.831  -6.778  -5.106
  765   2HD1  LEU 100          HD12      LEU 100   5.618  -5.854  -4.218
  766   3HD1  LEU 100          HD13      LEU 100   6.362  -5.174  -5.664
  767   1HD2  LEU 100          HD21      LEU 100   5.707  -8.671  -5.757
  768   2HD2  LEU 100          HD22      LEU 100   4.067  -8.651  -6.404
  769   3HD2  LEU 100          HD23      LEU 100   4.349  -8.272  -4.705
  770    H    LEU 101           HN       LEU 101   2.669  -4.440  -8.384
  771    HA   LEU 101           HA       LEU 101   5.088  -4.576  -9.914
  772   1HB   LEU 101          HB2       LEU 101   2.385  -3.416 -10.671
  773   2HB   LEU 101          HB1       LEU 101   3.708  -3.618 -11.806
  774    HG   LEU 101           HG       LEU 101   2.224  -5.499 -12.062
  775   1HD1  LEU 101          HD11      LEU 101   4.395  -6.734 -10.390
  776   2HD1  LEU 101          HD12      LEU 101   4.826  -5.849 -11.855
  777   3HD1  LEU 101          HD13      LEU 101   3.751  -7.241 -11.951
  778   1HD2  LEU 101          HD21      LEU 101   2.611  -6.236  -9.163
  779   2HD2  LEU 101          HD22      LEU 101   1.409  -6.840 -10.300
  780   3HD2  LEU 101          HD23      LEU 101   1.287  -5.195  -9.685
  781    H    HIS 102           HN       HIS 102   3.227  -1.768  -8.766
  782    HA   HIS 102           HA       HIS 102   4.898   0.153 -10.122
  783   1HB   HIS 102          HB2       HIS 102   2.910   0.347  -7.863
  784   2HB   HIS 102          HB1       HIS 102   3.873   1.746  -8.339
  785    HD1  HIS 102           HD1      HIS 102   3.431   2.779 -10.664
  786    HD2  HIS 102           HD2      HIS 102   0.966  -0.464  -9.789
  787    HE1  HIS 102           HE1      HIS 102   1.618   2.772 -12.425
  788    H    LEU 103           HN       LEU 103   5.006  -1.202  -6.820
  789    HA   LEU 103           HA       LEU 103   6.973   0.574  -5.813
  790   1HB   LEU 103          HB2       LEU 103   6.503  -2.349  -5.180
  791   2HB   LEU 103          HB1       LEU 103   7.569  -1.301  -4.248
  792    HG   LEU 103           HG       LEU 103   4.625  -0.738  -4.727
  793   1HD1  LEU 103          HD11      LEU 103   6.060  -2.017  -2.385
  794   2HD1  LEU 103          HD12      LEU 103   4.794  -2.732  -3.380
  795   3HD1  LEU 103          HD13      LEU 103   4.412  -1.396  -2.297
  796   1HD2  LEU 103          HD21      LEU 103   5.167   0.717  -2.578
  797   2HD2  LEU 103          HD22      LEU 103   5.567   1.337  -4.174
  798   3HD2  LEU 103          HD23      LEU 103   6.824   0.619  -3.170
  799    H    LYS 104           HN       LYS 104   7.476  -2.572  -7.456
  800    HA   LYS 104           HA       LYS 104  10.343  -2.376  -7.365
  801   1HB   LYS 104          HB2       LYS 104  10.299  -4.148  -9.100
  802   2HB   LYS 104          HB1       LYS 104   9.220  -4.518  -7.753
  803   1HG   LYS 104          HG2       LYS 104   7.327  -3.563  -9.058
  804   2HG   LYS 104          HG1       LYS 104   8.418  -3.330 -10.422
  805   1HD   LYS 104          HD2       LYS 104   7.236  -5.416 -10.757
  806   2HD   LYS 104          HD1       LYS 104   8.915  -5.789 -10.371
  807   1HE   LYS 104          HE2       LYS 104   7.036  -5.621  -8.054
  808   2HE   LYS 104          HE1       LYS 104   6.847  -7.004  -9.129
  809   1HZ   LYS 104          HZ1       LYS 104   9.476  -6.983  -8.863
  810   2HZ   LYS 104          HZ2       LYS 104   8.449  -7.838  -7.813
  811   3HZ   LYS 104          HZ3       LYS 104   9.051  -6.314  -7.364
  812    H    LYS 105           HN       LYS 105   7.936  -1.111  -9.608
  813    HA   LYS 105           HA       LYS 105   9.732  -0.561 -11.775
  814   1HB   LYS 105          HB2       LYS 105   7.281  -0.573 -12.041
  815   2HB   LYS 105          HB1       LYS 105   7.163   0.860 -11.019
  816   1HG   LYS 105          HG2       LYS 105   8.382   2.196 -12.607
  817   2HG   LYS 105          HG1       LYS 105   8.823   0.775 -13.548
  818   1HD   LYS 105          HD2       LYS 105   7.016   1.850 -14.717
  819   2HD   LYS 105          HD1       LYS 105   6.362   0.391 -13.978
  820   1HE   LYS 105          HE2       LYS 105   6.207   2.932 -12.388
  821   2HE   LYS 105          HE1       LYS 105   5.109   2.745 -13.754
  822   1HZ   LYS 105          HZ1       LYS 105   5.387   0.472 -11.950
  823   2HZ   LYS 105          HZ2       LYS 105   4.020   1.044 -12.782
  824   3HZ   LYS 105          HZ3       LYS 105   4.543   1.822 -11.365
  825    H    LEU 106           HN       LEU 106   8.679   1.491  -9.031
  826    HA   LEU 106           HA       LEU 106  10.082   3.840  -9.853
  827   1HB   LEU 106          HB2       LEU 106   9.129   2.813  -7.188
  828   2HB   LEU 106          HB1       LEU 106  10.140   4.248  -7.246
  829    HG   LEU 106           HG       LEU 106   7.568   4.568  -7.259
  830   1HD1  LEU 106          HD11      LEU 106   9.314   6.316  -7.818
  831   2HD1  LEU 106          HD12      LEU 106   7.743   6.561  -8.575
  832   3HD1  LEU 106          HD13      LEU 106   9.078   5.903  -9.516
  833   1HD2  LEU 106          HD21      LEU 106   7.838   4.114 -10.234
  834   2HD2  LEU 106          HD22      LEU 106   6.375   4.296  -9.271
  835   3HD2  LEU 106          HD23      LEU 106   7.321   2.824  -9.156
  836    H    PHE 107           HN       PHE 107  11.185   0.957  -8.127
  837    HA   PHE 107           HA       PHE 107  13.661   1.984  -7.192
  838   1HB   PHE 107          HB2       PHE 107  12.788  -0.225  -6.513
  839   2HB   PHE 107          HB1       PHE 107  13.055  -0.829  -8.147
  840    HD1  PHE 107           HD1      PHE 107  14.875   0.941  -5.398
  841    HD2  PHE 107           HD2      PHE 107  15.111  -1.862  -8.644
  842    HE1  PHE 107           HE1      PHE 107  17.238   0.481  -4.824
  843    HE2  PHE 107           HE2      PHE 107  17.479  -2.328  -8.067
  844    HZ   PHE 107           HZ       PHE 107  18.544  -1.157  -6.156
  845    H    ARG 108           HN       ARG 108  12.830   0.523 -10.330
  846    HA   ARG 108           HA       ARG 108  15.497   0.541 -11.364
  847   1HB   ARG 108          HB2       ARG 108  12.809   0.652 -12.759
  848   2HB   ARG 108          HB1       ARG 108  14.345   0.471 -13.609
  849   1HG   ARG 108          HG2       ARG 108  14.828  -1.573 -12.304
  850   2HG   ARG 108          HG1       ARG 108  13.285  -1.397 -11.468
  851   1HD   ARG 108          HD2       ARG 108  13.582  -1.695 -14.469
  852   2HD   ARG 108          HD1       ARG 108  13.171  -3.013 -13.368
  853    HE   ARG 108           HE       ARG 108  11.254  -1.139 -12.789
  854   1HH1  ARG 108          HH21      ARG 108  12.508  -2.531 -15.682
  855   2HH1  ARG 108          HH22      ARG 108  11.001  -2.451 -16.532
  856   1HH2  ARG 108          HH11      ARG 108   9.277  -1.037 -13.875
  857   2HH2  ARG 108          HH12      ARG 108   9.168  -1.611 -15.506
  858    H    GLU 109           HN       GLU 109  13.072   3.040 -11.037
  859    HA   GLU 109           HA       GLU 109  14.428   4.891 -12.855
  860   1HB   GLU 109          HB2       GLU 109  12.185   5.232 -10.849
  861   2HB   GLU 109          HB1       GLU 109  12.805   6.555 -11.833
  862   1HG   GLU 109          HG2       GLU 109  12.216   5.377 -13.879
  863   2HG   GLU 109          HG1       GLU 109  11.731   3.953 -12.958
  864    H    GLY 110           HN       GLY 110  14.350   4.267  -9.379
  865   1HA   GLY 110          HA2       GLY 110  15.990   4.879  -7.787
  866   2HA   GLY 110          HA1       GLY 110  16.835   5.778  -9.049
  867    H    ARG 111           HN       ARG 111  13.709   6.756  -9.307
  868    HA   ARG 111           HA       ARG 111  14.251   9.207  -7.707
  869   1HB   ARG 111          HB2       ARG 111  12.185   8.543  -9.823
  870   2HB   ARG 111          HB1       ARG 111  12.172  10.049  -8.904
  871   1HG   ARG 111          HG2       ARG 111  14.453  10.557  -9.695
  872   2HG   ARG 111          HG1       ARG 111  14.469   9.054 -10.609
  873   1HD   ARG 111          HD2       ARG 111  12.285  11.076 -11.044
  874   2HD   ARG 111          HD1       ARG 111  13.837  11.283 -11.840
  875    HE   ARG 111           HE       ARG 111  11.710   9.455 -12.573
  876   1HH1  ARG 111          HH21      ARG 111  15.149   9.637 -12.315
  877   2HH1  ARG 111          HH22      ARG 111  15.420   8.306 -13.389
  878   1HH2  ARG 111          HH11      ARG 111  12.054   7.739 -13.973
  879   2HH2  ARG 111          HH12      ARG 111  13.673   7.234 -14.324
  880    H    PHE 112           HN       PHE 112  13.781   8.613  -5.607
  881    HA   PHE 112           HA       PHE 112  11.255   7.209  -4.993
  882   1HB   PHE 112          HB2       PHE 112  13.396   8.264  -3.123
  883   2HB   PHE 112          HB1       PHE 112  12.134   7.088  -2.739
  884    HD1  PHE 112           HD1      PHE 112  12.121   4.859  -3.852
  885    HD2  PHE 112           HD2      PHE 112  15.377   7.615  -4.323
  886    HE1  PHE 112           HE1      PHE 112  13.544   3.035  -4.735
  887    HE2  PHE 112           HE2      PHE 112  16.800   5.784  -5.205
  888    HZ   PHE 112           HZ       PHE 112  15.882   3.491  -5.407
  889    H    ASN 113           HN       ASN 113   9.493   8.178  -4.024
  890    HA   ASN 113           HA       ASN 113   8.035   9.940  -3.511
  891   1HB   ASN 113          HB2       ASN 113  10.567  11.017  -2.224
  892   2HB   ASN 113          HB1       ASN 113   8.929  11.576  -1.883
  893   1HD2  ASN 113          HD21      ASN 113  11.197   9.778  -0.440
  894   2HD2  ASN 113          HD22      ASN 113  10.246   8.577   0.291
  Start of MODEL   17
    1   1H    MET   1           HT1      MET   1 -19.782   3.288 -14.658
    2   2H    MET   1           HT2      MET   1 -21.442   3.116 -14.975
    3   3H    MET   1           HT3      MET   1 -20.516   1.765 -14.523
    4    HA   MET   1           HA       MET   1 -22.016   3.217 -12.832
    5   1HB   MET   1          HB2       MET   1 -19.496   1.609 -12.341
    6   2HB   MET   1          HB1       MET   1 -20.579   2.134 -11.052
    7   1HG   MET   1          HG2       MET   1 -22.449   0.934 -12.136
    8   2HG   MET   1          HG1       MET   1 -21.358   0.403 -13.417
    9   1HE   MET   1          HE1       MET   1 -22.668  -1.646 -12.695
   10   2HE   MET   1          HE2       MET   1 -23.141  -1.524 -11.002
   11   3HE   MET   1          HE3       MET   1 -22.065  -2.821 -11.517
   12    H    GLY   2           HN       GLY   2 -21.765   4.975 -11.473
   13   1HA   GLY   2          HA2       GLY   2 -19.692   6.887 -12.096
   14   2HA   GLY   2          HA1       GLY   2 -20.888   7.056 -10.811
   15    HA   PRO   3           HA       PRO   3 -16.365   5.976  -9.343
   16   1HB   PRO   3          HB2       PRO   3 -16.635   8.385  -7.708
   17   2HB   PRO   3          HB1       PRO   3 -15.402   7.997  -8.912
   18   1HG   PRO   3          HG2       PRO   3 -17.643   9.811  -9.174
   19   2HG   PRO   3          HG1       PRO   3 -16.362   9.483 -10.347
   20   1HD   PRO   3          HD2       PRO   3 -19.094   8.727 -10.589
   21   2HD   PRO   3          HD1       PRO   3 -17.751   8.152 -11.608
   22    H    VAL   4           HN       VAL   4 -16.214   4.727  -7.499
   23    HA   VAL   4           HA       VAL   4 -18.582   4.443  -5.826
   24    HB   VAL   4           HB       VAL   4 -17.249   2.634  -4.740
   25   1HG1  VAL   4          HG11      VAL   4 -17.168   2.587  -7.770
   26   2HG1  VAL   4          HG12      VAL   4 -18.596   2.234  -6.798
   27   3HG1  VAL   4          HG13      VAL   4 -17.185   1.181  -6.705
   28   1HG2  VAL   4          HG21      VAL   4 -15.131   3.556  -6.708
   29   2HG2  VAL   4          HG22      VAL   4 -15.045   2.075  -5.757
   30   3HG2  VAL   4          HG23      VAL   4 -15.023   3.644  -4.951
   31    HA   PRO   5           HA       PRO   5 -17.187   7.251  -2.639
   32   1HB   PRO   5          HB2       PRO   5 -18.225   5.872  -0.392
   33   2HB   PRO   5          HB1       PRO   5 -19.071   7.080  -1.366
   34   1HG   PRO   5          HG2       PRO   5 -19.396   4.144  -1.340
   35   2HG   PRO   5          HG1       PRO   5 -20.520   5.389  -1.896
   36   1HD   PRO   5          HD2       PRO   5 -19.020   3.684  -3.567
   37   2HD   PRO   5          HD1       PRO   5 -19.814   5.198  -4.074
   38    HA   PRO   6           HA       PRO   6 -13.388   5.820  -0.839
   39   1HB   PRO   6          HB2       PRO   6 -13.826   6.789   1.849
   40   2HB   PRO   6          HB1       PRO   6 -12.861   7.528   0.568
   41   1HG   PRO   6          HG2       PRO   6 -15.438   8.372   1.580
   42   2HG   PRO   6          HG1       PRO   6 -14.429   9.162   0.364
   43   1HD   PRO   6          HD2       PRO   6 -16.904   7.777  -0.081
   44   2HD   PRO   6          HD1       PRO   6 -15.807   8.451  -1.312
   45    H    SER   7           HN       SER   7 -16.088   5.317   1.458
   46    HA   SER   7           HA       SER   7 -14.863   3.192   2.905
   47   1HB   SER   7          HB2       SER   7 -17.041   2.735   3.796
   48   2HB   SER   7          HB1       SER   7 -16.962   4.476   3.550
   49    HG   SER   7           HG       SER   7 -18.875   3.732   2.680
   50    H    THR   8           HN       THR   8 -16.855   3.168  -0.035
   51    HA   THR   8           HA       THR   8 -17.039   0.290  -0.199
   52    HB   THR   8           HB       THR   8 -17.215   2.374  -2.399
   53    HG1  THR   8           HG1      THR   8 -18.940   1.435  -0.445
   54   1HG2  THR   8          HG21      THR   8 -16.904   0.267  -3.450
   55   2HG2  THR   8          HG22      THR   8 -18.650   0.514  -3.443
   56   3HG2  THR   8          HG23      THR   8 -17.907  -0.563  -2.261
   57    H    ALA   9           HN       ALA   9 -14.799   2.679  -1.572
   58    HA   ALA   9           HA       ALA   9 -13.285   0.845  -3.158
   59   1HB   ALA   9          HB1       ALA   9 -12.586   3.500  -1.882
   60   2HB   ALA   9          HB2       ALA   9 -13.015   3.194  -3.565
   61   3HB   ALA   9          HB3       ALA   9 -11.473   2.621  -2.930
   62    H    LEU  10           HN       LEU  10 -12.955   1.922   0.218
   63    HA   LEU  10           HA       LEU  10 -10.477   0.646   0.750
   64   1HB   LEU  10          HB2       LEU  10 -11.504   2.263   2.303
   65   2HB   LEU  10          HB1       LEU  10 -12.801   1.120   2.646
   66    HG   LEU  10           HG       LEU  10 -11.100  -0.499   3.505
   67   1HD1  LEU  10          HD11      LEU  10  -9.064   0.039   2.459
   68   2HD1  LEU  10          HD12      LEU  10  -8.832   0.681   4.081
   69   3HD1  LEU  10          HD13      LEU  10  -9.255   1.767   2.757
   70   1HD2  LEU  10          HD21      LEU  10 -10.618   0.754   5.586
   71   2HD2  LEU  10          HD22      LEU  10 -12.276   0.993   5.041
   72   3HD2  LEU  10          HD23      LEU  10 -11.071   2.252   4.771
   73    H    ARG  11           HN       ARG  11 -13.819  -0.595   1.172
   74    HA   ARG  11           HA       ARG  11 -13.070  -3.164   2.158
   75   1HB   ARG  11          HB2       ARG  11 -15.450  -2.295   0.494
   76   2HB   ARG  11          HB1       ARG  11 -15.288  -3.907   1.187
   77   1HG   ARG  11          HG2       ARG  11 -15.207  -2.977   3.439
   78   2HG   ARG  11          HG1       ARG  11 -15.237  -1.335   2.791
   79   1HD   ARG  11          HD2       ARG  11 -17.461  -1.575   1.990
   80   2HD   ARG  11          HD1       ARG  11 -17.424  -3.328   2.174
   81    HE   ARG  11           HE       ARG  11 -17.048  -2.401   4.751
   82   1HH1  ARG  11          HH21      ARG  11 -19.293  -1.810   2.205
   83   2HH1  ARG  11          HH22      ARG  11 -20.631  -1.529   3.268
   84   1HH2  ARG  11          HH11      ARG  11 -18.783  -2.049   6.157
   85   2HH2  ARG  11          HH12      ARG  11 -20.343  -1.669   5.508
   86    H    GLU  12           HN       GLU  12 -13.561  -1.976  -1.148
   87    HA   GLU  12           HA       GLU  12 -13.079  -4.463  -2.468
   88   1HB   GLU  12          HB2       GLU  12 -12.672  -1.587  -3.350
   89   2HB   GLU  12          HB1       GLU  12 -12.486  -2.971  -4.432
   90   1HG   GLU  12          HG2       GLU  12 -15.004  -2.398  -2.846
   91   2HG   GLU  12          HG1       GLU  12 -14.767  -1.902  -4.521
   92    H    LEU  13           HN       LEU  13 -10.932  -1.850  -1.402
   93    HA   LEU  13           HA       LEU  13  -8.539  -2.980  -2.548
   94   1HB   LEU  13          HB2       LEU  13  -8.750  -0.589  -1.945
   95   2HB   LEU  13          HB1       LEU  13  -8.869  -1.032  -0.245
   96    HG   LEU  13           HG       LEU  13  -6.600  -2.059  -0.378
   97   1HD1  LEU  13          HD11      LEU  13  -6.233  -2.693  -2.594
   98   2HD1  LEU  13          HD12      LEU  13  -5.293  -1.206  -2.514
   99   3HD1  LEU  13          HD13      LEU  13  -6.896  -1.196  -3.246
  100   1HD2  LEU  13          HD21      LEU  13  -6.885   0.286   0.349
  101   2HD2  LEU  13          HD22      LEU  13  -6.751   0.821  -1.326
  102   3HD2  LEU  13          HD23      LEU  13  -5.368   0.074  -0.525
  103    H    ILE  14           HN       ILE  14  -9.847  -3.012   0.801
  104    HA   ILE  14           HA       ILE  14  -7.717  -4.519   1.928
  105    HB   ILE  14           HB       ILE  14 -10.637  -4.349   2.726
  106   1HG1  ILE  14          HG12      ILE  14  -8.151  -3.123   3.967
  107   2HG1  ILE  14          HG11      ILE  14  -9.193  -2.273   2.827
  108   1HG2  ILE  14          HG21      ILE  14  -9.848  -6.399   3.673
  109   2HG2  ILE  14          HG22      ILE  14  -9.708  -5.205   4.962
  110   3HG2  ILE  14          HG23      ILE  14  -8.277  -5.699   4.059
  111   1HD1  ILE  14          HD11      ILE  14  -9.857  -1.675   5.089
  112   2HD1  ILE  14          HD12      ILE  14  -9.996  -3.375   5.534
  113   3HD1  ILE  14          HD13      ILE  14 -11.123  -2.673   4.373
  114    H    GLU  15           HN       GLU  15 -10.842  -5.691   0.613
  115    HA   GLU  15           HA       GLU  15 -10.353  -8.447   1.080
  116   1HB   GLU  15          HB2       GLU  15 -12.001  -7.051  -1.038
  117   2HB   GLU  15          HB1       GLU  15 -11.996  -8.801  -0.819
  118   1HG   GLU  15          HG2       GLU  15 -12.820  -8.588   1.443
  119   2HG   GLU  15          HG1       GLU  15 -12.642  -6.834   1.394
  120    H    GLU  16           HN       GLU  16  -9.464  -6.438  -1.740
  121    HA   GLU  16           HA       GLU  16  -8.477  -8.692  -3.254
  122   1HB   GLU  16          HB2       GLU  16  -9.142  -6.476  -4.247
  123   2HB   GLU  16          HB1       GLU  16  -7.660  -5.794  -3.572
  124   1HG   GLU  16          HG2       GLU  16  -6.288  -7.292  -4.874
  125   2HG   GLU  16          HG1       GLU  16  -7.699  -8.207  -5.405
  126    H    LEU  17           HN       LEU  17  -6.848  -6.274  -1.178
  127    HA   LEU  17           HA       LEU  17  -4.192  -7.186  -1.668
  128   1HB   LEU  17          HB2       LEU  17  -5.431  -5.933   0.798
  129   2HB   LEU  17          HB1       LEU  17  -3.703  -6.220   0.621
  130    HG   LEU  17           HG       LEU  17  -5.358  -4.575  -1.317
  131   1HD1  LEU  17          HD11      LEU  17  -3.539  -3.680   0.941
  132   2HD1  LEU  17          HD12      LEU  17  -5.295  -3.523   0.908
  133   3HD1  LEU  17          HD13      LEU  17  -4.307  -2.614  -0.236
  134   1HD2  LEU  17          HD21      LEU  17  -2.437  -5.290  -1.085
  135   2HD2  LEU  17          HD22      LEU  17  -2.878  -3.718  -1.748
  136   3HD2  LEU  17          HD23      LEU  17  -3.451  -5.188  -2.525
  137    H    VAL  18           HN       VAL  18  -6.610  -8.202   0.717
  138    HA   VAL  18           HA       VAL  18  -4.922 -10.144   2.004
  139    HB   VAL  18           HB       VAL  18  -7.930  -9.822   1.834
  140   1HG1  VAL  18          HG11      VAL  18  -6.241 -11.861   3.282
  141   2HG1  VAL  18          HG12      VAL  18  -7.694 -12.119   2.317
  142   3HG1  VAL  18          HG13      VAL  18  -7.817 -11.378   3.912
  143   1HG2  VAL  18          HG21      VAL  18  -6.411  -8.124   3.047
  144   2HG2  VAL  18          HG22      VAL  18  -6.105  -9.416   4.209
  145   3HG2  VAL  18          HG23      VAL  18  -7.745  -8.811   3.975
  146    H    ASN  19           HN       ASN  19  -7.269 -10.348  -0.666
  147    HA   ASN  19           HA       ASN  19  -7.258 -13.168  -0.979
  148   1HB   ASN  19          HB2       ASN  19  -7.695 -10.927  -2.958
  149   2HB   ASN  19          HB1       ASN  19  -7.880 -12.626  -3.394
  150   1HD2  ASN  19          HD21      ASN  19 -10.087 -10.751  -3.400
  151   2HD2  ASN  19          HD22      ASN  19 -11.185 -11.247  -2.204
  152    H    ILE  20           HN       ILE  20  -5.042 -10.737  -2.393
  153    HA   ILE  20           HA       ILE  20  -3.688 -12.757  -3.990
  154    HB   ILE  20           HB       ILE  20  -2.097 -10.965  -4.546
  155   1HG1  ILE  20          HG12      ILE  20  -3.717  -9.273  -2.617
  156   2HG1  ILE  20          HG11      ILE  20  -2.095  -9.881  -2.287
  157   1HG2  ILE  20          HG21      ILE  20  -3.674  -9.542  -5.697
  158   2HG2  ILE  20          HG22      ILE  20  -4.950  -9.945  -4.549
  159   3HG2  ILE  20          HG23      ILE  20  -4.346 -11.172  -5.662
  160   1HD1  ILE  20          HD11      ILE  20  -1.892  -7.616  -3.128
  161   2HD1  ILE  20          HD12      ILE  20  -2.902  -8.003  -4.521
  162   3HD1  ILE  20          HD13      ILE  20  -1.300  -8.724  -4.367
  163    H    THR  21           HN       THR  21  -3.327 -11.762  -0.685
  164    HA   THR  21           HA       THR  21  -0.527 -12.810  -0.615
  165    HB   THR  21           HB       THR  21  -0.504 -11.932   1.708
  166    HG1  THR  21           HG1      THR  21  -2.663 -10.399   1.570
  167   1HG2  THR  21          HG21      THR  21  -0.190  -9.706   1.078
  168   2HG2  THR  21          HG22      THR  21  -1.566  -9.719  -0.022
  169   3HG2  THR  21          HG23      THR  21  -0.065 -10.526  -0.479
  170    H    GLN  22           HN       GLN  22  -3.767 -13.736   0.300
  171    HA   GLN  22           HA       GLN  22  -2.899 -15.676   2.289
  172   1HB   GLN  22          HB2       GLN  22  -5.526 -15.252   0.861
  173   2HB   GLN  22          HB1       GLN  22  -5.277 -16.523   2.060
  174   1HG   GLN  22          HG2       GLN  22  -4.632 -14.849   3.734
  175   2HG   GLN  22          HG1       GLN  22  -4.819 -13.564   2.543
  176   1HE2  GLN  22          HE21      GLN  22  -6.358 -13.949   5.082
  177   2HE2  GLN  22          HE22      GLN  22  -7.987 -14.066   4.617
  178    H    ASN  23           HN       ASN  23  -3.784 -15.879  -1.148
  179    HA   ASN  23           HA       ASN  23  -3.244 -18.801  -1.117
  180   1HB   ASN  23          HB2       ASN  23  -4.165 -18.801  -3.364
  181   2HB   ASN  23          HB1       ASN  23  -5.242 -17.887  -2.308
  182   1HD2  ASN  23          HD21      ASN  23  -5.412 -17.327  -5.024
  183   2HD2  ASN  23          HD22      ASN  23  -4.710 -15.818  -5.359
  184    H    GLN  24           HN       GLN  24  -1.200 -16.334  -1.136
  185    HA   GLN  24           HA       GLN  24   0.288 -16.925  -3.595
  186   1HB   GLN  24          HB2       GLN  24   1.781 -15.204  -2.942
  187   2HB   GLN  24          HB1       GLN  24   0.203 -14.655  -2.391
  188   1HG   GLN  24          HG2       GLN  24   0.759 -15.658  -0.124
  189   2HG   GLN  24          HG1       GLN  24   2.402 -15.896  -0.717
  190   1HE2  GLN  24          HE21      GLN  24   2.332 -14.227   1.395
  191   2HE2  GLN  24          HE22      GLN  24   2.469 -12.601   0.926
  192    H    LYS  25           HN       LYS  25   1.861 -18.416  -3.812
  193    HA   LYS  25           HA       LYS  25   2.582 -20.096  -1.496
  194   1HB   LYS  25          HB2       LYS  25   2.100 -21.098  -3.724
  195   2HB   LYS  25          HB1       LYS  25   3.465 -20.215  -4.401
  196   1HG   LYS  25          HG2       LYS  25   4.993 -21.390  -2.859
  197   2HG   LYS  25          HG1       LYS  25   3.625 -22.279  -2.185
  198   1HD   LYS  25          HD2       LYS  25   3.146 -23.238  -4.408
  199   2HD   LYS  25          HD1       LYS  25   4.514 -22.355  -5.085
  200   1HE   LYS  25          HE2       LYS  25   5.213 -24.635  -4.610
  201   2HE   LYS  25          HE1       LYS  25   6.015 -23.548  -3.476
  202   1HZ   LYS  25          HZ1       LYS  25   5.193 -24.901  -1.924
  203   2HZ   LYS  25          HZ2       LYS  25   4.066 -25.607  -2.982
  204   3HZ   LYS  25          HZ3       LYS  25   3.707 -24.137  -2.209
  205    H    ALA  26           HN       ALA  26   4.700 -18.875  -4.086
  206    HA   ALA  26           HA       ALA  26   6.812 -18.323  -2.110
  207   1HB   ALA  26          HB1       ALA  26   6.681 -18.883  -4.936
  208   2HB   ALA  26          HB2       ALA  26   8.119 -18.797  -3.922
  209   3HB   ALA  26          HB3       ALA  26   7.521 -17.347  -4.728
  210    HA   PRO  27           HA       PRO  27   6.142 -13.995  -1.477
  211   1HB   PRO  27          HB2       PRO  27   8.607 -13.133  -2.834
  212   2HB   PRO  27          HB1       PRO  27   8.198 -13.056  -1.117
  213   1HG   PRO  27          HG2       PRO  27  10.008 -14.870  -2.359
  214   2HG   PRO  27          HG1       PRO  27   9.457 -14.905  -0.680
  215   1HD   PRO  27          HD2       PRO  27   8.803 -16.779  -2.788
  216   2HD   PRO  27          HD1       PRO  27   8.234 -16.796  -1.100
  217    H    LEU  28           HN       LEU  28   5.434 -12.060  -2.659
  218    HA   LEU  28           HA       LEU  28   4.434 -12.611  -5.297
  219   1HB   LEU  28          HB2       LEU  28   4.746  -9.948  -3.876
  220   2HB   LEU  28          HB1       LEU  28   3.757 -10.229  -5.307
  221    HG   LEU  28           HG       LEU  28   3.369 -11.655  -2.655
  222   1HD1  LEU  28          HD11      LEU  28   1.948  -9.272  -3.877
  223   2HD1  LEU  28          HD12      LEU  28   2.840  -9.313  -2.356
  224   3HD1  LEU  28          HD13      LEU  28   1.319 -10.192  -2.510
  225   1HD2  LEU  28          HD21      LEU  28   1.940 -11.691  -5.317
  226   2HD2  LEU  28          HD22      LEU  28   1.045 -12.025  -3.835
  227   3HD2  LEU  28          HD23      LEU  28   2.403 -13.047  -4.289
  228    H    CYS  29           HN       CYS  29   6.883 -10.217  -4.262
  229    HA   CYS  29           HA       CYS  29   7.897 -10.047  -7.030
  230   1HB   CYS  29          HB2       CYS  29   8.653  -8.658  -4.449
  231   2HB   CYS  29          HB1       CYS  29   9.530  -8.414  -5.959
  232    H    ASN  30           HN       ASN  30  10.451 -10.077  -7.152
  233    HA   ASN  30           HA       ASN  30  11.310 -12.743  -6.458
  234   1HB   ASN  30          HB2       ASN  30  12.818 -10.310  -7.455
  235   2HB   ASN  30          HB1       ASN  30  13.578 -11.882  -7.211
  236   1HD2  ASN  30          HD21      ASN  30  13.328 -10.603  -9.815
  237   2HD2  ASN  30          HD22      ASN  30  12.322 -11.584 -10.767
  238    H    GLY  31           HN       GLY  31  10.493 -11.756  -4.058
  239   1HA   GLY  31          HA2       GLY  31  11.259 -11.617  -1.835
  240   2HA   GLY  31          HA1       GLY  31  12.885 -11.948  -2.439
  241    H    SER  32           HN       SER  32  11.049  -9.327  -3.795
  242    HA   SER  32           HA       SER  32  13.097  -7.408  -3.243
  243   1HB   SER  32          HB2       SER  32  10.195  -6.956  -3.988
  244   2HB   SER  32          HB1       SER  32  11.470  -5.744  -4.070
  245    HG   SER  32           HG       SER  32  10.994  -6.921  -6.067
  246    H    MET  33           HN       MET  33  13.113  -5.665  -1.795
  247    HA   MET  33           HA       MET  33  11.308  -5.925   0.593
  248   1HB   MET  33          HB2       MET  33  14.166  -4.899   0.438
  249   2HB   MET  33          HB1       MET  33  13.180  -4.987   1.898
  250   1HG   MET  33          HG2       MET  33  13.010  -7.435   1.644
  251   2HG   MET  33          HG1       MET  33  13.995  -7.351   0.186
  252   1HE   MET  33          HE1       MET  33  13.570  -6.766   3.801
  253   2HE   MET  33          HE2       MET  33  14.574  -5.322   3.746
  254   3HE   MET  33          HE3       MET  33  15.176  -6.771   4.541
  255    H    VAL  34           HN       VAL  34  10.802  -3.825   1.632
  256    HA   VAL  34           HA       VAL  34  11.064  -1.472  -0.215
  257    HB   VAL  34           HB       VAL  34   8.745  -0.820   0.569
  258   1HG1  VAL  34          HG11      VAL  34   9.033  -3.414  -0.976
  259   2HG1  VAL  34          HG12      VAL  34   9.133  -1.790  -1.653
  260   3HG1  VAL  34          HG13      VAL  34   7.608  -2.375  -0.989
  261   1HG2  VAL  34          HG21      VAL  34   8.671  -2.301   2.544
  262   2HG2  VAL  34          HG22      VAL  34   8.725  -3.712   1.486
  263   3HG2  VAL  34          HG23      VAL  34   7.329  -2.635   1.449
  264    H    TRP  35           HN       TRP  35  10.868   0.600   0.917
  265    HA   TRP  35           HA       TRP  35  12.348   0.579   3.408
  266   1HB   TRP  35          HB2       TRP  35  10.975   2.771   1.837
  267   2HB   TRP  35          HB1       TRP  35  11.876   3.075   3.321
  268    HD1  TRP  35           HD1      TRP  35  12.331   2.113  -0.328
  269    HE1  TRP  35           HE1      TRP  35  14.832   2.266  -0.928
  270    HE3  TRP  35           HE3      TRP  35  14.303   2.847   4.317
  271    HZ2  TRP  35           HZ2      TRP  35  17.340   2.640   0.391
  272    HZ3  TRP  35           HZ3      TRP  35  16.752   3.090   4.620
  273    HH2  TRP  35           HH2      TRP  35  18.272   2.989   2.665
  274    H    SER  36           HN       SER  36  11.524   0.569   5.456
  275    HA   SER  36           HA       SER  36   8.686   0.236   5.882
  276   1HB   SER  36          HB2       SER  36   9.261   0.204   8.256
  277   2HB   SER  36          HB1       SER  36  10.453  -0.736   7.364
  278    HG   SER  36           HG       SER  36  10.732   1.588   8.787
  279    H    ILE  37           HN       ILE  37   7.206   1.739   6.756
  280    HA   ILE  37           HA       ILE  37   8.149   4.576   7.010
  281    HB   ILE  37           HB       ILE  37   5.995   5.274   5.933
  282   1HG1  ILE  37          HG12      ILE  37   5.792   2.436   4.901
  283   2HG1  ILE  37          HG11      ILE  37   4.950   2.925   6.369
  284   1HG2  ILE  37          HG21      ILE  37   6.781   4.973   3.688
  285   2HG2  ILE  37          HG22      ILE  37   7.648   3.499   4.121
  286   3HG2  ILE  37          HG23      ILE  37   8.213   5.061   4.714
  287   1HD1  ILE  37          HD11      ILE  37   4.679   4.413   3.746
  288   2HD1  ILE  37          HD12      ILE  37   3.690   4.600   5.194
  289   3HD1  ILE  37          HD13      ILE  37   3.584   3.121   4.240
  290    H    ASN  38           HN       ASN  38   6.586   5.919   8.252
  291    HA   ASN  38           HA       ASN  38   5.525   4.376  10.539
  292   1HB   ASN  38          HB2       ASN  38   6.794   6.507  10.895
  293   2HB   ASN  38          HB1       ASN  38   5.524   7.373  10.031
  294   1HD2  ASN  38          HD21      ASN  38   5.400   4.772  12.538
  295   2HD2  ASN  38          HD22      ASN  38   4.371   5.630  13.580
  296    H    LEU  39           HN       LEU  39   3.427   3.691  10.483
  297    HA   LEU  39           HA       LEU  39   1.650   4.614   8.370
  298   1HB   LEU  39          HB2       LEU  39   1.215   2.787  10.747
  299   2HB   LEU  39          HB1       LEU  39  -0.020   3.114   9.536
  300    HG   LEU  39           HG       LEU  39   1.154   1.005   9.045
  301   1HD1  LEU  39          HD11      LEU  39   2.194   2.883   6.941
  302   2HD1  LEU  39          HD12      LEU  39   0.455   2.773   7.207
  303   3HD1  LEU  39          HD13      LEU  39   1.368   1.337   6.760
  304   1HD2  LEU  39          HD21      LEU  39   3.471   0.812   8.777
  305   2HD2  LEU  39          HD22      LEU  39   3.353   1.944  10.121
  306   3HD2  LEU  39          HD23      LEU  39   3.690   2.538   8.494
  307    H    THR  40           HN       THR  40   0.573   6.491   8.506
  308    HA   THR  40           HA       THR  40  -0.649   7.298  11.096
  309    HB   THR  40           HB       THR  40   0.215   9.554  10.907
  310    HG1  THR  40           HG1      THR  40   1.595  10.082   9.182
  311   1HG2  THR  40          HG21      THR  40   2.579   9.146  11.264
  312   2HG2  THR  40          HG22      THR  40   2.486   7.617  10.391
  313   3HG2  THR  40          HG23      THR  40   1.672   7.796  11.945
  314    H    ALA  41           HN       ALA  41  -0.694   9.866   8.998
  315    HA   ALA  41           HA       ALA  41  -3.483   9.276   8.217
  316   1HB   ALA  41          HB1       ALA  41  -1.788  11.770   7.916
  317   2HB   ALA  41          HB2       ALA  41  -2.992  11.469   9.168
  318   3HB   ALA  41          HB3       ALA  41  -3.495  11.654   7.488
  319    H    GLY  42           HN       GLY  42  -1.046  11.038   6.317
  320   1HA   GLY  42          HA2       GLY  42  -2.082  10.124   3.812
  321   2HA   GLY  42          HA1       GLY  42  -0.527  10.920   4.033
  322    H    MET  43           HN       MET  43  -1.736   7.792   5.254
  323    HA   MET  43           HA       MET  43   0.738   6.431   4.844
  324   1HB   MET  43          HB2       MET  43  -2.086   5.356   5.016
  325   2HB   MET  43          HB1       MET  43  -0.635   4.360   5.094
  326   1HG   MET  43          HG2       MET  43   0.133   5.723   7.031
  327   2HG   MET  43          HG1       MET  43  -1.407   6.572   7.007
  328   1HE   MET  43          HE1       MET  43  -3.533   5.484   6.838
  329   2HE   MET  43          HE2       MET  43  -4.046   4.130   7.839
  330   3HE   MET  43          HE3       MET  43  -3.429   3.831   6.216
  331    H    TYR  44           HN       TYR  44  -2.160   6.711   2.800
  332    HA   TYR  44           HA       TYR  44  -1.431   4.820   0.821
  333   1HB   TYR  44          HB2       TYR  44  -2.969   7.418   0.518
  334   2HB   TYR  44          HB1       TYR  44  -2.921   6.127  -0.683
  335    HD1  TYR  44           HD1      TYR  44  -4.050   3.986  -0.288
  336    HD2  TYR  44           HD2      TYR  44  -4.145   7.130   2.638
  337    HE1  TYR  44           HE1      TYR  44  -5.874   2.811   0.917
  338    HE2  TYR  44           HE2      TYR  44  -5.969   5.958   3.841
  339    HH   TYR  44           HH       TYR  44  -6.904   3.765   4.069
  340    H    CYS  45           HN       CYS  45  -0.746   8.334   0.940
  341    HA   CYS  45           HA       CYS  45   0.753   8.346  -1.515
  342   1HB   CYS  45          HB2       CYS  45   0.745  10.226   0.858
  343   2HB   CYS  45          HB1       CYS  45   1.657  10.531  -0.622
  344    H    ALA  46           HN       ALA  46   1.811   8.286   1.905
  345    HA   ALA  46           HA       ALA  46   4.595   8.117   1.355
  346   1HB   ALA  46          HB1       ALA  46   3.196   6.799   3.692
  347   2HB   ALA  46          HB2       ALA  46   3.503   8.533   3.612
  348   3HB   ALA  46          HB3       ALA  46   4.853   7.399   3.631
  349    H    ALA  47           HN       ALA  47   2.186   5.538   1.865
  350    HA   ALA  47           HA       ALA  47   4.002   3.358   1.518
  351   1HB   ALA  47          HB1       ALA  47   1.873   2.097   0.857
  352   2HB   ALA  47          HB2       ALA  47   1.018   3.619   1.090
  353   3HB   ALA  47          HB3       ALA  47   1.855   2.863   2.446
  354    H    LEU  48           HN       LEU  48   2.044   5.217  -0.784
  355    HA   LEU  48           HA       LEU  48   2.508   3.617  -3.071
  356   1HB   LEU  48          HB2       LEU  48   0.833   5.416  -3.006
  357   2HB   LEU  48          HB1       LEU  48   2.116   6.619  -2.906
  358    HG   LEU  48           HG       LEU  48   2.967   5.890  -5.121
  359   1HD1  LEU  48          HD11      LEU  48   2.400   3.633  -5.384
  360   2HD1  LEU  48          HD12      LEU  48   1.211   4.413  -6.422
  361   3HD1  LEU  48          HD13      LEU  48   0.750   3.872  -4.808
  362   1HD2  LEU  48          HD21      LEU  48   1.223   7.688  -4.880
  363   2HD2  LEU  48          HD22      LEU  48  -0.009   6.466  -5.195
  364   3HD2  LEU  48          HD23      LEU  48   1.178   6.861  -6.437
  365    H    GLU  49           HN       GLU  49   4.384   6.506  -1.973
  366    HA   GLU  49           HA       GLU  49   6.251   6.387  -4.116
  367   1HB   GLU  49          HB2       GLU  49   7.835   7.581  -2.519
  368   2HB   GLU  49          HB1       GLU  49   6.281   8.367  -2.797
  369   1HG   GLU  49          HG2       GLU  49   5.412   7.405  -0.714
  370   2HG   GLU  49          HG1       GLU  49   6.958   6.602  -0.426
  371    H    SER  50           HN       SER  50   6.182   4.627  -1.041
  372    HA   SER  50           HA       SER  50   8.830   3.537  -1.277
  373   1HB   SER  50          HB2       SER  50   8.154   1.950   0.390
  374   2HB   SER  50          HB1       SER  50   7.319   3.451   0.776
  375    HG   SER  50           HG       SER  50   6.116   1.576  -0.937
  376    H    LEU  51           HN       LEU  51   5.665   2.494  -2.490
  377    HA   LEU  51           HA       LEU  51   6.587  -0.003  -3.603
  378   1HB   LEU  51          HB2       LEU  51   4.194   1.726  -4.288
  379   2HB   LEU  51          HB1       LEU  51   4.448   0.096  -4.905
  380    HG   LEU  51           HG       LEU  51   4.334   0.779  -1.951
  381   1HD1  LEU  51          HD11      LEU  51   2.180   1.209  -3.231
  382   2HD1  LEU  51          HD12      LEU  51   2.057   0.023  -1.934
  383   3HD1  LEU  51          HD13      LEU  51   2.155  -0.513  -3.611
  384   1HD2  LEU  51          HD21      LEU  51   5.429  -1.286  -2.076
  385   2HD2  LEU  51          HD22      LEU  51   4.585  -1.769  -3.547
  386   3HD2  LEU  51          HD23      LEU  51   3.750  -1.809  -1.996
  387    H    ILE  52           HN       ILE  52   6.407   3.302  -4.834
  388    HA   ILE  52           HA       ILE  52   6.774   2.840  -7.583
  389    HB   ILE  52           HB       ILE  52   7.856   5.020  -5.782
  390   1HG1  ILE  52          HG12      ILE  52   5.411   4.966  -6.040
  391   2HG1  ILE  52          HG11      ILE  52   6.085   6.382  -6.832
  392   1HG2  ILE  52          HG21      ILE  52   8.095   4.706  -8.770
  393   2HG2  ILE  52          HG22      ILE  52   9.361   5.060  -7.597
  394   3HG2  ILE  52          HG23      ILE  52   8.158   6.288  -7.990
  395   1HD1  ILE  52          HD11      ILE  52   4.774   3.982  -8.023
  396   2HD1  ILE  52          HD12      ILE  52   6.094   4.697  -8.942
  397   3HD1  ILE  52          HD13      ILE  52   4.689   5.669  -8.518
  398    H    ASN  53           HN       ASN  53   8.983   2.292  -4.952
  399    HA   ASN  53           HA       ASN  53  11.359   2.194  -6.669
  400   1HB   ASN  53          HB2       ASN  53  10.822   1.439  -3.789
  401   2HB   ASN  53          HB1       ASN  53  12.380   1.148  -4.563
  402   1HD2  ASN  53          HD21      ASN  53  12.919   3.372  -6.014
  403   2HD2  ASN  53          HD22      ASN  53  12.890   4.773  -5.056
  404    H    VAL  54           HN       VAL  54   8.800   0.056  -5.826
  405    HA   VAL  54           HA       VAL  54  10.371  -2.381  -6.436
  406    HB   VAL  54           HB       VAL  54   7.434  -2.010  -5.769
  407   1HG1  VAL  54          HG11      VAL  54   9.179  -4.459  -6.125
  408   2HG1  VAL  54          HG12      VAL  54   7.688  -4.066  -6.981
  409   3HG1  VAL  54          HG13      VAL  54   7.636  -4.500  -5.272
  410   1HG2  VAL  54          HG21      VAL  54   8.105  -2.873  -3.557
  411   2HG2  VAL  54          HG22      VAL  54   8.980  -1.390  -3.941
  412   3HG2  VAL  54          HG23      VAL  54   9.784  -2.953  -4.094
  413    H    SER  55           HN       SER  55  10.608  -3.002  -8.513
  414    HA   SER  55           HA       SER  55   8.430  -2.374 -10.486
  415   1HB   SER  55          HB2       SER  55  11.431  -2.163 -10.815
  416   2HB   SER  55          HB1       SER  55  10.318  -2.196 -12.179
  417    HG   SER  55           HG       SER  55  10.162  -0.375 -10.004
  418    H    GLY  56           HN       GLY  56   8.110  -3.968 -12.110
  419   1HA   GLY  56          HA2       GLY  56   8.464  -6.069 -13.189
  420   2HA   GLY  56          HA1       GLY  56   9.742  -6.429 -12.029
  421    H    CYS  57           HN       CYS  57   6.493  -5.350 -11.124
  422    HA   CYS  57           HA       CYS  57   5.789  -8.122 -10.280
  423   1HB   CYS  57          HB2       CYS  57   5.865  -5.714  -8.438
  424   2HB   CYS  57          HB1       CYS  57   5.094  -7.248  -8.039
  425    H    SER  58           HN       SER  58   4.029  -8.229 -11.659
  426    HA   SER  58           HA       SER  58   2.162  -6.060 -12.072
  427   1HB   SER  58          HB2       SER  58   2.484  -7.943 -13.678
  428   2HB   SER  58          HB1       SER  58   1.758  -9.034 -12.501
  429    HG   SER  58           HG       SER  58   0.162  -6.941 -12.750
  430    H    ALA  59           HN       ALA  59   2.310  -8.819  -9.893
  431    HA   ALA  59           HA       ALA  59  -0.287  -8.922  -8.896
  432   1HB   ALA  59          HB1       ALA  59   1.459 -10.484  -8.200
  433   2HB   ALA  59          HB2       ALA  59   0.721  -9.740  -6.782
  434   3HB   ALA  59          HB3       ALA  59   2.301  -9.193  -7.344
  435    H    ILE  60           HN       ILE  60   1.942  -6.279  -8.550
  436    HA   ILE  60           HA       ILE  60   0.109  -5.038  -6.508
  437    HB   ILE  60           HB       ILE  60   2.039  -3.768  -5.684
  438   1HG1  ILE  60          HG12      ILE  60   3.685  -5.453  -7.602
  439   2HG1  ILE  60          HG11      ILE  60   3.316  -3.752  -7.853
  440   1HG2  ILE  60          HG21      ILE  60   1.449  -6.111  -4.843
  441   2HG2  ILE  60          HG22      ILE  60   3.085  -5.553  -4.495
  442   3HG2  ILE  60          HG23      ILE  60   2.803  -6.691  -5.813
  443   1HD1  ILE  60          HD11      ILE  60   4.334  -3.467  -5.435
  444   2HD1  ILE  60          HD12      ILE  60   5.398  -3.609  -6.832
  445   3HD1  ILE  60          HD13      ILE  60   5.106  -5.010  -5.802
  446    H    GLU  61           HN       GLU  61   1.081  -4.969  -9.676
  447    HA   GLU  61           HA       GLU  61   1.405  -2.188 -10.187
  448   1HB   GLU  61          HB2       GLU  61   1.908  -3.848 -11.878
  449   2HB   GLU  61          HB1       GLU  61   0.234  -4.402 -11.906
  450   1HG   GLU  61          HG2       GLU  61  -0.467  -2.201 -12.732
  451   2HG   GLU  61          HG1       GLU  61   1.205  -1.644 -12.669
  452    H    LYS  62           HN       LYS  62  -1.528  -4.232 -10.185
  453    HA   LYS  62           HA       LYS  62  -3.372  -2.091 -10.677
  454   1HB   LYS  62          HB2       LYS  62  -3.709  -4.751  -9.261
  455   2HB   LYS  62          HB1       LYS  62  -5.048  -3.651  -9.593
  456   1HG   LYS  62          HG2       LYS  62  -4.539  -3.754 -12.005
  457   2HG   LYS  62          HG1       LYS  62  -3.203  -4.858 -11.674
  458   1HD   LYS  62          HD2       LYS  62  -4.780  -6.485 -10.700
  459   2HD   LYS  62          HD1       LYS  62  -6.119  -5.386 -11.031
  460   1HE   LYS  62          HE2       LYS  62  -4.258  -6.409 -13.188
  461   2HE   LYS  62          HE1       LYS  62  -5.774  -7.207 -12.768
  462   1HZ   LYS  62          HZ1       LYS  62  -6.253  -5.743 -14.534
  463   2HZ   LYS  62          HZ2       LYS  62  -5.394  -4.462 -13.820
  464   3HZ   LYS  62          HZ3       LYS  62  -6.859  -4.991 -13.139
  465    H    THR  63           HN       THR  63  -1.948  -3.440  -7.745
  466    HA   THR  63           HA       THR  63  -3.506  -2.046  -5.831
  467    HB   THR  63           HB       THR  63  -0.591  -2.863  -5.660
  468    HG1  THR  63           HG1      THR  63  -2.825  -4.270  -5.835
  469   1HG2  THR  63          HG21      THR  63  -1.157  -1.279  -3.903
  470   2HG2  THR  63          HG22      THR  63  -1.065  -2.895  -3.205
  471   3HG2  THR  63          HG23      THR  63  -2.636  -2.167  -3.536
  472    H    GLN  64           HN       GLN  64  -0.570  -1.057  -7.584
  473    HA   GLN  64           HA       GLN  64  -0.122   1.370  -6.166
  474   1HB   GLN  64          HB2       GLN  64   0.416   0.622  -9.055
  475   2HB   GLN  64          HB1       GLN  64   0.973   2.127  -8.324
  476   1HG   GLN  64          HG2       GLN  64   2.280   0.906  -6.679
  477   2HG   GLN  64          HG1       GLN  64   1.628  -0.631  -7.249
  478   1HE2  GLN  64          HE21      GLN  64   4.484   0.117  -7.259
  479   2HE2  GLN  64          HE22      GLN  64   4.982   0.105  -8.882
  480    H    ARG  65           HN       ARG  65  -2.192   0.656  -8.978
  481    HA   ARG  65           HA       ARG  65  -3.040   3.351  -9.437
  482   1HB   ARG  65          HB2       ARG  65  -3.385   1.486 -11.046
  483   2HB   ARG  65          HB1       ARG  65  -4.573   0.785  -9.948
  484   1HG   ARG  65          HG2       ARG  65  -5.942   2.828 -10.128
  485   2HG   ARG  65          HG1       ARG  65  -4.762   3.526 -11.235
  486   1HD   ARG  65          HD2       ARG  65  -5.109   1.551 -12.741
  487   2HD   ARG  65          HD1       ARG  65  -6.411   1.015 -11.689
  488    HE   ARG  65           HE       ARG  65  -6.574   3.004 -13.761
  489   1HH1  ARG  65          HH21      ARG  65  -7.616   2.448 -10.511
  490   2HH1  ARG  65          HH22      ARG  65  -8.858   3.652 -10.580
  491   1HH2  ARG  65          HH11      ARG  65  -8.189   4.542 -13.859
  492   2HH2  ARG  65          HH12      ARG  65  -9.189   4.828 -12.473
  493    H    MET  66           HN       MET  66  -4.518   0.725  -7.491
  494    HA   MET  66           HA       MET  66  -6.760   2.265  -6.630
  495   1HB   MET  66          HB2       MET  66  -5.325  -0.061  -5.322
  496   2HB   MET  66          HB1       MET  66  -6.818   0.635  -4.692
  497   1HG   MET  66          HG2       MET  66  -7.854   0.237  -6.972
  498   2HG   MET  66          HG1       MET  66  -6.405  -0.673  -7.393
  499   1HE   MET  66          HE1       MET  66  -6.425  -3.790  -5.329
  500   2HE   MET  66          HE2       MET  66  -5.577  -2.330  -4.841
  501   3HE   MET  66          HE3       MET  66  -5.664  -2.756  -6.546
  502    H    LEU  67           HN       LEU  67  -3.496   1.902  -5.258
  503    HA   LEU  67           HA       LEU  67  -3.979   3.454  -2.896
  504   1HB   LEU  67          HB2       LEU  67  -1.446   3.008  -4.498
  505   2HB   LEU  67          HB1       LEU  67  -1.480   3.830  -2.943
  506    HG   LEU  67           HG       LEU  67  -2.522   1.015  -3.383
  507   1HD1  LEU  67          HD11      LEU  67   0.148   1.945  -2.282
  508   2HD1  LEU  67          HD12      LEU  67  -0.103   1.115  -3.818
  509   3HD1  LEU  67          HD13      LEU  67  -0.422   0.276  -2.300
  510   1HD2  LEU  67          HD21      LEU  67  -2.038   1.056  -0.788
  511   2HD2  LEU  67          HD22      LEU  67  -3.522   1.775  -1.400
  512   3HD2  LEU  67          HD23      LEU  67  -2.153   2.805  -0.981
  513    H    SER  68           HN       SER  68  -3.043   4.303  -6.197
  514    HA   SER  68           HA       SER  68  -2.489   7.056  -5.762
  515   1HB   SER  68          HB2       SER  68  -3.730   5.748  -8.200
  516   2HB   SER  68          HB1       SER  68  -3.005   7.351  -8.160
  517    HG   SER  68           HG       SER  68  -1.036   6.451  -7.817
  518    H    GLY  69           HN       GLY  69  -5.526   5.326  -6.360
  519   1HA   GLY  69          HA2       GLY  69  -7.283   7.484  -6.690
  520   2HA   GLY  69          HA1       GLY  69  -7.731   5.992  -5.860
  521    H    PHE  70           HN       PHE  70  -5.648   6.390  -3.771
  522    HA   PHE  70           HA       PHE  70  -7.163   8.351  -2.111
  523   1HB   PHE  70          HB2       PHE  70  -5.139   6.216  -1.385
  524   2HB   PHE  70          HB1       PHE  70  -5.894   7.305  -0.222
  525    HD1  PHE  70           HD1      PHE  70  -8.282   7.136   0.297
  526    HD2  PHE  70           HD2      PHE  70  -6.408   4.442  -2.469
  527    HE1  PHE  70           HE1      PHE  70 -10.241   5.635   0.444
  528    HE2  PHE  70           HE2      PHE  70  -8.373   2.935  -2.331
  529    HZ   PHE  70           HZ       PHE  70 -10.291   3.529  -0.874
  530    H    CYS  71           HN       CYS  71  -4.500   8.369  -4.069
  531    HA   CYS  71           HA       CYS  71  -3.190  10.562  -2.490
  532   1HB   CYS  71          HB2       CYS  71  -1.902   8.342  -2.572
  533   2HB   CYS  71          HB1       CYS  71  -1.692   8.658  -4.292
  534    HA   PRO  72           HA       PRO  72  -4.797  11.970  -6.669
  535   1HB   PRO  72          HB2       PRO  72  -4.604  14.588  -5.282
  536   2HB   PRO  72          HB1       PRO  72  -5.965  13.877  -6.162
  537   1HG   PRO  72          HG2       PRO  72  -5.884  14.082  -3.429
  538   2HG   PRO  72          HG1       PRO  72  -6.803  12.836  -4.286
  539   1HD   PRO  72          HD2       PRO  72  -4.291  12.562  -2.726
  540   2HD   PRO  72          HD1       PRO  72  -5.497  11.316  -3.143
  541    H    HIS  73           HN       HIS  73  -1.815  11.972  -5.342
  542    HA   HIS  73           HA       HIS  73  -0.705  13.635  -7.568
  543   1HB   HIS  73          HB2       HIS  73   0.835  14.747  -6.192
  544   2HB   HIS  73          HB1       HIS  73  -0.628  14.755  -5.218
  545    HD1  HIS  73           HD1      HIS  73   2.810  13.288  -5.397
  546    HD2  HIS  73           HD2      HIS  73  -0.530  13.050  -2.914
  547    HE1  HIS  73           HE1      HIS  73   3.581  12.169  -3.258
  548    H    LYS  74           HN       LYS  74   0.289  12.236  -8.860
  549    HA   LYS  74           HA       LYS  74   1.213   9.636  -7.965
  550   1HB   LYS  74          HB2       LYS  74   1.564  11.148 -10.569
  551   2HB   LYS  74          HB1       LYS  74   2.131   9.498 -10.316
  552   1HG   LYS  74          HG2       LYS  74  -0.175   8.783  -9.790
  553   2HG   LYS  74          HG1       LYS  74  -0.743  10.433 -10.048
  554   1HD   LYS  74          HD2       LYS  74   0.051  10.349 -12.383
  555   2HD   LYS  74          HD1       LYS  74   0.620   8.699 -12.131
  556   1HE   LYS  74          HE2       LYS  74  -2.258   9.625 -11.875
  557   2HE   LYS  74          HE1       LYS  74  -1.591   8.717 -13.231
  558   1HZ   LYS  74          HZ1       LYS  74  -2.388   7.015 -11.985
  559   2HZ   LYS  74          HZ2       LYS  74  -2.182   7.831 -10.509
  560   3HZ   LYS  74          HZ3       LYS  74  -0.845   7.132 -11.290
  561    H    VAL  75           HN       VAL  75   3.345   8.943  -7.660
  562    HA   VAL  75           HA       VAL  75   5.432  11.097  -7.496
  563    HB   VAL  75           HB       VAL  75   5.189   8.540  -5.885
  564   1HG1  VAL  75          HG11      VAL  75   7.042   9.707  -4.562
  565   2HG1  VAL  75          HG12      VAL  75   7.205  10.796  -5.939
  566   3HG1  VAL  75          HG13      VAL  75   7.511   9.071  -6.139
  567   1HG2  VAL  75          HG21      VAL  75   4.919  11.430  -5.013
  568   2HG2  VAL  75          HG22      VAL  75   4.627   9.993  -4.031
  569   3HG2  VAL  75          HG23      VAL  75   3.540  10.388  -5.364
  570    H    SER  76           HN       SER  76   7.212  10.836  -8.737
  571    HA   SER  76           HA       SER  76   7.453   8.358 -10.352
  572   1HB   SER  76          HB2       SER  76   8.857  11.040 -10.490
  573   2HB   SER  76          HB1       SER  76   9.226   9.685 -11.553
  574    HG   SER  76           HG       SER  76   7.686  10.666 -12.669
  575    H    ALA  77           HN       ALA  77   9.750   7.522 -10.665
  576    HA   ALA  77           HA       ALA  77  10.846   6.740  -8.140
  577   1HB   ALA  77          HB1       ALA  77  11.926   6.550 -10.958
  578   2HB   ALA  77          HB2       ALA  77  11.149   5.278 -10.015
  579   3HB   ALA  77          HB3       ALA  77  12.752   5.858  -9.562
  580    H    GLY  78           HN       GLY  78  11.149   9.671  -9.746
  581   1HA   GLY  78          HA2       GLY  78  13.900  10.190  -8.706
  582   2HA   GLY  78          HA1       GLY  78  13.010  11.226  -9.821
  583    H    GLN  79           HN       GLN  79  10.536  11.216  -8.339
  584    HA   GLN  79           HA       GLN  79  11.282  13.186  -6.259
  585   1HB   GLN  79          HB2       GLN  79   8.613  12.384  -7.455
  586   2HB   GLN  79          HB1       GLN  79   8.825  13.653  -6.246
  587   1HG   GLN  79          HG2       GLN  79  10.266  13.626  -8.913
  588   2HG   GLN  79          HG1       GLN  79   8.759  14.498  -8.628
  589   1HE2  GLN  79          HE21      GLN  79  11.911  15.182  -8.902
  590   2HE2  GLN  79          HE22      GLN  79  12.084  16.399  -7.732
  591    H    PHE  80           HN       PHE  80  11.337  12.648  -4.146
  592    HA   PHE  80           HA       PHE  80   9.697  10.328  -3.169
  593   1HB   PHE  80          HB2       PHE  80  12.544  11.043  -2.400
  594   2HB   PHE  80          HB1       PHE  80  11.559   9.827  -1.597
  595    HD1  PHE  80           HD1      PHE  80  13.558  10.625  -4.542
  596    HD2  PHE  80           HD2      PHE  80  10.854   7.769  -2.814
  597    HE1  PHE  80           HE1      PHE  80  14.255   8.946  -6.226
  598    HE2  PHE  80           HE2      PHE  80  11.548   6.090  -4.502
  599    HZ   PHE  80           HZ       PHE  80  13.250   6.676  -6.205
  600    H    SER  81           HN       SER  81   8.855  10.622  -1.020
  601    HA   SER  81           HA       SER  81   9.188  13.398   0.090
  602   1HB   SER  81          HB2       SER  81   6.674  11.762   0.370
  603   2HB   SER  81          HB1       SER  81   6.893  13.493   0.606
  604    HG   SER  81           HG       SER  81   7.693  12.887  -1.847
  605    H    SER  82           HN       SER  82   8.790   9.949   0.903
  606    HA   SER  82           HA       SER  82   9.329  10.663   3.779
  607   1HB   SER  82          HB2       SER  82   7.109   9.593   3.252
  608   2HB   SER  82          HB1       SER  82   7.991   8.157   2.737
  609    HG   SER  82           HG       SER  82   9.033   8.396   4.920
  610    H    LEU  83           HN       LEU  83  11.026   9.537   1.207
  611    HA   LEU  83           HA       LEU  83  12.344   7.286   2.615
  612   1HB   LEU  83          HB2       LEU  83  12.701   8.507  -0.114
  613   2HB   LEU  83          HB1       LEU  83  13.788   7.278   0.516
  614    HG   LEU  83           HG       LEU  83  11.957   6.340  -0.878
  615   1HD1  LEU  83          HD11      LEU  83  11.727   4.444   0.390
  616   2HD1  LEU  83          HD12      LEU  83  11.365   5.328   1.869
  617   3HD1  LEU  83          HD13      LEU  83  13.027   5.218   1.290
  618   1HD2  LEU  83          HD21      LEU  83   9.685   6.477  -0.276
  619   2HD2  LEU  83          HD22      LEU  83  10.286   8.113  -0.014
  620   3HD2  LEU  83          HD23      LEU  83  10.061   7.024   1.357
  621    H    HIS  84           HN       HIS  84  12.546  10.405   3.236
  622    HA   HIS  84           HA       HIS  84  15.381  10.950   2.876
  623   1HB   HIS  84          HB2       HIS  84  13.728  12.315   4.994
  624   2HB   HIS  84          HB1       HIS  84  14.980  12.988   3.951
  625    HD1  HIS  84           HD1      HIS  84  13.872  12.015   1.209
  626    HD2  HIS  84           HD2      HIS  84  11.567  13.812   4.178
  627    HE1  HIS  84           HE1      HIS  84  11.848  12.998   0.050
  628    H    VAL  85           HN       VAL  85  13.384   9.623   5.456
  629    HA   VAL  85           HA       VAL  85  15.500   9.655   7.434
  630    HB   VAL  85           HB       VAL  85  13.103   9.615   8.050
  631   1HG1  VAL  85          HG11      VAL  85  12.426   8.108   6.152
  632   2HG1  VAL  85          HG12      VAL  85  11.766   7.626   7.715
  633   3HG1  VAL  85          HG13      VAL  85  13.144   6.760   7.035
  634   1HG2  VAL  85          HG21      VAL  85  13.316   8.057   9.859
  635   2HG2  VAL  85          HG22      VAL  85  14.942   8.655   9.526
  636   3HG2  VAL  85          HG23      VAL  85  14.454   7.061   8.951
  637    H    ARG  86           HN       ARG  86  16.842   7.948   8.058
  638    HA   ARG  86           HA       ARG  86  17.318   5.906   5.975
  639   1HB   ARG  86          HB2       ARG  86  18.819   6.724   8.478
  640   2HB   ARG  86          HB1       ARG  86  19.329   5.399   7.431
  641   1HG   ARG  86          HG2       ARG  86  19.443   6.952   5.516
  642   2HG   ARG  86          HG1       ARG  86  18.937   8.278   6.563
  643   1HD   ARG  86          HD2       ARG  86  21.447   6.616   6.936
  644   2HD   ARG  86          HD1       ARG  86  21.395   8.249   6.272
  645    HE   ARG  86           HE       ARG  86  20.143   8.507   8.725
  646   1HH1  ARG  86          HH21      ARG  86  23.119   7.201   7.574
  647   2HH1  ARG  86          HH22      ARG  86  23.997   7.579   9.018
  648   1HH2  ARG  86          HH11      ARG  86  21.278   9.016  10.618
  649   2HH2  ARG  86          HH12      ARG  86  22.957   8.608  10.738
  650    H    ASP  87           HN       ASP  87  15.127   4.952   6.666
  651    HA   ASP  87           HA       ASP  87  15.134   3.433   9.183
  652   1HB   ASP  87          HB2       ASP  87  13.193   3.588   6.861
  653   2HB   ASP  87          HB1       ASP  87  12.942   2.552   8.267
  654    H    THR  88           HN       THR  88  14.333   1.009   8.819
  655    HA   THR  88           HA       THR  88  16.423  -0.263   7.129
  656    HB   THR  88           HB       THR  88  14.523  -1.618   9.056
  657    HG1  THR  88           HG1      THR  88  15.778   0.100  10.022
  658   1HG2  THR  88          HG21      THR  88  16.342  -3.289   9.139
  659   2HG2  THR  88          HG22      THR  88  17.265  -2.331   7.981
  660   3HG2  THR  88          HG23      THR  88  15.740  -3.073   7.495
  661    H    LYS  89           HN       LYS  89  15.878  -1.821   5.538
  662    HA   LYS  89           HA       LYS  89  13.245  -1.434   4.293
  663   1HB   LYS  89          HB2       LYS  89  15.580  -3.223   3.541
  664   2HB   LYS  89          HB1       LYS  89  14.149  -2.960   2.550
  665   1HG   LYS  89          HG2       LYS  89  14.681  -0.555   2.412
  666   2HG   LYS  89          HG1       LYS  89  16.120  -0.821   3.402
  667   1HD   LYS  89          HD2       LYS  89  17.000  -2.387   1.708
  668   2HD   LYS  89          HD1       LYS  89  15.567  -2.120   0.716
  669   1HE   LYS  89          HE2       LYS  89  17.548  -0.761   0.001
  670   2HE   LYS  89          HE1       LYS  89  16.140   0.209   0.414
  671   1HZ   LYS  89          HZ1       LYS  89  18.288   1.000   1.371
  672   2HZ   LYS  89          HZ2       LYS  89  18.318  -0.403   2.329
  673   3HZ   LYS  89          HZ3       LYS  89  17.066   0.730   2.516
  674    H    ILE  90           HN       ILE  90  11.709  -3.156   3.969
  675    HA   ILE  90           HA       ILE  90  12.128  -5.621   5.628
  676    HB   ILE  90           HB       ILE  90   9.772  -5.467   6.361
  677   1HG1  ILE  90          HG12      ILE  90   9.870  -2.803   4.908
  678   2HG1  ILE  90          HG11      ILE  90   8.867  -4.189   4.482
  679   1HG2  ILE  90          HG21      ILE  90  11.273  -2.900   6.946
  680   2HG2  ILE  90          HG22      ILE  90  11.670  -4.454   7.678
  681   3HG2  ILE  90          HG23      ILE  90  10.103  -3.709   7.989
  682   1HD1  ILE  90          HD11      ILE  90   8.675  -2.488   6.979
  683   2HD1  ILE  90          HD12      ILE  90   7.812  -4.012   6.775
  684   3HD1  ILE  90          HD13      ILE  90   7.470  -2.655   5.703
  685    H    GLU  91           HN       GLU  91  10.738  -7.436   4.938
  686    HA   GLU  91           HA       GLU  91  10.720  -7.744   2.086
  687   1HB   GLU  91          HB2       GLU  91   9.435  -9.358   4.303
  688   2HB   GLU  91          HB1       GLU  91   9.388  -9.842   2.607
  689   1HG   GLU  91          HG2       GLU  91  11.829  -9.894   2.516
  690   2HG   GLU  91          HG1       GLU  91  11.928  -9.304   4.175
  691    H    VAL  92           HN       VAL  92   9.002  -7.690   0.610
  692    HA   VAL  92           HA       VAL  92   6.946  -5.794   1.018
  693    HB   VAL  92           HB       VAL  92   7.171  -8.097  -0.936
  694   1HG1  VAL  92          HG11      VAL  92   5.422  -6.739  -2.228
  695   2HG1  VAL  92          HG12      VAL  92   5.095  -5.907  -0.707
  696   3HG1  VAL  92          HG13      VAL  92   4.829  -7.646  -0.836
  697   1HG2  VAL  92          HG21      VAL  92   7.441  -5.110  -1.361
  698   2HG2  VAL  92          HG22      VAL  92   7.893  -6.398  -2.478
  699   3HG2  VAL  92          HG23      VAL  92   8.812  -6.155  -0.993
  700    H    ALA  93           HN       ALA  93   6.879  -9.330   1.432
  701    HA   ALA  93           HA       ALA  93   4.115  -9.674   1.863
  702   1HB   ALA  93          HB1       ALA  93   5.855 -11.498   1.752
  703   2HB   ALA  93          HB2       ALA  93   4.686 -11.693   3.058
  704   3HB   ALA  93          HB3       ALA  93   6.305 -11.086   3.407
  705    H    GLN  94           HN       GLN  94   6.628  -8.650   4.170
  706    HA   GLN  94           HA       GLN  94   4.779  -8.523   6.412
  707   1HB   GLN  94          HB2       GLN  94   7.563  -7.406   5.972
  708   2HB   GLN  94          HB1       GLN  94   6.682  -7.238   7.491
  709   1HG   GLN  94          HG2       GLN  94   6.486  -9.691   7.653
  710   2HG   GLN  94          HG1       GLN  94   7.368  -9.863   6.136
  711   1HE2  GLN  94          HE21      GLN  94   8.301 -10.941   8.676
  712   2HE2  GLN  94          HE22      GLN  94   9.747 -10.141   9.066
  713    H    PHE  95           HN       PHE  95   6.028  -6.247   4.032
  714    HA   PHE  95           HA       PHE  95   5.085  -3.823   5.183
  715   1HB   PHE  95          HB2       PHE  95   6.614  -3.887   3.273
  716   2HB   PHE  95          HB1       PHE  95   5.367  -4.630   2.275
  717    HD1  PHE  95           HD1      PHE  95   6.490  -1.520   3.896
  718    HD2  PHE  95           HD2      PHE  95   3.445  -3.356   1.488
  719    HE1  PHE  95           HE1      PHE  95   5.621   0.721   3.285
  720    HE2  PHE  95           HE2      PHE  95   2.575  -1.117   0.878
  721    HZ   PHE  95           HZ       PHE  95   3.667   0.921   1.775
  722    H    VAL  96           HN       VAL  96   3.502  -5.988   2.812
  723    HA   VAL  96           HA       VAL  96   1.077  -4.507   2.617
  724    HB   VAL  96           HB       VAL  96   1.548  -7.486   2.301
  725   1HG1  VAL  96          HG11      VAL  96  -0.508  -7.311   0.837
  726   2HG1  VAL  96          HG12      VAL  96  -0.757  -5.693   1.492
  727   3HG1  VAL  96          HG13      VAL  96  -0.819  -7.096   2.559
  728   1HG2  VAL  96          HG21      VAL  96   2.936  -6.139   0.800
  729   2HG2  VAL  96          HG22      VAL  96   1.528  -5.197   0.310
  730   3HG2  VAL  96          HG23      VAL  96   1.639  -6.904  -0.119
  731    H    LYS  97           HN       LYS  97   1.898  -7.296   4.713
  732    HA   LYS  97           HA       LYS  97  -0.639  -7.483   5.978
  733   1HB   LYS  97          HB2       LYS  97   2.136  -8.197   6.948
  734   2HB   LYS  97          HB1       LYS  97   0.669  -8.590   7.846
  735   1HG   LYS  97          HG2       LYS  97  -0.200  -9.829   5.898
  736   2HG   LYS  97          HG1       LYS  97   1.265  -9.441   4.996
  737   1HD   LYS  97          HD2       LYS  97   2.622 -10.662   6.639
  738   2HD   LYS  97          HD1       LYS  97   1.176 -11.024   7.583
  739   1HE   LYS  97          HE2       LYS  97   0.237 -12.303   5.730
  740   2HE   LYS  97          HE1       LYS  97   1.598 -11.865   4.699
  741   1HZ   LYS  97          HZ1       LYS  97   1.436 -13.832   6.817
  742   2HZ   LYS  97          HZ2       LYS  97   2.856 -12.898   6.814
  743   3HZ   LYS  97          HZ3       LYS  97   2.424 -13.798   5.439
  744    H    ASP  98           HN       ASP  98   2.250  -5.613   7.004
  745    HA   ASP  98           HA       ASP  98   1.099  -4.600   9.407
  746   1HB   ASP  98          HB2       ASP  98   3.161  -3.411   7.531
  747   2HB   ASP  98          HB1       ASP  98   2.741  -2.696   9.088
  748    H    LEU  99           HN       LEU  99   0.972  -3.420   6.072
  749    HA   LEU  99           HA       LEU  99  -0.421  -0.991   6.632
  750   1HB   LEU  99          HB2       LEU  99   0.689  -1.434   4.472
  751   2HB   LEU  99          HB1       LEU  99  -0.473  -2.714   4.135
  752    HG   LEU  99           HG       LEU  99  -2.311  -1.071   4.182
  753   1HD1  LEU  99          HD11      LEU  99  -1.451   1.421   4.057
  754   2HD1  LEU  99          HD12      LEU  99  -0.067   0.787   4.948
  755   3HD1  LEU  99          HD13      LEU  99  -1.689   0.662   5.629
  756   1HD2  LEU  99          HD21      LEU  99  -0.051  -0.156   2.383
  757   2HD2  LEU  99          HD22      LEU  99  -1.779   0.030   2.084
  758   3HD2  LEU  99          HD23      LEU  99  -1.050  -1.576   2.073
  759    H    LEU 100           HN       LEU 100  -1.529  -4.302   6.031
  760    HA   LEU 100           HA       LEU 100  -4.287  -3.816   5.717
  761   1HB   LEU 100          HB2       LEU 100  -3.390  -6.022   5.323
  762   2HB   LEU 100          HB1       LEU 100  -2.861  -6.161   6.995
  763    HG   LEU 100           HG       LEU 100  -5.186  -6.167   7.773
  764   1HD1  LEU 100          HD11      LEU 100  -5.756  -5.634   4.856
  765   2HD1  LEU 100          HD12      LEU 100  -6.343  -4.755   6.268
  766   3HD1  LEU 100          HD13      LEU 100  -6.973  -6.360   5.907
  767   1HD2  LEU 100          HD21      LEU 100  -5.959  -8.259   6.506
  768   2HD2  LEU 100          HD22      LEU 100  -4.371  -8.343   7.268
  769   3HD2  LEU 100          HD23      LEU 100  -4.501  -8.075   5.530
  770    H    LEU 101           HN       LEU 101  -2.442  -4.185   8.793
  771    HA   LEU 101           HA       LEU 101  -4.766  -4.154  10.457
  772   1HB   LEU 101          HB2       LEU 101  -1.973  -3.120  11.023
  773   2HB   LEU 101          HB1       LEU 101  -3.241  -3.188  12.240
  774    HG   LEU 101           HG       LEU 101  -1.786  -5.147  12.419
  775   1HD1  LEU 101          HD11      LEU 101  -4.279  -6.287  11.190
  776   2HD1  LEU 101          HD12      LEU 101  -4.419  -5.261  12.618
  777   3HD1  LEU 101          HD13      LEU 101  -3.452  -6.733  12.682
  778   1HD2  LEU 101          HD21      LEU 101  -1.354  -6.641  10.652
  779   2HD2  LEU 101          HD22      LEU 101  -1.230  -5.050   9.906
  780   3HD2  LEU 101          HD23      LEU 101  -2.686  -6.021   9.677
  781    H    HIS 102           HN       HIS 102  -2.862  -1.473   9.124
  782    HA   HIS 102           HA       HIS 102  -4.404   0.563  10.475
  783   1HB   HIS 102          HB2       HIS 102  -2.465   0.581   8.164
  784   2HB   HIS 102          HB1       HIS 102  -3.348   2.041   8.612
  785    HD1  HIS 102           HD1      HIS 102  -2.760   3.168  10.844
  786    HD2  HIS 102           HD2      HIS 102  -0.587  -0.316  10.140
  787    HE1  HIS 102           HE1      HIS 102  -0.953   3.089  12.612
  788    H    LEU 103           HN       LEU 103  -4.660  -0.896   7.221
  789    HA   LEU 103           HA       LEU 103  -6.596   0.927   6.216
  790   1HB   LEU 103          HB2       LEU 103  -6.189  -2.016   5.630
  791   2HB   LEU 103          HB1       LEU 103  -7.277  -0.980   4.709
  792    HG   LEU 103           HG       LEU 103  -4.327  -0.415   5.099
  793   1HD1  LEU 103          HD11      LEU 103  -4.557  -2.461   3.816
  794   2HD1  LEU 103          HD12      LEU 103  -4.132  -1.158   2.707
  795   3HD1  LEU 103          HD13      LEU 103  -5.797  -1.730   2.797
  796   1HD2  LEU 103          HD21      LEU 103  -4.945   0.971   2.904
  797   2HD2  LEU 103          HD22      LEU 103  -5.233   1.646   4.502
  798   3HD2  LEU 103          HD23      LEU 103  -6.564   0.927   3.599
  799    H    LYS 104           HN       LYS 104  -7.153  -2.200   7.878
  800    HA   LYS 104           HA       LYS 104 -10.014  -1.923   7.883
  801   1HB   LYS 104          HB2       LYS 104  -9.973  -3.696   9.591
  802   2HB   LYS 104          HB1       LYS 104  -8.890  -4.088   8.254
  803   1HG   LYS 104          HG2       LYS 104  -7.011  -3.069   9.603
  804   2HG   LYS 104          HG1       LYS 104  -8.125  -2.977  10.967
  805   1HD   LYS 104          HD2       LYS 104  -7.309  -5.498   9.488
  806   2HD   LYS 104          HD1       LYS 104  -6.798  -5.034  11.110
  807   1HE   LYS 104          HE2       LYS 104  -9.521  -5.897  10.176
  808   2HE   LYS 104          HE1       LYS 104  -8.565  -6.518  11.518
  809   1HZ   LYS 104          HZ1       LYS 104  -8.900  -4.469  12.702
  810   2HZ   LYS 104          HZ2       LYS 104 -10.408  -5.108  12.251
  811   3HZ   LYS 104          HZ3       LYS 104  -9.745  -3.798  11.394
  812    H    LYS 105           HN       LYS 105  -7.491  -0.742  10.010
  813    HA   LYS 105           HA       LYS 105  -9.111  -0.150  12.282
  814   1HB   LYS 105          HB2       LYS 105  -6.664  -0.208  12.352
  815   2HB   LYS 105          HB1       LYS 105  -6.589   1.199  11.294
  816   1HG   LYS 105          HG2       LYS 105  -7.753   2.557  12.993
  817   2HG   LYS 105          HG1       LYS 105  -7.867   1.146  14.047
  818   1HD   LYS 105          HD2       LYS 105  -5.404   1.001  14.116
  819   2HD   LYS 105          HD1       LYS 105  -5.291   2.413  13.065
  820   1HE   LYS 105          HE2       LYS 105  -6.647   2.397  15.777
  821   2HE   LYS 105          HE1       LYS 105  -5.011   2.984  15.482
  822   1HZ   LYS 105          HZ1       LYS 105  -6.285   4.351  13.639
  823   2HZ   LYS 105          HZ2       LYS 105  -6.141   4.913  15.236
  824   3HZ   LYS 105          HZ3       LYS 105  -7.574   4.158  14.725
  825    H    LEU 106           HN       LEU 106  -8.176   1.970   9.529
  826    HA   LEU 106           HA       LEU 106  -9.594   4.251  10.499
  827   1HB   LEU 106          HB2       LEU 106  -8.677   3.405   7.759
  828   2HB   LEU 106          HB1       LEU 106  -9.687   4.832   7.941
  829    HG   LEU 106           HG       LEU 106  -7.124   5.170   7.931
  830   1HD1  LEU 106          HD11      LEU 106  -8.856   6.853   8.695
  831   2HD1  LEU 106          HD12      LEU 106  -7.265   7.032   9.428
  832   3HD1  LEU 106          HD13      LEU 106  -8.573   6.291  10.342
  833   1HD2  LEU 106          HD21      LEU 106  -7.341   4.403  10.847
  834   2HD2  LEU 106          HD22      LEU 106  -5.893   4.742   9.907
  835   3HD2  LEU 106          HD23      LEU 106  -6.795   3.262   9.624
  836    H    PHE 107           HN       PHE 107 -10.729   1.387   8.800
  837    HA   PHE 107           HA       PHE 107 -13.217   2.439   7.899
  838   1HB   PHE 107          HB2       PHE 107 -12.434   0.199   7.217
  839   2HB   PHE 107          HB1       PHE 107 -12.647  -0.377   8.875
  840    HD1  PHE 107           HD1      PHE 107 -14.440   0.990   5.915
  841    HD2  PHE 107           HD2      PHE 107 -14.806  -0.888   9.760
  842    HE1  PHE 107           HE1      PHE 107 -16.859   0.625   5.508
  843    HE2  PHE 107           HE2      PHE 107 -17.223  -1.260   9.350
  844    HZ   PHE 107           HZ       PHE 107 -18.250  -0.502   7.225
  845    H    ARG 108           HN       ARG 108 -12.287   1.091  11.057
  846    HA   ARG 108           HA       ARG 108 -14.886   1.073  12.211
  847   1HB   ARG 108          HB2       ARG 108 -12.155   1.460  13.461
  848   2HB   ARG 108          HB1       ARG 108 -13.636   1.291  14.406
  849   1HG   ARG 108          HG2       ARG 108 -14.068  -0.896  13.338
  850   2HG   ARG 108          HG1       ARG 108 -12.582  -0.729  12.403
  851   1HD   ARG 108          HD2       ARG 108 -11.289  -0.603  14.525
  852   2HD   ARG 108          HD1       ARG 108 -12.784  -0.861  15.425
  853    HE   ARG 108           HE       ARG 108 -12.694  -3.005  13.675
  854   1HH1  ARG 108          HH21      ARG 108 -10.589  -1.583  16.008
  855   2HH1  ARG 108          HH22      ARG 108  -9.804  -3.075  16.404
  856   1HH2  ARG 108          HH11      ARG 108 -11.674  -4.958  14.175
  857   2HH2  ARG 108          HH12      ARG 108 -10.416  -4.984  15.365
  858    H    GLU 109           HN       GLU 109 -12.554   3.701  11.783
  859    HA   GLU 109           HA       GLU 109 -14.166   5.557  13.400
  860   1HB   GLU 109          HB2       GLU 109 -11.710   5.921  11.664
  861   2HB   GLU 109          HB1       GLU 109 -12.490   7.246  12.529
  862   1HG   GLU 109          HG2       GLU 109 -12.152   6.076  14.662
  863   2HG   GLU 109          HG1       GLU 109 -11.405   4.722  13.812
  864    H    GLY 110           HN       GLY 110 -14.191   4.440  10.158
  865   1HA   GLY 110          HA2       GLY 110 -15.522   5.083   8.338
  866   2HA   GLY 110          HA1       GLY 110 -16.438   6.081   9.469
  867    H    ARG 111           HN       ARG 111 -13.246   6.943   9.775
  868    HA   ARG 111           HA       ARG 111 -13.667   9.355   8.078
  869   1HB   ARG 111          HB2       ARG 111 -11.671   8.683  10.261
  870   2HB   ARG 111          HB1       ARG 111 -11.616  10.173   9.317
  871   1HG   ARG 111          HG2       ARG 111 -13.874  10.753  10.057
  872   2HG   ARG 111          HG1       ARG 111 -13.987   9.250  10.967
  873   1HD   ARG 111          HD2       ARG 111 -11.953   9.981  12.260
  874   2HD   ARG 111          HD1       ARG 111 -12.063  11.546  11.464
  875    HE   ARG 111           HE       ARG 111 -13.591  10.648  13.736
  876   1HH1  ARG 111          HH21      ARG 111 -13.976  12.365  10.761
  877   2HH1  ARG 111          HH22      ARG 111 -15.476  13.087  11.236
  878   1HH2  ARG 111          HH11      ARG 111 -15.524  11.587  14.355
  879   2HH2  ARG 111          HH12      ARG 111 -16.348  12.651  13.265
  880    H    PHE 112           HN       PHE 112 -13.140   8.718   6.014
  881    HA   PHE 112           HA       PHE 112 -10.639   7.203   5.526
  882   1HB   PHE 112          HB2       PHE 112 -12.724   8.168   3.549
  883   2HB   PHE 112          HB1       PHE 112 -11.496   6.923   3.288
  884    HD1  PHE 112           HD1      PHE 112 -11.576   4.792   4.587
  885    HD2  PHE 112           HD2      PHE 112 -14.751   7.678   4.743
  886    HE1  PHE 112           HE1      PHE 112 -13.081   3.092   5.586
  887    HE2  PHE 112           HE2      PHE 112 -16.252   5.971   5.741
  888    HZ   PHE 112           HZ       PHE 112 -15.413   3.676   6.155
  889    H    ASN 113           HN       ASN 113  -8.853   8.092   4.520
  890    HA   ASN 113           HA       ASN 113  -7.368   9.788   3.899
  891   1HB   ASN 113          HB2       ASN 113  -9.920  10.667   2.536
  892   2HB   ASN 113          HB1       ASN 113  -8.396  11.531   2.331
  893   1HD2  ASN 113          HD21      ASN 113  -9.702  10.156   0.148
  894   2HD2  ASN 113          HD22      ASN 113  -8.705   8.865  -0.322
  Start of MODEL   18
    1   1H    MET   1           HT1      MET   1  21.923   4.628   9.977
    2   2H    MET   1           HT2      MET   1  22.071   3.290  11.013
    3   3H    MET   1           HT3      MET   1  23.427   4.253  10.665
    4    HA   MET   1           HA       MET   1  21.567   4.545  12.745
    5   1HB   MET   1          HB2       MET   1  23.966   6.135  11.794
    6   2HB   MET   1          HB1       MET   1  23.137   6.447  13.320
    7   1HG   MET   1          HG2       MET   1  23.557   4.100  14.012
    8   2HG   MET   1          HG1       MET   1  24.424   3.826  12.502
    9   1HE   MET   1          HE1       MET   1  25.518   6.254  16.150
   10   2HE   MET   1          HE2       MET   1  23.929   5.823  15.525
   11   3HE   MET   1          HE3       MET   1  24.754   7.247  14.901
   12    H    GLY   2           HN       GLY   2  22.304   6.634   9.946
   13   1HA   GLY   2          HA2       GLY   2  20.409   8.684  10.760
   14   2HA   GLY   2          HA1       GLY   2  21.191   8.568   9.181
   15    HA   PRO   3           HA       PRO   3  16.488   7.373   9.239
   16   1HB   PRO   3          HB2       PRO   3  16.628   9.082   6.816
   17   2HB   PRO   3          HB1       PRO   3  15.456   9.108   8.140
   18   1HG   PRO   3          HG2       PRO   3  17.542  10.959   7.753
   19   2HG   PRO   3          HG1       PRO   3  16.592  10.764   9.231
   20   1HD   PRO   3          HD2       PRO   3  19.400  10.132   8.830
   21   2HD   PRO   3          HD1       PRO   3  18.445   9.957  10.325
   22    H    VAL   4           HN       VAL   4  15.488   6.079   7.453
   23    HA   VAL   4           HA       VAL   4  17.490   4.431   6.138
   24    HB   VAL   4           HB       VAL   4  14.482   4.347   5.833
   25   1HG1  VAL   4          HG11      VAL   4  14.818   2.089   5.093
   26   2HG1  VAL   4          HG12      VAL   4  16.522   2.129   5.542
   27   3HG1  VAL   4          HG13      VAL   4  15.948   3.083   4.176
   28   1HG2  VAL   4          HG21      VAL   4  16.346   3.118   7.880
   29   2HG2  VAL   4          HG22      VAL   4  14.724   2.495   7.577
   30   3HG2  VAL   4          HG23      VAL   4  14.938   4.139   8.177
   31    HA   PRO   5           HA       PRO   5  17.480   7.047   2.436
   32   1HB   PRO   5          HB2       PRO   5  18.258   4.747   0.797
   33   2HB   PRO   5          HB1       PRO   5  19.209   6.173   1.225
   34   1HG   PRO   5          HG2       PRO   5  19.544   3.538   2.238
   35   2HG   PRO   5          HG1       PRO   5  20.362   5.001   2.794
   36   1HD   PRO   5          HD2       PRO   5  18.313   3.459   4.174
   37   2HD   PRO   5          HD1       PRO   5  19.214   4.882   4.760
   38    HA   PRO   6           HA       PRO   6  13.599   6.143   0.429
   39   1HB   PRO   6          HB2       PRO   6  14.166   6.915  -2.199
   40   2HB   PRO   6          HB1       PRO   6  13.740   8.019  -0.883
   41   1HG   PRO   6          HG2       PRO   6  16.410   7.451  -2.078
   42   2HG   PRO   6          HG1       PRO   6  15.802   8.942  -1.343
   43   1HD   PRO   6          HD2       PRO   6  17.572   7.192  -0.095
   44   2HD   PRO   6          HD1       PRO   6  16.500   8.322   0.774
   45    H    SER   7           HN       SER   7  16.202   5.228  -1.849
   46    HA   SER   7           HA       SER   7  14.760   3.150  -3.146
   47   1HB   SER   7          HB2       SER   7  16.907   2.419  -4.004
   48   2HB   SER   7          HB1       SER   7  16.897   4.179  -3.967
   49    HG   SER   7           HG       SER   7  18.812   3.257  -3.072
   50    H    THR   8           HN       THR   8  16.861   3.077  -0.284
   51    HA   THR   8           HA       THR   8  16.791   0.213   0.015
   52    HB   THR   8           HB       THR   8  17.231   2.366   2.105
   53    HG1  THR   8           HG1      THR   8  19.320   0.869   1.128
   54   1HG2  THR   8          HG21      THR   8  17.737  -0.617   2.095
   55   2HG2  THR   8          HG22      THR   8  16.708   0.294   3.200
   56   3HG2  THR   8          HG23      THR   8  18.460   0.486   3.265
   57    H    ALA   9           HN       ALA   9  14.786   2.834   1.347
   58    HA   ALA   9           HA       ALA   9  13.219   1.200   3.086
   59   1HB   ALA   9          HB1       ALA   9  11.539   3.027   2.932
   60   2HB   ALA   9          HB2       ALA   9  12.446   3.727   1.591
   61   3HB   ALA   9          HB3       ALA   9  13.164   3.657   3.201
   62    H    LEU  10           HN       LEU  10  12.855   2.064  -0.336
   63    HA   LEU  10           HA       LEU  10  10.324   0.842  -0.747
   64   1HB   LEU  10          HB2       LEU  10  11.422   2.348  -2.385
   65   2HB   LEU  10          HB1       LEU  10  12.642   1.115  -2.690
   66    HG   LEU  10           HG       LEU  10  10.749  -0.441  -3.377
   67   1HD1  LEU  10          HD11      LEU  10   9.212   2.141  -3.041
   68   2HD1  LEU  10          HD12      LEU  10   8.795   0.532  -2.450
   69   3HD1  LEU  10          HD13      LEU  10   8.679   0.896  -4.168
   70   1HD2  LEU  10          HD21      LEU  10  11.031   2.115  -4.974
   71   2HD2  LEU  10          HD22      LEU  10  10.590   0.529  -5.601
   72   3HD2  LEU  10          HD23      LEU  10  12.209   0.802  -4.968
   73    H    ARG  11           HN       ARG  11  13.629  -0.512  -1.199
   74    HA   ARG  11           HA       ARG  11  12.778  -3.128  -1.947
   75   1HB   ARG  11          HB2       ARG  11  15.276  -2.152  -0.549
   76   2HB   ARG  11          HB1       ARG  11  15.043  -3.839  -1.006
   77   1HG   ARG  11          HG2       ARG  11  14.805  -3.221  -3.344
   78   2HG   ARG  11          HG1       ARG  11  14.873  -1.511  -2.936
   79   1HD   ARG  11          HD2       ARG  11  17.146  -1.615  -2.342
   80   2HD   ARG  11          HD1       ARG  11  17.132  -3.365  -2.158
   81    HE   ARG  11           HE       ARG  11  17.667  -1.837  -4.574
   82   1HH1  ARG  11          HH21      ARG  11  16.099  -4.702  -3.455
   83   2HH1  ARG  11          HH22      ARG  11  16.058  -5.437  -5.023
   84   1HH2  ARG  11          HH11      ARG  11  17.613  -2.785  -6.611
   85   2HH2  ARG  11          HH12      ARG  11  16.908  -4.356  -6.802
   86    H    GLU  12           HN       GLU  12  13.453  -1.736   1.261
   87    HA   GLU  12           HA       GLU  12  13.024  -4.128   2.756
   88   1HB   GLU  12          HB2       GLU  12  12.619  -1.204   3.453
   89   2HB   GLU  12          HB1       GLU  12  12.425  -2.506   4.631
   90   1HG   GLU  12          HG2       GLU  12  14.942  -2.104   2.992
   91   2HG   GLU  12          HG1       GLU  12  14.722  -1.438   4.611
   92    H    LEU  13           HN       LEU  13  10.824  -1.637   1.553
   93    HA   LEU  13           HA       LEU  13   8.457  -2.733   2.786
   94   1HB   LEU  13          HB2       LEU  13   8.610  -0.384   2.043
   95   2HB   LEU  13          HB1       LEU  13   8.774  -0.917   0.372
   96    HG   LEU  13           HG       LEU  13   6.533  -1.968   0.504
   97   1HD1  LEU  13          HD11      LEU  13   6.735  -0.978   3.342
   98   2HD1  LEU  13          HD12      LEU  13   6.159  -2.536   2.746
   99   3HD1  LEU  13          HD13      LEU  13   5.153  -1.102   2.572
  100   1HD2  LEU  13          HD21      LEU  13   6.648   0.948   1.332
  101   2HD2  LEU  13          HD22      LEU  13   5.253   0.160   0.593
  102   3HD2  LEU  13          HD23      LEU  13   6.753   0.332  -0.318
  103    H    ILE  14           HN       ILE  14   9.825  -2.971  -0.520
  104    HA   ILE  14           HA       ILE  14   7.754  -4.591  -1.607
  105    HB   ILE  14           HB       ILE  14  10.703  -4.468  -2.316
  106   1HG1  ILE  14          HG12      ILE  14   8.292  -3.286  -3.727
  107   2HG1  ILE  14          HG11      ILE  14   9.275  -2.382  -2.576
  108   1HG2  ILE  14          HG21      ILE  14   9.892  -6.556  -3.168
  109   2HG2  ILE  14          HG22      ILE  14   9.847  -5.431  -4.524
  110   3HG2  ILE  14          HG23      ILE  14   8.363  -5.833  -3.663
  111   1HD1  ILE  14          HD11      ILE  14   9.984  -1.990  -4.933
  112   2HD1  ILE  14          HD12      ILE  14  10.333  -3.711  -5.088
  113   3HD1  ILE  14          HD13      ILE  14  11.266  -2.721  -3.965
  114    H    GLU  15           HN       GLU  15  10.863  -5.576  -0.138
  115    HA   GLU  15           HA       GLU  15  10.494  -8.373  -0.403
  116   1HB   GLU  15          HB2       GLU  15  12.010  -6.784   1.682
  117   2HB   GLU  15          HB1       GLU  15  12.128  -8.534   1.499
  118   1HG   GLU  15          HG2       GLU  15  12.676  -6.582  -0.750
  119   2HG   GLU  15          HG1       GLU  15  13.934  -7.241   0.297
  120    H    GLU  16           HN       GLU  16   9.501  -6.214   2.274
  121    HA   GLU  16           HA       GLU  16   8.553  -8.393   3.917
  122   1HB   GLU  16          HB2       GLU  16   9.138  -6.168   4.846
  123   2HB   GLU  16          HB1       GLU  16   7.749  -5.471   4.011
  124   1HG   GLU  16          HG2       GLU  16   6.236  -6.962   5.262
  125   2HG   GLU  16          HG1       GLU  16   7.619  -7.684   6.083
  126    H    LEU  17           HN       LEU  17   6.912  -6.180   1.642
  127    HA   LEU  17           HA       LEU  17   4.270  -7.105   2.162
  128   1HB   LEU  17          HB2       LEU  17   5.522  -5.983  -0.353
  129   2HB   LEU  17          HB1       LEU  17   3.803  -6.332  -0.214
  130    HG   LEU  17           HG       LEU  17   5.308  -4.508   1.687
  131   1HD1  LEU  17          HD11      LEU  17   3.586  -3.796  -0.709
  132   2HD1  LEU  17          HD12      LEU  17   5.338  -3.626  -0.625
  133   3HD1  LEU  17          HD13      LEU  17   4.306  -2.648   0.420
  134   1HD2  LEU  17          HD21      LEU  17   2.783  -3.698   1.913
  135   2HD2  LEU  17          HD22      LEU  17   3.343  -5.100   2.815
  136   3HD2  LEU  17          HD23      LEU  17   2.423  -5.322   1.329
  137    H    VAL  18           HN       VAL  18   6.724  -8.292  -0.122
  138    HA   VAL  18           HA       VAL  18   5.044 -10.304  -1.304
  139    HB   VAL  18           HB       VAL  18   8.055 -10.047  -1.070
  140   1HG1  VAL  18          HG11      VAL  18   8.043 -11.722  -2.988
  141   2HG1  VAL  18          HG12      VAL  18   6.362 -12.057  -2.574
  142   3HG1  VAL  18          HG13      VAL  18   7.641 -12.385  -1.405
  143   1HG2  VAL  18          HG21      VAL  18   6.338  -9.717  -3.533
  144   2HG2  VAL  18          HG22      VAL  18   7.975  -9.126  -3.246
  145   3HG2  VAL  18          HG23      VAL  18   6.610  -8.375  -2.421
  146    H    ASN  19           HN       ASN  19   7.340 -10.380   1.411
  147    HA   ASN  19           HA       ASN  19   7.293 -13.173   1.878
  148   1HB   ASN  19          HB2       ASN  19   8.897 -11.642   2.950
  149   2HB   ASN  19          HB1       ASN  19   7.589 -10.936   3.901
  150   1HD2  ASN  19          HD21      ASN  19   8.916 -11.750   5.822
  151   2HD2  ASN  19          HD22      ASN  19   8.726 -13.368   6.298
  152    H    ILE  20           HN       ILE  20   5.086 -10.644   3.113
  153    HA   ILE  20           HA       ILE  20   3.654 -12.545   4.782
  154    HB   ILE  20           HB       ILE  20   2.041 -10.703   5.132
  155   1HG1  ILE  20          HG12      ILE  20   3.825  -9.106   3.278
  156   2HG1  ILE  20          HG11      ILE  20   2.277  -9.784   2.782
  157   1HG2  ILE  20          HG21      ILE  20   3.603  -9.208   6.258
  158   2HG2  ILE  20          HG22      ILE  20   4.934  -9.805   5.267
  159   3HG2  ILE  20          HG23      ILE  20   4.159 -10.872   6.437
  160   1HD1  ILE  20          HD11      ILE  20   2.085  -7.411   3.528
  161   2HD1  ILE  20          HD12      ILE  20   2.643  -7.904   5.127
  162   3HD1  ILE  20          HD13      ILE  20   1.112  -8.516   4.500
  163    H    THR  21           HN       THR  21   3.381 -11.686   1.414
  164    HA   THR  21           HA       THR  21   0.592 -12.751   1.306
  165    HB   THR  21           HB       THR  21   0.697 -12.067  -1.092
  166    HG1  THR  21           HG1      THR  21   3.207 -12.197  -0.761
  167   1HG2  THR  21          HG21      THR  21   0.375  -9.789  -0.676
  168   2HG2  THR  21          HG22      THR  21   1.640  -9.732   0.549
  169   3HG2  THR  21          HG23      THR  21   0.094 -10.499   0.913
  170    H    GLN  22           HN       GLN  22   3.869 -13.712   0.591
  171    HA   GLN  22           HA       GLN  22   3.124 -15.817  -1.274
  172   1HB   GLN  22          HB2       GLN  22   5.651 -15.195   0.259
  173   2HB   GLN  22          HB1       GLN  22   5.509 -16.599  -0.800
  174   1HG   GLN  22          HG2       GLN  22   4.894 -13.783  -1.715
  175   2HG   GLN  22          HG1       GLN  22   6.487 -14.521  -1.890
  176   1HE2  GLN  22          HE21      GLN  22   4.115 -13.811  -3.861
  177   2HE2  GLN  22          HE22      GLN  22   4.001 -15.212  -4.811
  178    H    ASN  23           HN       ASN  23   3.882 -15.709   2.195
  179    HA   ASN  23           HA       ASN  23   3.381 -18.625   2.421
  180   1HB   ASN  23          HB2       ASN  23   4.326 -16.531   4.393
  181   2HB   ASN  23          HB1       ASN  23   4.010 -18.208   4.840
  182   1HD2  ASN  23          HD21      ASN  23   6.654 -16.765   4.783
  183   2HD2  ASN  23          HD22      ASN  23   7.638 -17.670   3.737
  184    H    GLN  24           HN       GLN  24   1.300 -16.244   2.058
  185    HA   GLN  24           HA       GLN  24  -0.343 -16.617   4.467
  186   1HB   GLN  24          HB2       GLN  24  -1.760 -14.953   3.592
  187   2HB   GLN  24          HB1       GLN  24  -0.172 -14.475   3.014
  188   1HG   GLN  24          HG2       GLN  24  -0.695 -15.740   0.865
  189   2HG   GLN  24          HG1       GLN  24  -2.353 -15.871   1.449
  190   1HE2  GLN  24          HE21      GLN  24  -1.802 -13.096   2.824
  191   2HE2  GLN  24          HE22      GLN  24  -2.077 -11.997   1.560
  192    H    LYS  25           HN       LYS  25  -1.941 -18.110   4.687
  193    HA   LYS  25           HA       LYS  25  -2.465 -19.962   2.433
  194   1HB   LYS  25          HB2       LYS  25  -2.088 -20.853   4.724
  195   2HB   LYS  25          HB1       LYS  25  -3.484 -19.945   5.298
  196   1HG   LYS  25          HG2       LYS  25  -4.940 -21.202   3.748
  197   2HG   LYS  25          HG1       LYS  25  -3.539 -22.120   3.188
  198   1HD   LYS  25          HD2       LYS  25  -3.164 -22.951   5.481
  199   2HD   LYS  25          HD1       LYS  25  -4.566 -22.036   6.039
  200   1HE   LYS  25          HE2       LYS  25  -5.311 -24.293   5.669
  201   2HE   LYS  25          HE1       LYS  25  -5.950 -23.317   4.346
  202   1HZ   LYS  25          HZ1       LYS  25  -3.326 -24.564   4.003
  203   2HZ   LYS  25          HZ2       LYS  25  -4.525 -24.231   2.848
  204   3HZ   LYS  25          HZ3       LYS  25  -4.697 -25.558   3.895
  205    H    ALA  26           HN       ALA  26  -4.767 -18.764   4.856
  206    HA   ALA  26           HA       ALA  26  -6.763 -18.301   2.740
  207   1HB   ALA  26          HB1       ALA  26  -7.871 -17.399   5.151
  208   2HB   ALA  26          HB2       ALA  26  -6.766 -18.671   5.666
  209   3HB   ALA  26          HB3       ALA  26  -8.040 -19.031   4.504
  210    HA   PRO  27           HA       PRO  27  -6.180 -13.950   2.163
  211   1HB   PRO  27          HB2       PRO  27  -8.812 -13.259   3.315
  212   2HB   PRO  27          HB1       PRO  27  -8.232 -13.057   1.658
  213   1HG   PRO  27          HG2       PRO  27 -10.063 -15.021   2.578
  214   2HG   PRO  27          HG1       PRO  27  -9.305 -14.954   0.983
  215   1HD   PRO  27          HD2       PRO  27  -8.821 -16.888   3.082
  216   2HD   PRO  27          HD1       PRO  27  -8.037 -16.799   1.484
  217    H    LEU  28           HN       LEU  28  -5.218 -12.338   3.481
  218    HA   LEU  28           HA       LEU  28  -4.807 -12.896   6.245
  219   1HB   LEU  28          HB2       LEU  28  -4.568 -10.237   4.803
  220   2HB   LEU  28          HB1       LEU  28  -3.870 -10.613   6.377
  221    HG   LEU  28           HG       LEU  28  -3.218 -12.084   3.805
  222   1HD1  LEU  28          HD11      LEU  28  -1.729  -9.930   5.331
  223   2HD1  LEU  28          HD12      LEU  28  -2.351  -9.827   3.683
  224   3HD1  LEU  28          HD13      LEU  28  -1.008 -10.908   4.054
  225   1HD2  LEU  28          HD21      LEU  28  -1.199 -12.746   5.389
  226   2HD2  LEU  28          HD22      LEU  28  -2.724 -13.616   5.508
  227   3HD2  LEU  28          HD23      LEU  28  -2.338 -12.355   6.678
  228    H    CYS  29           HN       CYS  29  -6.921 -10.477   4.688
  229    HA   CYS  29           HA       CYS  29  -8.234  -9.906   7.267
  230   1HB   CYS  29          HB2       CYS  29  -8.679  -8.895   4.449
  231   2HB   CYS  29          HB1       CYS  29  -9.697  -8.428   5.810
  232    H    ASN  30           HN       ASN  30 -10.669 -10.026   7.329
  233    HA   ASN  30           HA       ASN  30 -11.546 -12.697   6.689
  234   1HB   ASN  30          HB2       ASN  30 -13.052 -10.231   7.610
  235   2HB   ASN  30          HB1       ASN  30 -13.782 -11.832   7.467
  236   1HD2  ASN  30          HD21      ASN  30 -13.454 -10.381   9.994
  237   2HD2  ASN  30          HD22      ASN  30 -12.414 -11.305  10.967
  238    H    GLY  31           HN       GLY  31 -10.648 -11.366   4.327
  239   1HA   GLY  31          HA2       GLY  31 -11.365 -11.402   2.073
  240   2HA   GLY  31          HA1       GLY  31 -13.002 -11.748   2.631
  241    H    SER  32           HN       SER  32 -11.237  -9.069   3.990
  242    HA   SER  32           HA       SER  32 -13.295  -7.187   3.343
  243   1HB   SER  32          HB2       SER  32 -10.425  -6.745   4.196
  244   2HB   SER  32          HB1       SER  32 -11.649  -5.479   4.118
  245    HG   SER  32           HG       SER  32 -12.867  -7.191   5.464
  246    H    MET  33           HN       MET  33 -13.400  -5.588   1.774
  247    HA   MET  33           HA       MET  33 -11.475  -5.850  -0.516
  248   1HB   MET  33          HB2       MET  33 -14.365  -4.916  -0.519
  249   2HB   MET  33          HB1       MET  33 -13.319  -5.040  -1.935
  250   1HG   MET  33          HG2       MET  33 -13.069  -7.471  -1.530
  251   2HG   MET  33          HG1       MET  33 -14.131  -7.338  -0.132
  252   1HE   MET  33          HE1       MET  33 -14.805  -5.528  -3.908
  253   2HE   MET  33          HE2       MET  33 -14.947  -7.163  -4.545
  254   3HE   MET  33          HE3       MET  33 -13.499  -6.695  -3.662
  255    H    VAL  34           HN       VAL  34 -10.910  -3.813  -1.592
  256    HA   VAL  34           HA       VAL  34 -11.308  -1.366   0.105
  257    HB   VAL  34           HB       VAL  34  -8.955  -0.739  -0.461
  258   1HG1  VAL  34          HG11      VAL  34  -7.950  -2.170   1.194
  259   2HG1  VAL  34          HG12      VAL  34  -9.134  -3.443   0.890
  260   3HG1  VAL  34          HG13      VAL  34  -9.634  -1.939   1.662
  261   1HG2  VAL  34          HG21      VAL  34  -8.910  -3.573  -1.544
  262   2HG2  VAL  34          HG22      VAL  34  -7.474  -2.590  -1.261
  263   3HG2  VAL  34          HG23      VAL  34  -8.659  -2.093  -2.470
  264    H    TRP  35           HN       TRP  35 -11.031   0.647  -1.087
  265    HA   TRP  35           HA       TRP  35 -12.352   0.569  -3.656
  266   1HB   TRP  35          HB2       TRP  35 -11.003   2.779  -2.088
  267   2HB   TRP  35          HB1       TRP  35 -11.774   3.056  -3.648
  268    HD1  TRP  35           HD1      TRP  35 -12.533   2.346  -0.006
  269    HE1  TRP  35           HE1      TRP  35 -15.057   2.648   0.399
  270    HE3  TRP  35           HE3      TRP  35 -14.138   2.819  -4.823
  271    HZ2  TRP  35           HZ2      TRP  35 -17.449   3.032  -1.123
  272    HZ3  TRP  35           HZ3      TRP  35 -16.543   3.145  -5.320
  273    HH2  TRP  35           HH2      TRP  35 -18.200   3.253  -3.478
  274    H    SER  36           HN       SER  36 -11.449   0.596  -5.680
  275    HA   SER  36           HA       SER  36  -8.613   0.103  -5.969
  276   1HB   SER  36          HB2       SER  36 -10.355  -0.748  -7.571
  277   2HB   SER  36          HB1       SER  36 -10.606   0.907  -8.111
  278    HG   SER  36           HG       SER  36  -8.293  -0.704  -8.321
  279    H    ILE  37           HN       ILE  37  -7.033   1.544  -6.815
  280    HA   ILE  37           HA       ILE  37  -7.817   4.437  -6.964
  281    HB   ILE  37           HB       ILE  37  -5.584   4.922  -5.893
  282   1HG1  ILE  37          HG12      ILE  37  -5.670   2.056  -4.931
  283   2HG1  ILE  37          HG11      ILE  37  -4.796   2.484  -6.397
  284   1HG2  ILE  37          HG21      ILE  37  -7.559   3.311  -4.245
  285   2HG2  ILE  37          HG22      ILE  37  -7.715   5.023  -4.639
  286   3HG2  ILE  37          HG23      ILE  37  -6.393   4.473  -3.609
  287   1HD1  ILE  37          HD11      ILE  37  -3.368   2.496  -4.322
  288   2HD1  ILE  37          HD12      ILE  37  -4.341   3.843  -3.729
  289   3HD1  ILE  37          HD13      ILE  37  -3.380   4.028  -5.196
  290    H    ASN  38           HN       ASN  38  -6.270   5.730  -8.236
  291    HA   ASN  38           HA       ASN  38  -5.323   4.214 -10.577
  292   1HB   ASN  38          HB2       ASN  38  -4.910   6.408 -11.561
  293   2HB   ASN  38          HB1       ASN  38  -6.498   6.423 -10.795
  294   1HD2  ASN  38          HD21      ASN  38  -4.774   8.785 -11.269
  295   2HD2  ASN  38          HD22      ASN  38  -4.445   9.447  -9.742
  296    H    LEU  39           HN       LEU  39  -3.295   3.377 -10.581
  297    HA   LEU  39           HA       LEU  39  -1.351   4.227  -8.572
  298   1HB   LEU  39          HB2       LEU  39  -1.224   2.224 -10.844
  299   2HB   LEU  39          HB1       LEU  39   0.127   2.535  -9.763
  300    HG   LEU  39           HG       LEU  39  -1.308   0.539  -9.138
  301   1HD1  LEU  39          HD11      LEU  39  -1.419   2.614  -6.954
  302   2HD1  LEU  39          HD12      LEU  39   0.120   1.969  -7.522
  303   3HD1  LEU  39          HD13      LEU  39  -1.086   0.891  -6.828
  304   1HD2  LEU  39          HD21      LEU  39  -3.491   0.833  -8.252
  305   2HD2  LEU  39          HD22      LEU  39  -3.476   1.766  -9.745
  306   3HD2  LEU  39          HD23      LEU  39  -3.319   2.585  -8.189
  307    H    THR  40           HN       THR  40  -0.315   6.143  -8.914
  308    HA   THR  40           HA       THR  40   1.034   6.554 -11.535
  309    HB   THR  40           HB       THR  40   0.264   8.901 -11.615
  310    HG1  THR  40           HG1      THR  40  -0.456   9.634  -9.797
  311   1HG2  THR  40          HG21      THR  40  -1.006   7.021 -12.737
  312   2HG2  THR  40          HG22      THR  40  -1.969   8.456 -12.385
  313   3HG2  THR  40          HG23      THR  40  -2.100   7.031 -11.354
  314    H    ALA  41           HN       ALA  41   0.731   9.227  -9.390
  315    HA   ALA  41           HA       ALA  41   3.595   8.921  -8.614
  316   1HB   ALA  41          HB1       ALA  41   3.090  10.986  -9.750
  317   2HB   ALA  41          HB2       ALA  41   3.387  11.364  -8.053
  318   3HB   ALA  41          HB3       ALA  41   1.735  11.309  -8.670
  319    H    GLY  42           HN       GLY  42   0.979  10.678  -6.945
  320   1HA   GLY  42          HA2       GLY  42   2.000  10.009  -4.349
  321   2HA   GLY  42          HA1       GLY  42   0.421  10.725  -4.664
  322    H    MET  43           HN       MET  43   1.815   7.578  -5.601
  323    HA   MET  43           HA       MET  43  -0.626   6.147  -5.163
  324   1HB   MET  43          HB2       MET  43   2.233   5.133  -5.183
  325   2HB   MET  43          HB1       MET  43   0.788   4.131  -5.334
  326   1HG   MET  43          HG2       MET  43   0.148   5.506  -7.342
  327   2HG   MET  43          HG1       MET  43   1.729   6.277  -7.248
  328   1HE   MET  43          HE1       MET  43   3.594   3.536  -6.280
  329   2HE   MET  43          HE2       MET  43   3.784   5.140  -6.985
  330   3HE   MET  43          HE3       MET  43   4.287   3.719  -7.897
  331    H    TYR  44           HN       TYR  44   2.200   6.755  -3.120
  332    HA   TYR  44           HA       TYR  44   1.598   4.971  -1.003
  333   1HB   TYR  44          HB2       TYR  44   2.951   7.681  -0.972
  334   2HB   TYR  44          HB1       TYR  44   2.930   6.582   0.406
  335    HD1  TYR  44           HD1      TYR  44   4.097   4.395   0.293
  336    HD2  TYR  44           HD2      TYR  44   4.324   7.253  -2.910
  337    HE1  TYR  44           HE1      TYR  44   6.058   3.194  -0.646
  338    HE2  TYR  44           HE2      TYR  44   6.279   6.052  -3.845
  339    HH   TYR  44           HH       TYR  44   8.073   3.874  -2.150
  340    H    CYS  45           HN       CYS  45   0.707   8.429  -1.342
  341    HA   CYS  45           HA       CYS  45  -0.848   8.475   1.078
  342   1HB   CYS  45          HB2       CYS  45  -1.121  10.241  -1.375
  343   2HB   CYS  45          HB1       CYS  45  -1.742  10.595   0.238
  344    H    ALA  46           HN       ALA  46  -1.746   8.055  -2.348
  345    HA   ALA  46           HA       ALA  46  -4.550   7.827  -1.939
  346   1HB   ALA  46          HB1       ALA  46  -2.962   6.314  -4.022
  347   2HB   ALA  46          HB2       ALA  46  -3.326   8.034  -4.161
  348   3HB   ALA  46          HB3       ALA  46  -4.637   6.855  -4.130
  349    H    ALA  47           HN       ALA  47  -2.005   5.337  -2.007
  350    HA   ALA  47           HA       ALA  47  -3.733   3.112  -1.584
  351   1HB   ALA  47          HB1       ALA  47  -1.534   2.109  -0.552
  352   2HB   ALA  47          HB2       ALA  47  -0.804   3.618  -1.098
  353   3HB   ALA  47          HB3       ALA  47  -1.559   2.534  -2.264
  354    H    LEU  48           HN       LEU  48  -2.057   5.247   0.713
  355    HA   LEU  48           HA       LEU  48  -2.686   3.822   3.080
  356   1HB   LEU  48          HB2       LEU  48  -1.056   5.621   3.071
  357   2HB   LEU  48          HB1       LEU  48  -2.295   6.793   2.634
  358    HG   LEU  48           HG       LEU  48  -3.440   6.402   4.789
  359   1HD1  LEU  48          HD11      LEU  48  -1.257   4.336   5.092
  360   2HD1  LEU  48          HD12      LEU  48  -2.990   4.157   5.366
  361   3HD1  LEU  48          HD13      LEU  48  -2.008   5.065   6.513
  362   1HD2  LEU  48          HD21      LEU  48  -1.567   8.078   4.532
  363   2HD2  LEU  48          HD22      LEU  48  -0.481   6.875   5.227
  364   3HD2  LEU  48          HD23      LEU  48  -1.819   7.512   6.184
  365    H    GLU  49           HN       GLU  49  -4.533   6.539   1.578
  366    HA   GLU  49           HA       GLU  49  -6.581   6.536   3.550
  367   1HB   GLU  49          HB2       GLU  49  -8.030   7.595   1.765
  368   2HB   GLU  49          HB1       GLU  49  -6.494   8.405   2.064
  369   1HG   GLU  49          HG2       GLU  49  -5.503   7.308   0.124
  370   2HG   GLU  49          HG1       GLU  49  -6.995   6.410  -0.162
  371    H    SER  50           HN       SER  50  -6.288   4.591   0.586
  372    HA   SER  50           HA       SER  50  -8.922   3.476   0.711
  373   1HB   SER  50          HB2       SER  50  -7.294   3.250  -1.223
  374   2HB   SER  50          HB1       SER  50  -6.434   2.047  -0.266
  375    HG   SER  50           HG       SER  50  -9.134   1.632  -0.349
  376    H    LEU  51           HN       LEU  51  -5.854   2.513   2.210
  377    HA   LEU  51           HA       LEU  51  -6.891   0.094   3.392
  378   1HB   LEU  51          HB2       LEU  51  -4.503   1.825   4.087
  379   2HB   LEU  51          HB1       LEU  51  -4.850   0.288   4.874
  380    HG   LEU  51           HG       LEU  51  -4.448   0.649   1.888
  381   1HD1  LEU  51          HD11      LEU  51  -2.584  -0.550   3.960
  382   2HD1  LEU  51          HD12      LEU  51  -2.397   1.054   3.253
  383   3HD1  LEU  51          HD13      LEU  51  -2.263  -0.379   2.234
  384   1HD2  LEU  51          HD21      LEU  51  -5.678  -1.314   1.997
  385   2HD2  LEU  51          HD22      LEU  51  -5.173  -1.677   3.647
  386   3HD2  LEU  51          HD23      LEU  51  -4.079  -1.986   2.299
  387    H    ILE  52           HN       ILE  52  -6.739   3.461   4.456
  388    HA   ILE  52           HA       ILE  52  -7.302   3.096   7.195
  389    HB   ILE  52           HB       ILE  52  -8.055   5.295   5.258
  390   1HG1  ILE  52          HG12      ILE  52  -5.671   5.076   5.832
  391   2HG1  ILE  52          HG11      ILE  52  -6.336   6.559   6.501
  392   1HG2  ILE  52          HG21      ILE  52  -8.520   6.641   7.407
  393   2HG2  ILE  52          HG22      ILE  52  -8.713   5.072   8.190
  394   3HG2  ILE  52          HG23      ILE  52  -9.771   5.528   6.855
  395   1HD1  ILE  52          HD11      ILE  52  -6.740   4.872   8.608
  396   2HD1  ILE  52          HD12      ILE  52  -5.280   5.831   8.398
  397   3HD1  ILE  52          HD13      ILE  52  -5.305   4.145   7.889
  398    H    ASN  53           HN       ASN  53  -9.278   2.351   4.495
  399    HA   ASN  53           HA       ASN  53 -11.808   2.534   6.002
  400   1HB   ASN  53          HB2       ASN  53 -11.123   1.399   3.270
  401   2HB   ASN  53          HB1       ASN  53 -12.746   1.372   3.957
  402   1HD2  ASN  53          HD21      ASN  53 -13.216   3.796   4.995
  403   2HD2  ASN  53          HD22      ASN  53 -12.944   5.047   3.882
  404    H    VAL  54           HN       VAL  54  -9.238   0.314   5.607
  405    HA   VAL  54           HA       VAL  54 -10.877  -2.054   6.318
  406    HB   VAL  54           HB       VAL  54  -7.874  -1.857   5.939
  407   1HG1  VAL  54          HG11      VAL  54  -8.885  -3.866   7.148
  408   2HG1  VAL  54          HG12      VAL  54  -7.953  -4.239   5.699
  409   3HG1  VAL  54          HG13      VAL  54  -9.715  -4.241   5.637
  410   1HG2  VAL  54          HG21      VAL  54  -8.321  -2.689   3.652
  411   2HG2  VAL  54          HG22      VAL  54  -9.066  -1.111   3.914
  412   3HG2  VAL  54          HG23      VAL  54 -10.055  -2.570   3.955
  413    H    SER  55           HN       SER  55 -11.143  -2.649   8.404
  414    HA   SER  55           HA       SER  55  -9.152  -1.729  10.456
  415   1HB   SER  55          HB2       SER  55 -12.171  -1.795  10.712
  416   2HB   SER  55          HB1       SER  55 -11.052  -1.423  12.019
  417    HG   SER  55           HG       SER  55 -10.538   0.030   9.784
  418    H    GLY  56           HN       GLY  56  -8.876  -3.169  12.232
  419   1HA   GLY  56          HA2       GLY  56  -9.199  -5.203  13.448
  420   2HA   GLY  56          HA1       GLY  56 -10.315  -5.754  12.201
  421    H    CYS  57           HN       CYS  57  -7.915  -4.692  10.353
  422    HA   CYS  57           HA       CYS  57  -6.617  -7.377  10.252
  423   1HB   CYS  57          HB2       CYS  57  -6.671  -5.060   8.300
  424   2HB   CYS  57          HB1       CYS  57  -5.724  -6.527   8.061
  425    H    SER  58           HN       SER  58  -5.156  -7.095  12.038
  426    HA   SER  58           HA       SER  58  -3.345  -4.814  12.101
  427   1HB   SER  58          HB2       SER  58  -3.995  -6.011  14.169
  428   2HB   SER  58          HB1       SER  58  -3.200  -7.465  13.571
  429    HG   SER  58           HG       SER  58  -2.070  -5.718  15.000
  430    H    ALA  59           HN       ALA  59  -3.355  -7.984  10.676
  431    HA   ALA  59           HA       ALA  59  -0.635  -8.531  10.323
  432   1HB   ALA  59          HB1       ALA  59  -2.991  -8.963   8.481
  433   2HB   ALA  59          HB2       ALA  59  -2.212 -10.138   9.542
  434   3HB   ALA  59          HB3       ALA  59  -1.377  -9.561   8.100
  435    H    ILE  60           HN       ILE  60  -2.413  -5.860   9.094
  436    HA   ILE  60           HA       ILE  60  -0.163  -5.188   7.212
  437    HB   ILE  60           HB       ILE  60  -1.871  -3.789   6.016
  438   1HG1  ILE  60          HG12      ILE  60  -3.778  -5.289   7.830
  439   2HG1  ILE  60          HG11      ILE  60  -3.442  -3.561   7.913
  440   1HG2  ILE  60          HG21      ILE  60  -1.243  -6.146   5.349
  441   2HG2  ILE  60          HG22      ILE  60  -2.851  -5.644   4.829
  442   3HG2  ILE  60          HG23      ILE  60  -2.667  -6.705   6.226
  443   1HD1  ILE  60          HD11      ILE  60  -4.222  -3.372   5.526
  444   2HD1  ILE  60          HD12      ILE  60  -5.487  -3.858   6.654
  445   3HD1  ILE  60          HD13      ILE  60  -4.724  -5.060   5.612
  446    H    GLU  61           HN       GLU  61  -1.101  -4.538  10.226
  447    HA   GLU  61           HA       GLU  61  -1.451  -1.706  10.323
  448   1HB   GLU  61          HB2       GLU  61  -1.570  -3.487  12.251
  449   2HB   GLU  61          HB1       GLU  61   0.152  -3.195  12.415
  450   1HG   GLU  61          HG2       GLU  61  -0.380  -0.737  12.585
  451   2HG   GLU  61          HG1       GLU  61  -2.085  -1.180  12.657
  452    H    LYS  62           HN       LYS  62   1.423  -3.756  10.340
  453    HA   LYS  62           HA       LYS  62   3.397  -1.710  10.591
  454   1HB   LYS  62          HB2       LYS  62   3.457  -4.417   9.226
  455   2HB   LYS  62          HB1       LYS  62   4.888  -3.405   9.434
  456   1HG   LYS  62          HG2       LYS  62   4.536  -3.409  11.878
  457   2HG   LYS  62          HG1       LYS  62   3.112  -4.430  11.667
  458   1HD   LYS  62          HD2       LYS  62   4.513  -6.183  10.642
  459   2HD   LYS  62          HD1       LYS  62   5.939  -5.166  10.857
  460   1HE   LYS  62          HE2       LYS  62   5.758  -6.816  12.681
  461   2HE   LYS  62          HE1       LYS  62   5.581  -5.173  13.298
  462   1HZ   LYS  62          HZ1       LYS  62   3.186  -5.443  13.247
  463   2HZ   LYS  62          HZ2       LYS  62   3.899  -6.650  14.207
  464   3HZ   LYS  62          HZ3       LYS  62   3.350  -7.020  12.643
  465    H    THR  63           HN       THR  63   1.744  -3.080   7.768
  466    HA   THR  63           HA       THR  63   3.236  -1.765   5.747
  467    HB   THR  63           HB       THR  63   0.295  -2.502   5.758
  468    HG1  THR  63           HG1      THR  63   0.947  -4.458   5.301
  469   1HG2  THR  63          HG21      THR  63   0.827  -0.973   3.929
  470   2HG2  THR  63          HG22      THR  63   0.600  -2.599   3.289
  471   3HG2  THR  63          HG23      THR  63   2.227  -1.951   3.489
  472    H    GLN  64           HN       GLN  64   0.404  -0.672   7.612
  473    HA   GLN  64           HA       GLN  64  -0.034   1.750   6.172
  474   1HB   GLN  64          HB2       GLN  64  -0.539   1.020   9.065
  475   2HB   GLN  64          HB1       GLN  64  -1.077   2.537   8.344
  476   1HG   GLN  64          HG2       GLN  64  -2.414   1.339   6.702
  477   2HG   GLN  64          HG1       GLN  64  -1.794  -0.209   7.276
  478   1HE2  GLN  64          HE21      GLN  64  -4.619   1.129   7.322
  479   2HE2  GLN  64          HE22      GLN  64  -5.121   0.911   8.929
  480    H    ARG  65           HN       ARG  65   2.046   1.064   8.989
  481    HA   ARG  65           HA       ARG  65   2.930   3.752   9.372
  482   1HB   ARG  65          HB2       ARG  65   3.256   1.870  11.002
  483   2HB   ARG  65          HB1       ARG  65   4.498   1.217   9.936
  484   1HG   ARG  65          HG2       ARG  65   5.761   2.469  11.453
  485   2HG   ARG  65          HG1       ARG  65   5.568   3.608  10.126
  486   1HD   ARG  65          HD2       ARG  65   3.314   4.143  11.629
  487   2HD   ARG  65          HD1       ARG  65   4.476   3.730  12.883
  488    HE   ARG  65           HE       ARG  65   4.373   6.215  11.627
  489   1HH1  ARG  65          HH21      ARG  65   6.728   3.705  11.977
  490   2HH1  ARG  65          HH22      ARG  65   8.068   4.759  11.708
  491   1HH2  ARG  65          HH11      ARG  65   6.121   7.588  11.308
  492   2HH2  ARG  65          HH12      ARG  65   7.730   6.949  11.345
  493    H    MET  66           HN       MET  66   4.418   1.079   7.480
  494    HA   MET  66           HA       MET  66   6.637   2.634   6.574
  495   1HB   MET  66          HB2       MET  66   5.261   0.237   5.343
  496   2HB   MET  66          HB1       MET  66   6.728   0.953   4.676
  497   1HG   MET  66          HG2       MET  66   7.862   0.615   6.860
  498   2HG   MET  66          HG1       MET  66   6.407  -0.162   7.480
  499   1HE   MET  66          HE1       MET  66   5.390  -2.069   4.959
  500   2HE   MET  66          HE2       MET  66   5.360  -2.094   6.718
  501   3HE   MET  66          HE3       MET  66   6.073  -3.441   5.838
  502    H    LEU  67           HN       LEU  67   3.389   2.170   5.166
  503    HA   LEU  67           HA       LEU  67   3.896   3.662   2.778
  504   1HB   LEU  67          HB2       LEU  67   1.342   3.240   4.352
  505   2HB   LEU  67          HB1       LEU  67   1.393   4.060   2.793
  506    HG   LEU  67           HG       LEU  67   2.422   1.247   3.273
  507   1HD1  LEU  67          HD11      LEU  67  -0.203   2.199   2.089
  508   2HD1  LEU  67          HD12      LEU  67   0.001   1.308   3.598
  509   3HD1  LEU  67          HD13      LEU  67   0.369   0.531   2.057
  510   1HD2  LEU  67          HD21      LEU  67   2.227   3.053   0.871
  511   2HD2  LEU  67          HD22      LEU  67   2.013   1.320   0.637
  512   3HD2  LEU  67          HD23      LEU  67   3.510   1.932   1.326
  513    H    SER  68           HN       SER  68   2.880   4.627   6.029
  514    HA   SER  68           HA       SER  68   2.411   7.383   5.477
  515   1HB   SER  68          HB2       SER  68   3.384   5.993   7.987
  516   2HB   SER  68          HB1       SER  68   2.988   7.707   7.927
  517    HG   SER  68           HG       SER  68   1.211   5.677   7.067
  518    H    GLY  69           HN       GLY  69   5.381   5.590   6.230
  519   1HA   GLY  69          HA2       GLY  69   7.183   7.695   6.614
  520   2HA   GLY  69          HA1       GLY  69   7.616   6.192   5.796
  521    H    PHE  70           HN       PHE  70   5.662   6.608   3.622
  522    HA   PHE  70           HA       PHE  70   7.269   8.546   2.027
  523   1HB   PHE  70          HB2       PHE  70   5.165   6.493   1.265
  524   2HB   PHE  70          HB1       PHE  70   5.941   7.577   0.112
  525    HD1  PHE  70           HD1      PHE  70   8.273   7.283  -0.529
  526    HD2  PHE  70           HD2      PHE  70   6.444   4.719   2.393
  527    HE1  PHE  70           HE1      PHE  70  10.186   5.714  -0.705
  528    HE2  PHE  70           HE2      PHE  70   8.355   3.151   2.213
  529    HZ   PHE  70           HZ       PHE  70  10.225   3.648   0.665
  530    H    CYS  71           HN       CYS  71   4.339   8.296   3.743
  531    HA   CYS  71           HA       CYS  71   3.423  10.911   2.645
  532   1HB   CYS  71          HB2       CYS  71   2.222   8.914   1.561
  533   2HB   CYS  71          HB1       CYS  71   1.506   8.628   3.146
  534    HA   PRO  72           HA       PRO  72   3.314  10.504   7.291
  535   1HB   PRO  72          HB2       PRO  72   4.635  12.950   7.713
  536   2HB   PRO  72          HB1       PRO  72   5.390  11.354   7.696
  537   1HG   PRO  72          HG2       PRO  72   5.577  13.496   5.698
  538   2HG   PRO  72          HG1       PRO  72   6.577  12.049   5.875
  539   1HD   PRO  72          HD2       PRO  72   4.505  12.516   3.924
  540   2HD   PRO  72          HD1       PRO  72   5.457  11.027   4.152
  541    H    HIS  73           HN       HIS  73   1.250  11.712   5.416
  542    HA   HIS  73           HA       HIS  73   0.443  14.158   6.895
  543   1HB   HIS  73          HB2       HIS  73  -1.242  14.432   5.191
  544   2HB   HIS  73          HB1       HIS  73   0.266  14.012   4.384
  545    HD1  HIS  73           HD1      HIS  73  -2.585  13.453   3.162
  546    HD2  HIS  73           HD2      HIS  73  -0.254  10.645   5.176
  547    HE1  HIS  73           HE1      HIS  73  -3.373  11.180   2.381
  548    H    LYS  74           HN       LYS  74  -1.514  14.266   8.124
  549    HA   LYS  74           HA       LYS  74  -2.289  11.725   9.336
  550   1HB   LYS  74          HB2       LYS  74  -3.368  14.537   9.705
  551   2HB   LYS  74          HB1       LYS  74  -3.884  13.141  10.653
  552   1HG   LYS  74          HG2       LYS  74  -1.550  12.791  11.401
  553   2HG   LYS  74          HG1       LYS  74  -1.050  14.206  10.475
  554   1HD   LYS  74          HD2       LYS  74  -2.559  15.625  11.816
  555   2HD   LYS  74          HD1       LYS  74  -3.060  14.213  12.746
  556   1HE   LYS  74          HE2       LYS  74  -1.390  15.179  14.096
  557   2HE   LYS  74          HE1       LYS  74  -0.523  13.907  13.238
  558   1HZ   LYS  74          HZ1       LYS  74   0.710  15.967  13.173
  559   2HZ   LYS  74          HZ2       LYS  74  -0.614  16.780  12.485
  560   3HZ   LYS  74          HZ3       LYS  74   0.187  15.563  11.610
  561    H    VAL  75           HN       VAL  75  -3.896  10.424   8.622
  562    HA   VAL  75           HA       VAL  75  -5.916  11.550   6.699
  563    HB   VAL  75           HB       VAL  75  -4.858   8.719   6.929
  564   1HG1  VAL  75          HG11      VAL  75  -6.094   8.459   4.758
  565   2HG1  VAL  75          HG12      VAL  75  -6.786  10.059   5.010
  566   3HG1  VAL  75          HG13      VAL  75  -7.156   8.752   6.135
  567   1HG2  VAL  75          HG21      VAL  75  -3.125  10.082   5.994
  568   2HG2  VAL  75          HG22      VAL  75  -4.280  11.003   5.030
  569   3HG2  VAL  75          HG23      VAL  75  -3.928   9.324   4.619
  570    H    SER  76           HN       SER  76  -7.986  11.486   7.386
  571    HA   SER  76           HA       SER  76  -8.649   9.795   9.774
  572   1HB   SER  76          HB2       SER  76  -9.896  12.328   8.682
  573   2HB   SER  76          HB1       SER  76 -10.615  11.368   9.972
  574    HG   SER  76           HG       SER  76  -7.929  12.012  10.243
  575    H    ALA  77           HN       ALA  77 -10.607   8.586   9.720
  576    HA   ALA  77           HA       ALA  77 -11.230   7.318   7.255
  577   1HB   ALA  77          HB1       ALA  77 -11.705   6.419   9.568
  578   2HB   ALA  77          HB2       ALA  77 -13.061   6.277   8.449
  579   3HB   ALA  77          HB3       ALA  77 -13.052   7.553   9.666
  580    H    GLY  78           HN       GLY  78 -12.158  10.367   8.491
  581   1HA   GLY  78          HA2       GLY  78 -14.596  10.527   6.794
  582   2HA   GLY  78          HA1       GLY  78 -14.065  11.742   7.958
  583    H    GLN  79           HN       GLN  79 -11.240  11.486   6.832
  584    HA   GLN  79           HA       GLN  79 -11.648  13.422   4.617
  585   1HB   GLN  79          HB2       GLN  79  -9.218  12.621   6.231
  586   2HB   GLN  79          HB1       GLN  79  -9.130  13.699   4.837
  587   1HG   GLN  79          HG2       GLN  79 -10.762  15.217   5.925
  588   2HG   GLN  79          HG1       GLN  79 -10.803  14.149   7.328
  589   1HE2  GLN  79          HE21      GLN  79  -9.768  15.541   8.863
  590   2HE2  GLN  79          HE22      GLN  79  -8.173  16.094   8.680
  591    H    PHE  80           HN       PHE  80 -11.470  12.808   2.543
  592    HA   PHE  80           HA       PHE  80  -9.842  10.382   1.860
  593   1HB   PHE  80          HB2       PHE  80 -12.595  11.152   0.852
  594   2HB   PHE  80          HB1       PHE  80 -11.586   9.915   0.108
  595    HD1  PHE  80           HD1      PHE  80 -13.908  10.650   2.768
  596    HD2  PHE  80           HD2      PHE  80 -10.779   7.964   1.558
  597    HE1  PHE  80           HE1      PHE  80 -14.672   9.000   4.455
  598    HE2  PHE  80           HE2      PHE  80 -11.544   6.315   3.245
  599    HZ   PHE  80           HZ       PHE  80 -13.491   6.833   4.695
  600    H    SER  81           HN       SER  81  -8.800  10.502  -0.214
  601    HA   SER  81           HA       SER  81  -8.833  13.236  -1.470
  602   1HB   SER  81          HB2       SER  81  -6.468  11.364  -1.320
  603   2HB   SER  81          HB1       SER  81  -6.479  13.035  -1.878
  604    HG   SER  81           HG       SER  81  -5.856  12.429   0.439
  605    H    SER  82           HN       SER  82  -8.074   9.786  -2.190
  606    HA   SER  82           HA       SER  82  -8.461  10.390  -5.081
  607   1HB   SER  82          HB2       SER  82  -6.453   9.106  -4.243
  608   2HB   SER  82          HB1       SER  82  -7.551   7.791  -3.835
  609    HG   SER  82           HG       SER  82  -6.695   8.729  -6.303
  610    H    LEU  83           HN       LEU  83 -10.419   9.256  -2.579
  611    HA   LEU  83           HA       LEU  83 -11.817   7.243  -4.213
  612   1HB   LEU  83          HB2       LEU  83 -12.312   8.405  -1.467
  613   2HB   LEU  83          HB1       LEU  83 -13.447   7.305  -2.234
  614    HG   LEU  83           HG       LEU  83 -11.546   5.668  -2.527
  615   1HD1  LEU  83          HD11      LEU  83 -10.142   7.797  -0.902
  616   2HD1  LEU  83          HD12      LEU  83  -9.587   6.995  -2.371
  617   3HD1  LEU  83          HD13      LEU  83  -9.623   6.114  -0.848
  618   1HD2  LEU  83          HD21      LEU  83 -13.051   5.228  -0.738
  619   2HD2  LEU  83          HD22      LEU  83 -12.442   6.583   0.214
  620   3HD2  LEU  83          HD23      LEU  83 -11.449   5.142  -0.006
  621    H    HIS  84           HN       HIS  84 -11.635  10.120  -5.086
  622    HA   HIS  84           HA       HIS  84 -14.322  11.230  -4.844
  623   1HB   HIS  84          HB2       HIS  84 -12.150  11.911  -6.849
  624   2HB   HIS  84          HB1       HIS  84 -13.544  12.908  -6.432
  625    HD1  HIS  84           HD1      HIS  84 -12.892  11.726  -3.295
  626    HD2  HIS  84           HD2      HIS  84 -10.689  14.265  -5.759
  627    HE1  HIS  84           HE1      HIS  84 -11.331  13.018  -1.782
  628    H    VAL  85           HN       VAL  85 -12.523   9.434  -7.309
  629    HA   VAL  85           HA       VAL  85 -14.685   9.542  -9.244
  630    HB   VAL  85           HB       VAL  85 -12.436   7.519  -9.193
  631   1HG1  VAL  85          HG11      VAL  85 -13.822   8.932 -11.488
  632   2HG1  VAL  85          HG12      VAL  85 -14.298   7.345 -10.885
  633   3HG1  VAL  85          HG13      VAL  85 -12.701   7.576 -11.598
  634   1HG2  VAL  85          HG21      VAL  85 -12.395  10.463  -9.898
  635   2HG2  VAL  85          HG22      VAL  85 -11.252   9.332 -10.621
  636   3HG2  VAL  85          HG23      VAL  85 -11.273   9.567  -8.874
  637    H    ARG  86           HN       ARG  86 -16.080   7.762  -9.817
  638    HA   ARG  86           HA       ARG  86 -16.794   6.100  -7.487
  639   1HB   ARG  86          HB2       ARG  86 -18.059   6.500 -10.211
  640   2HB   ARG  86          HB1       ARG  86 -18.699   5.392  -8.998
  641   1HG   ARG  86          HG2       ARG  86 -18.907   7.267  -7.398
  642   2HG   ARG  86          HG1       ARG  86 -18.287   8.374  -8.624
  643   1HD   ARG  86          HD2       ARG  86 -20.775   8.398  -8.502
  644   2HD   ARG  86          HD1       ARG  86 -20.188   7.875 -10.081
  645    HE   ARG  86           HE       ARG  86 -20.488   5.511  -8.663
  646   1HH1  ARG  86          HH21      ARG  86 -22.450   8.249  -9.396
  647   2HH1  ARG  86          HH22      ARG  86 -23.929   7.347  -9.421
  648   1HH2  ARG  86          HH11      ARG  86 -22.413   4.326  -8.664
  649   2HH2  ARG  86          HH12      ARG  86 -23.907   5.130  -9.013
  650    H    ASP  87           HN       ASP  87 -14.635   4.966  -7.769
  651    HA   ASP  87           HA       ASP  87 -14.459   3.045  -9.984
  652   1HB   ASP  87          HB2       ASP  87 -12.753   3.663  -7.568
  653   2HB   ASP  87          HB1       ASP  87 -12.441   2.251  -8.574
  654    H    THR  88           HN       THR  88 -14.011   0.686  -9.336
  655    HA   THR  88           HA       THR  88 -16.198  -0.188  -7.523
  656    HB   THR  88           HB       THR  88 -16.209  -1.232  -9.692
  657    HG1  THR  88           HG1      THR  88 -14.954  -3.080  -7.960
  658   1HG2  THR  88          HG21      THR  88 -14.110  -2.642 -10.305
  659   2HG2  THR  88          HG22      THR  88 -13.265  -1.602  -9.159
  660   3HG2  THR  88          HG23      THR  88 -14.057  -0.901 -10.571
  661    H    LYS  89           HN       LYS  89 -15.760  -1.858  -5.909
  662    HA   LYS  89           HA       LYS  89 -13.191  -1.424  -4.551
  663   1HB   LYS  89          HB2       LYS  89 -15.517  -3.239  -3.837
  664   2HB   LYS  89          HB1       LYS  89 -14.142  -2.882  -2.796
  665   1HG   LYS  89          HG2       LYS  89 -14.760  -0.493  -2.788
  666   2HG   LYS  89          HG1       LYS  89 -16.142  -0.848  -3.830
  667   1HD   LYS  89          HD2       LYS  89 -17.048  -2.367  -2.106
  668   2HD   LYS  89          HD1       LYS  89 -15.673  -2.004  -1.065
  669   1HE   LYS  89          HE2       LYS  89 -17.611  -0.653  -0.409
  670   2HE   LYS  89          HE1       LYS  89 -16.334   0.383  -1.046
  671   1HZ   LYS  89          HZ1       LYS  89 -18.800   0.597  -1.863
  672   2HZ   LYS  89          HZ2       LYS  89 -18.336  -0.656  -2.913
  673   3HZ   LYS  89          HZ3       LYS  89 -17.502   0.825  -2.930
  674    H    ILE  90           HN       ILE  90 -11.687  -3.128  -4.059
  675    HA   ILE  90           HA       ILE  90 -11.966  -5.636  -5.672
  676    HB   ILE  90           HB       ILE  90  -9.578  -5.466  -6.287
  677   1HG1  ILE  90          HG12      ILE  90  -9.735  -2.706  -5.023
  678   2HG1  ILE  90          HG11      ILE  90  -8.857  -4.076  -4.344
  679   1HG2  ILE  90          HG21      ILE  90 -11.122  -2.957  -7.006
  680   2HG2  ILE  90          HG22      ILE  90 -11.364  -4.532  -7.762
  681   3HG2  ILE  90          HG23      ILE  90  -9.823  -3.695  -7.943
  682   1HD1  ILE  90          HD11      ILE  90  -7.305  -2.650  -5.579
  683   2HD1  ILE  90          HD12      ILE  90  -8.317  -2.753  -7.019
  684   3HD1  ILE  90          HD13      ILE  90  -7.485  -4.189  -6.422
  685    H    GLU  91           HN       GLU  91 -10.670  -7.421  -4.812
  686    HA   GLU  91           HA       GLU  91 -10.776  -7.577  -1.945
  687   1HB   GLU  91          HB2       GLU  91  -9.472  -9.349  -4.025
  688   2HB   GLU  91          HB1       GLU  91  -9.517  -9.746  -2.306
  689   1HG   GLU  91          HG2       GLU  91 -11.982  -9.627  -2.338
  690   2HG   GLU  91          HG1       GLU  91 -11.942  -9.234  -4.057
  691    H    VAL  92           HN       VAL  92  -9.108  -7.506  -0.412
  692    HA   VAL  92           HA       VAL  92  -6.976  -5.709  -0.839
  693    HB   VAL  92           HB       VAL  92  -7.318  -7.919   1.204
  694   1HG1  VAL  92          HG11      VAL  92  -5.535  -6.552   2.465
  695   2HG1  VAL  92          HG12      VAL  92  -5.146  -5.837   0.900
  696   3HG1  VAL  92          HG13      VAL  92  -4.965  -7.573   1.145
  697   1HG2  VAL  92          HG21      VAL  92  -8.073  -6.186   2.647
  698   2HG2  VAL  92          HG22      VAL  92  -8.857  -5.847   1.104
  699   3HG2  VAL  92          HG23      VAL  92  -7.439  -4.921   1.595
  700    H    ALA  93           HN       ALA  93  -7.041  -9.254  -1.119
  701    HA   ALA  93           HA       ALA  93  -4.310  -9.781  -1.457
  702   1HB   ALA  93          HB1       ALA  93  -4.979 -11.746  -2.703
  703   2HB   ALA  93          HB2       ALA  93  -6.532 -11.015  -3.107
  704   3HB   ALA  93          HB3       ALA  93  -6.180 -11.473  -1.441
  705    H    GLN  94           HN       GLN  94  -6.644  -8.596  -3.873
  706    HA   GLN  94           HA       GLN  94  -4.681  -8.554  -6.019
  707   1HB   GLN  94          HB2       GLN  94  -7.415  -7.286  -5.709
  708   2HB   GLN  94          HB1       GLN  94  -6.447  -7.158  -7.179
  709   1HG   GLN  94          HG2       GLN  94  -6.400  -9.605  -7.382
  710   2HG   GLN  94          HG1       GLN  94  -7.336  -9.756  -5.894
  711   1HE2  GLN  94          HE21      GLN  94  -7.986 -10.416  -8.844
  712   2HE2  GLN  94          HE22      GLN  94  -9.479  -9.653  -9.109
  713    H    PHE  95           HN       PHE  95  -5.955  -6.205  -3.706
  714    HA   PHE  95           HA       PHE  95  -4.808  -3.852  -4.819
  715   1HB   PHE  95          HB2       PHE  95  -6.437  -3.805  -2.976
  716   2HB   PHE  95          HB1       PHE  95  -5.269  -4.590  -1.916
  717    HD1  PHE  95           HD1      PHE  95  -6.237  -1.450  -3.539
  718    HD2  PHE  95           HD2      PHE  95  -3.231  -3.423  -1.187
  719    HE1  PHE  95           HE1      PHE  95  -5.252   0.746  -2.952
  720    HE2  PHE  95           HE2      PHE  95  -2.244  -1.226  -0.605
  721    HZ   PHE  95           HZ       PHE  95  -3.256   0.854  -1.487
  722    H    VAL  96           HN       VAL  96  -3.491  -6.141  -2.411
  723    HA   VAL  96           HA       VAL  96  -1.009  -4.792  -2.043
  724    HB   VAL  96           HB       VAL  96  -1.631  -7.751  -1.826
  725   1HG1  VAL  96          HG11      VAL  96   0.329  -7.530  -0.117
  726   2HG1  VAL  96          HG12      VAL  96   0.733  -6.065  -1.010
  727   3HG1  VAL  96          HG13      VAL  96   0.715  -7.625  -1.834
  728   1HG2  VAL  96          HG21      VAL  96  -1.863  -7.206   0.604
  729   2HG2  VAL  96          HG22      VAL  96  -3.078  -6.407  -0.393
  730   3HG2  VAL  96          HG23      VAL  96  -1.692  -5.496   0.205
  731    H    LYS  97           HN       LYS  97  -1.820  -7.544  -4.205
  732    HA   LYS  97           HA       LYS  97   0.789  -7.691  -5.373
  733   1HB   LYS  97          HB2       LYS  97  -1.925  -8.538  -6.412
  734   2HB   LYS  97          HB1       LYS  97  -0.415  -8.886  -7.254
  735   1HG   LYS  97          HG2       LYS  97   0.423 -10.081  -5.258
  736   2HG   LYS  97          HG1       LYS  97  -1.094  -9.737  -4.425
  737   1HD   LYS  97          HD2       LYS  97  -2.338 -10.981  -6.149
  738   2HD   LYS  97          HD1       LYS  97  -0.827 -11.328  -6.991
  739   1HE   LYS  97          HE2       LYS  97   0.004 -12.503  -4.964
  740   2HE   LYS  97          HE1       LYS  97  -1.550 -12.217  -4.182
  741   1HZ   LYS  97          HZ1       LYS  97  -1.256 -13.636  -6.770
  742   2HZ   LYS  97          HZ2       LYS  97  -2.648 -13.530  -5.802
  743   3HZ   LYS  97          HZ3       LYS  97  -1.310 -14.431  -5.273
  744    H    ASP  98           HN       ASP  98  -2.131  -5.885  -6.352
  745    HA   ASP  98           HA       ASP  98  -1.103  -4.916  -8.830
  746   1HB   ASP  98          HB2       ASP  98  -3.037  -3.664  -6.848
  747   2HB   ASP  98          HB1       ASP  98  -2.734  -3.020  -8.461
  748    H    LEU  99           HN       LEU  99  -0.886  -3.662  -5.526
  749    HA   LEU  99           HA       LEU  99   0.567  -1.280  -6.156
  750   1HB   LEU  99          HB2       LEU  99  -0.578  -1.633  -3.995
  751   2HB   LEU  99          HB1       LEU  99   0.547  -2.931  -3.607
  752    HG   LEU  99           HG       LEU  99   2.425  -1.309  -3.710
  753   1HD1  LEU  99          HD11      LEU  99   1.583   1.185  -3.584
  754   2HD1  LEU  99          HD12      LEU  99   0.175   0.560  -4.441
  755   3HD1  LEU  99          HD13      LEU  99   1.780   0.421  -5.159
  756   1HD2  LEU  99          HD21      LEU  99   1.959  -0.271  -1.588
  757   2HD2  LEU  99          HD22      LEU  99   1.115  -1.820  -1.598
  758   3HD2  LEU  99          HD23      LEU  99   0.220  -0.327  -1.879
  759    H    LEU 100           HN       LEU 100   1.571  -4.596  -5.457
  760    HA   LEU 100           HA       LEU 100   4.334  -4.200  -5.095
  761   1HB   LEU 100          HB2       LEU 100   3.331  -6.361  -4.683
  762   2HB   LEU 100          HB1       LEU 100   2.843  -6.506  -6.366
  763    HG   LEU 100           HG       LEU 100   5.161  -6.656  -7.091
  764   1HD1  LEU 100          HD11      LEU 100   5.721  -6.004  -4.194
  765   2HD1  LEU 100          HD12      LEU 100   6.347  -5.207  -5.638
  766   3HD1  LEU 100          HD13      LEU 100   6.921  -6.814  -5.201
  767   1HD2  LEU 100          HD21      LEU 100   5.782  -8.763  -6.007
  768   2HD2  LEU 100          HD22      LEU 100   4.039  -8.719  -6.275
  769   3HD2  LEU 100          HD23      LEU 100   4.691  -8.414  -4.665
  770    H    LEU 101           HN       LEU 101   2.582  -4.713  -8.195
  771    HA   LEU 101           HA       LEU 101   4.921  -4.730  -9.820
  772   1HB   LEU 101          HB2       LEU 101   2.043  -4.029 -10.358
  773   2HB   LEU 101          HB1       LEU 101   3.249  -3.783 -11.616
  774    HG   LEU 101           HG       LEU 101   2.091  -5.999 -11.755
  775   1HD1  LEU 101          HD11      LEU 101   4.945  -6.637 -11.090
  776   2HD1  LEU 101          HD12      LEU 101   4.623  -5.481 -12.382
  777   3HD1  LEU 101          HD13      LEU 101   3.975  -7.115 -12.478
  778   1HD2  LEU 101          HD21      LEU 101   2.578  -7.723 -10.106
  779   2HD2  LEU 101          HD22      LEU 101   1.847  -6.337  -9.308
  780   3HD2  LEU 101          HD23      LEU 101   3.584  -6.607  -9.186
  781    H    HIS 102           HN       HIS 102   2.911  -1.984  -8.757
  782    HA   HIS 102           HA       HIS 102   4.445  -0.051 -10.248
  783   1HB   HIS 102          HB2       HIS 102   2.471   0.158  -7.978
  784   2HB   HIS 102          HB1       HIS 102   3.332   1.583  -8.564
  785    HD1  HIS 102           HD1      HIS 102   2.868   2.346 -11.008
  786    HD2  HIS 102           HD2      HIS 102   0.532  -0.868  -9.769
  787    HE1  HIS 102           HE1      HIS 102   1.077   2.060 -12.762
  788    H    LEU 103           HN       LEU 103   4.684  -1.204  -6.874
  789    HA   LEU 103           HA       LEU 103   6.560   0.742  -6.008
  790   1HB   LEU 103          HB2       LEU 103   6.257  -2.169  -5.231
  791   2HB   LEU 103          HB1       LEU 103   7.312  -1.043  -4.384
  792    HG   LEU 103           HG       LEU 103   4.347  -0.565  -4.789
  793   1HD1  LEU 103          HD11      LEU 103   5.857  -1.921  -2.549
  794   2HD1  LEU 103          HD12      LEU 103   4.448  -2.511  -3.430
  795   3HD1  LEU 103          HD13      LEU 103   4.278  -1.179  -2.287
  796   1HD2  LEU 103          HD21      LEU 103   5.290   1.519  -4.264
  797   2HD2  LEU 103          HD22      LEU 103   6.544   0.813  -3.248
  798   3HD2  LEU 103          HD23      LEU 103   4.886   0.905  -2.666
  799    H    LYS 104           HN       LYS 104   7.252  -2.505  -7.387
  800    HA   LYS 104           HA       LYS 104  10.096  -2.072  -7.452
  801   1HB   LYS 104          HB2       LYS 104  10.185  -4.043  -8.893
  802   2HB   LYS 104          HB1       LYS 104   9.067  -4.327  -7.558
  803   1HG   LYS 104          HG2       LYS 104   7.220  -3.525  -9.136
  804   2HG   LYS 104          HG1       LYS 104   8.402  -3.675 -10.434
  805   1HD   LYS 104          HD2       LYS 104   7.402  -5.875  -8.603
  806   2HD   LYS 104          HD1       LYS 104   7.149  -5.740 -10.342
  807   1HE   LYS 104          HE2       LYS 104   9.702  -5.809 -10.567
  808   2HE   LYS 104          HE1       LYS 104   9.729  -6.319  -8.879
  809   1HZ   LYS 104          HZ1       LYS 104   9.359  -8.364  -9.597
  810   2HZ   LYS 104          HZ2       LYS 104   9.111  -7.837 -11.193
  811   3HZ   LYS 104          HZ3       LYS 104   7.814  -7.876 -10.096
  812    H    LYS 105           HN       LYS 105   7.521  -1.141  -9.613
  813    HA   LYS 105           HA       LYS 105   9.100  -0.785 -11.979
  814   1HB   LYS 105          HB2       LYS 105   6.609  -0.815 -11.926
  815   2HB   LYS 105          HB1       LYS 105   6.636   0.763 -11.138
  816   1HG   LYS 105          HG2       LYS 105   7.853   1.708 -13.076
  817   2HG   LYS 105          HG1       LYS 105   7.810   0.129 -13.863
  818   1HD   LYS 105          HD2       LYS 105   5.401   0.172 -13.981
  819   2HD   LYS 105          HD1       LYS 105   5.328   1.624 -12.983
  820   1HE   LYS 105          HE2       LYS 105   6.450   2.924 -14.714
  821   2HE   LYS 105          HE1       LYS 105   6.665   1.479 -15.702
  822   1HZ   LYS 105          HZ1       LYS 105   4.316   1.278 -15.957
  823   2HZ   LYS 105          HZ2       LYS 105   4.742   2.874 -16.354
  824   3HZ   LYS 105          HZ3       LYS 105   4.022   2.532 -14.854
  825    H    LEU 106           HN       LEU 106   8.189   1.561  -9.416
  826    HA   LEU 106           HA       LEU 106   9.538   3.791 -10.574
  827   1HB   LEU 106          HB2       LEU 106   8.760   3.097  -7.745
  828   2HB   LEU 106          HB1       LEU 106   9.722   4.532  -8.065
  829    HG   LEU 106           HG       LEU 106   7.151   4.803  -7.953
  830   1HD1  LEU 106          HD11      LEU 106   7.184   6.591  -9.534
  831   2HD1  LEU 106          HD12      LEU 106   8.445   5.821 -10.491
  832   3HD1  LEU 106          HD13      LEU 106   8.822   6.472  -8.897
  833   1HD2  LEU 106          HD21      LEU 106   7.259   3.889 -10.832
  834   2HD2  LEU 106          HD22      LEU 106   5.846   4.236  -9.841
  835   3HD2  LEU 106          HD23      LEU 106   6.803   2.797  -9.529
  836    H    PHE 107           HN       PHE 107  10.721   1.077  -8.723
  837    HA   PHE 107           HA       PHE 107  13.248   2.122  -7.952
  838   1HB   PHE 107          HB2       PHE 107  12.360  -0.044  -7.138
  839   2HB   PHE 107          HB1       PHE 107  12.564  -0.722  -8.753
  840    HD1  PHE 107           HD1      PHE 107  14.415   0.896  -5.951
  841    HD2  PHE 107           HD2      PHE 107  14.666  -1.555  -9.469
  842    HE1  PHE 107           HE1      PHE 107  16.797   0.425  -5.452
  843    HE2  PHE 107           HE2      PHE 107  17.044  -2.034  -8.966
  844    HZ   PHE 107           HZ       PHE 107  18.112  -1.045  -6.959
  845    H    ARG 108           HN       ARG 108  12.172   0.592 -10.962
  846    HA   ARG 108           HA       ARG 108  14.706   0.394 -12.226
  847   1HB   ARG 108          HB2       ARG 108  11.993   0.900 -13.492
  848   2HB   ARG 108          HB1       ARG 108  13.428   0.346 -14.350
  849   1HG   ARG 108          HG2       ARG 108  12.409  -1.201 -11.969
  850   2HG   ARG 108          HG1       ARG 108  11.660  -1.422 -13.547
  851   1HD   ARG 108          HD2       ARG 108  14.623  -1.759 -12.978
  852   2HD   ARG 108          HD1       ARG 108  13.465  -3.075 -13.129
  853    HE   ARG 108           HE       ARG 108  13.163  -1.663 -15.493
  854   1HH1  ARG 108          HH21      ARG 108  15.770  -3.061 -13.726
  855   2HH1  ARG 108          HH22      ARG 108  16.712  -3.419 -15.135
  856   1HH2  ARG 108          HH11      ARG 108  14.379  -2.127 -17.352
  857   2HH2  ARG 108          HH12      ARG 108  15.924  -2.892 -17.187
  858    H    GLU 109           HN       GLU 109  12.433   3.122 -12.012
  859    HA   GLU 109           HA       GLU 109  14.100   4.778 -13.780
  860   1HB   GLU 109          HB2       GLU 109  11.688   5.408 -12.052
  861   2HB   GLU 109          HB1       GLU 109  12.505   6.600 -13.063
  862   1HG   GLU 109          HG2       GLU 109  12.059   5.219 -15.060
  863   2HG   GLU 109          HG1       GLU 109  11.238   4.026 -14.051
  864    H    GLY 110           HN       GLY 110  14.108   3.909 -10.478
  865   1HA   GLY 110          HA2       GLY 110  15.441   4.645  -8.697
  866   2HA   GLY 110          HA1       GLY 110  16.413   5.500  -9.896
  867    H    ARG 111           HN       ARG 111  13.168   6.389 -10.160
  868    HA   ARG 111           HA       ARG 111  13.733   8.963  -8.758
  869   1HB   ARG 111          HB2       ARG 111  11.626   8.151 -10.780
  870   2HB   ARG 111          HB1       ARG 111  11.640   9.718  -9.969
  871   1HG   ARG 111          HG2       ARG 111  13.905  10.154 -10.847
  872   2HG   ARG 111          HG1       ARG 111  13.889   8.590 -11.663
  873   1HD   ARG 111          HD2       ARG 111  13.268  10.271 -13.286
  874   2HD   ARG 111          HD1       ARG 111  11.822   9.341 -12.894
  875    HE   ARG 111           HE       ARG 111  11.738  11.463 -11.119
  876   1HH1  ARG 111          HH21      ARG 111  12.094  11.081 -14.530
  877   2HH1  ARG 111          HH22      ARG 111  11.290  12.567 -14.912
  878   1HH2  ARG 111          HH11      ARG 111  10.703  13.411 -11.602
  879   2HH2  ARG 111          HH12      ARG 111  10.507  13.887 -13.255
  880    H    PHE 112           HN       PHE 112  13.358   8.354  -6.622
  881    HA   PHE 112           HA       PHE 112  10.851   7.001  -5.882
  882   1HB   PHE 112          HB2       PHE 112  13.031   8.168  -4.131
  883   2HB   PHE 112          HB1       PHE 112  11.786   7.011  -3.645
  884    HD1  PHE 112           HD1      PHE 112  11.791   4.709  -4.536
  885    HD2  PHE 112           HD2      PHE 112  14.935   7.479  -5.449
  886    HE1  PHE 112           HE1      PHE 112  13.205   2.842  -5.352
  887    HE2  PHE 112           HE2      PHE 112  16.348   5.612  -6.269
  888    HZ   PHE 112           HZ       PHE 112  15.481   3.289  -6.216
  889    H    ASN 113           HN       ASN 113   9.115   8.002  -4.867
  890    HA   ASN 113           HA       ASN 113   7.704   9.744  -4.193
  891   1HB   ASN 113          HB2       ASN 113  10.138  11.463  -3.709
  892   2HB   ASN 113          HB1       ASN 113   8.618  11.415  -2.816
  893   1HD2  ASN 113          HD21      ASN 113  11.736  10.674  -2.328
  894   2HD2  ASN 113          HD22      ASN 113  11.592   9.285  -1.364
  Start of MODEL   19
    1   1H    MET   1           HT1      MET   1 -21.985  -7.686  12.707
    2   2H    MET   1           HT2      MET   1 -21.772  -8.208  14.310
    3   3H    MET   1           HT3      MET   1 -20.974  -9.006  13.041
    4    HA   MET   1           HA       MET   1 -20.372  -6.221  13.051
    5   1HB   MET   1          HB2       MET   1 -19.870  -7.855  15.549
    6   2HB   MET   1          HB1       MET   1 -18.931  -6.417  15.142
    7   1HG   MET   1          HG2       MET   1 -20.987  -5.070  15.087
    8   2HG   MET   1          HG1       MET   1 -21.950  -6.502  15.455
    9   1HE   MET   1          HE1       MET   1 -23.019  -5.171  17.223
   10   2HE   MET   1          HE2       MET   1 -21.988  -3.743  17.271
   11   3HE   MET   1          HE3       MET   1 -22.302  -4.644  18.752
   12    H    GLY   2           HN       GLY   2 -20.004  -8.797  11.590
   13   1HA   GLY   2          HA2       GLY   2 -17.273  -9.668  11.966
   14   2HA   GLY   2          HA1       GLY   2 -18.278 -10.016  10.557
   15    HA   PRO   3           HA       PRO   3 -14.661  -6.860   9.812
   16   1HB   PRO   3          HB2       PRO   3 -14.400  -8.633   7.446
   17   2HB   PRO   3          HB1       PRO   3 -13.150  -8.041   8.548
   18   1HG   PRO   3          HG2       PRO   3 -14.226 -10.646   8.526
   19   2HG   PRO   3          HG1       PRO   3 -13.245  -9.942   9.817
   20   1HD   PRO   3          HD2       PRO   3 -16.064 -10.638   9.909
   21   2HD   PRO   3          HD1       PRO   3 -15.067  -9.944  11.213
   22    H    VAL   4           HN       VAL   4 -14.510  -5.540   7.710
   23    HA   VAL   4           HA       VAL   4 -17.200  -4.828   6.881
   24    HB   VAL   4           HB       VAL   4 -15.889  -3.149   5.436
   25   1HG1  VAL   4          HG11      VAL   4 -16.792  -2.319   7.457
   26   2HG1  VAL   4          HG12      VAL   4 -15.076  -1.933   7.581
   27   3HG1  VAL   4          HG13      VAL   4 -15.732  -3.323   8.447
   28   1HG2  VAL   4          HG21      VAL   4 -13.811  -4.688   5.545
   29   2HG2  VAL   4          HG22      VAL   4 -13.576  -4.039   7.167
   30   3HG2  VAL   4          HG23      VAL   4 -13.545  -2.959   5.773
   31    HA   PRO   5           HA       PRO   5 -17.531  -7.296   3.174
   32   1HB   PRO   5          HB2       PRO   5 -18.288  -4.966   1.544
   33   2HB   PRO   5          HB1       PRO   5 -19.273  -6.351   2.029
   34   1HG   PRO   5          HG2       PRO   5 -19.419  -3.706   3.069
   35   2HG   PRO   5          HG1       PRO   5 -20.282  -5.129   3.655
   36   1HD   PRO   5          HD2       PRO   5 -18.140  -3.705   4.975
   37   2HD   PRO   5          HD1       PRO   5 -19.000  -5.159   5.541
   38    HA   PRO   6           HA       PRO   6 -13.821  -6.642   0.794
   39   1HB   PRO   6          HB2       PRO   6 -14.661  -7.364  -1.787
   40   2HB   PRO   6          HB1       PRO   6 -14.141  -8.481  -0.520
   41   1HG   PRO   6          HG2       PRO   6 -16.864  -7.938  -1.525
   42   2HG   PRO   6          HG1       PRO   6 -16.254  -9.347  -0.648
   43   1HD   PRO   6          HD2       PRO   6 -17.877  -7.280   0.429
   44   2HD   PRO   6          HD1       PRO   6 -17.004  -8.525   1.358
   45    H    SER   7           HN       SER   7 -16.394  -5.628  -1.480
   46    HA   SER   7           HA       SER   7 -14.858  -3.568  -2.708
   47   1HB   SER   7          HB2       SER   7 -16.960  -2.801  -3.667
   48   2HB   SER   7          HB1       SER   7 -16.936  -4.563  -3.668
   49    HG   SER   7           HG       SER   7 -18.790  -3.092  -2.680
   50    H    THR   8           HN       THR   8 -17.027  -3.472   0.102
   51    HA   THR   8           HA       THR   8 -17.086  -0.614   0.341
   52    HB   THR   8           HB       THR   8 -17.366  -2.731   2.495
   53    HG1  THR   8           HG1      THR   8 -19.615  -1.499   1.686
   54   1HG2  THR   8          HG21      THR   8 -18.678  -0.910   3.639
   55   2HG2  THR   8          HG22      THR   8 -18.088   0.209   2.410
   56   3HG2  THR   8          HG23      THR   8 -16.951  -0.576   3.506
   57    H    ALA   9           HN       ALA   9 -14.898  -3.073   1.691
   58    HA   ALA   9           HA       ALA   9 -13.410  -1.315   3.374
   59   1HB   ALA   9          HB1       ALA   9 -12.432  -3.777   1.894
   60   2HB   ALA   9          HB2       ALA   9 -13.231  -3.789   3.466
   61   3HB   ALA   9          HB3       ALA   9 -11.651  -3.028   3.287
   62    H    LEU  10           HN       LEU  10 -13.009  -2.198  -0.053
   63    HA   LEU  10           HA       LEU  10 -10.561  -0.810  -0.478
   64   1HB   LEU  10          HB2       LEU  10 -11.596  -2.415  -2.101
   65   2HB   LEU  10          HB1       LEU  10 -12.826  -1.207  -2.457
   66    HG   LEU  10           HG       LEU  10 -10.952   0.384  -3.095
   67   1HD1  LEU  10          HD11      LEU  10  -8.830  -0.995  -3.814
   68   2HD1  LEU  10          HD12      LEU  10  -9.362  -2.121  -2.568
   69   3HD1  LEU  10          HD13      LEU  10  -8.985  -0.451  -2.146
   70   1HD2  LEU  10          HD21      LEU  10 -10.658  -0.613  -5.306
   71   2HD2  LEU  10          HD22      LEU  10 -12.307  -0.877  -4.743
   72   3HD2  LEU  10          HD23      LEU  10 -11.131  -2.192  -4.679
   73    H    ARG  11           HN       ARG  11 -13.950   0.275  -0.858
   74    HA   ARG  11           HA       ARG  11 -13.354   2.913  -1.756
   75   1HB   ARG  11          HB2       ARG  11 -15.676   1.883  -0.094
   76   2HB   ARG  11          HB1       ARG  11 -15.608   3.499  -0.793
   77   1HG   ARG  11          HG2       ARG  11 -15.415   2.514  -3.052
   78   2HG   ARG  11          HG1       ARG  11 -15.499   0.897  -2.348
   79   1HD   ARG  11          HD2       ARG  11 -17.721   1.516  -1.350
   80   2HD   ARG  11          HD1       ARG  11 -17.646   3.035  -2.239
   81    HE   ARG  11           HE       ARG  11 -17.280   1.090  -4.187
   82   1HH1  ARG  11          HH21      ARG  11 -19.575   1.778  -1.707
   83   2HH1  ARG  11          HH22      ARG  11 -20.909   1.079  -2.562
   84   1HH2  ARG  11          HH11      ARG  11 -19.013   0.179  -5.322
   85   2HH2  ARG  11          HH12      ARG  11 -20.592   0.180  -4.612
   86    H    GLU  12           HN       GLU  12 -13.815   1.611   1.520
   87    HA   GLU  12           HA       GLU  12 -13.421   4.068   2.917
   88   1HB   GLU  12          HB2       GLU  12 -12.975   1.180   3.721
   89   2HB   GLU  12          HB1       GLU  12 -12.792   2.531   4.846
   90   1HG   GLU  12          HG2       GLU  12 -15.117   3.216   4.416
   91   2HG   GLU  12          HG1       GLU  12 -15.305   1.886   3.272
   92    H    LEU  13           HN       LEU  13 -11.150   1.572   1.812
   93    HA   LEU  13           HA       LEU  13  -8.835   2.745   3.054
   94   1HB   LEU  13          HB2       LEU  13  -8.903   0.396   2.295
   95   2HB   LEU  13          HB1       LEU  13  -9.053   0.937   0.625
   96    HG   LEU  13           HG       LEU  13  -6.843   2.035   0.780
   97   1HD1  LEU  13          HD11      LEU  13  -5.457   1.264   2.869
   98   2HD1  LEU  13          HD12      LEU  13  -7.036   1.065   3.628
   99   3HD1  LEU  13          HD13      LEU  13  -6.537   2.646   3.030
  100   1HD2  LEU  13          HD21      LEU  13  -6.981  -0.880   1.591
  101   2HD2  LEU  13          HD22      LEU  13  -5.497  -0.093   1.057
  102   3HD2  LEU  13          HD23      LEU  13  -6.868  -0.231  -0.044
  103    H    ILE  14           HN       ILE  14 -10.173   2.976  -0.255
  104    HA   ILE  14           HA       ILE  14  -8.139   4.671  -1.311
  105    HB   ILE  14           HB       ILE  14 -11.069   4.369  -2.026
  106   1HG1  ILE  14          HG12      ILE  14  -8.564   3.458  -3.469
  107   2HG1  ILE  14          HG11      ILE  14  -9.456   2.437  -2.341
  108   1HG2  ILE  14          HG21      ILE  14 -10.499   6.536  -2.836
  109   2HG2  ILE  14          HG22      ILE  14 -10.276   5.466  -4.219
  110   3HG2  ILE  14          HG23      ILE  14  -8.878   6.021  -3.300
  111   1HD1  ILE  14          HD11      ILE  14 -10.163   1.995  -4.662
  112   2HD1  ILE  14          HD12      ILE  14 -10.589   3.696  -4.859
  113   3HD1  ILE  14          HD13      ILE  14 -11.489   2.687  -3.727
  114    H    GLU  15           HN       GLU  15 -11.274   5.521   0.195
  115    HA   GLU  15           HA       GLU  15 -11.008   8.336  -0.057
  116   1HB   GLU  15          HB2       GLU  15 -12.446   6.648   2.000
  117   2HB   GLU  15          HB1       GLU  15 -12.590   8.404   1.922
  118   1HG   GLU  15          HG2       GLU  15 -13.396   8.238  -0.403
  119   2HG   GLU  15          HG1       GLU  15 -13.256   6.481  -0.327
  120    H    GLU  16           HN       GLU  16  -9.866   6.162   2.536
  121    HA   GLU  16           HA       GLU  16  -8.947   8.341   4.201
  122   1HB   GLU  16          HB2       GLU  16  -9.416   6.060   5.078
  123   2HB   GLU  16          HB1       GLU  16  -8.018   5.457   4.185
  124   1HG   GLU  16          HG2       GLU  16  -6.521   6.891   5.447
  125   2HG   GLU  16          HG1       GLU  16  -7.883   7.674   6.248
  126    H    LEU  17           HN       LEU  17  -7.227   6.123   1.966
  127    HA   LEU  17           HA       LEU  17  -4.649   7.270   2.366
  128   1HB   LEU  17          HB2       LEU  17  -5.838   5.892  -0.055
  129   2HB   LEU  17          HB1       LEU  17  -4.135   6.321   0.085
  130    HG   LEU  17           HG       LEU  17  -5.623   4.555   2.051
  131   1HD1  LEU  17          HD11      LEU  17  -3.643   3.754  -0.100
  132   2HD1  LEU  17          HD12      LEU  17  -5.391   3.568  -0.242
  133   3HD1  LEU  17          HD13      LEU  17  -4.507   2.675   0.995
  134   1HD2  LEU  17          HD21      LEU  17  -2.799   5.572   1.841
  135   2HD2  LEU  17          HD22      LEU  17  -3.056   3.950   2.481
  136   3HD2  LEU  17          HD23      LEU  17  -3.798   5.334   3.274
  137    H    VAL  18           HN       VAL  18  -7.208   8.077   0.027
  138    HA   VAL  18           HA       VAL  18  -5.711  10.097  -1.346
  139    HB   VAL  18           HB       VAL  18  -8.689   9.658  -1.003
  140   1HG1  VAL  18          HG11      VAL  18  -8.480  11.994  -1.480
  141   2HG1  VAL  18          HG12      VAL  18  -8.824  11.220  -3.027
  142   3HG1  VAL  18          HG13      VAL  18  -7.177  11.712  -2.634
  143   1HG2  VAL  18          HG21      VAL  18  -6.879   9.284  -3.404
  144   2HG2  VAL  18          HG22      VAL  18  -8.554   8.758  -3.240
  145   3HG2  VAL  18          HG23      VAL  18  -7.289   7.985  -2.284
  146    H    ASN  19           HN       ASN  19  -7.961  10.288   1.413
  147    HA   ASN  19           HA       ASN  19  -7.972  13.112   1.651
  148   1HB   ASN  19          HB2       ASN  19  -9.530  11.634   2.863
  149   2HB   ASN  19          HB1       ASN  19  -8.197  11.052   3.861
  150   1HD2  ASN  19          HD21      ASN  19  -9.170  14.356   2.772
  151   2HD2  ASN  19          HD22      ASN  19  -9.187  15.023   4.333
  152    H    ILE  20           HN       ILE  20  -5.792  10.738   3.228
  153    HA   ILE  20           HA       ILE  20  -4.294  12.879   4.523
  154    HB   ILE  20           HB       ILE  20  -2.915  11.148   5.458
  155   1HG1  ILE  20          HG12      ILE  20  -4.207   9.319   3.404
  156   2HG1  ILE  20          HG11      ILE  20  -2.512   9.800   3.460
  157   1HG2  ILE  20          HG21      ILE  20  -5.707  10.007   5.219
  158   2HG2  ILE  20          HG22      ILE  20  -5.326  11.414   6.211
  159   3HG2  ILE  20          HG23      ILE  20  -4.594   9.852   6.578
  160   1HD1  ILE  20          HD11      ILE  20  -3.987   8.099   5.484
  161   2HD1  ILE  20          HD12      ILE  20  -2.374   8.758   5.757
  162   3HD1  ILE  20          HD13      ILE  20  -2.646   7.609   4.448
  163    H    THR  21           HN       THR  21  -4.194  11.597   1.350
  164    HA   THR  21           HA       THR  21  -1.301  12.311   1.034
  165    HB   THR  21           HB       THR  21  -1.548  11.334  -1.246
  166    HG1  THR  21           HG1      THR  21  -3.539  10.120  -1.534
  167   1HG2  THR  21          HG21      THR  21  -2.246   9.714   1.191
  168   2HG2  THR  21          HG22      THR  21  -0.722   9.786   0.315
  169   3HG2  THR  21          HG23      THR  21  -2.107   8.949  -0.386
  170    H    GLN  22           HN       GLN  22  -4.498  13.496   0.317
  171    HA   GLN  22           HA       GLN  22  -3.638  15.258  -1.837
  172   1HB   GLN  22          HB2       GLN  22  -6.154  15.095  -0.172
  173   2HB   GLN  22          HB1       GLN  22  -5.905  16.360  -1.376
  174   1HG   GLN  22          HG2       GLN  22  -5.680  14.731  -3.144
  175   2HG   GLN  22          HG1       GLN  22  -5.678  13.402  -1.986
  176   1HE2  GLN  22          HE21      GLN  22  -7.621  13.623  -4.122
  177   2HE2  GLN  22          HE22      GLN  22  -9.146  13.846  -3.410
  178    H    ASN  23           HN       ASN  23  -3.996  15.552   1.661
  179    HA   ASN  23           HA       ASN  23  -3.348  18.451   1.524
  180   1HB   ASN  23          HB2       ASN  23  -5.167  17.612   3.027
  181   2HB   ASN  23          HB1       ASN  23  -3.940  16.747   3.954
  182   1HD2  ASN  23          HD21      ASN  23  -4.617  20.077   2.736
  183   2HD2  ASN  23          HD22      ASN  23  -3.957  20.862   4.088
  184    H    GLN  24           HN       GLN  24  -1.531  15.671   1.527
  185    HA   GLN  24           HA       GLN  24   0.408  16.476   3.571
  186   1HB   GLN  24          HB2       GLN  24   1.591  14.511   3.028
  187   2HB   GLN  24          HB1       GLN  24  -0.086  14.066   2.733
  188   1HG   GLN  24          HG2       GLN  24   0.289  14.689   0.299
  189   2HG   GLN  24          HG1       GLN  24   2.005  14.824   0.675
  190   1HE2  GLN  24          HE21      GLN  24   1.295  12.521   2.771
  191   2HE2  GLN  24          HE22      GLN  24   1.437  11.129   1.811
  192    H    LYS  25           HN       LYS  25   2.064  17.899   3.266
  193    HA   LYS  25           HA       LYS  25   2.480  19.016   0.555
  194   1HB   LYS  25          HB2       LYS  25   2.354  20.521   2.550
  195   2HB   LYS  25          HB1       LYS  25   3.811  19.756   3.185
  196   1HG   LYS  25          HG2       LYS  25   5.056  20.442   1.163
  197   2HG   LYS  25          HG1       LYS  25   3.600  21.210   0.531
  198   1HD   LYS  25          HD2       LYS  25   3.552  22.726   2.481
  199   2HD   LYS  25          HD1       LYS  25   5.014  21.961   3.109
  200   1HE   LYS  25          HE2       LYS  25   6.272  22.655   1.133
  201   2HE   LYS  25          HE1       LYS  25   4.815  23.338   0.414
  202   1HZ   LYS  25          HZ1       LYS  25   6.464  24.842   1.725
  203   2HZ   LYS  25          HZ2       LYS  25   5.640  24.237   3.082
  204   3HZ   LYS  25          HZ3       LYS  25   4.791  25.077   1.875
  205    H    ALA  26           HN       ALA  26   4.938  18.373   3.030
  206    HA   ALA  26           HA       ALA  26   6.731  17.285   0.974
  207   1HB   ALA  26          HB1       ALA  26   7.028  18.580   3.510
  208   2HB   ALA  26          HB2       ALA  26   8.310  18.118   2.395
  209   3HB   ALA  26          HB3       ALA  26   7.793  16.999   3.656
  210    HA   PRO  27           HA       PRO  27   6.078  12.946   1.507
  211   1HB   PRO  27          HB2       PRO  27   8.723  12.500   2.752
  212   2HB   PRO  27          HB1       PRO  27   8.098  11.901   1.210
  213   1HG   PRO  27          HG2       PRO  27   9.991  13.979   1.561
  214   2HG   PRO  27          HG1       PRO  27   9.165  13.555   0.057
  215   1HD   PRO  27          HD2       PRO  27   8.805  15.943   1.660
  216   2HD   PRO  27          HD1       PRO  27   7.980  15.512   0.141
  217    H    LEU  28           HN       LEU  28   5.053  11.769   3.146
  218    HA   LEU  28           HA       LEU  28   4.768  12.902   5.756
  219   1HB   LEU  28          HB2       LEU  28   4.266  10.048   4.857
  220   2HB   LEU  28          HB1       LEU  28   3.655  10.775   6.342
  221    HG   LEU  28           HG       LEU  28   3.026  11.750   3.541
  222   1HD1  LEU  28          HD11      LEU  28   0.794  10.812   3.948
  223   2HD1  LEU  28          HD12      LEU  28   1.306  10.249   5.539
  224   3HD1  LEU  28          HD13      LEU  28   2.017   9.549   4.085
  225   1HD2  LEU  28          HD21      LEU  28   1.154  12.926   5.006
  226   2HD2  LEU  28          HD22      LEU  28   2.754  13.650   4.885
  227   3HD2  LEU  28          HD23      LEU  28   2.320  12.708   6.312
  228    H    CYS  29           HN       CYS  29   6.793  10.252   4.545
  229    HA   CYS  29           HA       CYS  29   7.968   9.813   7.204
  230   1HB   CYS  29          HB2       CYS  29   8.497   8.632   4.469
  231   2HB   CYS  29          HB1       CYS  29   9.479   8.236   5.879
  232    H    ASN  30           HN       ASN  30  10.392   9.945   7.438
  233    HA   ASN  30           HA       ASN  30  11.312  12.582   6.766
  234   1HB   ASN  30          HB2       ASN  30  12.742  10.143   7.853
  235   2HB   ASN  30          HB1       ASN  30  13.521  11.715   7.661
  236   1HD2  ASN  30          HD21      ASN  30  12.950  10.319  10.228
  237   2HD2  ASN  30          HD22      ASN  30  11.932  11.353  11.110
  238    H    GLY  31           HN       GLY  31  10.600  11.383   4.335
  239   1HA   GLY  31          HA2       GLY  31  11.532  11.407   2.157
  240   2HA   GLY  31          HA1       GLY  31  13.125  11.645   2.877
  241    H    SER  32           HN       SER  32  11.203   9.060   4.123
  242    HA   SER  32           HA       SER  32  13.177   7.084   3.532
  243   1HB   SER  32          HB2       SER  32  10.243   6.713   4.197
  244   2HB   SER  32          HB1       SER  32  11.473   5.455   4.271
  245    HG   SER  32           HG       SER  32  12.275   6.333   6.038
  246    H    MET  33           HN       MET  33  13.210   5.442   1.970
  247    HA   MET  33           HA       MET  33  11.394   5.830  -0.394
  248   1HB   MET  33          HB2       MET  33  14.269   4.849  -0.329
  249   2HB   MET  33          HB1       MET  33  13.271   5.023  -1.773
  250   1HG   MET  33          HG2       MET  33  13.059   7.444  -1.338
  251   2HG   MET  33          HG1       MET  33  14.059   7.269   0.101
  252   1HE   MET  33          HE1       MET  33  15.204   7.061  -4.291
  253   2HE   MET  33          HE2       MET  33  13.612   6.979  -3.545
  254   3HE   MET  33          HE3       MET  33  14.621   5.536  -3.612
  255    H    VAL  34           HN       VAL  34  10.783   3.853  -1.507
  256    HA   VAL  34           HA       VAL  34  11.182   1.331   0.075
  257    HB   VAL  34           HB       VAL  34   8.801   0.752  -0.560
  258   1HG1  VAL  34          HG11      VAL  34   9.384   3.127   1.227
  259   2HG1  VAL  34          HG12      VAL  34   9.226   1.435   1.698
  260   3HG1  VAL  34          HG13      VAL  34   7.807   2.338   1.166
  261   1HG2  VAL  34          HG21      VAL  34   8.754   3.705  -1.263
  262   2HG2  VAL  34          HG22      VAL  34   7.331   2.671  -1.139
  263   3HG2  VAL  34          HG23      VAL  34   8.536   2.367  -2.391
  264    H    TRP  35           HN       TRP  35  10.882  -0.634  -1.240
  265    HA   TRP  35           HA       TRP  35  12.185  -0.382  -3.813
  266   1HB   TRP  35          HB2       TRP  35  10.838  -2.738  -2.468
  267   2HB   TRP  35          HB1       TRP  35  11.762  -2.847  -3.965
  268    HD1  TRP  35           HD1      TRP  35  12.148  -2.313  -0.223
  269    HE1  TRP  35           HE1      TRP  35  14.635  -2.557   0.402
  270    HE3  TRP  35           HE3      TRP  35  14.210  -2.555  -4.890
  271    HZ2  TRP  35           HZ2      TRP  35  17.168  -2.815  -0.904
  272    HZ3  TRP  35           HZ3      TRP  35  16.661  -2.797  -5.169
  273    HH2  TRP  35           HH2      TRP  35  18.141  -2.927  -3.186
  274    H    SER  36           HN       SER  36  11.273  -0.238  -5.809
  275    HA   SER  36           HA       SER  36   8.413   0.140  -6.082
  276   1HB   SER  36          HB2       SER  36   9.994   1.295  -7.568
  277   2HB   SER  36          HB1       SER  36  10.572  -0.251  -8.181
  278    HG   SER  36           HG       SER  36   8.206   1.120  -8.683
  279    H    ILE  37           HN       ILE  37   6.884  -1.329  -6.874
  280    HA   ILE  37           HA       ILE  37   7.841  -4.092  -7.552
  281    HB   ILE  37           HB       ILE  37   5.822  -4.962  -6.351
  282   1HG1  ILE  37          HG12      ILE  37   5.692  -2.275  -4.967
  283   2HG1  ILE  37          HG11      ILE  37   4.720  -2.586  -6.403
  284   1HG2  ILE  37          HG21      ILE  37   7.919  -3.418  -4.807
  285   2HG2  ILE  37          HG22      ILE  37   7.939  -5.129  -5.237
  286   3HG2  ILE  37          HG23      ILE  37   6.788  -4.534  -4.042
  287   1HD1  ILE  37          HD11      ILE  37   3.554  -4.380  -5.355
  288   2HD1  ILE  37          HD12      ILE  37   3.592  -3.080  -4.165
  289   3HD1  ILE  37          HD13      ILE  37   4.703  -4.443  -4.018
  290    H    ASN  38           HN       ASN  38   6.165  -5.333  -8.763
  291    HA   ASN  38           HA       ASN  38   4.860  -3.577 -10.751
  292   1HB   ASN  38          HB2       ASN  38   5.231  -6.582 -10.555
  293   2HB   ASN  38          HB1       ASN  38   4.310  -5.808 -11.844
  294   1HD2  ASN  38          HD21      ASN  38   6.800  -7.306 -12.255
  295   2HD2  ASN  38          HD22      ASN  38   7.941  -6.209 -12.870
  296    H    LEU  39           HN       LEU  39   2.747  -3.017 -10.529
  297    HA   LEU  39           HA       LEU  39   1.131  -4.242  -8.416
  298   1HB   LEU  39          HB2       LEU  39   0.578  -2.102 -10.479
  299   2HB   LEU  39          HB1       LEU  39  -0.633  -2.640  -9.320
  300    HG   LEU  39           HG       LEU  39   0.532  -0.604  -8.544
  301   1HD1  LEU  39          HD11      LEU  39   1.580  -2.731  -6.715
  302   2HD1  LEU  39          HD12      LEU  39  -0.160  -2.664  -7.005
  303   3HD1  LEU  39          HD13      LEU  39   0.678  -1.263  -6.342
  304   1HD2  LEU  39          HD21      LEU  39   3.059  -2.210  -8.228
  305   2HD2  LEU  39          HD22      LEU  39   2.850  -0.460  -8.241
  306   3HD2  LEU  39          HD23      LEU  39   2.727  -1.371  -9.745
  307    H    THR  40           HN       THR  40   0.119  -6.157  -8.790
  308    HA   THR  40           HA       THR  40  -1.403  -6.492 -11.310
  309    HB   THR  40           HB       THR  40  -0.414  -8.866 -11.489
  310    HG1  THR  40           HG1      THR  40   1.446  -7.578  -9.790
  311   1HG2  THR  40          HG21      THR  40   1.458  -6.538 -12.008
  312   2HG2  THR  40          HG22      THR  40   0.099  -6.972 -13.045
  313   3HG2  THR  40          HG23      THR  40   1.448  -8.089 -12.846
  314    H    ALA  41           HN       ALA  41  -0.685  -9.364  -9.594
  315    HA   ALA  41           HA       ALA  41  -3.445  -9.442  -8.537
  316   1HB   ALA  41          HB1       ALA  41  -2.610 -11.407  -9.729
  317   2HB   ALA  41          HB2       ALA  41  -2.904 -11.816  -8.039
  318   3HB   ALA  41          HB3       ALA  41  -1.257 -11.541  -8.606
  319    H    GLY  42           HN       GLY  42  -0.526 -10.797  -7.023
  320   1HA   GLY  42          HA2       GLY  42  -1.458 -10.253  -4.367
  321   2HA   GLY  42          HA1       GLY  42   0.184 -10.738  -4.789
  322    H    MET  43           HN       MET  43  -1.666  -7.827  -5.691
  323    HA   MET  43           HA       MET  43   0.533  -6.037  -5.440
  324   1HB   MET  43          HB2       MET  43  -2.418  -5.500  -5.072
  325   2HB   MET  43          HB1       MET  43  -1.200  -4.275  -5.397
  326   1HG   MET  43          HG2       MET  43  -0.939  -4.939  -7.613
  327   2HG   MET  43          HG1       MET  43  -1.454  -6.594  -7.292
  328   1HE   MET  43          HE1       MET  43  -3.487  -3.564  -5.761
  329   2HE   MET  43          HE2       MET  43  -4.265  -2.948  -7.216
  330   3HE   MET  43          HE3       MET  43  -2.509  -2.927  -7.090
  331    H    TYR  44           HN       TYR  44  -2.153  -6.703  -3.172
  332    HA   TYR  44           HA       TYR  44  -1.285  -4.976  -1.089
  333   1HB   TYR  44          HB2       TYR  44  -2.837  -7.575  -0.899
  334   2HB   TYR  44          HB1       TYR  44  -2.727  -6.361   0.376
  335    HD1  TYR  44           HD1      TYR  44  -3.825  -4.180   0.145
  336    HD2  TYR  44           HD2      TYR  44  -4.134  -7.168  -2.924
  337    HE1  TYR  44           HE1      TYR  44  -5.699  -2.922  -0.891
  338    HE2  TYR  44           HE2      TYR  44  -6.006  -5.912  -3.961
  339    HH   TYR  44           HH       TYR  44  -6.788  -2.707  -3.059
  340    H    CYS  45           HN       CYS  45  -0.561  -8.408  -1.686
  341    HA   CYS  45           HA       CYS  45   0.981  -8.820   0.697
  342   1HB   CYS  45          HB2       CYS  45   1.487 -10.214  -1.934
  343   2HB   CYS  45          HB1       CYS  45   1.649 -10.859  -0.299
  344    H    ALA  46           HN       ALA  46   2.028  -8.164  -2.659
  345    HA   ALA  46           HA       ALA  46   4.797  -7.844  -2.070
  346   1HB   ALA  46          HB1       ALA  46   3.265  -6.425  -4.263
  347   2HB   ALA  46          HB2       ALA  46   3.724  -8.125  -4.355
  348   3HB   ALA  46          HB3       ALA  46   4.969  -6.879  -4.265
  349    H    ALA  47           HN       ALA  47   2.209  -5.391  -2.372
  350    HA   ALA  47           HA       ALA  47   3.872  -3.143  -1.842
  351   1HB   ALA  47          HB1       ALA  47   0.917  -3.634  -1.461
  352   2HB   ALA  47          HB2       ALA  47   1.715  -2.689  -2.717
  353   3HB   ALA  47          HB3       ALA  47   1.660  -2.086  -1.061
  354    H    LEU  48           HN       LEU  48   2.093  -5.289   0.367
  355    HA   LEU  48           HA       LEU  48   2.471  -3.783   2.734
  356   1HB   LEU  48          HB2       LEU  48   0.950  -5.672   2.680
  357   2HB   LEU  48          HB1       LEU  48   2.273  -6.777   2.317
  358    HG   LEU  48           HG       LEU  48   3.264  -6.418   4.501
  359   1HD1  LEU  48          HD11      LEU  48   1.194  -4.228   4.686
  360   2HD1  LEU  48          HD12      LEU  48   2.929  -4.140   4.988
  361   3HD1  LEU  48          HD13      LEU  48   1.876  -4.949   6.146
  362   1HD2  LEU  48          HD21      LEU  48   1.485  -7.309   5.926
  363   2HD2  LEU  48          HD22      LEU  48   1.385  -8.038   4.323
  364   3HD2  LEU  48          HD23      LEU  48   0.263  -6.757   4.780
  365    H    GLU  49           HN       GLU  49   4.544  -6.436   1.448
  366    HA   GLU  49           HA       GLU  49   6.465  -6.292   3.544
  367   1HB   GLU  49          HB2       GLU  49   8.051  -7.305   1.829
  368   2HB   GLU  49          HB1       GLU  49   6.552  -8.193   2.100
  369   1HG   GLU  49          HG2       GLU  49   5.558  -7.207   0.113
  370   2HG   GLU  49          HG1       GLU  49   6.991  -6.207  -0.148
  371    H    SER  50           HN       SER  50   6.238  -4.447   0.511
  372    HA   SER  50           HA       SER  50   8.791  -3.195   0.670
  373   1HB   SER  50          HB2       SER  50   6.190  -2.072  -0.404
  374   2HB   SER  50          HB1       SER  50   7.794  -1.427  -0.740
  375    HG   SER  50           HG       SER  50   7.766  -2.820  -2.316
  376    H    LEU  51           HN       LEU  51   5.676  -2.307   2.136
  377    HA   LEU  51           HA       LEU  51   6.638   0.166   3.272
  378   1HB   LEU  51          HB2       LEU  51   4.275  -1.601   3.933
  379   2HB   LEU  51          HB1       LEU  51   4.576  -0.061   4.736
  380    HG   LEU  51           HG       LEU  51   4.313  -0.390   1.730
  381   1HD1  LEU  51          HD11      LEU  51   2.283   0.638   3.735
  382   2HD1  LEU  51          HD12      LEU  51   2.205  -0.927   2.925
  383   3HD1  LEU  51          HD13      LEU  51   2.068   0.560   1.986
  384   1HD2  LEU  51          HD21      LEU  51   3.783   2.214   2.171
  385   2HD2  LEU  51          HD22      LEU  51   5.429   1.637   1.948
  386   3HD2  LEU  51          HD23      LEU  51   4.815   1.932   3.573
  387    H    ILE  52           HN       ILE  52   6.520  -3.175   4.427
  388    HA   ILE  52           HA       ILE  52   7.057  -2.760   7.158
  389    HB   ILE  52           HB       ILE  52   7.973  -4.951   5.275
  390   1HG1  ILE  52          HG12      ILE  52   5.546  -4.804   5.662
  391   2HG1  ILE  52          HG11      ILE  52   6.209  -6.258   6.390
  392   1HG2  ILE  52          HG21      ILE  52   8.328  -4.736   8.262
  393   2HG2  ILE  52          HG22      ILE  52   9.566  -5.008   7.037
  394   3HG2  ILE  52          HG23      ILE  52   8.389  -6.271   7.394
  395   1HD1  ILE  52          HD11      ILE  52   6.393  -4.622   8.528
  396   2HD1  ILE  52          HD12      ILE  52   4.934  -5.532   8.162
  397   3HD1  ILE  52          HD13      ILE  52   5.053  -3.839   7.695
  398    H    ASN  53           HN       ASN  53   9.025  -1.975   4.475
  399    HA   ASN  53           HA       ASN  53  11.552  -2.078   5.988
  400   1HB   ASN  53          HB2       ASN  53  10.816  -1.068   3.230
  401   2HB   ASN  53          HB1       ASN  53  12.436  -0.893   3.907
  402   1HD2  ASN  53          HD21      ASN  53  11.801  -2.546   1.572
  403   2HD2  ASN  53          HD22      ASN  53  12.157  -4.153   1.989
  404    H    VAL  54           HN       VAL  54   8.929   0.072   5.638
  405    HA   VAL  54           HA       VAL  54  10.545   2.478   6.299
  406    HB   VAL  54           HB       VAL  54   7.539   2.270   6.007
  407   1HG1  VAL  54          HG11      VAL  54   7.640   4.644   5.684
  408   2HG1  VAL  54          HG12      VAL  54   9.398   4.615   5.554
  409   3HG1  VAL  54          HG13      VAL  54   8.624   4.295   7.105
  410   1HG2  VAL  54          HG21      VAL  54   9.639   2.865   3.896
  411   2HG2  VAL  54          HG22      VAL  54   7.896   3.011   3.668
  412   3HG2  VAL  54          HG23      VAL  54   8.618   1.428   3.960
  413    H    SER  55           HN       SER  55  10.849   3.045   8.399
  414    HA   SER  55           HA       SER  55   8.854   2.139  10.454
  415   1HB   SER  55          HB2       SER  55  11.868   2.226  10.785
  416   2HB   SER  55          HB1       SER  55  10.698   1.739  12.008
  417    HG   SER  55           HG       SER  55  10.506   0.461   9.558
  418    H    GLY  56           HN       GLY  56   8.660   3.579  12.280
  419   1HA   GLY  56          HA2       GLY  56   9.057   5.631  13.465
  420   2HA   GLY  56          HA1       GLY  56  10.072   6.184  12.133
  421    H    CYS  57           HN       CYS  57   7.521   5.003  10.537
  422    HA   CYS  57           HA       CYS  57   6.169   7.663  10.445
  423   1HB   CYS  57          HB2       CYS  57   6.079   5.323   8.517
  424   2HB   CYS  57          HB1       CYS  57   5.278   6.878   8.278
  425    H    SER  58           HN       SER  58   4.765   7.478  12.219
  426    HA   SER  58           HA       SER  58   3.106   5.170  12.719
  427   1HB   SER  58          HB2       SER  58   3.718   6.877  14.439
  428   2HB   SER  58          HB1       SER  58   2.675   8.031  13.612
  429    HG   SER  58           HG       SER  58   1.299   7.155  15.000
  430    H    ALA  59           HN       ALA  59   2.581   8.200  10.982
  431    HA   ALA  59           HA       ALA  59  -0.184   8.118  10.628
  432   1HB   ALA  59          HB1       ALA  59   1.897   8.941   8.589
  433   2HB   ALA  59          HB2       ALA  59   1.225   9.971   9.853
  434   3HB   ALA  59          HB3       ALA  59   0.191   9.389   8.547
  435    H    ILE  60           HN       ILE  60   2.201   5.996   9.128
  436    HA   ILE  60           HA       ILE  60   0.093   4.956   7.277
  437    HB   ILE  60           HB       ILE  60   1.885   3.870   6.062
  438   1HG1  ILE  60          HG12      ILE  60   3.816   5.058   8.074
  439   2HG1  ILE  60          HG11      ILE  60   3.313   3.372   8.114
  440   1HG2  ILE  60          HG21      ILE  60   2.812   6.663   6.756
  441   2HG2  ILE  60          HG22      ILE  60   1.372   6.353   5.787
  442   3HG2  ILE  60          HG23      ILE  60   2.954   5.828   5.209
  443   1HD1  ILE  60          HD11      ILE  60   5.474   3.757   6.879
  444   2HD1  ILE  60          HD12      ILE  60   4.562   4.681   5.687
  445   3HD1  ILE  60          HD13      ILE  60   4.224   2.966   5.919
  446    H    GLU  61           HN       GLU  61   1.250   4.237  10.348
  447    HA   GLU  61           HA       GLU  61   1.481   1.389  10.225
  448   1HB   GLU  61          HB2       GLU  61   0.619   3.275  12.426
  449   2HB   GLU  61          HB1       GLU  61   0.643   1.528  12.668
  450   1HG   GLU  61          HG2       GLU  61   3.002   1.419  12.178
  451   2HG   GLU  61          HG1       GLU  61   3.029   3.110  11.683
  452    H    LYS  62           HN       LYS  62  -1.345   3.512  10.626
  453    HA   LYS  62           HA       LYS  62  -3.277   1.427  10.956
  454   1HB   LYS  62          HB2       LYS  62  -3.525   4.195   9.749
  455   2HB   LYS  62          HB1       LYS  62  -4.905   3.126  10.018
  456   1HG   LYS  62          HG2       LYS  62  -4.350   3.000  12.410
  457   2HG   LYS  62          HG1       LYS  62  -2.971   4.068  12.151
  458   1HD   LYS  62          HD2       LYS  62  -4.501   5.843  11.360
  459   2HD   LYS  62          HD1       LYS  62  -5.874   4.770  11.634
  460   1HE   LYS  62          HE2       LYS  62  -5.123   4.593  14.051
  461   2HE   LYS  62          HE1       LYS  62  -3.975   5.886  13.709
  462   1HZ   LYS  62          HZ1       LYS  62  -5.662   7.399  13.325
  463   2HZ   LYS  62          HZ2       LYS  62  -6.264   6.500  14.635
  464   3HZ   LYS  62          HZ3       LYS  62  -6.834   6.202  13.063
  465    H    THR  63           HN       THR  63  -1.861   2.922   8.082
  466    HA   THR  63           HA       THR  63  -3.497   1.651   6.139
  467    HB   THR  63           HB       THR  63  -0.574   2.425   5.921
  468    HG1  THR  63           HG1      THR  63  -1.610   4.265   6.299
  469   1HG2  THR  63          HG21      THR  63  -1.224   0.921   4.124
  470   2HG2  THR  63          HG22      THR  63  -1.112   2.561   3.486
  471   3HG2  THR  63          HG23      THR  63  -2.691   1.855   3.833
  472    H    GLN  64           HN       GLN  64  -0.568   0.545   7.829
  473    HA   GLN  64           HA       GLN  64  -0.109  -1.815   6.311
  474   1HB   GLN  64          HB2       GLN  64   0.383  -1.205   9.239
  475   2HB   GLN  64          HB1       GLN  64   0.950  -2.674   8.451
  476   1HG   GLN  64          HG2       GLN  64   1.609   0.108   7.454
  477   2HG   GLN  64          HG1       GLN  64   2.652  -0.805   8.546
  478   1HE2  GLN  64          HE21      GLN  64   1.717  -0.401   5.240
  479   2HE2  GLN  64          HE22      GLN  64   2.625  -1.685   4.602
  480    H    ARG  65           HN       ARG  65  -2.207  -1.264   9.153
  481    HA   ARG  65           HA       ARG  65  -3.033  -3.982   9.468
  482   1HB   ARG  65          HB2       ARG  65  -4.448  -1.381  10.103
  483   2HB   ARG  65          HB1       ARG  65  -5.075  -2.963  10.558
  484   1HG   ARG  65          HG2       ARG  65  -3.023  -3.416  11.845
  485   2HG   ARG  65          HG1       ARG  65  -2.388  -1.832  11.394
  486   1HD   ARG  65          HD2       ARG  65  -4.307  -0.742  12.499
  487   2HD   ARG  65          HD1       ARG  65  -4.949  -2.322  12.946
  488    HE   ARG  65           HE       ARG  65  -2.411  -2.340  14.033
  489   1HH1  ARG  65          HH21      ARG  65  -5.106  -0.186  14.081
  490   2HH1  ARG  65          HH22      ARG  65  -4.796   0.382  15.688
  491   1HH2  ARG  65          HH11      ARG  65  -1.997  -1.620  16.140
  492   2HH2  ARG  65          HH12      ARG  65  -3.037  -0.432  16.854
  493    H    MET  66           HN       MET  66  -4.496  -1.307   7.623
  494    HA   MET  66           HA       MET  66  -6.720  -2.802   6.649
  495   1HB   MET  66          HB2       MET  66  -5.310  -0.339   5.584
  496   2HB   MET  66          HB1       MET  66  -6.792  -0.983   4.873
  497   1HG   MET  66          HG2       MET  66  -7.851  -0.838   7.174
  498   2HG   MET  66          HG1       MET  66  -6.412   0.022   7.712
  499   1HE   MET  66          HE1       MET  66  -5.605   2.101   7.036
  500   2HE   MET  66          HE2       MET  66  -6.416   3.352   6.101
  501   3HE   MET  66          HE3       MET  66  -5.628   2.016   5.269
  502    H    LEU  67           HN       LEU  67  -3.460  -2.311   5.304
  503    HA   LEU  67           HA       LEU  67  -3.940  -3.585   2.792
  504   1HB   LEU  67          HB2       LEU  67  -1.426  -3.342   4.457
  505   2HB   LEU  67          HB1       LEU  67  -1.444  -4.005   2.826
  506    HG   LEU  67           HG       LEU  67  -2.477  -1.243   3.532
  507   1HD1  LEU  67          HD11      LEU  67  -0.341  -0.464   2.450
  508   2HD1  LEU  67          HD12      LEU  67   0.222  -2.135   2.484
  509   3HD1  LEU  67          HD13      LEU  67  -0.106  -1.284   3.994
  510   1HD2  LEU  67          HD21      LEU  67  -1.947  -1.039   0.943
  511   2HD2  LEU  67          HD22      LEU  67  -3.457  -1.766   1.473
  512   3HD2  LEU  67          HD23      LEU  67  -2.116  -2.794   0.971
  513    H    SER  68           HN       SER  68  -2.946  -4.920   5.938
  514    HA   SER  68           HA       SER  68  -2.416  -7.571   5.056
  515   1HB   SER  68          HB2       SER  68  -3.445  -6.522   7.705
  516   2HB   SER  68          HB1       SER  68  -3.001  -8.205   7.440
  517    HG   SER  68           HG       SER  68  -1.351  -6.605   8.262
  518    H    GLY  69           HN       GLY  69  -5.437  -5.999   6.037
  519   1HA   GLY  69          HA2       GLY  69  -7.158  -8.191   6.155
  520   2HA   GLY  69          HA1       GLY  69  -7.654  -6.615   5.542
  521    H    PHE  70           HN       PHE  70  -5.585  -6.847   3.321
  522    HA   PHE  70           HA       PHE  70  -7.308  -8.464   1.510
  523   1HB   PHE  70          HB2       PHE  70  -5.103  -6.456   0.982
  524   2HB   PHE  70          HB1       PHE  70  -5.943  -7.351  -0.286
  525    HD1  PHE  70           HD1      PHE  70  -8.323  -6.973  -0.738
  526    HD2  PHE  70           HD2      PHE  70  -6.229  -4.721   2.259
  527    HE1  PHE  70           HE1      PHE  70 -10.188  -5.340  -0.664
  528    HE2  PHE  70           HE2      PHE  70  -8.092  -3.085   2.335
  529    HZ   PHE  70           HZ       PHE  70 -10.073  -3.395   0.873
  530    H    CYS  71           HN       CYS  71  -4.281  -8.685   3.140
  531    HA   CYS  71           HA       CYS  71  -3.699 -11.190   1.641
  532   1HB   CYS  71          HB2       CYS  71  -2.349  -9.211   0.717
  533   2HB   CYS  71          HB1       CYS  71  -1.468  -9.258   2.246
  534    HA   PRO  72           HA       PRO  72  -3.387 -11.953   6.225
  535   1HB   PRO  72          HB2       PRO  72  -3.254 -14.767   5.291
  536   2HB   PRO  72          HB1       PRO  72  -4.381 -14.018   6.428
  537   1HG   PRO  72          HG2       PRO  72  -5.079 -14.806   3.894
  538   2HG   PRO  72          HG1       PRO  72  -5.908 -13.517   4.779
  539   1HD   PRO  72          HD2       PRO  72  -4.043 -13.305   2.473
  540   2HD   PRO  72          HD1       PRO  72  -5.289 -12.154   3.027
  541    H    HIS  73           HN       HIS  73  -1.087 -11.302   4.504
  542    HA   HIS  73           HA       HIS  73   0.891 -13.427   4.982
  543   1HB   HIS  73          HB2       HIS  73   0.523 -11.432   3.049
  544   2HB   HIS  73          HB1       HIS  73   1.919 -10.865   3.946
  545    HD1  HIS  73           HD1      HIS  73   4.077 -12.237   3.773
  546    HD2  HIS  73           HD2      HIS  73   0.872 -13.917   1.720
  547    HE1  HIS  73           HE1      HIS  73   5.054 -14.070   2.346
  548    H    LYS  74           HN       LYS  74   1.728 -13.529   7.023
  549    HA   LYS  74           HA       LYS  74   2.125 -11.083   8.624
  550   1HB   LYS  74          HB2       LYS  74   3.039 -13.935   9.157
  551   2HB   LYS  74          HB1       LYS  74   3.018 -12.617  10.326
  552   1HG   LYS  74          HG2       LYS  74   0.558 -13.723   8.935
  553   2HG   LYS  74          HG1       LYS  74   1.064 -14.154  10.568
  554   1HD   LYS  74          HD2       LYS  74   1.025 -11.586  11.017
  555   2HD   LYS  74          HD1       LYS  74   0.052 -11.501   9.548
  556   1HE   LYS  74          HE2       LYS  74  -1.439 -11.682  11.460
  557   2HE   LYS  74          HE1       LYS  74  -1.511 -13.185  10.540
  558   1HZ   LYS  74          HZ1       LYS  74  -1.205 -13.252  13.095
  559   2HZ   LYS  74          HZ2       LYS  74   0.422 -12.918  12.738
  560   3HZ   LYS  74          HZ3       LYS  74  -0.318 -14.317  12.117
  561    H    VAL  75           HN       VAL  75   3.639  -9.911   7.349
  562    HA   VAL  75           HA       VAL  75   6.158 -11.258   6.554
  563    HB   VAL  75           HB       VAL  75   5.295  -8.382   6.140
  564   1HG1  VAL  75          HG11      VAL  75   7.736  -8.856   5.921
  565   2HG1  VAL  75          HG12      VAL  75   7.001  -8.403   4.387
  566   3HG1  VAL  75          HG13      VAL  75   7.360 -10.095   4.724
  567   1HG2  VAL  75          HG21      VAL  75   4.747  -9.198   3.822
  568   2HG2  VAL  75          HG22      VAL  75   3.679  -9.833   5.074
  569   3HG2  VAL  75          HG23      VAL  75   4.962 -10.845   4.412
  570    H    SER  76           HN       SER  76   8.046 -11.003   7.634
  571    HA   SER  76           HA       SER  76   8.119  -9.120   9.964
  572   1HB   SER  76          HB2       SER  76   9.729 -11.605   9.314
  573   2HB   SER  76          HB1       SER  76  10.075 -10.541  10.674
  574    HG   SER  76           HG       SER  76   8.518 -11.482  11.706
  575    H    ALA  77           HN       ALA  77  10.089  -7.856  10.236
  576    HA   ALA  77           HA       ALA  77  11.018  -6.601   7.872
  577   1HB   ALA  77          HB1       ALA  77  12.829  -5.674   9.352
  578   2HB   ALA  77          HB2       ALA  77  12.256  -6.743  10.633
  579   3HB   ALA  77          HB3       ALA  77  11.203  -5.473  10.007
  580    H    GLY  78           HN       GLY  78  11.786  -9.665   9.065
  581   1HA   GLY  78          HA2       GLY  78  14.464  -9.697   7.722
  582   2HA   GLY  78          HA1       GLY  78  13.884 -10.901   8.872
  583    H    GLN  79           HN       GLN  79  11.220 -11.073   7.619
  584    HA   GLN  79           HA       GLN  79  11.979 -12.907   5.412
  585   1HB   GLN  79          HB2       GLN  79   9.394 -12.443   6.924
  586   2HB   GLN  79          HB1       GLN  79   9.537 -13.561   5.567
  587   1HG   GLN  79          HG2       GLN  79  11.287 -14.814   6.755
  588   2HG   GLN  79          HG1       GLN  79  11.197 -13.682   8.105
  589   1HE2  GLN  79          HE21      GLN  79  10.613 -16.570   8.248
  590   2HE2  GLN  79          HE22      GLN  79   8.989 -16.714   8.721
  591    H    PHE  80           HN       PHE  80  11.824 -12.262   3.332
  592    HA   PHE  80           HA       PHE  80   9.833 -10.140   2.592
  593   1HB   PHE  80          HB2       PHE  80  12.690 -10.421   1.607
  594   2HB   PHE  80          HB1       PHE  80  11.500  -9.307   0.934
  595    HD1  PHE  80           HD1      PHE  80  13.881  -9.883   3.597
  596    HD2  PHE  80           HD2      PHE  80  10.471  -7.546   2.437
  597    HE1  PHE  80           HE1      PHE  80  14.419  -8.224   5.358
  598    HE2  PHE  80           HE2      PHE  80  11.007  -5.885   4.199
  599    HZ   PHE  80           HZ       PHE  80  12.984  -6.225   5.661
  600    H    SER  81           HN       SER  81   8.943 -10.396   0.460
  601    HA   SER  81           HA       SER  81   9.458 -13.089  -0.778
  602   1HB   SER  81          HB2       SER  81   6.831 -11.595  -0.723
  603   2HB   SER  81          HB1       SER  81   7.117 -13.227  -1.319
  604    HG   SER  81           HG       SER  81   8.064 -13.274   1.070
  605    H    SER  82           HN       SER  82   8.575  -9.684  -1.447
  606    HA   SER  82           HA       SER  82   9.018 -10.216  -4.363
  607   1HB   SER  82          HB2       SER  82   6.837  -9.215  -3.585
  608   2HB   SER  82          HB1       SER  82   7.744  -7.784  -3.102
  609    HG   SER  82           HG       SER  82   7.080  -7.428  -5.174
  610    H    LEU  83           HN       LEU  83  10.906  -9.134  -1.882
  611    HA   LEU  83           HA       LEU  83  12.033  -6.809  -3.328
  612   1HB   LEU  83          HB2       LEU  83  12.972  -8.169  -0.785
  613   2HB   LEU  83          HB1       LEU  83  13.601  -6.658  -1.427
  614    HG   LEU  83           HG       LEU  83  10.802  -7.176  -0.383
  615   1HD1  LEU  83          HD11      LEU  83  11.392  -5.692   1.374
  616   2HD1  LEU  83          HD12      LEU  83  12.808  -5.098   0.508
  617   3HD1  LEU  83          HD13      LEU  83  12.807  -6.728   1.179
  618   1HD2  LEU  83          HD21      LEU  83  10.375  -5.688  -2.159
  619   2HD2  LEU  83          HD22      LEU  83  11.937  -4.887  -1.995
  620   3HD2  LEU  83          HD23      LEU  83  10.661  -4.583  -0.816
  621    H    HIS  84           HN       HIS  84  12.210  -9.902  -4.078
  622    HA   HIS  84           HA       HIS  84  15.094 -10.342  -4.142
  623   1HB   HIS  84          HB2       HIS  84  13.131 -11.751  -5.949
  624   2HB   HIS  84          HB1       HIS  84  14.612 -12.376  -5.221
  625    HD1  HIS  84           HD1      HIS  84  13.610 -10.967  -2.366
  626    HD2  HIS  84           HD2      HIS  84  11.738 -13.913  -4.637
  627    HE1  HIS  84           HE1      HIS  84  12.039 -12.183  -0.805
  628    H    VAL  85           HN       VAL  85  12.808  -8.666  -6.105
  629    HA   VAL  85           HA       VAL  85  14.293  -8.814  -8.593
  630    HB   VAL  85           HB       VAL  85  12.356  -6.621  -7.831
  631   1HG1  VAL  85          HG11      VAL  85  13.591  -6.570 -10.027
  632   2HG1  VAL  85          HG12      VAL  85  11.837  -6.646 -10.196
  633   3HG1  VAL  85          HG13      VAL  85  12.811  -8.096 -10.440
  634   1HG2  VAL  85          HG21      VAL  85  10.602  -8.247  -8.761
  635   2HG2  VAL  85          HG22      VAL  85  11.204  -8.595  -7.141
  636   3HG2  VAL  85          HG23      VAL  85  11.803  -9.515  -8.521
  637    H    ARG  86           HN       ARG  86  15.748  -7.265  -9.433
  638    HA   ARG  86           HA       ARG  86  17.065  -5.585  -7.384
  639   1HB   ARG  86          HB2       ARG  86  17.786  -6.150 -10.276
  640   2HB   ARG  86          HB1       ARG  86  18.776  -5.228  -9.146
  641   1HG   ARG  86          HG2       ARG  86  18.917  -7.204  -7.663
  642   2HG   ARG  86          HG1       ARG  86  17.950  -8.126  -8.815
  643   1HD   ARG  86          HD2       ARG  86  20.343  -8.583  -9.157
  644   2HD   ARG  86          HD1       ARG  86  19.671  -7.744 -10.555
  645    HE   ARG  86           HE       ARG  86  20.637  -5.709  -8.915
  646   1HH1  ARG  86          HH21      ARG  86  21.869  -8.579 -10.383
  647   2HH1  ARG  86          HH22      ARG  86  23.485  -7.971 -10.518
  648   1HH2  ARG  86          HH11      ARG  86  22.731  -4.905  -9.078
  649   2HH2  ARG  86          HH12      ARG  86  23.972  -5.885  -9.785
  650    H    ASP  87           HN       ASP  87  14.618  -4.536  -7.812
  651    HA   ASP  87           HA       ASP  87  14.686  -2.515  -9.937
  652   1HB   ASP  87          HB2       ASP  87  12.775  -3.053  -7.647
  653   2HB   ASP  87          HB1       ASP  87  12.560  -1.733  -8.798
  654    H    THR  88           HN       THR  88  14.368  -0.165  -9.292
  655    HA   THR  88           HA       THR  88  16.398   0.527  -7.255
  656    HB   THR  88           HB       THR  88  14.798   2.343  -9.087
  657    HG1  THR  88           HG1      THR  88  16.301   2.010 -10.555
  658   1HG2  THR  88          HG21      THR  88  17.230   2.713  -7.336
  659   2HG2  THR  88          HG22      THR  88  15.727   3.636  -7.331
  660   3HG2  THR  88          HG23      THR  88  16.862   3.806  -8.671
  661    H    LYS  89           HN       LYS  89  15.865   2.140  -5.561
  662    HA   LYS  89           HA       LYS  89  13.196   1.631  -4.433
  663   1HB   LYS  89          HB2       LYS  89  15.480   3.352  -3.415
  664   2HB   LYS  89          HB1       LYS  89  14.022   2.948  -2.512
  665   1HG   LYS  89          HG2       LYS  89  14.592   0.554  -2.644
  666   2HG   LYS  89          HG1       LYS  89  16.057   0.952  -3.546
  667   1HD   LYS  89          HD2       LYS  89  16.864   2.306  -1.644
  668   2HD   LYS  89          HD1       LYS  89  15.407   1.901  -0.739
  669   1HE   LYS  89          HE2       LYS  89  16.011  -0.390  -0.578
  670   2HE   LYS  89          HE1       LYS  89  17.246  -0.233  -1.828
  671   1HZ   LYS  89          HZ1       LYS  89  17.961  -0.250   0.630
  672   2HZ   LYS  89          HZ2       LYS  89  17.419   1.360   0.645
  673   3HZ   LYS  89          HZ3       LYS  89  18.662   0.889  -0.413
  674    H    ILE  90           HN       ILE  90  11.675   3.310  -3.965
  675    HA   ILE  90           HA       ILE  90  12.084   5.880  -5.460
  676    HB   ILE  90           HB       ILE  90   9.682   5.748  -6.111
  677   1HG1  ILE  90          HG12      ILE  90   9.843   2.886  -5.108
  678   2HG1  ILE  90          HG11      ILE  90   9.043   4.182  -4.222
  679   1HG2  ILE  90          HG21      ILE  90   9.988   3.897  -7.785
  680   2HG2  ILE  90          HG22      ILE  90  11.459   3.432  -6.930
  681   3HG2  ILE  90          HG23      ILE  90  11.353   5.010  -7.711
  682   1HD1  ILE  90          HD11      ILE  90   8.338   3.427  -7.068
  683   2HD1  ILE  90          HD12      ILE  90   7.459   4.529  -6.009
  684   3HD1  ILE  90          HD13      ILE  90   7.492   2.802  -5.654
  685    H    GLU  91           HN       GLU  91  10.726   7.647  -4.627
  686    HA   GLU  91           HA       GLU  91  10.776   7.777  -1.763
  687   1HB   GLU  91          HB2       GLU  91   9.396   9.531  -3.814
  688   2HB   GLU  91          HB1       GLU  91   9.501   9.916  -2.096
  689   1HG   GLU  91          HG2       GLU  91  11.927   9.357  -3.818
  690   2HG   GLU  91          HG1       GLU  91  11.301  10.980  -3.524
  691    H    VAL  92           HN       VAL  92   9.101   7.586  -0.257
  692    HA   VAL  92           HA       VAL  92   7.024   5.736  -0.793
  693    HB   VAL  92           HB       VAL  92   7.290   7.832   1.379
  694   1HG1  VAL  92          HG11      VAL  92   5.252   5.635   0.976
  695   2HG1  VAL  92          HG12      VAL  92   4.956   7.345   1.286
  696   3HG1  VAL  92          HG13      VAL  92   5.597   6.315   2.566
  697   1HG2  VAL  92          HG21      VAL  92   8.154   6.063   2.712
  698   2HG2  VAL  92          HG22      VAL  92   8.948   5.872   1.149
  699   3HG2  VAL  92          HG23      VAL  92   7.594   4.829   1.582
  700    H    ALA  93           HN       ALA  93   6.989   9.292  -0.822
  701    HA   ALA  93           HA       ALA  93   4.246   9.775  -1.079
  702   1HB   ALA  93          HB1       ALA  93   4.853  11.823  -2.281
  703   2HB   ALA  93          HB2       ALA  93   6.463  11.177  -2.601
  704   3HB   ALA  93          HB3       ALA  93   5.975  11.550  -0.947
  705    H    GLN  94           HN       GLN  94   6.528   8.827  -3.655
  706    HA   GLN  94           HA       GLN  94   4.441   8.911  -5.695
  707   1HB   GLN  94          HB2       GLN  94   6.842   9.271  -6.244
  708   2HB   GLN  94          HB1       GLN  94   7.174   7.596  -5.798
  709   1HG   GLN  94          HG2       GLN  94   5.646   6.799  -7.541
  710   2HG   GLN  94          HG1       GLN  94   5.225   8.460  -7.955
  711   1HE2  GLN  94          HE21      GLN  94   6.132   7.499 -10.160
  712   2HE2  GLN  94          HE22      GLN  94   7.792   7.733 -10.429
  713    H    PHE  95           HN       PHE  95   5.882   6.469  -3.608
  714    HA   PHE  95           HA       PHE  95   4.843   4.145  -4.885
  715   1HB   PHE  95          HB2       PHE  95   6.478   4.017  -3.049
  716   2HB   PHE  95          HB1       PHE  95   5.287   4.687  -1.933
  717    HD1  PHE  95           HD1      PHE  95   6.341   1.713  -3.797
  718    HD2  PHE  95           HD2      PHE  95   3.290   3.397  -1.285
  719    HE1  PHE  95           HE1      PHE  95   5.423  -0.555  -3.389
  720    HE2  PHE  95           HE2      PHE  95   2.373   1.132  -0.877
  721    HZ   PHE  95           HZ       PHE  95   3.441  -0.845  -1.929
  722    H    VAL  96           HN       VAL  96   3.471   6.168  -2.284
  723    HA   VAL  96           HA       VAL  96   1.021   4.732  -2.045
  724    HB   VAL  96           HB       VAL  96   1.629   7.661  -1.547
  725   1HG1  VAL  96          HG11      VAL  96  -0.408   7.389   0.011
  726   2HG1  VAL  96          HG12      VAL  96  -0.778   5.943  -0.929
  727   3HG1  VAL  96          HG13      VAL  96  -0.732   7.520  -1.718
  728   1HG2  VAL  96          HG21      VAL  96   2.945   6.004  -0.214
  729   2HG2  VAL  96          HG22      VAL  96   1.429   5.315   0.365
  730   3HG2  VAL  96          HG23      VAL  96   1.859   6.973   0.784
  731    H    LYS  97           HN       LYS  97   1.849   7.613  -4.000
  732    HA   LYS  97           HA       LYS  97  -0.731   7.957  -5.151
  733   1HB   LYS  97          HB2       LYS  97   2.030   8.623  -6.197
  734   2HB   LYS  97          HB1       LYS  97   0.544   9.117  -7.009
  735   1HG   LYS  97          HG2       LYS  97  -0.185  10.298  -4.968
  736   2HG   LYS  97          HG1       LYS  97   1.302   9.811  -4.153
  737   1HD   LYS  97          HD2       LYS  97   2.629  11.026  -5.845
  738   2HD   LYS  97          HD1       LYS  97   1.142  11.515  -6.658
  739   1HE   LYS  97          HE2       LYS  97   1.788  12.185  -3.774
  740   2HE   LYS  97          HE1       LYS  97   2.083  13.274  -5.129
  741   1HZ   LYS  97          HZ1       LYS  97  -0.393  12.798  -5.647
  742   2HZ   LYS  97          HZ2       LYS  97   0.010  13.923  -4.439
  743   3HZ   LYS  97          HZ3       LYS  97  -0.475  12.351  -4.013
  744    H    ASP  98           HN       ASP  98   2.069   6.052  -6.332
  745    HA   ASP  98           HA       ASP  98   0.847   5.190  -8.757
  746   1HB   ASP  98          HB2       ASP  98   2.893   3.845  -6.968
  747   2HB   ASP  98          HB1       ASP  98   2.428   3.220  -8.551
  748    H    LEU  99           HN       LEU  99   0.769   3.847  -5.485
  749    HA   LEU  99           HA       LEU  99  -0.728   1.494  -6.092
  750   1HB   LEU  99          HB2       LEU  99   0.483   1.825  -3.967
  751   2HB   LEU  99          HB1       LEU  99  -0.618   3.129  -3.536
  752    HG   LEU  99           HG       LEU  99  -2.512   1.515  -3.595
  753   1HD1  LEU  99          HD11      LEU  99  -1.679  -0.979  -3.491
  754   2HD1  LEU  99          HD12      LEU  99  -0.279  -0.361  -4.367
  755   3HD1  LEU  99          HD13      LEU  99  -1.894  -0.211  -5.061
  756   1HD2  LEU  99          HD21      LEU  99  -0.183   0.718  -1.826
  757   2HD2  LEU  99          HD22      LEU  99  -1.872   0.304  -1.533
  758   3HD2  LEU  99          HD23      LEU  99  -1.354   1.990  -1.480
  759    H    LEU 100           HN       LEU 100  -1.695   4.791  -5.250
  760    HA   LEU 100           HA       LEU 100  -4.460   4.396  -4.883
  761   1HB   LEU 100          HB2       LEU 100  -3.440   6.507  -4.339
  762   2HB   LEU 100          HB1       LEU 100  -2.941   6.758  -6.008
  763    HG   LEU 100           HG       LEU 100  -5.242   6.996  -6.724
  764   1HD1  LEU 100          HD11      LEU 100  -7.023   7.038  -4.835
  765   2HD1  LEU 100          HD12      LEU 100  -5.844   6.120  -3.897
  766   3HD1  LEU 100          HD13      LEU 100  -6.475   5.464  -5.406
  767   1HD2  LEU 100          HD21      LEU 100  -5.846   9.024  -5.500
  768   2HD2  LEU 100          HD22      LEU 100  -4.100   8.971  -5.740
  769   3HD2  LEU 100          HD23      LEU 100  -4.786   8.560  -4.169
  770    H    LEU 101           HN       LEU 101  -2.750   5.099  -7.984
  771    HA   LEU 101           HA       LEU 101  -5.126   5.163  -9.565
  772   1HB   LEU 101          HB2       LEU 101  -2.252   4.503 -10.195
  773   2HB   LEU 101          HB1       LEU 101  -3.486   4.356 -11.439
  774    HG   LEU 101           HG       LEU 101  -2.223   6.583 -11.337
  775   1HD1  LEU 101          HD11      LEU 101  -4.558   6.154 -12.378
  776   2HD1  LEU 101          HD12      LEU 101  -4.093   7.820 -12.050
  777   3HD1  LEU 101          HD13      LEU 101  -5.191   6.985 -10.958
  778   1HD2  LEU 101          HD21      LEU 101  -4.057   7.145  -8.999
  779   2HD2  LEU 101          HD22      LEU 101  -2.762   8.157  -9.634
  780   3HD2  LEU 101          HD23      LEU 101  -2.377   6.663  -8.793
  781    H    HIS 102           HN       HIS 102  -3.074   2.428  -8.598
  782    HA   HIS 102           HA       HIS 102  -4.561   0.496 -10.144
  783   1HB   HIS 102          HB2       HIS 102  -2.567   0.300  -7.896
  784   2HB   HIS 102          HB1       HIS 102  -3.421  -1.140  -8.455
  785    HD1  HIS 102           HD1      HIS 102  -3.006  -1.907 -10.912
  786    HD2  HIS 102           HD2      HIS 102  -0.661   1.320  -9.712
  787    HE1  HIS 102           HE1      HIS 102  -1.229  -1.626 -12.691
  788    H    LEU 103           HN       LEU 103  -4.836   1.568  -6.749
  789    HA   LEU 103           HA       LEU 103  -6.658  -0.447  -5.935
  790   1HB   LEU 103          HB2       LEU 103  -6.412   2.440  -5.055
  791   2HB   LEU 103          HB1       LEU 103  -7.463   1.275  -4.257
  792    HG   LEU 103           HG       LEU 103  -4.484   0.844  -4.637
  793   1HD1  LEU 103          HD11      LEU 103  -4.683   2.763  -3.222
  794   2HD1  LEU 103          HD12      LEU 103  -4.423   1.394  -2.143
  795   3HD1  LEU 103          HD13      LEU 103  -6.043   2.061  -2.346
  796   1HD2  LEU 103          HD21      LEU 103  -6.671  -0.580  -3.114
  797   2HD2  LEU 103          HD22      LEU 103  -4.996  -0.708  -2.593
  798   3HD2  LEU 103          HD23      LEU 103  -5.460  -1.267  -4.193
  799    H    LYS 104           HN       LYS 104  -7.407   2.762  -7.359
  800    HA   LYS 104           HA       LYS 104 -10.253   2.277  -7.364
  801   1HB   LYS 104          HB2       LYS 104 -10.378   4.207  -8.895
  802   2HB   LYS 104          HB1       LYS 104  -9.336   4.548  -7.516
  803   1HG   LYS 104          HG2       LYS 104  -7.356   3.958  -8.910
  804   2HG   LYS 104          HG1       LYS 104  -8.424   3.717 -10.287
  805   1HD   LYS 104          HD2       LYS 104  -7.640   5.935 -10.557
  806   2HD   LYS 104          HD1       LYS 104  -9.245   6.125  -9.857
  807   1HE   LYS 104          HE2       LYS 104  -8.365   6.619  -7.706
  808   2HE   LYS 104          HE1       LYS 104  -6.767   6.019  -8.136
  809   1HZ   LYS 104          HZ1       LYS 104  -7.498   8.594  -8.212
  810   2HZ   LYS 104          HZ2       LYS 104  -7.752   8.135  -9.828
  811   3HZ   LYS 104          HZ3       LYS 104  -6.223   7.934  -9.115
  812    H    LYS 105           HN       LYS 105  -7.675   1.374  -9.544
  813    HA   LYS 105           HA       LYS 105  -9.254   0.933 -11.885
  814   1HB   LYS 105          HB2       LYS 105  -6.788   1.023 -11.902
  815   2HB   LYS 105          HB1       LYS 105  -6.731  -0.497 -11.009
  816   1HG   LYS 105          HG2       LYS 105  -7.866  -1.655 -12.846
  817   2HG   LYS 105          HG1       LYS 105  -8.023  -0.137 -13.732
  818   1HD   LYS 105          HD2       LYS 105  -5.518   0.056 -13.714
  819   2HD   LYS 105          HD1       LYS 105  -5.446  -1.555 -12.997
  820   1HE   LYS 105          HE2       LYS 105  -6.601  -2.501 -14.938
  821   2HE   LYS 105          HE1       LYS 105  -6.766  -0.895 -15.646
  822   1HZ   LYS 105          HZ1       LYS 105  -4.305  -2.472 -15.222
  823   2HZ   LYS 105          HZ2       LYS 105  -4.249  -0.791 -15.460
  824   3HZ   LYS 105          HZ3       LYS 105  -4.895  -1.803 -16.664
  825    H    LEU 106           HN       LEU 106  -8.276  -1.404  -9.322
  826    HA   LEU 106           HA       LEU 106  -9.667  -3.616 -10.479
  827   1HB   LEU 106          HB2       LEU 106  -8.842  -2.982  -7.642
  828   2HB   LEU 106          HB1       LEU 106  -9.742  -4.443  -8.018
  829    HG   LEU 106           HG       LEU 106  -7.177  -4.647  -7.955
  830   1HD1  LEU 106          HD11      LEU 106  -7.148  -6.315  -9.628
  831   2HD1  LEU 106          HD12      LEU 106  -8.333  -5.474 -10.621
  832   3HD1  LEU 106          HD13      LEU 106  -8.831  -6.247  -9.119
  833   1HD2  LEU 106          HD21      LEU 106  -5.920  -3.885  -9.845
  834   2HD2  LEU 106          HD22      LEU 106  -6.849  -2.507  -9.274
  835   3HD2  LEU 106          HD23      LEU 106  -7.376  -3.389 -10.702
  836    H    PHE 107           HN       PHE 107 -10.763  -0.931  -8.516
  837    HA   PHE 107           HA       PHE 107 -13.277  -1.994  -7.716
  838   1HB   PHE 107          HB2       PHE 107 -12.379   0.138  -6.839
  839   2HB   PHE 107          HB1       PHE 107 -12.599   0.878  -8.424
  840    HD1  PHE 107           HD1      PHE 107 -14.473  -0.962  -5.758
  841    HD2  PHE 107           HD2      PHE 107 -14.660   1.883  -8.975
  842    HE1  PHE 107           HE1      PHE 107 -16.841  -0.495  -5.208
  843    HE2  PHE 107           HE2      PHE 107 -17.029   2.357  -8.416
  844    HZ   PHE 107           HZ       PHE 107 -18.119   1.170  -6.530
  845    H    ARG 108           HN       ARG 108 -12.264  -0.367 -10.705
  846    HA   ARG 108           HA       ARG 108 -14.832  -0.139 -11.903
  847   1HB   ARG 108          HB2       ARG 108 -12.090  -0.513 -13.136
  848   2HB   ARG 108          HB1       ARG 108 -13.539  -0.192 -14.087
  849   1HG   ARG 108          HG2       ARG 108 -13.896   1.907 -12.831
  850   2HG   ARG 108          HG1       ARG 108 -12.440   1.587 -11.888
  851   1HD   ARG 108          HD2       ARG 108 -11.817   3.104 -13.653
  852   2HD   ARG 108          HD1       ARG 108 -11.154   1.526 -14.070
  853    HE   ARG 108           HE       ARG 108 -13.644   1.588 -15.314
  854   1HH1  ARG 108          HH21      ARG 108 -10.778   3.511 -15.253
  855   2HH1  ARG 108          HH22      ARG 108 -10.999   4.125 -16.858
  856   1HH2  ARG 108          HH11      ARG 108 -13.952   2.391 -17.402
  857   2HH2  ARG 108          HH12      ARG 108 -12.795   3.493 -18.073
  858    H    GLU 109           HN       GLU 109 -12.533  -2.861 -11.835
  859    HA   GLU 109           HA       GLU 109 -14.286  -4.474 -13.572
  860   1HB   GLU 109          HB2       GLU 109 -11.705  -5.088 -12.110
  861   2HB   GLU 109          HB1       GLU 109 -12.571  -6.267 -13.097
  862   1HG   GLU 109          HG2       GLU 109 -11.688  -3.564 -14.136
  863   2HG   GLU 109          HG1       GLU 109 -10.723  -5.030 -14.310
  864    H    GLY 110           HN       GLY 110 -14.157  -3.773 -10.237
  865   1HA   GLY 110          HA2       GLY 110 -15.405  -4.654  -8.456
  866   2HA   GLY 110          HA1       GLY 110 -16.291  -5.608  -9.645
  867    H    ARG 111           HN       ARG 111 -12.909  -6.064  -9.842
  868    HA   ARG 111           HA       ARG 111 -13.197  -8.753  -8.571
  869   1HB   ARG 111          HB2       ARG 111 -11.019  -7.581 -10.333
  870   2HB   ARG 111          HB1       ARG 111 -11.013  -9.220  -9.684
  871   1HG   ARG 111          HG2       ARG 111 -13.126  -9.701 -10.859
  872   2HG   ARG 111          HG1       ARG 111 -13.138  -8.062 -11.513
  873   1HD   ARG 111          HD2       ARG 111 -10.984  -8.497 -12.640
  874   2HD   ARG 111          HD1       ARG 111 -10.977 -10.137 -11.993
  875    HE   ARG 111           HE       ARG 111 -13.393  -9.956 -13.351
  876   1HH1  ARG 111          HH21      ARG 111 -10.062  -9.389 -14.044
  877   2HH1  ARG 111          HH22      ARG 111 -10.198  -9.816 -15.717
  878   1HH2  ARG 111          HH11      ARG 111 -13.588 -10.522 -15.535
  879   2HH2  ARG 111          HH12      ARG 111 -12.195 -10.449 -16.562
  880    H    PHE 112           HN       PHE 112 -12.807  -8.573  -6.402
  881    HA   PHE 112           HA       PHE 112 -10.606  -6.795  -5.464
  882   1HB   PHE 112          HB2       PHE 112 -12.737  -8.258  -3.877
  883   2HB   PHE 112          HB1       PHE 112 -11.644  -7.002  -3.278
  884    HD1  PHE 112           HD1      PHE 112 -11.767  -4.687  -4.209
  885    HD2  PHE 112           HD2      PHE 112 -14.679  -7.691  -5.179
  886    HE1  PHE 112           HE1      PHE 112 -13.288  -2.938  -5.083
  887    HE2  PHE 112           HE2      PHE 112 -16.200  -5.930  -6.049
  888    HZ   PHE 112           HZ       PHE 112 -15.505  -3.556  -5.994
  889    H    ASN 113           HN       ASN 113  -8.783  -7.586  -4.519
  890    HA   ASN 113           HA       ASN 113  -7.094  -9.168  -4.143
  891   1HB   ASN 113          HB2       ASN 113  -7.557 -10.629  -2.340
  892   2HB   ASN 113          HB1       ASN 113  -8.649  -9.270  -2.093
  893   1HD2  ASN 113          HD21      ASN 113  -8.510 -12.656  -3.200
  894   2HD2  ASN 113          HD22      ASN 113 -10.177 -12.944  -3.062
  Start of MODEL   20
    1   1H    MET   1           HT1      MET   1  21.627   2.056  14.208
    2   2H    MET   1           HT2      MET   1  21.312   2.799  12.713
    3   3H    MET   1           HT3      MET   1  20.120   2.781  13.924
    4    HA   MET   1           HA       MET   1  21.490   4.182  15.334
    5   1HB   MET   1          HB2       MET   1  23.661   3.363  14.422
    6   2HB   MET   1          HB1       MET   1  23.344   4.242  12.929
    7   1HG   MET   1          HG2       MET   1  23.213   6.359  14.242
    8   2HG   MET   1          HG1       MET   1  23.623   5.452  15.697
    9   1HE   MET   1          HE1       MET   1  24.718   7.376  12.761
   10   2HE   MET   1          HE2       MET   1  24.773   5.820  11.938
   11   3HE   MET   1          HE3       MET   1  26.265   6.714  12.215
   12    H    GLY   2           HN       GLY   2  22.398   5.580  12.275
   13   1HA   GLY   2          HA2       GLY   2  20.529   7.740  12.624
   14   2HA   GLY   2          HA1       GLY   2  21.543   7.491  11.203
   15    HA   PRO   3           HA       PRO   3  16.813   6.390  10.631
   16   1HB   PRO   3          HB2       PRO   3  16.978   8.395   8.480
   17   2HB   PRO   3          HB1       PRO   3  15.815   8.277   9.805
   18   1HG   PRO   3          HG2       PRO   3  17.965  10.133   9.580
   19   2HG   PRO   3          HG1       PRO   3  16.908   9.896  10.976
   20   1HD   PRO   3          HD2       PRO   3  19.713   9.235  10.768
   21   2HD   PRO   3          HD1       PRO   3  18.628   8.952  12.152
   22    H    VAL   4           HN       VAL   4  16.079   5.190   8.726
   23    HA   VAL   4           HA       VAL   4  18.280   4.001   7.231
   24    HB   VAL   4           HB       VAL   4  16.513   2.558   6.282
   25   1HG1  VAL   4          HG11      VAL   4  16.019   2.944   9.241
   26   2HG1  VAL   4          HG12      VAL   4  17.493   2.206   8.613
   27   3HG1  VAL   4          HG13      VAL   4  15.929   1.445   8.317
   28   1HG2  VAL   4          HG21      VAL   4  14.168   2.916   7.219
   29   2HG2  VAL   4          HG22      VAL   4  14.694   4.100   6.022
   30   3HG2  VAL   4          HG23      VAL   4  14.716   4.511   7.737
   31    HA   PRO   5           HA       PRO   5  17.813   6.936   3.855
   32   1HB   PRO   5          HB2       PRO   5  18.829   5.268   1.799
   33   2HB   PRO   5          HB1       PRO   5  19.758   6.386   2.805
   34   1HG   PRO   5          HG2       PRO   5  19.613   3.446   2.946
   35   2HG   PRO   5          HG1       PRO   5  20.842   4.534   3.593
   36   1HD   PRO   5          HD2       PRO   5  18.887   3.172   5.116
   37   2HD   PRO   5          HD1       PRO   5  19.867   4.553   5.675
   38    HA   PRO   6           HA       PRO   6  14.008   6.005   1.779
   39   1HB   PRO   6          HB2       PRO   6  14.649   6.940  -0.838
   40   2HB   PRO   6          HB1       PRO   6  13.891   7.859   0.467
   41   1HG   PRO   6          HG2       PRO   6  16.647   8.010  -0.542
   42   2HG   PRO   6          HG1       PRO   6  15.771   9.152   0.486
   43   1HD   PRO   6          HD2       PRO   6  17.844   7.417   1.329
   44   2HD   PRO   6          HD1       PRO   6  16.721   8.301   2.393
   45    H    SER   7           HN       SER   7  16.730   5.203  -0.420
   46    HA   SER   7           HA       SER   7  15.318   3.260  -1.940
   47   1HB   SER   7          HB2       SER   7  17.493   2.470  -2.673
   48   2HB   SER   7          HB1       SER   7  17.552   4.226  -2.545
   49    HG   SER   7           HG       SER   7  18.162   3.041  -0.189
   50    H    THR   8           HN       THR   8  17.175   2.935   1.074
   51    HA   THR   8           HA       THR   8  16.911   0.059   1.198
   52    HB   THR   8           HB       THR   8  17.326   2.059   3.441
   53    HG1  THR   8           HG1      THR   8  18.857   1.495   1.457
   54   1HG2  THR   8          HG21      THR   8  17.732  -0.942   3.305
   55   2HG2  THR   8          HG22      THR   8  16.568  -0.084   4.315
   56   3HG2  THR   8          HG23      THR   8  18.296   0.084   4.623
   57    H    ALA   9           HN       ALA   9  14.991   2.763   2.465
   58    HA   ALA   9           HA       ALA   9  13.139   1.218   3.985
   59   1HB   ALA   9          HB1       ALA   9  12.610   3.779   2.441
   60   2HB   ALA   9          HB2       ALA   9  13.284   3.706   4.069
   61   3HB   ALA   9          HB3       ALA   9  11.638   3.148   3.771
   62    H    LEU  10           HN       LEU  10  13.197   2.142   0.552
   63    HA   LEU  10           HA       LEU  10  10.656   1.008  -0.123
   64   1HB   LEU  10          HB2       LEU  10  12.308   2.579  -1.476
   65   2HB   LEU  10          HB1       LEU  10  12.958   1.060  -2.070
   66    HG   LEU  10           HG       LEU  10  11.308   1.731  -3.658
   67   1HD1  LEU  10          HD11      LEU  10   9.798  -0.087  -3.665
   68   2HD1  LEU  10          HD12      LEU  10   9.818  -0.220  -1.911
   69   3HD1  LEU  10          HD13      LEU  10  11.244  -0.674  -2.847
   70   1HD2  LEU  10          HD21      LEU  10  10.167   3.297  -1.879
   71   2HD2  LEU  10          HD22      LEU  10   9.126   1.905  -1.591
   72   3HD2  LEU  10          HD23      LEU  10   9.207   2.628  -3.194
   73    H    ARG  11           HN       ARG  11  13.973  -0.312  -0.311
   74    HA   ARG  11           HA       ARG  11  13.292  -2.875  -1.341
   75   1HB   ARG  11          HB2       ARG  11  15.544  -1.973   0.475
   76   2HB   ARG  11          HB1       ARG  11  15.451  -3.589  -0.225
   77   1HG   ARG  11          HG2       ARG  11  15.420  -2.619  -2.488
   78   2HG   ARG  11          HG1       ARG  11  15.502  -0.997  -1.799
   79   1HD   ARG  11          HD2       ARG  11  17.654  -1.697  -0.661
   80   2HD   ARG  11          HD1       ARG  11  17.601  -3.172  -1.632
   81    HE   ARG  11           HE       ARG  11  17.364  -1.188  -3.521
   82   1HH1  ARG  11          HH21      ARG  11  19.490  -1.855  -0.892
   83   2HH1  ARG  11          HH22      ARG  11  20.860  -1.094  -1.630
   84   1HH2  ARG  11          HH11      ARG  11  19.142  -0.198  -4.509
   85   2HH2  ARG  11          HH12      ARG  11  20.665  -0.163  -3.686
   86    H    GLU  12           HN       GLU  12  13.594  -1.737   2.013
   87    HA   GLU  12           HA       GLU  12  13.054  -4.225   3.286
   88   1HB   GLU  12          HB2       GLU  12  12.617  -1.361   4.164
   89   2HB   GLU  12          HB1       GLU  12  12.361  -2.747   5.229
   90   1HG   GLU  12          HG2       GLU  12  14.682  -3.448   4.929
   91   2HG   GLU  12          HG1       GLU  12  14.958  -2.134   3.788
   92    H    LEU  13           HN       LEU  13  10.883  -1.681   2.108
   93    HA   LEU  13           HA       LEU  13   8.508  -2.812   3.272
   94   1HB   LEU  13          HB2       LEU  13   8.649  -0.459   2.558
   95   2HB   LEU  13          HB1       LEU  13   8.833  -0.971   0.882
   96    HG   LEU  13           HG       LEU  13   6.598  -2.030   0.963
   97   1HD1  LEU  13          HD11      LEU  13   5.189  -1.233   3.045
   98   2HD1  LEU  13          HD12      LEU  13   6.762  -1.135   3.835
   99   3HD1  LEU  13          HD13      LEU  13   6.197  -2.672   3.179
  100   1HD2  LEU  13          HD21      LEU  13   5.292   0.079   1.116
  101   2HD2  LEU  13          HD22      LEU  13   6.794   0.298   0.219
  102   3HD2  LEU  13          HD23      LEU  13   6.673   0.858   1.887
  103    H    ILE  14           HN       ILE  14  10.000  -3.144   0.028
  104    HA   ILE  14           HA       ILE  14   7.884  -4.737  -1.071
  105    HB   ILE  14           HB       ILE  14  10.839  -4.653  -1.759
  106   1HG1  ILE  14          HG12      ILE  14   8.440  -3.450  -3.176
  107   2HG1  ILE  14          HG11      ILE  14   9.468  -2.552  -2.060
  108   1HG2  ILE  14          HG21      ILE  14   9.991  -6.751  -2.570
  109   2HG2  ILE  14          HG22      ILE  14  10.004  -5.656  -3.950
  110   3HG2  ILE  14          HG23      ILE  14   8.491  -6.004  -3.116
  111   1HD1  ILE  14          HD11      ILE  14  11.414  -2.920  -3.475
  112   2HD1  ILE  14          HD12      ILE  14  10.119  -2.244  -4.463
  113   3HD1  ILE  14          HD13      ILE  14  10.481  -3.966  -4.544
  114    H    GLU  15           HN       GLU  15  10.896  -5.636   0.611
  115    HA   GLU  15           HA       GLU  15  10.636  -8.451   0.359
  116   1HB   GLU  15          HB2       GLU  15  11.903  -6.747   2.518
  117   2HB   GLU  15          HB1       GLU  15  12.053  -8.503   2.455
  118   1HG   GLU  15          HG2       GLU  15  13.048  -8.351   0.207
  119   2HG   GLU  15          HG1       GLU  15  12.899  -6.593   0.255
  120    H    GLU  16           HN       GLU  16   9.388  -6.259   2.886
  121    HA   GLU  16           HA       GLU  16   8.279  -8.383   4.488
  122   1HB   GLU  16          HB2       GLU  16   8.776  -6.065   5.310
  123   2HB   GLU  16          HB1       GLU  16   7.415  -5.486   4.356
  124   1HG   GLU  16          HG2       GLU  16   6.674  -5.829   6.648
  125   2HG   GLU  16          HG1       GLU  16   5.919  -7.043   5.617
  126    H    LEU  17           HN       LEU  17   6.868  -6.233   2.007
  127    HA   LEU  17           HA       LEU  17   4.185  -7.184   2.267
  128   1HB   LEU  17          HB2       LEU  17   5.678  -6.034  -0.104
  129   2HB   LEU  17          HB1       LEU  17   3.950  -6.372  -0.123
  130    HG   LEU  17           HG       LEU  17   5.292  -4.575   1.920
  131   1HD1  LEU  17          HD11      LEU  17   4.390  -2.700   0.589
  132   2HD1  LEU  17          HD12      LEU  17   3.805  -3.841  -0.621
  133   3HD1  LEU  17          HD13      LEU  17   5.538  -3.654  -0.351
  134   1HD2  LEU  17          HD21      LEU  17   2.773  -3.744   1.952
  135   2HD2  LEU  17          HD22      LEU  17   3.233  -5.175   2.866
  136   3HD2  LEU  17          HD23      LEU  17   2.441  -5.349   1.300
  137    H    VAL  18           HN       VAL  18   6.889  -8.280   0.249
  138    HA   VAL  18           HA       VAL  18   5.421 -10.304  -1.162
  139    HB   VAL  18           HB       VAL  18   8.373  -9.984  -0.538
  140   1HG1  VAL  18          HG11      VAL  18   7.999 -12.339  -0.985
  141   2HG1  VAL  18          HG12      VAL  18   8.687 -11.614  -2.435
  142   3HG1  VAL  18          HG13      VAL  18   6.961 -11.953  -2.357
  143   1HG2  VAL  18          HG21      VAL  18   8.531  -9.099  -2.762
  144   2HG2  VAL  18          HG22      VAL  18   7.165  -8.283  -2.001
  145   3HG2  VAL  18          HG23      VAL  18   6.882  -9.596  -3.144
  146    H    ASN  19           HN       ASN  19   7.317 -10.340   1.829
  147    HA   ASN  19           HA       ASN  19   7.318 -13.134   2.291
  148   1HB   ASN  19          HB2       ASN  19   7.328 -10.777   4.189
  149   2HB   ASN  19          HB1       ASN  19   7.559 -12.441   4.723
  150   1HD2  ASN  19          HD21      ASN  19   8.885 -12.489   1.719
  151   2HD2  ASN  19          HD22      ASN  19  10.486 -12.074   2.092
  152    H    ILE  20           HN       ILE  20   4.889 -10.693   3.246
  153    HA   ILE  20           HA       ILE  20   3.289 -12.693   4.638
  154    HB   ILE  20           HB       ILE  20   1.692 -10.847   4.978
  155   1HG1  ILE  20          HG12      ILE  20   3.641  -9.180   3.360
  156   2HG1  ILE  20          HG11      ILE  20   2.110  -9.773   2.725
  157   1HG2  ILE  20          HG21      ILE  20   3.202  -9.429   6.291
  158   2HG2  ILE  20          HG22      ILE  20   4.587 -10.037   5.385
  159   3HG2  ILE  20          HG23      ILE  20   3.682 -11.120   6.443
  160   1HD1  ILE  20          HD11      ILE  20   1.961  -7.439   3.606
  161   2HD1  ILE  20          HD12      ILE  20   2.374  -8.056   5.205
  162   3HD1  ILE  20          HD13      ILE  20   0.872  -8.557   4.427
  163    H    THR  21           HN       THR  21   3.404 -11.655   1.307
  164    HA   THR  21           HA       THR  21   0.627 -12.668   0.859
  165    HB   THR  21           HB       THR  21   0.893 -11.755  -1.433
  166    HG1  THR  21           HG1      THR  21   2.754 -10.554  -1.864
  167   1HG2  THR  21          HG21      THR  21   1.743  -9.581   0.452
  168   2HG2  THR  21          HG22      THR  21   0.191 -10.382   0.700
  169   3HG2  THR  21          HG23      THR  21   0.522  -9.540  -0.814
  170    H    GLN  22           HN       GLN  22   3.937 -13.675   0.350
  171    HA   GLN  22           HA       GLN  22   3.307 -15.509  -1.812
  172   1HB   GLN  22          HB2       GLN  22   5.668 -15.288   0.058
  173   2HB   GLN  22          HB1       GLN  22   5.552 -16.542  -1.177
  174   1HG   GLN  22          HG2       GLN  22   5.310 -14.808  -2.917
  175   2HG   GLN  22          HG1       GLN  22   5.432 -13.558  -1.681
  176   1HE2  GLN  22          HE21      GLN  22   7.447 -15.697  -0.383
  177   2HE2  GLN  22          HE22      GLN  22   8.904 -15.309  -1.162
  178    H    ASN  23           HN       ASN  23   3.526 -15.843   1.710
  179    HA   ASN  23           HA       ASN  23   2.907 -18.736   1.499
  180   1HB   ASN  23          HB2       ASN  23   3.377 -18.813   3.871
  181   2HB   ASN  23          HB1       ASN  23   4.644 -17.868   3.087
  182   1HD2  ASN  23          HD21      ASN  23   2.153 -15.800   2.857
  183   2HD2  ASN  23          HD22      ASN  23   2.285 -14.973   4.334
  184    H    GLN  24           HN       GLN  24   0.986 -16.048   1.385
  185    HA   GLN  24           HA       GLN  24  -0.995 -16.906   3.382
  186   1HB   GLN  24          HB2       GLN  24  -2.211 -14.970   2.835
  187   2HB   GLN  24          HB1       GLN  24  -0.538 -14.474   2.600
  188   1HG   GLN  24          HG2       GLN  24  -0.811 -15.020   0.143
  189   2HG   GLN  24          HG1       GLN  24  -2.530 -15.264   0.451
  190   1HE2  GLN  24          HE21      GLN  24  -2.643 -13.327  -1.155
  191   2HE2  GLN  24          HE22      GLN  24  -2.571 -11.773  -0.475
  192    H    LYS  25           HN       LYS  25  -2.670 -18.286   3.021
  193    HA   LYS  25           HA       LYS  25  -2.985 -19.452   0.322
  194   1HB   LYS  25          HB2       LYS  25  -3.017 -20.881   2.386
  195   2HB   LYS  25          HB1       LYS  25  -4.493 -20.057   2.889
  196   1HG   LYS  25          HG2       LYS  25  -5.626 -20.812   0.835
  197   2HG   LYS  25          HG1       LYS  25  -4.152 -21.630   0.316
  198   1HD   LYS  25          HD2       LYS  25  -4.236 -23.054   2.336
  199   2HD   LYS  25          HD1       LYS  25  -5.721 -22.245   2.840
  200   1HE   LYS  25          HE2       LYS  25  -6.847 -23.014   0.789
  201   2HE   LYS  25          HE1       LYS  25  -5.359 -23.801   0.262
  202   1HZ   LYS  25          HZ1       LYS  25  -6.651 -25.461   1.279
  203   2HZ   LYS  25          HZ2       LYS  25  -7.041 -24.472   2.605
  204   3HZ   LYS  25          HZ3       LYS  25  -5.459 -25.062   2.417
  205    H    ALA  26           HN       ALA  26  -5.538 -18.594   2.649
  206    HA   ALA  26           HA       ALA  26  -7.159 -17.482   0.464
  207   1HB   ALA  26          HB1       ALA  26  -7.635 -18.522   3.128
  208   2HB   ALA  26          HB2       ALA  26  -8.818 -18.191   1.866
  209   3HB   ALA  26          HB3       ALA  26  -8.366 -16.922   3.004
  210    HA   PRO  27           HA       PRO  27  -6.096 -13.210   0.800
  211   1HB   PRO  27          HB2       PRO  27  -8.729 -12.384   1.845
  212   2HB   PRO  27          HB1       PRO  27  -7.969 -11.993   0.298
  213   1HG   PRO  27          HG2       PRO  27 -10.101 -13.816   0.712
  214   2HG   PRO  27          HG1       PRO  27  -9.176 -13.601  -0.779
  215   1HD   PRO  27          HD2       PRO  27  -9.142 -15.883   1.016
  216   2HD   PRO  27          HD1       PRO  27  -8.226 -15.667  -0.497
  217    H    LEU  28           HN       LEU  28  -5.358 -11.706   2.417
  218    HA   LEU  28           HA       LEU  28  -4.957 -12.763   5.038
  219   1HB   LEU  28          HB2       LEU  28  -4.793  -9.899   4.055
  220   2HB   LEU  28          HB1       LEU  28  -4.148 -10.472   5.591
  221    HG   LEU  28           HG       LEU  28  -3.330 -11.565   2.885
  222   1HD1  LEU  28          HD11      LEU  28  -2.657  -9.212   3.131
  223   2HD1  LEU  28          HD12      LEU  28  -1.250 -10.270   3.218
  224   3HD1  LEU  28          HD13      LEU  28  -1.923  -9.576   4.693
  225   1HD2  LEU  28          HD21      LEU  28  -2.783 -13.250   4.412
  226   2HD2  LEU  28          HD22      LEU  28  -2.516 -12.116   5.736
  227   3HD2  LEU  28          HD23      LEU  28  -1.315 -12.280   4.456
  228    H    CYS  29           HN       CYS  29  -7.124 -10.168   3.911
  229    HA   CYS  29           HA       CYS  29  -8.467 -10.063   6.525
  230   1HB   CYS  29          HB2       CYS  29  -8.992  -8.681   3.882
  231   2HB   CYS  29          HB1       CYS  29  -9.942  -8.399   5.341
  232    H    ASN  30           HN       ASN  30 -10.918 -10.324   6.559
  233    HA   ASN  30           HA       ASN  30 -11.625 -12.908   5.487
  234   1HB   ASN  30          HB2       ASN  30 -13.292 -10.725   6.769
  235   2HB   ASN  30          HB1       ASN  30 -13.932 -12.306   6.325
  236   1HD2  ASN  30          HD21      ASN  30 -11.080 -13.417   7.077
  237   2HD2  ASN  30          HD22      ASN  30 -11.166 -13.551   8.765
  238    H    GLY  31           HN       GLY  31 -10.830 -11.658   3.265
  239   1HA   GLY  31          HA2       GLY  31 -11.553 -11.311   1.054
  240   2HA   GLY  31          HA1       GLY  31 -13.193 -11.673   1.591
  241    H    SER  32           HN       SER  32 -11.257  -9.148   3.092
  242    HA   SER  32           HA       SER  32 -13.310  -7.185   2.772
  243   1HB   SER  32          HB2       SER  32 -10.364  -6.878   3.388
  244   2HB   SER  32          HB1       SER  32 -11.515  -5.550   3.439
  245    HG   SER  32           HG       SER  32 -11.870  -6.233   5.394
  246    H    MET  33           HN       MET  33 -13.581  -5.544   1.288
  247    HA   MET  33           HA       MET  33 -11.932  -5.694  -1.213
  248   1HB   MET  33          HB2       MET  33 -14.728  -4.596  -0.757
  249   2HB   MET  33          HB1       MET  33 -13.895  -4.680  -2.307
  250   1HG   MET  33          HG2       MET  33 -14.437  -7.112  -0.595
  251   2HG   MET  33          HG1       MET  33 -15.526  -6.576  -1.872
  252   1HE   MET  33          HE1       MET  33 -14.087  -7.170  -5.067
  253   2HE   MET  33          HE2       MET  33 -13.270  -5.735  -4.459
  254   3HE   MET  33          HE3       MET  33 -14.952  -6.024  -4.035
  255    H    VAL  34           HN       VAL  34 -11.130  -3.706  -2.087
  256    HA   VAL  34           HA       VAL  34 -11.404  -1.282  -0.332
  257    HB   VAL  34           HB       VAL  34  -9.021  -0.777  -0.805
  258   1HG1  VAL  34          HG11      VAL  34  -9.643  -1.943   1.267
  259   2HG1  VAL  34          HG12      VAL  34  -8.075  -2.498   0.685
  260   3HG1  VAL  34          HG13      VAL  34  -9.509  -3.496   0.443
  261   1HG2  VAL  34          HG21      VAL  34  -7.635  -2.704  -1.676
  262   2HG2  VAL  34          HG22      VAL  34  -8.702  -1.971  -2.874
  263   3HG2  VAL  34          HG23      VAL  34  -9.142  -3.504  -2.120
  264    H    TRP  35           HN       TRP  35 -10.964   0.740  -1.453
  265    HA   TRP  35           HA       TRP  35 -12.195   0.789  -4.080
  266   1HB   TRP  35          HB2       TRP  35 -10.876   2.929  -2.394
  267   2HB   TRP  35          HB1       TRP  35 -11.675   3.252  -3.932
  268    HD1  TRP  35           HD1      TRP  35 -12.369   2.363  -0.314
  269    HE1  TRP  35           HE1      TRP  35 -14.895   2.566   0.136
  270    HE3  TRP  35           HE3      TRP  35 -14.054   3.037  -5.085
  271    HZ2  TRP  35           HZ2      TRP  35 -17.320   2.958  -1.340
  272    HZ3  TRP  35           HZ3      TRP  35 -16.474   3.318  -5.534
  273    HH2  TRP  35           HH2      TRP  35 -18.106   3.283  -3.671
  274    H    SER  36           HN       SER  36 -11.177   0.759  -6.034
  275    HA   SER  36           HA       SER  36  -8.313   0.358  -6.203
  276   1HB   SER  36          HB2       SER  36  -8.659   0.249  -8.585
  277   2HB   SER  36          HB1       SER  36 -10.045  -0.534  -7.833
  278    HG   SER  36           HG       SER  36 -10.181   2.215  -8.275
  279    H    ILE  37           HN       ILE  37  -6.773   1.845  -7.180
  280    HA   ILE  37           HA       ILE  37  -7.679   4.688  -7.393
  281    HB   ILE  37           HB       ILE  37  -5.566   5.360  -6.193
  282   1HG1  ILE  37          HG12      ILE  37  -5.520   2.535  -5.110
  283   2HG1  ILE  37          HG11      ILE  37  -4.582   2.961  -6.539
  284   1HG2  ILE  37          HG21      ILE  37  -7.655   3.736  -4.717
  285   2HG2  ILE  37          HG22      ILE  37  -7.665   5.475  -5.009
  286   3HG2  ILE  37          HG23      ILE  37  -6.476   4.772  -3.914
  287   1HD1  ILE  37          HD11      ILE  37  -4.394   4.408  -3.881
  288   2HD1  ILE  37          HD12      ILE  37  -3.392   4.691  -5.305
  289   3HD1  ILE  37          HD13      ILE  37  -3.267   3.166  -4.428
  290    H    ASN  38           HN       ASN  38  -6.007   6.039  -8.501
  291    HA   ASN  38           HA       ASN  38  -4.856   4.524 -10.762
  292   1HB   ASN  38          HB2       ASN  38  -6.080   6.696 -11.094
  293   2HB   ASN  38          HB1       ASN  38  -4.794   7.508 -10.200
  294   1HD2  ASN  38          HD21      ASN  38  -4.331   4.798 -12.494
  295   2HD2  ASN  38          HD22      ASN  38  -3.429   5.696 -13.618
  296    H    LEU  39           HN       LEU  39  -2.808   3.734 -10.554
  297    HA   LEU  39           HA       LEU  39  -1.070   4.661  -8.406
  298   1HB   LEU  39          HB2       LEU  39  -0.633   2.708 -10.684
  299   2HB   LEU  39          HB1       LEU  39   0.574   3.042  -9.447
  300    HG   LEU  39           HG       LEU  39  -0.693   1.012  -8.893
  301   1HD1  LEU  39          HD11      LEU  39  -1.756   3.020  -6.928
  302   2HD1  LEU  39          HD12      LEU  39  -0.011   2.874  -7.126
  303   3HD1  LEU  39          HD13      LEU  39  -0.960   1.474  -6.638
  304   1HD2  LEU  39          HD21      LEU  39  -3.023   0.910  -8.731
  305   2HD2  LEU  39          HD22      LEU  39  -2.809   1.985 -10.111
  306   3HD2  LEU  39          HD23      LEU  39  -3.193   2.652  -8.523
  307    H    THR  40           HN       THR  40   0.154   6.470  -8.578
  308    HA   THR  40           HA       THR  40   1.607   7.001 -11.100
  309    HB   THR  40           HB       THR  40   0.862   9.420 -11.022
  310    HG1  THR  40           HG1      THR  40  -1.470   8.944  -9.821
  311   1HG2  THR  40          HG21      THR  40  -1.121   9.022 -12.283
  312   2HG2  THR  40          HG22      THR  40  -1.454   7.520 -11.422
  313   3HG2  THR  40          HG23      THR  40  -0.102   7.608 -12.551
  314    H    ALA  41           HN       ALA  41   1.113   9.541  -8.783
  315    HA   ALA  41           HA       ALA  41   3.926   9.164  -7.809
  316   1HB   ALA  41          HB1       ALA  41   3.333  11.256  -9.104
  317   2HB   ALA  41          HB2       ALA  41   4.001  11.547  -7.498
  318   3HB   ALA  41          HB3       ALA  41   2.265  11.694  -7.772
  319    H    GLY  42           HN       GLY  42   1.012  10.827  -6.547
  320   1HA   GLY  42          HA2       GLY  42   1.753  10.394  -3.805
  321   2HA   GLY  42          HA1       GLY  42   0.162  10.912  -4.359
  322    H    MET  43           HN       MET  43   1.816   7.895  -5.241
  323    HA   MET  43           HA       MET  43  -0.500   6.291  -4.837
  324   1HB   MET  43          HB2       MET  43   2.416   5.479  -4.781
  325   2HB   MET  43          HB1       MET  43   1.058   4.374  -4.967
  326   1HG   MET  43          HG2       MET  43   0.378   5.726  -6.989
  327   2HG   MET  43          HG1       MET  43   1.914   6.571  -6.860
  328   1HE   MET  43          HE1       MET  43   3.838   3.861  -5.823
  329   2HE   MET  43          HE2       MET  43   4.014   5.484  -6.488
  330   3HE   MET  43          HE3       MET  43   4.602   4.096  -7.401
  331    H    TYR  44           HN       TYR  44   2.295   6.907  -2.704
  332    HA   TYR  44           HA       TYR  44   1.543   5.110  -0.629
  333   1HB   TYR  44          HB2       TYR  44   3.091   7.714  -0.554
  334   2HB   TYR  44          HB1       TYR  44   2.920   6.647   0.841
  335    HD1  TYR  44           HD1      TYR  44   3.939   4.412   0.854
  336    HD2  TYR  44           HD2      TYR  44   4.448   7.070  -2.477
  337    HE1  TYR  44           HE1      TYR  44   5.780   2.987   0.004
  338    HE2  TYR  44           HE2      TYR  44   6.290   5.645  -3.330
  339    HH   TYR  44           HH       TYR  44   6.840   2.914  -2.929
  340    H    CYS  45           HN       CYS  45   0.743   8.535  -1.136
  341    HA   CYS  45           HA       CYS  45  -0.815   8.825   1.270
  342   1HB   CYS  45          HB2       CYS  45  -1.237  10.379  -1.287
  343   2HB   CYS  45          HB1       CYS  45  -1.462  10.925   0.376
  344    H    ALA  46           HN       ALA  46  -1.819   8.435  -2.143
  345    HA   ALA  46           HA       ALA  46  -4.593   8.107  -1.621
  346   1HB   ALA  46          HB1       ALA  46  -3.772   8.554  -3.867
  347   2HB   ALA  46          HB2       ALA  46  -4.646   7.022  -3.876
  348   3HB   ALA  46          HB3       ALA  46  -2.882   7.032  -3.879
  349    H    ALA  47           HN       ALA  47  -2.018   5.661  -1.983
  350    HA   ALA  47           HA       ALA  47  -3.694   3.387  -1.688
  351   1HB   ALA  47          HB1       ALA  47  -0.791   3.754  -0.892
  352   2HB   ALA  47          HB2       ALA  47  -1.382   3.164  -2.446
  353   3HB   ALA  47          HB3       ALA  47  -1.613   2.198  -0.989
  354    H    LEU  48           HN       LEU  48  -2.108   5.435   0.729
  355    HA   LEU  48           HA       LEU  48  -2.616   3.812   2.992
  356   1HB   LEU  48          HB2       LEU  48  -1.129   5.760   3.067
  357   2HB   LEU  48          HB1       LEU  48  -2.495   6.835   2.790
  358    HG   LEU  48           HG       LEU  48  -3.507   6.108   4.929
  359   1HD1  LEU  48          HD11      LEU  48  -2.794   3.901   5.298
  360   2HD1  LEU  48          HD12      LEU  48  -1.836   4.804   6.466
  361   3HD1  LEU  48          HD13      LEU  48  -1.107   4.281   4.947
  362   1HD2  LEU  48          HD21      LEU  48  -1.860   8.018   4.782
  363   2HD2  LEU  48          HD22      LEU  48  -0.607   6.899   5.318
  364   3HD2  LEU  48          HD23      LEU  48  -1.967   7.274   6.376
  365    H    GLU  49           HN       GLU  49  -4.658   6.501   1.694
  366    HA   GLU  49           HA       GLU  49  -6.683   6.186   3.665
  367   1HB   GLU  49          HB2       GLU  49  -8.231   7.231   1.899
  368   2HB   GLU  49          HB1       GLU  49  -6.824   8.169   2.398
  369   1HG   GLU  49          HG2       GLU  49  -5.589   7.386   0.419
  370   2HG   GLU  49          HG1       GLU  49  -6.990   6.436  -0.084
  371    H    SER  50           HN       SER  50  -6.329   4.533   0.527
  372    HA   SER  50           HA       SER  50  -8.868   3.239   0.589
  373   1HB   SER  50          HB2       SER  50  -6.243   2.208  -0.528
  374   2HB   SER  50          HB1       SER  50  -7.833   1.550  -0.901
  375    HG   SER  50           HG       SER  50  -6.638   3.951  -1.677
  376    H    LEU  51           HN       LEU  51  -5.750   2.344   2.030
  377    HA   LEU  51           HA       LEU  51  -6.652  -0.204   3.034
  378   1HB   LEU  51          HB2       LEU  51  -4.336   1.592   3.786
  379   2HB   LEU  51          HB1       LEU  51  -4.589   0.001   4.501
  380    HG   LEU  51           HG       LEU  51  -4.387   0.473   1.508
  381   1HD1  LEU  51          HD11      LEU  51  -2.222  -0.582   3.346
  382   2HD1  LEU  51          HD12      LEU  51  -2.289   1.085   2.773
  383   3HD1  LEU  51          HD13      LEU  51  -2.089  -0.235   1.622
  384   1HD2  LEU  51          HD21      LEU  51  -5.409  -1.622   1.762
  385   2HD2  LEU  51          HD22      LEU  51  -4.583  -1.961   3.282
  386   3HD2  LEU  51          HD23      LEU  51  -3.709  -2.077   1.756
  387    H    ILE  52           HN       ILE  52  -6.748   3.083   4.325
  388    HA   ILE  52           HA       ILE  52  -7.302   2.439   7.045
  389    HB   ILE  52           HB       ILE  52  -8.248   4.767   5.340
  390   1HG1  ILE  52          HG12      ILE  52  -5.828   4.720   5.676
  391   2HG1  ILE  52          HG11      ILE  52  -6.529   6.025   6.614
  392   1HG2  ILE  52          HG21      ILE  52  -9.813   4.604   7.138
  393   2HG2  ILE  52          HG22      ILE  52  -8.679   5.885   7.562
  394   3HG2  ILE  52          HG23      ILE  52  -8.532   4.295   8.310
  395   1HD1  ILE  52          HD11      ILE  52  -5.269   3.480   7.543
  396   2HD1  ILE  52          HD12      ILE  52  -6.586   4.137   8.514
  397   3HD1  ILE  52          HD13      ILE  52  -5.145   5.104   8.214
  398    H    ASN  53           HN       ASN  53  -9.161   1.915   4.211
  399    HA   ASN  53           HA       ASN  53 -11.752   1.863   5.599
  400   1HB   ASN  53          HB2       ASN  53 -10.890   0.977   2.827
  401   2HB   ASN  53          HB1       ASN  53 -12.547   0.870   3.415
  402   1HD2  ASN  53          HD21      ASN  53 -13.316   3.128   4.435
  403   2HD2  ASN  53          HD22      ASN  53 -12.925   4.494   3.507
  404    H    VAL  54           HN       VAL  54  -9.095  -0.250   5.207
  405    HA   VAL  54           HA       VAL  54 -10.703  -2.713   5.560
  406    HB   VAL  54           HB       VAL  54  -7.690  -2.345   5.494
  407   1HG1  VAL  54          HG11      VAL  54  -9.502  -4.767   5.299
  408   2HG1  VAL  54          HG12      VAL  54  -8.303  -4.434   6.549
  409   3HG1  VAL  54          HG13      VAL  54  -7.784  -4.796   4.903
  410   1HG2  VAL  54          HG21      VAL  54  -8.573  -1.638   3.373
  411   2HG2  VAL  54          HG22      VAL  54  -9.722  -2.975   3.342
  412   3HG2  VAL  54          HG23      VAL  54  -7.998  -3.290   3.150
  413    H    SER  55           HN       SER  55 -11.219  -3.439   7.554
  414    HA   SER  55           HA       SER  55  -9.507  -2.636   9.889
  415   1HB   SER  55          HB2       SER  55 -12.528  -2.786   9.724
  416   2HB   SER  55          HB1       SER  55 -11.624  -2.584  11.222
  417    HG   SER  55           HG       SER  55 -10.941  -0.620  10.549
  418    H    GLY  56           HN       GLY  56  -9.337  -4.213  11.547
  419   1HA   GLY  56          HA2       GLY  56  -9.569  -6.366  12.526
  420   2HA   GLY  56          HA1       GLY  56 -10.700  -6.800  11.243
  421    H    CYS  57           HN       CYS  57  -7.518  -5.420  10.663
  422    HA   CYS  57           HA       CYS  57  -6.467  -8.078   9.811
  423   1HB   CYS  57          HB2       CYS  57  -6.547  -5.592   8.071
  424   2HB   CYS  57          HB1       CYS  57  -5.703  -7.087   7.666
  425    H    SER  58           HN       SER  58  -4.959  -7.981  11.510
  426    HA   SER  58           HA       SER  58  -3.348  -5.655  12.067
  427   1HB   SER  58          HB2       SER  58  -3.661  -7.309  13.799
  428   2HB   SER  58          HB1       SER  58  -2.997  -8.579  12.776
  429    HG   SER  58           HG       SER  58  -1.382  -6.372  13.086
  430    H    ALA  59           HN       ALA  59  -2.945  -8.479  10.004
  431    HA   ALA  59           HA       ALA  59  -0.210  -8.379   9.439
  432   1HB   ALA  59          HB1       ALA  59  -0.762  -9.426   7.287
  433   2HB   ALA  59          HB2       ALA  59  -2.446  -8.936   7.469
  434   3HB   ALA  59          HB3       ALA  59  -1.746 -10.114   8.579
  435    H    ILE  60           HN       ILE  60  -2.651  -6.055   8.479
  436    HA   ILE  60           HA       ILE  60  -0.693  -4.781   6.596
  437    HB   ILE  60           HB       ILE  60  -2.608  -3.541   5.689
  438   1HG1  ILE  60          HG12      ILE  60  -4.313  -5.222   7.537
  439   2HG1  ILE  60          HG11      ILE  60  -3.930  -3.532   7.851
  440   1HG2  ILE  60          HG21      ILE  60  -3.767  -5.471   4.673
  441   2HG2  ILE  60          HG22      ILE  60  -3.081  -6.529   5.906
  442   3HG2  ILE  60          HG23      ILE  60  -2.024  -5.734   4.739
  443   1HD1  ILE  60          HD11      ILE  60  -5.409  -4.633   5.448
  444   2HD1  ILE  60          HD12      ILE  60  -4.911  -2.950   5.624
  445   3HD1  ILE  60          HD13      ILE  60  -6.087  -3.643   6.741
  446    H    GLU  61           HN       GLU  61  -1.873  -4.452   9.768
  447    HA   GLU  61           HA       GLU  61  -2.032  -1.606   9.984
  448   1HB   GLU  61          HB2       GLU  61  -1.274  -3.774  11.952
  449   2HB   GLU  61          HB1       GLU  61  -1.257  -2.070  12.411
  450   1HG   GLU  61          HG2       GLU  61  -3.615  -1.846  11.815
  451   2HG   GLU  61          HG1       GLU  61  -3.655  -3.511  11.236
  452    H    LYS  62           HN       LYS  62   0.731  -3.847  10.183
  453    HA   LYS  62           HA       LYS  62   2.700  -1.833  10.756
  454   1HB   LYS  62          HB2       LYS  62   2.905  -4.517   9.358
  455   2HB   LYS  62          HB1       LYS  62   4.305  -3.518   9.748
  456   1HG   LYS  62          HG2       LYS  62   3.598  -3.553  12.147
  457   2HG   LYS  62          HG1       LYS  62   2.312  -4.680  11.715
  458   1HD   LYS  62          HD2       LYS  62   5.256  -5.178  11.177
  459   2HD   LYS  62          HD1       LYS  62   4.395  -5.806  12.580
  460   1HE   LYS  62          HE2       LYS  62   2.730  -6.794  10.828
  461   2HE   LYS  62          HE1       LYS  62   4.035  -6.518   9.674
  462   1HZ   LYS  62          HZ1       LYS  62   3.812  -8.497  11.742
  463   2HZ   LYS  62          HZ2       LYS  62   5.301  -7.681  11.756
  464   3HZ   LYS  62          HZ3       LYS  62   4.784  -8.485  10.352
  465    H    THR  63           HN       THR  63   1.358  -3.172   7.769
  466    HA   THR  63           HA       THR  63   3.059  -1.849   5.921
  467    HB   THR  63           HB       THR  63   0.134  -2.589   5.615
  468    HG1  THR  63           HG1      THR  63   2.346  -4.037   4.665
  469   1HG2  THR  63          HG21      THR  63   2.302  -1.926   3.611
  470   2HG2  THR  63          HG22      THR  63   0.773  -1.080   3.850
  471   3HG2  THR  63          HG23      THR  63   0.784  -2.712   3.179
  472    H    GLN  64           HN       GLN  64   0.022  -0.782   7.443
  473    HA   GLN  64           HA       GLN  64  -0.276   1.644   5.991
  474   1HB   GLN  64          HB2       GLN  64  -1.077   0.898   8.812
  475   2HB   GLN  64          HB1       GLN  64  -1.550   2.412   8.040
  476   1HG   GLN  64          HG2       GLN  64  -2.647   1.155   6.226
  477   2HG   GLN  64          HG1       GLN  64  -2.163  -0.364   6.982
  478   1HE2  GLN  64          HE21      GLN  64  -4.948   0.614   6.540
  479   2HE2  GLN  64          HE22      GLN  64  -5.659   0.698   8.079
  480    H    ARG  65           HN       ARG  65   1.503   0.980   9.025
  481    HA   ARG  65           HA       ARG  65   2.269   3.690   9.496
  482   1HB   ARG  65          HB2       ARG  65   3.596   1.080  10.258
  483   2HB   ARG  65          HB1       ARG  65   4.162   2.654  10.818
  484   1HG   ARG  65          HG2       ARG  65   1.859   3.083  11.728
  485   2HG   ARG  65          HG1       ARG  65   1.439   1.421  11.311
  486   1HD   ARG  65          HD2       ARG  65   3.270   0.597  12.752
  487   2HD   ARG  65          HD1       ARG  65   3.681   2.259  13.173
  488    HE   ARG  65           HE       ARG  65   0.990   2.033  13.832
  489   1HH1  ARG  65          HH21      ARG  65   3.910   0.346  14.547
  490   2HH1  ARG  65          HH22      ARG  65   3.395  -0.148  16.125
  491   1HH2  ARG  65          HH11      ARG  65   0.298   1.402  15.887
  492   2HH2  ARG  65          HH12      ARG  65   1.347   0.452  16.885
  493    H    MET  66           HN       MET  66   3.968   1.066   7.761
  494    HA   MET  66           HA       MET  66   6.261   2.631   7.104
  495   1HB   MET  66          HB2       MET  66   5.022   0.224   5.746
  496   2HB   MET  66          HB1       MET  66   6.557   0.933   5.241
  497   1HG   MET  66          HG2       MET  66   7.381   0.653   7.609
  498   2HG   MET  66          HG1       MET  66   5.901  -0.237   7.962
  499   1HE   MET  66          HE1       MET  66   6.090  -3.480   6.161
  500   2HE   MET  66          HE2       MET  66   5.316  -2.080   5.428
  501   3HE   MET  66          HE3       MET  66   5.210  -2.322   7.168
  502    H    LEU  67           HN       LEU  67   3.159   2.190   5.400
  503    HA   LEU  67           HA       LEU  67   3.899   3.646   3.050
  504   1HB   LEU  67          HB2       LEU  67   1.210   3.287   4.401
  505   2HB   LEU  67          HB1       LEU  67   1.409   4.061   2.833
  506    HG   LEU  67           HG       LEU  67   2.372   1.253   3.444
  507   1HD1  LEU  67          HD11      LEU  67  -0.216   2.222   2.198
  508   2HD1  LEU  67          HD12      LEU  67  -0.041   1.279   3.678
  509   3HD1  LEU  67          HD13      LEU  67   0.350   0.554   2.118
  510   1HD2  LEU  67          HD21      LEU  67   2.139   2.936   0.943
  511   2HD2  LEU  67          HD22      LEU  67   2.137   1.178   0.845
  512   3HD2  LEU  67          HD23      LEU  67   3.528   2.016   1.519
  513    H    SER  68           HN       SER  68   2.564   4.677   6.170
  514    HA   SER  68           HA       SER  68   2.158   7.419   5.513
  515   1HB   SER  68          HB2       SER  68   2.872   6.080   8.136
  516   2HB   SER  68          HB1       SER  68   2.473   7.790   8.002
  517    HG   SER  68           HG       SER  68   0.520   6.904   6.840
  518    H    GLY  69           HN       GLY  69   5.017   5.664   6.655
  519   1HA   GLY  69          HA2       GLY  69   6.769   7.781   7.166
  520   2HA   GLY  69          HA1       GLY  69   7.289   6.240   6.483
  521    H    PHE  70           HN       PHE  70   5.531   6.647   4.086
  522    HA   PHE  70           HA       PHE  70   7.433   8.372   2.587
  523   1HB   PHE  70          HB2       PHE  70   5.323   6.369   1.760
  524   2HB   PHE  70          HB1       PHE  70   6.099   7.439   0.593
  525    HD1  PHE  70           HD1      PHE  70   8.480   7.250   0.090
  526    HD2  PHE  70           HD2      PHE  70   6.574   4.588   2.869
  527    HE1  PHE  70           HE1      PHE  70  10.433   5.735  -0.031
  528    HE2  PHE  70           HE2      PHE  70   8.532   3.068   2.753
  529    HZ   PHE  70           HZ       PHE  70  10.463   3.640   1.302
  530    H    CYS  71           HN       CYS  71   4.270   8.509   3.927
  531    HA   CYS  71           HA       CYS  71   3.819  11.108   2.540
  532   1HB   CYS  71          HB2       CYS  71   2.499   9.199   1.450
  533   2HB   CYS  71          HB1       CYS  71   1.555   9.158   2.941
  534    HA   PRO  72           HA       PRO  72   3.278  11.665   7.130
  535   1HB   PRO  72          HB2       PRO  72   3.142  14.517   6.325
  536   2HB   PRO  72          HB1       PRO  72   4.233  13.729   7.472
  537   1HG   PRO  72          HG2       PRO  72   5.019  14.647   5.004
  538   2HG   PRO  72          HG1       PRO  72   5.836  13.339   5.870
  539   1HD   PRO  72          HD2       PRO  72   4.087  13.189   3.474
  540   2HD   PRO  72          HD1       PRO  72   5.322  12.034   4.044
  541    H    HIS  73           HN       HIS  73   1.064  11.057   5.296
  542    HA   HIS  73           HA       HIS  73  -0.949  13.146   5.768
  543   1HB   HIS  73          HB2       HIS  73  -0.492  11.240   3.774
  544   2HB   HIS  73          HB1       HIS  73  -1.900  10.604   4.604
  545    HD1  HIS  73           HD1      HIS  73  -4.097  11.898   4.370
  546    HD2  HIS  73           HD2      HIS  73  -0.853  13.815   2.592
  547    HE1  HIS  73           HE1      HIS  73  -5.063  13.809   3.030
  548    H    LYS  74           HN       LYS  74  -1.836  13.181   7.774
  549    HA   LYS  74           HA       LYS  74  -2.249  10.709   9.314
  550   1HB   LYS  74          HB2       LYS  74  -3.072  13.600   9.788
  551   2HB   LYS  74          HB1       LYS  74  -3.406  12.287  10.916
  552   1HG   LYS  74          HG2       LYS  74  -0.994  11.833  11.116
  553   2HG   LYS  74          HG1       LYS  74  -0.648  13.145   9.987
  554   1HD   LYS  74          HD2       LYS  74  -1.721  14.752  11.529
  555   2HD   LYS  74          HD1       LYS  74  -2.057  13.441  12.658
  556   1HE   LYS  74          HE2       LYS  74   0.228  13.123  13.158
  557   2HE   LYS  74          HE1       LYS  74   0.756  13.996  11.718
  558   1HZ   LYS  74          HZ1       LYS  74  -0.664  15.877  12.948
  559   2HZ   LYS  74          HZ2       LYS  74   1.006  15.665  13.181
  560   3HZ   LYS  74          HZ3       LYS  74  -0.099  15.018  14.297
  561    H    VAL  75           HN       VAL  75  -3.706   9.507   8.013
  562    HA   VAL  75           HA       VAL  75  -6.198  10.832   7.099
  563    HB   VAL  75           HB       VAL  75  -5.266   7.979   6.701
  564   1HG1  VAL  75          HG11      VAL  75  -7.615   8.108   6.330
  565   2HG1  VAL  75          HG12      VAL  75  -6.886   8.224   4.731
  566   3HG1  VAL  75          HG13      VAL  75  -7.480   9.674   5.530
  567   1HG2  VAL  75          HG21      VAL  75  -3.701   9.661   5.743
  568   2HG2  VAL  75          HG22      VAL  75  -5.043  10.377   4.853
  569   3HG2  VAL  75          HG23      VAL  75  -4.522   8.732   4.490
  570    H    SER  76           HN       SER  76  -8.083  10.635   8.150
  571    HA   SER  76           HA       SER  76  -8.297   8.686  10.411
  572   1HB   SER  76          HB2       SER  76  -8.736  10.890  11.200
  573   2HB   SER  76          HB1       SER  76  -9.686  11.298   9.775
  574    HG   SER  76           HG       SER  76 -10.417   9.193  11.513
  575    H    ALA  77           HN       ALA  77 -10.178   7.329  10.494
  576    HA   ALA  77           HA       ALA  77 -11.097   6.299   8.029
  577   1HB   ALA  77          HB1       ALA  77 -12.765   5.091   9.328
  578   2HB   ALA  77          HB2       ALA  77 -12.572   6.213  10.675
  579   3HB   ALA  77          HB3       ALA  77 -11.254   5.126  10.237
  580    H    GLY  78           HN       GLY  78 -11.847   9.252   9.442
  581   1HA   GLY  78          HA2       GLY  78 -14.531   9.405   8.125
  582   2HA   GLY  78          HA1       GLY  78 -13.928  10.528   9.343
  583    H    GLN  79           HN       GLN  79 -11.245  10.585   7.938
  584    HA   GLN  79           HA       GLN  79 -11.999  12.674   5.965
  585   1HB   GLN  79          HB2       GLN  79  -9.335  11.901   7.192
  586   2HB   GLN  79          HB1       GLN  79  -9.560  13.218   6.040
  587   1HG   GLN  79          HG2       GLN  79 -11.053  13.015   8.670
  588   2HG   GLN  79          HG1       GLN  79  -9.574  13.952   8.454
  589   1HE2  GLN  79          HE21      GLN  79 -12.953  14.173   8.298
  590   2HE2  GLN  79          HE22      GLN  79 -13.066  15.584   7.361
  591    H    PHE  80           HN       PHE  80 -11.993  12.226   3.824
  592    HA   PHE  80           HA       PHE  80 -10.210  10.046   2.785
  593   1HB   PHE  80          HB2       PHE  80 -13.098  10.603   2.044
  594   2HB   PHE  80          HB1       PHE  80 -12.030   9.529   1.142
  595    HD1  PHE  80           HD1      PHE  80 -14.045   9.940   4.148
  596    HD2  PHE  80           HD2      PHE  80 -11.102   7.477   2.216
  597    HE1  PHE  80           HE1      PHE  80 -14.526   8.108   5.750
  598    HE2  PHE  80           HE2      PHE  80 -11.581   5.648   3.816
  599    HZ   PHE  80           HZ       PHE  80 -13.294   5.960   5.583
  600    H    SER  81           HN       SER  81  -9.317  10.484   0.703
  601    HA   SER  81           HA       SER  81  -9.769  13.284  -0.302
  602   1HB   SER  81          HB2       SER  81  -7.231  11.676  -0.032
  603   2HB   SER  81          HB1       SER  81  -7.339  13.098  -1.066
  604    HG   SER  81           HG       SER  81  -7.122  14.239   0.670
  605    H    SER  82           HN       SER  82  -8.608  10.048  -1.375
  606    HA   SER  82           HA       SER  82  -9.169  10.838  -4.172
  607   1HB   SER  82          HB2       SER  82  -7.063   9.653  -3.550
  608   2HB   SER  82          HB1       SER  82  -8.027   8.242  -3.123
  609    HG   SER  82           HG       SER  82  -7.698   9.485  -5.644
  610    H    LEU  83           HN       LEU  83 -11.090   9.520  -1.787
  611    HA   LEU  83           HA       LEU  83 -12.376   7.494  -3.509
  612   1HB   LEU  83          HB2       LEU  83 -12.903   8.515  -0.719
  613   2HB   LEU  83          HB1       LEU  83 -14.055   7.470  -1.536
  614    HG   LEU  83           HG       LEU  83 -12.150   5.840  -1.927
  615   1HD1  LEU  83          HD11      LEU  83 -10.210   7.189  -1.639
  616   2HD1  LEU  83          HD12      LEU  83 -10.256   6.141  -0.222
  617   3HD1  LEU  83          HD13      LEU  83 -10.778   7.819  -0.093
  618   1HD2  LEU  83          HD21      LEU  83 -13.735   5.332  -0.212
  619   2HD2  LEU  83          HD22      LEU  83 -13.076   6.565   0.862
  620   3HD2  LEU  83          HD23      LEU  83 -12.147   5.106   0.520
  621    H    HIS  84           HN       HIS  84 -12.346  10.569  -4.035
  622    HA   HIS  84           HA       HIS  84 -15.146  11.354  -3.875
  623   1HB   HIS  84          HB2       HIS  84 -13.038  12.506  -5.717
  624   2HB   HIS  84          HB1       HIS  84 -14.495  13.300  -5.123
  625    HD1  HIS  84           HD1      HIS  84 -13.601  11.716  -2.215
  626    HD2  HIS  84           HD2      HIS  84 -11.772  14.816  -4.316
  627    HE1  HIS  84           HE1      HIS  84 -12.095  12.907  -0.570
  628    H    VAL  85           HN       VAL  85 -13.041  10.018  -6.381
  629    HA   VAL  85           HA       VAL  85 -15.051  10.162  -8.470
  630    HB   VAL  85           HB       VAL  85 -12.633   8.345  -8.423
  631   1HG1  VAL  85          HG11      VAL  85 -13.919   9.865 -10.707
  632   2HG1  VAL  85          HG12      VAL  85 -14.364   8.211 -10.284
  633   3HG1  VAL  85          HG13      VAL  85 -12.722   8.575 -10.813
  634   1HG2  VAL  85          HG21      VAL  85 -11.800  10.513  -7.776
  635   2HG2  VAL  85          HG22      VAL  85 -12.817  11.322  -8.969
  636   3HG2  VAL  85          HG23      VAL  85 -11.459  10.328  -9.497
  637    H    ARG  86           HN       ARG  86 -16.203   8.349  -9.386
  638    HA   ARG  86           HA       ARG  86 -16.973   6.351  -7.349
  639   1HB   ARG  86          HB2       ARG  86 -18.025   6.998 -10.117
  640   2HB   ARG  86          HB1       ARG  86 -18.664   5.693  -9.118
  641   1HG   ARG  86          HG2       ARG  86 -19.314   7.258  -7.384
  642   2HG   ARG  86          HG1       ARG  86 -18.523   8.589  -8.230
  643   1HD   ARG  86          HD2       ARG  86 -20.979   8.588  -8.613
  644   2HD   ARG  86          HD1       ARG  86 -20.082   8.352 -10.111
  645    HE   ARG  86           HE       ARG  86 -20.590   5.773  -9.209
  646   1HH1  ARG  86          HH21      ARG  86 -22.433   8.613  -9.871
  647   2HH1  ARG  86          HH22      ARG  86 -23.852   7.741 -10.344
  648   1HH2  ARG  86          HH11      ARG  86 -22.432   4.620  -9.824
  649   2HH2  ARG  86          HH12      ARG  86 -23.854   5.480 -10.313
  650    H    ASP  87           HN       ASP  87 -14.665   5.453  -7.603
  651    HA   ASP  87           HA       ASP  87 -14.176   3.854 -10.019
  652   1HB   ASP  87          HB2       ASP  87 -12.721   4.125  -7.373
  653   2HB   ASP  87          HB1       ASP  87 -12.181   3.060  -8.672
  654    H    THR  88           HN       THR  88 -13.658   1.434  -9.654
  655    HA   THR  88           HA       THR  88 -15.895   0.253  -8.084
  656    HB   THR  88           HB       THR  88 -15.469  -1.773  -9.351
  657    HG1  THR  88           HG1      THR  88 -13.080  -0.440  -9.873
  658   1HG2  THR  88          HG21      THR  88 -16.635   0.227 -10.440
  659   2HG2  THR  88          HG22      THR  88 -15.995  -0.996 -11.538
  660   3HG2  THR  88          HG23      THR  88 -15.118   0.514 -11.292
  661    H    LYS  89           HN       LYS  89 -15.454  -1.545  -6.614
  662    HA   LYS  89           HA       LYS  89 -12.920  -1.163  -5.149
  663   1HB   LYS  89          HB2       LYS  89 -15.310  -2.931  -4.561
  664   2HB   LYS  89          HB1       LYS  89 -13.934  -2.692  -3.490
  665   1HG   LYS  89          HG2       LYS  89 -14.441  -0.286  -3.357
  666   2HG   LYS  89          HG1       LYS  89 -15.823  -0.519  -4.432
  667   1HD   LYS  89          HD2       LYS  89 -16.824  -2.085  -2.809
  668   2HD   LYS  89          HD1       LYS  89 -15.448  -1.849  -1.732
  669   1HE   LYS  89          HE2       LYS  89 -16.028   0.400  -1.296
  670   2HE   LYS  89          HE1       LYS  89 -17.118   0.476  -2.682
  671   1HZ   LYS  89          HZ1       LYS  89 -18.751  -0.098  -1.320
  672   2HZ   LYS  89          HZ2       LYS  89 -17.674  -0.342  -0.028
  673   3HZ   LYS  89          HZ3       LYS  89 -18.014  -1.611  -1.106
  674    H    ILE  90           HN       ILE  90 -11.459  -2.892  -4.685
  675    HA   ILE  90           HA       ILE  90 -11.724  -5.346  -6.386
  676    HB   ILE  90           HB       ILE  90  -9.255  -5.209  -6.779
  677   1HG1  ILE  90          HG12      ILE  90  -9.607  -2.444  -5.577
  678   2HG1  ILE  90          HG11      ILE  90  -8.711  -3.774  -4.843
  679   1HG2  ILE  90          HG21      ILE  90  -9.399  -3.519  -8.521
  680   2HG2  ILE  90          HG22      ILE  90 -10.768  -2.754  -7.715
  681   3HG2  ILE  90          HG23      ILE  90 -10.947  -4.358  -8.423
  682   1HD1  ILE  90          HD11      ILE  90  -7.250  -3.819  -6.894
  683   2HD1  ILE  90          HD12      ILE  90  -7.118  -2.333  -5.952
  684   3HD1  ILE  90          HD13      ILE  90  -8.067  -2.354  -7.438
  685    H    GLU  91           HN       GLU  91 -10.438  -7.171  -5.539
  686    HA   GLU  91           HA       GLU  91 -10.736  -7.469  -2.699
  687   1HB   GLU  91          HB2       GLU  91  -9.234  -9.102  -4.764
  688   2HB   GLU  91          HB1       GLU  91  -9.398  -9.589  -3.076
  689   1HG   GLU  91          HG2       GLU  91 -11.853  -9.532  -3.290
  690   2HG   GLU  91          HG1       GLU  91 -11.696  -9.039  -4.976
  691    H    VAL  92           HN       VAL  92  -9.171  -7.422  -1.042
  692    HA   VAL  92           HA       VAL  92  -7.045  -5.567  -1.261
  693    HB   VAL  92           HB       VAL  92  -7.451  -7.881   0.657
  694   1HG1  VAL  92          HG11      VAL  92  -5.104  -7.427   0.729
  695   2HG1  VAL  92          HG12      VAL  92  -5.802  -6.559   2.096
  696   3HG1  VAL  92          HG13      VAL  92  -5.365  -5.686   0.627
  697   1HG2  VAL  92          HG21      VAL  92  -7.721  -4.916   1.187
  698   2HG2  VAL  92          HG22      VAL  92  -8.377  -6.260   2.123
  699   3HG2  VAL  92          HG23      VAL  92  -9.063  -5.864   0.548
  700    H    ALA  93           HN       ALA  93  -7.054  -9.097  -1.663
  701    HA   ALA  93           HA       ALA  93  -4.290  -9.570  -1.876
  702   1HB   ALA  93          HB1       ALA  93  -4.923 -11.472  -3.368
  703   2HB   ALA  93          HB2       ALA  93  -6.561 -10.824  -3.446
  704   3HB   ALA  93          HB3       ALA  93  -5.910 -11.394  -1.909
  705    H    GLN  94           HN       GLN  94  -6.544  -8.394  -4.368
  706    HA   GLN  94           HA       GLN  94  -4.518  -8.322  -6.451
  707   1HB   GLN  94          HB2       GLN  94  -7.251  -7.040  -6.191
  708   2HB   GLN  94          HB1       GLN  94  -6.248  -6.895  -7.634
  709   1HG   GLN  94          HG2       GLN  94  -6.206  -9.352  -7.856
  710   2HG   GLN  94          HG1       GLN  94  -7.213  -9.499  -6.416
  711   1HE2  GLN  94          HE21      GLN  94  -8.550  -6.834  -7.490
  712   2HE2  GLN  94          HE22      GLN  94  -9.678  -7.421  -8.615
  713    H    PHE  95           HN       PHE  95  -5.894  -6.001  -4.182
  714    HA   PHE  95           HA       PHE  95  -4.689  -3.633  -5.189
  715   1HB   PHE  95          HB2       PHE  95  -6.445  -3.642  -3.464
  716   2HB   PHE  95          HB1       PHE  95  -5.334  -4.408  -2.330
  717    HD1  PHE  95           HD1      PHE  95  -6.272  -1.290  -4.003
  718    HD2  PHE  95           HD2      PHE  95  -3.374  -3.189  -1.462
  719    HE1  PHE  95           HE1      PHE  95  -5.404   0.930  -3.327
  720    HE2  PHE  95           HE2      PHE  95  -2.501  -0.974  -0.794
  721    HZ   PHE  95           HZ       PHE  95  -3.520   1.085  -1.726
  722    H    VAL  96           HN       VAL  96  -3.511  -5.913  -2.692
  723    HA   VAL  96           HA       VAL  96  -1.066  -4.539  -2.189
  724    HB   VAL  96           HB       VAL  96  -1.675  -7.503  -1.989
  725   1HG1  VAL  96          HG11      VAL  96   0.681  -7.336  -1.951
  726   2HG1  VAL  96          HG12      VAL  96   0.239  -7.295  -0.245
  727   3HG1  VAL  96          HG13      VAL  96   0.651  -5.800  -1.084
  728   1HG2  VAL  96          HG21      VAL  96  -1.598  -5.414   0.198
  729   2HG2  VAL  96          HG22      VAL  96  -2.204  -7.067   0.305
  730   3HG2  VAL  96          HG23      VAL  96  -3.084  -5.864  -0.638
  731    H    LYS  97           HN       LYS  97  -1.752  -7.272  -4.404
  732    HA   LYS  97           HA       LYS  97   0.902  -7.497  -5.415
  733   1HB   LYS  97          HB2       LYS  97  -1.767  -8.139  -6.696
  734   2HB   LYS  97          HB1       LYS  97  -0.211  -8.568  -7.408
  735   1HG   LYS  97          HG2       LYS  97   0.365  -9.864  -5.389
  736   2HG   LYS  97          HG1       LYS  97  -1.190  -9.440  -4.671
  737   1HD   LYS  97          HD2       LYS  97  -2.341 -10.535  -6.587
  738   2HD   LYS  97          HD1       LYS  97  -0.770 -11.023  -7.221
  739   1HE   LYS  97          HE2       LYS  97  -1.728 -11.762  -4.448
  740   2HE   LYS  97          HE1       LYS  97  -1.972 -12.793  -5.857
  741   1HZ   LYS  97          HZ1       LYS  97   0.007 -13.602  -5.183
  742   2HZ   LYS  97          HZ2       LYS  97   0.477 -12.164  -4.411
  743   3HZ   LYS  97          HZ3       LYS  97   0.609 -12.308  -6.099
  744    H    ASP  98           HN       ASP  98  -1.849  -5.513  -6.564
  745    HA   ASP  98           HA       ASP  98  -0.554  -4.505  -8.899
  746   1HB   ASP  98          HB2       ASP  98  -2.631  -3.259  -7.075
  747   2HB   ASP  98          HB1       ASP  98  -2.118  -2.533  -8.598
  748    H    LEU  99           HN       LEU  99  -0.551  -3.399  -5.543
  749    HA   LEU  99           HA       LEU  99   1.013  -1.042  -5.946
  750   1HB   LEU  99          HB2       LEU  99  -0.286  -1.475  -3.893
  751   2HB   LEU  99          HB1       LEU  99   0.771  -2.827  -3.503
  752    HG   LEU  99           HG       LEU  99   2.699  -1.255  -3.402
  753   1HD1  LEU  99          HD11      LEU  99   2.157   0.580  -4.764
  754   2HD1  LEU  99          HD12      LEU  99   1.926   1.238  -3.147
  755   3HD1  LEU  99          HD13      LEU  99   0.531   0.722  -4.096
  756   1HD2  LEU  99          HD21      LEU  99   1.536  -1.846  -1.349
  757   2HD2  LEU  99          HD22      LEU  99   0.312  -0.613  -1.649
  758   3HD2  LEU  99          HD23      LEU  99   1.970  -0.137  -1.283
  759    H    LEU 100           HN       LEU 100   1.890  -4.409  -5.265
  760    HA   LEU 100           HA       LEU 100   4.644  -4.118  -4.775
  761   1HB   LEU 100          HB2       LEU 100   3.540  -6.244  -4.473
  762   2HB   LEU 100          HB1       LEU 100   3.121  -6.325  -6.179
  763    HG   LEU 100           HG       LEU 100   5.472  -6.543  -6.794
  764   1HD1  LEU 100          HD11      LEU 100   5.890  -6.011  -3.852
  765   2HD1  LEU 100          HD12      LEU 100   6.670  -5.244  -5.235
  766   3HD1  LEU 100          HD13      LEU 100   7.097  -6.894  -4.787
  767   1HD2  LEU 100          HD21      LEU 100   5.866  -8.743  -5.887
  768   2HD2  LEU 100          HD22      LEU 100   4.121  -8.547  -6.057
  769   3HD2  LEU 100          HD23      LEU 100   4.875  -8.393  -4.471
  770    H    LEU 101           HN       LEU 101   3.014  -4.454  -7.956
  771    HA   LEU 101           HA       LEU 101   5.409  -4.493  -9.500
  772   1HB   LEU 101          HB2       LEU 101   2.575  -3.667 -10.096
  773   2HB   LEU 101          HB1       LEU 101   3.828  -3.436 -11.308
  774    HG   LEU 101           HG       LEU 101   2.488  -5.625 -11.427
  775   1HD1  LEU 101          HD11      LEU 101   4.846  -5.151 -12.422
  776   2HD1  LEU 101          HD12      LEU 101   4.310  -6.822 -12.292
  777   3HD1  LEU 101          HD13      LEU 101   5.436  -6.168 -11.109
  778   1HD2  LEU 101          HD21      LEU 101   2.965  -7.378  -9.902
  779   2HD2  LEU 101          HD22      LEU 101   2.670  -5.967  -8.899
  780   3HD2  LEU 101          HD23      LEU 101   4.318  -6.504  -9.188
  781    H    HIS 102           HN       HIS 102   3.404  -1.716  -8.467
  782    HA   HIS 102           HA       HIS 102   5.076   0.227  -9.782
  783   1HB   HIS 102          HB2       HIS 102   2.991   0.415  -7.609
  784   2HB   HIS 102          HB1       HIS 102   3.925   1.830  -8.092
  785    HD1  HIS 102           HD1      HIS 102   3.534   2.776 -10.477
  786    HD2  HIS 102           HD2      HIS 102   1.149  -0.516  -9.568
  787    HE1  HIS 102           HE1      HIS 102   1.771   2.653 -12.289
  788    H    LEU 103           HN       LEU 103   5.106  -1.080  -6.453
  789    HA   LEU 103           HA       LEU 103   6.947   0.777  -5.370
  790   1HB   LEU 103          HB2       LEU 103   6.535  -2.158  -4.780
  791   2HB   LEU 103          HB1       LEU 103   7.612  -1.137  -3.831
  792    HG   LEU 103           HG       LEU 103   4.689  -0.507  -4.315
  793   1HD1  LEU 103          HD11      LEU 103   4.474  -1.241  -1.875
  794   2HD1  LEU 103          HD12      LEU 103   6.066  -1.977  -2.058
  795   3HD1  LEU 103          HD13      LEU 103   4.718  -2.533  -3.049
  796   1HD2  LEU 103          HD21      LEU 103   5.275   0.828  -2.070
  797   2HD2  LEU 103          HD22      LEU 103   5.621   1.524  -3.646
  798   3HD2  LEU 103          HD23      LEU 103   6.912   0.757  -2.723
  799    H    LYS 104           HN       LYS 104   7.759  -2.396  -6.887
  800    HA   LYS 104           HA       LYS 104  10.587  -1.805  -6.746
  801   1HB   LYS 104          HB2       LYS 104  10.931  -3.775  -8.079
  802   2HB   LYS 104          HB1       LYS 104   9.630  -4.123  -6.942
  803   1HG   LYS 104          HG2       LYS 104   7.998  -3.484  -8.768
  804   2HG   LYS 104          HG1       LYS 104   9.370  -3.439  -9.878
  805   1HD   LYS 104          HD2       LYS 104   9.917  -5.796  -9.191
  806   2HD   LYS 104          HD1       LYS 104   8.413  -5.825  -8.270
  807   1HE   LYS 104          HE2       LYS 104   7.668  -6.721 -10.278
  808   2HE   LYS 104          HE1       LYS 104   7.388  -5.010 -10.596
  809   1HZ   LYS 104          HZ1       LYS 104   9.350  -6.805 -11.739
  810   2HZ   LYS 104          HZ2       LYS 104   9.940  -5.264 -11.333
  811   3HZ   LYS 104          HZ3       LYS 104   8.627  -5.421 -12.401
  812    H    LYS 105           HN       LYS 105   8.083  -0.845  -8.932
  813    HA   LYS 105           HA       LYS 105   9.659  -0.441 -11.288
  814   1HB   LYS 105          HB2       LYS 105   7.155  -0.359 -11.198
  815   2HB   LYS 105          HB1       LYS 105   7.277   1.193 -10.368
  816   1HG   LYS 105          HG2       LYS 105   8.515   2.128 -12.287
  817   2HG   LYS 105          HG1       LYS 105   8.393   0.579 -13.120
  818   1HD   LYS 105          HD2       LYS 105   5.930   0.749 -13.079
  819   2HD   LYS 105          HD1       LYS 105   6.054   2.304 -12.254
  820   1HE   LYS 105          HE2       LYS 105   5.779   2.854 -14.554
  821   2HE   LYS 105          HE1       LYS 105   7.502   3.060 -14.240
  822   1HZ   LYS 105          HZ1       LYS 105   7.472   0.511 -14.919
  823   2HZ   LYS 105          HZ2       LYS 105   7.646   1.757 -16.062
  824   3HZ   LYS 105          HZ3       LYS 105   6.130   1.030 -15.817
  825    H    LEU 106           HN       LEU 106   8.788   1.865  -8.680
  826    HA   LEU 106           HA       LEU 106  10.322   4.036  -9.742
  827   1HB   LEU 106          HB2       LEU 106   9.240   3.391  -7.005
  828   2HB   LEU 106          HB1       LEU 106  10.277   4.795  -7.239
  829    HG   LEU 106           HG       LEU 106   7.808   5.286  -7.418
  830   1HD1  LEU 106          HD11      LEU 106   9.851   6.408  -8.836
  831   2HD1  LEU 106          HD12      LEU 106   8.185   6.958  -8.938
  832   3HD1  LEU 106          HD13      LEU 106   8.827   5.866 -10.162
  833   1HD2  LEU 106          HD21      LEU 106   7.325   3.082  -8.577
  834   2HD2  LEU 106          HD22      LEU 106   7.979   3.794 -10.046
  835   3HD2  LEU 106          HD23      LEU 106   6.545   4.488  -9.290
  836    H    PHE 107           HN       PHE 107  11.260   1.210  -7.911
  837    HA   PHE 107           HA       PHE 107  13.684   2.160  -6.774
  838   1HB   PHE 107          HB2       PHE 107  12.778  -0.012  -6.156
  839   2HB   PHE 107          HB1       PHE 107  12.998  -0.608  -7.801
  840    HD1  PHE 107           HD1      PHE 107  14.961   0.970  -5.017
  841    HD2  PHE 107           HD2      PHE 107  14.975  -1.759  -8.328
  842    HE1  PHE 107           HE1      PHE 107  17.281   0.327  -4.465
  843    HE2  PHE 107           HE2      PHE 107  17.302  -2.414  -7.771
  844    HZ   PHE 107           HZ       PHE 107  18.455  -1.368  -5.837
  845    H    ARG 108           HN       ARG 108  13.039   0.856 -10.028
  846    HA   ARG 108           HA       ARG 108  15.748   0.726 -10.889
  847   1HB   ARG 108          HB2       ARG 108  13.187   1.181 -12.439
  848   2HB   ARG 108          HB1       ARG 108  14.757   0.951 -13.212
  849   1HG   ARG 108          HG2       ARG 108  15.002  -1.220 -12.051
  850   2HG   ARG 108          HG1       ARG 108  13.416  -0.997 -11.315
  851   1HD   ARG 108          HD2       ARG 108  13.964  -1.159 -14.293
  852   2HD   ARG 108          HD1       ARG 108  13.270  -2.444 -13.308
  853    HE   ARG 108           HE       ARG 108  11.613  -0.229 -12.892
  854   1HH1  ARG 108          HH21      ARG 108  12.783  -2.108 -15.529
  855   2HH1  ARG 108          HH22      ARG 108  11.401  -1.814 -16.530
  856   1HH2  ARG 108          HH11      ARG 108   9.800   0.180 -14.184
  857   2HH2  ARG 108          HH12      ARG 108   9.709  -0.517 -15.767
  858    H    GLU 109           HN       GLU 109  13.437   3.437 -10.943
  859    HA   GLU 109           HA       GLU 109  15.382   5.180 -12.289
  860   1HB   GLU 109          HB2       GLU 109  12.652   5.666 -11.076
  861   2HB   GLU 109          HB1       GLU 109  13.615   6.937 -11.831
  862   1HG   GLU 109          HG2       GLU 109  13.670   5.678 -13.935
  863   2HG   GLU 109          HG1       GLU 109  12.755   4.366 -13.192
  864    H    GLY 110           HN       GLY 110  14.849   4.176  -9.082
  865   1HA   GLY 110          HA2       GLY 110  15.945   4.841  -7.109
  866   2HA   GLY 110          HA1       GLY 110  16.896   5.960  -8.087
  867    H    ARG 111           HN       ARG 111  13.639   6.477  -8.704
  868    HA   ARG 111           HA       ARG 111  13.661   8.903  -6.974
  869   1HB   ARG 111          HB2       ARG 111  11.873   8.038  -9.270
  870   2HB   ARG 111          HB1       ARG 111  11.653   9.530  -8.354
  871   1HG   ARG 111          HG2       ARG 111  13.920  10.261  -8.990
  872   2HG   ARG 111          HG1       ARG 111  14.142   8.773  -9.911
  873   1HD   ARG 111          HD2       ARG 111  12.174   9.386 -11.316
  874   2HD   ARG 111          HD1       ARG 111  12.056  10.911 -10.438
  875    HE   ARG 111           HE       ARG 111  14.669  10.886 -11.351
  876   1HH1  ARG 111          HH21      ARG 111  11.537  10.474 -12.727
  877   2HH1  ARG 111          HH22      ARG 111  11.980  11.127 -14.268
  878   1HH2  ARG 111          HH11      ARG 111  15.272  11.737 -13.361
  879   2HH2  ARG 111          HH12      ARG 111  14.097  11.836 -14.630
  880    H    PHE 112           HN       PHE 112  13.020   8.216  -4.940
  881    HA   PHE 112           HA       PHE 112  10.711   6.370  -4.693
  882   1HB   PHE 112          HB2       PHE 112  12.506   7.570  -2.566
  883   2HB   PHE 112          HB1       PHE 112  11.355   6.245  -2.348
  884    HD1  PHE 112           HD1      PHE 112  11.690   4.087  -3.530
  885    HD2  PHE 112           HD2      PHE 112  14.637   7.206  -3.627
  886    HE1  PHE 112           HE1      PHE 112  13.375   2.474  -4.353
  887    HE2  PHE 112           HE2      PHE 112  16.326   5.587  -4.451
  888    HZ   PHE 112           HZ       PHE 112  15.695   3.218  -4.813
  889    H    ASN 113           HN       ASN 113   8.705   7.187  -4.495
  890    HA   ASN 113           HA       ASN 113   8.316  10.025  -3.805
  891   1HB   ASN 113          HB2       ASN 113   6.416   7.819  -4.637
  892   2HB   ASN 113          HB1       ASN 113   5.879   9.445  -4.215
  893   1HD2  ASN 113          HD21      ASN 113   5.646   8.227  -6.885
  894   2HD2  ASN 113          HD22      ASN 113   6.572   9.182  -7.940
  Start of MODEL   21
    1   1H    MET   1           HT1      MET   1  25.224   3.475  12.432
    2   2H    MET   1           HT2      MET   1  23.565   3.633  12.762
    3   3H    MET   1           HT3      MET   1  24.547   5.015  12.647
    4    HA   MET   1           HA       MET   1  24.995   4.415  10.284
    5   1HB   MET   1          HB2       MET   1  22.844   2.403  10.976
    6   2HB   MET   1          HB1       MET   1  23.186   2.893   9.318
    7   1HG   MET   1          HG2       MET   1  25.527   2.161   9.581
    8   2HG   MET   1          HG1       MET   1  25.187   1.667  11.241
    9   1HE   MET   1          HE1       MET   1  26.360  -0.270  10.478
   10   2HE   MET   1          HE2       MET   1  26.226  -0.619   8.756
   11   3HE   MET   1          HE3       MET   1  25.544  -1.741   9.931
   12    H    GLY   2           HN       GLY   2  24.043   5.992   9.063
   13   1HA   GLY   2          HA2       GLY   2  21.879   7.555  10.190
   14   2HA   GLY   2          HA1       GLY   2  22.610   7.806   8.602
   15    HA   PRO   3           HA       PRO   3  18.166   5.809   8.571
   16   1HB   PRO   3          HB2       PRO   3  17.849   7.991   6.577
   17   2HB   PRO   3          HB1       PRO   3  16.767   7.505   7.888
   18   1HG   PRO   3          HG2       PRO   3  18.419   9.769   7.908
   19   2HG   PRO   3          HG1       PRO   3  17.661   9.042   9.330
   20   1HD   PRO   3          HD2       PRO   3  20.495   9.102   8.644
   21   2HD   PRO   3          HD1       PRO   3  19.733   8.455  10.120
   22    H    VAL   4           HN       VAL   4  17.427   4.557   6.702
   23    HA   VAL   4           HA       VAL   4  19.601   3.850   4.908
   24    HB   VAL   4           HB       VAL   4  17.959   2.183   4.031
   25   1HG1  VAL   4          HG11      VAL   4  17.739   0.945   6.193
   26   2HG1  VAL   4          HG12      VAL   4  18.226   2.413   7.041
   27   3HG1  VAL   4          HG13      VAL   4  19.353   1.611   5.948
   28   1HG2  VAL   4          HG21      VAL   4  15.942   3.682   4.450
   29   2HG2  VAL   4          HG22      VAL   4  16.107   3.291   6.160
   30   3HG2  VAL   4          HG23      VAL   4  15.755   2.017   4.994
   31    HA   PRO   5           HA       PRO   5  18.398   6.634   1.646
   32   1HB   PRO   5          HB2       PRO   5  19.134   5.080  -0.578
   33   2HB   PRO   5          HB1       PRO   5  20.217   6.121   0.356
   34   1HG   PRO   5          HG2       PRO   5  19.957   3.164   0.400
   35   2HG   PRO   5          HG1       PRO   5  21.357   4.172   0.782
   36   1HD   PRO   5          HD2       PRO   5  19.757   2.879   2.685
   37   2HD   PRO   5          HD1       PRO   5  20.812   4.278   3.020
   38    HA   PRO   6           HA       PRO   6  14.329   5.594   0.239
   39   1HB   PRO   6          HB2       PRO   6  14.540   6.463  -2.474
   40   2HB   PRO   6          HB1       PRO   6  13.956   7.400  -1.094
   41   1HG   PRO   6          HG2       PRO   6  16.544   7.569  -2.491
   42   2HG   PRO   6          HG1       PRO   6  15.779   8.742  -1.411
   43   1HD   PRO   6          HD2       PRO   6  18.000   7.146  -0.758
   44   2HD   PRO   6          HD1       PRO   6  16.950   7.975   0.419
   45    H    SER   7           HN       SER   7  16.739   4.750  -2.271
   46    HA   SER   7           HA       SER   7  15.175   2.743  -3.541
   47   1HB   SER   7          HB2       SER   7  17.234   1.978  -4.540
   48   2HB   SER   7          HB1       SER   7  17.325   3.732  -4.420
   49    HG   SER   7           HG       SER   7  18.209   2.493  -2.168
   50    H    THR   8           HN       THR   8  17.369   2.558  -0.757
   51    HA   THR   8           HA       THR   8  17.204  -0.317  -0.507
   52    HB   THR   8           HB       THR   8  17.921   1.811   1.527
   53    HG1  THR   8           HG1      THR   8  19.204   1.382  -0.474
   54   1HG2  THR   8          HG21      THR   8  17.315  -0.115   2.781
   55   2HG2  THR   8          HG22      THR   8  19.070  -0.193   2.636
   56   3HG2  THR   8          HG23      THR   8  18.055  -1.205   1.608
   57    H    ALA   9           HN       ALA   9  15.378   2.363   0.970
   58    HA   ALA   9           HA       ALA   9  13.875   0.786   2.807
   59   1HB   ALA   9          HB1       ALA   9  13.149   3.346   1.353
   60   2HB   ALA   9          HB2       ALA   9  13.847   3.208   2.967
   61   3HB   ALA   9          HB3       ALA   9  12.199   2.655   2.670
   62    H    LEU  10           HN       LEU  10  13.279   1.616  -0.599
   63    HA   LEU  10           HA       LEU  10  10.690   0.468  -0.798
   64   1HB   LEU  10          HB2       LEU  10  11.665   1.894  -2.557
   65   2HB   LEU  10          HB1       LEU  10  12.854   0.644  -2.916
   66    HG   LEU  10           HG       LEU  10  11.039  -0.909  -3.542
   67   1HD1  LEU  10          HD11      LEU  10   9.135  -0.328  -2.316
   68   2HD1  LEU  10          HD12      LEU  10   8.735   0.318  -3.904
   69   3HD1  LEU  10          HD13      LEU  10   9.325   1.396  -2.639
   70   1HD2  LEU  10          HD21      LEU  10  10.230   0.423  -5.559
   71   2HD2  LEU  10          HD22      LEU  10  11.975   0.344  -5.334
   72   3HD2  LEU  10          HD23      LEU  10  11.095   1.801  -4.877
   73    H    ARG  11           HN       ARG  11  13.886  -1.014  -1.493
   74    HA   ARG  11           HA       ARG  11  12.861  -3.588  -2.154
   75   1HB   ARG  11          HB2       ARG  11  15.513  -2.741  -0.961
   76   2HB   ARG  11          HB1       ARG  11  15.166  -4.396  -1.465
   77   1HG   ARG  11          HG2       ARG  11  14.684  -3.620  -3.742
   78   2HG   ARG  11          HG1       ARG  11  14.966  -1.956  -3.253
   79   1HD   ARG  11          HD2       ARG  11  17.268  -2.277  -3.013
   80   2HD   ARG  11          HD1       ARG  11  17.124  -4.018  -2.805
   81    HE   ARG  11           HE       ARG  11  17.484  -2.552  -5.288
   82   1HH1  ARG  11          HH21      ARG  11  15.792  -5.244  -3.941
   83   2HH1  ARG  11          HH22      ARG  11  15.501  -5.986  -5.479
   84   1HH2  ARG  11          HH11      ARG  11  17.109  -3.511  -7.287
   85   2HH2  ARG  11          HH12      ARG  11  16.242  -5.007  -7.366
   86    H    GLU  12           HN       GLU  12  13.808  -2.177   0.963
   87    HA   GLU  12           HA       GLU  12  13.370  -4.538   2.518
   88   1HB   GLU  12          HB2       GLU  12  13.188  -1.592   3.221
   89   2HB   GLU  12          HB1       GLU  12  13.036  -2.885   4.416
   90   1HG   GLU  12          HG2       GLU  12  15.262  -3.737   3.786
   91   2HG   GLU  12          HG1       GLU  12  15.418  -2.453   2.588
   92    H    LEU  13           HN       LEU  13  11.232  -1.920   1.445
   93    HA   LEU  13           HA       LEU  13   8.917  -2.876   2.879
   94   1HB   LEU  13          HB2       LEU  13   9.110  -0.548   2.067
   95   2HB   LEU  13          HB1       LEU  13   9.105  -1.127   0.404
   96    HG   LEU  13           HG       LEU  13   6.838  -2.077   0.750
   97   1HD1  LEU  13          HD11      LEU  13   5.680  -1.107   2.914
   98   2HD1  LEU  13          HD12      LEU  13   7.327  -1.056   3.542
   99   3HD1  LEU  13          HD13      LEU  13   6.626  -2.589   3.024
  100   1HD2  LEU  13          HD21      LEU  13   5.671   0.170   1.077
  101   2HD2  LEU  13          HD22      LEU  13   6.907   0.128  -0.180
  102   3HD2  LEU  13          HD23      LEU  13   7.268   0.851   1.387
  103    H    ILE  14           HN       ILE  14   9.999  -3.239  -0.525
  104    HA   ILE  14           HA       ILE  14   7.768  -4.780  -1.388
  105    HB   ILE  14           HB       ILE  14  10.642  -4.812  -2.362
  106   1HG1  ILE  14          HG12      ILE  14   8.163  -3.549  -3.573
  107   2HG1  ILE  14          HG11      ILE  14   9.291  -2.668  -2.543
  108   1HG2  ILE  14          HG21      ILE  14   8.128  -6.116  -3.422
  109   2HG2  ILE  14          HG22      ILE  14   9.685  -6.874  -3.093
  110   3HG2  ILE  14          HG23      ILE  14   9.511  -5.774  -4.460
  111   1HD1  ILE  14          HD11      ILE  14   9.819  -2.329  -4.932
  112   2HD1  ILE  14          HD12      ILE  14  10.007  -4.070  -5.135
  113   3HD1  ILE  14          HD13      ILE  14  11.128  -3.177  -4.106
  114    H    GLU  15           HN       GLU  15  10.932  -5.883  -0.118
  115    HA   GLU  15           HA       GLU  15  10.375  -8.666  -0.276
  116   1HB   GLU  15          HB2       GLU  15  12.137  -7.105   1.632
  117   2HB   GLU  15          HB1       GLU  15  12.100  -8.867   1.561
  118   1HG   GLU  15          HG2       GLU  15  12.726  -8.791  -0.824
  119   2HG   GLU  15          HG1       GLU  15  12.767  -7.029  -0.756
  120    H    GLU  16           HN       GLU  16   9.677  -6.314   2.307
  121    HA   GLU  16           HA       GLU  16   8.683  -8.280   4.166
  122   1HB   GLU  16          HB2       GLU  16   9.401  -5.973   4.807
  123   2HB   GLU  16          HB1       GLU  16   7.979  -5.335   3.983
  124   1HG   GLU  16          HG2       GLU  16   6.497  -6.524   5.486
  125   2HG   GLU  16          HG1       GLU  16   7.858  -7.363   6.231
  126    H    LEU  17           HN       LEU  17   7.023  -6.104   1.850
  127    HA   LEU  17           HA       LEU  17   4.380  -6.993   2.474
  128   1HB   LEU  17          HB2       LEU  17   5.541  -5.905  -0.107
  129   2HB   LEU  17          HB1       LEU  17   3.819  -6.165   0.159
  130    HG   LEU  17           HG       LEU  17   5.559  -4.404   1.913
  131   1HD1  LEU  17          HD11      LEU  17   5.396  -3.524  -0.394
  132   2HD1  LEU  17          HD12      LEU  17   4.508  -2.511   0.745
  133   3HD1  LEU  17          HD13      LEU  17   3.638  -3.630  -0.304
  134   1HD2  LEU  17          HD21      LEU  17   3.691  -4.939   3.225
  135   2HD2  LEU  17          HD22      LEU  17   2.622  -5.092   1.832
  136   3HD2  LEU  17          HD23      LEU  17   3.116  -3.497   2.394
  137    H    VAL  18           HN       VAL  18   6.777  -8.183   0.146
  138    HA   VAL  18           HA       VAL  18   5.073 -10.157  -1.043
  139    HB   VAL  18           HB       VAL  18   8.081  -9.901  -0.827
  140   1HG1  VAL  18          HG11      VAL  18   7.740 -12.233  -1.142
  141   2HG1  VAL  18          HG12      VAL  18   8.022 -11.593  -2.760
  142   3HG1  VAL  18          HG13      VAL  18   6.380 -11.969  -2.235
  143   1HG2  VAL  18          HG21      VAL  18   6.749  -8.228  -2.164
  144   2HG2  VAL  18          HG22      VAL  18   6.189  -9.564  -3.169
  145   3HG2  VAL  18          HG23      VAL  18   7.903  -9.154  -3.125
  146    H    ASN  19           HN       ASN  19   7.353 -10.338   1.695
  147    HA   ASN  19           HA       ASN  19   7.203 -13.141   2.100
  148   1HB   ASN  19          HB2       ASN  19   8.855 -11.707   3.218
  149   2HB   ASN  19          HB1       ASN  19   7.570 -10.950   4.160
  150   1HD2  ASN  19          HD21      ASN  19   7.217 -14.359   3.501
  151   2HD2  ASN  19          HD22      ASN  19   7.635 -14.906   5.053
  152    H    ILE  20           HN       ILE  20   5.083 -10.559   3.360
  153    HA   ILE  20           HA       ILE  20   3.545 -12.415   4.984
  154    HB   ILE  20           HB       ILE  20   1.988 -10.484   5.263
  155   1HG1  ILE  20          HG12      ILE  20   3.952  -9.071   3.439
  156   2HG1  ILE  20          HG11      ILE  20   2.331  -9.566   2.958
  157   1HG2  ILE  20          HG21      ILE  20   3.533  -9.136   6.522
  158   2HG2  ILE  20          HG22      ILE  20   4.890  -9.655   5.522
  159   3HG2  ILE  20          HG23      ILE  20   4.111 -10.800   6.614
  160   1HD1  ILE  20          HD11      ILE  20   3.037  -7.610   5.164
  161   2HD1  ILE  20          HD12      ILE  20   1.402  -8.174   4.815
  162   3HD1  ILE  20          HD13      ILE  20   2.282  -7.220   3.620
  163    H    THR  21           HN       THR  21   3.393 -11.487   1.625
  164    HA   THR  21           HA       THR  21   0.589 -12.495   1.404
  165    HB   THR  21           HB       THR  21   0.701 -11.633  -0.913
  166    HG1  THR  21           HG1      THR  21   2.543 -10.580  -1.582
  167   1HG2  THR  21          HG21      THR  21   0.321  -9.446  -0.288
  168   2HG2  THR  21          HG22      THR  21   1.775  -9.366   0.696
  169   3HG2  THR  21          HG23      THR  21   0.337 -10.165   1.322
  170    H    GLN  22           HN       GLN  22   3.729 -13.762   1.107
  171    HA   GLN  22           HA       GLN  22   3.040 -15.576  -1.120
  172   1HB   GLN  22          HB2       GLN  22   5.494 -15.216   0.599
  173   2HB   GLN  22          HB1       GLN  22   5.325 -16.600  -0.482
  174   1HG   GLN  22          HG2       GLN  22   5.048 -15.127  -2.401
  175   2HG   GLN  22          HG1       GLN  22   5.071 -13.709  -1.359
  176   1HE2  GLN  22          HE21      GLN  22   6.990 -14.346  -3.534
  177   2HE2  GLN  22          HE22      GLN  22   8.519 -14.439  -2.801
  178    H    ASN  23           HN       ASN  23   3.612 -15.860   2.387
  179    HA   ASN  23           HA       ASN  23   2.687 -18.696   2.282
  180   1HB   ASN  23          HB2       ASN  23   4.077 -17.061   4.415
  181   2HB   ASN  23          HB1       ASN  23   3.497 -18.707   4.676
  182   1HD2  ASN  23          HD21      ASN  23   6.342 -17.706   4.591
  183   2HD2  ASN  23          HD22      ASN  23   7.100 -18.620   3.378
  184    H    GLN  24           HN       GLN  24   0.860 -16.220   2.164
  185    HA   GLN  24           HA       GLN  24  -0.533 -16.307   4.739
  186   1HB   GLN  24          HB2       GLN  24  -1.899 -14.591   3.904
  187   2HB   GLN  24          HB1       GLN  24  -0.372 -14.307   3.078
  188   1HG   GLN  24          HG2       GLN  24  -2.869 -15.603   1.956
  189   2HG   GLN  24          HG1       GLN  24  -2.092 -14.117   1.420
  190   1HE2  GLN  24          HE21      GLN  24  -2.641 -16.774  -0.019
  191   2HE2  GLN  24          HE22      GLN  24  -1.134 -17.218  -0.661
  192    H    LYS  25           HN       LYS  25  -2.194 -17.672   5.273
  193    HA   LYS  25           HA       LYS  25  -3.050 -19.664   3.256
  194   1HB   LYS  25          HB2       LYS  25  -2.506 -20.373   5.574
  195   2HB   LYS  25          HB1       LYS  25  -3.806 -19.350   6.182
  196   1HG   LYS  25          HG2       LYS  25  -5.447 -20.653   4.875
  197   2HG   LYS  25          HG1       LYS  25  -4.145 -21.680   4.269
  198   1HD   LYS  25          HD2       LYS  25  -3.600 -22.340   6.594
  199   2HD   LYS  25          HD1       LYS  25  -4.933 -21.344   7.179
  200   1HE   LYS  25          HE2       LYS  25  -5.704 -23.639   7.030
  201   2HE   LYS  25          HE1       LYS  25  -6.493 -22.704   5.759
  202   1HZ   LYS  25          HZ1       LYS  25  -4.058 -24.368   5.404
  203   2HZ   LYS  25          HZ2       LYS  25  -4.863 -23.500   4.184
  204   3HZ   LYS  25          HZ3       LYS  25  -5.626 -24.818   4.939
  205    H    ALA  26           HN       ALA  26  -5.060 -18.106   5.734
  206    HA   ALA  26           HA       ALA  26  -7.212 -17.749   3.762
  207   1HB   ALA  26          HB1       ALA  26  -8.587 -17.641   5.610
  208   2HB   ALA  26          HB2       ALA  26  -7.526 -16.508   6.448
  209   3HB   ALA  26          HB3       ALA  26  -7.179 -18.234   6.483
  210    HA   PRO  27           HA       PRO  27  -6.311 -13.585   2.524
  211   1HB   PRO  27          HB2       PRO  27  -8.795 -12.557   3.787
  212   2HB   PRO  27          HB1       PRO  27  -8.303 -12.518   2.088
  213   1HG   PRO  27          HG2       PRO  27 -10.241 -14.229   3.180
  214   2HG   PRO  27          HG1       PRO  27  -9.455 -14.437   1.610
  215   1HD   PRO  27          HD2       PRO  27  -9.136 -16.067   4.008
  216   2HD   PRO  27          HD1       PRO  27  -8.438 -16.338   2.392
  217    H    LEU  28           HN       LEU  28  -5.358 -11.674   3.500
  218    HA   LEU  28           HA       LEU  28  -4.462 -11.968   6.187
  219   1HB   LEU  28          HB2       LEU  28  -4.632  -9.483   4.458
  220   2HB   LEU  28          HB1       LEU  28  -3.746  -9.574   5.977
  221    HG   LEU  28           HG       LEU  28  -3.226 -11.408   3.617
  222   1HD1  LEU  28          HD11      LEU  28  -1.162  -9.958   3.332
  223   2HD1  LEU  28          HD12      LEU  28  -1.916  -8.802   4.430
  224   3HD1  LEU  28          HD13      LEU  28  -2.685  -9.184   2.889
  225   1HD2  LEU  28          HD21      LEU  28  -2.319 -12.472   5.509
  226   2HD2  LEU  28          HD22      LEU  28  -1.915 -10.949   6.300
  227   3HD2  LEU  28          HD23      LEU  28  -0.951 -11.521   4.941
  228    H    CYS  29           HN       CYS  29  -6.894  -9.702   4.875
  229    HA   CYS  29           HA       CYS  29  -7.817  -9.063   7.598
  230   1HB   CYS  29          HB2       CYS  29  -8.586  -8.145   4.829
  231   2HB   CYS  29          HB1       CYS  29  -9.605  -7.764   6.217
  232    H    ASN  30           HN       ASN  30 -10.247  -9.207   7.991
  233    HA   ASN  30           HA       ASN  30 -11.111 -11.942   7.662
  234   1HB   ASN  30          HB2       ASN  30 -12.580  -9.457   8.598
  235   2HB   ASN  30          HB1       ASN  30 -13.237 -11.093   8.694
  236   1HD2  ASN  30          HD21      ASN  30 -11.047 -12.592   9.524
  237   2HD2  ASN  30          HD22      ASN  30 -10.500 -12.047  11.036
  238    H    GLY  31           HN       GLY  31 -10.579 -10.727   5.118
  239   1HA   GLY  31          HA2       GLY  31 -11.607 -10.957   2.992
  240   2HA   GLY  31          HA1       GLY  31 -13.151 -11.245   3.799
  241    H    SER  32           HN       SER  32 -11.260  -8.512   4.779
  242    HA   SER  32           HA       SER  32 -13.377  -6.662   4.194
  243   1HB   SER  32          HB2       SER  32 -10.451  -6.082   4.738
  244   2HB   SER  32          HB1       SER  32 -11.781  -4.936   4.876
  245    HG   SER  32           HG       SER  32 -12.498  -7.008   6.281
  246    H    MET  33           HN       MET  33 -13.463  -5.038   2.570
  247    HA   MET  33           HA       MET  33 -11.700  -5.509   0.180
  248   1HB   MET  33          HB2       MET  33 -14.593  -4.587   0.261
  249   2HB   MET  33          HB1       MET  33 -13.615  -4.800  -1.189
  250   1HG   MET  33          HG2       MET  33 -13.341  -7.192  -0.671
  251   2HG   MET  33          HG1       MET  33 -14.310  -6.990   0.787
  252   1HE   MET  33          HE1       MET  33 -15.617  -6.987  -3.588
  253   2HE   MET  33          HE2       MET  33 -13.991  -7.008  -2.912
  254   3HE   MET  33          HE3       MET  33 -14.886  -5.493  -2.993
  255    H    VAL  34           HN       VAL  34 -11.113  -3.587  -1.020
  256    HA   VAL  34           HA       VAL  34 -11.517  -1.000   0.449
  257    HB   VAL  34           HB       VAL  34  -9.179  -0.411  -0.062
  258   1HG1  VAL  34          HG11      VAL  34  -9.438  -3.089   1.328
  259   2HG1  VAL  34          HG12      VAL  34  -9.795  -1.530   2.064
  260   3HG1  VAL  34          HG13      VAL  34  -8.147  -1.910   1.567
  261   1HG2  VAL  34          HG21      VAL  34  -8.874  -1.794  -2.077
  262   2HG2  VAL  34          HG22      VAL  34  -9.042  -3.261  -1.113
  263   3HG2  VAL  34          HG23      VAL  34  -7.651  -2.205  -0.874
  264    H    TRP  35           HN       TRP  35 -11.227   0.911  -0.908
  265    HA   TRP  35           HA       TRP  35 -12.542   0.620  -3.467
  266   1HB   TRP  35          HB2       TRP  35 -11.132   2.990  -2.201
  267   2HB   TRP  35          HB1       TRP  35 -12.106   3.074  -3.667
  268    HD1  TRP  35           HD1      TRP  35 -12.370   2.689   0.101
  269    HE1  TRP  35           HE1      TRP  35 -14.838   2.941   0.799
  270    HE3  TRP  35           HE3      TRP  35 -14.575   2.743  -4.496
  271    HZ2  TRP  35           HZ2      TRP  35 -17.415   3.135  -0.436
  272    HZ3  TRP  35           HZ3      TRP  35 -17.038   2.953  -4.710
  273    HH2  TRP  35           HH2      TRP  35 -18.458   3.153  -2.688
  274    H    SER  36           HN       SER  36 -11.633   0.487  -5.489
  275    HA   SER  36           HA       SER  36  -8.786  -0.011  -5.724
  276   1HB   SER  36          HB2       SER  36  -9.220  -0.297  -8.083
  277   2HB   SER  36          HB1       SER  36 -10.575  -1.011  -7.214
  278    HG   SER  36           HG       SER  36 -10.543   1.036  -8.965
  279    H    ILE  37           HN       ILE  37  -7.229   1.355  -6.758
  280    HA   ILE  37           HA       ILE  37  -8.060   4.207  -7.182
  281    HB   ILE  37           HB       ILE  37  -5.861   4.872  -6.164
  282   1HG1  ILE  37          HG12      ILE  37  -5.798   2.099  -4.955
  283   2HG1  ILE  37          HG11      ILE  37  -4.941   2.450  -6.453
  284   1HG2  ILE  37          HG21      ILE  37  -6.607   4.404  -3.790
  285   2HG2  ILE  37          HG22      ILE  37  -7.879   3.385  -4.464
  286   3HG2  ILE  37          HG23      ILE  37  -7.847   5.111  -4.826
  287   1HD1  ILE  37          HD11      ILE  37  -3.593   2.709  -4.288
  288   2HD1  ILE  37          HD12      ILE  37  -4.575   4.140  -3.975
  289   3HD1  ILE  37          HD13      ILE  37  -3.548   4.071  -5.407
  290    H    ASN  38           HN       ASN  38  -6.466   5.401  -8.538
  291    HA   ASN  38           HA       ASN  38  -5.538   3.677 -10.741
  292   1HB   ASN  38          HB2       ASN  38  -6.683   5.866 -11.169
  293   2HB   ASN  38          HB1       ASN  38  -5.318   6.689 -10.414
  294   1HD2  ASN  38          HD21      ASN  38  -4.330   3.861 -12.075
  295   2HD2  ASN  38          HD22      ASN  38  -3.780   4.608 -13.496
  296    H    LEU  39           HN       LEU  39  -3.502   2.848 -10.712
  297    HA   LEU  39           HA       LEU  39  -1.562   3.788  -8.743
  298   1HB   LEU  39          HB2       LEU  39  -1.398   1.693 -10.926
  299   2HB   LEU  39          HB1       LEU  39  -0.081   2.041  -9.813
  300    HG   LEU  39           HG       LEU  39  -1.457   0.087  -9.103
  301   1HD1  LEU  39          HD11      LEU  39  -0.309   1.814  -7.494
  302   2HD1  LEU  39          HD12      LEU  39  -1.397   0.598  -6.837
  303   3HD1  LEU  39          HD13      LEU  39  -1.966   2.248  -7.074
  304   1HD2  LEU  39          HD21      LEU  39  -3.619   1.211 -10.013
  305   2HD2  LEU  39          HD22      LEU  39  -3.680   2.013  -8.442
  306   3HD2  LEU  39          HD23      LEU  39  -3.729   0.255  -8.538
  307    H    THR  40           HN       THR  40  -0.290   5.535  -9.131
  308    HA   THR  40           HA       THR  40   0.912   5.882 -11.825
  309    HB   THR  40           HB       THR  40   0.350   8.345 -11.703
  310    HG1  THR  40           HG1      THR  40  -0.376   7.744  -9.324
  311   1HG2  THR  40          HG21      THR  40  -0.905   6.722 -13.120
  312   2HG2  THR  40          HG22      THR  40  -1.917   8.050 -12.554
  313   3HG2  THR  40          HG23      THR  40  -2.027   6.467 -11.785
  314    H    ALA  41           HN       ALA  41   0.962   8.553  -9.650
  315    HA   ALA  41           HA       ALA  41   3.780   7.870  -8.861
  316   1HB   ALA  41          HB1       ALA  41   3.489   9.887 -10.308
  317   2HB   ALA  41          HB2       ALA  41   4.167  10.274  -8.727
  318   3HB   ALA  41          HB3       ALA  41   2.465  10.596  -9.059
  319    H    GLY  42           HN       GLY  42   1.139   9.962  -7.634
  320   1HA   GLY  42          HA2       GLY  42   2.030   9.742  -4.900
  321   2HA   GLY  42          HA1       GLY  42   0.475  10.391  -5.420
  322    H    MET  43           HN       MET  43   1.755   7.141  -6.047
  323    HA   MET  43           HA       MET  43  -0.701   5.845  -5.375
  324   1HB   MET  43          HB2       MET  43   2.114   4.724  -5.406
  325   2HB   MET  43          HB1       MET  43   0.632   3.771  -5.443
  326   1HG   MET  43          HG2       MET  43  -0.020   4.972  -7.528
  327   2HG   MET  43          HG1       MET  43   1.549   5.764  -7.530
  328   1HE   MET  43          HE1       MET  43   4.121   3.195  -8.075
  329   2HE   MET  43          HE2       MET  43   3.468   3.030  -6.447
  330   3HE   MET  43          HE3       MET  43   3.616   4.630  -7.173
  331    H    TYR  44           HN       TYR  44   2.259   6.437  -3.511
  332    HA   TYR  44           HA       TYR  44   1.587   4.901  -1.215
  333   1HB   TYR  44          HB2       TYR  44   3.220   7.441  -1.492
  334   2HB   TYR  44          HB1       TYR  44   3.156   6.467  -0.024
  335    HD1  TYR  44           HD1      TYR  44   4.177   4.244   0.066
  336    HD2  TYR  44           HD2      TYR  44   4.328   6.616  -3.511
  337    HE1  TYR  44           HE1      TYR  44   5.921   2.741  -0.857
  338    HE2  TYR  44           HE2      TYR  44   6.073   5.115  -4.433
  339    HH   TYR  44           HH       TYR  44   7.935   3.306  -2.900
  340    H    CYS  45           HN       CYS  45   0.910   8.312  -2.009
  341    HA   CYS  45           HA       CYS  45  -0.470   8.904   0.452
  342   1HB   CYS  45          HB2       CYS  45  -0.475  10.167  -2.295
  343   2HB   CYS  45          HB1       CYS  45  -1.488  10.781  -0.989
  344    H    ALA  46           HN       ALA  46  -1.717   8.246  -2.839
  345    HA   ALA  46           HA       ALA  46  -4.463   8.083  -2.120
  346   1HB   ALA  46          HB1       ALA  46  -3.680   8.260  -4.454
  347   2HB   ALA  46          HB2       ALA  46  -4.741   6.866  -4.248
  348   3HB   ALA  46          HB3       ALA  46  -2.995   6.638  -4.345
  349    H    ALA  47           HN       ALA  47  -1.985   5.537  -2.376
  350    HA   ALA  47           HA       ALA  47  -3.712   3.365  -1.768
  351   1HB   ALA  47          HB1       ALA  47  -0.757   3.643  -1.150
  352   2HB   ALA  47          HB2       ALA  47  -1.430   3.068  -2.675
  353   3HB   ALA  47          HB3       ALA  47  -1.660   2.130  -1.199
  354    H    LEU  48           HN       LEU  48  -1.848   5.525   0.342
  355    HA   LEU  48           HA       LEU  48  -2.279   4.129   2.766
  356   1HB   LEU  48          HB2       LEU  48  -0.681   5.980   2.552
  357   2HB   LEU  48          HB1       LEU  48  -2.008   7.113   2.309
  358    HG   LEU  48           HG       LEU  48  -2.868   6.607   4.572
  359   1HD1  LEU  48          HD11      LEU  48  -0.599   4.616   4.517
  360   2HD1  LEU  48          HD12      LEU  48  -2.262   4.393   5.065
  361   3HD1  LEU  48          HD13      LEU  48  -1.126   5.304   6.054
  362   1HD2  LEU  48          HD21      LEU  48   0.068   7.353   4.378
  363   2HD2  LEU  48          HD22      LEU  48  -0.895   7.554   5.842
  364   3HD2  LEU  48          HD23      LEU  48  -1.312   8.452   4.383
  365    H    GLU  49           HN       GLU  49  -4.256   6.811   1.373
  366    HA   GLU  49           HA       GLU  49  -6.171   6.815   3.481
  367   1HB   GLU  49          HB2       GLU  49  -7.741   7.819   1.763
  368   2HB   GLU  49          HB1       GLU  49  -6.198   8.653   1.949
  369   1HG   GLU  49          HG2       GLU  49  -5.314   7.595  -0.022
  370   2HG   GLU  49          HG1       GLU  49  -6.740   6.566  -0.174
  371    H    SER  50           HN       SER  50  -5.943   4.773   0.597
  372    HA   SER  50           HA       SER  50  -8.562   3.638   0.779
  373   1HB   SER  50          HB2       SER  50  -7.693   1.832  -0.593
  374   2HB   SER  50          HB1       SER  50  -6.984   3.341  -1.155
  375    HG   SER  50           HG       SER  50  -5.834   1.199   0.211
  376    H    LEU  51           HN       LEU  51  -5.491   2.772   2.327
  377    HA   LEU  51           HA       LEU  51  -6.492   0.400   3.632
  378   1HB   LEU  51          HB2       LEU  51  -4.167   2.201   4.375
  379   2HB   LEU  51          HB1       LEU  51  -4.444   0.577   5.002
  380    HG   LEU  51           HG       LEU  51  -4.066   1.245   2.067
  381   1HD1  LEU  51          HD11      LEU  51  -2.142   0.027   4.071
  382   2HD1  LEU  51          HD12      LEU  51  -2.012   1.638   3.365
  383   3HD1  LEU  51          HD13      LEU  51  -1.839   0.210   2.344
  384   1HD2  LEU  51          HD21      LEU  51  -5.256  -0.778   2.093
  385   2HD2  LEU  51          HD22      LEU  51  -4.535  -1.303   3.614
  386   3HD2  LEU  51          HD23      LEU  51  -3.591  -1.351   2.126
  387    H    ILE  52           HN       ILE  52  -6.305   3.812   4.579
  388    HA   ILE  52           HA       ILE  52  -6.920   3.592   7.315
  389    HB   ILE  52           HB       ILE  52  -7.821   5.669   5.297
  390   1HG1  ILE  52          HG12      ILE  52  -5.394   5.483   5.510
  391   2HG1  ILE  52          HG11      ILE  52  -5.946   6.990   6.218
  392   1HG2  ILE  52          HG21      ILE  52  -8.097   7.155   7.296
  393   2HG2  ILE  52          HG22      ILE  52  -7.901   5.735   8.322
  394   3HG2  ILE  52          HG23      ILE  52  -9.275   5.846   7.222
  395   1HD1  ILE  52          HD11      ILE  52  -4.804   4.566   7.545
  396   2HD1  ILE  52          HD12      ILE  52  -6.004   5.493   8.442
  397   3HD1  ILE  52          HD13      ILE  52  -4.523   6.269   7.891
  398    H    ASN  53           HN       ASN  53  -8.867   2.737   4.617
  399    HA   ASN  53           HA       ASN  53 -11.413   2.991   6.076
  400   1HB   ASN  53          HB2       ASN  53 -10.651   1.869   3.371
  401   2HB   ASN  53          HB1       ASN  53 -12.282   1.717   4.024
  402   1HD2  ASN  53          HD21      ASN  53 -12.650   4.210   5.259
  403   2HD2  ASN  53          HD22      ASN  53 -12.568   5.443   4.095
  404    H    VAL  54           HN       VAL  54  -8.884   0.666   5.770
  405    HA   VAL  54           HA       VAL  54 -10.643  -1.586   6.607
  406    HB   VAL  54           HB       VAL  54  -7.643  -1.593   6.146
  407   1HG1  VAL  54          HG11      VAL  54  -9.644  -3.870   6.077
  408   2HG1  VAL  54          HG12      VAL  54  -8.702  -3.461   7.511
  409   3HG1  VAL  54          HG13      VAL  54  -7.886  -3.989   6.040
  410   1HG2  VAL  54          HG21      VAL  54  -9.918  -2.299   4.270
  411   2HG2  VAL  54          HG22      VAL  54  -8.203  -2.540   3.931
  412   3HG2  VAL  54          HG23      VAL  54  -8.847  -0.907   4.110
  413    H    SER  55           HN       SER  55 -10.929  -1.982   8.731
  414    HA   SER  55           HA       SER  55  -8.822  -1.083  10.677
  415   1HB   SER  55          HB2       SER  55 -11.829  -1.039  11.064
  416   2HB   SER  55          HB1       SER  55 -10.623  -0.540  12.248
  417    HG   SER  55           HG       SER  55 -11.300   1.283  11.175
  418    H    GLY  56           HN       GLY  56  -8.518  -2.465  12.484
  419   1HA   GLY  56          HA2       GLY  56  -8.932  -4.422  13.815
  420   2HA   GLY  56          HA1       GLY  56 -10.065  -4.995  12.593
  421    H    CYS  57           HN       CYS  57  -7.636  -4.077  10.697
  422    HA   CYS  57           HA       CYS  57  -6.417  -6.799  10.694
  423   1HB   CYS  57          HB2       CYS  57  -6.303  -4.551   8.662
  424   2HB   CYS  57          HB1       CYS  57  -5.530  -6.124   8.474
  425    H    SER  58           HN       SER  58  -4.887  -6.613  12.379
  426    HA   SER  58           HA       SER  58  -3.090  -4.377  12.661
  427   1HB   SER  58          HB2       SER  58  -3.604  -5.981  14.495
  428   2HB   SER  58          HB1       SER  58  -2.741  -7.236  13.611
  429    HG   SER  58           HG       SER  58  -1.487  -4.775  14.114
  430    H    ALA  59           HN       ALA  59  -2.885  -7.468  10.971
  431    HA   ALA  59           HA       ALA  59  -0.190  -7.653  10.372
  432   1HB   ALA  59          HB1       ALA  59  -0.808  -8.890   8.391
  433   2HB   ALA  59          HB2       ALA  59  -2.399  -8.131   8.360
  434   3HB   ALA  59          HB3       ALA  59  -1.983  -9.252   9.656
  435    H    ILE  60           HN       ILE  60  -2.499  -5.391   8.866
  436    HA   ILE  60           HA       ILE  60  -0.333  -4.448   7.038
  437    HB   ILE  60           HB       ILE  60  -2.117  -3.198   5.901
  438   1HG1  ILE  60          HG12      ILE  60  -4.023  -4.490   7.874
  439   2HG1  ILE  60          HG11      ILE  60  -3.494  -2.819   8.014
  440   1HG2  ILE  60          HG21      ILE  60  -1.711  -5.493   5.208
  441   2HG2  ILE  60          HG22      ILE  60  -3.448  -5.190   5.170
  442   3HG2  ILE  60          HG23      ILE  60  -2.741  -6.103   6.503
  443   1HD1  ILE  60          HD11      ILE  60  -4.484  -2.225   5.920
  444   2HD1  ILE  60          HD12      ILE  60  -5.699  -3.155   6.798
  445   3HD1  ILE  60          HD13      ILE  60  -4.773  -3.914   5.504
  446    H    GLU  61           HN       GLU  61  -1.475  -3.649  10.106
  447    HA   GLU  61           HA       GLU  61  -1.559  -0.803   9.954
  448   1HB   GLU  61          HB2       GLU  61  -0.831  -2.701  12.191
  449   2HB   GLU  61          HB1       GLU  61  -0.804  -0.951  12.415
  450   1HG   GLU  61          HG2       GLU  61  -3.216  -2.443  11.352
  451   2HG   GLU  61          HG1       GLU  61  -2.989  -2.072  13.062
  452    H    LYS  62           HN       LYS  62   1.181  -3.044  10.363
  453    HA   LYS  62           HA       LYS  62   3.167  -1.001  10.726
  454   1HB   LYS  62          HB2       LYS  62   3.362  -3.795   9.560
  455   2HB   LYS  62          HB1       LYS  62   4.762  -2.758   9.839
  456   1HG   LYS  62          HG2       LYS  62   4.188  -2.617  12.231
  457   2HG   LYS  62          HG1       LYS  62   2.789  -3.656  11.957
  458   1HD   LYS  62          HD2       LYS  62   4.280  -5.463  11.175
  459   2HD   LYS  62          HD1       LYS  62   5.680  -4.426  11.454
  460   1HE   LYS  62          HE2       LYS  62   5.412  -5.906  13.366
  461   2HE   LYS  62          HE1       LYS  62   5.015  -4.261  13.862
  462   1HZ   LYS  62          HZ1       LYS  62   3.395  -5.933  14.626
  463   2HZ   LYS  62          HZ2       LYS  62   3.017  -6.283  13.006
  464   3HZ   LYS  62          HZ3       LYS  62   2.697  -4.741  13.643
  465    H    THR  63           HN       THR  63   1.776  -2.551   7.860
  466    HA   THR  63           HA       THR  63   3.468  -1.375   5.904
  467    HB   THR  63           HB       THR  63   0.532  -2.093   5.677
  468    HG1  THR  63           HG1      THR  63   2.942  -3.525   5.348
  469   1HG2  THR  63          HG21      THR  63   1.095  -0.733   3.808
  470   2HG2  THR  63          HG22      THR  63   1.223  -2.396   3.233
  471   3HG2  THR  63          HG23      THR  63   2.680  -1.489   3.642
  472    H    GLN  64           HN       GLN  64   0.474  -0.173   7.412
  473    HA   GLN  64           HA       GLN  64   0.157   2.137   5.788
  474   1HB   GLN  64          HB2       GLN  64  -0.561   1.646   8.692
  475   2HB   GLN  64          HB1       GLN  64  -1.072   3.069   7.783
  476   1HG   GLN  64          HG2       GLN  64  -2.213   1.638   6.144
  477   2HG   GLN  64          HG1       GLN  64  -1.676   0.199   7.012
  478   1HE2  GLN  64          HE21      GLN  64  -3.239   3.320   7.975
  479   2HE2  GLN  64          HE22      GLN  64  -4.430   2.587   8.936
  480    H    ARG  65           HN       ARG  65   2.066   1.631   8.754
  481    HA   ARG  65           HA       ARG  65   2.893   4.355   9.053
  482   1HB   ARG  65          HB2       ARG  65   4.221   1.762   9.886
  483   2HB   ARG  65          HB1       ARG  65   4.813   3.355  10.353
  484   1HG   ARG  65          HG2       ARG  65   2.614   3.846  11.399
  485   2HG   ARG  65          HG1       ARG  65   2.071   2.220  10.979
  486   1HD   ARG  65          HD2       ARG  65   3.981   1.292  12.303
  487   2HD   ARG  65          HD1       ARG  65   4.392   2.931  12.796
  488    HE   ARG  65           HE       ARG  65   1.695   2.615  13.473
  489   1HH1  ARG  65          HH21      ARG  65   4.705   1.067  14.121
  490   2HH1  ARG  65          HH22      ARG  65   4.226   0.491  15.682
  491   1HH2  ARG  65          HH11      ARG  65   1.049   1.867  15.510
  492   2HH2  ARG  65          HH12      ARG  65   2.157   0.942  16.467
  493    H    MET  66           HN       MET  66   4.465   1.595   7.406
  494    HA   MET  66           HA       MET  66   6.758   3.073   6.548
  495   1HB   MET  66          HB2       MET  66   5.460   0.566   5.459
  496   2HB   MET  66          HB1       MET  66   6.980   1.215   4.838
  497   1HG   MET  66          HG2       MET  66   7.910   1.128   7.162
  498   2HG   MET  66          HG1       MET  66   6.425   0.342   7.691
  499   1HE   MET  66          HE1       MET  66   5.714  -1.759   5.243
  500   2HE   MET  66          HE2       MET  66   5.525  -1.683   6.992
  501   3HE   MET  66          HE3       MET  66   6.356  -3.053   6.264
  502    H    LEU  67           HN       LEU  67   3.607   2.514   4.977
  503    HA   LEU  67           HA       LEU  67   4.262   3.695   2.464
  504   1HB   LEU  67          HB2       LEU  67   1.641   3.589   3.981
  505   2HB   LEU  67          HB1       LEU  67   1.781   4.192   2.333
  506    HG   LEU  67           HG       LEU  67   2.689   1.421   3.172
  507   1HD1  LEU  67          HD11      LEU  67   0.043   2.393   2.070
  508   2HD1  LEU  67          HD12      LEU  67   0.324   1.472   3.547
  509   3HD1  LEU  67          HD13      LEU  67   0.553   0.708   1.975
  510   1HD2  LEU  67          HD21      LEU  67   3.742   1.938   1.116
  511   2HD2  LEU  67          HD22      LEU  67   2.358   2.861   0.534
  512   3HD2  LEU  67          HD23      LEU  67   2.279   1.104   0.608
  513    H    SER  68           HN       SER  68   3.148   5.107   5.509
  514    HA   SER  68           HA       SER  68   2.769   7.771   4.600
  515   1HB   SER  68          HB2       SER  68   3.648   6.692   7.291
  516   2HB   SER  68          HB1       SER  68   3.261   8.387   7.006
  517    HG   SER  68           HG       SER  68   1.618   6.199   7.250
  518    H    GLY  69           HN       GLY  69   5.687   6.055   5.668
  519   1HA   GLY  69          HA2       GLY  69   7.501   8.178   5.850
  520   2HA   GLY  69          HA1       GLY  69   7.946   6.576   5.259
  521    H    PHE  70           HN       PHE  70   6.170   6.657   2.932
  522    HA   PHE  70           HA       PHE  70   7.863   8.384   1.201
  523   1HB   PHE  70          HB2       PHE  70   5.791   6.256   0.569
  524   2HB   PHE  70          HB1       PHE  70   6.669   7.174  -0.654
  525    HD1  PHE  70           HD1      PHE  70   9.063   6.838  -1.015
  526    HD2  PHE  70           HD2      PHE  70   6.925   4.597   1.961
  527    HE1  PHE  70           HE1      PHE  70  10.963   5.261  -0.841
  528    HE2  PHE  70           HE2      PHE  70   8.828   3.017   2.139
  529    HZ   PHE  70           HZ       PHE  70  10.849   3.347   0.738
  530    H    CYS  71           HN       CYS  71   4.867   8.471   2.782
  531    HA   CYS  71           HA       CYS  71   4.051  10.847   1.184
  532   1HB   CYS  71          HB2       CYS  71   2.606   8.282   1.346
  533   2HB   CYS  71          HB1       CYS  71   1.599   9.662   1.771
  534    HA   PRO  72           HA       PRO  72   3.842  11.710   5.755
  535   1HB   PRO  72          HB2       PRO  72   3.857  14.519   4.830
  536   2HB   PRO  72          HB1       PRO  72   4.988  13.697   5.912
  537   1HG   PRO  72          HG2       PRO  72   5.608  14.488   3.343
  538   2HG   PRO  72          HG1       PRO  72   6.441  13.188   4.206
  539   1HD   PRO  72          HD2       PRO  72   4.483  12.997   1.973
  540   2HD   PRO  72          HD1       PRO  72   5.729  11.829   2.484
  541    H    HIS  73           HN       HIS  73   1.589  11.145   3.944
  542    HA   HIS  73           HA       HIS  73  -0.313  13.345   4.349
  543   1HB   HIS  73          HB2       HIS  73   0.072  11.416   2.374
  544   2HB   HIS  73          HB1       HIS  73  -1.355  10.817   3.212
  545    HD1  HIS  73           HD1      HIS  73  -3.505  12.167   2.990
  546    HD2  HIS  73           HD2      HIS  73  -0.233  14.000   1.194
  547    HE1  HIS  73           HE1      HIS  73  -4.434  14.119   1.685
  548    H    LYS  74           HN       LYS  74  -0.899  13.409   6.505
  549    HA   LYS  74           HA       LYS  74  -1.697  10.951   7.922
  550   1HB   LYS  74          HB2       LYS  74  -2.028  13.867   8.717
  551   2HB   LYS  74          HB1       LYS  74  -2.212  12.475   9.780
  552   1HG   LYS  74          HG2       LYS  74   0.356  13.135   8.309
  553   2HG   LYS  74          HG1       LYS  74   0.023  13.648   9.962
  554   1HD   LYS  74          HD2       LYS  74  -0.442  11.120  10.414
  555   2HD   LYS  74          HD1       LYS  74   0.421  10.851   8.900
  556   1HE   LYS  74          HE2       LYS  74   2.374  12.054   9.774
  557   2HE   LYS  74          HE1       LYS  74   1.513  12.386  11.276
  558   1HZ   LYS  74          HZ1       LYS  74   1.428  10.083  11.778
  559   2HZ   LYS  74          HZ2       LYS  74   3.036  10.442  11.363
  560   3HZ   LYS  74          HZ3       LYS  74   2.024   9.652  10.250
  561    H    VAL  75           HN       VAL  75  -3.492  10.177   6.726
  562    HA   VAL  75           HA       VAL  75  -5.754  12.058   6.229
  563    HB   VAL  75           HB       VAL  75  -5.363   9.198   5.310
  564   1HG1  VAL  75          HG11      VAL  75  -7.701   9.814   5.327
  565   2HG1  VAL  75          HG12      VAL  75  -7.139   9.901   3.660
  566   3HG1  VAL  75          HG13      VAL  75  -7.344  11.378   4.598
  567   1HG2  VAL  75          HG21      VAL  75  -4.773  10.223   3.147
  568   2HG2  VAL  75          HG22      VAL  75  -3.653  10.752   4.405
  569   3HG2  VAL  75          HG23      VAL  75  -4.943  11.827   3.860
  570    H    SER  76           HN       SER  76  -7.569  11.980   7.462
  571    HA   SER  76           HA       SER  76  -7.788   9.869   9.538
  572   1HB   SER  76          HB2       SER  76  -9.568  11.270  10.470
  573   2HB   SER  76          HB1       SER  76  -8.143  12.258  10.163
  574    HG   SER  76           HG       SER  76 -10.626  12.455   9.135
  575    H    ALA  77           HN       ALA  77 -10.071   8.940   9.821
  576    HA   ALA  77           HA       ALA  77 -10.854   7.592   7.440
  577   1HB   ALA  77          HB1       ALA  77 -12.655   6.683   8.729
  578   2HB   ALA  77          HB2       ALA  77 -12.622   8.043   9.852
  579   3HB   ALA  77          HB3       ALA  77 -11.298   6.877   9.840
  580    H    GLY  78           HN       GLY  78 -11.648  10.753   8.573
  581   1HA   GLY  78          HA2       GLY  78 -14.133  10.891   6.961
  582   2HA   GLY  78          HA1       GLY  78 -13.502  12.165   8.001
  583    H    GLN  79           HN       GLN  79 -10.782  12.035   6.836
  584    HA   GLN  79           HA       GLN  79 -11.342  13.723   4.480
  585   1HB   GLN  79          HB2       GLN  79  -8.761  12.986   5.888
  586   2HB   GLN  79          HB1       GLN  79  -8.865  14.089   4.517
  587   1HG   GLN  79          HG2       GLN  79 -10.239  15.630   5.767
  588   2HG   GLN  79          HG1       GLN  79 -10.394  14.484   7.101
  589   1HE2  GLN  79          HE21      GLN  79  -9.236  17.160   7.380
  590   2HE2  GLN  79          HE22      GLN  79  -7.609  16.955   7.819
  591    H    PHE  80           HN       PHE  80 -11.208  13.005   2.419
  592    HA   PHE  80           HA       PHE  80  -9.619  10.532   1.827
  593   1HB   PHE  80          HB2       PHE  80 -12.411  11.230   0.886
  594   2HB   PHE  80          HB1       PHE  80 -11.417   9.977   0.152
  595    HD1  PHE  80           HD1      PHE  80 -13.635  10.788   2.871
  596    HD2  PHE  80           HD2      PHE  80 -10.514   8.102   1.647
  597    HE1  PHE  80           HE1      PHE  80 -14.304   9.197   4.652
  598    HE2  PHE  80           HE2      PHE  80 -11.183   6.512   3.427
  599    HZ   PHE  80           HZ       PHE  80 -13.079   7.059   4.930
  600    H    SER  81           HN       SER  81  -8.655  10.521  -0.288
  601    HA   SER  81           HA       SER  81  -8.700  13.185  -1.685
  602   1HB   SER  81          HB2       SER  81  -6.335  11.315  -1.566
  603   2HB   SER  81          HB1       SER  81  -6.366  12.993  -2.099
  604    HG   SER  81           HG       SER  81  -7.241  12.361   0.488
  605    H    SER  82           HN       SER  82  -7.970   9.700  -2.250
  606    HA   SER  82           HA       SER  82  -8.446  10.145  -5.154
  607   1HB   SER  82          HB2       SER  82  -6.425   8.892  -4.232
  608   2HB   SER  82          HB1       SER  82  -7.540   7.588  -3.833
  609    HG   SER  82           HG       SER  82  -6.843   7.147  -5.860
  610    H    LEU  83           HN       LEU  83 -10.386   9.249  -2.574
  611    HA   LEU  83           HA       LEU  83 -11.871   7.143  -4.047
  612   1HB   LEU  83          HB2       LEU  83 -12.115   8.392  -1.316
  613   2HB   LEU  83          HB1       LEU  83 -13.429   7.426  -1.967
  614    HG   LEU  83           HG       LEU  83 -11.750   5.574  -2.364
  615   1HD1  LEU  83          HD11      LEU  83  -9.666   5.779  -0.917
  616   2HD1  LEU  83          HD12      LEU  83 -10.020   7.501  -0.792
  617   3HD1  LEU  83          HD13      LEU  83  -9.677   6.784  -2.366
  618   1HD2  LEU  83          HD21      LEU  83 -12.324   6.624   0.413
  619   2HD2  LEU  83          HD22      LEU  83 -11.556   5.061   0.139
  620   3HD2  LEU  83          HD23      LEU  83 -13.183   5.362  -0.471
  621    H    HIS  84           HN       HIS  84 -11.694  10.031  -4.998
  622    HA   HIS  84           HA       HIS  84 -14.341  11.169  -4.640
  623   1HB   HIS  84          HB2       HIS  84 -12.354  11.688  -6.870
  624   2HB   HIS  84          HB1       HIS  84 -13.687  12.735  -6.383
  625    HD1  HIS  84           HD1      HIS  84 -12.766  11.741  -3.254
  626    HD2  HIS  84           HD2      HIS  84 -10.752  14.057  -6.070
  627    HE1  HIS  84           HE1      HIS  84 -11.056  13.093  -1.976
  628    H    VAL  85           HN       VAL  85 -12.782   9.150  -7.078
  629    HA   VAL  85           HA       VAL  85 -15.093   9.158  -8.847
  630    HB   VAL  85           HB       VAL  85 -12.812   7.170  -8.811
  631   1HG1  VAL  85          HG11      VAL  85 -14.638   8.241 -10.983
  632   2HG1  VAL  85          HG12      VAL  85 -14.680   6.618 -10.292
  633   3HG1  VAL  85          HG13      VAL  85 -13.294   7.132 -11.254
  634   1HG2  VAL  85          HG21      VAL  85 -11.822   9.385  -8.776
  635   2HG2  VAL  85          HG22      VAL  85 -12.961   9.960  -9.994
  636   3HG2  VAL  85          HG23      VAL  85 -11.728   8.775 -10.428
  637    H    ARG  86           HN       ARG  86 -16.601   7.443  -9.111
  638    HA   ARG  86           HA       ARG  86 -16.994   5.822  -6.670
  639   1HB   ARG  86          HB2       ARG  86 -18.669   6.245  -9.159
  640   2HB   ARG  86          HB1       ARG  86 -19.130   5.154  -7.852
  641   1HG   ARG  86          HG2       ARG  86 -19.048   7.032  -6.254
  642   2HG   ARG  86          HG1       ARG  86 -18.593   8.124  -7.562
  643   1HD   ARG  86          HD2       ARG  86 -21.150   6.501  -7.502
  644   2HD   ARG  86          HD1       ARG  86 -21.038   8.197  -7.039
  645    HE   ARG  86           HE       ARG  86 -19.954   8.113  -9.598
  646   1HH1  ARG  86          HH21      ARG  86 -22.864   7.109  -8.052
  647   2HH1  ARG  86          HH22      ARG  86 -23.849   7.332  -9.459
  648   1HH2  ARG  86          HH11      ARG  86 -21.225   8.413 -11.451
  649   2HH2  ARG  86          HH12      ARG  86 -22.921   8.067 -11.383
  650    H    ASP  87           HN       ASP  87 -14.914   4.650  -7.333
  651    HA   ASP  87           HA       ASP  87 -15.202   2.695  -9.510
  652   1HB   ASP  87          HB2       ASP  87 -13.080   3.144  -7.389
  653   2HB   ASP  87          HB1       ASP  87 -13.002   1.842  -8.577
  654    H    THR  88           HN       THR  88 -14.795   0.301  -8.852
  655    HA   THR  88           HA       THR  88 -16.728  -0.336  -6.701
  656    HB   THR  88           HB       THR  88 -16.614  -2.617  -7.567
  657    HG1  THR  88           HG1      THR  88 -15.110  -2.351  -9.690
  658   1HG2  THR  88          HG21      THR  88 -16.768  -0.453  -9.676
  659   2HG2  THR  88          HG22      THR  88 -18.103  -1.182  -8.784
  660   3HG2  THR  88          HG23      THR  88 -17.220  -2.130  -9.980
  661    H    LYS  89           HN       LYS  89 -16.136  -1.999  -5.072
  662    HA   LYS  89           HA       LYS  89 -13.435  -1.467  -4.017
  663   1HB   LYS  89          HB2       LYS  89 -15.720  -3.117  -2.901
  664   2HB   LYS  89          HB1       LYS  89 -14.218  -2.755  -2.057
  665   1HG   LYS  89          HG2       LYS  89 -14.712  -0.348  -2.181
  666   2HG   LYS  89          HG1       LYS  89 -16.221  -0.703  -3.028
  667   1HD   LYS  89          HD2       LYS  89 -16.999  -2.028  -1.098
  668   2HD   LYS  89          HD1       LYS  89 -15.496  -1.672  -0.248
  669   1HE   LYS  89          HE2       LYS  89 -16.013   0.648  -0.099
  670   2HE   LYS  89          HE1       LYS  89 -17.332   0.501  -1.262
  671   1HZ   LYS  89          HZ1       LYS  89 -18.589  -0.771   0.279
  672   2HZ   LYS  89          HZ2       LYS  89 -18.045   0.612   1.102
  673   3HZ   LYS  89          HZ3       LYS  89 -17.286  -0.886   1.358
  674    H    ILE  90           HN       ILE  90 -11.942  -3.144  -3.491
  675    HA   ILE  90           HA       ILE  90 -12.367  -5.763  -4.888
  676    HB   ILE  90           HB       ILE  90  -9.955  -5.681  -5.528
  677   1HG1  ILE  90          HG12      ILE  90 -10.113  -2.763  -4.713
  678   2HG1  ILE  90          HG11      ILE  90  -9.352  -3.999  -3.713
  679   1HG2  ILE  90          HG21      ILE  90 -10.249  -4.043  -7.349
  680   2HG2  ILE  90          HG22      ILE  90 -11.625  -3.341  -6.499
  681   3HG2  ILE  90          HG23      ILE  90 -11.718  -4.990  -7.116
  682   1HD1  ILE  90          HD11      ILE  90  -7.881  -4.574  -5.670
  683   2HD1  ILE  90          HD12      ILE  90  -7.624  -2.951  -5.030
  684   3HD1  ILE  90          HD13      ILE  90  -8.551  -3.177  -6.513
  685    H    GLU  91           HN       GLU  91 -11.008  -7.502  -3.984
  686    HA   GLU  91           HA       GLU  91 -11.038  -7.516  -1.113
  687   1HB   GLU  91          HB2       GLU  91  -9.589  -9.347  -3.052
  688   2HB   GLU  91          HB1       GLU  91  -9.858  -9.683  -1.341
  689   1HG   GLU  91          HG2       GLU  91 -12.103  -9.129  -3.296
  690   2HG   GLU  91          HG1       GLU  91 -11.542 -10.754  -2.900
  691    H    VAL  92           HN       VAL  92  -9.310  -7.305   0.369
  692    HA   VAL  92           HA       VAL  92  -7.255  -5.457  -0.264
  693    HB   VAL  92           HB       VAL  92  -7.474  -7.497   1.965
  694   1HG1  VAL  92          HG11      VAL  92  -5.427  -5.313   1.494
  695   2HG1  VAL  92          HG12      VAL  92  -5.125  -7.026   1.781
  696   3HG1  VAL  92          HG13      VAL  92  -5.733  -6.009   3.086
  697   1HG2  VAL  92          HG21      VAL  92  -9.114  -5.530   1.729
  698   2HG2  VAL  92          HG22      VAL  92  -7.734  -4.487   2.078
  699   3HG2  VAL  92          HG23      VAL  92  -8.269  -5.670   3.271
  700    H    ALA  93           HN       ALA  93  -7.179  -9.021  -0.203
  701    HA   ALA  93           HA       ALA  93  -4.419  -9.418  -0.590
  702   1HB   ALA  93          HB1       ALA  93  -4.989 -11.560  -1.567
  703   2HB   ALA  93          HB2       ALA  93  -6.616 -11.000  -1.955
  704   3HB   ALA  93          HB3       ALA  93  -6.141 -11.229  -0.273
  705    H    GLN  94           HN       GLN  94  -6.930  -8.598  -2.958
  706    HA   GLN  94           HA       GLN  94  -5.134  -8.746  -5.239
  707   1HB   GLN  94          HB2       GLN  94  -7.821  -7.380  -4.865
  708   2HB   GLN  94          HB1       GLN  94  -6.986  -7.527  -6.411
  709   1HG   GLN  94          HG2       GLN  94  -7.044  -9.986  -6.214
  710   2HG   GLN  94          HG1       GLN  94  -7.878  -9.842  -4.666
  711   1HE2  GLN  94          HE21      GLN  94  -9.024 -11.143  -7.027
  712   2HE2  GLN  94          HE22      GLN  94 -10.390 -10.243  -7.477
  713    H    PHE  95           HN       PHE  95  -6.262  -6.235  -3.042
  714    HA   PHE  95           HA       PHE  95  -5.238  -3.954  -4.391
  715   1HB   PHE  95          HB2       PHE  95  -6.759  -3.838  -2.449
  716   2HB   PHE  95          HB1       PHE  95  -5.481  -4.472  -1.413
  717    HD1  PHE  95           HD1      PHE  95  -6.659  -1.556  -3.325
  718    HD2  PHE  95           HD2      PHE  95  -3.528  -3.133  -0.843
  719    HE1  PHE  95           HE1      PHE  95  -5.758   0.733  -3.001
  720    HE2  PHE  95           HE2      PHE  95  -2.630  -0.850  -0.520
  721    HZ   PHE  95           HZ       PHE  95  -3.744   1.078  -1.597
  722    H    VAL  96           HN       VAL  96  -3.709  -5.979  -1.865
  723    HA   VAL  96           HA       VAL  96  -1.238  -4.559  -1.793
  724    HB   VAL  96           HB       VAL  96  -1.722  -7.502  -1.246
  725   1HG1  VAL  96          HG11      VAL  96   0.474  -5.584  -0.421
  726   2HG1  VAL  96          HG12      VAL  96   0.644  -7.026  -1.422
  727   3HG1  VAL  96          HG13      VAL  96   0.246  -7.180   0.290
  728   1HG2  VAL  96          HG21      VAL  96  -3.159  -5.749   0.004
  729   2HG2  VAL  96          HG22      VAL  96  -1.656  -5.268   0.789
  730   3HG2  VAL  96          HG23      VAL  96  -2.265  -6.912   0.983
  731    H    LYS  97           HN       LYS  97  -2.126  -7.517  -3.610
  732    HA   LYS  97           HA       LYS  97   0.399  -7.884  -4.854
  733   1HB   LYS  97          HB2       LYS  97  -2.392  -8.626  -5.747
  734   2HB   LYS  97          HB1       LYS  97  -0.935  -9.140  -6.601
  735   1HG   LYS  97          HG2       LYS  97  -0.091 -10.193  -4.538
  736   2HG   LYS  97          HG1       LYS  97  -1.546  -9.685  -3.682
  737   1HD   LYS  97          HD2       LYS  97  -2.927 -11.019  -5.229
  738   2HD   LYS  97          HD1       LYS  97  -1.471 -11.532  -6.085
  739   1HE   LYS  97          HE2       LYS  97  -0.621 -12.603  -4.051
  740   2HE   LYS  97          HE1       LYS  97  -2.029 -12.043  -3.148
  741   1HZ   LYS  97          HZ1       LYS  97  -3.451 -13.395  -4.428
  742   2HZ   LYS  97          HZ2       LYS  97  -2.142 -14.384  -3.987
  743   3HZ   LYS  97          HZ3       LYS  97  -2.238 -13.749  -5.560
  744    H    ASP  98           HN       ASP  98  -2.445  -6.033  -6.024
  745    HA   ASP  98           HA       ASP  98  -1.283  -5.293  -8.525
  746   1HB   ASP  98          HB2       ASP  98  -3.269  -3.848  -6.743
  747   2HB   ASP  98          HB1       ASP  98  -2.842  -3.297  -8.363
  748    H    LEU  99           HN       LEU  99  -1.098  -3.870  -5.300
  749    HA   LEU  99           HA       LEU  99   0.415  -1.560  -6.017
  750   1HB   LEU  99          HB2       LEU  99  -0.728  -1.795  -3.845
  751   2HB   LEU  99          HB1       LEU  99   0.361  -3.108  -3.407
  752    HG   LEU  99           HG       LEU  99   2.284  -1.570  -3.534
  753   1HD1  LEU  99          HD11      LEU  99   1.569   0.962  -3.606
  754   2HD1  LEU  99          HD12      LEU  99   0.149   0.349  -4.454
  755   3HD1  LEU  99          HD13      LEU  99   1.761   0.079  -5.119
  756   1HD2  LEU  99          HD21      LEU  99   0.048  -0.404  -1.851
  757   2HD2  LEU  99          HD22      LEU  99   1.779  -0.300  -1.527
  758   3HD2  LEU  99          HD23      LEU  99   0.953  -1.854  -1.419
  759    H    LEU 100           HN       LEU 100   1.383  -4.852  -5.108
  760    HA   LEU 100           HA       LEU 100   4.164  -4.475  -4.852
  761   1HB   LEU 100          HB2       LEU 100   3.176  -6.580  -4.246
  762   2HB   LEU 100          HB1       LEU 100   2.579  -6.838  -5.880
  763    HG   LEU 100           HG       LEU 100   4.853  -7.091  -6.723
  764   1HD1  LEU 100          HD11      LEU 100   5.595  -6.275  -3.911
  765   2HD1  LEU 100          HD12      LEU 100   6.149  -5.579  -5.433
  766   3HD1  LEU 100          HD13      LEU 100   6.717  -7.171  -4.936
  767   1HD2  LEU 100          HD21      LEU 100   5.546  -9.091  -5.363
  768   2HD2  LEU 100          HD22      LEU 100   3.852  -9.110  -5.851
  769   3HD2  LEU 100          HD23      LEU 100   4.289  -8.668  -4.201
  770    H    LEU 101           HN       LEU 101   2.335  -5.196  -7.875
  771    HA   LEU 101           HA       LEU 101   4.653  -5.328  -9.524
  772   1HB   LEU 101          HB2       LEU 101   1.778  -4.639 -10.093
  773   2HB   LEU 101          HB1       LEU 101   2.984  -4.541 -11.372
  774    HG   LEU 101           HG       LEU 101   1.763  -6.746 -11.259
  775   1HD1  LEU 101          HD11      LEU 101   4.647  -7.322 -10.632
  776   2HD1  LEU 101          HD12      LEU 101   4.260  -6.350 -12.050
  777   3HD1  LEU 101          HD13      LEU 101   3.618  -7.982 -11.897
  778   1HD2  LEU 101          HD21      LEU 101   3.402  -7.247  -8.770
  779   2HD2  LEU 101          HD22      LEU 101   2.119  -8.249  -9.452
  780   3HD2  LEU 101          HD23      LEU 101   1.730  -6.702  -8.712
  781    H    HIS 102           HN       HIS 102   2.676  -2.498  -8.613
  782    HA   HIS 102           HA       HIS 102   4.221  -0.678 -10.243
  783   1HB   HIS 102          HB2       HIS 102   2.248  -0.319  -7.997
  784   2HB   HIS 102          HB1       HIS 102   3.166   1.065  -8.594
  785    HD1  HIS 102           HD1      HIS 102   2.746   1.823 -11.038
  786    HD2  HIS 102           HD2      HIS 102   0.321  -1.331  -9.813
  787    HE1  HIS 102           HE1      HIS 102   0.947   1.593 -12.798
  788    H    LEU 103           HN       LEU 103   4.470  -1.639  -6.818
  789    HA   LEU 103           HA       LEU 103   6.375   0.309  -6.052
  790   1HB   LEU 103          HB2       LEU 103   6.057  -2.569  -5.164
  791   2HB   LEU 103          HB1       LEU 103   7.167  -1.443  -4.390
  792    HG   LEU 103           HG       LEU 103   4.195  -0.922  -4.701
  793   1HD1  LEU 103          HD11      LEU 103   4.271  -2.783  -3.252
  794   2HD1  LEU 103          HD12      LEU 103   4.264  -1.412  -2.147
  795   3HD1  LEU 103          HD13      LEU 103   5.773  -2.254  -2.498
  796   1HD2  LEU 103          HD21      LEU 103   4.849   0.626  -2.660
  797   2HD2  LEU 103          HD22      LEU 103   5.179   1.171  -4.299
  798   3HD2  LEU 103          HD23      LEU 103   6.477   0.489  -3.321
  799    H    LYS 104           HN       LYS 104   7.003  -2.953  -7.409
  800    HA   LYS 104           HA       LYS 104   9.851  -2.556  -7.539
  801   1HB   LYS 104          HB2       LYS 104   9.838  -4.521  -9.047
  802   2HB   LYS 104          HB1       LYS 104   8.876  -4.799  -7.598
  803   1HG   LYS 104          HG2       LYS 104   6.823  -4.229  -8.855
  804   2HG   LYS 104          HG1       LYS 104   7.787  -3.967 -10.307
  805   1HD   LYS 104          HD2       LYS 104   7.035  -6.171 -10.592
  806   2HD   LYS 104          HD1       LYS 104   8.638  -6.401  -9.902
  807   1HE   LYS 104          HE2       LYS 104   7.071  -6.227  -7.621
  808   2HE   LYS 104          HE1       LYS 104   5.999  -7.052  -8.746
  809   1HZ   LYS 104          HZ1       LYS 104   8.484  -8.188  -9.094
  810   2HZ   LYS 104          HZ2       LYS 104   7.130  -8.882  -8.339
  811   3HZ   LYS 104          HZ3       LYS 104   8.284  -8.045  -7.416
  812    H    LYS 105           HN       LYS 105   7.223  -1.614  -9.638
  813    HA   LYS 105           HA       LYS 105   8.687  -1.287 -12.066
  814   1HB   LYS 105          HB2       LYS 105   6.222  -1.237 -11.935
  815   2HB   LYS 105          HB1       LYS 105   6.301   0.288 -11.056
  816   1HG   LYS 105          HG2       LYS 105   7.401   1.357 -12.985
  817   2HG   LYS 105          HG1       LYS 105   7.349  -0.170 -13.866
  818   1HD   LYS 105          HD2       LYS 105   4.872  -0.161 -13.689
  819   2HD   LYS 105          HD1       LYS 105   4.952   1.400 -12.872
  820   1HE   LYS 105          HE2       LYS 105   4.496   1.760 -15.242
  821   2HE   LYS 105          HE1       LYS 105   6.119   2.341 -14.867
  822   1HZ   LYS 105          HZ1       LYS 105   6.208   1.052 -16.858
  823   2HZ   LYS 105          HZ2       LYS 105   5.398  -0.249 -16.124
  824   3HZ   LYS 105          HZ3       LYS 105   6.969   0.165 -15.629
  825    H    LEU 106           HN       LEU 106   7.989   1.109  -9.482
  826    HA   LEU 106           HA       LEU 106   9.387   3.260 -10.726
  827   1HB   LEU 106          HB2       LEU 106   8.709   2.638  -7.849
  828   2HB   LEU 106          HB1       LEU 106   9.660   4.059  -8.259
  829    HG   LEU 106           HG       LEU 106   7.110   4.363  -8.029
  830   1HD1  LEU 106          HD11      LEU 106   8.698   5.990  -9.123
  831   2HD1  LEU 106          HD12      LEU 106   7.045   6.054  -9.729
  832   3HD1  LEU 106          HD13      LEU 106   8.293   5.250 -10.671
  833   1HD2  LEU 106          HD21      LEU 106   7.094   3.224 -10.835
  834   2HD2  LEU 106          HD22      LEU 106   5.716   3.745  -9.871
  835   3HD2  LEU 106          HD23      LEU 106   6.608   2.300  -9.418
  836    H    PHE 107           HN       PHE 107  10.550   0.503  -8.905
  837    HA   PHE 107           HA       PHE 107  13.118   1.493  -8.194
  838   1HB   PHE 107          HB2       PHE 107  12.212  -0.680  -7.389
  839   2HB   PHE 107          HB1       PHE 107  12.402  -1.337  -9.015
  840    HD1  PHE 107           HD1      PHE 107  14.267   0.206  -6.190
  841    HD2  PHE 107           HD2      PHE 107  14.513  -2.121  -9.790
  842    HE1  PHE 107           HE1      PHE 107  16.653  -0.258  -5.723
  843    HE2  PHE 107           HE2      PHE 107  16.903  -2.595  -9.318
  844    HZ   PHE 107           HZ       PHE 107  17.973  -1.663  -7.283
  845    H    ARG 108           HN       ARG 108  11.987  -0.015 -11.213
  846    HA   ARG 108           HA       ARG 108  14.526  -0.237 -12.474
  847   1HB   ARG 108          HB2       ARG 108  11.762   0.200 -13.640
  848   2HB   ARG 108          HB1       ARG 108  13.190  -0.117 -14.624
  849   1HG   ARG 108          HG2       ARG 108  13.556  -2.221 -13.284
  850   2HG   ARG 108          HG1       ARG 108  11.997  -1.931 -12.511
  851   1HD   ARG 108          HD2       ARG 108  12.464  -2.291 -15.487
  852   2HD   ARG 108          HD1       ARG 108  11.732  -3.475 -14.404
  853    HE   ARG 108           HE       ARG 108  10.119  -1.275 -14.070
  854   1HH1  ARG 108          HH21      ARG 108  11.364  -3.025 -16.769
  855   2HH1  ARG 108          HH22      ARG 108   9.988  -2.716 -17.775
  856   1HH2  ARG 108          HH11      ARG 108   8.311  -0.863 -15.372
  857   2HH2  ARG 108          HH12      ARG 108   8.260  -1.496 -16.984
  858    H    GLU 109           HN       GLU 109  12.335   2.505 -12.120
  859    HA   GLU 109           HA       GLU 109  13.950   4.190 -13.924
  860   1HB   GLU 109          HB2       GLU 109  11.588   4.833 -12.131
  861   2HB   GLU 109          HB1       GLU 109  12.319   5.952 -13.282
  862   1HG   GLU 109          HG2       GLU 109  11.219   3.246 -14.077
  863   2HG   GLU 109          HG1       GLU 109  10.270   4.732 -14.145
  864    H    GLY 110           HN       GLY 110  14.019   3.292 -10.628
  865   1HA   GLY 110          HA2       GLY 110  15.354   4.050  -8.855
  866   2HA   GLY 110          HA1       GLY 110  16.293   4.935 -10.059
  867    H    ARG 111           HN       ARG 111  13.040   5.766 -10.314
  868    HA   ARG 111           HA       ARG 111  13.554   8.358  -8.946
  869   1HB   ARG 111          HB2       ARG 111  11.404   7.406 -10.856
  870   2HB   ARG 111          HB1       ARG 111  11.307   8.955 -10.020
  871   1HG   ARG 111          HG2       ARG 111  13.474   9.612 -10.988
  872   2HG   ARG 111          HG1       ARG 111  13.571   8.071 -11.836
  873   1HD   ARG 111          HD2       ARG 111  11.428   8.618 -12.986
  874   2HD   ARG 111          HD1       ARG 111  11.432  10.199 -12.215
  875    HE   ARG 111           HE       ARG 111  12.878   9.422 -14.587
  876   1HH1  ARG 111          HH21      ARG 111  13.255  11.252 -11.684
  877   2HH1  ARG 111          HH22      ARG 111  14.648  12.104 -12.259
  878   1HH2  ARG 111          HH11      ARG 111  14.681  10.523 -15.338
  879   2HH2  ARG 111          HH12      ARG 111  15.455  11.692 -14.320
  880    H    PHE 112           HN       PHE 112  13.314   7.811  -6.776
  881    HA   PHE 112           HA       PHE 112  10.867   6.401  -5.890
  882   1HB   PHE 112          HB2       PHE 112  13.158   7.515  -4.248
  883   2HB   PHE 112          HB1       PHE 112  11.947   6.337  -3.728
  884    HD1  PHE 112           HD1      PHE 112  11.870   4.077  -4.773
  885    HD2  PHE 112           HD2      PHE 112  15.037   6.856  -5.595
  886    HE1  PHE 112           HE1      PHE 112  13.243   2.241  -5.710
  887    HE2  PHE 112           HE2      PHE 112  16.410   5.015  -6.533
  888    HZ   PHE 112           HZ       PHE 112  15.512   2.705  -6.588
  889    H    ASN 113           HN       ASN 113   9.204   7.401  -4.781
  890    HA   ASN 113           HA       ASN 113   7.796   9.195  -4.227
  891   1HB   ASN 113          HB2       ASN 113   9.345   9.119  -2.271
  892   2HB   ASN 113          HB1       ASN 113  10.388  10.284  -3.087
  893   1HD2  ASN 113          HD21      ASN 113   7.135   9.885  -1.659
  894   2HD2  ASN 113          HD22      ASN 113   6.843  11.546  -1.461
  Start of MODEL   22
    1   1H    MET   1           HT1      MET   1  19.252   2.933  12.234
    2   2H    MET   1           HT2      MET   1  19.701   1.994  13.576
    3   3H    MET   1           HT3      MET   1  20.892   2.654  12.559
    4    HA   MET   1           HA       MET   1  19.320   3.927  14.665
    5   1HB   MET   1          HB2       MET   1  22.117   4.202  13.531
    6   2HB   MET   1          HB1       MET   1  21.488   5.221  14.824
    7   1HG   MET   1          HG2       MET   1  21.055   3.215  16.197
    8   2HG   MET   1          HG1       MET   1  21.697   2.198  14.909
    9   1HE   MET   1          HE1       MET   1  23.733   2.532  13.801
   10   2HE   MET   1          HE2       MET   1  25.264   2.665  14.659
   11   3HE   MET   1          HE3       MET   1  24.518   4.108  13.978
   12    H    GLY   2           HN       GLY   2  21.358   5.322  12.099
   13   1HA   GLY   2          HA2       GLY   2  19.715   7.683  11.941
   14   2HA   GLY   2          HA1       GLY   2  21.026   7.277  10.834
   15    HA   PRO   3           HA       PRO   3  16.596   6.506   9.028
   16   1HB   PRO   3          HB2       PRO   3  16.799   8.647   7.184
   17   2HB   PRO   3          HB1       PRO   3  15.829   8.626   8.661
   18   1HG   PRO   3          HG2       PRO   3  18.433   9.956   8.143
   19   2HG   PRO   3          HG1       PRO   3  17.170  10.377   9.308
   20   1HD   PRO   3          HD2       PRO   3  19.591   9.180   9.986
   21   2HD   PRO   3          HD1       PRO   3  18.112   9.079  10.976
   22    H    VAL   4           HN       VAL   4  16.558   5.067   7.326
   23    HA   VAL   4           HA       VAL   4  18.994   4.620   5.787
   24    HB   VAL   4           HB       VAL   4  17.589   2.780   4.749
   25   1HG1  VAL   4          HG11      VAL   4  17.381   1.510   6.935
   26   2HG1  VAL   4          HG12      VAL   4  17.838   3.003   7.756
   27   3HG1  VAL   4          HG13      VAL   4  18.965   2.228   6.641
   28   1HG2  VAL   4          HG21      VAL   4  15.395   2.345   5.650
   29   2HG2  VAL   4          HG22      VAL   4  15.415   4.026   5.122
   30   3HG2  VAL   4          HG23      VAL   4  15.568   3.638   6.835
   31    HA   PRO   5           HA       PRO   5  17.828   7.148   2.305
   32   1HB   PRO   5          HB2       PRO   5  18.754   5.462   0.218
   33   2HB   PRO   5          HB1       PRO   5  19.685   6.709   1.055
   34   1HG   PRO   5          HG2       PRO   5  19.800   3.774   1.366
   35   2HG   PRO   5          HG1       PRO   5  21.017   4.988   1.769
   36   1HD   PRO   5          HD2       PRO   5  19.443   3.604   3.635
   37   2HD   PRO   5          HD1       PRO   5  20.305   5.129   3.956
   38    HA   PRO   6           HA       PRO   6  13.942   5.738   0.679
   39   1HB   PRO   6          HB2       PRO   6  14.222   6.571  -2.034
   40   2HB   PRO   6          HB1       PRO   6  13.509   7.493  -0.706
   41   1HG   PRO   6          HG2       PRO   6  16.100   7.869  -2.021
   42   2HG   PRO   6          HG1       PRO   6  15.245   8.955  -0.919
   43   1HD   PRO   6          HD2       PRO   6  17.565   7.418  -0.310
   44   2HD   PRO   6          HD1       PRO   6  16.539   8.300   0.850
   45    H    SER   7           HN       SER   7  16.528   5.090  -1.703
   46    HA   SER   7           HA       SER   7  15.228   2.946  -3.034
   47   1HB   SER   7          HB2       SER   7  17.430   2.362  -3.882
   48   2HB   SER   7          HB1       SER   7  17.293   4.117  -3.833
   49    HG   SER   7           HG       SER   7  19.157   2.703  -2.745
   50    H    THR   8           HN       THR   8  17.328   2.946  -0.172
   51    HA   THR   8           HA       THR   8  17.401   0.066   0.057
   52    HB   THR   8           HB       THR   8  17.860   2.211   2.148
   53    HG1  THR   8           HG1      THR   8  19.999   0.839   1.244
   54   1HG2  THR   8          HG21      THR   8  19.156   0.376   3.280
   55   2HG2  THR   8          HG22      THR   8  18.460  -0.756   2.121
   56   3HG2  THR   8          HG23      THR   8  17.414   0.108   3.248
   57    H    ALA   9           HN       ALA   9  15.372   2.573   1.579
   58    HA   ALA   9           HA       ALA   9  13.917   0.812   3.287
   59   1HB   ALA   9          HB1       ALA   9  12.947   3.362   1.957
   60   2HB   ALA   9          HB2       ALA   9  13.851   3.290   3.470
   61   3HB   ALA   9          HB3       ALA   9  12.233   2.595   3.375
   62    H    LEU  10           HN       LEU  10  13.334   1.846  -0.069
   63    HA   LEU  10           HA       LEU  10  10.828   0.543  -0.380
   64   1HB   LEU  10          HB2       LEU  10  11.678   2.185  -2.000
   65   2HB   LEU  10          HB1       LEU  10  12.970   1.077  -2.460
   66    HG   LEU  10           HG       LEU  10  11.293  -0.562  -3.243
   67   1HD1  LEU  10          HD11      LEU  10   8.897   0.482  -3.501
   68   2HD1  LEU  10          HD12      LEU  10   9.389   1.501  -2.149
   69   3HD1  LEU  10          HD13      LEU  10   9.354  -0.254  -1.968
   70   1HD2  LEU  10          HD21      LEU  10  11.192   2.258  -4.321
   71   2HD2  LEU  10          HD22      LEU  10  10.315   0.944  -5.102
   72   3HD2  LEU  10          HD23      LEU  10  12.065   0.863  -4.953
   73    H    ARG  11           HN       ARG  11  14.129  -0.644  -1.119
   74    HA   ARG  11           HA       ARG  11  13.330  -3.208  -2.073
   75   1HB   ARG  11          HB2       ARG  11  15.850  -2.315  -0.638
   76   2HB   ARG  11          HB1       ARG  11  15.643  -3.919  -1.346
   77   1HG   ARG  11          HG2       ARG  11  15.414  -3.030  -3.546
   78   2HG   ARG  11          HG1       ARG  11  15.230  -1.387  -2.940
   79   1HD   ARG  11          HD2       ARG  11  17.468  -1.617  -3.801
   80   2HD   ARG  11          HD1       ARG  11  17.578  -1.496  -2.055
   81    HE   ARG  11           HE       ARG  11  18.196  -3.804  -3.849
   82   1HH1  ARG  11          HH21      ARG  11  17.552  -2.805  -0.613
   83   2HH1  ARG  11          HH22      ARG  11  18.101  -4.293   0.079
   84   1HH2  ARG  11          HH11      ARG  11  18.924  -5.717  -2.970
   85   2HH2  ARG  11          HH12      ARG  11  18.881  -5.939  -1.253
   86    H    GLU  12           HN       GLU  12  14.005  -2.008   1.187
   87    HA   GLU  12           HA       GLU  12  13.733  -4.526   2.527
   88   1HB   GLU  12          HB2       GLU  12  13.335  -1.668   3.456
   89   2HB   GLU  12          HB1       GLU  12  13.271  -3.060   4.541
   90   1HG   GLU  12          HG2       GLU  12  15.632  -2.456   2.743
   91   2HG   GLU  12          HG1       GLU  12  15.531  -1.930   4.423
   92    H    LEU  13           HN       LEU  13  11.411  -1.973   1.681
   93    HA   LEU  13           HA       LEU  13   9.176  -3.192   3.033
   94   1HB   LEU  13          HB2       LEU  13   9.222  -0.801   2.437
   95   2HB   LEU  13          HB1       LEU  13   9.238  -1.219   0.728
   96    HG   LEU  13           HG       LEU  13   7.027  -2.315   0.982
   97   1HD1  LEU  13          HD11      LEU  13   7.437  -1.501   3.857
   98   2HD1  LEU  13          HD12      LEU  13   6.882  -3.046   3.214
   99   3HD1  LEU  13          HD13      LEU  13   5.807  -1.652   3.201
  100   1HD2  LEU  13          HD21      LEU  13   5.759  -0.288   1.090
  101   2HD2  LEU  13          HD22      LEU  13   7.341   0.161   0.452
  102   3HD2  LEU  13          HD23      LEU  13   6.950   0.478   2.142
  103    H    ILE  14           HN       ILE  14  10.363  -3.336  -0.331
  104    HA   ILE  14           HA       ILE  14   8.177  -4.827  -1.387
  105    HB   ILE  14           HB       ILE  14  11.098  -4.744  -2.201
  106   1HG1  ILE  14          HG12      ILE  14   8.613  -3.530  -3.457
  107   2HG1  ILE  14          HG11      ILE  14   9.698  -2.656  -2.378
  108   1HG2  ILE  14          HG21      ILE  14  10.162  -5.691  -4.391
  109   2HG2  ILE  14          HG22      ILE  14   8.715  -6.106  -3.477
  110   3HG2  ILE  14          HG23      ILE  14  10.263  -6.828  -3.047
  111   1HD1  ILE  14          HD11      ILE  14  11.539  -2.884  -3.916
  112   2HD1  ILE  14          HD12      ILE  14  10.154  -2.303  -4.841
  113   3HD1  ILE  14          HD13      ILE  14  10.624  -4.000  -4.930
  114    H    GLU  15           HN       GLU  15  11.280  -5.976  -0.034
  115    HA   GLU  15           HA       GLU  15  10.774  -8.751  -0.355
  116   1HB   GLU  15          HB2       GLU  15  12.408  -7.254   1.709
  117   2HB   GLU  15          HB1       GLU  15  12.422  -9.010   1.543
  118   1HG   GLU  15          HG2       GLU  15  13.154  -8.788  -0.803
  119   2HG   GLU  15          HG1       GLU  15  13.146  -7.031  -0.637
  120    H    GLU  16           HN       GLU  16   9.943  -6.567   2.345
  121    HA   GLU  16           HA       GLU  16   8.900  -8.679   4.010
  122   1HB   GLU  16          HB2       GLU  16   9.609  -6.401   4.821
  123   2HB   GLU  16          HB1       GLU  16   8.145  -5.752   4.084
  124   1HG   GLU  16          HG2       GLU  16   6.761  -7.221   5.477
  125   2HG   GLU  16          HG1       GLU  16   8.210  -7.924   6.196
  126    H    LEU  17           HN       LEU  17   7.307  -6.343   1.799
  127    HA   LEU  17           HA       LEU  17   4.639  -7.225   2.311
  128   1HB   LEU  17          HB2       LEU  17   5.875  -6.076  -0.208
  129   2HB   LEU  17          HB1       LEU  17   4.147  -6.338   0.000
  130    HG   LEU  17           HG       LEU  17   5.843  -4.608   1.824
  131   1HD1  LEU  17          HD11      LEU  17   4.735  -2.709   0.665
  132   2HD1  LEU  17          HD12      LEU  17   3.983  -3.850  -0.450
  133   3HD1  LEU  17          HD13      LEU  17   5.736  -3.658  -0.435
  134   1HD2  LEU  17          HD21      LEU  17   3.957  -5.176   3.098
  135   2HD2  LEU  17          HD22      LEU  17   2.911  -5.312   1.685
  136   3HD2  LEU  17          HD23      LEU  17   3.387  -3.723   2.283
  137    H    VAL  18           HN       VAL  18   7.068  -8.325  -0.020
  138    HA   VAL  18           HA       VAL  18   5.390 -10.251  -1.317
  139    HB   VAL  18           HB       VAL  18   8.397 -10.035  -1.014
  140   1HG1  VAL  18          HG11      VAL  18   6.703 -11.997  -2.566
  141   2HG1  VAL  18          HG12      VAL  18   8.020 -12.341  -1.445
  142   3HG1  VAL  18          HG13      VAL  18   8.368 -11.633  -3.021
  143   1HG2  VAL  18          HG21      VAL  18   6.598  -9.545  -3.405
  144   2HG2  VAL  18          HG22      VAL  18   8.315  -9.164  -3.267
  145   3HG2  VAL  18          HG23      VAL  18   7.134  -8.271  -2.308
  146    H    ASN  19           HN       ASN  19   7.580 -10.466   1.470
  147    HA   ASN  19           HA       ASN  19   7.493 -13.276   1.831
  148   1HB   ASN  19          HB2       ASN  19   7.821 -11.008   3.805
  149   2HB   ASN  19          HB1       ASN  19   7.999 -12.704   4.253
  150   1HD2  ASN  19          HD21      ASN  19  10.149 -10.682   4.276
  151   2HD2  ASN  19          HD22      ASN  19  11.328 -11.217   3.178
  152    H    ILE  20           HN       ILE  20   5.265 -10.771   3.055
  153    HA   ILE  20           HA       ILE  20   3.741 -12.707   4.599
  154    HB   ILE  20           HB       ILE  20   2.135 -10.803   4.899
  155   1HG1  ILE  20          HG12      ILE  20   4.191  -9.337   3.218
  156   2HG1  ILE  20          HG11      ILE  20   2.546  -9.711   2.715
  157   1HG2  ILE  20          HG21      ILE  20   3.661  -9.509   6.285
  158   2HG2  ILE  20          HG22      ILE  20   5.048 -10.106   5.373
  159   3HG2  ILE  20          HG23      ILE  20   4.113 -11.212   6.379
  160   1HD1  ILE  20          HD11      ILE  20   3.465  -7.800   4.858
  161   2HD1  ILE  20          HD12      ILE  20   1.823  -8.445   4.864
  162   3HD1  ILE  20          HD13      ILE  20   2.391  -7.489   3.494
  163    H    THR  21           HN       THR  21   3.632 -11.768   1.249
  164    HA   THR  21           HA       THR  21   0.818 -12.752   1.017
  165    HB   THR  21           HB       THR  21   0.910 -11.886  -1.287
  166    HG1  THR  21           HG1      THR  21   3.421 -10.783  -0.688
  167   1HG2  THR  21          HG21      THR  21   0.496 -10.421   0.852
  168   2HG2  THR  21          HG22      THR  21   0.724  -9.633  -0.709
  169   3HG2  THR  21          HG23      THR  21   2.055  -9.714   0.438
  170    H    GLN  22           HN       GLN  22   4.081 -13.795   0.387
  171    HA   GLN  22           HA       GLN  22   3.362 -15.722  -1.661
  172   1HB   GLN  22          HB2       GLN  22   5.797 -15.435   0.106
  173   2HB   GLN  22          HB1       GLN  22   5.623 -16.739  -1.069
  174   1HG   GLN  22          HG2       GLN  22   5.391 -15.126  -2.885
  175   2HG   GLN  22          HG1       GLN  22   5.438 -13.788  -1.742
  176   1HE2  GLN  22          HE21      GLN  22   7.374 -14.246  -3.922
  177   2HE2  GLN  22          HE22      GLN  22   8.888 -14.465  -3.187
  178    H    ASN  23           HN       ASN  23   3.672 -15.865   1.868
  179    HA   ASN  23           HA       ASN  23   2.965 -18.759   1.817
  180   1HB   ASN  23          HB2       ASN  23   3.587 -18.773   4.156
  181   2HB   ASN  23          HB1       ASN  23   4.853 -17.954   3.242
  182   1HD2  ASN  23          HD21      ASN  23   2.529 -15.707   3.081
  183   2HD2  ASN  23          HD22      ASN  23   2.812 -14.842   4.513
  184    H    GLN  24           HN       GLN  24   1.141 -16.061   1.639
  185    HA   GLN  24           HA       GLN  24  -0.702 -16.626   3.853
  186   1HB   GLN  24          HB2       GLN  24  -1.940 -14.752   3.130
  187   2HB   GLN  24          HB1       GLN  24  -0.280 -14.323   2.734
  188   1HG   GLN  24          HG2       GLN  24  -0.713 -15.208   0.393
  189   2HG   GLN  24          HG1       GLN  24  -2.416 -15.339   0.836
  190   1HE2  GLN  24          HE21      GLN  24  -2.212 -13.624  -1.158
  191   2HE2  GLN  24          HE22      GLN  24  -2.194 -12.002  -0.658
  192    H    LYS  25           HN       LYS  25  -2.367 -18.066   3.776
  193    HA   LYS  25           HA       LYS  25  -2.846 -19.519   1.242
  194   1HB   LYS  25          HB2       LYS  25  -2.622 -20.750   3.397
  195   2HB   LYS  25          HB1       LYS  25  -4.056 -19.918   3.998
  196   1HG   LYS  25          HG2       LYS  25  -5.426 -20.905   2.252
  197   2HG   LYS  25          HG1       LYS  25  -4.006 -21.636   1.503
  198   1HD   LYS  25          HD2       LYS  25  -3.615 -22.913   3.626
  199   2HD   LYS  25          HD1       LYS  25  -5.142 -22.277   4.240
  200   1HE   LYS  25          HE2       LYS  25  -6.273 -23.251   2.209
  201   2HE   LYS  25          HE1       LYS  25  -4.745 -24.030   1.801
  202   1HZ   LYS  25          HZ1       LYS  25  -4.892 -24.872   4.234
  203   2HZ   LYS  25          HZ2       LYS  25  -5.787 -25.650   3.016
  204   3HZ   LYS  25          HZ3       LYS  25  -6.548 -24.548   4.062
  205    H    ALA  26           HN       ALA  26  -5.255 -18.586   3.685
  206    HA   ALA  26           HA       ALA  26  -7.089 -17.751   1.536
  207   1HB   ALA  26          HB1       ALA  26  -8.365 -17.098   3.896
  208   2HB   ALA  26          HB2       ALA  26  -7.279 -18.373   4.437
  209   3HB   ALA  26          HB3       ALA  26  -8.440 -18.696   3.153
  210    HA   PRO  27           HA       PRO  27  -6.203 -13.419   1.435
  211   1HB   PRO  27          HB2       PRO  27  -8.817 -12.713   2.635
  212   2HB   PRO  27          HB1       PRO  27  -8.171 -12.309   1.039
  213   1HG   PRO  27          HG2       PRO  27 -10.134 -14.280   1.621
  214   2HG   PRO  27          HG1       PRO  27  -9.325 -14.024   0.070
  215   1HD   PRO  27          HD2       PRO  27  -9.023 -16.281   1.833
  216   2HD   PRO  27          HD1       PRO  27  -8.129 -15.968   0.327
  217    H    LEU  28           HN       LEU  28  -5.292 -11.899   2.881
  218    HA   LEU  28           HA       LEU  28  -4.749 -12.729   5.548
  219   1HB   LEU  28          HB2       LEU  28  -4.622  -9.988   4.256
  220   2HB   LEU  28          HB1       LEU  28  -3.992 -10.333   5.864
  221    HG   LEU  28           HG       LEU  28  -3.118 -11.827   3.373
  222   1HD1  LEU  28          HD11      LEU  28  -2.011  -9.344   4.698
  223   2HD1  LEU  28          HD12      LEU  28  -2.419  -9.586   2.999
  224   3HD1  LEU  28          HD13      LEU  28  -1.008 -10.388   3.689
  225   1HD2  LEU  28          HD21      LEU  28  -2.522 -13.153   5.231
  226   2HD2  LEU  28          HD22      LEU  28  -2.216 -11.754   6.258
  227   3HD2  LEU  28          HD23      LEU  28  -1.074 -12.182   4.987
  228    H    CYS  29           HN       CYS  29  -7.000 -10.259   4.321
  229    HA   CYS  29           HA       CYS  29  -8.228  -9.976   6.987
  230   1HB   CYS  29          HB2       CYS  29  -8.860  -8.713   4.305
  231   2HB   CYS  29          HB1       CYS  29  -9.724  -8.350   5.798
  232    H    ASN  30           HN       ASN  30 -10.669 -10.158   7.114
  233    HA   ASN  30           HA       ASN  30 -11.512 -12.783   6.286
  234   1HB   ASN  30          HB2       ASN  30 -13.110 -10.436   7.354
  235   2HB   ASN  30          HB1       ASN  30 -13.724 -12.082   7.196
  236   1HD2  ASN  30          HD21      ASN  30 -12.094 -13.782   8.290
  237   2HD2  ASN  30          HD22      ASN  30 -11.527 -13.333   9.826
  238    H    GLY  31           HN       GLY  31 -10.712 -11.326   3.977
  239   1HA   GLY  31          HA2       GLY  31 -11.547 -11.255   1.750
  240   2HA   GLY  31          HA1       GLY  31 -13.168 -11.560   2.377
  241    H    SER  32           HN       SER  32 -11.246  -9.061   3.815
  242    HA   SER  32           HA       SER  32 -13.208  -7.043   3.445
  243   1HB   SER  32          HB2       SER  32 -10.241  -6.796   4.001
  244   2HB   SER  32          HB1       SER  32 -11.390  -5.466   4.124
  245    HG   SER  32           HG       SER  32 -12.566  -7.094   5.541
  246    H    MET  33           HN       MET  33 -13.469  -5.443   1.920
  247    HA   MET  33           HA       MET  33 -11.809  -5.653  -0.572
  248   1HB   MET  33          HB2       MET  33 -14.597  -4.509  -0.167
  249   2HB   MET  33          HB1       MET  33 -13.749  -4.644  -1.702
  250   1HG   MET  33          HG2       MET  33 -14.359  -7.032   0.047
  251   2HG   MET  33          HG1       MET  33 -15.432  -6.487  -1.239
  252   1HE   MET  33          HE1       MET  33 -13.862  -5.723  -3.754
  253   2HE   MET  33          HE2       MET  33 -15.234  -6.808  -3.541
  254   3HE   MET  33          HE3       MET  33 -13.836  -7.339  -4.471
  255    H    VAL  34           HN       VAL  34 -11.054  -3.657  -1.510
  256    HA   VAL  34           HA       VAL  34 -11.298  -1.213   0.219
  257    HB   VAL  34           HB       VAL  34  -8.932  -0.693  -0.296
  258   1HG1  VAL  34          HG11      VAL  34  -9.175  -3.464   0.887
  259   2HG1  VAL  34          HG12      VAL  34  -9.675  -2.009   1.745
  260   3HG1  VAL  34          HG13      VAL  34  -7.986  -2.224   1.285
  261   1HG2  VAL  34          HG21      VAL  34  -7.525  -2.544  -1.230
  262   2HG2  VAL  34          HG22      VAL  34  -8.700  -1.922  -2.389
  263   3HG2  VAL  34          HG23      VAL  34  -9.002  -3.450  -1.562
  264    H    TRP  35           HN       TRP  35 -10.903   0.805  -0.969
  265    HA   TRP  35           HA       TRP  35 -12.226   0.783  -3.547
  266   1HB   TRP  35          HB2       TRP  35 -10.754   2.974  -2.058
  267   2HB   TRP  35          HB1       TRP  35 -11.662   3.226  -3.547
  268    HD1  TRP  35           HD1      TRP  35 -12.087   2.591   0.160
  269    HE1  TRP  35           HE1      TRP  35 -14.568   2.893   0.789
  270    HE3  TRP  35           HE3      TRP  35 -14.139   2.992  -4.502
  271    HZ2  TRP  35           HZ2      TRP  35 -17.089   3.255  -0.511
  272    HZ3  TRP  35           HZ3      TRP  35 -16.583   3.310  -4.768
  273    HH2  TRP  35           HH2      TRP  35 -18.057   3.443  -2.786
  274    H    SER  36           HN       SER  36 -11.298   0.672  -5.546
  275    HA   SER  36           HA       SER  36  -8.463   0.157  -5.804
  276   1HB   SER  36          HB2       SER  36  -8.898   0.043  -8.191
  277   2HB   SER  36          HB1       SER  36 -10.222  -0.755  -7.351
  278    HG   SER  36           HG       SER  36 -11.114   1.564  -7.437
  279    H    ILE  37           HN       ILE  37  -6.932   1.534  -6.965
  280    HA   ILE  37           HA       ILE  37  -7.694   4.420  -7.154
  281    HB   ILE  37           HB       ILE  37  -5.458   4.960  -6.104
  282   1HG1  ILE  37          HG12      ILE  37  -5.575   2.129  -5.043
  283   2HG1  ILE  37          HG11      ILE  37  -4.638   2.536  -6.479
  284   1HG2  ILE  37          HG21      ILE  37  -6.268   4.453  -3.764
  285   2HG2  ILE  37          HG22      ILE  37  -7.573   3.514  -4.489
  286   3HG2  ILE  37          HG23      ILE  37  -7.458   5.248  -4.793
  287   1HD1  ILE  37          HD11      ILE  37  -4.317   3.924  -3.806
  288   2HD1  ILE  37          HD12      ILE  37  -3.301   4.126  -5.234
  289   3HD1  ILE  37          HD13      ILE  37  -3.296   2.596  -4.357
  290    H    ASN  38           HN       ASN  38  -6.008   5.673  -8.365
  291    HA   ASN  38           HA       ASN  38  -5.050   4.072 -10.667
  292   1HB   ASN  38          HB2       ASN  38  -6.248   6.244 -11.029
  293   2HB   ASN  38          HB1       ASN  38  -4.931   7.071 -10.198
  294   1HD2  ASN  38          HD21      ASN  38  -4.699   8.185 -12.411
  295   2HD2  ASN  38          HD22      ASN  38  -3.759   7.405 -13.590
  296    H    LEU  39           HN       LEU  39  -3.023   3.227 -10.503
  297    HA   LEU  39           HA       LEU  39  -1.167   4.217  -8.493
  298   1HB   LEU  39          HB2       LEU  39  -0.862   2.143 -10.680
  299   2HB   LEU  39          HB1       LEU  39   0.377   2.489  -9.480
  300    HG   LEU  39           HG       LEU  39  -0.922   0.541  -8.784
  301   1HD1  LEU  39          HD11      LEU  39  -1.204   1.138  -6.569
  302   2HD1  LEU  39          HD12      LEU  39  -1.982   2.672  -6.957
  303   3HD1  LEU  39          HD13      LEU  39  -0.235   2.499  -7.131
  304   1HD2  LEU  39          HD21      LEU  39  -3.023   1.467 -10.077
  305   2HD2  LEU  39          HD22      LEU  39  -3.413   2.209  -8.523
  306   3HD2  LEU  39          HD23      LEU  39  -3.248   0.459  -8.648
  307    H    THR  40           HN       THR  40   0.084   5.961  -8.794
  308    HA   THR  40           HA       THR  40   1.394   6.390 -11.429
  309    HB   THR  40           HB       THR  40   0.869   8.872 -11.181
  310    HG1  THR  40           HG1      THR  40  -0.988   9.295  -9.897
  311   1HG2  THR  40          HG21      THR  40  -0.285   7.543 -12.853
  312   2HG2  THR  40          HG22      THR  40  -1.452   8.618 -12.084
  313   3HG2  THR  40          HG23      THR  40  -1.397   6.914 -11.639
  314    H    ALA  41           HN       ALA  41   1.372   8.942  -9.090
  315    HA   ALA  41           HA       ALA  41   4.153   8.182  -8.239
  316   1HB   ALA  41          HB1       ALA  41   4.521  10.600  -7.912
  317   2HB   ALA  41          HB2       ALA  41   2.870  10.923  -8.438
  318   3HB   ALA  41          HB3       ALA  41   4.042  10.253  -9.572
  319    H    GLY  42           HN       GLY  42   1.431  10.184  -7.021
  320   1HA   GLY  42          HA2       GLY  42   2.250   9.866  -4.265
  321   2HA   GLY  42          HA1       GLY  42   0.713  10.540  -4.807
  322    H    MET  43           HN       MET  43   1.995   7.326  -5.551
  323    HA   MET  43           HA       MET  43  -0.462   5.992  -5.035
  324   1HB   MET  43          HB2       MET  43   2.350   4.864  -4.924
  325   2HB   MET  43          HB1       MET  43   0.866   3.931  -5.128
  326   1HG   MET  43          HG2       MET  43   0.396   5.262  -7.196
  327   2HG   MET  43          HG1       MET  43   1.980   6.008  -7.028
  328   1HE   MET  43          HE1       MET  43   3.763   3.279  -5.920
  329   2HE   MET  43          HE2       MET  43   3.994   4.868  -6.646
  330   3HE   MET  43          HE3       MET  43   4.534   3.429  -7.505
  331    H    TYR  44           HN       TYR  44   2.373   6.537  -2.964
  332    HA   TYR  44           HA       TYR  44   1.582   4.900  -0.783
  333   1HB   TYR  44          HB2       TYR  44   3.165   7.486  -0.803
  334   2HB   TYR  44          HB1       TYR  44   3.066   6.384   0.570
  335    HD1  TYR  44           HD1      TYR  44   4.177   4.217   0.536
  336    HD2  TYR  44           HD2      TYR  44   4.340   6.835  -2.866
  337    HE1  TYR  44           HE1      TYR  44   5.984   2.831  -0.443
  338    HE2  TYR  44           HE2      TYR  44   6.152   5.450  -3.843
  339    HH   TYR  44           HH       TYR  44   7.244   2.462  -2.248
  340    H    CYS  45           HN       CYS  45   0.882   8.350  -1.430
  341    HA   CYS  45           HA       CYS  45  -0.648   8.732   0.988
  342   1HB   CYS  45          HB2       CYS  45  -0.498  10.225  -1.635
  343   2HB   CYS  45          HB1       CYS  45  -1.611  10.711  -0.354
  344    H    ALA  46           HN       ALA  46  -1.634   8.172  -2.405
  345    HA   ALA  46           HA       ALA  46  -4.428   8.008  -1.908
  346   1HB   ALA  46          HB1       ALA  46  -4.463   6.664  -4.052
  347   2HB   ALA  46          HB2       ALA  46  -2.701   6.730  -4.041
  348   3HB   ALA  46          HB3       ALA  46  -3.638   8.218  -4.175
  349    H    ALA  47           HN       ALA  47  -1.980   5.421  -2.078
  350    HA   ALA  47           HA       ALA  47  -3.764   3.269  -1.563
  351   1HB   ALA  47          HB1       ALA  47  -0.802   3.583  -1.014
  352   2HB   ALA  47          HB2       ALA  47  -1.557   2.787  -2.394
  353   3HB   ALA  47          HB3       ALA  47  -1.669   2.066  -0.789
  354    H    LEU  48           HN       LEU  48  -1.931   5.342   0.672
  355    HA   LEU  48           HA       LEU  48  -2.472   3.882   3.036
  356   1HB   LEU  48          HB2       LEU  48  -0.827   5.705   2.933
  357   2HB   LEU  48          HB1       LEU  48  -2.122   6.874   2.694
  358    HG   LEU  48           HG       LEU  48  -3.064   6.276   4.911
  359   1HD1  LEU  48          HD11      LEU  48  -0.790   4.296   4.848
  360   2HD1  LEU  48          HD12      LEU  48  -2.465   4.050   5.345
  361   3HD1  LEU  48          HD13      LEU  48  -1.357   4.928   6.394
  362   1HD2  LEU  48          HD21      LEU  48  -0.112   6.869   5.201
  363   2HD2  LEU  48          HD22      LEU  48  -1.441   7.455   6.201
  364   3HD2  LEU  48          HD23      LEU  48  -1.248   8.052   4.553
  365    H    GLU  49           HN       GLU  49  -4.349   6.644   1.660
  366    HA   GLU  49           HA       GLU  49  -6.336   6.609   3.699
  367   1HB   GLU  49          HB2       GLU  49  -7.838   7.670   1.942
  368   2HB   GLU  49          HB1       GLU  49  -6.326   8.506   2.276
  369   1HG   GLU  49          HG2       GLU  49  -5.299   7.500   0.295
  370   2HG   GLU  49          HG1       GLU  49  -6.777   6.590  -0.030
  371    H    SER  50           HN       SER  50  -6.145   4.772   0.659
  372    HA   SER  50           HA       SER  50  -8.752   3.609   0.861
  373   1HB   SER  50          HB2       SER  50  -6.215   2.546  -0.412
  374   2HB   SER  50          HB1       SER  50  -7.805   1.820  -0.620
  375    HG   SER  50           HG       SER  50  -7.255   4.548  -1.156
  376    H    LEU  51           HN       LEU  51  -5.595   2.610   2.155
  377    HA   LEU  51           HA       LEU  51  -6.549   0.119   3.263
  378   1HB   LEU  51          HB2       LEU  51  -4.132   1.832   3.883
  379   2HB   LEU  51          HB1       LEU  51  -4.426   0.274   4.649
  380    HG   LEU  51           HG       LEU  51  -4.289   0.668   1.643
  381   1HD1  LEU  51          HD11      LEU  51  -2.134   1.206   2.853
  382   2HD1  LEU  51          HD12      LEU  51  -2.020  -0.142   1.723
  383   3HD1  LEU  51          HD13      LEU  51  -2.134  -0.452   3.455
  384   1HD2  LEU  51          HD21      LEU  51  -5.395  -1.369   1.947
  385   2HD2  LEU  51          HD22      LEU  51  -4.584  -1.709   3.476
  386   3HD2  LEU  51          HD23      LEU  51  -3.721  -1.912   1.953
  387    H    ILE  52           HN       ILE  52  -6.254   3.414   4.556
  388    HA   ILE  52           HA       ILE  52  -6.734   2.877   7.273
  389    HB   ILE  52           HB       ILE  52  -7.501   5.202   5.501
  390   1HG1  ILE  52          HG12      ILE  52  -5.115   4.932   6.023
  391   2HG1  ILE  52          HG11      ILE  52  -5.754   6.368   6.807
  392   1HG2  ILE  52          HG21      ILE  52  -9.196   5.372   7.128
  393   2HG2  ILE  52          HG22      ILE  52  -7.920   6.428   7.732
  394   3HG2  ILE  52          HG23      ILE  52  -8.133   4.819   8.423
  395   1HD1  ILE  52          HD11      ILE  52  -4.665   5.499   8.624
  396   2HD1  ILE  52          HD12      ILE  52  -4.738   3.850   8.011
  397   3HD1  ILE  52          HD13      ILE  52  -6.144   4.557   8.801
  398    H    ASN  53           HN       ASN  53  -8.759   2.195   4.652
  399    HA   ASN  53           HA       ASN  53 -11.268   2.368   6.203
  400   1HB   ASN  53          HB2       ASN  53 -10.644   1.296   3.433
  401   2HB   ASN  53          HB1       ASN  53 -12.260   1.330   4.140
  402   1HD2  ASN  53          HD21      ASN  53 -10.569   2.994   1.941
  403   2HD2  ASN  53          HD22      ASN  53 -11.107   4.575   2.244
  404    H    VAL  54           HN       VAL  54  -8.722   0.137   5.623
  405    HA   VAL  54           HA       VAL  54 -10.362  -2.224   6.379
  406    HB   VAL  54           HB       VAL  54  -7.397  -2.034   5.755
  407   1HG1  VAL  54          HG11      VAL  54  -7.901  -4.036   7.006
  408   2HG1  VAL  54          HG12      VAL  54  -7.725  -4.502   5.314
  409   3HG1  VAL  54          HG13      VAL  54  -9.332  -4.351   6.024
  410   1HG2  VAL  54          HG21      VAL  54  -8.121  -3.018   3.548
  411   2HG2  VAL  54          HG22      VAL  54  -8.647  -1.354   3.801
  412   3HG2  VAL  54          HG23      VAL  54  -9.789  -2.681   4.011
  413    H    SER  55           HN       SER  55 -10.600  -2.643   8.525
  414    HA   SER  55           HA       SER  55  -8.337  -1.971  10.385
  415   1HB   SER  55          HB2       SER  55 -11.308  -1.656  10.910
  416   2HB   SER  55          HB1       SER  55 -10.032  -1.406  12.097
  417    HG   SER  55           HG       SER  55 -10.593   0.051   9.739
  418    H    GLY  56           HN       GLY  56  -8.009  -3.459  12.071
  419   1HA   GLY  56          HA2       GLY  56  -8.552  -5.413  13.380
  420   2HA   GLY  56          HA1       GLY  56  -9.760  -5.863  12.180
  421    H    CYS  57           HN       CYS  57  -7.261  -5.004  10.295
  422    HA   CYS  57           HA       CYS  57  -6.265  -7.816  10.127
  423   1HB   CYS  57          HB2       CYS  57  -6.079  -5.507   8.170
  424   2HB   CYS  57          HB1       CYS  57  -5.412  -7.117   7.899
  425    H    SER  58           HN       SER  58  -4.728  -7.714  11.849
  426    HA   SER  58           HA       SER  58  -2.738  -5.689  12.173
  427   1HB   SER  58          HB2       SER  58  -3.305  -7.475  13.850
  428   2HB   SER  58          HB1       SER  58  -2.478  -8.640  12.820
  429    HG   SER  58           HG       SER  58  -1.267  -6.251  13.747
  430    H    ALA  59           HN       ALA  59  -2.823  -8.632  10.225
  431    HA   ALA  59           HA       ALA  59  -0.172  -8.901   9.444
  432   1HB   ALA  59          HB1       ALA  59  -0.976 -10.013   7.469
  433   2HB   ALA  59          HB2       ALA  59  -2.515  -9.156   7.550
  434   3HB   ALA  59          HB3       ALA  59  -2.113 -10.362   8.772
  435    H    ILE  60           HN       ILE  60  -2.270  -6.232   8.650
  436    HA   ILE  60           HA       ILE  60  -0.174  -5.221   6.738
  437    HB   ILE  60           HB       ILE  60  -1.957  -4.073   5.503
  438   1HG1  ILE  60          HG12      ILE  60  -3.832  -5.515   7.407
  439   2HG1  ILE  60          HG11      ILE  60  -3.537  -3.781   7.399
  440   1HG2  ILE  60          HG21      ILE  60  -2.541  -7.023   5.911
  441   2HG2  ILE  60          HG22      ILE  60  -1.290  -6.370   4.854
  442   3HG2  ILE  60          HG23      ILE  60  -2.989  -6.069   4.498
  443   1HD1  ILE  60          HD11      ILE  60  -4.883  -5.444   5.271
  444   2HD1  ILE  60          HD12      ILE  60  -4.263  -3.826   4.938
  445   3HD1  ILE  60          HD13      ILE  60  -5.530  -4.055   6.144
  446    H    GLU  61           HN       GLU  61  -1.595  -4.820   9.705
  447    HA   GLU  61           HA       GLU  61  -1.978  -2.004   9.866
  448   1HB   GLU  61          HB2       GLU  61  -2.720  -3.474  11.647
  449   2HB   GLU  61          HB1       GLU  61  -1.064  -3.996  11.967
  450   1HG   GLU  61          HG2       GLU  61  -0.454  -1.785  12.699
  451   2HG   GLU  61          HG1       GLU  61  -2.011  -1.136  12.188
  452    H    LYS  62           HN       LYS  62   0.927  -4.016  10.291
  453    HA   LYS  62           HA       LYS  62   2.698  -1.872  10.989
  454   1HB   LYS  62          HB2       LYS  62   3.206  -4.535   9.633
  455   2HB   LYS  62          HB1       LYS  62   4.493  -3.430  10.116
  456   1HG   LYS  62          HG2       LYS  62   3.707  -3.522  12.449
  457   2HG   LYS  62          HG1       LYS  62   2.419  -4.630  11.972
  458   1HD   LYS  62          HD2       LYS  62   4.104  -6.259  11.197
  459   2HD   LYS  62          HD1       LYS  62   5.392  -5.155  11.679
  460   1HE   LYS  62          HE2       LYS  62   4.962  -6.895  13.403
  461   2HE   LYS  62          HE1       LYS  62   4.660  -5.268  14.011
  462   1HZ   LYS  62          HZ1       LYS  62   2.334  -5.556  13.712
  463   2HZ   LYS  62          HZ2       LYS  62   2.903  -6.915  14.557
  464   3HZ   LYS  62          HZ3       LYS  62   2.548  -7.029  12.900
  465    H    THR  63           HN       THR  63   1.660  -3.240   7.901
  466    HA   THR  63           HA       THR  63   3.435  -1.829   6.199
  467    HB   THR  63           HB       THR  63   0.575  -2.668   5.648
  468    HG1  THR  63           HG1      THR  63   1.749  -4.457   4.664
  469   1HG2  THR  63          HG21      THR  63   1.387  -2.710   3.278
  470   2HG2  THR  63          HG22      THR  63   2.885  -1.954   3.824
  471   3HG2  THR  63          HG23      THR  63   1.354  -1.091   3.975
  472    H    GLN  64           HN       GLN  64   0.307  -0.857   7.589
  473    HA   GLN  64           HA       GLN  64   0.008   1.562   6.119
  474   1HB   GLN  64          HB2       GLN  64  -0.882   0.807   8.913
  475   2HB   GLN  64          HB1       GLN  64  -1.355   2.311   8.121
  476   1HG   GLN  64          HG2       GLN  64  -2.378   1.053   6.284
  477   2HG   GLN  64          HG1       GLN  64  -1.857  -0.467   7.012
  478   1HE2  GLN  64          HE21      GLN  64  -4.643   0.172   6.535
  479   2HE2  GLN  64          HE22      GLN  64  -5.409   0.291   8.045
  480    H    ARG  65           HN       ARG  65   1.790   0.879   9.129
  481    HA   ARG  65           HA       ARG  65   2.526   3.607   9.645
  482   1HB   ARG  65          HB2       ARG  65   3.837   0.985  10.406
  483   2HB   ARG  65          HB1       ARG  65   4.406   2.553  10.977
  484   1HG   ARG  65          HG2       ARG  65   2.211   2.999  11.991
  485   2HG   ARG  65          HG1       ARG  65   1.613   1.448  11.398
  486   1HD   ARG  65          HD2       ARG  65   2.346   1.348  13.788
  487   2HD   ARG  65          HD1       ARG  65   3.248   0.248  12.749
  488    HE   ARG  65           HE       ARG  65   4.751   2.602  12.777
  489   1HH1  ARG  65          HH21      ARG  65   3.449   0.387  15.077
  490   2HH1  ARG  65          HH22      ARG  65   4.716   0.636  16.232
  491   1HH2  ARG  65          HH11      ARG  65   6.413   2.939  14.272
  492   2HH2  ARG  65          HH12      ARG  65   6.392   2.083  15.778
  493    H    MET  66           HN       MET  66   4.153   0.989   7.845
  494    HA   MET  66           HA       MET  66   6.498   2.513   7.217
  495   1HB   MET  66          HB2       MET  66   5.234   0.108   5.876
  496   2HB   MET  66          HB1       MET  66   6.779   0.793   5.370
  497   1HG   MET  66          HG2       MET  66   7.571   0.527   7.767
  498   2HG   MET  66          HG1       MET  66   6.094  -0.381   8.080
  499   1HE   MET  66          HE1       MET  66   5.610  -2.228   5.482
  500   2HE   MET  66          HE2       MET  66   5.430  -2.448   7.222
  501   3HE   MET  66          HE3       MET  66   6.360  -3.614   6.286
  502    H    LEU  67           HN       LEU  67   3.410   2.095   5.492
  503    HA   LEU  67           HA       LEU  67   4.151   3.475   3.105
  504   1HB   LEU  67          HB2       LEU  67   1.479   3.189   4.495
  505   2HB   LEU  67          HB1       LEU  67   1.662   3.937   2.913
  506    HG   LEU  67           HG       LEU  67   2.616   1.127   3.551
  507   1HD1  LEU  67          HD11      LEU  67   0.193   1.216   3.824
  508   2HD1  LEU  67          HD12      LEU  67   0.571   0.400   2.309
  509   3HD1  LEU  67          HD13      LEU  67   0.022   2.076   2.295
  510   1HD2  LEU  67          HD21      LEU  67   2.388   2.802   1.042
  511   2HD2  LEU  67          HD22      LEU  67   2.305   1.046   0.937
  512   3HD2  LEU  67          HD23      LEU  67   3.743   1.817   1.592
  513    H    SER  68           HN       SER  68   2.872   4.671   6.190
  514    HA   SER  68           HA       SER  68   2.466   7.372   5.406
  515   1HB   SER  68          HB2       SER  68   3.244   6.177   8.079
  516   2HB   SER  68          HB1       SER  68   2.836   7.875   7.860
  517    HG   SER  68           HG       SER  68   1.115   6.226   8.445
  518    H    GLY  69           HN       GLY  69   5.369   5.677   6.541
  519   1HA   GLY  69          HA2       GLY  69   7.113   7.833   6.913
  520   2HA   GLY  69          HA1       GLY  69   7.631   6.274   6.269
  521    H    PHE  70           HN       PHE  70   5.850   6.522   3.891
  522    HA   PHE  70           HA       PHE  70   7.634   8.302   2.304
  523   1HB   PHE  70          HB2       PHE  70   5.584   6.216   1.509
  524   2HB   PHE  70          HB1       PHE  70   6.428   7.237   0.348
  525    HD1  PHE  70           HD1      PHE  70   8.839   7.007  -0.020
  526    HD2  PHE  70           HD2      PHE  70   6.740   4.442   2.711
  527    HE1  PHE  70           HE1      PHE  70  10.761   5.445  -0.015
  528    HE2  PHE  70           HE2      PHE  70   8.666   2.879   2.722
  529    HZ   PHE  70           HZ       PHE  70  10.677   3.377   1.358
  530    H    CYS  71           HN       CYS  71   4.478   8.225   3.667
  531    HA   CYS  71           HA       CYS  71   3.770  10.717   2.172
  532   1HB   CYS  71          HB2       CYS  71   2.332   8.148   2.219
  533   2HB   CYS  71          HB1       CYS  71   1.307   9.524   2.619
  534    HA   PRO  72           HA       PRO  72   3.428  11.487   6.753
  535   1HB   PRO  72          HB2       PRO  72   3.470  14.307   5.860
  536   2HB   PRO  72          HB1       PRO  72   4.557  13.475   6.978
  537   1HG   PRO  72          HG2       PRO  72   5.283  14.286   4.448
  538   2HG   PRO  72          HG1       PRO  72   6.069  12.964   5.323
  539   1HD   PRO  72          HD2       PRO  72   4.192  12.831   3.017
  540   2HD   PRO  72          HD1       PRO  72   5.410  11.641   3.553
  541    H    HIS  73           HN       HIS  73   1.203  10.948   4.906
  542    HA   HIS  73           HA       HIS  73  -0.705  13.148   5.299
  543   1HB   HIS  73          HB2       HIS  73  -0.309  11.192   3.342
  544   2HB   HIS  73          HB1       HIS  73  -1.753  10.623   4.168
  545    HD1  HIS  73           HD1      HIS  73  -3.899  12.000   3.872
  546    HD2  HIS  73           HD2      HIS  73  -0.559  13.748   2.124
  547    HE1  HIS  73           HE1      HIS  73  -4.767  13.889   2.437
  548    H    LYS  74           HN       LYS  74  -1.404  13.224   7.429
  549    HA   LYS  74           HA       LYS  74  -2.103  10.753   8.865
  550   1HB   LYS  74          HB2       LYS  74  -2.501  13.695   9.519
  551   2HB   LYS  74          HB1       LYS  74  -3.010  12.383  10.581
  552   1HG   LYS  74          HG2       LYS  74  -0.682  11.571  10.699
  553   2HG   LYS  74          HG1       LYS  74  -0.171  12.886   9.639
  554   1HD   LYS  74          HD2       LYS  74  -0.971  14.534  11.292
  555   2HD   LYS  74          HD1       LYS  74  -1.479  13.222  12.355
  556   1HE   LYS  74          HE2       LYS  74   0.946  12.403  12.255
  557   2HE   LYS  74          HE1       LYS  74   1.333  13.964  11.533
  558   1HZ   LYS  74          HZ1       LYS  74  -0.227  13.850  14.024
  559   2HZ   LYS  74          HZ2       LYS  74   0.775  15.091  13.441
  560   3HZ   LYS  74          HZ3       LYS  74   1.458  13.674  14.084
  561    H    VAL  75           HN       VAL  75  -3.560  10.134   7.002
  562    HA   VAL  75           HA       VAL  75  -6.091  11.666   6.848
  563    HB   VAL  75           HB       VAL  75  -4.811  10.799   4.814
  564   1HG1  VAL  75          HG11      VAL  75  -4.900   8.522   4.239
  565   2HG1  VAL  75          HG12      VAL  75  -6.161   8.178   5.422
  566   3HG1  VAL  75          HG13      VAL  75  -4.511   8.493   5.959
  567   1HG2  VAL  75          HG21      VAL  75  -7.207  11.561   4.819
  568   2HG2  VAL  75          HG22      VAL  75  -7.684   9.884   5.080
  569   3HG2  VAL  75          HG23      VAL  75  -6.854  10.344   3.596
  570    H    SER  76           HN       SER  76  -7.737  11.136   8.131
  571    HA   SER  76           HA       SER  76  -7.787   8.486   9.468
  572   1HB   SER  76          HB2       SER  76  -9.566   9.511  10.853
  573   2HB   SER  76          HB1       SER  76  -8.101  10.487  10.860
  574    HG   SER  76           HG       SER  76  -9.243  11.528   8.940
  575    H    ALA  77           HN       ALA  77 -10.065   7.500   9.676
  576    HA   ALA  77           HA       ALA  77 -11.048   6.837   7.084
  577   1HB   ALA  77          HB1       ALA  77 -11.362   5.373   9.040
  578   2HB   ALA  77          HB2       ALA  77 -12.914   5.751   8.291
  579   3HB   ALA  77          HB3       ALA  77 -12.427   6.573   9.774
  580    H    GLY  78           HN       GLY  78 -11.567   9.624   8.965
  581   1HA   GLY  78          HA2       GLY  78 -14.233  10.202   7.816
  582   2HA   GLY  78          HA1       GLY  78 -13.350  11.222   8.954
  583    H    GLN  79           HN       GLN  79 -10.856  11.181   7.460
  584    HA   GLN  79           HA       GLN  79 -11.584  13.175   5.384
  585   1HB   GLN  79          HB2       GLN  79  -8.893  12.391   6.547
  586   2HB   GLN  79          HB1       GLN  79  -9.167  13.709   5.407
  587   1HG   GLN  79          HG2       GLN  79 -10.498  13.506   8.123
  588   2HG   GLN  79          HG1       GLN  79  -9.062  14.476   7.790
  589   1HE2  GLN  79          HE21      GLN  79 -12.061  15.159   8.421
  590   2HE2  GLN  79          HE22      GLN  79 -12.440  16.321   7.244
  591    H    PHE  80           HN       PHE  80 -11.370  12.773   3.229
  592    HA   PHE  80           HA       PHE  80  -9.872  10.324   2.357
  593   1HB   PHE  80          HB2       PHE  80 -12.620  11.253   1.486
  594   2HB   PHE  80          HB1       PHE  80 -11.676  10.041   0.622
  595    HD1  PHE  80           HD1      PHE  80 -13.882  10.653   3.401
  596    HD2  PHE  80           HD2      PHE  80 -10.859   7.980   1.919
  597    HE1  PHE  80           HE1      PHE  80 -14.625   8.919   5.010
  598    HE2  PHE  80           HE2      PHE  80 -11.609   6.246   3.524
  599    HZ   PHE  80           HZ       PHE  80 -13.491   6.714   5.069
  600    H    SER  81           HN       SER  81  -8.857  10.520   0.300
  601    HA   SER  81           HA       SER  81  -8.792  13.313  -0.815
  602   1HB   SER  81          HB2       SER  81  -6.497  11.353  -0.849
  603   2HB   SER  81          HB1       SER  81  -6.456  13.076  -1.211
  604    HG   SER  81           HG       SER  81  -7.441  13.034   1.133
  605    H    SER  82           HN       SER  82  -7.921   9.947  -1.780
  606    HA   SER  82           HA       SER  82  -8.500  10.687  -4.591
  607   1HB   SER  82          HB2       SER  82  -6.433   9.423  -3.987
  608   2HB   SER  82          HB1       SER  82  -7.447   8.075  -3.481
  609    HG   SER  82           HG       SER  82  -7.180   9.223  -6.060
  610    H    LEU  83           HN       LEU  83 -10.340   9.381  -2.079
  611    HA   LEU  83           HA       LEU  83 -11.785   7.445  -3.773
  612   1HB   LEU  83          HB2       LEU  83 -12.106   8.422  -0.937
  613   2HB   LEU  83          HB1       LEU  83 -13.366   7.465  -1.702
  614    HG   LEU  83           HG       LEU  83 -11.591   5.733  -2.244
  615   1HD1  LEU  83          HD11      LEU  83  -9.986   7.574  -0.452
  616   2HD1  LEU  83          HD12      LEU  83  -9.573   7.015  -2.072
  617   3HD1  LEU  83          HD13      LEU  83  -9.553   5.886  -0.719
  618   1HD2  LEU  83          HD21      LEU  83 -12.094   6.423   0.667
  619   2HD2  LEU  83          HD22      LEU  83 -11.514   4.862   0.088
  620   3HD2  LEU  83          HD23      LEU  83 -13.123   5.426  -0.362
  621    H    HIS  84           HN       HIS  84 -11.671  10.322  -4.574
  622    HA   HIS  84           HA       HIS  84 -14.334  11.421  -4.112
  623   1HB   HIS  84          HB2       HIS  84 -12.253  12.141  -6.201
  624   2HB   HIS  84          HB1       HIS  84 -13.691  13.086  -5.822
  625    HD1  HIS  84           HD1      HIS  84 -12.674  11.822  -2.689
  626    HD2  HIS  84           HD2      HIS  84 -11.216  14.852  -5.151
  627    HE1  HIS  84           HE1      HIS  84 -11.248  13.314  -1.222
  628    H    VAL  85           HN       VAL  85 -12.715   9.683  -6.749
  629    HA   VAL  85           HA       VAL  85 -15.033   9.776  -8.501
  630    HB   VAL  85           HB       VAL  85 -13.770   8.097  -9.840
  631   1HG1  VAL  85          HG11      VAL  85 -13.253  10.438 -10.210
  632   2HG1  VAL  85          HG12      VAL  85 -11.740   9.533 -10.227
  633   3HG1  VAL  85          HG13      VAL  85 -12.191  10.470  -8.802
  634   1HG2  VAL  85          HG21      VAL  85 -11.827   8.253  -7.512
  635   2HG2  VAL  85          HG22      VAL  85 -11.501   7.448  -9.048
  636   3HG2  VAL  85          HG23      VAL  85 -12.770   6.840  -7.984
  637    H    ARG  86           HN       ARG  86 -16.510   8.036  -8.902
  638    HA   ARG  86           HA       ARG  86 -16.890   6.271  -6.557
  639   1HB   ARG  86          HB2       ARG  86 -18.578   6.800  -9.018
  640   2HB   ARG  86          HB1       ARG  86 -19.029   5.674  -7.739
  641   1HG   ARG  86          HG2       ARG  86 -18.917   7.508  -6.091
  642   2HG   ARG  86          HG1       ARG  86 -18.498   8.638  -7.376
  643   1HD   ARG  86          HD2       ARG  86 -20.661   7.864  -8.530
  644   2HD   ARG  86          HD1       ARG  86 -21.099   7.136  -6.989
  645    HE   ARG  86           HE       ARG  86 -21.345   9.901  -7.693
  646   1HH1  ARG  86          HH21      ARG  86 -20.261   7.912  -5.084
  647   2HH1  ARG  86          HH22      ARG  86 -20.301   9.199  -3.929
  648   1HH2  ARG  86          HH11      ARG  86 -21.420  11.562  -6.196
  649   2HH2  ARG  86          HH12      ARG  86 -20.962  11.257  -4.554
  650    H    ASP  87           HN       ASP  87 -14.815   5.102  -7.280
  651    HA   ASP  87           HA       ASP  87 -15.111   3.305  -9.594
  652   1HB   ASP  87          HB2       ASP  87 -12.989   3.536  -7.435
  653   2HB   ASP  87          HB1       ASP  87 -12.910   2.400  -8.783
  654    H    THR  88           HN       THR  88 -14.551   0.863  -9.029
  655    HA   THR  88           HA       THR  88 -16.509   0.034  -6.946
  656    HB   THR  88           HB       THR  88 -16.435  -2.143  -7.986
  657    HG1  THR  88           HG1      THR  88 -14.100  -1.983  -8.341
  658   1HG2  THR  88          HG21      THR  88 -16.356   0.059 -10.069
  659   2HG2  THR  88          HG22      THR  88 -17.778  -0.489  -9.179
  660   3HG2  THR  88          HG23      THR  88 -16.996  -1.561 -10.343
  661    H    LYS  89           HN       LYS  89 -15.852  -1.704  -5.420
  662    HA   LYS  89           HA       LYS  89 -13.146  -1.192  -4.378
  663   1HB   LYS  89          HB2       LYS  89 -15.228  -3.119  -3.317
  664   2HB   LYS  89          HB1       LYS  89 -13.838  -2.466  -2.454
  665   1HG   LYS  89          HG2       LYS  89 -14.799  -0.181  -2.696
  666   2HG   LYS  89          HG1       LYS  89 -16.229  -0.896  -3.446
  667   1HD   LYS  89          HD2       LYS  89 -16.469  -2.337  -1.370
  668   2HD   LYS  89          HD1       LYS  89 -15.214  -1.344  -0.629
  669   1HE   LYS  89          HE2       LYS  89 -17.503  -0.557  -0.053
  670   2HE   LYS  89          HE1       LYS  89 -16.576   0.658  -0.929
  671   1HZ   LYS  89          HZ1       LYS  89 -18.885   0.334  -1.747
  672   2HZ   LYS  89          HZ2       LYS  89 -18.447  -1.233  -2.233
  673   3HZ   LYS  89          HZ3       LYS  89 -17.695   0.118  -2.935
  674    H    ILE  90           HN       ILE  90 -11.666  -2.985  -3.851
  675    HA   ILE  90           HA       ILE  90 -12.035  -5.443  -5.521
  676    HB   ILE  90           HB       ILE  90  -9.671  -5.316  -6.204
  677   1HG1  ILE  90          HG12      ILE  90  -9.704  -2.598  -4.840
  678   2HG1  ILE  90          HG11      ILE  90  -8.853  -4.018  -4.233
  679   1HG2  ILE  90          HG21      ILE  90  -9.912  -3.420  -7.763
  680   2HG2  ILE  90          HG22      ILE  90 -11.229  -2.778  -6.780
  681   3HG2  ILE  90          HG23      ILE  90 -11.426  -4.312  -7.624
  682   1HD1  ILE  90          HD11      ILE  90  -8.324  -2.528  -6.814
  683   2HD1  ILE  90          HD12      ILE  90  -7.613  -4.099  -6.440
  684   3HD1  ILE  90          HD13      ILE  90  -7.240  -2.700  -5.433
  685    H    GLU  91           HN       GLU  91 -10.665  -7.262  -4.767
  686    HA   GLU  91           HA       GLU  91 -10.763  -7.561  -1.915
  687   1HB   GLU  91          HB2       GLU  91  -9.365  -9.174  -4.060
  688   2HB   GLU  91          HB1       GLU  91  -9.412  -9.652  -2.363
  689   1HG   GLU  91          HG2       GLU  91 -11.878  -9.657  -2.427
  690   2HG   GLU  91          HG1       GLU  91 -11.835  -9.181  -4.125
  691    H    VAL  92           HN       VAL  92  -9.128  -7.509  -0.366
  692    HA   VAL  92           HA       VAL  92  -7.023  -5.628  -0.703
  693    HB   VAL  92           HB       VAL  92  -7.400  -7.877   1.299
  694   1HG1  VAL  92          HG11      VAL  92  -5.721  -6.520   2.664
  695   2HG1  VAL  92          HG12      VAL  92  -5.309  -5.693   1.161
  696   3HG1  VAL  92          HG13      VAL  92  -5.050  -7.431   1.311
  697   1HG2  VAL  92          HG21      VAL  92  -8.359  -6.254   2.701
  698   2HG2  VAL  92          HG22      VAL  92  -8.974  -5.786   1.117
  699   3HG2  VAL  92          HG23      VAL  92  -7.616  -4.914   1.828
  700    H    ALA  93           HN       ALA  93  -7.036  -9.178  -0.976
  701    HA   ALA  93           HA       ALA  93  -4.262  -9.615  -1.266
  702   1HB   ALA  93          HB1       ALA  93  -4.848 -11.661  -2.435
  703   2HB   ALA  93          HB2       ALA  93  -6.452 -11.033  -2.812
  704   3HB   ALA  93          HB3       ALA  93  -6.021 -11.406  -1.143
  705    H    GLN  94           HN       GLN  94  -6.665  -8.598  -3.665
  706    HA   GLN  94           HA       GLN  94  -4.801  -8.615  -5.893
  707   1HB   GLN  94          HB2       GLN  94  -7.491  -7.271  -5.472
  708   2HB   GLN  94          HB1       GLN  94  -6.600  -7.205  -6.992
  709   1HG   GLN  94          HG2       GLN  94  -6.646  -9.662  -7.141
  710   2HG   GLN  94          HG1       GLN  94  -7.514  -9.743  -5.607
  711   1HE2  GLN  94          HE21      GLN  94  -8.583 -10.708  -8.161
  712   2HE2  GLN  94          HE22      GLN  94  -9.956  -9.774  -8.509
  713    H    PHE  95           HN       PHE  95  -5.961  -6.243  -3.572
  714    HA   PHE  95           HA       PHE  95  -4.875  -3.892  -4.724
  715   1HB   PHE  95          HB2       PHE  95  -6.461  -3.918  -2.829
  716   2HB   PHE  95          HB1       PHE  95  -5.209  -4.608  -1.797
  717    HD1  PHE  95           HD1      PHE  95  -6.366  -1.602  -3.552
  718    HD2  PHE  95           HD2      PHE  95  -3.270  -3.291  -1.105
  719    HE1  PHE  95           HE1      PHE  95  -5.500   0.672  -3.082
  720    HE2  PHE  95           HE2      PHE  95  -2.399  -1.023  -0.633
  721    HZ   PHE  95           HZ       PHE  95  -3.521   0.959  -1.622
  722    H    VAL  96           HN       VAL  96  -3.426  -6.077  -2.268
  723    HA   VAL  96           HA       VAL  96  -0.956  -4.658  -2.067
  724    HB   VAL  96           HB       VAL  96  -1.506  -7.611  -1.657
  725   1HG1  VAL  96          HG11      VAL  96   0.852  -7.338  -1.861
  726   2HG1  VAL  96          HG12      VAL  96   0.531  -7.355  -0.127
  727   3HG1  VAL  96          HG13      VAL  96   0.830  -5.825  -0.954
  728   1HG2  VAL  96          HG21      VAL  96  -1.466  -5.265   0.264
  729   2HG2  VAL  96          HG22      VAL  96  -1.630  -6.957   0.737
  730   3HG2  VAL  96          HG23      VAL  96  -2.890  -6.183  -0.225
  731    H    LYS  97           HN       LYS  97  -1.882  -7.450  -4.082
  732    HA   LYS  97           HA       LYS  97   0.652  -7.861  -5.285
  733   1HB   LYS  97          HB2       LYS  97  -2.153  -8.366  -6.300
  734   2HB   LYS  97          HB1       LYS  97  -0.705  -8.906  -7.153
  735   1HG   LYS  97          HG2       LYS  97   0.005 -10.171  -5.155
  736   2HG   LYS  97          HG1       LYS  97  -1.443  -9.636  -4.301
  737   1HD   LYS  97          HD2       LYS  97  -2.854 -10.748  -5.993
  738   2HD   LYS  97          HD1       LYS  97  -1.407 -11.287  -6.844
  739   1HE   LYS  97          HE2       LYS  97  -0.706 -12.591  -4.899
  740   2HE   LYS  97          HE1       LYS  97  -2.085 -11.996  -3.975
  741   1HZ   LYS  97          HZ1       LYS  97  -1.979 -14.182  -5.725
  742   2HZ   LYS  97          HZ2       LYS  97  -3.040 -13.031  -6.385
  743   3HZ   LYS  97          HZ3       LYS  97  -3.298 -13.625  -4.815
  744    H    ASP  98           HN       ASP  98  -2.099  -5.881  -6.484
  745    HA   ASP  98           HA       ASP  98  -0.792  -4.983  -8.851
  746   1HB   ASP  98          HB2       ASP  98  -2.895  -3.661  -7.111
  747   2HB   ASP  98          HB1       ASP  98  -2.378  -3.014  -8.668
  748    H    LEU  99           HN       LEU  99  -0.802  -3.725  -5.547
  749    HA   LEU  99           HA       LEU  99   0.711  -1.362  -6.046
  750   1HB   LEU  99          HB2       LEU  99  -0.486  -1.757  -3.928
  751   2HB   LEU  99          HB1       LEU  99   0.593  -3.096  -3.555
  752    HG   LEU  99           HG       LEU  99   2.513  -1.545  -3.515
  753   1HD1  LEU  99          HD11      LEU  99   1.792   0.976  -3.402
  754   2HD1  LEU  99          HD12      LEU  99   0.387   0.435  -4.319
  755   3HD1  LEU  99          HD13      LEU  99   2.009   0.220  -4.978
  756   1HD2  LEU  99          HD21      LEU  99   1.977  -0.488  -1.417
  757   2HD2  LEU  99          HD22      LEU  99   1.097  -2.015  -1.475
  758   3HD2  LEU  99          HD23      LEU  99   0.253  -0.500  -1.791
  759    H    LEU 100           HN       LEU 100   1.675  -4.702  -5.360
  760    HA   LEU 100           HA       LEU 100   4.435  -4.308  -4.960
  761   1HB   LEU 100          HB2       LEU 100   3.296  -6.456  -4.579
  762   2HB   LEU 100          HB1       LEU 100   3.058  -6.641  -6.314
  763    HG   LEU 100           HG       LEU 100   5.523  -6.637  -6.642
  764   1HD1  LEU 100          HD11      LEU 100   6.801  -7.066  -4.369
  765   2HD1  LEU 100          HD12      LEU 100   5.455  -6.169  -3.667
  766   3HD1  LEU 100          HD13      LEU 100   6.476  -5.416  -4.893
  767   1HD2  LEU 100          HD21      LEU 100   5.907  -8.860  -5.765
  768   2HD2  LEU 100          HD22      LEU 100   4.214  -8.748  -6.244
  769   3HD2  LEU 100          HD23      LEU 100   4.657  -8.641  -4.540
  770    H    LEU 101           HN       LEU 101   2.701  -4.776  -8.076
  771    HA   LEU 101           HA       LEU 101   5.060  -4.863  -9.681
  772   1HB   LEU 101          HB2       LEU 101   2.231  -3.986 -10.256
  773   2HB   LEU 101          HB1       LEU 101   3.477  -3.831 -11.489
  774    HG   LEU 101           HG       LEU 101   2.156  -5.961 -11.633
  775   1HD1  LEU 101          HD11      LEU 101   4.716  -5.630 -12.262
  776   2HD1  LEU 101          HD12      LEU 101   3.968  -7.222 -12.326
  777   3HD1  LEU 101          HD13      LEU 101   4.963  -6.778 -10.944
  778   1HD2  LEU 101          HD21      LEU 101   1.965  -6.169  -9.124
  779   2HD2  LEU 101          HD22      LEU 101   3.631  -6.737  -9.110
  780   3HD2  LEU 101          HD23      LEU 101   2.389  -7.657  -9.961
  781    H    HIS 102           HN       HIS 102   3.105  -2.084  -8.625
  782    HA   HIS 102           HA       HIS 102   4.722  -0.150 -10.014
  783   1HB   HIS 102          HB2       HIS 102   2.713   0.051  -7.772
  784   2HB   HIS 102          HB1       HIS 102   3.592   1.466  -8.352
  785    HD1  HIS 102           HD1      HIS 102   3.117   2.273 -10.769
  786    HD2  HIS 102           HD2      HIS 102   0.796  -0.982  -9.600
  787    HE1  HIS 102           HE1      HIS 102   1.309   2.029 -12.517
  788    H    LEU 103           HN       LEU 103   4.867  -1.400  -6.657
  789    HA   LEU 103           HA       LEU 103   6.718   0.514  -5.696
  790   1HB   LEU 103          HB2       LEU 103   6.462  -2.424  -5.008
  791   2HB   LEU 103          HB1       LEU 103   7.489  -1.301  -4.122
  792    HG   LEU 103           HG       LEU 103   4.511  -0.906  -4.519
  793   1HD1  LEU 103          HD11      LEU 103   4.457  -1.552  -2.039
  794   2HD1  LEU 103          HD12      LEU 103   6.082  -2.194  -2.280
  795   3HD1  LEU 103          HD13      LEU 103   4.726  -2.867  -3.180
  796   1HD2  LEU 103          HD21      LEU 103   5.000   0.565  -2.386
  797   2HD2  LEU 103          HD22      LEU 103   5.371   1.210  -3.979
  798   3HD2  LEU 103          HD23      LEU 103   6.657   0.543  -2.978
  799    H    LYS 104           HN       LYS 104   7.542  -2.713  -7.094
  800    HA   LYS 104           HA       LYS 104  10.352  -2.047  -7.161
  801   1HB   LYS 104          HB2       LYS 104  10.615  -4.070  -8.541
  802   2HB   LYS 104          HB1       LYS 104   9.623  -4.379  -7.119
  803   1HG   LYS 104          HG2       LYS 104   7.582  -4.139  -8.491
  804   2HG   LYS 104          HG1       LYS 104   8.585  -3.850  -9.916
  805   1HD   LYS 104          HD2       LYS 104   9.611  -6.058  -9.688
  806   2HD   LYS 104          HD1       LYS 104   8.702  -6.353  -8.206
  807   1HE   LYS 104          HE2       LYS 104   7.787  -7.343 -10.429
  808   2HE   LYS 104          HE1       LYS 104   6.657  -6.531  -9.346
  809   1HZ   LYS 104          HZ1       LYS 104   8.054  -5.030 -11.465
  810   2HZ   LYS 104          HZ2       LYS 104   6.595  -4.659 -10.677
  811   3HZ   LYS 104          HZ3       LYS 104   6.651  -5.914 -11.822
  812    H    LYS 105           HN       LYS 105   7.738  -1.225  -9.235
  813    HA   LYS 105           HA       LYS 105   9.141  -0.947 -11.714
  814   1HB   LYS 105          HB2       LYS 105   6.671  -0.855 -11.497
  815   2HB   LYS 105          HB1       LYS 105   6.815   0.683 -10.654
  816   1HG   LYS 105          HG2       LYS 105   7.879   1.684 -12.641
  817   2HG   LYS 105          HG1       LYS 105   7.733   0.144 -13.491
  818   1HD   LYS 105          HD2       LYS 105   5.280   0.232 -13.237
  819   2HD   LYS 105          HD1       LYS 105   5.424   1.773 -12.390
  820   1HE   LYS 105          HE2       LYS 105   6.380   1.271 -15.224
  821   2HE   LYS 105          HE1       LYS 105   4.858   2.054 -14.804
  822   1HZ   LYS 105          HZ1       LYS 105   7.413   3.050 -13.719
  823   2HZ   LYS 105          HZ2       LYS 105   5.940   3.876 -13.913
  824   3HZ   LYS 105          HZ3       LYS 105   6.897   3.510 -15.268
  825    H    LEU 106           HN       LEU 106   8.473   1.470  -9.149
  826    HA   LEU 106           HA       LEU 106   9.929   3.589 -10.400
  827   1HB   LEU 106          HB2       LEU 106   9.101   3.045  -7.551
  828   2HB   LEU 106          HB1       LEU 106  10.090   4.445  -7.942
  829    HG   LEU 106           HG       LEU 106   7.558   4.830  -7.871
  830   1HD1  LEU 106          HD11      LEU 106   8.665   5.497 -10.598
  831   2HD1  LEU 106          HD12      LEU 106   9.326   6.246  -9.147
  832   3HD1  LEU 106          HD13      LEU 106   7.629   6.463  -9.553
  833   1HD2  LEU 106          HD21      LEU 106   6.204   4.075  -9.681
  834   2HD2  LEU 106          HD22      LEU 106   7.091   2.661  -9.127
  835   3HD2  LEU 106          HD23      LEU 106   7.602   3.499 -10.587
  836    H    PHE 107           HN       PHE 107  10.980   0.845  -8.502
  837    HA   PHE 107           HA       PHE 107  13.503   1.819  -7.630
  838   1HB   PHE 107          HB2       PHE 107  12.561  -0.333  -6.869
  839   2HB   PHE 107          HB1       PHE 107  12.775  -0.999  -8.486
  840    HD1  PHE 107           HD1      PHE 107  14.717   0.749  -5.800
  841    HD2  PHE 107           HD2      PHE 107  14.776  -2.118  -8.994
  842    HE1  PHE 107           HE1      PHE 107  17.063   0.194  -5.250
  843    HE2  PHE 107           HE2      PHE 107  17.128  -2.680  -8.443
  844    HZ   PHE 107           HZ       PHE 107  18.273  -1.524  -6.570
  845    H    ARG 108           HN       ARG 108  12.571   0.296 -10.710
  846    HA   ARG 108           HA       ARG 108  15.196   0.127 -11.798
  847   1HB   ARG 108          HB2       ARG 108  12.501   0.430 -13.138
  848   2HB   ARG 108          HB1       ARG 108  14.000   0.165 -14.031
  849   1HG   ARG 108          HG2       ARG 108  14.391  -1.914 -12.757
  850   2HG   ARG 108          HG1       ARG 108  12.886  -1.655 -11.875
  851   1HD   ARG 108          HD2       ARG 108  13.031  -1.895 -14.890
  852   2HD   ARG 108          HD1       ARG 108  12.694  -3.255 -13.822
  853    HE   ARG 108           HE       ARG 108  10.838  -1.320 -13.081
  854   1HH1  ARG 108          HH21      ARG 108  11.822  -2.889 -15.989
  855   2HH1  ARG 108          HH22      ARG 108  10.253  -2.815 -16.718
  856   1HH2  ARG 108          HH11      ARG 108   8.781  -1.220 -14.016
  857   2HH2  ARG 108          HH12      ARG 108   8.532  -1.869 -15.601
  858    H    GLU 109           HN       GLU 109  12.853   2.799 -11.789
  859    HA   GLU 109           HA       GLU 109  14.582   4.457 -13.483
  860   1HB   GLU 109          HB2       GLU 109  12.051   5.043 -11.922
  861   2HB   GLU 109          HB1       GLU 109  12.880   6.236 -12.924
  862   1HG   GLU 109          HG2       GLU 109  12.637   4.762 -14.889
  863   2HG   GLU 109          HG1       GLU 109  11.804   3.569 -13.890
  864    H    GLY 110           HN       GLY 110  14.535   3.643 -10.187
  865   1HA   GLY 110          HA2       GLY 110  15.791   4.461  -8.385
  866   2HA   GLY 110          HA1       GLY 110  16.721   5.381  -9.568
  867    H    ARG 111           HN       ARG 111  13.430   6.078  -9.866
  868    HA   ARG 111           HA       ARG 111  13.834   8.691  -8.487
  869   1HB   ARG 111          HB2       ARG 111  11.713   7.685 -10.410
  870   2HB   ARG 111          HB1       ARG 111  11.654   9.267  -9.635
  871   1HG   ARG 111          HG2       ARG 111  13.830   9.840 -10.637
  872   2HG   ARG 111          HG1       ARG 111  13.887   8.266 -11.426
  873   1HD   ARG 111          HD2       ARG 111  11.709   8.820 -12.541
  874   2HD   ARG 111          HD1       ARG 111  11.817  10.444 -11.876
  875    HE   ARG 111           HE       ARG 111  13.121   9.457 -14.244
  876   1HH1  ARG 111          HH21      ARG 111  13.770  11.387 -11.452
  877   2HH1  ARG 111          HH22      ARG 111  15.157  12.147 -12.154
  878   1HH2  ARG 111          HH11      ARG 111  14.899  10.456 -15.163
  879   2HH2  ARG 111          HH12      ARG 111  15.792  11.627 -14.250
  880    H    PHE 112           HN       PHE 112  13.476   8.239  -6.313
  881    HA   PHE 112           HA       PHE 112  11.090   6.663  -5.536
  882   1HB   PHE 112          HB2       PHE 112  13.241   7.924  -3.812
  883   2HB   PHE 112          HB1       PHE 112  12.049   6.718  -3.307
  884    HD1  PHE 112           HD1      PHE 112  12.075   4.438  -4.296
  885    HD2  PHE 112           HD2      PHE 112  15.187   7.288  -5.082
  886    HE1  PHE 112           HE1      PHE 112  13.518   2.629  -5.164
  887    HE2  PHE 112           HE2      PHE 112  16.635   5.467  -5.950
  888    HZ   PHE 112           HZ       PHE 112  15.798   3.135  -5.989
  889    H    ASN 113           HN       ASN 113   9.346   7.517  -4.438
  890    HA   ASN 113           HA       ASN 113   7.790   9.138  -3.806
  891   1HB   ASN 113          HB2       ASN 113   9.589   9.594  -2.099
  892   2HB   ASN 113          HB1       ASN 113  10.214  10.844  -3.175
  893   1HD2  ASN 113          HD21      ASN 113   7.466   9.970  -1.107
  894   2HD2  ASN 113          HD22      ASN 113   6.764  11.515  -1.092
  Start of MODEL   23
    1   1H    MET   1           HT1      MET   1  20.761   2.683  13.553
    2   2H    MET   1           HT2      MET   1  21.380   2.892  11.985
    3   3H    MET   1           HT3      MET   1  19.788   3.366  12.344
    4    HA   MET   1           HA       MET   1  21.203   4.768  14.162
    5   1HB   MET   1          HB2       MET   1  22.760   4.565  11.570
    6   2HB   MET   1          HB1       MET   1  22.990   5.860  12.746
    7   1HG   MET   1          HG2       MET   1  23.545   4.186  14.478
    8   2HG   MET   1          HG1       MET   1  23.321   2.896  13.295
    9   1HE   MET   1          HE1       MET   1  26.759   2.263  13.212
   10   2HE   MET   1          HE2       MET   1  25.333   2.177  14.241
   11   3HE   MET   1          HE3       MET   1  26.647   3.273  14.658
   12    H    GLY   2           HN       GLY   2  21.844   6.361  11.279
   13   1HA   GLY   2          HA2       GLY   2  19.561   8.099  11.596
   14   2HA   GLY   2          HA1       GLY   2  20.728   8.174  10.274
   15    HA   PRO   3           HA       PRO   3  16.380   6.258   9.131
   16   1HB   PRO   3          HB2       PRO   3  16.261   8.404   7.150
   17   2HB   PRO   3          HB1       PRO   3  15.116   8.031   8.443
   18   1HG   PRO   3          HG2       PRO   3  17.077  10.167   8.348
   19   2HG   PRO   3          HG1       PRO   3  15.856   9.857   9.588
   20   1HD   PRO   3          HD2       PRO   3  18.660   9.544   9.895
   21   2HD   PRO   3          HD1       PRO   3  17.412   8.932  11.006
   22    H    VAL   4           HN       VAL   4  16.149   5.009   7.189
   23    HA   VAL   4           HA       VAL   4  18.642   4.517   5.775
   24    HB   VAL   4           HB       VAL   4  17.210   2.815   4.537
   25   1HG1  VAL   4          HG11      VAL   4  16.922   1.381   6.565
   26   2HG1  VAL   4          HG12      VAL   4  17.248   2.795   7.568
   27   3HG1  VAL   4          HG13      VAL   4  18.501   2.163   6.499
   28   1HG2  VAL   4          HG21      VAL   4  15.121   3.486   6.614
   29   2HG2  VAL   4          HG22      VAL   4  14.955   2.478   5.175
   30   3HG2  VAL   4          HG23      VAL   4  15.088   4.228   5.015
   31    HA   PRO   5           HA       PRO   5  17.888   7.277   2.358
   32   1HB   PRO   5          HB2       PRO   5  18.780   5.512   0.276
   33   2HB   PRO   5          HB1       PRO   5  19.714   6.770   1.092
   34   1HG   PRO   5          HG2       PRO   5  19.881   3.868   1.416
   35   2HG   PRO   5          HG1       PRO   5  20.989   5.115   1.997
   36   1HD   PRO   5          HD2       PRO   5  19.202   3.588   3.594
   37   2HD   PRO   5          HD1       PRO   5  20.099   5.041   4.105
   38    HA   PRO   6           HA       PRO   6  13.979   6.312   0.526
   39   1HB   PRO   6          HB2       PRO   6  14.478   7.064  -2.172
   40   2HB   PRO   6          HB1       PRO   6  13.854   8.099  -0.882
   41   1HG   PRO   6          HG2       PRO   6  16.567   8.005  -2.052
   42   2HG   PRO   6          HG1       PRO   6  15.782   9.307  -1.147
   43   1HD   PRO   6          HD2       PRO   6  17.812   7.657  -0.146
   44   2HD   PRO   6          HD1       PRO   6  16.686   8.605   0.857
   45    H    SER   7           HN       SER   7  16.544   5.360  -1.779
   46    HA   SER   7           HA       SER   7  15.058   3.306  -3.064
   47   1HB   SER   7          HB2       SER   7  17.170   2.548  -3.951
   48   2HB   SER   7          HB1       SER   7  17.231   4.306  -3.867
   49    HG   SER   7           HG       SER   7  18.021   3.163  -1.543
   50    H    THR   8           HN       THR   8  17.123   3.200  -0.174
   51    HA   THR   8           HA       THR   8  17.009   0.329   0.086
   52    HB   THR   8           HB       THR   8  17.508   2.435   2.214
   53    HG1  THR   8           HG1      THR   8  19.433   0.846   0.925
   54   1HG2  THR   8          HG21      THR   8  16.985   0.366   3.296
   55   2HG2  THR   8          HG22      THR   8  18.746   0.470   3.274
   56   3HG2  THR   8          HG23      THR   8  17.908  -0.560   2.114
   57    H    ALA   9           HN       ALA   9  15.024   2.963   1.439
   58    HA   ALA   9           HA       ALA   9  13.445   1.370   3.194
   59   1HB   ALA   9          HB1       ALA   9  13.393   3.826   3.248
   60   2HB   ALA   9          HB2       ALA   9  11.767   3.187   3.004
   61   3HB   ALA   9          HB3       ALA   9  12.665   3.858   1.642
   62    H    LEU  10           HN       LEU  10  13.009   2.169  -0.248
   63    HA   LEU  10           HA       LEU  10  10.480   0.916  -0.587
   64   1HB   LEU  10          HB2       LEU  10  11.487   2.395  -2.281
   65   2HB   LEU  10          HB1       LEU  10  12.767   1.216  -2.562
   66    HG   LEU  10           HG       LEU  10  11.026  -0.430  -3.285
   67   1HD1  LEU  10          HD11      LEU  10   8.787   0.715  -3.945
   68   2HD1  LEU  10          HD12      LEU  10   9.234   1.944  -2.763
   69   3HD1  LEU  10          HD13      LEU  10   9.011   0.270  -2.255
   70   1HD2  LEU  10          HD21      LEU  10  11.211   2.237  -4.700
   71   2HD2  LEU  10          HD22      LEU  10  10.504   0.802  -5.432
   72   3HD2  LEU  10          HD23      LEU  10  12.202   0.805  -4.974
   73    H    ARG  11           HN       ARG  11  13.783  -0.407  -1.033
   74    HA   ARG  11           HA       ARG  11  12.948  -3.038  -1.742
   75   1HB   ARG  11          HB2       ARG  11  15.429  -2.027  -0.336
   76   2HB   ARG  11          HB1       ARG  11  15.225  -3.709  -0.806
   77   1HG   ARG  11          HG2       ARG  11  14.890  -1.485  -2.821
   78   2HG   ARG  11          HG1       ARG  11  16.489  -2.118  -2.435
   79   1HD   ARG  11          HD2       ARG  11  15.586  -4.434  -2.967
   80   2HD   ARG  11          HD1       ARG  11  14.135  -3.651  -3.579
   81    HE   ARG  11           HE       ARG  11  16.219  -2.387  -4.915
   82   1HH1  ARG  11          HH21      ARG  11  15.091  -5.603  -4.414
   83   2HH1  ARG  11          HH22      ARG  11  15.699  -6.194  -5.924
   84   1HH2  ARG  11          HH11      ARG  11  17.028  -3.143  -6.881
   85   2HH2  ARG  11          HH12      ARG  11  16.794  -4.801  -7.321
   86    H    GLU  12           HN       GLU  12  13.599  -1.575   1.431
   87    HA   GLU  12           HA       GLU  12  13.166  -3.953   2.958
   88   1HB   GLU  12          HB2       GLU  12  12.813  -1.020   3.642
   89   2HB   GLU  12          HB1       GLU  12  12.650  -2.318   4.828
   90   1HG   GLU  12          HG2       GLU  12  14.945  -3.069   4.328
   91   2HG   GLU  12          HG1       GLU  12  15.113  -1.775   3.141
   92    H    LEU  13           HN       LEU  13  10.969  -1.431   1.781
   93    HA   LEU  13           HA       LEU  13   8.629  -2.504   3.088
   94   1HB   LEU  13          HB2       LEU  13   8.753  -0.163   2.302
   95   2HB   LEU  13          HB1       LEU  13   8.866  -0.724   0.637
   96    HG   LEU  13           HG       LEU  13   6.632  -1.769   0.835
   97   1HD1  LEU  13          HD11      LEU  13   6.913  -0.810   3.677
   98   2HD1  LEU  13          HD12      LEU  13   6.310  -2.355   3.074
   99   3HD1  LEU  13          HD13      LEU  13   5.307  -0.912   2.953
  100   1HD2  LEU  13          HD21      LEU  13   6.459   1.088   1.814
  101   2HD2  LEU  13          HD22      LEU  13   5.387   0.254   0.688
  102   3HD2  LEU  13          HD23      LEU  13   7.020   0.692   0.189
  103    H    ILE  14           HN       ILE  14   9.953  -2.827  -0.226
  104    HA   ILE  14           HA       ILE  14   7.854  -4.455  -1.251
  105    HB   ILE  14           HB       ILE  14  10.795  -4.322  -1.973
  106   1HG1  ILE  14          HG12      ILE  14   8.337  -3.296  -3.432
  107   2HG1  ILE  14          HG11      ILE  14   9.307  -2.305  -2.345
  108   1HG2  ILE  14          HG21      ILE  14  10.143  -6.463  -2.747
  109   2HG2  ILE  14          HG22      ILE  14   9.896  -5.424  -4.149
  110   3HG2  ILE  14          HG23      ILE  14   8.521  -5.915  -3.163
  111   1HD1  ILE  14          HD11      ILE  14  10.337  -3.707  -4.828
  112   2HD1  ILE  14          HD12      ILE  14  11.297  -2.703  -3.743
  113   3HD1  ILE  14          HD13      ILE  14   9.997  -1.983  -4.693
  114    H    GLU  15           HN       GLU  15  10.966  -5.432   0.208
  115    HA   GLU  15           HA       GLU  15  10.548  -8.231   0.027
  116   1HB   GLU  15          HB2       GLU  15  12.140  -6.566   1.990
  117   2HB   GLU  15          HB1       GLU  15  12.198  -8.328   1.950
  118   1HG   GLU  15          HG2       GLU  15  12.758  -6.595  -0.472
  119   2HG   GLU  15          HG1       GLU  15  14.021  -7.181   0.612
  120    H    GLU  16           HN       GLU  16   9.604  -5.952   2.605
  121    HA   GLU  16           HA       GLU  16   8.654  -8.017   4.384
  122   1HB   GLU  16          HB2       GLU  16   9.240  -5.692   5.102
  123   2HB   GLU  16          HB1       GLU  16   7.802  -5.118   4.265
  124   1HG   GLU  16          HG2       GLU  16   6.358  -6.412   5.697
  125   2HG   GLU  16          HG1       GLU  16   7.742  -7.211   6.446
  126    H    LEU  17           HN       LEU  17   7.003  -5.951   1.989
  127    HA   LEU  17           HA       LEU  17   4.361  -6.828   2.585
  128   1HB   LEU  17          HB2       LEU  17   5.599  -5.841   0.002
  129   2HB   LEU  17          HB1       LEU  17   3.875  -6.153   0.186
  130    HG   LEU  17           HG       LEU  17   5.468  -4.249   1.933
  131   1HD1  LEU  17          HD11      LEU  17   5.372  -3.389  -0.337
  132   2HD1  LEU  17          HD12      LEU  17   4.239  -2.479   0.662
  133   3HD1  LEU  17          HD13      LEU  17   3.644  -3.729  -0.431
  134   1HD2  LEU  17          HD21      LEU  17   3.631  -4.693   3.259
  135   2HD2  LEU  17          HD22      LEU  17   2.626  -5.201   1.904
  136   3HD2  LEU  17          HD23      LEU  17   2.881  -3.486   2.218
  137    H    VAL  18           HN       VAL  18   6.796  -8.140   0.356
  138    HA   VAL  18           HA       VAL  18   5.115 -10.208  -0.720
  139    HB   VAL  18           HB       VAL  18   8.121  -9.950  -0.482
  140   1HG1  VAL  18          HG11      VAL  18   6.422 -12.021  -1.889
  141   2HG1  VAL  18          HG12      VAL  18   7.701 -12.298  -0.705
  142   3HG1  VAL  18          HG13      VAL  18   8.104 -11.715  -2.319
  143   1HG2  VAL  18          HG21      VAL  18   6.169  -9.517  -2.765
  144   2HG2  VAL  18          HG22      VAL  18   7.924  -9.425  -2.909
  145   3HG2  VAL  18          HG23      VAL  18   7.061  -8.265  -1.900
  146    H    ASN  19           HN       ASN  19   7.362 -10.120   2.027
  147    HA   ASN  19           HA       ASN  19   7.351 -12.880   2.649
  148   1HB   ASN  19          HB2       ASN  19   7.680 -10.430   4.391
  149   2HB   ASN  19          HB1       ASN  19   7.919 -12.073   4.989
  150   1HD2  ASN  19          HD21      ASN  19  10.064 -10.144   4.850
  151   2HD2  ASN  19          HD22      ASN  19  11.194 -10.703   3.713
  152    H    ILE  20           HN       ILE  20   5.069 -10.336   3.695
  153    HA   ILE  20           HA       ILE  20   3.654 -12.165   5.451
  154    HB   ILE  20           HB       ILE  20   2.032 -10.324   5.693
  155   1HG1  ILE  20          HG12      ILE  20   3.770  -8.819   3.711
  156   2HG1  ILE  20          HG11      ILE  20   2.228  -9.557   3.273
  157   1HG2  ILE  20          HG21      ILE  20   4.960  -9.531   5.757
  158   2HG2  ILE  20          HG22      ILE  20   4.048 -10.291   7.063
  159   3HG2  ILE  20          HG23      ILE  20   3.668  -8.642   6.564
  160   1HD1  ILE  20          HD11      ILE  20   2.594  -7.508   5.476
  161   2HD1  ILE  20          HD12      ILE  20   1.064  -8.203   4.942
  162   3HD1  ILE  20          HD13      ILE  20   1.979  -7.151   3.862
  163    H    THR  21           HN       THR  21   3.494 -11.609   2.043
  164    HA   THR  21           HA       THR  21   0.711 -12.707   1.911
  165    HB   THR  21           HB       THR  21   0.810 -12.066  -0.478
  166    HG1  THR  21           HG1      THR  21   3.410 -11.225   0.263
  167   1HG2  THR  21          HG21      THR  21   0.344 -10.413   1.565
  168   2HG2  THR  21          HG22      THR  21   0.424  -9.816  -0.091
  169   3HG2  THR  21          HG23      THR  21   1.818  -9.648   0.971
  170    H    GLN  22           HN       GLN  22   4.031 -13.608   1.310
  171    HA   GLN  22           HA       GLN  22   3.427 -15.775  -0.517
  172   1HB   GLN  22          HB2       GLN  22   5.841 -15.128   1.181
  173   2HB   GLN  22          HB1       GLN  22   5.770 -16.539   0.124
  174   1HG   GLN  22          HG2       GLN  22   5.227 -13.728  -0.853
  175   2HG   GLN  22          HG1       GLN  22   6.826 -14.470  -0.918
  176   1HE2  GLN  22          HE21      GLN  22   4.421 -13.800  -2.956
  177   2HE2  GLN  22          HE22      GLN  22   4.431 -15.178  -3.947
  178    H    ASN  23           HN       ASN  23   3.878 -15.573   2.996
  179    HA   ASN  23           HA       ASN  23   3.327 -18.490   3.237
  180   1HB   ASN  23          HB2       ASN  23   4.277 -16.407   5.216
  181   2HB   ASN  23          HB1       ASN  23   3.892 -18.069   5.664
  182   1HD2  ASN  23          HD21      ASN  23   6.578 -16.697   5.665
  183   2HD2  ASN  23          HD22      ASN  23   7.567 -17.646   4.664
  184    H    GLN  24           HN       GLN  24   1.318 -16.033   2.812
  185    HA   GLN  24           HA       GLN  24  -0.369 -16.330   5.193
  186   1HB   GLN  24          HB2       GLN  24  -1.784 -14.700   4.230
  187   2HB   GLN  24          HB1       GLN  24  -0.174 -14.229   3.703
  188   1HG   GLN  24          HG2       GLN  24  -0.604 -15.506   1.555
  189   2HG   GLN  24          HG1       GLN  24  -2.276 -15.691   2.083
  190   1HE2  GLN  24          HE21      GLN  24  -2.060 -14.293  -0.225
  191   2HE2  GLN  24          HE22      GLN  24  -2.257 -12.627   0.031
  192    H    LYS  25           HN       LYS  25  -1.973 -17.800   5.463
  193    HA   LYS  25           HA       LYS  25  -2.497 -19.733   3.299
  194   1HB   LYS  25          HB2       LYS  25  -2.207 -20.558   5.604
  195   2HB   LYS  25          HB1       LYS  25  -3.557 -19.564   6.143
  196   1HG   LYS  25          HG2       LYS  25  -4.278 -21.898   5.802
  197   2HG   LYS  25          HG1       LYS  25  -5.085 -20.829   4.657
  198   1HD   LYS  25          HD2       LYS  25  -3.762 -21.571   2.844
  199   2HD   LYS  25          HD1       LYS  25  -2.519 -22.236   3.906
  200   1HE   LYS  25          HE2       LYS  25  -3.957 -24.045   4.570
  201   2HE   LYS  25          HE1       LYS  25  -5.349 -23.305   3.780
  202   1HZ   LYS  25          HZ1       LYS  25  -3.494 -25.065   2.680
  203   2HZ   LYS  25          HZ2       LYS  25  -3.259 -23.564   1.919
  204   3HZ   LYS  25          HZ3       LYS  25  -4.791 -24.300   1.900
  205    H    ALA  26           HN       ALA  26  -4.837 -18.304   5.566
  206    HA   ALA  26           HA       ALA  26  -6.775 -17.993   3.380
  207   1HB   ALA  26          HB1       ALA  26  -6.836 -18.029   6.317
  208   2HB   ALA  26          HB2       ALA  26  -8.133 -18.398   5.183
  209   3HB   ALA  26          HB3       ALA  26  -7.835 -16.729   5.667
  210    HA   PRO  27           HA       PRO  27  -6.035 -13.801   2.186
  211   1HB   PRO  27          HB2       PRO  27  -8.587 -12.881   3.390
  212   2HB   PRO  27          HB1       PRO  27  -8.054 -12.810   1.708
  213   1HG   PRO  27          HG2       PRO  27  -9.941 -14.613   2.740
  214   2HG   PRO  27          HG1       PRO  27  -9.110 -14.770   1.187
  215   1HD   PRO  27          HD2       PRO  27  -8.785 -16.421   3.565
  216   2HD   PRO  27          HD1       PRO  27  -8.013 -16.621   1.972
  217    H    LEU  28           HN       LEU  28  -5.633 -11.590   3.157
  218    HA   LEU  28           HA       LEU  28  -4.464 -11.822   5.778
  219   1HB   LEU  28          HB2       LEU  28  -5.106  -9.363   4.123
  220   2HB   LEU  28          HB1       LEU  28  -4.137  -9.347   5.592
  221    HG   LEU  28           HG       LEU  28  -3.469 -10.999   3.136
  222   1HD1  LEU  28          HD11      LEU  28  -3.370  -8.564   2.681
  223   2HD1  LEU  28          HD12      LEU  28  -1.764  -9.289   2.675
  224   3HD1  LEU  28          HD13      LEU  28  -2.306  -8.356   4.070
  225   1HD2  LEU  28          HD21      LEU  28  -1.145 -10.841   4.364
  226   2HD2  LEU  28          HD22      LEU  28  -2.333 -12.005   4.935
  227   3HD2  LEU  28          HD23      LEU  28  -2.119 -10.477   5.787
  228    H    CYS  29           HN       CYS  29  -7.657 -11.138   4.724
  229    HA   CYS  29           HA       CYS  29  -8.448 -10.619   7.539
  230   1HB   CYS  29          HB2       CYS  29  -9.240  -8.826   5.222
  231   2HB   CYS  29          HB1       CYS  29  -9.862  -8.708   6.868
  232    H    ASN  30           HN       ASN  30 -10.980 -10.546   7.580
  233    HA   ASN  30           HA       ASN  30 -11.923 -13.038   6.526
  234   1HB   ASN  30          HB2       ASN  30 -14.189 -12.073   7.286
  235   2HB   ASN  30          HB1       ASN  30 -12.945 -12.265   8.522
  236   1HD2  ASN  30          HD21      ASN  30 -12.345  -9.726   6.240
  237   2HD2  ASN  30          HD22      ASN  30 -12.792  -8.432   7.243
  238    H    GLY  31           HN       GLY  31 -10.988 -11.766   4.280
  239   1HA   GLY  31          HA2       GLY  31 -11.740 -11.490   2.059
  240   2HA   GLY  31          HA1       GLY  31 -13.395 -11.661   2.640
  241    H    SER  32           HN       SER  32 -11.073  -9.299   3.888
  242    HA   SER  32           HA       SER  32 -12.918  -7.128   3.657
  243   1HB   SER  32          HB2       SER  32  -9.894  -7.052   3.844
  244   2HB   SER  32          HB1       SER  32 -10.965  -5.682   4.119
  245    HG   SER  32           HG       SER  32 -10.565  -6.571   6.096
  246    H    MET  33           HN       MET  33 -12.935  -5.371   2.170
  247    HA   MET  33           HA       MET  33 -11.519  -5.844  -0.434
  248   1HB   MET  33          HB2       MET  33 -14.410  -5.027   0.017
  249   2HB   MET  33          HB1       MET  33 -13.595  -4.986  -1.545
  250   1HG   MET  33          HG2       MET  33 -13.173  -7.393  -1.434
  251   2HG   MET  33          HG1       MET  33 -13.898  -7.466   0.172
  252   1HE   MET  33          HE1       MET  33 -14.910  -5.708  -3.316
  253   2HE   MET  33          HE2       MET  33 -15.924  -7.023  -3.897
  254   3HE   MET  33          HE3       MET  33 -14.229  -7.328  -3.526
  255    H    VAL  34           HN       VAL  34 -10.868  -3.938  -1.503
  256    HA   VAL  34           HA       VAL  34 -11.220  -1.371   0.020
  257    HB   VAL  34           HB       VAL  34  -8.852  -0.835  -0.593
  258   1HG1  VAL  34          HG11      VAL  34  -9.322  -3.343   1.044
  259   2HG1  VAL  34          HG12      VAL  34  -9.335  -1.684   1.639
  260   3HG1  VAL  34          HG13      VAL  34  -7.830  -2.404   1.065
  261   1HG2  VAL  34          HG21      VAL  34  -8.551  -2.315  -2.491
  262   2HG2  VAL  34          HG22      VAL  34  -8.899  -3.731  -1.500
  263   3HG2  VAL  34          HG23      VAL  34  -7.420  -2.811  -1.233
  264    H    TRP  35           HN       TRP  35 -10.851   0.556  -1.320
  265    HA   TRP  35           HA       TRP  35 -12.203   0.343  -3.866
  266   1HB   TRP  35          HB2       TRP  35 -10.716   2.622  -2.538
  267   2HB   TRP  35          HB1       TRP  35 -11.619   2.785  -4.041
  268    HD1  TRP  35           HD1      TRP  35 -12.053   2.355  -0.300
  269    HE1  TRP  35           HE1      TRP  35 -14.531   2.728   0.303
  270    HE3  TRP  35           HE3      TRP  35 -14.070   2.550  -4.987
  271    HZ2  TRP  35           HZ2      TRP  35 -17.041   3.068  -1.031
  272    HZ3  TRP  35           HZ3      TRP  35 -16.507   2.893  -5.290
  273    HH2  TRP  35           HH2      TRP  35 -17.992   3.154  -3.322
  274    H    SER  36           HN       SER  36 -11.300   0.124  -5.883
  275    HA   SER  36           HA       SER  36  -8.452  -0.354  -6.150
  276   1HB   SER  36          HB2       SER  36 -10.111  -1.404  -7.671
  277   2HB   SER  36          HB1       SER  36 -10.557   0.187  -8.278
  278    HG   SER  36           HG       SER  36  -8.253   0.389  -8.817
  279    H    ILE  37           HN       ILE  37  -6.894   1.106  -7.003
  280    HA   ILE  37           HA       ILE  37  -7.823   3.933  -7.426
  281    HB   ILE  37           HB       ILE  37  -5.706   4.654  -6.294
  282   1HG1  ILE  37          HG12      ILE  37  -5.560   1.854  -5.157
  283   2HG1  ILE  37          HG11      ILE  37  -4.677   2.268  -6.623
  284   1HG2  ILE  37          HG21      ILE  37  -6.587   4.424  -4.074
  285   2HG2  ILE  37          HG22      ILE  37  -7.442   2.941  -4.498
  286   3HG2  ILE  37          HG23      ILE  37  -7.975   4.487  -5.160
  287   1HD1  ILE  37          HD11      ILE  37  -3.389   2.530  -4.437
  288   2HD1  ILE  37          HD12      ILE  37  -4.449   3.894  -4.083
  289   3HD1  ILE  37          HD13      ILE  37  -3.395   3.940  -5.497
  290    H    ASN  38           HN       ASN  38  -6.290   5.236  -8.687
  291    HA   ASN  38           HA       ASN  38  -5.143   3.649 -10.890
  292   1HB   ASN  38          HB2       ASN  38  -5.165   6.658 -10.467
  293   2HB   ASN  38          HB1       ASN  38  -4.815   5.811 -11.974
  294   1HD2  ASN  38          HD21      ASN  38  -6.878   3.837 -11.905
  295   2HD2  ASN  38          HD22      ASN  38  -8.380   4.617 -12.029
  296    H    LEU  39           HN       LEU  39  -3.041   2.980 -10.776
  297    HA   LEU  39           HA       LEU  39  -1.299   4.045  -8.687
  298   1HB   LEU  39          HB2       LEU  39  -0.889   1.967 -10.851
  299   2HB   LEU  39          HB1       LEU  39   0.369   2.414  -9.705
  300    HG   LEU  39           HG       LEU  39  -0.864   0.393  -8.977
  301   1HD1  LEU  39          HD11      LEU  39  -1.742   2.499  -7.030
  302   2HD1  LEU  39          HD12      LEU  39  -0.020   2.338  -7.372
  303   3HD1  LEU  39          HD13      LEU  39  -0.923   0.966  -6.741
  304   1HD2  LEU  39          HD21      LEU  39  -3.296   2.113  -8.522
  305   2HD2  LEU  39          HD22      LEU  39  -3.176   0.359  -8.582
  306   3HD2  LEU  39          HD23      LEU  39  -3.052   1.298 -10.069
  307    H    THR  40           HN       THR  40  -0.376   6.004  -9.024
  308    HA   THR  40           HA       THR  40   1.118   6.441 -11.565
  309    HB   THR  40           HB       THR  40   0.307   8.877 -11.432
  310    HG1  THR  40           HG1      THR  40  -1.122   7.661  -9.426
  311   1HG2  THR  40          HG21      THR  40  -0.499   7.543 -13.226
  312   2HG2  THR  40          HG22      THR  40  -1.940   8.242 -12.487
  313   3HG2  THR  40          HG23      THR  40  -1.501   6.568 -12.151
  314    H    ALA  41           HN       ALA  41   0.732   9.163  -9.553
  315    HA   ALA  41           HA       ALA  41   3.537   8.901  -8.633
  316   1HB   ALA  41          HB1       ALA  41   1.612  11.232  -8.417
  317   2HB   ALA  41          HB2       ALA  41   2.787  11.001  -9.712
  318   3HB   ALA  41          HB3       ALA  41   3.339  11.274  -8.060
  319    H    GLY  42           HN       GLY  42   0.852  10.488  -6.941
  320   1HA   GLY  42          HA2       GLY  42   1.809   9.750  -4.351
  321   2HA   GLY  42          HA1       GLY  42   0.208  10.400  -4.691
  322    H    MET  43           HN       MET  43   1.704   7.343  -5.778
  323    HA   MET  43           HA       MET  43  -0.672   5.816  -5.396
  324   1HB   MET  43          HB2       MET  43   2.210   4.871  -5.336
  325   2HB   MET  43          HB1       MET  43   0.794   3.859  -5.629
  326   1HG   MET  43          HG2       MET  43   0.256   5.363  -7.584
  327   2HG   MET  43          HG1       MET  43   1.833   6.110  -7.365
  328   1HE   MET  43          HE1       MET  43   3.858   4.885  -7.019
  329   2HE   MET  43          HE2       MET  43   4.385   3.508  -7.984
  330   3HE   MET  43          HE3       MET  43   3.569   3.236  -6.447
  331    H    TYR  44           HN       TYR  44   2.120   6.409  -3.284
  332    HA   TYR  44           HA       TYR  44   1.413   4.601  -1.199
  333   1HB   TYR  44          HB2       TYR  44   2.921   7.228  -1.115
  334   2HB   TYR  44          HB1       TYR  44   2.810   6.113   0.246
  335    HD1  TYR  44           HD1      TYR  44   3.934   3.939   0.202
  336    HD2  TYR  44           HD2      TYR  44   4.194   6.643  -3.127
  337    HE1  TYR  44           HE1      TYR  44   5.800   2.604  -0.737
  338    HE2  TYR  44           HE2      TYR  44   6.065   5.308  -4.059
  339    HH   TYR  44           HH       TYR  44   6.987   3.099  -3.926
  340    H    CYS  45           HN       CYS  45   0.628   8.059  -1.613
  341    HA   CYS  45           HA       CYS  45  -0.887   8.265   0.825
  342   1HB   CYS  45          HB2       CYS  45  -0.843   9.897  -1.718
  343   2HB   CYS  45          HB1       CYS  45  -1.866  10.314  -0.345
  344    H    ALA  46           HN       ALA  46  -1.928   7.781  -2.570
  345    HA   ALA  46           HA       ALA  46  -4.718   7.654  -2.016
  346   1HB   ALA  46          HB1       ALA  46  -4.901   6.472  -4.166
  347   2HB   ALA  46          HB2       ALA  46  -3.163   6.169  -4.158
  348   3HB   ALA  46          HB3       ALA  46  -3.769   7.818  -4.306
  349    H    ALA  47           HN       ALA  47  -2.254   5.083  -2.135
  350    HA   ALA  47           HA       ALA  47  -4.019   2.919  -1.555
  351   1HB   ALA  47          HB1       ALA  47  -1.829   1.878  -0.620
  352   2HB   ALA  47          HB2       ALA  47  -1.062   3.369  -1.166
  353   3HB   ALA  47          HB3       ALA  47  -1.868   2.316  -2.328
  354    H    LEU  48           HN       LEU  48  -2.242   5.170   0.540
  355    HA   LEU  48           HA       LEU  48  -2.714   3.864   3.006
  356   1HB   LEU  48          HB2       LEU  48  -1.147   5.736   2.744
  357   2HB   LEU  48          HB1       LEU  48  -2.492   6.830   2.436
  358    HG   LEU  48           HG       LEU  48  -3.380   6.392   4.702
  359   1HD1  LEU  48          HD11      LEU  48  -2.737   4.214   5.301
  360   2HD1  LEU  48          HD12      LEU  48  -1.630   5.189   6.264
  361   3HD1  LEU  48          HD13      LEU  48  -1.074   4.447   4.762
  362   1HD2  LEU  48          HD21      LEU  48  -1.895   8.269   4.501
  363   2HD2  LEU  48          HD22      LEU  48  -0.477   7.223   4.488
  364   3HD2  LEU  48          HD23      LEU  48  -1.420   7.410   5.966
  365    H    GLU  49           HN       GLU  49  -4.700   6.459   1.474
  366    HA   GLU  49           HA       GLU  49  -6.651   6.507   3.546
  367   1HB   GLU  49          HB2       GLU  49  -8.207   7.384   1.706
  368   2HB   GLU  49          HB1       GLU  49  -6.730   8.304   1.997
  369   1HG   GLU  49          HG2       GLU  49  -5.637   7.194   0.113
  370   2HG   GLU  49          HG1       GLU  49  -7.073   6.203  -0.160
  371    H    SER  50           HN       SER  50  -6.409   4.469   0.644
  372    HA   SER  50           HA       SER  50  -8.966   3.227   0.898
  373   1HB   SER  50          HB2       SER  50  -6.343   2.156  -0.181
  374   2HB   SER  50          HB1       SER  50  -7.883   1.321  -0.349
  375    HG   SER  50           HG       SER  50  -8.461   2.710  -1.833
  376    H    LEU  51           HN       LEU  51  -5.816   2.460   2.346
  377    HA   LEU  51           HA       LEU  51  -6.712   0.067   3.686
  378   1HB   LEU  51          HB2       LEU  51  -4.356   1.895   4.188
  379   2HB   LEU  51          HB1       LEU  51  -4.608   0.364   5.023
  380    HG   LEU  51           HG       LEU  51  -4.453   0.630   2.004
  381   1HD1  LEU  51          HD11      LEU  51  -2.331  -0.252   3.978
  382   2HD1  LEU  51          HD12      LEU  51  -2.335   1.268   3.089
  383   3HD1  LEU  51          HD13      LEU  51  -2.172  -0.258   2.221
  384   1HD2  LEU  51          HD21      LEU  51  -5.534  -1.414   2.384
  385   2HD2  LEU  51          HD22      LEU  51  -4.732  -1.674   3.931
  386   3HD2  LEU  51          HD23      LEU  51  -3.851  -1.927   2.427
  387    H    ILE  52           HN       ILE  52  -6.558   3.483   4.654
  388    HA   ILE  52           HA       ILE  52  -7.017   3.178   7.420
  389    HB   ILE  52           HB       ILE  52  -7.940   5.317   5.479
  390   1HG1  ILE  52          HG12      ILE  52  -5.511   5.161   5.830
  391   2HG1  ILE  52          HG11      ILE  52  -6.141   6.642   6.532
  392   1HG2  ILE  52          HG21      ILE  52  -9.494   5.444   7.302
  393   2HG2  ILE  52          HG22      ILE  52  -8.308   6.728   7.532
  394   3HG2  ILE  52          HG23      ILE  52  -8.203   5.250   8.489
  395   1HD1  ILE  52          HD11      ILE  52  -4.859   5.952   8.313
  396   2HD1  ILE  52          HD12      ILE  52  -4.971   4.252   7.869
  397   3HD1  ILE  52          HD13      ILE  52  -6.308   5.030   8.709
  398    H    ASN  53           HN       ASN  53  -9.105   2.472   4.772
  399    HA   ASN  53           HA       ASN  53 -11.563   2.577   6.394
  400   1HB   ASN  53          HB2       ASN  53 -10.977   1.634   3.576
  401   2HB   ASN  53          HB1       ASN  53 -12.578   1.549   4.312
  402   1HD2  ASN  53          HD21      ASN  53 -11.816   3.245   1.999
  403   2HD2  ASN  53          HD22      ASN  53 -12.081   4.852   2.481
  404    H    VAL  54           HN       VAL  54  -9.034   0.354   5.803
  405    HA   VAL  54           HA       VAL  54 -10.692  -2.032   6.385
  406    HB   VAL  54           HB       VAL  54  -7.680  -1.836   6.085
  407   1HG1  VAL  54          HG11      VAL  54  -7.850  -4.229   5.582
  408   2HG1  VAL  54          HG12      VAL  54  -9.604  -4.160   5.756
  409   3HG1  VAL  54          HG13      VAL  54  -8.567  -3.895   7.158
  410   1HG2  VAL  54          HG21      VAL  54  -9.800  -2.428   3.997
  411   2HG2  VAL  54          HG22      VAL  54  -8.058  -2.531   3.746
  412   3HG2  VAL  54          HG23      VAL  54  -8.810  -0.971   4.072
  413    H    SER  55           HN       SER  55 -11.107  -2.546   8.480
  414    HA   SER  55           HA       SER  55  -9.088  -1.808  10.582
  415   1HB   SER  55          HB2       SER  55 -12.112  -1.665  10.732
  416   2HB   SER  55          HB1       SER  55 -11.034  -1.451  12.108
  417    HG   SER  55           HG       SER  55 -11.658   0.262  10.062
  418    H    GLY  56           HN       GLY  56  -8.886  -3.284  12.306
  419   1HA   GLY  56          HA2       GLY  56  -9.322  -5.296  13.507
  420   2HA   GLY  56          HA1       GLY  56 -10.506  -5.753  12.283
  421    H    CYS  57           HN       CYS  57  -7.288  -4.686  11.379
  422    HA   CYS  57           HA       CYS  57  -6.403  -7.502  10.967
  423   1HB   CYS  57          HB2       CYS  57  -6.729  -5.408   8.809
  424   2HB   CYS  57          HB1       CYS  57  -5.645  -6.788   8.624
  425    H    SER  58           HN       SER  58  -4.708  -7.285  12.409
  426    HA   SER  58           HA       SER  58  -3.007  -4.969  12.573
  427   1HB   SER  58          HB2       SER  58  -3.314  -6.685  14.391
  428   2HB   SER  58          HB1       SER  58  -2.341  -7.792  13.429
  429    HG   SER  58           HG       SER  58  -0.686  -6.820  14.271
  430    H    ALA  59           HN       ALA  59  -2.891  -7.944  10.709
  431    HA   ALA  59           HA       ALA  59  -0.221  -7.998   9.893
  432   1HB   ALA  59          HB1       ALA  59  -1.008  -9.098   7.838
  433   2HB   ALA  59          HB2       ALA  59  -2.649  -8.539   8.161
  434   3HB   ALA  59          HB3       ALA  59  -1.884  -9.702   9.244
  435    H    ILE  60           HN       ILE  60  -2.708  -5.691   8.937
  436    HA   ILE  60           HA       ILE  60  -0.826  -4.536   6.909
  437    HB   ILE  60           HB       ILE  60  -2.780  -3.352   6.018
  438   1HG1  ILE  60          HG12      ILE  60  -4.411  -4.882   8.070
  439   2HG1  ILE  60          HG11      ILE  60  -4.001  -3.176   8.234
  440   1HG2  ILE  60          HG21      ILE  60  -3.380  -6.287   6.469
  441   2HG2  ILE  60          HG22      ILE  60  -2.209  -5.683   5.296
  442   3HG2  ILE  60          HG23      ILE  60  -3.920  -5.294   5.114
  443   1HD1  ILE  60          HD11      ILE  60  -6.249  -3.499   7.224
  444   2HD1  ILE  60          HD12      ILE  60  -5.500  -4.373   5.888
  445   3HD1  ILE  60          HD13      ILE  60  -5.143  -2.663   6.134
  446    H    GLU  61           HN       GLU  61  -1.887  -4.022  10.103
  447    HA   GLU  61           HA       GLU  61  -2.026  -1.173  10.186
  448   1HB   GLU  61          HB2       GLU  61  -1.174  -3.219  12.244
  449   2HB   GLU  61          HB1       GLU  61  -1.222  -1.492  12.602
  450   1HG   GLU  61          HG2       GLU  61  -3.590  -3.017  11.487
  451   2HG   GLU  61          HG1       GLU  61  -3.332  -2.760  13.215
  452    H    LYS  62           HN       LYS  62   0.767  -3.376  10.456
  453    HA   LYS  62           HA       LYS  62   2.721  -1.315  10.893
  454   1HB   LYS  62          HB2       LYS  62   2.936  -4.085   9.672
  455   2HB   LYS  62          HB1       LYS  62   4.332  -3.053   9.989
  456   1HG   LYS  62          HG2       LYS  62   3.715  -2.937  12.367
  457   2HG   LYS  62          HG1       LYS  62   2.320  -3.970  12.057
  458   1HD   LYS  62          HD2       LYS  62   3.821  -5.773  11.293
  459   2HD   LYS  62          HD1       LYS  62   5.218  -4.742  11.608
  460   1HE   LYS  62          HE2       LYS  62   3.185  -5.548  13.708
  461   2HE   LYS  62          HE1       LYS  62   4.743  -6.344  13.477
  462   1HZ   LYS  62          HZ1       LYS  62   5.496  -4.818  14.898
  463   2HZ   LYS  62          HZ2       LYS  62   4.136  -3.817  14.713
  464   3HZ   LYS  62          HZ3       LYS  62   5.414  -3.733  13.598
  465    H    THR  63           HN       THR  63   1.393  -2.816   7.968
  466    HA   THR  63           HA       THR  63   3.115  -1.577   6.081
  467    HB   THR  63           HB       THR  63   0.202  -2.348   5.775
  468    HG1  THR  63           HG1      THR  63   2.426  -3.777   6.127
  469   1HG2  THR  63          HG21      THR  63   2.374  -1.686   3.784
  470   2HG2  THR  63          HG22      THR  63   0.774  -0.958   3.928
  471   3HG2  THR  63          HG23      THR  63   0.940  -2.614   3.345
  472    H    GLN  64           HN       GLN  64   0.100  -0.444   7.578
  473    HA   GLN  64           HA       GLN  64  -0.210   1.911   6.014
  474   1HB   GLN  64          HB2       GLN  64  -0.976   1.302   8.880
  475   2HB   GLN  64          HB1       GLN  64  -1.452   2.781   8.044
  476   1HG   GLN  64          HG2       GLN  64  -2.600   1.471   6.319
  477   2HG   GLN  64          HG1       GLN  64  -2.080  -0.029   7.087
  478   1HE2  GLN  64          HE21      GLN  64  -4.890   0.858   6.711
  479   2HE2  GLN  64          HE22      GLN  64  -5.559   0.986   8.264
  480    H    ARG  65           HN       ARG  65   1.639   1.342   9.013
  481    HA   ARG  65           HA       ARG  65   2.487   4.041   9.405
  482   1HB   ARG  65          HB2       ARG  65   2.806   2.258  11.098
  483   2HB   ARG  65          HB1       ARG  65   3.981   1.477  10.042
  484   1HG   ARG  65          HG2       ARG  65   5.425   3.479  10.149
  485   2HG   ARG  65          HG1       ARG  65   4.250   4.270  11.193
  486   1HD   ARG  65          HD2       ARG  65   5.557   1.635  11.861
  487   2HD   ARG  65          HD1       ARG  65   6.212   3.177  12.389
  488    HE   ARG  65           HE       ARG  65   4.011   1.698  13.561
  489   1HH1  ARG  65          HH21      ARG  65   4.975   4.919  12.766
  490   2HH1  ARG  65          HH22      ARG  65   3.873   5.650  13.884
  491   1HH2  ARG  65          HH11      ARG  65   2.591   2.635  15.009
  492   2HH2  ARG  65          HH12      ARG  65   2.521   4.360  15.147
  493    H    MET  66           HN       MET  66   4.109   1.336   7.699
  494    HA   MET  66           HA       MET  66   6.358   2.841   6.825
  495   1HB   MET  66          HB2       MET  66   4.988   0.421   5.623
  496   2HB   MET  66          HB1       MET  66   6.512   1.074   5.019
  497   1HG   MET  66          HG2       MET  66   7.439   0.841   7.367
  498   2HG   MET  66          HG1       MET  66   5.967  -0.032   7.790
  499   1HE   MET  66          HE1       MET  66   5.196  -2.095   6.983
  500   2HE   MET  66          HE2       MET  66   6.027  -3.271   5.968
  501   3HE   MET  66          HE3       MET  66   5.283  -1.855   5.232
  502    H    LEU  67           HN       LEU  67   3.151   2.361   5.337
  503    HA   LEU  67           HA       LEU  67   3.745   3.736   2.889
  504   1HB   LEU  67          HB2       LEU  67   1.145   3.365   4.394
  505   2HB   LEU  67          HB1       LEU  67   1.239   4.113   2.806
  506    HG   LEU  67           HG       LEU  67   2.296   1.334   3.409
  507   1HD1  LEU  67          HD11      LEU  67   0.210   0.616   2.138
  508   2HD1  LEU  67          HD12      LEU  67  -0.384   2.261   2.362
  509   3HD1  LEU  67          HD13      LEU  67  -0.070   1.239   3.764
  510   1HD2  LEU  67          HD21      LEU  67   3.334   2.040   1.421
  511   2HD2  LEU  67          HD22      LEU  67   1.941   2.996   0.914
  512   3HD2  LEU  67          HD23      LEU  67   1.891   1.239   0.813
  513    H    SER  68           HN       SER  68   2.577   4.845   6.044
  514    HA   SER  68           HA       SER  68   2.075   7.556   5.335
  515   1HB   SER  68          HB2       SER  68   3.053   6.395   7.964
  516   2HB   SER  68          HB1       SER  68   2.473   8.045   7.757
  517    HG   SER  68           HG       SER  68   0.986   6.135   8.397
  518    H    GLY  69           HN       GLY  69   5.049   5.888   6.323
  519   1HA   GLY  69          HA2       GLY  69   6.769   8.073   6.644
  520   2HA   GLY  69          HA1       GLY  69   7.290   6.531   5.961
  521    H    PHE  70           HN       PHE  70   5.458   6.737   3.648
  522    HA   PHE  70           HA       PHE  70   7.122   8.572   2.005
  523   1HB   PHE  70          HB2       PHE  70   5.035   6.482   1.307
  524   2HB   PHE  70          HB1       PHE  70   5.807   7.516   0.106
  525    HD1  PHE  70           HD1      PHE  70   8.166   7.281  -0.438
  526    HD2  PHE  70           HD2      PHE  70   6.309   4.744   2.485
  527    HE1  PHE  70           HE1      PHE  70  10.115   5.758  -0.525
  528    HE2  PHE  70           HE2      PHE  70   8.261   3.218   2.396
  529    HZ   PHE  70           HZ       PHE  70  10.163   3.725   0.893
  530    H    CYS  71           HN       CYS  71   4.219   8.579   3.689
  531    HA   CYS  71           HA       CYS  71   3.220  10.959   2.165
  532   1HB   CYS  71          HB2       CYS  71   1.729   8.553   3.206
  533   2HB   CYS  71          HB1       CYS  71   0.909  10.092   2.966
  534    HA   PRO  72           HA       PRO  72   4.262  11.853   6.668
  535   1HB   PRO  72          HB2       PRO  72   4.501  14.589   5.541
  536   2HB   PRO  72          HB1       PRO  72   5.648  13.676   6.531
  537   1HG   PRO  72          HG2       PRO  72   5.991  14.142   3.842
  538   2HG   PRO  72          HG1       PRO  72   6.698  12.766   4.699
  539   1HD   PRO  72          HD2       PRO  72   4.458  12.798   2.757
  540   2HD   PRO  72          HD1       PRO  72   5.493  11.437   3.255
  541    H    HIS  73           HN       HIS  73   1.654  12.567   4.659
  542    HA   HIS  73           HA       HIS  73   0.349  14.372   6.649
  543   1HB   HIS  73          HB2       HIS  73  -1.279  14.841   4.963
  544   2HB   HIS  73          HB1       HIS  73   0.281  14.851   4.145
  545    HD1  HIS  73           HD1      HIS  73  -2.980  13.108   4.228
  546    HD2  HIS  73           HD2      HIS  73   0.789  12.453   2.574
  547    HE1  HIS  73           HE1      HIS  73  -3.267  11.290   2.489
  548    H    LYS  74           HN       LYS  74  -0.825  13.419   8.213
  549    HA   LYS  74           HA       LYS  74  -1.538  10.603   8.089
  550   1HB   LYS  74          HB2       LYS  74  -2.180  12.818  10.049
  551   2HB   LYS  74          HB1       LYS  74  -2.709  11.150  10.276
  552   1HG   LYS  74          HG2       LYS  74  -0.356  10.394  10.181
  553   2HG   LYS  74          HG1       LYS  74   0.171  12.063   9.961
  554   1HD   LYS  74          HD2       LYS  74  -0.819  12.657  12.146
  555   2HD   LYS  74          HD1       LYS  74  -1.329  10.982  12.365
  556   1HE   LYS  74          HE2       LYS  74   1.033  10.249  12.230
  557   2HE   LYS  74          HE1       LYS  74   1.536  11.929  12.052
  558   1HZ   LYS  74          HZ1       LYS  74   1.085  10.538  14.405
  559   2HZ   LYS  74          HZ2       LYS  74  -0.172  11.674  14.280
  560   3HZ   LYS  74          HZ3       LYS  74   1.449  12.186  14.233
  561    H    VAL  75           HN       VAL  75  -3.532   9.704   7.632
  562    HA   VAL  75           HA       VAL  75  -5.688  11.579   6.701
  563    HB   VAL  75           HB       VAL  75  -5.174   8.700   5.895
  564   1HG1  VAL  75          HG11      VAL  75  -6.872   9.213   4.150
  565   2HG1  VAL  75          HG12      VAL  75  -7.133  10.788   4.895
  566   3HG1  VAL  75          HG13      VAL  75  -7.542   9.317   5.776
  567   1HG2  VAL  75          HG21      VAL  75  -3.447  10.224   5.031
  568   2HG2  VAL  75          HG22      VAL  75  -4.695  11.311   4.421
  569   3HG2  VAL  75          HG23      VAL  75  -4.508   9.700   3.724
  570    H    SER  76           HN       SER  76  -7.576  11.523   7.801
  571    HA   SER  76           HA       SER  76  -7.909   9.468   9.924
  572   1HB   SER  76          HB2       SER  76  -9.741  10.953  10.710
  573   2HB   SER  76          HB1       SER  76  -8.204  11.803  10.591
  574    HG   SER  76           HG       SER  76 -10.511  11.999   9.025
  575    H    ALA  77           HN       ALA  77 -10.086   8.469  10.159
  576    HA   ALA  77           HA       ALA  77 -10.944   7.195   7.770
  577   1HB   ALA  77          HB1       ALA  77 -12.807   6.332   9.101
  578   2HB   ALA  77          HB2       ALA  77 -12.513   7.554  10.339
  579   3HB   ALA  77          HB3       ALA  77 -11.321   6.287  10.051
  580    H    GLY  78           HN       GLY  78 -11.454  10.377   8.649
  581   1HA   GLY  78          HA2       GLY  78 -14.081  10.542   7.205
  582   2HA   GLY  78          HA1       GLY  78 -13.453  11.767   8.303
  583    H    GLN  79           HN       GLN  79 -10.717  11.492   7.079
  584    HA   GLN  79           HA       GLN  79 -11.191  13.392   4.860
  585   1HB   GLN  79          HB2       GLN  79  -8.677  12.471   6.281
  586   2HB   GLN  79          HB1       GLN  79  -8.686  13.632   4.953
  587   1HG   GLN  79          HG2       GLN  79 -10.174  15.109   6.246
  588   2HG   GLN  79          HG1       GLN  79 -10.170  13.952   7.577
  589   1HE2  GLN  79          HE21      GLN  79  -9.124  16.732   7.661
  590   2HE2  GLN  79          HE22      GLN  79  -7.474  16.605   8.041
  591    H    PHE  80           HN       PHE  80 -11.296  12.673   2.803
  592    HA   PHE  80           HA       PHE  80  -9.602  10.340   1.978
  593   1HB   PHE  80          HB2       PHE  80 -12.466  10.906   1.146
  594   2HB   PHE  80          HB1       PHE  80 -11.439   9.648   0.454
  595    HD1  PHE  80           HD1      PHE  80 -13.589  10.571   3.219
  596    HD2  PHE  80           HD2      PHE  80 -10.537   7.826   1.956
  597    HE1  PHE  80           HE1      PHE  80 -14.200   9.040   5.072
  598    HE2  PHE  80           HE2      PHE  80 -11.147   6.293   3.806
  599    HZ   PHE  80           HZ       PHE  80 -12.980   6.900   5.366
  600    H    SER  81           HN       SER  81  -8.656  10.586  -0.076
  601    HA   SER  81           HA       SER  81  -9.134  13.226  -1.438
  602   1HB   SER  81          HB2       SER  81  -6.538  11.718  -1.049
  603   2HB   SER  81          HB1       SER  81  -6.723  13.144  -2.066
  604    HG   SER  81           HG       SER  81  -7.791  13.503   0.405
  605    H    SER  82           HN       SER  82  -8.476   9.772  -1.847
  606    HA   SER  82           HA       SER  82  -8.696  10.116  -4.816
  607   1HB   SER  82          HB2       SER  82  -6.635   9.033  -3.872
  608   2HB   SER  82          HB1       SER  82  -7.656   7.717  -3.297
  609    HG   SER  82           HG       SER  82  -8.236   8.260  -5.850
  610    H    LEU  83           HN       LEU  83 -10.738   9.262  -2.315
  611    HA   LEU  83           HA       LEU  83 -11.984   6.986  -3.743
  612   1HB   LEU  83          HB2       LEU  83 -12.914   8.480  -1.272
  613   2HB   LEU  83          HB1       LEU  83 -13.612   6.991  -1.897
  614    HG   LEU  83           HG       LEU  83 -10.823   7.367  -0.769
  615   1HD1  LEU  83          HD11      LEU  83 -12.852   7.120   0.764
  616   2HD1  LEU  83          HD12      LEU  83 -11.562   5.939   0.994
  617   3HD1  LEU  83          HD13      LEU  83 -13.024   5.491   0.115
  618   1HD2  LEU  83          HD21      LEU  83 -12.053   5.111  -2.351
  619   2HD2  LEU  83          HD22      LEU  83 -10.840   4.759  -1.118
  620   3HD2  LEU  83          HD23      LEU  83 -10.436   5.804  -2.478
  621    H    HIS  84           HN       HIS  84 -11.923  10.001  -4.679
  622    HA   HIS  84           HA       HIS  84 -14.751  10.705  -4.750
  623   1HB   HIS  84          HB2       HIS  84 -12.686  11.797  -6.664
  624   2HB   HIS  84          HB1       HIS  84 -14.098  12.604  -5.977
  625    HD1  HIS  84           HD1      HIS  84 -13.347  11.429  -3.020
  626    HD2  HIS  84           HD2      HIS  84 -10.959  13.776  -5.501
  627    HE1  HIS  84           HE1      HIS  84 -11.657  12.562  -1.524
  628    H    VAL  85           HN       VAL  85 -12.628   8.769  -6.699
  629    HA   VAL  85           HA       VAL  85 -14.275   8.848  -9.099
  630    HB   VAL  85           HB       VAL  85 -12.249   6.732  -8.332
  631   1HG1  VAL  85          HG11      VAL  85 -13.698   6.371 -10.343
  632   2HG1  VAL  85          HG12      VAL  85 -11.984   6.506 -10.737
  633   3HG1  VAL  85          HG13      VAL  85 -13.065   7.872 -11.020
  634   1HG2  VAL  85          HG21      VAL  85 -11.827   9.483  -9.543
  635   2HG2  VAL  85          HG22      VAL  85 -10.600   8.215  -9.513
  636   3HG2  VAL  85          HG23      VAL  85 -11.197   8.900  -8.002
  637    H    ARG  86           HN       ARG  86 -15.819   7.295  -9.751
  638    HA   ARG  86           HA       ARG  86 -16.964   5.675  -7.551
  639   1HB   ARG  86          HB2       ARG  86 -17.904   6.234 -10.381
  640   2HB   ARG  86          HB1       ARG  86 -18.782   5.229  -9.227
  641   1HG   ARG  86          HG2       ARG  86 -18.912   7.131  -7.667
  642   2HG   ARG  86          HG1       ARG  86 -18.046   8.141  -8.822
  643   1HD   ARG  86          HD2       ARG  86 -19.882   7.582 -10.495
  644   2HD   ARG  86          HD1       ARG  86 -20.796   6.898  -9.155
  645    HE   ARG  86           HE       ARG  86 -20.561   9.682  -9.832
  646   1HH1  ARG  86          HH21      ARG  86 -20.524   7.578  -7.097
  647   2HH1  ARG  86          HH22      ARG  86 -20.766   8.857  -5.957
  648   1HH2  ARG  86          HH11      ARG  86 -20.885  11.344  -8.362
  649   2HH2  ARG  86          HH12      ARG  86 -20.977  10.982  -6.671
  650    H    ASP  87           HN       ASP  87 -14.624   4.554  -8.017
  651    HA   ASP  87           HA       ASP  87 -14.779   2.512 -10.132
  652   1HB   ASP  87          HB2       ASP  87 -12.759   3.088  -7.948
  653   2HB   ASP  87          HB1       ASP  87 -12.602   1.750  -9.087
  654    H    THR  88           HN       THR  88 -14.429   0.159  -9.448
  655    HA   THR  88           HA       THR  88 -16.341  -0.464  -7.267
  656    HB   THR  88           HB       THR  88 -16.195  -2.786  -8.158
  657    HG1  THR  88           HG1      THR  88 -14.995  -2.378 -10.439
  658   1HG2  THR  88          HG21      THR  88 -17.083  -2.206 -10.489
  659   2HG2  THR  88          HG22      THR  88 -16.748  -0.524 -10.080
  660   3HG2  THR  88          HG23      THR  88 -17.908  -1.449  -9.128
  661    H    LYS  89           HN       LYS  89 -15.743  -2.138  -5.672
  662    HA   LYS  89           HA       LYS  89 -13.020  -1.684  -4.663
  663   1HB   LYS  89          HB2       LYS  89 -15.262  -3.409  -3.572
  664   2HB   LYS  89          HB1       LYS  89 -13.772  -3.006  -2.727
  665   1HG   LYS  89          HG2       LYS  89 -14.364  -0.616  -2.802
  666   2HG   LYS  89          HG1       LYS  89 -15.861  -1.015  -3.650
  667   1HD   LYS  89          HD2       LYS  89 -16.582  -2.398  -1.734
  668   2HD   LYS  89          HD1       LYS  89 -15.089  -1.998  -0.883
  669   1HE   LYS  89          HE2       LYS  89 -16.942  -0.568  -0.124
  670   2HE   LYS  89          HE1       LYS  89 -15.702   0.387  -0.933
  671   1HZ   LYS  89          HZ1       LYS  89 -17.072   0.898  -2.607
  672   2HZ   LYS  89          HZ2       LYS  89 -18.314   0.457  -1.536
  673   3HZ   LYS  89          HZ3       LYS  89 -17.743  -0.658  -2.683
  674    H    ILE  90           HN       ILE  90 -11.595  -3.462  -4.076
  675    HA   ILE  90           HA       ILE  90 -12.001  -5.986  -5.638
  676    HB   ILE  90           HB       ILE  90  -9.534  -5.916  -6.130
  677   1HG1  ILE  90          HG12      ILE  90  -9.820  -3.037  -5.215
  678   2HG1  ILE  90          HG11      ILE  90  -8.982  -4.295  -4.310
  679   1HG2  ILE  90          HG21      ILE  90  -9.753  -4.239  -7.949
  680   2HG2  ILE  90          HG22      ILE  90 -11.223  -3.630  -7.189
  681   3HG2  ILE  90          HG23      ILE  90 -11.176  -5.272  -7.831
  682   1HD1  ILE  90          HD11      ILE  90  -7.390  -2.954  -5.621
  683   2HD1  ILE  90          HD12      ILE  90  -8.266  -3.354  -7.099
  684   3HD1  ILE  90          HD13      ILE  90  -7.429  -4.620  -6.198
  685    H    GLU  91           HN       GLU  91 -10.679  -7.799  -4.753
  686    HA   GLU  91           HA       GLU  91 -10.834  -7.909  -1.882
  687   1HB   GLU  91          HB2       GLU  91  -9.484  -9.721  -3.904
  688   2HB   GLU  91          HB1       GLU  91  -9.563 -10.082  -2.178
  689   1HG   GLU  91          HG2       GLU  91 -12.025  -9.977  -2.261
  690   2HG   GLU  91          HG1       GLU  91 -11.948  -9.608  -3.983
  691    H    VAL  92           HN       VAL  92  -9.132  -7.919  -0.326
  692    HA   VAL  92           HA       VAL  92  -7.054  -6.045  -0.736
  693    HB   VAL  92           HB       VAL  92  -7.294  -8.276   1.296
  694   1HG1  VAL  92          HG11      VAL  92  -5.596  -6.869   2.572
  695   2HG1  VAL  92          HG12      VAL  92  -5.283  -6.023   1.058
  696   3HG1  VAL  92          HG13      VAL  92  -4.954  -7.749   1.187
  697   1HG2  VAL  92          HG21      VAL  92  -7.845  -5.293   1.357
  698   2HG2  VAL  92          HG22      VAL  92  -7.825  -6.316   2.793
  699   3HG2  VAL  92          HG23      VAL  92  -9.020  -6.595   1.530
  700    H    ALA  93           HN       ALA  93  -6.996  -9.595  -1.012
  701    HA   ALA  93           HA       ALA  93  -4.230  -9.988  -1.334
  702   1HB   ALA  93          HB1       ALA  93  -5.778 -11.867  -1.225
  703   2HB   ALA  93          HB2       ALA  93  -4.854 -11.967  -2.724
  704   3HB   ALA  93          HB3       ALA  93  -6.519 -11.384  -2.751
  705    H    GLN  94           HN       GLN  94  -6.624  -8.945  -3.759
  706    HA   GLN  94           HA       GLN  94  -4.667  -8.902  -5.914
  707   1HB   GLN  94          HB2       GLN  94  -7.430  -7.677  -5.633
  708   2HB   GLN  94          HB1       GLN  94  -6.464  -7.585  -7.107
  709   1HG   GLN  94          HG2       GLN  94  -6.367 -10.037  -7.213
  710   2HG   GLN  94          HG1       GLN  94  -7.324 -10.147  -5.734
  711   1HE2  GLN  94          HE21      GLN  94  -8.149 -11.189  -8.361
  712   2HE2  GLN  94          HE22      GLN  94  -9.554 -10.346  -8.802
  713    H    PHE  95           HN       PHE  95  -6.043  -6.533  -3.681
  714    HA   PHE  95           HA       PHE  95  -4.908  -4.185  -4.802
  715   1HB   PHE  95          HB2       PHE  95  -6.612  -4.122  -3.046
  716   2HB   PHE  95          HB1       PHE  95  -5.490  -4.875  -1.917
  717    HD1  PHE  95           HD1      PHE  95  -6.315  -1.795  -3.747
  718    HD2  PHE  95           HD2      PHE  95  -3.615  -3.654  -0.974
  719    HE1  PHE  95           HE1      PHE  95  -5.410   0.430  -3.131
  720    HE2  PHE  95           HE2      PHE  95  -2.711  -1.431  -0.357
  721    HZ   PHE  95           HZ       PHE  95  -3.611   0.612  -1.437
  722    H    VAL  96           HN       VAL  96  -3.617  -6.322  -2.223
  723    HA   VAL  96           HA       VAL  96  -1.195  -4.879  -1.838
  724    HB   VAL  96           HB       VAL  96  -1.733  -7.849  -1.518
  725   1HG1  VAL  96          HG11      VAL  96   0.615  -7.681  -1.543
  726   2HG1  VAL  96          HG12      VAL  96   0.232  -7.531   0.172
  727   3HG1  VAL  96          HG13      VAL  96   0.607  -6.093  -0.774
  728   1HG2  VAL  96          HG21      VAL  96  -3.195  -6.567  -0.092
  729   2HG2  VAL  96          HG22      VAL  96  -1.884  -5.482   0.371
  730   3HG2  VAL  96          HG23      VAL  96  -1.878  -7.158   0.922
  731    H    LYS  97           HN       LYS  97  -1.829  -7.735  -3.915
  732    HA   LYS  97           HA       LYS  97   0.812  -7.849  -4.988
  733   1HB   LYS  97          HB2       LYS  97  -1.839  -8.839  -6.052
  734   2HB   LYS  97          HB1       LYS  97  -0.297  -9.177  -6.841
  735   1HG   LYS  97          HG2       LYS  97   0.546 -10.211  -4.764
  736   2HG   LYS  97          HG1       LYS  97  -0.995  -9.879  -3.974
  737   1HD   LYS  97          HD2       LYS  97  -2.166 -11.314  -5.566
  738   2HD   LYS  97          HD1       LYS  97  -0.669 -11.588  -6.456
  739   1HE   LYS  97          HE2       LYS  97  -0.847 -12.253  -3.519
  740   2HE   LYS  97          HE1       LYS  97  -1.418 -13.391  -4.739
  741   1HZ   LYS  97          HZ1       LYS  97   1.101 -13.282  -3.908
  742   2HZ   LYS  97          HZ2       LYS  97   1.189 -12.212  -5.225
  743   3HZ   LYS  97          HZ3       LYS  97   0.655 -13.808  -5.458
  744    H    ASP  98           HN       ASP  98  -2.084  -6.103  -6.180
  745    HA   ASP  98           HA       ASP  98  -0.952  -5.280  -8.666
  746   1HB   ASP  98          HB2       ASP  98  -2.954  -3.902  -6.852
  747   2HB   ASP  98          HB1       ASP  98  -2.540  -3.320  -8.466
  748    H    LEU  99           HN       LEU  99  -0.886  -3.800  -5.459
  749    HA   LEU  99           HA       LEU  99   0.616  -1.482  -6.165
  750   1HB   LEU  99          HB2       LEU  99  -0.626  -1.707  -4.046
  751   2HB   LEU  99          HB1       LEU  99   0.471  -2.984  -3.531
  752    HG   LEU  99           HG       LEU  99   2.356  -1.395  -3.598
  753   1HD1  LEU  99          HD11      LEU  99   1.862   0.223  -5.222
  754   2HD1  LEU  99          HD12      LEU  99   1.561   1.116  -3.734
  755   3HD1  LEU  99          HD13      LEU  99   0.208   0.443  -4.646
  756   1HD2  LEU  99          HD21      LEU  99   0.043  -0.222  -2.033
  757   2HD2  LEU  99          HD22      LEU  99   1.755  -0.169  -1.614
  758   3HD2  LEU  99          HD23      LEU  99   0.881  -1.699  -1.555
  759    H    LEU 100           HN       LEU 100   1.577  -4.768  -5.266
  760    HA   LEU 100           HA       LEU 100   4.335  -4.342  -4.836
  761   1HB   LEU 100          HB2       LEU 100   3.243  -6.466  -4.325
  762   2HB   LEU 100          HB1       LEU 100   2.947  -6.751  -6.037
  763    HG   LEU 100           HG       LEU 100   5.371  -6.846  -6.464
  764   1HD1  LEU 100          HD11      LEU 100   5.493  -6.094  -3.545
  765   2HD1  LEU 100          HD12      LEU 100   6.389  -5.414  -4.903
  766   3HD1  LEU 100          HD13      LEU 100   6.810  -7.006  -4.283
  767   1HD2  LEU 100          HD21      LEU 100   5.842  -8.925  -5.190
  768   2HD2  LEU 100          HD22      LEU 100   4.205  -8.919  -5.849
  769   3HD2  LEU 100          HD23      LEU 100   4.468  -8.575  -4.139
  770    H    LEU 101           HN       LEU 101   2.648  -4.954  -7.957
  771    HA   LEU 101           HA       LEU 101   5.043  -5.107  -9.509
  772   1HB   LEU 101          HB2       LEU 101   2.297  -4.075 -10.282
  773   2HB   LEU 101          HB1       LEU 101   3.606  -4.292 -11.430
  774    HG   LEU 101           HG       LEU 101   2.193  -6.226 -11.571
  775   1HD1  LEU 101          HD11      LEU 101   4.399  -7.307  -9.845
  776   2HD1  LEU 101          HD12      LEU 101   4.801  -6.496 -11.362
  777   3HD1  LEU 101          HD13      LEU 101   3.761  -7.919 -11.369
  778   1HD2  LEU 101          HD21      LEU 101   1.441  -7.507  -9.733
  779   2HD2  LEU 101          HD22      LEU 101   1.240  -5.834  -9.226
  780   3HD2  LEU 101          HD23      LEU 101   2.607  -6.777  -8.633
  781    H    HIS 102           HN       HIS 102   3.034  -2.273  -8.704
  782    HA   HIS 102           HA       HIS 102   4.697  -0.419 -10.129
  783   1HB   HIS 102          HB2       HIS 102   2.642  -0.098  -7.943
  784   2HB   HIS 102          HB1       HIS 102   3.539   1.286  -8.570
  785    HD1  HIS 102           HD1      HIS 102   3.071   2.025 -10.998
  786    HD2  HIS 102           HD2      HIS 102   0.799  -1.251  -9.794
  787    HE1  HIS 102           HE1      HIS 102   1.290   1.708 -12.766
  788    H    LEU 103           HN       LEU 103   4.745  -1.465  -6.708
  789    HA   LEU 103           HA       LEU 103   6.580   0.472  -5.788
  790   1HB   LEU 103          HB2       LEU 103   6.208  -2.419  -4.984
  791   2HB   LEU 103          HB1       LEU 103   7.268  -1.311  -4.116
  792    HG   LEU 103           HG       LEU 103   4.331  -0.753  -4.628
  793   1HD1  LEU 103          HD11      LEU 103   5.720  -2.129  -2.326
  794   2HD1  LEU 103          HD12      LEU 103   4.299  -2.658  -3.225
  795   3HD1  LEU 103          HD13      LEU 103   4.177  -1.304  -2.104
  796   1HD2  LEU 103          HD21      LEU 103   4.868   0.736  -2.495
  797   2HD2  LEU 103          HD22      LEU 103   5.279   1.319  -4.102
  798   3HD2  LEU 103          HD23      LEU 103   6.527   0.611  -3.078
  799    H    LYS 104           HN       LYS 104   7.404  -2.814  -7.042
  800    HA   LYS 104           HA       LYS 104  10.224  -2.180  -7.030
  801   1HB   LYS 104          HB2       LYS 104  10.508  -4.240  -8.363
  802   2HB   LYS 104          HB1       LYS 104   9.478  -4.507  -6.960
  803   1HG   LYS 104          HG2       LYS 104   7.475  -4.293  -8.373
  804   2HG   LYS 104          HG1       LYS 104   8.496  -4.018  -9.788
  805   1HD   LYS 104          HD2       LYS 104   9.542  -6.233  -9.467
  806   2HD   LYS 104          HD1       LYS 104   8.528  -6.510  -8.052
  807   1HE   LYS 104          HE2       LYS 104   6.605  -6.800  -9.324
  808   2HE   LYS 104          HE1       LYS 104   7.209  -5.826 -10.667
  809   1HZ   LYS 104          HZ1       LYS 104   7.372  -8.613 -10.287
  810   2HZ   LYS 104          HZ2       LYS 104   8.944  -7.971 -10.357
  811   3HZ   LYS 104          HZ3       LYS 104   7.852  -7.695 -11.629
  812    H    LYS 105           HN       LYS 105   7.671  -1.469  -9.266
  813    HA   LYS 105           HA       LYS 105   9.240  -1.271 -11.649
  814   1HB   LYS 105          HB2       LYS 105   6.726  -1.257 -11.547
  815   2HB   LYS 105          HB1       LYS 105   6.818   0.404 -10.958
  816   1HG   LYS 105          HG2       LYS 105   8.044   1.063 -12.994
  817   2HG   LYS 105          HG1       LYS 105   7.952  -0.596 -13.588
  818   1HD   LYS 105          HD2       LYS 105   5.460  -0.447 -13.492
  819   2HD   LYS 105          HD1       LYS 105   5.612   1.248 -13.027
  820   1HE   LYS 105          HE2       LYS 105   6.776   0.077 -15.567
  821   2HE   LYS 105          HE1       LYS 105   5.232   0.924 -15.486
  822   1HZ   LYS 105          HZ1       LYS 105   7.936   1.970 -15.300
  823   2HZ   LYS 105          HZ2       LYS 105   6.795   2.669 -14.253
  824   3HZ   LYS 105          HZ3       LYS 105   6.535   2.687 -15.933
  825    H    LEU 106           HN       LEU 106   8.341   1.263  -9.275
  826    HA   LEU 106           HA       LEU 106   9.732   3.385 -10.578
  827   1HB   LEU 106          HB2       LEU 106   8.912   2.903  -7.713
  828   2HB   LEU 106          HB1       LEU 106   9.862   4.319  -8.137
  829    HG   LEU 106           HG       LEU 106   7.288   4.577  -8.075
  830   1HD1  LEU 106          HD11      LEU 106   8.958   6.172  -9.159
  831   2HD1  LEU 106          HD12      LEU 106   7.319   6.226  -9.799
  832   3HD1  LEU 106          HD13      LEU 106   8.581   5.383 -10.691
  833   1HD2  LEU 106          HD21      LEU 106   6.021   3.844  -9.953
  834   2HD2  LEU 106          HD22      LEU 106   6.943   2.441  -9.432
  835   3HD2  LEU 106          HD23      LEU 106   7.461   3.360 -10.841
  836    H    PHE 107           HN       PHE 107  10.910   0.732  -8.630
  837    HA   PHE 107           HA       PHE 107  13.370   1.866  -7.778
  838   1HB   PHE 107          HB2       PHE 107  12.574  -0.325  -6.965
  839   2HB   PHE 107          HB1       PHE 107  12.833  -1.011  -8.571
  840    HD1  PHE 107           HD1      PHE 107  14.560   0.698  -5.747
  841    HD2  PHE 107           HD2      PHE 107  14.994  -1.736  -9.262
  842    HE1  PHE 107           HE1      PHE 107  16.950   0.348  -5.209
  843    HE2  PHE 107           HE2      PHE 107  17.390  -2.086  -8.722
  844    HZ   PHE 107           HZ       PHE 107  18.367  -1.044  -6.695
  845    H    ARG 108           HN       ARG 108  12.537   0.260 -10.856
  846    HA   ARG 108           HA       ARG 108  15.197   0.264 -11.904
  847   1HB   ARG 108          HB2       ARG 108  12.511   0.381 -13.319
  848   2HB   ARG 108          HB1       ARG 108  14.048   0.220 -14.168
  849   1HG   ARG 108          HG2       ARG 108  14.437  -1.814 -12.557
  850   2HG   ARG 108          HG1       ARG 108  12.694  -1.741 -12.324
  851   1HD   ARG 108          HD2       ARG 108  14.224  -2.257 -14.864
  852   2HD   ARG 108          HD1       ARG 108  12.996  -3.270 -14.117
  853    HE   ARG 108           HE       ARG 108  12.565  -1.189 -16.054
  854   1HH1  ARG 108          HH21      ARG 108  11.269  -2.369 -13.080
  855   2HH1  ARG 108          HH22      ARG 108   9.736  -1.603 -13.309
  856   1HH2  ARG 108          HH11      ARG 108  10.576  -0.212 -16.363
  857   2HH2  ARG 108          HH12      ARG 108   9.341  -0.386 -15.161
  858    H    GLU 109           HN       GLU 109  12.823   2.789 -11.538
  859    HA   GLU 109           HA       GLU 109  14.234   4.596 -13.395
  860   1HB   GLU 109          HB2       GLU 109  11.839   4.956 -11.573
  861   2HB   GLU 109          HB1       GLU 109  12.486   6.234 -12.604
  862   1HG   GLU 109          HG2       GLU 109  12.147   4.814 -14.588
  863   2HG   GLU 109          HG1       GLU 109  11.499   3.533 -13.566
  864    H    GLY 110           HN       GLY 110  14.447   3.730 -10.079
  865   1HA   GLY 110          HA2       GLY 110  15.808   4.586  -8.368
  866   2HA   GLY 110          HA1       GLY 110  16.643   5.506  -9.620
  867    H    ARG 111           HN       ARG 111  13.489   6.331  -9.991
  868    HA   ARG 111           HA       ARG 111  13.883   8.840  -8.443
  869   1HB   ARG 111          HB2       ARG 111  11.858   8.023 -10.552
  870   2HB   ARG 111          HB1       ARG 111  11.811   9.568  -9.700
  871   1HG   ARG 111          HG2       ARG 111  14.085  10.087 -10.515
  872   2HG   ARG 111          HG1       ARG 111  14.123   8.548 -11.375
  873   1HD   ARG 111          HD2       ARG 111  13.481  10.256 -12.962
  874   2HD   ARG 111          HD1       ARG 111  12.055   9.279 -12.617
  875    HE   ARG 111           HE       ARG 111  11.944  11.365 -10.774
  876   1HH1  ARG 111          HH21      ARG 111  12.136  10.978 -14.191
  877   2HH1  ARG 111          HH22      ARG 111  11.325  12.468 -14.539
  878   1HH2  ARG 111          HH11      ARG 111  10.891  13.314 -11.202
  879   2HH2  ARG 111          HH12      ARG 111  10.619  13.794 -12.844
  880    H    PHE 112           HN       PHE 112  13.377   8.325  -6.336
  881    HA   PHE 112           HA       PHE 112  10.895   6.825  -5.736
  882   1HB   PHE 112          HB2       PHE 112  12.955   8.004  -3.846
  883   2HB   PHE 112          HB1       PHE 112  11.741   6.775  -3.470
  884    HD1  PHE 112           HD1      PHE 112  11.875   4.521  -4.501
  885    HD2  PHE 112           HD2      PHE 112  14.975   7.442  -5.034
  886    HE1  PHE 112           HE1      PHE 112  13.404   2.752  -5.326
  887    HE2  PHE 112           HE2      PHE 112  16.501   5.670  -5.863
  888    HZ   PHE 112           HZ       PHE 112  15.716   3.325  -6.004
  889    H    ASN 113           HN       ASN 113   9.070   7.796  -4.881
  890    HA   ASN 113           HA       ASN 113   7.572   9.559  -4.481
  891   1HB   ASN 113          HB2       ASN 113   8.963   9.504  -2.378
  892   2HB   ASN 113          HB1       ASN 113   9.964  10.778  -3.077
  893   1HD2  ASN 113          HD21      ASN 113   6.472  10.088  -2.458
  894   2HD2  ASN 113          HD22      ASN 113   6.076  11.690  -2.064
  Start of MODEL   24
    1   1H    MET   1           HT1      MET   1  21.259   5.412  13.877
    2   2H    MET   1           HT2      MET   1  20.935   4.496  12.482
    3   3H    MET   1           HT3      MET   1  21.207   3.719  13.968
    4    HA   MET   1           HA       MET   1  18.871   3.682  13.533
    5   1HB   MET   1          HB2       MET   1  19.694   5.742  15.605
    6   2HB   MET   1          HB1       MET   1  18.091   5.010  15.515
    7   1HG   MET   1          HG2       MET   1  19.091   2.771  15.795
    8   2HG   MET   1          HG1       MET   1  20.696   3.497  15.881
    9   1HE   MET   1          HE1       MET   1  17.282   4.997  17.734
   10   2HE   MET   1          HE2       MET   1  17.253   3.619  18.828
   11   3HE   MET   1          HE3       MET   1  17.234   3.351  17.088
   12    H    GLY   2           HN       GLY   2  20.415   6.150  12.080
   13   1HA   GLY   2          HA2       GLY   2  18.381   8.199  12.014
   14   2HA   GLY   2          HA1       GLY   2  19.734   8.064  10.892
   15    HA   PRO   3           HA       PRO   3  15.395   6.780   9.077
   16   1HB   PRO   3          HB2       PRO   3  16.050   8.819   7.059
   17   2HB   PRO   3          HB1       PRO   3  14.587   8.650   8.036
   18   1HG   PRO   3          HG2       PRO   3  16.673  10.566   8.387
   19   2HG   PRO   3          HG1       PRO   3  15.285  10.297   9.446
   20   1HD   PRO   3          HD2       PRO   3  18.053   9.710  10.012
   21   2HD   PRO   3          HD1       PRO   3  16.639   9.372  11.043
   22    H    VAL   4           HN       VAL   4  15.322   5.366   7.263
   23    HA   VAL   4           HA       VAL   4  17.914   4.495   6.262
   24    HB   VAL   4           HB       VAL   4  16.447   2.841   4.973
   25   1HG1  VAL   4          HG11      VAL   4  15.777   1.658   7.119
   26   2HG1  VAL   4          HG12      VAL   4  16.325   3.092   7.986
   27   3HG1  VAL   4          HG13      VAL   4  17.469   2.147   7.034
   28   1HG2  VAL   4          HG21      VAL   4  14.120   2.747   5.480
   29   2HG2  VAL   4          HG22      VAL   4  14.443   4.440   5.112
   30   3HG2  VAL   4          HG23      VAL   4  14.282   3.919   6.788
   31    HA   PRO   5           HA       PRO   5  18.009   6.959   2.519
   32   1HB   PRO   5          HB2       PRO   5  18.702   4.606   0.894
   33   2HB   PRO   5          HB1       PRO   5  19.694   6.012   1.289
   34   1HG   PRO   5          HG2       PRO   5  19.946   3.393   2.369
   35   2HG   PRO   5          HG1       PRO   5  20.816   4.842   2.882
   36   1HD   PRO   5          HD2       PRO   5  18.772   3.404   4.341
   37   2HD   PRO   5          HD1       PRO   5  19.643   4.877   4.839
   38    HA   PRO   6           HA       PRO   6  14.154   6.210   0.396
   39   1HB   PRO   6          HB2       PRO   6  14.857   6.861  -2.251
   40   2HB   PRO   6          HB1       PRO   6  14.358   8.006  -1.001
   41   1HG   PRO   6          HG2       PRO   6  17.057   7.498  -2.096
   42   2HG   PRO   6          HG1       PRO   6  16.438   8.927  -1.258
   43   1HD   PRO   6          HD2       PRO   6  18.172   6.989  -0.150
   44   2HD   PRO   6          HD1       PRO   6  17.248   8.204   0.767
   45    H    SER   7           HN       SER   7  16.755   5.115  -1.795
   46    HA   SER   7           HA       SER   7  15.249   3.059  -3.055
   47   1HB   SER   7          HB2       SER   7  17.420   2.206  -3.820
   48   2HB   SER   7          HB1       SER   7  17.374   3.962  -3.948
   49    HG   SER   7           HG       SER   7  19.288   2.952  -2.919
   50    H    THR   8           HN       THR   8  17.326   2.970  -0.166
   51    HA   THR   8           HA       THR   8  17.213   0.112   0.143
   52    HB   THR   8           HB       THR   8  17.627   2.263   2.239
   53    HG1  THR   8           HG1      THR   8  19.638   0.687   1.102
   54   1HG2  THR   8          HG21      THR   8  17.087   0.213   3.348
   55   2HG2  THR   8          HG22      THR   8  18.844   0.354   3.398
   56   3HG2  THR   8          HG23      THR   8  18.079  -0.727   2.233
   57    H    ALA   9           HN       ALA   9  15.195   2.744   1.421
   58    HA   ALA   9           HA       ALA   9  13.582   1.134   3.133
   59   1HB   ALA   9          HB1       ALA   9  12.050   2.980   3.154
   60   2HB   ALA   9          HB2       ALA   9  12.643   3.569   1.601
   61   3HB   ALA   9          HB3       ALA   9  13.665   3.676   3.033
   62    H    LEU  10           HN       LEU  10  13.176   2.052  -0.294
   63    HA   LEU  10           HA       LEU  10  10.665   0.751  -0.659
   64   1HB   LEU  10          HB2       LEU  10  11.617   2.361  -2.285
   65   2HB   LEU  10          HB1       LEU  10  12.885   1.201  -2.684
   66    HG   LEU  10           HG       LEU  10  11.091  -0.421  -3.391
   67   1HD1  LEU  10          HD11      LEU  10   8.857   0.821  -3.943
   68   2HD1  LEU  10          HD12      LEU  10   9.361   1.949  -2.685
   69   3HD1  LEU  10          HD13      LEU  10   9.116   0.246  -2.299
   70   1HD2  LEU  10          HD21      LEU  10  11.226   2.285  -4.741
   71   2HD2  LEU  10          HD22      LEU  10  10.539   0.843  -5.489
   72   3HD2  LEU  10          HD23      LEU  10  12.244   0.883  -5.054
   73    H    ARG  11           HN       ARG  11  14.008  -0.424  -1.122
   74    HA   ARG  11           HA       ARG  11  13.341  -3.028  -2.077
   75   1HB   ARG  11          HB2       ARG  11  15.684  -2.046  -0.419
   76   2HB   ARG  11          HB1       ARG  11  15.588  -3.671  -1.091
   77   1HG   ARG  11          HG2       ARG  11  15.445  -2.746  -3.362
   78   2HG   ARG  11          HG1       ARG  11  15.491  -1.108  -2.710
   79   1HD   ARG  11          HD2       ARG  11  17.704  -1.707  -1.626
   80   2HD   ARG  11          HD1       ARG  11  17.673  -3.199  -2.568
   81    HE   ARG  11           HE       ARG  11  17.339  -1.288  -4.501
   82   1HH1  ARG  11          HH21      ARG  11  19.506  -1.726  -1.854
   83   2HH1  ARG  11          HH22      ARG  11  20.840  -0.953  -2.642
   84   1HH2  ARG  11          HH11      ARG  11  19.075  -0.266  -5.545
   85   2HH2  ARG  11          HH12      ARG  11  20.596  -0.129  -4.729
   86    H    GLU  12           HN       GLU  12  13.819  -1.786   1.216
   87    HA   GLU  12           HA       GLU  12  13.383  -4.268   2.575
   88   1HB   GLU  12          HB2       GLU  12  13.053  -1.385   3.447
   89   2HB   GLU  12          HB1       GLU  12  12.866  -2.757   4.544
   90   1HG   GLU  12          HG2       GLU  12  15.155  -3.475   4.098
   91   2HG   GLU  12          HG1       GLU  12  15.352  -2.196   2.899
   92    H    LEU  13           HN       LEU  13  11.170  -1.662   1.596
   93    HA   LEU  13           HA       LEU  13   8.864  -2.798   2.902
   94   1HB   LEU  13          HB2       LEU  13   8.962  -0.426   2.301
   95   2HB   LEU  13          HB1       LEU  13   9.078  -0.839   0.594
   96    HG   LEU  13           HG       LEU  13   6.824  -1.919   0.741
   97   1HD1  LEU  13          HD11      LEU  13   5.486  -1.159   2.833
   98   2HD1  LEU  13          HD12      LEU  13   7.065  -0.953   3.590
   99   3HD1  LEU  13          HD13      LEU  13   6.566  -2.539   3.004
  100   1HD2  LEU  13          HD21      LEU  13   7.108   0.436   0.021
  101   2HD2  LEU  13          HD22      LEU  13   6.915   0.956   1.695
  102   3HD2  LEU  13          HD23      LEU  13   5.573   0.184   0.851
  103    H    ILE  14           HN       ILE  14  10.000  -2.901  -0.501
  104    HA   ILE  14           HA       ILE  14   7.797  -4.395  -1.492
  105    HB   ILE  14           HB       ILE  14  10.686  -4.304  -2.414
  106   1HG1  ILE  14          HG12      ILE  14   8.166  -3.106  -3.616
  107   2HG1  ILE  14          HG11      ILE  14   9.263  -2.217  -2.563
  108   1HG2  ILE  14          HG21      ILE  14   9.892  -6.372  -3.262
  109   2HG2  ILE  14          HG22      ILE  14   9.606  -5.239  -4.581
  110   3HG2  ILE  14          HG23      ILE  14   8.274  -5.733  -3.539
  111   1HD1  ILE  14          HD11      ILE  14   9.950  -3.461  -5.241
  112   2HD1  ILE  14          HD12      ILE  14  11.124  -2.706  -4.163
  113   3HD1  ILE  14          HD13      ILE  14   9.835  -1.739  -4.882
  114    H    GLU  15           HN       GLU  15  10.938  -5.544  -0.244
  115    HA   GLU  15           HA       GLU  15  10.446  -8.310  -0.622
  116   1HB   GLU  15          HB2       GLU  15  12.131  -6.849   1.426
  117   2HB   GLU  15          HB1       GLU  15  12.157  -8.601   1.213
  118   1HG   GLU  15          HG2       GLU  15  12.791  -8.313  -1.152
  119   2HG   GLU  15          HG1       GLU  15  12.767  -6.562  -0.946
  120    H    GLU  16           HN       GLU  16   9.627  -6.199   2.140
  121    HA   GLU  16           HA       GLU  16   8.643  -8.380   3.760
  122   1HB   GLU  16          HB2       GLU  16   9.306  -6.181   4.711
  123   2HB   GLU  16          HB1       GLU  16   7.920  -5.439   3.909
  124   1HG   GLU  16          HG2       GLU  16   6.388  -6.895   5.162
  125   2HG   GLU  16          HG1       GLU  16   7.759  -7.690   5.936
  126    H    LEU  17           HN       LEU  17   7.072  -6.094   1.516
  127    HA   LEU  17           HA       LEU  17   4.389  -6.909   2.022
  128   1HB   LEU  17          HB2       LEU  17   5.696  -5.845  -0.498
  129   2HB   LEU  17          HB1       LEU  17   3.962  -6.113  -0.352
  130    HG   LEU  17           HG       LEU  17   5.557  -4.349   1.531
  131   1HD1  LEU  17          HD11      LEU  17   5.680  -3.377  -0.682
  132   2HD1  LEU  17          HD12      LEU  17   4.479  -2.470   0.240
  133   3HD1  LEU  17          HD13      LEU  17   3.961  -3.662  -0.952
  134   1HD2  LEU  17          HD21      LEU  17   3.091  -3.416   1.778
  135   2HD2  LEU  17          HD22      LEU  17   3.568  -4.860   2.662
  136   3HD2  LEU  17          HD23      LEU  17   2.632  -5.009   1.175
  137    H    VAL  18           HN       VAL  18   6.769  -8.129  -0.323
  138    HA   VAL  18           HA       VAL  18   5.044 -10.082  -1.504
  139    HB   VAL  18           HB       VAL  18   8.061  -9.948  -1.264
  140   1HG1  VAL  18          HG11      VAL  18   7.543 -12.245  -1.689
  141   2HG1  VAL  18          HG12      VAL  18   7.953 -11.541  -3.252
  142   3HG1  VAL  18          HG13      VAL  18   6.265 -11.815  -2.825
  143   1HG2  VAL  18          HG21      VAL  18   6.255  -9.390  -3.630
  144   2HG2  VAL  18          HG22      VAL  18   7.979  -9.049  -3.495
  145   3HG2  VAL  18          HG23      VAL  18   6.821  -8.134  -2.530
  146    H    ASN  19           HN       ASN  19   7.359 -10.312   1.195
  147    HA   ASN  19           HA       ASN  19   7.177 -13.109   1.603
  148   1HB   ASN  19          HB2       ASN  19   8.870 -11.702   2.681
  149   2HB   ASN  19          HB1       ASN  19   7.620 -10.924   3.652
  150   1HD2  ASN  19          HD21      ASN  19   7.606 -11.771   5.726
  151   2HD2  ASN  19          HD22      ASN  19   7.877 -13.399   6.124
  152    H    ILE  20           HN       ILE  20   5.123 -10.504   2.936
  153    HA   ILE  20           HA       ILE  20   3.622 -12.370   4.577
  154    HB   ILE  20           HB       ILE  20   2.117 -10.461   4.998
  155   1HG1  ILE  20          HG12      ILE  20   3.892  -8.938   3.072
  156   2HG1  ILE  20          HG11      ILE  20   2.285  -9.520   2.661
  157   1HG2  ILE  20          HG21      ILE  20   3.849  -8.956   5.974
  158   2HG2  ILE  20          HG22      ILE  20   5.080  -9.827   5.061
  159   3HG2  ILE  20          HG23      ILE  20   4.160 -10.658   6.315
  160   1HD1  ILE  20          HD11      ILE  20   1.368  -8.236   4.596
  161   2HD1  ILE  20          HD12      ILE  20   2.109  -7.205   3.372
  162   3HD1  ILE  20          HD13      ILE  20   2.977  -7.565   4.865
  163    H    THR  21           HN       THR  21   3.417 -11.500   1.225
  164    HA   THR  21           HA       THR  21   0.579 -12.419   1.093
  165    HB   THR  21           HB       THR  21   0.699 -11.682  -1.282
  166    HG1  THR  21           HG1      THR  21   2.563 -11.286  -2.116
  167   1HG2  THR  21          HG21      THR  21   0.185 -10.143   0.773
  168   2HG2  THR  21          HG22      THR  21   0.477  -9.403  -0.800
  169   3HG2  THR  21          HG23      THR  21   1.756  -9.433   0.406
  170    H    GLN  22           HN       GLN  22   3.819 -13.511   0.319
  171    HA   GLN  22           HA       GLN  22   2.947 -15.536  -1.564
  172   1HB   GLN  22          HB2       GLN  22   5.515 -15.175  -0.015
  173   2HB   GLN  22          HB1       GLN  22   5.244 -16.539  -1.101
  174   1HG   GLN  22          HG2       GLN  22   4.784 -14.964  -2.955
  175   2HG   GLN  22          HG1       GLN  22   5.089 -13.610  -1.872
  176   1HE2  GLN  22          HE21      GLN  22   7.276 -15.521  -0.603
  177   2HE2  GLN  22          HE22      GLN  22   8.598 -15.300  -1.645
  178    H    ASN  23           HN       ASN  23   3.584 -15.539   1.928
  179    HA   ASN  23           HA       ASN  23   2.844 -18.415   2.060
  180   1HB   ASN  23          HB2       ASN  23   3.916 -16.469   4.112
  181   2HB   ASN  23          HB1       ASN  23   3.409 -18.110   4.514
  182   1HD2  ASN  23          HD21      ASN  23   6.142 -17.228   4.795
  183   2HD2  ASN  23          HD22      ASN  23   7.087 -18.095   3.684
  184    H    GLN  24           HN       GLN  24   0.965 -15.875   1.688
  185    HA   GLN  24           HA       GLN  24  -0.742 -16.159   4.066
  186   1HB   GLN  24          HB2       GLN  24  -2.023 -14.382   3.199
  187   2HB   GLN  24          HB1       GLN  24  -0.395 -14.006   2.647
  188   1HG   GLN  24          HG2       GLN  24  -1.028 -15.257   0.478
  189   2HG   GLN  24          HG1       GLN  24  -2.694 -15.154   1.052
  190   1HE2  GLN  24          HE21      GLN  24  -3.089 -12.696   1.999
  191   2HE2  GLN  24          HE22      GLN  24  -2.652 -11.487   0.891
  192    H    LYS  25           HN       LYS  25  -2.067 -17.899   4.260
  193    HA   LYS  25           HA       LYS  25  -2.841 -19.453   1.888
  194   1HB   LYS  25          HB2       LYS  25  -2.336 -20.574   4.054
  195   2HB   LYS  25          HB1       LYS  25  -3.709 -19.742   4.786
  196   1HG   LYS  25          HG2       LYS  25  -5.231 -20.827   3.174
  197   2HG   LYS  25          HG1       LYS  25  -3.861 -21.661   2.440
  198   1HD   LYS  25          HD2       LYS  25  -3.382 -22.758   4.606
  199   2HD   LYS  25          HD1       LYS  25  -4.776 -21.945   5.318
  200   1HE   LYS  25          HE2       LYS  25  -5.068 -23.658   2.850
  201   2HE   LYS  25          HE1       LYS  25  -5.110 -24.366   4.464
  202   1HZ   LYS  25          HZ1       LYS  25  -6.745 -22.158   4.580
  203   2HZ   LYS  25          HZ2       LYS  25  -7.231 -23.785   4.545
  204   3HZ   LYS  25          HZ3       LYS  25  -7.120 -22.898   3.101
  205    H    ALA  26           HN       ALA  26  -4.830 -18.180   4.562
  206    HA   ALA  26           HA       ALA  26  -7.064 -17.726   2.701
  207   1HB   ALA  26          HB1       ALA  26  -7.860 -16.647   5.123
  208   2HB   ALA  26          HB2       ALA  26  -6.675 -17.843   5.641
  209   3HB   ALA  26          HB3       ALA  26  -8.067 -18.344   4.684
  210    HA   PRO  27           HA       PRO  27  -6.292 -13.471   1.737
  211   1HB   PRO  27          HB2       PRO  27  -8.736 -12.557   3.134
  212   2HB   PRO  27          HB1       PRO  27  -8.331 -12.466   1.416
  213   1HG   PRO  27          HG2       PRO  27 -10.157 -14.270   2.612
  214   2HG   PRO  27          HG1       PRO  27  -9.545 -14.343   0.955
  215   1HD   PRO  27          HD2       PRO  27  -8.972 -16.168   3.132
  216   2HD   PRO  27          HD1       PRO  27  -8.351 -16.232   1.464
  217    H    LEU  28           HN       LEU  28  -5.741 -11.368   2.834
  218    HA   LEU  28           HA       LEU  28  -4.506 -11.823   5.401
  219   1HB   LEU  28          HB2       LEU  28  -5.050  -9.212   3.952
  220   2HB   LEU  28          HB1       LEU  28  -3.965  -9.408   5.328
  221    HG   LEU  28           HG       LEU  28  -3.666 -10.818   2.657
  222   1HD1  LEU  28          HD11      LEU  28  -1.960  -8.614   3.845
  223   2HD1  LEU  28          HD12      LEU  28  -3.246  -8.319   2.676
  224   3HD1  LEU  28          HD13      LEU  28  -1.850  -9.296   2.223
  225   1HD2  LEU  28          HD21      LEU  28  -2.596 -12.246   4.171
  226   2HD2  LEU  28          HD22      LEU  28  -2.177 -10.938   5.276
  227   3HD2  LEU  28          HD23      LEU  28  -1.277 -11.148   3.776
  228    H    CYS  29           HN       CYS  29  -7.691 -10.995   4.507
  229    HA   CYS  29           HA       CYS  29  -8.356 -10.514   7.363
  230   1HB   CYS  29          HB2       CYS  29  -9.208  -8.657   5.118
  231   2HB   CYS  29          HB1       CYS  29  -9.731  -8.547   6.798
  232    H    ASN  30           HN       ASN  30 -10.990 -10.111   7.261
  233    HA   ASN  30           HA       ASN  30 -12.065 -12.646   6.426
  234   1HB   ASN  30          HB2       ASN  30 -13.402 -10.061   7.282
  235   2HB   ASN  30          HB1       ASN  30 -14.281 -11.561   6.981
  236   1HD2  ASN  30          HD21      ASN  30 -14.148 -10.273   9.589
  237   2HD2  ASN  30          HD22      ASN  30 -13.324 -11.326  10.634
  238    H    GLY  31           HN       GLY  31 -10.836 -11.472   4.179
  239   1HA   GLY  31          HA2       GLY  31 -11.330 -11.257   1.885
  240   2HA   GLY  31          HA1       GLY  31 -13.028 -11.542   2.273
  241    H    SER  32           HN       SER  32 -11.237  -9.056   3.933
  242    HA   SER  32           HA       SER  32 -13.123  -7.014   3.343
  243   1HB   SER  32          HB2       SER  32 -10.218  -6.763   4.174
  244   2HB   SER  32          HB1       SER  32 -11.392  -5.452   4.209
  245    HG   SER  32           HG       SER  32 -11.042  -6.743   6.210
  246    H    MET  33           HN       MET  33 -13.209  -5.456   1.750
  247    HA   MET  33           HA       MET  33 -11.231  -5.690  -0.499
  248   1HB   MET  33          HB2       MET  33 -14.108  -4.714  -0.544
  249   2HB   MET  33          HB1       MET  33 -13.035  -4.835  -1.939
  250   1HG   MET  33          HG2       MET  33 -12.847  -7.269  -1.593
  251   2HG   MET  33          HG1       MET  33 -13.918  -7.156  -0.198
  252   1HE   MET  33          HE1       MET  33 -13.495  -6.144  -3.879
  253   2HE   MET  33          HE2       MET  33 -14.888  -6.909  -4.639
  254   3HE   MET  33          HE3       MET  33 -13.670  -7.904  -3.846
  255    H    VAL  34           HN       VAL  34 -10.691  -3.619  -1.567
  256    HA   VAL  34           HA       VAL  34 -11.104  -1.207   0.172
  257    HB   VAL  34           HB       VAL  34  -8.729  -0.568  -0.470
  258   1HG1  VAL  34          HG11      VAL  34  -9.225  -1.353   1.771
  259   2HG1  VAL  34          HG12      VAL  34  -7.731  -2.125   1.240
  260   3HG1  VAL  34          HG13      VAL  34  -9.244  -3.030   1.224
  261   1HG2  VAL  34          HG21      VAL  34  -8.628  -3.513  -1.204
  262   2HG2  VAL  34          HG22      VAL  34  -7.246  -2.419  -1.142
  263   3HG2  VAL  34          HG23      VAL  34  -8.511  -2.175  -2.347
  264    H    TRP  35           HN       TRP  35 -10.776   0.846  -1.028
  265    HA   TRP  35           HA       TRP  35 -12.120   0.745  -3.596
  266   1HB   TRP  35          HB2       TRP  35 -10.793   3.010  -2.086
  267   2HB   TRP  35          HB1       TRP  35 -11.671   3.227  -3.598
  268    HD1  TRP  35           HD1      TRP  35 -12.165   2.487   0.087
  269    HE1  TRP  35           HE1      TRP  35 -14.673   2.661   0.655
  270    HE3  TRP  35           HE3      TRP  35 -14.105   2.933  -4.619
  271    HZ2  TRP  35           HZ2      TRP  35 -17.171   2.956  -0.706
  272    HZ3  TRP  35           HZ3      TRP  35 -16.551   3.157  -4.951
  273    HH2  TRP  35           HH2      TRP  35 -18.085   3.171  -3.003
  274    H    SER  36           HN       SER  36 -11.239   0.827  -5.625
  275    HA   SER  36           HA       SER  36  -8.404   0.361  -5.971
  276   1HB   SER  36          HB2       SER  36 -10.084  -0.521  -7.555
  277   2HB   SER  36          HB1       SER  36 -10.529   1.123  -8.003
  278    HG   SER  36           HG       SER  36  -8.310   1.395  -8.649
  279    H    ILE  37           HN       ILE  37  -6.840   1.832  -6.844
  280    HA   ILE  37           HA       ILE  37  -7.669   4.711  -7.002
  281    HB   ILE  37           HB       ILE  37  -5.538   5.301  -5.832
  282   1HG1  ILE  37          HG12      ILE  37  -5.424   2.417  -4.922
  283   2HG1  ILE  37          HG11      ILE  37  -4.537   2.944  -6.349
  284   1HG2  ILE  37          HG21      ILE  37  -7.617   5.298  -4.574
  285   2HG2  ILE  37          HG22      ILE  37  -6.344   4.620  -3.558
  286   3HG2  ILE  37          HG23      ILE  37  -7.513   3.553  -4.336
  287   1HD1  ILE  37          HD11      ILE  37  -4.289   4.256  -3.629
  288   2HD1  ILE  37          HD12      ILE  37  -3.313   4.590  -5.060
  289   3HD1  ILE  37          HD13      ILE  37  -3.177   3.033  -4.244
  290    H    ASN  38           HN       ASN  38  -6.034   6.048  -8.174
  291    HA   ASN  38           HA       ASN  38  -4.971   4.543 -10.483
  292   1HB   ASN  38          HB2       ASN  38  -5.100   7.505  -9.830
  293   2HB   ASN  38          HB1       ASN  38  -4.362   6.862 -11.297
  294   1HD2  ASN  38          HD21      ASN  38  -6.818   8.561 -11.085
  295   2HD2  ASN  38          HD22      ASN  38  -8.066   7.655 -11.795
  296    H    LEU  39           HN       LEU  39  -2.870   3.905 -10.570
  297    HA   LEU  39           HA       LEU  39  -1.059   4.628  -8.376
  298   1HB   LEU  39          HB2       LEU  39  -0.821   2.814 -10.791
  299   2HB   LEU  39          HB1       LEU  39   0.521   3.087  -9.684
  300    HG   LEU  39           HG       LEU  39  -0.817   1.025  -9.160
  301   1HD1  LEU  39          HD11      LEU  39  -1.245   2.913  -6.862
  302   2HD1  LEU  39          HD12      LEU  39   0.399   2.596  -7.416
  303   3HD1  LEU  39          HD13      LEU  39  -0.617   1.267  -6.865
  304   1HD2  LEU  39          HD21      LEU  39  -3.059   1.135  -8.432
  305   2HD2  LEU  39          HD22      LEU  39  -3.016   2.191  -9.841
  306   3HD2  LEU  39          HD23      LEU  39  -2.999   2.883  -8.217
  307    H    THR  40           HN       THR  40   0.014   6.534  -8.485
  308    HA   THR  40           HA       THR  40   1.504   7.205 -10.953
  309    HB   THR  40           HB       THR  40   0.651   9.620 -10.734
  310    HG1  THR  40           HG1      THR  40  -1.664   8.533  -9.653
  311   1HG2  THR  40          HG21      THR  40  -1.262   9.181 -12.154
  312   2HG2  THR  40          HG22      THR  40  -1.388   7.531 -11.545
  313   3HG2  THR  40          HG23      THR  40  -0.009   8.001 -12.540
  314    H    ALA  41           HN       ALA  41   1.112   9.892  -8.953
  315    HA   ALA  41           HA       ALA  41   3.757   9.357  -7.663
  316   1HB   ALA  41          HB1       ALA  41   3.387  11.437  -9.078
  317   2HB   ALA  41          HB2       ALA  41   3.977  11.736  -7.442
  318   3HB   ALA  41          HB3       ALA  41   2.274  11.993  -7.827
  319    H    GLY  42           HN       GLY  42   0.399  10.218  -6.946
  320   1HA   GLY  42          HA2       GLY  42   0.950  10.453  -4.061
  321   2HA   GLY  42          HA1       GLY  42  -0.632  10.595  -4.830
  322    H    MET  43           HN       MET  43   1.539   7.915  -5.450
  323    HA   MET  43           HA       MET  43  -0.427   5.915  -4.993
  324   1HB   MET  43          HB2       MET  43   2.588   5.729  -4.844
  325   2HB   MET  43          HB1       MET  43   1.507   4.349  -4.967
  326   1HG   MET  43          HG2       MET  43   0.896   4.875  -7.167
  327   2HG   MET  43          HG1       MET  43   1.390   6.560  -7.009
  328   1HE   MET  43          HE1       MET  43   4.344   3.035  -6.931
  329   2HE   MET  43          HE2       MET  43   2.626   2.977  -6.551
  330   3HE   MET  43          HE3       MET  43   3.735   3.801  -5.459
  331    H    TYR  44           HN       TYR  44   2.285   6.952  -2.899
  332    HA   TYR  44           HA       TYR  44   1.652   5.218  -0.718
  333   1HB   TYR  44          HB2       TYR  44   3.064   7.903  -0.693
  334   2HB   TYR  44          HB1       TYR  44   3.113   6.708   0.605
  335    HD1  TYR  44           HD1      TYR  44   4.327   4.588   0.326
  336    HD2  TYR  44           HD2      TYR  44   4.226   7.537  -2.797
  337    HE1  TYR  44           HE1      TYR  44   6.186   3.424  -0.836
  338    HE2  TYR  44           HE2      TYR  44   6.084   6.374  -3.956
  339    HH   TYR  44           HH       TYR  44   8.098   4.351  -2.632
  340    H    CYS  45           HN       CYS  45   0.835   8.647  -1.274
  341    HA   CYS  45           HA       CYS  45  -0.686   9.000   1.133
  342   1HB   CYS  45          HB2       CYS  45  -1.230  10.429  -1.475
  343   2HB   CYS  45          HB1       CYS  45  -1.391  11.047   0.171
  344    H    ALA  46           HN       ALA  46  -1.764   8.438  -2.224
  345    HA   ALA  46           HA       ALA  46  -4.519   8.093  -1.631
  346   1HB   ALA  46          HB1       ALA  46  -4.704   7.176  -3.847
  347   2HB   ALA  46          HB2       ALA  46  -2.999   6.729  -3.863
  348   3HB   ALA  46          HB3       ALA  46  -3.465   8.428  -3.912
  349    H    ALA  47           HN       ALA  47  -1.927   5.658  -1.959
  350    HA   ALA  47           HA       ALA  47  -3.581   3.390  -1.537
  351   1HB   ALA  47          HB1       ALA  47  -0.660   3.774  -0.821
  352   2HB   ALA  47          HB2       ALA  47  -1.281   3.182  -2.362
  353   3HB   ALA  47          HB3       ALA  47  -1.488   2.219  -0.899
  354    H    LEU  48           HN       LEU  48  -1.898   5.477   0.798
  355    HA   LEU  48           HA       LEU  48  -2.378   3.893   3.096
  356   1HB   LEU  48          HB2       LEU  48  -0.850   5.803   3.123
  357   2HB   LEU  48          HB1       LEU  48  -2.194   6.908   2.846
  358    HG   LEU  48           HG       LEU  48  -3.190   6.273   5.008
  359   1HD1  LEU  48          HD11      LEU  48  -0.895   4.314   5.018
  360   2HD1  LEU  48          HD12      LEU  48  -2.594   4.032   5.396
  361   3HD1  LEU  48          HD13      LEU  48  -1.571   4.893   6.541
  362   1HD2  LEU  48          HD21      LEU  48  -1.541   8.115   4.924
  363   2HD2  LEU  48          HD22      LEU  48  -0.243   6.960   5.227
  364   3HD2  LEU  48          HD23      LEU  48  -1.464   7.258   6.464
  365    H    GLU  49           HN       GLU  49  -4.396   6.593   1.801
  366    HA   GLU  49           HA       GLU  49  -6.386   6.350   3.818
  367   1HB   GLU  49          HB2       GLU  49  -7.943   7.419   2.108
  368   2HB   GLU  49          HB1       GLU  49  -6.474   8.314   2.493
  369   1HG   GLU  49          HG2       GLU  49  -5.393   7.435   0.474
  370   2HG   GLU  49          HG1       GLU  49  -6.852   6.517   0.083
  371    H    SER  50           HN       SER  50  -6.037   4.575   0.757
  372    HA   SER  50           HA       SER  50  -8.608   3.336   0.812
  373   1HB   SER  50          HB2       SER  50  -5.982   2.247  -0.238
  374   2HB   SER  50          HB1       SER  50  -7.565   1.566  -0.587
  375    HG   SER  50           HG       SER  50  -7.301   2.934  -2.224
  376    H    LEU  51           HN       LEU  51  -5.537   2.419   2.343
  377    HA   LEU  51           HA       LEU  51  -6.485  -0.087   3.402
  378   1HB   LEU  51          HB2       LEU  51  -4.218   1.743   4.222
  379   2HB   LEU  51          HB1       LEU  51  -4.501   0.170   4.962
  380    HG   LEU  51           HG       LEU  51  -4.120   0.587   1.982
  381   1HD1  LEU  51          HD11      LEU  51  -2.131  -0.180   4.135
  382   2HD1  LEU  51          HD12      LEU  51  -2.069   1.232   3.080
  383   3HD1  LEU  51          HD13      LEU  51  -1.834  -0.381   2.408
  384   1HD2  LEU  51          HD21      LEU  51  -5.141  -1.501   2.162
  385   2HD2  LEU  51          HD22      LEU  51  -4.491  -1.808   3.771
  386   3HD2  LEU  51          HD23      LEU  51  -3.456  -1.972   2.355
  387    H    ILE  52           HN       ILE  52  -6.376   3.213   4.713
  388    HA   ILE  52           HA       ILE  52  -7.089   2.687   7.373
  389    HB   ILE  52           HB       ILE  52  -7.895   4.979   5.562
  390   1HG1  ILE  52          HG12      ILE  52  -5.484   4.786   5.942
  391   2HG1  ILE  52          HG11      ILE  52  -6.115   6.184   6.792
  392   1HG2  ILE  52          HG21      ILE  52  -9.497   4.997   7.328
  393   2HG2  ILE  52          HG22      ILE  52  -8.283   6.206   7.744
  394   3HG2  ILE  52          HG23      ILE  52  -8.267   4.632   8.539
  395   1HD1  ILE  52          HD11      ILE  52  -4.836   5.283   8.483
  396   2HD1  ILE  52          HD12      ILE  52  -5.017   3.636   7.888
  397   3HD1  ILE  52          HD13      ILE  52  -6.327   4.395   8.789
  398    H    ASN  53           HN       ASN  53  -8.918   1.986   4.592
  399    HA   ASN  53           HA       ASN  53 -11.530   2.149   5.953
  400   1HB   ASN  53          HB2       ASN  53 -10.663   1.091   3.250
  401   2HB   ASN  53          HB1       ASN  53 -12.327   1.013   3.828
  402   1HD2  ASN  53          HD21      ASN  53 -13.048   3.340   4.785
  403   2HD2  ASN  53          HD22      ASN  53 -12.673   4.652   3.776
  404    H    VAL  54           HN       VAL  54  -8.957  -0.117   5.574
  405    HA   VAL  54           HA       VAL  54 -10.661  -2.458   6.199
  406    HB   VAL  54           HB       VAL  54  -7.640  -2.370   6.046
  407   1HG1  VAL  54          HG11      VAL  54  -9.697  -4.557   5.604
  408   2HG1  VAL  54          HG12      VAL  54  -8.644  -4.398   7.010
  409   3HG1  VAL  54          HG13      VAL  54  -7.952  -4.751   5.426
  410   1HG2  VAL  54          HG21      VAL  54  -9.702  -2.600   3.838
  411   2HG2  VAL  54          HG22      VAL  54  -8.036  -3.145   3.645
  412   3HG2  VAL  54          HG23      VAL  54  -8.376  -1.443   3.960
  413    H    SER  55           HN       SER  55 -11.126  -2.928   8.286
  414    HA   SER  55           HA       SER  55  -9.200  -2.072  10.432
  415   1HB   SER  55          HB2       SER  55 -12.229  -2.139  10.455
  416   2HB   SER  55          HB1       SER  55 -11.245  -1.928  11.901
  417    HG   SER  55           HG       SER  55 -10.352  -0.072  10.928
  418    H    GLY  56           HN       GLY  56  -8.796  -3.577  12.064
  419   1HA   GLY  56          HA2       GLY  56  -9.035  -5.636  13.249
  420   2HA   GLY  56          HA1       GLY  56 -10.267  -6.139  12.092
  421    H    CYS  57           HN       CYS  57  -6.978  -4.957  11.407
  422    HA   CYS  57           HA       CYS  57  -6.134  -7.685  10.608
  423   1HB   CYS  57          HB2       CYS  57  -6.241  -5.341   8.686
  424   2HB   CYS  57          HB1       CYS  57  -5.445  -6.879   8.354
  425    H    SER  58           HN       SER  58  -4.501  -7.534  12.199
  426    HA   SER  58           HA       SER  58  -2.764  -5.269  12.518
  427   1HB   SER  58          HB2       SER  58  -3.043  -7.022  14.247
  428   2HB   SER  58          HB1       SER  58  -2.247  -8.181  13.187
  429    HG   SER  58           HG       SER  58  -0.581  -7.430  14.306
  430    H    ALA  59           HN       ALA  59  -2.540  -8.216  10.583
  431    HA   ALA  59           HA       ALA  59   0.086  -8.205   9.724
  432   1HB   ALA  59          HB1       ALA  59  -1.517  -9.891   8.998
  433   2HB   ALA  59          HB2       ALA  59  -0.747  -9.167   7.587
  434   3HB   ALA  59          HB3       ALA  59  -2.383  -8.690   8.039
  435    H    ILE  60           HN       ILE  60  -2.447  -5.947   8.652
  436    HA   ILE  60           HA       ILE  60  -0.524  -4.732   6.716
  437    HB   ILE  60           HB       ILE  60  -2.476  -3.481   5.890
  438   1HG1  ILE  60          HG12      ILE  60  -4.058  -5.039   7.954
  439   2HG1  ILE  60          HG11      ILE  60  -3.647  -3.336   8.122
  440   1HG2  ILE  60          HG21      ILE  60  -3.592  -5.336   4.877
  441   2HG2  ILE  60          HG22      ILE  60  -3.222  -6.390   6.241
  442   3HG2  ILE  60          HG23      ILE  60  -1.933  -5.861   5.161
  443   1HD1  ILE  60          HD11      ILE  60  -4.801  -2.895   5.943
  444   2HD1  ILE  60          HD12      ILE  60  -5.884  -3.490   7.202
  445   3HD1  ILE  60          HD13      ILE  60  -5.327  -4.579   5.931
  446    H    GLU  61           HN       GLU  61  -1.547  -4.232   9.927
  447    HA   GLU  61           HA       GLU  61  -1.655  -1.387  10.007
  448   1HB   GLU  61          HB2       GLU  61  -0.864  -3.453  12.067
  449   2HB   GLU  61          HB1       GLU  61  -0.870  -1.728  12.434
  450   1HG   GLU  61          HG2       GLU  61  -3.240  -1.583  11.774
  451   2HG   GLU  61          HG1       GLU  61  -3.244  -3.302  11.389
  452    H    LYS  62           HN       LYS  62   1.139  -3.608  10.198
  453    HA   LYS  62           HA       LYS  62   3.102  -1.562  10.672
  454   1HB   LYS  62          HB2       LYS  62   3.307  -4.258   9.311
  455   2HB   LYS  62          HB1       LYS  62   4.702  -3.232   9.640
  456   1HG   LYS  62          HG2       LYS  62   4.117  -3.255  12.055
  457   2HG   LYS  62          HG1       LYS  62   2.786  -4.358  11.702
  458   1HD   LYS  62          HD2       LYS  62   5.683  -4.938  11.013
  459   2HD   LYS  62          HD1       LYS  62   4.899  -5.506  12.486
  460   1HE   LYS  62          HE2       LYS  62   3.103  -6.502  10.874
  461   2HE   LYS  62          HE1       LYS  62   4.333  -6.290   9.628
  462   1HZ   LYS  62          HZ1       LYS  62   4.464  -7.957  12.064
  463   2HZ   LYS  62          HZ2       LYS  62   5.862  -7.510  11.207
  464   3HZ   LYS  62          HZ3       LYS  62   4.654  -8.432  10.447
  465    H    THR  63           HN       THR  63   1.714  -2.956   7.720
  466    HA   THR  63           HA       THR  63   3.392  -1.649   5.843
  467    HB   THR  63           HB       THR  63   0.469  -2.401   5.549
  468    HG1  THR  63           HG1      THR  63   2.608  -3.871   4.523
  469   1HG2  THR  63          HG21      THR  63   1.007  -0.953   3.747
  470   2HG2  THR  63          HG22      THR  63   1.219  -2.579   3.098
  471   3HG2  THR  63          HG23      THR  63   2.626  -1.632   3.580
  472    H    GLN  64           HN       GLN  64   0.390  -0.558   7.410
  473    HA   GLN  64           HA       GLN  64   0.066   1.845   5.918
  474   1HB   GLN  64          HB2       GLN  64  -0.674   1.143   8.771
  475   2HB   GLN  64          HB1       GLN  64  -1.166   2.643   7.984
  476   1HG   GLN  64          HG2       GLN  64  -2.287   1.349   6.206
  477   2HG   GLN  64          HG1       GLN  64  -1.799  -0.152   6.994
  478   1HE2  GLN  64          HE21      GLN  64  -2.233   1.353   9.692
  479   2HE2  GLN  64          HE22      GLN  64  -3.912   1.260   9.923
  480    H    ARG  65           HN       ARG  65   1.940   1.147   8.856
  481    HA   ARG  65           HA       ARG  65   2.798   3.822   9.377
  482   1HB   ARG  65          HB2       ARG  65   3.055   1.871  10.944
  483   2HB   ARG  65          HB1       ARG  65   4.328   1.253   9.896
  484   1HG   ARG  65          HG2       ARG  65   5.571   2.418  11.485
  485   2HG   ARG  65          HG1       ARG  65   5.395   3.645  10.238
  486   1HD   ARG  65          HD2       ARG  65   3.162   4.188  11.640
  487   2HD   ARG  65          HD1       ARG  65   4.116   3.488  12.943
  488    HE   ARG  65           HE       ARG  65   4.414   6.114  11.930
  489   1HH1  ARG  65          HH21      ARG  65   6.379   3.356  12.615
  490   2HH1  ARG  65          HH22      ARG  65   7.851   4.260  12.647
  491   1HH2  ARG  65          HH11      ARG  65   6.316   7.295  12.000
  492   2HH2  ARG  65          HH12      ARG  65   7.816   6.488  12.312
  493    H    MET  66           HN       MET  66   4.397   1.185   7.555
  494    HA   MET  66           HA       MET  66   6.647   2.745   6.767
  495   1HB   MET  66          HB2       MET  66   5.359   0.308   5.515
  496   2HB   MET  66          HB1       MET  66   6.866   1.013   4.927
  497   1HG   MET  66          HG2       MET  66   7.830   0.767   7.219
  498   2HG   MET  66          HG1       MET  66   6.351  -0.043   7.725
  499   1HE   MET  66          HE1       MET  66   5.598  -2.031   5.183
  500   2HE   MET  66          HE2       MET  66   5.434  -2.026   6.936
  501   3HE   MET  66          HE3       MET  66   6.258  -3.364   6.139
  502    H    LEU  67           HN       LEU  67   3.482   2.260   5.174
  503    HA   LEU  67           HA       LEU  67   4.139   3.687   2.777
  504   1HB   LEU  67          HB2       LEU  67   1.493   3.346   4.215
  505   2HB   LEU  67          HB1       LEU  67   1.647   4.091   2.627
  506    HG   LEU  67           HG       LEU  67   2.617   1.294   3.278
  507   1HD1  LEU  67          HD11      LEU  67   0.012   2.279   2.099
  508   2HD1  LEU  67          HD12      LEU  67   0.233   1.273   3.530
  509   3HD1  LEU  67          HD13      LEU  67   0.573   0.616   1.928
  510   1HD2  LEU  67          HD21      LEU  67   3.773   1.933   1.342
  511   2HD2  LEU  67          HD22      LEU  67   2.462   2.965   0.773
  512   3HD2  LEU  67          HD23      LEU  67   2.322   1.213   0.653
  513    H    SER  68           HN       SER  68   2.906   4.748   5.923
  514    HA   SER  68           HA       SER  68   2.444   7.474   5.255
  515   1HB   SER  68          HB2       SER  68   3.325   6.219   7.872
  516   2HB   SER  68          HB1       SER  68   2.787   7.888   7.706
  517    HG   SER  68           HG       SER  68   1.354   5.495   7.516
  518    H    GLY  69           HN       GLY  69   5.376   5.772   6.310
  519   1HA   GLY  69          HA2       GLY  69   7.098   7.942   6.722
  520   2HA   GLY  69          HA1       GLY  69   7.630   6.404   6.039
  521    H    PHE  70           HN       PHE  70   5.729   6.788   3.708
  522    HA   PHE  70           HA       PHE  70   7.562   8.501   2.113
  523   1HB   PHE  70          HB2       PHE  70   5.389   6.537   1.359
  524   2HB   PHE  70          HB1       PHE  70   6.222   7.545   0.177
  525    HD1  PHE  70           HD1      PHE  70   8.681   7.306  -0.166
  526    HD2  PHE  70           HD2      PHE  70   6.464   4.641   2.370
  527    HE1  PHE  70           HE1      PHE  70  10.556   5.685  -0.233
  528    HE2  PHE  70           HE2      PHE  70   8.340   3.019   2.304
  529    HZ   PHE  70           HZ       PHE  70  10.385   3.541   1.002
  530    H    CYS  71           HN       CYS  71   4.409   8.611   3.536
  531    HA   CYS  71           HA       CYS  71   3.937  11.229   2.188
  532   1HB   CYS  71          HB2       CYS  71   2.604   9.342   1.082
  533   2HB   CYS  71          HB1       CYS  71   1.667   9.285   2.576
  534    HA   PRO  72           HA       PRO  72   3.413  11.703   6.793
  535   1HB   PRO  72          HB2       PRO  72   3.399  14.570   6.020
  536   2HB   PRO  72          HB1       PRO  72   4.432  13.726   7.181
  537   1HG   PRO  72          HG2       PRO  72   5.322  14.632   4.754
  538   2HG   PRO  72          HG1       PRO  72   6.042  13.255   5.602
  539   1HD   PRO  72          HD2       PRO  72   4.311  13.267   3.182
  540   2HD   PRO  72          HD1       PRO  72   5.489  12.041   3.721
  541    H    HIS  73           HN       HIS  73   1.178  11.209   4.943
  542    HA   HIS  73           HA       HIS  73  -0.770  13.357   5.464
  543   1HB   HIS  73          HB2       HIS  73  -0.385  11.484   3.425
  544   2HB   HIS  73          HB1       HIS  73  -1.803  10.864   4.252
  545    HD1  HIS  73           HD1      HIS  73  -3.973  12.195   4.017
  546    HD2  HIS  73           HD2      HIS  73  -0.685  14.102   2.326
  547    HE1  HIS  73           HE1      HIS  73  -4.900  14.154   2.727
  548    H    LYS  74           HN       LYS  74  -1.636  13.361   7.500
  549    HA   LYS  74           HA       LYS  74  -2.155  10.829   8.920
  550   1HB   LYS  74          HB2       LYS  74  -2.813  13.719   9.607
  551   2HB   LYS  74          HB1       LYS  74  -3.130  12.345  10.667
  552   1HG   LYS  74          HG2       LYS  74  -0.724  11.793  10.678
  553   2HG   LYS  74          HG1       LYS  74  -0.405  13.169   9.621
  554   1HD   LYS  74          HD2       LYS  74  -1.292  14.701  11.342
  555   2HD   LYS  74          HD1       LYS  74  -1.609  13.327  12.401
  556   1HE   LYS  74          HE2       LYS  74   1.155  13.828  11.295
  557   2HE   LYS  74          HE1       LYS  74   0.599  14.634  12.760
  558   1HZ   LYS  74          HZ1       LYS  74   0.443  12.666  13.900
  559   2HZ   LYS  74          HZ2       LYS  74   1.797  12.360  12.918
  560   3HZ   LYS  74          HZ3       LYS  74   0.277  11.725  12.498
  561    H    VAL  75           HN       VAL  75  -3.712   9.769   7.670
  562    HA   VAL  75           HA       VAL  75  -6.141  11.248   6.826
  563    HB   VAL  75           HB       VAL  75  -5.452   8.344   6.363
  564   1HG1  VAL  75          HG11      VAL  75  -7.119   8.371   4.719
  565   2HG1  VAL  75          HG12      VAL  75  -7.073  10.124   4.553
  566   3HG1  VAL  75          HG13      VAL  75  -7.831   9.390   5.964
  567   1HG2  VAL  75          HG21      VAL  75  -3.603   9.439   5.410
  568   2HG2  VAL  75          HG22      VAL  75  -4.559  10.838   4.933
  569   3HG2  VAL  75          HG23      VAL  75  -4.724   9.321   4.055
  570    H    SER  76           HN       SER  76  -8.100  10.998   7.796
  571    HA   SER  76           HA       SER  76  -8.302   9.103  10.104
  572   1HB   SER  76          HB2       SER  76 -10.200  10.506  10.814
  573   2HB   SER  76          HB1       SER  76  -8.748  11.480  10.607
  574    HG   SER  76           HG       SER  76 -10.546  12.448   9.599
  575    H    ALA  77           HN       ALA  77 -10.309   7.875  10.291
  576    HA   ALA  77           HA       ALA  77 -11.119   6.610   7.875
  577   1HB   ALA  77          HB1       ALA  77 -11.380   5.541  10.069
  578   2HB   ALA  77          HB2       ALA  77 -12.941   5.633   9.252
  579   3HB   ALA  77          HB3       ALA  77 -12.553   6.770  10.543
  580    H    GLY  78           HN       GLY  78 -11.885   9.688   9.012
  581   1HA   GLY  78          HA2       GLY  78 -14.546   9.742   7.646
  582   2HA   GLY  78          HA1       GLY  78 -13.950  10.962   8.768
  583    H    GLN  79           HN       GLN  79 -11.359  11.356   7.627
  584    HA   GLN  79           HA       GLN  79 -12.148  13.001   5.307
  585   1HB   GLN  79          HB2       GLN  79  -9.511  12.719   6.782
  586   2HB   GLN  79          HB1       GLN  79  -9.814  13.866   5.477
  587   1HG   GLN  79          HG2       GLN  79 -11.443  13.751   8.029
  588   2HG   GLN  79          HG1       GLN  79 -10.091  14.854   7.776
  589   1HE2  GLN  79          HE21      GLN  79 -13.405  14.762   7.617
  590   2HE2  GLN  79          HE22      GLN  79 -13.667  15.951   6.434
  591    H    PHE  80           HN       PHE  80 -11.751  12.469   3.222
  592    HA   PHE  80           HA       PHE  80  -9.792  10.278   2.617
  593   1HB   PHE  80          HB2       PHE  80 -12.549  10.681   1.422
  594   2HB   PHE  80          HB1       PHE  80 -11.341   9.555   0.811
  595    HD1  PHE  80           HD1      PHE  80 -13.757  10.234   3.476
  596    HD2  PHE  80           HD2      PHE  80 -10.641   7.596   2.141
  597    HE1  PHE  80           HE1      PHE  80 -14.487   8.535   5.129
  598    HE2  PHE  80           HE2      PHE  80 -11.370   5.898   3.794
  599    HZ   PHE  80           HZ       PHE  80 -13.293   6.366   5.288
  600    H    SER  81           HN       SER  81  -8.769  10.493   0.522
  601    HA   SER  81           HA       SER  81  -9.000  13.252  -0.655
  602   1HB   SER  81          HB2       SER  81  -6.573  11.504  -0.232
  603   2HB   SER  81          HB1       SER  81  -6.565  12.958  -1.226
  604    HG   SER  81           HG       SER  81  -7.735  13.395   1.179
  605    H    SER  82           HN       SER  82  -8.184   9.836  -1.461
  606    HA   SER  82           HA       SER  82  -8.486  10.527  -4.352
  607   1HB   SER  82          HB2       SER  82  -6.465   9.269  -3.538
  608   2HB   SER  82          HB1       SER  82  -7.531   7.922  -3.149
  609    HG   SER  82           HG       SER  82  -7.945   7.630  -5.260
  610    H    LEU  83           HN       LEU  83 -10.541   9.407  -1.964
  611    HA   LEU  83           HA       LEU  83 -11.867   7.362  -3.646
  612   1HB   LEU  83          HB2       LEU  83 -12.377   8.475  -0.891
  613   2HB   LEU  83          HB1       LEU  83 -13.588   7.489  -1.695
  614    HG   LEU  83           HG       LEU  83 -11.841   5.710  -2.012
  615   1HD1  LEU  83          HD11      LEU  83  -9.801   6.938  -1.886
  616   2HD1  LEU  83          HD12      LEU  83  -9.844   5.955  -0.422
  617   3HD1  LEU  83          HD13      LEU  83 -10.250   7.670  -0.345
  618   1HD2  LEU  83          HD21      LEU  83 -11.731   5.167   0.518
  619   2HD2  LEU  83          HD22      LEU  83 -13.329   5.349  -0.203
  620   3HD2  LEU  83          HD23      LEU  83 -12.636   6.665   0.745
  621    H    HIS  84           HN       HIS  84 -11.699  10.341  -4.389
  622    HA   HIS  84           HA       HIS  84 -14.415  11.354  -4.217
  623   1HB   HIS  84          HB2       HIS  84 -12.287  12.111  -6.238
  624   2HB   HIS  84          HB1       HIS  84 -13.682  13.074  -5.753
  625    HD1  HIS  84           HD1      HIS  84 -12.934  11.942  -2.633
  626    HD2  HIS  84           HD2      HIS  84 -10.773  14.413  -5.199
  627    HE1  HIS  84           HE1      HIS  84 -11.304  13.229  -1.181
  628    H    VAL  85           HN       VAL  85 -12.546   9.588  -6.645
  629    HA   VAL  85           HA       VAL  85 -14.646   9.656  -8.647
  630    HB   VAL  85           HB       VAL  85 -12.367   7.672  -8.448
  631   1HG1  VAL  85          HG11      VAL  85 -12.574   7.659 -10.899
  632   2HG1  VAL  85          HG12      VAL  85 -13.875   8.847 -10.804
  633   3HG1  VAL  85          HG13      VAL  85 -14.109   7.227 -10.147
  634   1HG2  VAL  85          HG21      VAL  85 -12.370  10.461  -9.649
  635   2HG2  VAL  85          HG22      VAL  85 -11.047   9.299  -9.758
  636   3HG2  VAL  85          HG23      VAL  85 -11.501   9.975  -8.193
  637    H    ARG  86           HN       ARG  86 -16.108   7.967  -9.168
  638    HA   ARG  86           HA       ARG  86 -16.758   6.190  -6.893
  639   1HB   ARG  86          HB2       ARG  86 -18.166   6.829  -9.499
  640   2HB   ARG  86          HB1       ARG  86 -18.773   5.655  -8.332
  641   1HG   ARG  86          HG2       ARG  86 -18.834   7.405  -6.594
  642   2HG   ARG  86          HG1       ARG  86 -18.227   8.583  -7.759
  643   1HD   ARG  86          HD2       ARG  86 -20.653   8.787  -7.613
  644   2HD   ARG  86          HD1       ARG  86 -20.223   8.130  -9.193
  645    HE   ARG  86           HE       ARG  86 -20.650   5.876  -7.651
  646   1HH1  ARG  86          HH21      ARG  86 -22.383   8.767  -8.376
  647   2HH1  ARG  86          HH22      ARG  86 -23.942   8.027  -8.225
  648   1HH2  ARG  86          HH11      ARG  86 -22.674   4.893  -7.455
  649   2HH2  ARG  86          HH12      ARG  86 -24.107   5.834  -7.705
  650    H    ASP  87           HN       ASP  87 -14.617   5.032  -7.446
  651    HA   ASP  87           HA       ASP  87 -14.754   3.215  -9.765
  652   1HB   ASP  87          HB2       ASP  87 -12.728   3.606  -7.547
  653   2HB   ASP  87          HB1       ASP  87 -12.580   2.343  -8.769
  654    H    THR  88           HN       THR  88 -14.205   0.814  -9.188
  655    HA   THR  88           HA       THR  88 -16.240  -0.069  -7.220
  656    HB   THR  88           HB       THR  88 -15.893  -2.291  -8.236
  657    HG1  THR  88           HG1      THR  88 -14.099  -2.657  -9.232
  658   1HG2  THR  88          HG21      THR  88 -16.797  -1.797 -10.403
  659   2HG2  THR  88          HG22      THR  88 -16.045  -0.202 -10.419
  660   3HG2  THR  88          HG23      THR  88 -17.378  -0.537  -9.315
  661    H    LYS  89           HN       LYS  89 -15.653  -1.777  -5.651
  662    HA   LYS  89           HA       LYS  89 -13.025  -1.237  -4.435
  663   1HB   LYS  89          HB2       LYS  89 -15.323  -3.023  -3.581
  664   2HB   LYS  89          HB1       LYS  89 -13.858  -2.763  -2.639
  665   1HG   LYS  89          HG2       LYS  89 -14.341  -0.350  -2.534
  666   2HG   LYS  89          HG1       LYS  89 -15.812  -0.605  -3.476
  667   1HD   LYS  89          HD2       LYS  89 -16.680  -2.109  -1.724
  668   2HD   LYS  89          HD1       LYS  89 -15.214  -1.853  -0.778
  669   1HE   LYS  89          HE2       LYS  89 -15.719   0.466  -0.457
  670   2HE   LYS  89          HE1       LYS  89 -17.021   0.409  -1.647
  671   1HZ   LYS  89          HZ1       LYS  89 -17.032  -0.365   1.122
  672   2HZ   LYS  89          HZ2       LYS  89 -17.713  -1.533   0.092
  673   3HZ   LYS  89          HZ3       LYS  89 -18.325   0.052   0.108
  674    H    ILE  90           HN       ILE  90 -11.491  -2.935  -3.960
  675    HA   ILE  90           HA       ILE  90 -11.778  -5.421  -5.608
  676    HB   ILE  90           HB       ILE  90  -9.368  -5.239  -6.174
  677   1HG1  ILE  90          HG12      ILE  90  -9.584  -2.434  -5.032
  678   2HG1  ILE  90          HG11      ILE  90  -8.772  -3.767  -4.212
  679   1HG2  ILE  90          HG21      ILE  90 -10.862  -2.732  -6.980
  680   2HG2  ILE  90          HG22      ILE  90 -11.226  -4.325  -7.641
  681   3HG2  ILE  90          HG23      ILE  90  -9.641  -3.601  -7.909
  682   1HD1  ILE  90          HD11      ILE  90  -7.402  -4.020  -6.396
  683   2HD1  ILE  90          HD12      ILE  90  -7.027  -2.653  -5.354
  684   3HD1  ILE  90          HD13      ILE  90  -8.005  -2.413  -6.797
  685    H    GLU  91           HN       GLU  91 -10.401  -7.198  -4.823
  686    HA   GLU  91           HA       GLU  91 -10.559  -7.504  -1.980
  687   1HB   GLU  91          HB2       GLU  91  -9.076  -9.062  -4.107
  688   2HB   GLU  91          HB1       GLU  91  -9.117  -9.550  -2.413
  689   1HG   GLU  91          HG2       GLU  91 -11.580  -9.629  -2.491
  690   2HG   GLU  91          HG1       GLU  91 -11.544  -9.145  -4.187
  691    H    VAL  92           HN       VAL  92  -8.989  -7.318  -0.383
  692    HA   VAL  92           HA       VAL  92  -6.906  -5.419  -0.716
  693    HB   VAL  92           HB       VAL  92  -7.332  -7.582   1.363
  694   1HG1  VAL  92          HG11      VAL  92  -5.229  -5.418   1.166
  695   2HG1  VAL  92          HG12      VAL  92  -5.002  -7.137   1.487
  696   3HG1  VAL  92          HG13      VAL  92  -5.718  -6.098   2.719
  697   1HG2  VAL  92          HG21      VAL  92  -8.365  -5.907   2.648
  698   2HG2  VAL  92          HG22      VAL  92  -8.910  -5.504   1.021
  699   3HG2  VAL  92          HG23      VAL  92  -7.587  -4.600   1.756
  700    H    ALA  93           HN       ALA  93  -6.800  -8.988  -0.746
  701    HA   ALA  93           HA       ALA  93  -4.010  -9.333  -0.972
  702   1HB   ALA  93          HB1       ALA  93  -4.603 -11.430  -2.268
  703   2HB   ALA  93          HB2       ALA  93  -6.285 -10.903  -2.217
  704   3HB   ALA  93          HB3       ALA  93  -5.431 -11.269  -0.718
  705    H    GLN  94           HN       GLN  94  -6.413  -8.577  -3.463
  706    HA   GLN  94           HA       GLN  94  -4.477  -8.635  -5.635
  707   1HB   GLN  94          HB2       GLN  94  -7.286  -7.516  -5.412
  708   2HB   GLN  94          HB1       GLN  94  -6.347  -7.494  -6.905
  709   1HG   GLN  94          HG2       GLN  94  -6.963 -10.014  -5.334
  710   2HG   GLN  94          HG1       GLN  94  -7.909  -9.461  -6.716
  711   1HE2  GLN  94          HE21      GLN  94  -5.813 -11.793  -6.158
  712   2HE2  GLN  94          HE22      GLN  94  -4.854 -11.749  -7.558
  713    H    PHE  95           HN       PHE  95  -5.791  -6.195  -3.458
  714    HA   PHE  95           HA       PHE  95  -4.871  -3.867  -4.814
  715   1HB   PHE  95          HB2       PHE  95  -6.380  -3.730  -2.887
  716   2HB   PHE  95          HB1       PHE  95  -5.132  -4.402  -1.839
  717    HD1  PHE  95           HD1      PHE  95  -6.367  -1.412  -3.508
  718    HD2  PHE  95           HD2      PHE  95  -3.024  -3.123  -1.427
  719    HE1  PHE  95           HE1      PHE  95  -5.434   0.855  -3.148
  720    HE2  PHE  95           HE2      PHE  95  -2.092  -0.854  -1.062
  721    HZ   PHE  95           HZ       PHE  95  -3.295   1.129  -1.923
  722    H    VAL  96           HN       VAL  96  -3.279  -5.908  -2.356
  723    HA   VAL  96           HA       VAL  96  -0.848  -4.416  -2.245
  724    HB   VAL  96           HB       VAL  96  -1.372  -7.357  -1.734
  725   1HG1  VAL  96          HG11      VAL  96   0.746  -7.085  -0.311
  726   2HG1  VAL  96          HG12      VAL  96   1.033  -5.599  -1.216
  727   3HG1  VAL  96          HG13      VAL  96   0.981  -7.147  -2.059
  728   1HG2  VAL  96          HG21      VAL  96  -1.493  -6.677   0.602
  729   2HG2  VAL  96          HG22      VAL  96  -2.632  -5.710  -0.333
  730   3HG2  VAL  96          HG23      VAL  96  -1.092  -5.015   0.170
  731    H    LYS  97           HN       LYS  97  -1.750  -7.275  -4.217
  732    HA   LYS  97           HA       LYS  97   0.781  -7.539  -5.505
  733   1HB   LYS  97          HB2       LYS  97  -2.009  -8.242  -6.450
  734   2HB   LYS  97          HB1       LYS  97  -0.548  -8.667  -7.341
  735   1HG   LYS  97          HG2       LYS  97   0.294  -9.905  -5.379
  736   2HG   LYS  97          HG1       LYS  97  -1.169  -9.483  -4.487
  737   1HD   LYS  97          HD2       LYS  97  -2.538 -10.669  -6.166
  738   2HD   LYS  97          HD1       LYS  97  -1.075 -11.095  -7.055
  739   1HE   LYS  97          HE2       LYS  97  -1.866 -12.936  -5.564
  740   2HE   LYS  97          HE1       LYS  97  -0.244 -12.379  -5.159
  741   1HZ   LYS  97          HZ1       LYS  97  -2.231 -12.606  -3.390
  742   2HZ   LYS  97          HZ2       LYS  97  -2.396 -10.974  -3.832
  743   3HZ   LYS  97          HZ3       LYS  97  -0.922 -11.543  -3.209
  744    H    ASP  98           HN       ASP  98  -2.117  -5.669  -6.482
  745    HA   ASP  98           HA       ASP  98  -1.022  -4.683  -8.925
  746   1HB   ASP  98          HB2       ASP  98  -3.027  -3.473  -6.999
  747   2HB   ASP  98          HB1       ASP  98  -2.644  -2.759  -8.567
  748    H    LEU  99           HN       LEU  99  -0.818  -3.516  -5.599
  749    HA   LEU  99           HA       LEU  99   0.610  -1.103  -6.177
  750   1HB   LEU  99          HB2       LEU  99  -0.548  -1.554  -4.027
  751   2HB   LEU  99          HB1       LEU  99   0.639  -2.801  -3.659
  752    HG   LEU  99           HG       LEU  99   2.436  -1.079  -3.772
  753   1HD1  LEU  99          HD11      LEU  99   1.691   0.662  -5.136
  754   2HD1  LEU  99          HD12      LEU  99   1.429   1.360  -3.542
  755   3HD1  LEU  99          HD13      LEU  99   0.074   0.666  -4.432
  756   1HD2  LEU  99          HD21      LEU  99   1.512  -1.636  -1.597
  757   2HD2  LEU  99          HD22      LEU  99   0.132  -0.569  -1.864
  758   3HD2  LEU  99          HD23      LEU  99   1.746   0.111  -1.658
  759    H    LEU 100           HN       LEU 100   1.622  -4.438  -5.615
  760    HA   LEU 100           HA       LEU 100   4.401  -4.028  -5.273
  761   1HB   LEU 100          HB2       LEU 100   3.328  -6.185  -4.867
  762   2HB   LEU 100          HB1       LEU 100   2.933  -6.338  -6.573
  763    HG   LEU 100           HG       LEU 100   5.326  -6.411  -7.143
  764   1HD1  LEU 100          HD11      LEU 100   6.883  -6.758  -5.083
  765   2HD1  LEU 100          HD12      LEU 100   5.617  -5.929  -4.178
  766   3HD1  LEU 100          HD13      LEU 100   6.428  -5.113  -5.516
  767   1HD2  LEU 100          HD21      LEU 100   4.138  -8.509  -6.623
  768   2HD2  LEU 100          HD22      LEU 100   4.548  -8.322  -4.918
  769   3HD2  LEU 100          HD23      LEU 100   5.823  -8.599  -6.106
  770    H    LEU 101           HN       LEU 101   2.557  -4.446  -8.323
  771    HA   LEU 101           HA       LEU 101   4.838  -4.503 -10.028
  772   1HB   LEU 101          HB2       LEU 101   1.975  -3.668 -10.475
  773   2HB   LEU 101          HB1       LEU 101   3.160  -3.528 -11.767
  774    HG   LEU 101           HG       LEU 101   1.724  -5.686 -11.646
  775   1HD1  LEU 101          HD11      LEU 101   3.610  -7.074 -12.431
  776   2HD1  LEU 101          HD12      LEU 101   4.745  -5.877 -11.822
  777   3HD1  LEU 101          HD13      LEU 101   3.648  -5.460 -13.134
  778   1HD2  LEU 101          HD21      LEU 101   2.439  -7.425 -10.173
  779   2HD2  LEU 101          HD22      LEU 101   2.188  -6.004  -9.173
  780   3HD2  LEU 101          HD23      LEU 101   3.820  -6.490  -9.611
  781    H    HIS 102           HN       HIS 102   2.907  -1.677  -8.982
  782    HA   HIS 102           HA       HIS 102   4.551   0.174 -10.465
  783   1HB   HIS 102          HB2       HIS 102   2.531   0.479  -8.251
  784   2HB   HIS 102          HB1       HIS 102   3.494   1.863  -8.768
  785    HD1  HIS 102           HD1      HIS 102   3.007   2.882 -11.042
  786    HD2  HIS 102           HD2      HIS 102   0.758  -0.541 -10.290
  787    HE1  HIS 102           HE1      HIS 102   1.277   2.758 -12.878
  788    H    LEU 103           HN       LEU 103   4.713  -0.982  -7.096
  789    HA   LEU 103           HA       LEU 103   6.613   0.917  -6.184
  790   1HB   LEU 103          HB2       LEU 103   6.213  -1.975  -5.397
  791   2HB   LEU 103          HB1       LEU 103   7.317  -0.896  -4.555
  792    HG   LEU 103           HG       LEU 103   4.363  -0.315  -4.921
  793   1HD1  LEU 103          HD11      LEU 103   5.883  -1.718  -2.712
  794   2HD1  LEU 103          HD12      LEU 103   4.440  -2.269  -3.563
  795   3HD1  LEU 103          HD13      LEU 103   4.331  -0.934  -2.415
  796   1HD2  LEU 103          HD21      LEU 103   4.958   1.149  -2.830
  797   2HD2  LEU 103          HD22      LEU 103   5.415   1.739  -4.421
  798   3HD2  LEU 103          HD23      LEU 103   6.619   0.978  -3.385
  799    H    LYS 104           HN       LYS 104   7.294  -2.332  -7.600
  800    HA   LYS 104           HA       LYS 104  10.135  -1.902  -7.462
  801   1HB   LYS 104          HB2       LYS 104  10.348  -3.854  -8.935
  802   2HB   LYS 104          HB1       LYS 104   9.216  -4.164  -7.622
  803   1HG   LYS 104          HG2       LYS 104   7.324  -3.725  -9.121
  804   2HG   LYS 104          HG1       LYS 104   8.441  -3.356 -10.438
  805   1HD   LYS 104          HD2       LYS 104   9.322  -5.613 -10.413
  806   2HD   LYS 104          HD1       LYS 104   8.392  -6.008  -8.969
  807   1HE   LYS 104          HE2       LYS 104   6.405  -6.196 -10.138
  808   2HE   LYS 104          HE1       LYS 104   6.890  -5.031 -11.372
  809   1HZ   LYS 104          HZ1       LYS 104   8.618  -6.813 -11.981
  810   2HZ   LYS 104          HZ2       LYS 104   7.007  -7.040 -12.469
  811   3HZ   LYS 104          HZ3       LYS 104   7.614  -7.876 -11.122
  812    H    LYS 105           HN       LYS 105   7.752  -0.779  -9.707
  813    HA   LYS 105           HA       LYS 105   9.500  -0.459 -11.975
  814   1HB   LYS 105          HB2       LYS 105   6.808   0.528 -11.173
  815   2HB   LYS 105          HB1       LYS 105   7.658   1.538 -12.342
  816   1HG   LYS 105          HG2       LYS 105   7.914  -0.303 -13.859
  817   2HG   LYS 105          HG1       LYS 105   7.308  -1.446 -12.660
  818   1HD   LYS 105          HD2       LYS 105   5.100  -0.486 -12.740
  819   2HD   LYS 105          HD1       LYS 105   5.669   0.873 -13.710
  820   1HE   LYS 105          HE2       LYS 105   4.493  -0.869 -15.068
  821   2HE   LYS 105          HE1       LYS 105   6.160  -0.602 -15.581
  822   1HZ   LYS 105          HZ1       LYS 105   5.604  -2.964 -15.397
  823   2HZ   LYS 105          HZ2       LYS 105   5.269  -2.758 -13.744
  824   3HZ   LYS 105          HZ3       LYS 105   6.846  -2.523 -14.330
  825    H    LEU 106           HN       LEU 106   8.655   1.744  -9.282
  826    HA   LEU 106           HA       LEU 106  10.129   3.940 -10.327
  827   1HB   LEU 106          HB2       LEU 106   9.523   3.162  -7.456
  828   2HB   LEU 106          HB1       LEU 106  10.370   4.643  -7.873
  829    HG   LEU 106           HG       LEU 106   8.053   5.199  -7.549
  830   1HD1  LEU 106          HD11      LEU 106   7.620   6.386  -9.488
  831   2HD1  LEU 106          HD12      LEU 106   8.132   5.075 -10.548
  832   3HD1  LEU 106          HD13      LEU 106   9.336   6.040  -9.690
  833   1HD2  LEU 106          HD21      LEU 106   6.219   4.094  -8.635
  834   2HD2  LEU 106          HD22      LEU 106   7.225   2.851  -7.895
  835   3HD2  LEU 106          HD23      LEU 106   7.309   3.135  -9.634
  836    H    PHE 107           HN       PHE 107  11.107   1.098  -8.494
  837    HA   PHE 107           HA       PHE 107  13.775   1.903  -7.915
  838   1HB   PHE 107          HB2       PHE 107  12.670  -0.180  -7.021
  839   2HB   PHE 107          HB1       PHE 107  12.864  -0.903  -8.616
  840    HD1  PHE 107           HD1      PHE 107  14.807   0.831  -5.940
  841    HD2  PHE 107           HD2      PHE 107  14.881  -1.991  -9.172
  842    HE1  PHE 107           HE1      PHE 107  17.151   0.292  -5.402
  843    HE2  PHE 107           HE2      PHE 107  17.237  -2.548  -8.629
  844    HZ   PHE 107           HZ       PHE 107  18.375  -1.408  -6.743
  845    H    ARG 108           HN       ARG 108  12.387   0.285 -10.770
  846    HA   ARG 108           HA       ARG 108  14.830  -0.089 -12.195
  847   1HB   ARG 108          HB2       ARG 108  12.012   0.408 -13.205
  848   2HB   ARG 108          HB1       ARG 108  13.348  -0.106 -14.229
  849   1HG   ARG 108          HG2       ARG 108  12.592  -1.673 -11.762
  850   2HG   ARG 108          HG1       ARG 108  11.748  -1.927 -13.287
  851   1HD   ARG 108          HD2       ARG 108  14.013  -2.321 -14.365
  852   2HD   ARG 108          HD1       ARG 108  14.705  -2.317 -12.743
  853    HE   ARG 108           HE       ARG 108  12.642  -4.152 -12.575
  854   1HH1  ARG 108          HH21      ARG 108  15.383  -3.637 -14.607
  855   2HH1  ARG 108          HH22      ARG 108  15.607  -5.321 -14.949
  856   1HH2  ARG 108          HH11      ARG 108  12.920  -6.346 -13.011
  857   2HH2  ARG 108          HH12      ARG 108  14.213  -6.854 -14.046
  858    H    GLU 109           HN       GLU 109  12.566   2.638 -12.057
  859    HA   GLU 109           HA       GLU 109  14.194   4.206 -13.947
  860   1HB   GLU 109          HB2       GLU 109  11.783   4.931 -12.253
  861   2HB   GLU 109          HB1       GLU 109  12.529   6.000 -13.442
  862   1HG   GLU 109          HG2       GLU 109  11.486   3.237 -14.116
  863   2HG   GLU 109          HG1       GLU 109  10.526   4.705 -14.298
  864    H    GLY 110           HN       GLY 110  14.280   3.498 -10.636
  865   1HA   GLY 110          HA2       GLY 110  15.619   4.332  -8.909
  866   2HA   GLY 110          HA1       GLY 110  16.514   5.215 -10.146
  867    H    ARG 111           HN       ARG 111  13.157   5.874 -10.180
  868    HA   ARG 111           HA       ARG 111  13.676   8.552  -8.967
  869   1HB   ARG 111          HB2       ARG 111  11.419   7.492 -10.693
  870   2HB   ARG 111          HB1       ARG 111  11.417   9.099  -9.965
  871   1HG   ARG 111          HG2       ARG 111  13.574   9.579 -11.100
  872   2HG   ARG 111          HG1       ARG 111  13.492   8.009 -11.890
  873   1HD   ARG 111          HD2       ARG 111  11.362   8.642 -12.943
  874   2HD   ARG 111          HD1       ARG 111  11.414  10.214 -12.157
  875    HE   ARG 111           HE       ARG 111  12.718   9.464 -14.614
  876   1HH1  ARG 111          HH21      ARG 111  13.325  11.230 -11.702
  877   2HH1  ARG 111          HH22      ARG 111  14.668  12.094 -12.369
  878   1HH2  ARG 111          HH11      ARG 111  14.441  10.599 -15.481
  879   2HH2  ARG 111          HH12      ARG 111  15.293  11.745 -14.500
  880    H    PHE 112           HN       PHE 112  13.476   8.277  -6.781
  881    HA   PHE 112           HA       PHE 112  11.222   6.681  -5.705
  882   1HB   PHE 112          HB2       PHE 112  13.516   8.077  -4.293
  883   2HB   PHE 112          HB1       PHE 112  12.379   6.937  -3.567
  884    HD1  PHE 112           HD1      PHE 112  12.319   4.575  -4.310
  885    HD2  PHE 112           HD2      PHE 112  15.299   7.311  -5.735
  886    HE1  PHE 112           HE1      PHE 112  13.669   2.679  -5.136
  887    HE2  PHE 112           HE2      PHE 112  16.651   5.407  -6.571
  888    HZ   PHE 112           HZ       PHE 112  15.834   3.085  -6.268
  889    H    ASN 113           HN       ASN 113   9.429   7.583  -4.855
  890    HA   ASN 113           HA       ASN 113   7.876   9.214  -4.224
  891   1HB   ASN 113          HB2       ASN 113  10.267  10.880  -3.397
  892   2HB   ASN 113          HB1       ASN 113   8.643  10.896  -2.711
  893   1HD2  ASN 113          HD21      ASN 113  10.840  10.452  -0.999
  894   2HD2  ASN 113          HD22      ASN 113  10.823   8.840  -0.469
  Start of MODEL   25
    1   1H    MET   1           HT1      MET   1  23.672   6.134  14.258
    2   2H    MET   1           HT2      MET   1  24.000   7.255  13.024
    3   3H    MET   1           HT3      MET   1  25.073   5.970  13.316
    4    HA   MET   1           HA       MET   1  23.966   5.147  11.510
    5   1HB   MET   1          HB2       MET   1  22.192   4.403  13.857
    6   2HB   MET   1          HB1       MET   1  22.297   3.524  12.332
    7   1HG   MET   1          HG2       MET   1  24.642   4.002  14.189
    8   2HG   MET   1          HG1       MET   1  23.699   2.515  14.151
    9   1HE   MET   1          HE1       MET   1  23.301   1.121  12.351
   10   2HE   MET   1          HE2       MET   1  24.448   0.717  11.080
   11   3HE   MET   1          HE3       MET   1  23.247   1.974  10.803
   12    H    GLY   2           HN       GLY   2  23.131   6.891  10.261
   13   1HA   GLY   2          HA2       GLY   2  20.674   8.250  10.947
   14   2HA   GLY   2          HA1       GLY   2  21.467   8.301   9.371
   15    HA   PRO   3           HA       PRO   3  17.523   5.522   9.518
   16   1HB   PRO   3          HB2       PRO   3  16.412   7.196   7.428
   17   2HB   PRO   3          HB1       PRO   3  15.795   6.941   9.063
   18   1HG   PRO   3          HG2       PRO   3  17.158   9.276   7.996
   19   2HG   PRO   3          HG1       PRO   3  16.401   9.074   9.580
   20   1HD   PRO   3          HD2       PRO   3  19.201   9.228   9.046
   21   2HD   PRO   3          HD1       PRO   3  18.441   8.783  10.595
   22    H    VAL   4           HN       VAL   4  16.762   4.294   7.481
   23    HA   VAL   4           HA       VAL   4  19.102   3.718   5.841
   24    HB   VAL   4           HB       VAL   4  17.469   2.051   4.773
   25   1HG1  VAL   4          HG11      VAL   4  19.080   1.496   6.592
   26   2HG1  VAL   4          HG12      VAL   4  17.593   0.553   6.695
   27   3HG1  VAL   4          HG13      VAL   4  17.845   1.925   7.775
   28   1HG2  VAL   4          HG21      VAL   4  15.753   2.787   7.148
   29   2HG2  VAL   4          HG22      VAL   4  15.348   1.718   5.806
   30   3HG2  VAL   4          HG23      VAL   4  15.463   3.457   5.543
   31    HA   PRO   5           HA       PRO   5  17.998   6.425   2.488
   32   1HB   PRO   5          HB2       PRO   5  18.852   4.844   0.316
   33   2HB   PRO   5          HB1       PRO   5  19.868   5.936   1.268
   34   1HG   PRO   5          HG2       PRO   5  19.695   2.973   1.362
   35   2HG   PRO   5          HG1       PRO   5  21.043   4.033   1.795
   36   1HD   PRO   5          HD2       PRO   5  19.394   2.720   3.637
   37   2HD   PRO   5          HD1       PRO   5  20.386   4.155   4.001
   38    HA   PRO   6           HA       PRO   6  14.023   5.344   0.850
   39   1HB   PRO   6          HB2       PRO   6  14.407   6.185  -1.858
   40   2HB   PRO   6          HB1       PRO   6  13.702   7.119  -0.535
   41   1HG   PRO   6          HG2       PRO   6  16.354   7.374  -1.760
   42   2HG   PRO   6          HG1       PRO   6  15.516   8.496  -0.682
   43   1HD   PRO   6          HD2       PRO   6  17.736   6.884   0.012
   44   2HD   PRO   6          HD1       PRO   6  16.662   7.729   1.155
   45    H    SER   7           HN       SER   7  16.629   4.441  -1.426
   46    HA   SER   7           HA       SER   7  15.162   2.463  -2.848
   47   1HB   SER   7          HB2       SER   7  17.333   1.575  -3.530
   48   2HB   SER   7          HB1       SER   7  17.394   3.335  -3.548
   49    HG   SER   7           HG       SER   7  19.074   1.860  -2.364
   50    H    THR   8           HN       THR   8  17.033   2.267   0.150
   51    HA   THR   8           HA       THR   8  16.793  -0.590   0.450
   52    HB   THR   8           HB       THR   8  17.179   1.566   2.540
   53    HG1  THR   8           HG1      THR   8  18.711   1.059   0.633
   54   1HG2  THR   8          HG21      THR   8  17.450  -1.440   2.600
   55   2HG2  THR   8          HG22      THR   8  16.537  -0.405   3.697
   56   3HG2  THR   8          HG23      THR   8  18.299  -0.409   3.751
   57    H    ALA   9           HN       ALA   9  14.892   2.150   1.725
   58    HA   ALA   9           HA       ALA   9  13.068   0.568   3.255
   59   1HB   ALA   9          HB1       ALA   9  12.587   3.226   1.870
   60   2HB   ALA   9          HB2       ALA   9  13.256   3.024   3.489
   61   3HB   ALA   9          HB3       ALA   9  11.593   2.544   3.157
   62    H    LEU  10           HN       LEU  10  13.038   1.630  -0.127
   63    HA   LEU  10           HA       LEU  10  10.434   0.669  -0.786
   64   1HB   LEU  10          HB2       LEU  10  12.145   2.160  -2.119
   65   2HB   LEU  10          HB1       LEU  10  12.742   0.630  -2.729
   66    HG   LEU  10           HG       LEU  10  11.157   1.342  -4.338
   67   1HD1  LEU  10          HD11      LEU  10   9.445  -0.321  -4.306
   68   2HD1  LEU  10          HD12      LEU  10   9.546  -0.489  -2.559
   69   3HD1  LEU  10          HD13      LEU  10  10.881  -1.033  -3.576
   70   1HD2  LEU  10          HD21      LEU  10   8.996   1.734  -2.277
   71   2HD2  LEU  10          HD22      LEU  10   9.096   2.361  -3.921
   72   3HD2  LEU  10          HD23      LEU  10  10.117   3.041  -2.660
   73    H    ARG  11           HN       ARG  11  13.644  -0.857  -1.257
   74    HA   ARG  11           HA       ARG  11  12.692  -3.352  -2.231
   75   1HB   ARG  11          HB2       ARG  11  15.199  -2.631  -0.693
   76   2HB   ARG  11          HB1       ARG  11  14.916  -4.228  -1.386
   77   1HG   ARG  11          HG2       ARG  11  14.669  -3.214  -3.625
   78   2HG   ARG  11          HG1       ARG  11  14.959  -1.618  -2.930
   79   1HD   ARG  11          HD2       ARG  11  16.903  -3.945  -2.860
   80   2HD   ARG  11          HD1       ARG  11  17.029  -2.534  -3.912
   81    HE   ARG  11           HE       ARG  11  16.891  -1.452  -1.363
   82   1HH1  ARG  11          HH21      ARG  11  18.813  -3.807  -2.996
   83   2HH1  ARG  11          HH22      ARG  11  20.221  -3.520  -2.029
   84   1HH2  ARG  11          HH11      ARG  11  18.719  -1.066  -0.093
   85   2HH2  ARG  11          HH12      ARG  11  20.167  -1.970  -0.386
   86    H    GLU  12           HN       GLU  12  13.441  -2.338   1.109
   87    HA   GLU  12           HA       GLU  12  12.885  -4.844   2.342
   88   1HB   GLU  12          HB2       GLU  12  12.708  -2.012   3.392
   89   2HB   GLU  12          HB1       GLU  12  12.478  -3.435   4.410
   90   1HG   GLU  12          HG2       GLU  12  14.709  -4.252   3.834
   91   2HG   GLU  12          HG1       GLU  12  14.950  -2.895   2.737
   92    H    LEU  13           HN       LEU  13  10.747  -2.122   1.534
   93    HA   LEU  13           HA       LEU  13   8.428  -3.199   2.838
   94   1HB   LEU  13          HB2       LEU  13   8.595  -0.838   2.129
   95   2HB   LEU  13          HB1       LEU  13   8.638  -1.343   0.443
   96    HG   LEU  13           HG       LEU  13   6.378  -2.346   0.710
   97   1HD1  LEU  13          HD11      LEU  13   6.136  -2.900   2.978
   98   2HD1  LEU  13          HD12      LEU  13   5.137  -1.456   2.841
   99   3HD1  LEU  13          HD13      LEU  13   6.758  -1.343   3.526
  100   1HD2  LEU  13          HD21      LEU  13   5.167  -0.176   0.897
  101   2HD2  LEU  13          HD22      LEU  13   6.592  -0.064  -0.136
  102   3HD2  LEU  13          HD23      LEU  13   6.645   0.567   1.510
  103    H    ILE  14           HN       ILE  14   9.636  -3.454  -0.521
  104    HA   ILE  14           HA       ILE  14   7.469  -5.010  -1.532
  105    HB   ILE  14           HB       ILE  14  10.400  -4.933  -2.306
  106   1HG1  ILE  14          HG12      ILE  14   7.950  -3.831  -3.714
  107   2HG1  ILE  14          HG11      ILE  14   8.957  -2.877  -2.624
  108   1HG2  ILE  14          HG21      ILE  14   8.073  -6.447  -3.490
  109   2HG2  ILE  14          HG22      ILE  14   9.680  -7.048  -3.095
  110   3HG2  ILE  14          HG23      ILE  14   9.455  -5.983  -4.481
  111   1HD1  ILE  14          HD11      ILE  14   9.903  -4.265  -5.151
  112   2HD1  ILE  14          HD12      ILE  14  10.928  -3.345  -4.050
  113   3HD1  ILE  14          HD13      ILE  14   9.655  -2.532  -4.957
  114    H    GLU  15           HN       GLU  15  10.591  -6.043  -0.151
  115    HA   GLU  15           HA       GLU  15  10.147  -8.835  -0.340
  116   1HB   GLU  15          HB2       GLU  15  11.778  -7.190   1.606
  117   2HB   GLU  15          HB1       GLU  15  11.830  -8.953   1.554
  118   1HG   GLU  15          HG2       GLU  15  12.552  -8.898  -0.779
  119   2HG   GLU  15          HG1       GLU  15  12.414  -7.140  -0.806
  120    H    GLU  16           HN       GLU  16   9.275  -6.557   2.268
  121    HA   GLU  16           HA       GLU  16   8.292  -8.655   4.004
  122   1HB   GLU  16          HB2       GLU  16   8.985  -6.413   4.841
  123   2HB   GLU  16          HB1       GLU  16   7.582  -5.713   4.036
  124   1HG   GLU  16          HG2       GLU  16   6.077  -7.109   5.380
  125   2HG   GLU  16          HG1       GLU  16   7.462  -7.877   6.156
  126    H    LEU  17           HN       LEU  17   6.706  -6.432   1.691
  127    HA   LEU  17           HA       LEU  17   4.032  -7.230   2.263
  128   1HB   LEU  17          HB2       LEU  17   5.294  -6.259  -0.311
  129   2HB   LEU  17          HB1       LEU  17   3.565  -6.533  -0.135
  130    HG   LEU  17           HG       LEU  17   5.167  -4.683   1.659
  131   1HD1  LEU  17          HD11      LEU  17   4.135  -2.855   0.317
  132   2HD1  LEU  17          HD12      LEU  17   3.476  -4.064  -0.784
  133   3HD1  LEU  17          HD13      LEU  17   5.222  -3.857  -0.647
  134   1HD2  LEU  17          HD21      LEU  17   2.688  -3.764   1.893
  135   2HD2  LEU  17          HD22      LEU  17   3.195  -5.159   2.837
  136   3HD2  LEU  17          HD23      LEU  17   2.245  -5.388   1.370
  137    H    VAL  18           HN       VAL  18   6.359  -8.525  -0.103
  138    HA   VAL  18           HA       VAL  18   4.608 -10.527  -1.158
  139    HB   VAL  18           HB       VAL  18   7.630 -10.367  -1.007
  140   1HG1  VAL  18          HG11      VAL  18   7.465 -12.073  -2.914
  141   2HG1  VAL  18          HG12      VAL  18   5.808 -12.353  -2.377
  142   3HG1  VAL  18          HG13      VAL  18   7.155 -12.685  -1.289
  143   1HG2  VAL  18          HG21      VAL  18   5.786  -9.990  -3.375
  144   2HG2  VAL  18          HG22      VAL  18   7.493  -9.562  -3.254
  145   3HG2  VAL  18          HG23      VAL  18   6.289  -8.654  -2.340
  146    H    ASN  19           HN       ASN  19   6.937 -10.593   1.526
  147    HA   ASN  19           HA       ASN  19   6.830 -13.376   2.046
  148   1HB   ASN  19          HB2       ASN  19   7.333 -10.992   3.832
  149   2HB   ASN  19          HB1       ASN  19   7.448 -12.649   4.424
  150   1HD2  ASN  19          HD21      ASN  19   8.560 -13.825   1.999
  151   2HD2  ASN  19          HD22      ASN  19  10.135 -13.220   1.818
  152    H    ILE  20           HN       ILE  20   4.701 -10.768   3.225
  153    HA   ILE  20           HA       ILE  20   3.202 -12.612   4.911
  154    HB   ILE  20           HB       ILE  20   1.676 -10.690   5.259
  155   1HG1  ILE  20          HG12      ILE  20   3.555  -9.194   3.417
  156   2HG1  ILE  20          HG11      ILE  20   1.972  -9.773   2.919
  157   1HG2  ILE  20          HG21      ILE  20   4.651 -10.154   5.454
  158   2HG2  ILE  20          HG22      ILE  20   3.621 -10.885   6.685
  159   3HG2  ILE  20          HG23      ILE  20   3.420  -9.184   6.263
  160   1HD1  ILE  20          HD11      ILE  20   2.562  -7.790   5.127
  161   2HD1  ILE  20          HD12      ILE  20   0.968  -8.480   4.822
  162   3HD1  ILE  20          HD13      ILE  20   1.738  -7.465   3.603
  163    H    THR  21           HN       THR  21   3.038 -11.832   1.539
  164    HA   THR  21           HA       THR  21   0.180 -12.687   1.402
  165    HB   THR  21           HB       THR  21   0.366 -12.054  -1.005
  166    HG1  THR  21           HG1      THR  21   2.979 -11.398  -0.155
  167   1HG2  THR  21          HG21      THR  21   1.380  -9.770   0.670
  168   2HG2  THR  21          HG22      THR  21  -0.226 -10.442   0.942
  169   3HG2  THR  21          HG23      THR  21   0.186  -9.744  -0.623
  170    H    GLN  22           HN       GLN  22   3.367 -13.960   0.824
  171    HA   GLN  22           HA       GLN  22   2.487 -15.987  -1.070
  172   1HB   GLN  22          HB2       GLN  22   5.006 -15.684   0.570
  173   2HB   GLN  22          HB1       GLN  22   4.731 -17.041  -0.522
  174   1HG   GLN  22          HG2       GLN  22   4.444 -15.496  -2.406
  175   2HG   GLN  22          HG1       GLN  22   4.663 -14.119  -1.331
  176   1HE2  GLN  22          HE21      GLN  22   6.373 -15.140  -3.658
  177   2HE2  GLN  22          HE22      GLN  22   7.929 -15.298  -2.998
  178    H    ASN  23           HN       ASN  23   3.048 -15.948   2.444
  179    HA   ASN  23           HA       ASN  23   2.197 -18.793   2.608
  180   1HB   ASN  23          HB2       ASN  23   3.362 -16.871   4.629
  181   2HB   ASN  23          HB1       ASN  23   2.792 -18.485   5.053
  182   1HD2  ASN  23          HD21      ASN  23   5.574 -17.691   5.273
  183   2HD2  ASN  23          HD22      ASN  23   6.462 -18.621   4.165
  184    H    GLN  24           HN       GLN  24   0.449 -16.086   2.329
  185    HA   GLN  24           HA       GLN  24  -1.275 -16.400   4.686
  186   1HB   GLN  24          HB2       GLN  24  -2.535 -14.572   3.845
  187   2HB   GLN  24          HB1       GLN  24  -0.874 -14.204   3.405
  188   1HG   GLN  24          HG2       GLN  24  -1.331 -15.208   1.134
  189   2HG   GLN  24          HG1       GLN  24  -3.028 -15.332   1.593
  190   1HE2  GLN  24          HE21      GLN  24  -3.094 -13.771  -0.418
  191   2HE2  GLN  24          HE22      GLN  24  -3.004 -12.114  -0.063
  192    H    LYS  25           HN       LYS  25  -3.059 -17.697   4.817
  193    HA   LYS  25           HA       LYS  25  -3.720 -19.392   2.489
  194   1HB   LYS  25          HB2       LYS  25  -3.657 -20.394   4.759
  195   2HB   LYS  25          HB1       LYS  25  -4.929 -19.289   5.279
  196   1HG   LYS  25          HG2       LYS  25  -6.455 -20.245   3.584
  197   2HG   LYS  25          HG1       LYS  25  -5.182 -21.349   3.065
  198   1HD   LYS  25          HD2       LYS  25  -5.129 -22.349   5.318
  199   2HD   LYS  25          HD1       LYS  25  -6.396 -21.239   5.841
  200   1HE   LYS  25          HE2       LYS  25  -7.481 -23.309   5.270
  201   2HE   LYS  25          HE1       LYS  25  -7.840 -22.166   3.977
  202   1HZ   LYS  25          HZ1       LYS  25  -5.759 -23.143   2.883
  203   2HZ   LYS  25          HZ2       LYS  25  -7.188 -24.060   2.854
  204   3HZ   LYS  25          HZ3       LYS  25  -5.957 -24.434   3.964
  205    H    ALA  26           HN       ALA  26  -5.928 -17.820   4.783
  206    HA   ALA  26           HA       ALA  26  -7.718 -17.088   2.568
  207   1HB   ALA  26          HB1       ALA  26  -9.259 -17.353   4.232
  208   2HB   ALA  26          HB2       ALA  26  -8.602 -15.933   5.046
  209   3HB   ALA  26          HB3       ALA  26  -7.965 -17.534   5.414
  210    HA   PRO  27           HA       PRO  27  -6.501 -12.901   1.827
  211   1HB   PRO  27          HB2       PRO  27  -8.940 -11.827   3.143
  212   2HB   PRO  27          HB1       PRO  27  -8.387 -11.631   1.475
  213   1HG   PRO  27          HG2       PRO  27 -10.478 -13.303   2.301
  214   2HG   PRO  27          HG1       PRO  27  -9.644 -13.400   0.745
  215   1HD   PRO  27          HD2       PRO  27  -9.546 -15.302   2.954
  216   2HD   PRO  27          HD1       PRO  27  -8.793 -15.441   1.345
  217    H    LEU  28           HN       LEU  28  -5.890 -10.831   3.017
  218    HA   LEU  28           HA       LEU  28  -4.770 -11.431   5.610
  219   1HB   LEU  28          HB2       LEU  28  -5.172  -8.740   4.265
  220   2HB   LEU  28          HB1       LEU  28  -4.139  -9.041   5.659
  221    HG   LEU  28           HG       LEU  28  -3.797 -10.300   2.919
  222   1HD1  LEU  28          HD11      LEU  28  -3.297  -7.823   3.131
  223   2HD1  LEU  28          HD12      LEU  28  -1.917  -8.814   2.657
  224   3HD1  LEU  28          HD13      LEU  28  -2.064  -8.245   4.320
  225   1HD2  LEU  28          HD21      LEU  28  -2.849 -11.857   4.403
  226   2HD2  LEU  28          HD22      LEU  28  -2.381 -10.617   5.567
  227   3HD2  LEU  28          HD23      LEU  28  -1.474 -10.809   4.068
  228    H    CYS  29           HN       CYS  29  -7.892 -10.606   4.665
  229    HA   CYS  29           HA       CYS  29  -8.627 -10.015   7.485
  230   1HB   CYS  29          HB2       CYS  29  -9.366  -8.268   5.115
  231   2HB   CYS  29          HB1       CYS  29 -10.083  -8.128   6.720
  232    H    ASN  30           HN       ASN  30 -11.232  -9.796   7.428
  233    HA   ASN  30           HA       ASN  30 -12.194 -12.358   6.538
  234   1HB   ASN  30          HB2       ASN  30 -13.639  -9.881   7.514
  235   2HB   ASN  30          HB1       ASN  30 -14.454 -11.406   7.163
  236   1HD2  ASN  30          HD21      ASN  30 -12.761 -13.320   8.192
  237   2HD2  ASN  30          HD22      ASN  30 -12.523 -13.083   9.856
  238    H    GLY  31           HN       GLY  31 -11.083 -11.127   4.298
  239   1HA   GLY  31          HA2       GLY  31 -11.640 -10.903   2.020
  240   2HA   GLY  31          HA1       GLY  31 -13.320 -11.235   2.448
  241    H    SER  32           HN       SER  32 -11.545  -8.705   4.076
  242    HA   SER  32           HA       SER  32 -13.509  -6.722   3.518
  243   1HB   SER  32          HB2       SER  32 -10.594  -6.394   4.290
  244   2HB   SER  32          HB1       SER  32 -11.791  -5.101   4.320
  245    HG   SER  32           HG       SER  32 -11.459  -6.237   6.353
  246    H    MET  33           HN       MET  33 -13.673  -5.196   1.892
  247    HA   MET  33           HA       MET  33 -11.780  -5.487  -0.417
  248   1HB   MET  33          HB2       MET  33 -14.642  -4.486  -0.305
  249   2HB   MET  33          HB1       MET  33 -13.641  -4.518  -1.758
  250   1HG   MET  33          HG2       MET  33 -13.391  -6.969  -1.530
  251   2HG   MET  33          HG1       MET  33 -14.396  -6.931  -0.084
  252   1HE   MET  33          HE1       MET  33 -15.537  -6.373  -4.449
  253   2HE   MET  33          HE2       MET  33 -13.947  -6.335  -3.693
  254   3HE   MET  33          HE3       MET  33 -14.972  -4.906  -3.642
  255    H    VAL  34           HN       VAL  34 -11.077  -3.534  -1.475
  256    HA   VAL  34           HA       VAL  34 -11.386  -1.022   0.141
  257    HB   VAL  34           HB       VAL  34  -8.974  -0.555  -0.488
  258   1HG1  VAL  34          HG11      VAL  34  -9.484  -3.009   1.218
  259   2HG1  VAL  34          HG12      VAL  34  -9.694  -1.345   1.759
  260   3HG1  VAL  34          HG13      VAL  34  -8.088  -1.936   1.329
  261   1HG2  VAL  34          HG21      VAL  34  -7.594  -2.364  -1.234
  262   2HG2  VAL  34          HG22      VAL  34  -8.996  -2.352  -2.303
  263   3HG2  VAL  34          HG23      VAL  34  -8.889  -3.538  -1.002
  264    H    TRP  35           HN       TRP  35 -10.948   0.948  -1.130
  265    HA   TRP  35           HA       TRP  35 -12.233   0.838  -3.725
  266   1HB   TRP  35          HB2       TRP  35 -10.795   3.051  -2.247
  267   2HB   TRP  35          HB1       TRP  35 -11.589   3.284  -3.802
  268    HD1  TRP  35           HD1      TRP  35 -12.305   2.680  -0.120
  269    HE1  TRP  35           HE1      TRP  35 -14.808   3.094   0.321
  270    HE3  TRP  35           HE3      TRP  35 -13.967   3.194  -4.917
  271    HZ2  TRP  35           HZ2      TRP  35 -17.208   3.572  -1.168
  272    HZ3  TRP  35           HZ3      TRP  35 -16.365   3.622  -5.378
  273    HH2  TRP  35           HH2      TRP  35 -17.985   3.813  -3.513
  274    H    SER  36           HN       SER  36 -11.264   0.582  -5.698
  275    HA   SER  36           HA       SER  36  -8.406   0.127  -5.879
  276   1HB   SER  36          HB2       SER  36  -8.788  -0.226  -8.226
  277   2HB   SER  36          HB1       SER  36 -10.184  -0.899  -7.391
  278    HG   SER  36           HG       SER  36 -10.333   0.749  -9.294
  279    H    ILE  37           HN       ILE  37  -6.864   1.511  -6.950
  280    HA   ILE  37           HA       ILE  37  -7.743   4.348  -7.374
  281    HB   ILE  37           HB       ILE  37  -5.562   5.043  -6.325
  282   1HG1  ILE  37          HG12      ILE  37  -5.507   2.256  -5.144
  283   2HG1  ILE  37          HG11      ILE  37  -4.594   2.655  -6.597
  284   1HG2  ILE  37          HG21      ILE  37  -6.355   4.701  -3.998
  285   2HG2  ILE  37          HG22      ILE  37  -7.498   3.490  -4.579
  286   3HG2  ILE  37          HG23      ILE  37  -7.670   5.174  -5.073
  287   1HD1  ILE  37          HD11      ILE  37  -3.319   4.332  -5.441
  288   2HD1  ILE  37          HD12      ILE  37  -3.297   2.886  -4.432
  289   3HD1  ILE  37          HD13      ILE  37  -4.363   4.230  -4.023
  290    H    ASN  38           HN       ASN  38  -6.106   5.582  -8.668
  291    HA   ASN  38           HA       ASN  38  -5.114   3.888 -10.877
  292   1HB   ASN  38          HB2       ASN  38  -6.294   6.076 -11.297
  293   2HB   ASN  38          HB1       ASN  38  -4.939   6.902 -10.529
  294   1HD2  ASN  38          HD21      ASN  38  -4.574   4.018 -12.595
  295   2HD2  ASN  38          HD22      ASN  38  -3.744   4.816 -13.842
  296    H    LEU  39           HN       LEU  39  -3.063   3.100 -10.776
  297    HA   LEU  39           HA       LEU  39  -1.226   4.074  -8.728
  298   1HB   LEU  39          HB2       LEU  39  -0.919   2.002 -10.920
  299   2HB   LEU  39          HB1       LEU  39   0.333   2.362  -9.736
  300    HG   LEU  39           HG       LEU  39  -1.012   0.390  -9.077
  301   1HD1  LEU  39          HD11      LEU  39  -0.094   2.215  -7.411
  302   2HD1  LEU  39          HD12      LEU  39  -1.142   0.928  -6.827
  303   3HD1  LEU  39          HD13      LEU  39  -1.806   2.532  -7.124
  304   1HD2  LEU  39          HD21      LEU  39  -3.325   0.439  -8.739
  305   2HD2  LEU  39          HD22      LEU  39  -3.142   1.431 -10.183
  306   3HD2  LEU  39          HD23      LEU  39  -3.375   2.195  -8.609
  307    H    THR  40           HN       THR  40  -0.175   5.943  -9.060
  308    HA   THR  40           HA       THR  40   1.209   6.369 -11.669
  309    HB   THR  40           HB       THR  40   0.587   8.834 -11.428
  310    HG1  THR  40           HG1      THR  40  -0.325   8.066  -9.176
  311   1HG2  THR  40          HG21      THR  40  -1.575   6.775 -11.941
  312   2HG2  THR  40          HG22      THR  40  -0.469   7.465 -13.129
  313   3HG2  THR  40          HG23      THR  40  -1.704   8.478 -12.381
  314    H    ALA  41           HN       ALA  41   1.321   9.113  -9.762
  315    HA   ALA  41           HA       ALA  41   4.060   8.438  -8.873
  316   1HB   ALA  41          HB1       ALA  41   2.507  11.037  -8.734
  317   2HB   ALA  41          HB2       ALA  41   3.662  10.590  -9.989
  318   3HB   ALA  41          HB3       ALA  41   4.213  10.842  -8.333
  319    H    GLY  42           HN       GLY  42   1.694  10.455  -7.144
  320   1HA   GLY  42          HA2       GLY  42   2.622   9.623  -4.568
  321   2HA   GLY  42          HA1       GLY  42   1.130  10.509  -4.869
  322    H    MET  43           HN       MET  43   2.205   7.217  -5.776
  323    HA   MET  43           HA       MET  43  -0.378   6.047  -5.411
  324   1HB   MET  43          HB2       MET  43   2.353   4.740  -5.273
  325   2HB   MET  43          HB1       MET  43   0.824   3.890  -5.479
  326   1HG   MET  43          HG2       MET  43   0.429   5.223  -7.560
  327   2HG   MET  43          HG1       MET  43   2.043   5.904  -7.386
  328   1HE   MET  43          HE1       MET  43   3.996   4.627  -6.925
  329   2HE   MET  43          HE2       MET  43   4.482   3.200  -7.832
  330   3HE   MET  43          HE3       MET  43   3.683   3.012  -6.274
  331    H    TYR  44           HN       TYR  44   2.411   6.368  -3.247
  332    HA   TYR  44           HA       TYR  44   1.516   4.700  -1.141
  333   1HB   TYR  44          HB2       TYR  44   3.213   7.208  -1.070
  334   2HB   TYR  44          HB1       TYR  44   3.029   6.095   0.287
  335    HD1  TYR  44           HD1      TYR  44   4.021   3.870   0.243
  336    HD2  TYR  44           HD2      TYR  44   4.375   6.519  -3.119
  337    HE1  TYR  44           HE1      TYR  44   5.749   2.391  -0.738
  338    HE2  TYR  44           HE2      TYR  44   6.110   5.043  -4.097
  339    HH   TYR  44           HH       TYR  44   7.034   2.967  -3.970
  340    H    CYS  45           HN       CYS  45   0.993   8.238  -1.546
  341    HA   CYS  45           HA       CYS  45  -0.534   8.478   0.876
  342   1HB   CYS  45          HB2       CYS  45  -0.457  10.173  -1.630
  343   2HB   CYS  45          HB1       CYS  45  -1.399  10.603  -0.203
  344    H    ALA  46           HN       ALA  46  -1.570   8.148  -2.533
  345    HA   ALA  46           HA       ALA  46  -4.365   8.054  -1.996
  346   1HB   ALA  46          HB1       ALA  46  -2.914   6.548  -4.189
  347   2HB   ALA  46          HB2       ALA  46  -3.280   8.271  -4.271
  348   3HB   ALA  46          HB3       ALA  46  -4.591   7.094  -4.202
  349    H    ALA  47           HN       ALA  47  -1.938   5.468  -2.218
  350    HA   ALA  47           HA       ALA  47  -3.722   3.287  -1.761
  351   1HB   ALA  47          HB1       ALA  47  -1.543   2.754  -2.561
  352   2HB   ALA  47          HB2       ALA  47  -1.571   2.153  -0.903
  353   3HB   ALA  47          HB3       ALA  47  -0.763   3.674  -1.275
  354    H    LEU  48           HN       LEU  48  -1.884   5.353   0.470
  355    HA   LEU  48           HA       LEU  48  -2.425   3.908   2.841
  356   1HB   LEU  48          HB2       LEU  48  -0.761   5.709   2.716
  357   2HB   LEU  48          HB1       LEU  48  -2.043   6.893   2.477
  358    HG   LEU  48           HG       LEU  48  -2.971   6.346   4.703
  359   1HD1  LEU  48          HD11      LEU  48  -2.449   4.104   5.153
  360   2HD1  LEU  48          HD12      LEU  48  -1.287   4.943   6.176
  361   3HD1  LEU  48          HD13      LEU  48  -0.775   4.280   4.625
  362   1HD2  LEU  48          HD21      LEU  48  -1.198   8.098   4.414
  363   2HD2  LEU  48          HD22      LEU  48   0.014   6.885   4.825
  364   3HD2  LEU  48          HD23      LEU  48  -1.192   7.365   6.018
  365    H    GLU  49           HN       GLU  49  -4.281   6.690   1.479
  366    HA   GLU  49           HA       GLU  49  -6.252   6.698   3.535
  367   1HB   GLU  49          HB2       GLU  49  -7.745   7.800   1.805
  368   2HB   GLU  49          HB1       GLU  49  -6.186   8.585   2.065
  369   1HG   GLU  49          HG2       GLU  49  -5.272   7.501   0.087
  370   2HG   GLU  49          HG1       GLU  49  -6.777   6.610  -0.157
  371    H    SER  50           HN       SER  50  -6.070   4.787   0.544
  372    HA   SER  50           HA       SER  50  -8.713   3.703   0.701
  373   1HB   SER  50          HB2       SER  50  -7.958   2.031  -0.830
  374   2HB   SER  50          HB1       SER  50  -7.036   3.477  -1.230
  375    HG   SER  50           HG       SER  50  -5.274   2.527  -0.561
  376    H    LEU  51           HN       LEU  51  -5.644   2.750   2.179
  377    HA   LEU  51           HA       LEU  51  -6.629   0.332   3.401
  378   1HB   LEU  51          HB2       LEU  51  -4.300   2.140   4.104
  379   2HB   LEU  51          HB1       LEU  51  -4.599   0.582   4.869
  380    HG   LEU  51           HG       LEU  51  -4.264   0.956   1.877
  381   1HD1  LEU  51          HD11      LEU  51  -2.207   1.566   3.128
  382   2HD1  LEU  51          HD12      LEU  51  -1.991   0.099   2.173
  383   3HD1  LEU  51          HD13      LEU  51  -2.237  -0.012   3.916
  384   1HD2  LEU  51          HD21      LEU  51  -5.344  -1.099   2.108
  385   2HD2  LEU  51          HD22      LEU  51  -4.658  -1.411   3.702
  386   3HD2  LEU  51          HD23      LEU  51  -3.667  -1.614   2.259
  387    H    ILE  52           HN       ILE  52  -6.399   3.706   4.484
  388    HA   ILE  52           HA       ILE  52  -7.085   3.370   7.194
  389    HB   ILE  52           HB       ILE  52  -7.832   5.584   5.259
  390   1HG1  ILE  52          HG12      ILE  52  -5.422   5.340   5.582
  391   2HG1  ILE  52          HG11      ILE  52  -5.978   6.799   6.381
  392   1HG2  ILE  52          HG21      ILE  52  -8.143   5.410   8.256
  393   2HG2  ILE  52          HG22      ILE  52  -9.377   5.777   7.052
  394   3HG2  ILE  52          HG23      ILE  52  -8.101   6.947   7.391
  395   1HD1  ILE  52          HD11      ILE  52  -4.944   4.260   7.562
  396   2HD1  ILE  52          HD12      ILE  52  -6.187   5.121   8.468
  397   3HD1  ILE  52          HD13      ILE  52  -4.672   5.924   8.068
  398    H    ASN  53           HN       ASN  53  -8.975   2.691   4.423
  399    HA   ASN  53           HA       ASN  53 -11.559   3.003   5.805
  400   1HB   ASN  53          HB2       ASN  53 -10.793   1.856   3.104
  401   2HB   ASN  53          HB1       ASN  53 -12.452   1.928   3.701
  402   1HD2  ASN  53          HD21      ASN  53 -10.316   3.608   1.780
  403   2HD2  ASN  53          HD22      ASN  53 -10.953   5.172   1.955
  404    H    VAL  54           HN       VAL  54  -9.087   0.670   5.623
  405    HA   VAL  54           HA       VAL  54 -10.887  -1.628   6.151
  406    HB   VAL  54           HB       VAL  54  -7.858  -1.468   6.018
  407   1HG1  VAL  54          HG11      VAL  54  -8.077  -3.968   5.789
  408   2HG1  VAL  54          HG12      VAL  54  -9.784  -3.803   6.200
  409   3HG1  VAL  54          HG13      VAL  54  -8.547  -3.354   7.374
  410   1HG2  VAL  54          HG21      VAL  54  -8.689  -1.030   3.835
  411   2HG2  VAL  54          HG22      VAL  54 -10.003  -2.194   4.012
  412   3HG2  VAL  54          HG23      VAL  54  -8.341  -2.759   3.836
  413    H    SER  55           HN       SER  55 -11.392  -2.234   8.200
  414    HA   SER  55           HA       SER  55  -9.628  -1.331  10.458
  415   1HB   SER  55          HB2       SER  55 -12.657  -1.321  10.325
  416   2HB   SER  55          HB1       SER  55 -11.727  -1.052  11.797
  417    HG   SER  55           HG       SER  55 -11.130   0.441   9.499
  418    H    GLY  56           HN       GLY  56  -9.516  -2.794  12.229
  419   1HA   GLY  56          HA2       GLY  56  -9.895  -4.839  13.382
  420   2HA   GLY  56          HA1       GLY  56 -11.040  -5.308  12.126
  421    H    CYS  57           HN       CYS  57  -7.740  -4.217  11.472
  422    HA   CYS  57           HA       CYS  57  -6.886  -7.019  10.940
  423   1HB   CYS  57          HB2       CYS  57  -6.988  -4.798   8.882
  424   2HB   CYS  57          HB1       CYS  57  -5.987  -6.238   8.688
  425    H    SER  58           HN       SER  58  -5.391  -6.768  12.644
  426    HA   SER  58           HA       SER  58  -3.584  -4.530  12.853
  427   1HB   SER  58          HB2       SER  58  -4.150  -6.016  14.762
  428   2HB   SER  58          HB1       SER  58  -3.288  -7.331  13.968
  429    HG   SER  58           HG       SER  58  -2.154  -5.895  15.591
  430    H    ALA  59           HN       ALA  59  -3.554  -7.499  11.053
  431    HA   ALA  59           HA       ALA  59  -0.801  -7.859  10.591
  432   1HB   ALA  59          HB1       ALA  59  -2.257  -9.552   9.814
  433   2HB   ALA  59          HB2       ALA  59  -1.608  -8.826   8.343
  434   3HB   ALA  59          HB3       ALA  59  -3.232  -8.408   8.892
  435    H    ILE  60           HN       ILE  60  -3.030  -5.559   9.028
  436    HA   ILE  60           HA       ILE  60  -0.833  -4.696   7.207
  437    HB   ILE  60           HB       ILE  60  -2.570  -3.408   6.053
  438   1HG1  ILE  60          HG12      ILE  60  -4.430  -4.512   8.188
  439   2HG1  ILE  60          HG11      ILE  60  -3.937  -2.825   8.046
  440   1HG2  ILE  60          HG21      ILE  60  -2.203  -5.933   5.712
  441   2HG2  ILE  60          HG22      ILE  60  -3.724  -5.263   5.123
  442   3HG2  ILE  60          HG23      ILE  60  -3.684  -6.155   6.644
  443   1HD1  ILE  60          HD11      ILE  60  -5.529  -4.423   6.026
  444   2HD1  ILE  60          HD12      ILE  60  -4.896  -2.804   5.726
  445   3HD1  ILE  60          HD13      ILE  60  -6.100  -3.060   6.989
  446    H    GLU  61           HN       GLU  61  -1.966  -3.797  10.274
  447    HA   GLU  61           HA       GLU  61  -1.905  -0.950  10.054
  448   1HB   GLU  61          HB2       GLU  61  -1.259  -2.800  12.358
  449   2HB   GLU  61          HB1       GLU  61  -1.209  -1.043  12.514
  450   1HG   GLU  61          HG2       GLU  61  -3.549  -0.876  11.838
  451   2HG   GLU  61          HG1       GLU  61  -3.622  -2.615  11.563
  452    H    LYS  62           HN       LYS  62   0.701  -3.328  10.553
  453    HA   LYS  62           HA       LYS  62   2.798  -1.399  10.884
  454   1HB   LYS  62          HB2       LYS  62   2.848  -4.223   9.774
  455   2HB   LYS  62          HB1       LYS  62   4.299  -3.258  10.045
  456   1HG   LYS  62          HG2       LYS  62   3.718  -3.044  12.432
  457   2HG   LYS  62          HG1       LYS  62   2.267  -4.010  12.164
  458   1HD   LYS  62          HD2       LYS  62   3.658  -5.907  11.424
  459   2HD   LYS  62          HD1       LYS  62   5.113  -4.948  11.693
  460   1HE   LYS  62          HE2       LYS  62   4.359  -4.676  14.101
  461   2HE   LYS  62          HE1       LYS  62   3.114  -5.880  13.767
  462   1HZ   LYS  62          HZ1       LYS  62   4.755  -7.255  14.450
  463   2HZ   LYS  62          HZ2       LYS  62   6.004  -6.201  13.988
  464   3HZ   LYS  62          HZ3       LYS  62   5.216  -7.152  12.822
  465    H    THR  63           HN       THR  63   1.335  -2.931   8.050
  466    HA   THR  63           HA       THR  63   3.097  -1.887   6.079
  467    HB   THR  63           HB       THR  63   0.134  -2.495   5.860
  468    HG1  THR  63           HG1      THR  63   1.899  -4.246   4.785
  469   1HG2  THR  63          HG21      THR  63   0.955  -2.972   3.415
  470   2HG2  THR  63          HG22      THR  63   2.268  -1.872   3.835
  471   3HG2  THR  63          HG23      THR  63   0.596  -1.318   3.902
  472    H    GLN  64           HN       GLN  64   0.183  -0.484   7.568
  473    HA   GLN  64           HA       GLN  64   0.019   1.817   5.896
  474   1HB   GLN  64          HB2       GLN  64  -0.754   1.402   8.795
  475   2HB   GLN  64          HB1       GLN  64  -1.130   2.870   7.892
  476   1HG   GLN  64          HG2       GLN  64  -2.432   1.610   6.275
  477   2HG   GLN  64          HG1       GLN  64  -1.952   0.085   7.023
  478   1HE2  GLN  64          HE21      GLN  64  -4.721   0.891   6.788
  479   2HE2  GLN  64          HE22      GLN  64  -5.323   1.138   8.356
  480    H    ARG  65           HN       ARG  65   1.864   1.239   8.891
  481    HA   ARG  65           HA       ARG  65   2.874   3.895   9.165
  482   1HB   ARG  65          HB2       ARG  65   3.015   2.153  10.937
  483   2HB   ARG  65          HB1       ARG  65   4.225   1.305   9.974
  484   1HG   ARG  65          HG2       ARG  65   5.686   3.292  10.065
  485   2HG   ARG  65          HG1       ARG  65   4.483   4.135  11.036
  486   1HD   ARG  65          HD2       ARG  65   4.657   2.326  12.741
  487   2HD   ARG  65          HD1       ARG  65   5.949   1.586  11.806
  488    HE   ARG  65           HE       ARG  65   6.178   3.790  13.657
  489   1HH1  ARG  65          HH21      ARG  65   7.310   2.763  10.558
  490   2HH1  ARG  65          HH22      ARG  65   8.655   3.853  10.557
  491   1HH2  ARG  65          HH11      ARG  65   7.928   5.186  13.670
  492   2HH2  ARG  65          HH12      ARG  65   9.007   5.217  12.315
  493    H    MET  66           HN       MET  66   4.328   1.027   7.575
  494    HA   MET  66           HA       MET  66   6.684   2.357   6.682
  495   1HB   MET  66          HB2       MET  66   5.142   0.028   5.511
  496   2HB   MET  66          HB1       MET  66   6.707   0.557   4.897
  497   1HG   MET  66          HG2       MET  66   7.616   0.277   7.245
  498   2HG   MET  66          HG1       MET  66   6.083  -0.479   7.676
  499   1HE   MET  66          HE1       MET  66   5.181  -2.517   6.934
  500   2HE   MET  66          HE2       MET  66   5.896  -3.731   5.878
  501   3HE   MET  66          HE3       MET  66   5.230  -2.260   5.185
  502    H    LEU  67           HN       LEU  67   3.471   2.016   5.214
  503    HA   LEU  67           HA       LEU  67   4.089   3.348   2.745
  504   1HB   LEU  67          HB2       LEU  67   1.494   3.022   4.273
  505   2HB   LEU  67          HB1       LEU  67   1.585   3.747   2.672
  506    HG   LEU  67           HG       LEU  67   2.622   0.967   3.301
  507   1HD1  LEU  67          HD11      LEU  67   0.514   0.210   2.152
  508   2HD1  LEU  67          HD12      LEU  67  -0.062   1.874   2.225
  509   3HD1  LEU  67          HD13      LEU  67   0.234   0.980   3.715
  510   1HD2  LEU  67          HD21      LEU  67   2.174   2.567   0.773
  511   2HD2  LEU  67          HD22      LEU  67   2.195   0.807   0.731
  512   3HD2  LEU  67          HD23      LEU  67   3.619   1.687   1.269
  513    H    SER  68           HN       SER  68   2.930   4.489   5.888
  514    HA   SER  68           HA       SER  68   2.413   7.185   5.179
  515   1HB   SER  68          HB2       SER  68   3.383   5.966   7.778
  516   2HB   SER  68          HB1       SER  68   2.913   7.656   7.619
  517    HG   SER  68           HG       SER  68   0.855   7.026   7.127
  518    H    GLY  69           HN       GLY  69   5.428   5.561   6.115
  519   1HA   GLY  69          HA2       GLY  69   7.128   7.765   6.411
  520   2HA   GLY  69          HA1       GLY  69   7.651   6.228   5.720
  521    H    PHE  70           HN       PHE  70   5.721   6.448   3.462
  522    HA   PHE  70           HA       PHE  70   7.356   8.267   1.766
  523   1HB   PHE  70          HB2       PHE  70   5.242   6.201   1.081
  524   2HB   PHE  70          HB1       PHE  70   6.100   7.177  -0.109
  525    HD1  PHE  70           HD1      PHE  70   8.480   6.827  -0.555
  526    HD2  PHE  70           HD2      PHE  70   6.374   4.424   2.314
  527    HE1  PHE  70           HE1      PHE  70  10.342   5.195  -0.561
  528    HE2  PHE  70           HE2      PHE  70   8.240   2.790   2.315
  529    HZ   PHE  70           HZ       PHE  70  10.226   3.171   0.873
  530    H    CYS  71           HN       CYS  71   4.616   8.481   3.610
  531    HA   CYS  71           HA       CYS  71   3.492  10.681   1.911
  532   1HB   CYS  71          HB2       CYS  71   2.153   8.523   1.804
  533   2HB   CYS  71          HB1       CYS  71   1.824   8.741   3.523
  534    HA   PRO  72           HA       PRO  72   4.632  12.058   6.244
  535   1HB   PRO  72          HB2       PRO  72   4.654  14.702   4.910
  536   2HB   PRO  72          HB1       PRO  72   5.913  13.921   5.875
  537   1HG   PRO  72          HG2       PRO  72   6.044  14.218   3.140
  538   2HG   PRO  72          HG1       PRO  72   6.897  12.952   4.036
  539   1HD   PRO  72          HD2       PRO  72   4.521  12.713   2.272
  540   2HD   PRO  72          HD1       PRO  72   5.686  11.457   2.767
  541    H    HIS  73           HN       HIS  73   2.052  13.092   4.073
  542    HA   HIS  73           HA       HIS  73   0.712  14.587   6.254
  543   1HB   HIS  73          HB2       HIS  73  -0.853  15.317   4.638
  544   2HB   HIS  73          HB1       HIS  73   0.682  15.288   3.778
  545    HD1  HIS  73           HD1      HIS  73  -2.603  13.480   4.046
  546    HD2  HIS  73           HD2      HIS  73   0.858  13.324   1.731
  547    HE1  HIS  73           HE1      HIS  73  -3.118  11.964   2.082
  548    H    LYS  74           HN       LYS  74  -0.542  13.577   7.680
  549    HA   LYS  74           HA       LYS  74  -1.276  10.779   7.357
  550   1HB   LYS  74          HB2       LYS  74  -2.041  12.807   9.478
  551   2HB   LYS  74          HB1       LYS  74  -2.322  11.072   9.587
  552   1HG   LYS  74          HG2       LYS  74   0.450  12.183   9.127
  553   2HG   LYS  74          HG1       LYS  74  -0.212  12.029  10.753
  554   1HD   LYS  74          HD2       LYS  74  -0.669   9.583  10.218
  555   2HD   LYS  74          HD1       LYS  74   0.278   9.811   8.748
  556   1HE   LYS  74          HE2       LYS  74   2.177  10.626  10.169
  557   2HE   LYS  74          HE1       LYS  74   1.231  10.197  11.595
  558   1HZ   LYS  74          HZ1       LYS  74   2.905   8.528  10.343
  559   2HZ   LYS  74          HZ2       LYS  74   1.436   8.121   9.593
  560   3HZ   LYS  74          HZ3       LYS  74   1.586   8.023  11.283
  561    H    VAL  75           HN       VAL  75  -3.337   9.918   7.048
  562    HA   VAL  75           HA       VAL  75  -5.500  11.844   6.264
  563    HB   VAL  75           HB       VAL  75  -6.304   9.638   5.005
  564   1HG1  VAL  75          HG11      VAL  75  -5.884  11.583   3.724
  565   2HG1  VAL  75          HG12      VAL  75  -4.808  10.370   3.032
  566   3HG1  VAL  75          HG13      VAL  75  -4.170  11.588   4.137
  567   1HG2  VAL  75          HG21      VAL  75  -4.295   8.402   6.065
  568   2HG2  VAL  75          HG22      VAL  75  -3.308   9.265   4.886
  569   3HG2  VAL  75          HG23      VAL  75  -4.573   8.164   4.341
  570    H    SER  76           HN       SER  76  -7.318  11.745   7.464
  571    HA   SER  76           HA       SER  76  -7.533   9.605   9.522
  572   1HB   SER  76          HB2       SER  76  -7.768  11.889  10.339
  573   2HB   SER  76          HB1       SER  76  -9.012  12.228   9.139
  574    HG   SER  76           HG       SER  76 -10.138  10.370  10.178
  575    H    ALA  77           HN       ALA  77  -9.812   8.748   9.887
  576    HA   ALA  77           HA       ALA  77 -10.798   7.548   7.490
  577   1HB   ALA  77          HB1       ALA  77 -12.619   6.698   8.869
  578   2HB   ALA  77          HB2       ALA  77 -12.265   7.890  10.120
  579   3HB   ALA  77          HB3       ALA  77 -11.111   6.600   9.778
  580    H    GLY  78           HN       GLY  78 -11.099  10.704   8.491
  581   1HA   GLY  78          HA2       GLY  78 -13.759  11.069   7.146
  582   2HA   GLY  78          HA1       GLY  78 -13.044  12.206   8.289
  583    H    GLN  79           HN       GLN  79 -10.354  11.953   7.071
  584    HA   GLN  79           HA       GLN  79 -10.794  13.868   4.854
  585   1HB   GLN  79          HB2       GLN  79  -8.323  12.977   6.364
  586   2HB   GLN  79          HB1       GLN  79  -8.278  14.101   5.006
  587   1HG   GLN  79          HG2       GLN  79  -9.807  15.620   6.202
  588   2HG   GLN  79          HG1       GLN  79  -9.858  14.500   7.564
  589   1HE2  GLN  79          HE21      GLN  79  -6.805  14.026   6.694
  590   2HE2  GLN  79          HE22      GLN  79  -6.015  15.278   7.524
  591    H    PHE  80           HN       PHE  80 -10.836  13.150   2.796
  592    HA   PHE  80           HA       PHE  80  -9.148  10.785   2.038
  593   1HB   PHE  80          HB2       PHE  80 -11.962  11.402   1.081
  594   2HB   PHE  80          HB1       PHE  80 -10.929  10.117   0.467
  595    HD1  PHE  80           HD1      PHE  80 -13.048  11.219   3.236
  596    HD2  PHE  80           HD2      PHE  80 -10.322   8.186   1.886
  597    HE1  PHE  80           HE1      PHE  80 -13.820   9.717   5.053
  598    HE2  PHE  80           HE2      PHE  80 -11.093   6.684   3.703
  599    HZ   PHE  80           HZ       PHE  80 -12.842   7.447   5.284
  600    H    SER  81           HN       SER  81  -8.321  10.897  -0.144
  601    HA   SER  81           HA       SER  81  -8.535  13.622  -1.403
  602   1HB   SER  81          HB2       SER  81  -6.124  11.795  -1.294
  603   2HB   SER  81          HB1       SER  81  -6.197  13.357  -2.104
  604    HG   SER  81           HG       SER  81  -5.434  13.064   0.268
  605    H    SER  82           HN       SER  82  -8.027  10.139  -2.065
  606    HA   SER  82           HA       SER  82  -8.549  10.676  -4.961
  607   1HB   SER  82          HB2       SER  82  -6.494   9.400  -4.223
  608   2HB   SER  82          HB1       SER  82  -7.572   8.109  -3.702
  609    HG   SER  82           HG       SER  82  -7.743   7.535  -5.708
  610    H    LEU  83           HN       LEU  83 -10.406   9.827  -2.339
  611    HA   LEU  83           HA       LEU  83 -11.912   7.663  -3.653
  612   1HB   LEU  83          HB2       LEU  83 -12.319   9.177  -1.082
  613   2HB   LEU  83          HB1       LEU  83 -13.463   7.981  -1.670
  614    HG   LEU  83           HG       LEU  83 -11.819   7.042  -0.062
  615   1HD1  LEU  83          HD11      LEU  83 -11.152   5.727  -2.666
  616   2HD1  LEU  83          HD12      LEU  83 -12.844   5.794  -2.174
  617   3HD1  LEU  83          HD13      LEU  83 -11.655   5.013  -1.137
  618   1HD2  LEU  83          HD21      LEU  83  -9.508   6.936  -0.497
  619   2HD2  LEU  83          HD22      LEU  83  -9.939   8.576  -0.974
  620   3HD2  LEU  83          HD23      LEU  83  -9.722   7.328  -2.202
  621    H    HIS  84           HN       HIS  84 -11.728  10.719  -4.524
  622    HA   HIS  84           HA       HIS  84 -14.493  11.603  -4.443
  623   1HB   HIS  84          HB2       HIS  84 -12.403  12.516  -6.431
  624   2HB   HIS  84          HB1       HIS  84 -13.782  13.423  -5.809
  625    HD1  HIS  84           HD1      HIS  84 -12.771  11.926  -2.881
  626    HD2  HIS  84           HD2      HIS  84 -10.979  14.876  -5.217
  627    HE1  HIS  84           HE1      HIS  84 -11.140  13.136  -1.379
  628    H    VAL  85           HN       VAL  85 -12.495   9.855  -6.771
  629    HA   VAL  85           HA       VAL  85 -14.507   9.887  -8.871
  630    HB   VAL  85           HB       VAL  85 -13.032   8.095  -9.878
  631   1HG1  VAL  85          HG11      VAL  85 -12.697  10.534 -10.287
  632   2HG1  VAL  85          HG12      VAL  85 -11.185   9.627 -10.336
  633   3HG1  VAL  85          HG13      VAL  85 -11.593  10.585  -8.912
  634   1HG2  VAL  85          HG21      VAL  85 -10.943   7.557  -8.769
  635   2HG2  VAL  85          HG22      VAL  85 -12.256   7.231  -7.639
  636   3HG2  VAL  85          HG23      VAL  85 -11.290   8.697  -7.469
  637    H    ARG  86           HN       ARG  86 -15.751   8.023  -9.568
  638    HA   ARG  86           HA       ARG  86 -16.618   6.335  -7.292
  639   1HB   ARG  86          HB2       ARG  86 -17.706   6.748 -10.091
  640   2HB   ARG  86          HB1       ARG  86 -18.391   5.597  -8.942
  641   1HG   ARG  86          HG2       ARG  86 -18.760   7.425  -7.334
  642   2HG   ARG  86          HG1       ARG  86 -18.090   8.578  -8.483
  643   1HD   ARG  86          HD2       ARG  86 -19.862   7.880 -10.116
  644   2HD   ARG  86          HD1       ARG  86 -20.592   6.896  -8.853
  645    HE   ARG  86           HE       ARG  86 -20.902   9.736  -9.227
  646   1HH1  ARG  86          HH21      ARG  86 -20.420   7.399  -6.727
  647   2HH1  ARG  86          HH22      ARG  86 -20.922   8.473  -5.465
  648   1HH2  ARG  86          HH11      ARG  86 -21.561  11.122  -7.594
  649   2HH2  ARG  86          HH12      ARG  86 -21.568  10.569  -5.953
  650    H    ASP  87           HN       ASP  87 -14.416   5.251  -7.434
  651    HA   ASP  87           HA       ASP  87 -13.984   3.441  -9.700
  652   1HB   ASP  87          HB2       ASP  87 -12.585   3.806  -7.035
  653   2HB   ASP  87          HB1       ASP  87 -12.085   2.618  -8.239
  654    H    THR  88           HN       THR  88 -13.637   1.042  -9.169
  655    HA   THR  88           HA       THR  88 -15.981   0.094  -7.607
  656    HB   THR  88           HB       THR  88 -14.062  -1.583  -9.242
  657    HG1  THR  88           HG1      THR  88 -16.492  -0.734 -10.285
  658   1HG2  THR  88          HG21      THR  88 -15.609  -2.759  -7.719
  659   2HG2  THR  88          HG22      THR  88 -16.020  -3.065  -9.407
  660   3HG2  THR  88          HG23      THR  88 -16.971  -1.919  -8.461
  661    H    LYS  89           HN       LYS  89 -15.736  -1.393  -5.859
  662    HA   LYS  89           HA       LYS  89 -13.174  -1.153  -4.441
  663   1HB   LYS  89          HB2       LYS  89 -15.686  -2.687  -3.712
  664   2HB   LYS  89          HB1       LYS  89 -14.309  -2.407  -2.649
  665   1HG   LYS  89          HG2       LYS  89 -14.686   0.025  -2.791
  666   2HG   LYS  89          HG1       LYS  89 -16.069  -0.253  -3.853
  667   1HD   LYS  89          HD2       LYS  89 -17.171  -1.573  -2.085
  668   2HD   LYS  89          HD1       LYS  89 -15.794  -1.296  -1.019
  669   1HE   LYS  89          HE2       LYS  89 -16.239   1.031  -0.873
  670   2HE   LYS  89          HE1       LYS  89 -17.354   0.985  -2.240
  671   1HZ   LYS  89          HZ1       LYS  89 -18.854  -0.374  -0.938
  672   2HZ   LYS  89          HZ2       LYS  89 -18.522   1.076  -0.118
  673   3HZ   LYS  89          HZ3       LYS  89 -17.775  -0.370   0.370
  674    H    ILE  90           HN       ILE  90 -11.786  -2.891  -3.971
  675    HA   ILE  90           HA       ILE  90 -12.311  -5.470  -5.406
  676    HB   ILE  90           HB       ILE  90  -9.884  -5.497  -6.005
  677   1HG1  ILE  90          HG12      ILE  90  -9.976  -2.603  -5.089
  678   2HG1  ILE  90          HG11      ILE  90  -9.165  -3.903  -4.218
  679   1HG2  ILE  90          HG21      ILE  90 -11.248  -3.004  -7.047
  680   2HG2  ILE  90          HG22      ILE  90 -11.738  -4.629  -7.525
  681   3HG2  ILE  90          HG23      ILE  90 -10.115  -4.052  -7.900
  682   1HD1  ILE  90          HD11      ILE  90  -7.874  -4.336  -6.395
  683   2HD1  ILE  90          HD12      ILE  90  -7.454  -2.876  -5.501
  684   3HD1  ILE  90          HD13      ILE  90  -8.481  -2.770  -6.930
  685    H    GLU  91           HN       GLU  91 -10.995  -7.263  -4.535
  686    HA   GLU  91           HA       GLU  91 -11.065  -7.338  -1.664
  687   1HB   GLU  91          HB2       GLU  91  -9.836  -9.167  -3.738
  688   2HB   GLU  91          HB1       GLU  91  -9.796  -9.522  -2.010
  689   1HG   GLU  91          HG2       GLU  91 -12.224  -9.498  -1.896
  690   2HG   GLU  91          HG1       GLU  91 -12.334  -8.985  -3.580
  691    H    VAL  92           HN       VAL  92  -9.341  -7.272  -0.166
  692    HA   VAL  92           HA       VAL  92  -7.206  -5.489  -0.710
  693    HB   VAL  92           HB       VAL  92  -7.533  -7.604   1.435
  694   1HG1  VAL  92          HG11      VAL  92  -5.337  -5.581   0.966
  695   2HG1  VAL  92          HG12      VAL  92  -5.192  -7.287   1.389
  696   3HG1  VAL  92          HG13      VAL  92  -5.733  -6.124   2.598
  697   1HG2  VAL  92          HG21      VAL  92  -9.070  -5.531   1.262
  698   2HG2  VAL  92          HG22      VAL  92  -7.643  -4.592   1.697
  699   3HG2  VAL  92          HG23      VAL  92  -8.269  -5.809   2.808
  700    H    ALA  93           HN       ALA  93  -7.312  -9.045  -0.814
  701    HA   ALA  93           HA       ALA  93  -4.580  -9.588  -1.169
  702   1HB   ALA  93          HB1       ALA  93  -5.345 -11.573  -2.508
  703   2HB   ALA  93          HB2       ALA  93  -6.978 -10.909  -2.471
  704   3HB   ALA  93          HB3       ALA  93  -6.190 -11.394  -0.970
  705    H    GLN  94           HN       GLN  94  -6.967  -8.513  -3.576
  706    HA   GLN  94           HA       GLN  94  -5.067  -8.624  -5.779
  707   1HB   GLN  94          HB2       GLN  94  -7.765  -7.279  -5.458
  708   2HB   GLN  94          HB1       GLN  94  -6.837  -7.245  -6.957
  709   1HG   GLN  94          HG2       GLN  94  -6.844  -9.711  -7.022
  710   2HG   GLN  94          HG1       GLN  94  -7.776  -9.746  -5.525
  711   1HE2  GLN  94          HE21      GLN  94  -9.030  -7.086  -6.862
  712   2HE2  GLN  94          HE22      GLN  94 -10.266  -7.749  -7.819
  713    H    PHE  95           HN       PHE  95  -6.194  -6.186  -3.500
  714    HA   PHE  95           HA       PHE  95  -5.070  -3.882  -4.728
  715   1HB   PHE  95          HB2       PHE  95  -6.610  -3.779  -2.809
  716   2HB   PHE  95          HB1       PHE  95  -5.380  -4.511  -1.779
  717    HD1  PHE  95           HD1      PHE  95  -6.452  -1.463  -3.504
  718    HD2  PHE  95           HD2      PHE  95  -3.308  -3.298  -1.224
  719    HE1  PHE  95           HE1      PHE  95  -5.445   0.767  -3.096
  720    HE2  PHE  95           HE2      PHE  95  -2.302  -1.070  -0.816
  721    HZ   PHE  95           HZ       PHE  95  -3.372   0.961  -1.754
  722    H    VAL  96           HN       VAL  96  -3.667  -6.057  -2.254
  723    HA   VAL  96           HA       VAL  96  -1.150  -4.729  -2.104
  724    HB   VAL  96           HB       VAL  96  -1.743  -7.671  -1.674
  725   1HG1  VAL  96          HG11      VAL  96   0.537  -5.865  -0.832
  726   2HG1  VAL  96          HG12      VAL  96   0.632  -7.316  -1.830
  727   3HG1  VAL  96          HG13      VAL  96   0.242  -7.449  -0.115
  728   1HG2  VAL  96          HG21      VAL  96  -1.998  -7.025   0.696
  729   2HG2  VAL  96          HG22      VAL  96  -3.185  -6.200  -0.314
  730   3HG2  VAL  96          HG23      VAL  96  -1.761  -5.332   0.261
  731    H    LYS  97           HN       LYS  97  -2.153  -7.560  -4.058
  732    HA   LYS  97           HA       LYS  97   0.372  -7.956  -5.298
  733   1HB   LYS  97          HB2       LYS  97  -2.435  -8.564  -6.257
  734   2HB   LYS  97          HB1       LYS  97  -0.985  -9.077  -7.123
  735   1HG   LYS  97          HG2       LYS  97  -0.200 -10.273  -5.112
  736   2HG   LYS  97          HG1       LYS  97  -1.647  -9.765  -4.243
  737   1HD   LYS  97          HD2       LYS  97  -3.053 -10.979  -5.872
  738   2HD   LYS  97          HD1       LYS  97  -1.604 -11.491  -6.738
  739   1HE   LYS  97          HE2       LYS  97  -0.851 -12.815  -4.903
  740   2HE   LYS  97          HE1       LYS  97  -2.016 -12.082  -3.801
  741   1HZ   LYS  97          HZ1       LYS  97  -3.655 -13.407  -4.517
  742   2HZ   LYS  97          HZ2       LYS  97  -2.396 -14.406  -5.070
  743   3HZ   LYS  97          HZ3       LYS  97  -3.166 -13.334  -6.140
  744    H    ASP  98           HN       ASP  98  -2.406  -5.954  -6.387
  745    HA   ASP  98           HA       ASP  98  -1.199  -5.097  -8.825
  746   1HB   ASP  98          HB2       ASP  98  -3.177  -3.719  -6.990
  747   2HB   ASP  98          HB1       ASP  98  -2.706  -3.073  -8.562
  748    H    LEU  99           HN       LEU  99  -1.024  -3.776  -5.540
  749    HA   LEU  99           HA       LEU  99   0.551  -1.488  -6.212
  750   1HB   LEU  99          HB2       LEU  99  -0.654  -1.711  -4.066
  751   2HB   LEU  99          HB1       LEU  99   0.407  -3.040  -3.605
  752    HG   LEU  99           HG       LEU  99   2.351  -1.527  -3.695
  753   1HD1  LEU  99          HD11      LEU  99   0.262   0.395  -4.699
  754   2HD1  LEU  99          HD12      LEU  99   1.914   0.146  -5.265
  755   3HD1  LEU  99          HD13      LEU  99   1.623   1.026  -3.768
  756   1HD2  LEU  99          HD21      LEU  99   1.804  -0.209  -1.709
  757   2HD2  LEU  99          HD22      LEU  99   1.028  -1.789  -1.592
  758   3HD2  LEU  99          HD23      LEU  99   0.081  -0.373  -2.046
  759    H    LEU 100           HN       LEU 100   1.408  -4.818  -5.360
  760    HA   LEU 100           HA       LEU 100   4.188  -4.535  -4.999
  761   1HB   LEU 100          HB2       LEU 100   3.112  -6.637  -4.522
  762   2HB   LEU 100          HB1       LEU 100   2.580  -6.806  -6.190
  763    HG   LEU 100           HG       LEU 100   4.878  -7.088  -6.952
  764   1HD1  LEU 100          HD11      LEU 100   6.154  -5.667  -5.542
  765   2HD1  LEU 100          HD12      LEU 100   6.663  -7.294  -5.104
  766   3HD1  LEU 100          HD13      LEU 100   5.525  -6.419  -4.077
  767   1HD2  LEU 100          HD21      LEU 100   4.149  -8.754  -4.529
  768   2HD2  LEU 100          HD22      LEU 100   5.467  -9.159  -5.629
  769   3HD2  LEU 100          HD23      LEU 100   3.806  -9.120  -6.220
  770    H    LEU 101           HN       LEU 101   2.417  -5.029  -8.092
  771    HA   LEU 101           HA       LEU 101   4.762  -5.218  -9.692
  772   1HB   LEU 101          HB2       LEU 101   1.944  -4.345 -10.283
  773   2HB   LEU 101          HB1       LEU 101   3.178  -4.214 -11.531
  774    HG   LEU 101           HG       LEU 101   1.843  -6.373 -11.559
  775   1HD1  LEU 101          HD11      LEU 101   4.377  -6.000 -12.324
  776   2HD1  LEU 101          HD12      LEU 101   3.642  -7.599 -12.340
  777   3HD1  LEU 101          HD13      LEU 101   4.696  -7.133 -11.010
  778   1HD2  LEU 101          HD21      LEU 101   2.141  -7.999  -9.858
  779   2HD2  LEU 101          HD22      LEU 101   1.873  -6.489  -8.998
  780   3HD2  LEU 101          HD23      LEU 101   3.503  -7.130  -9.152
  781    H    HIS 102           HN       HIS 102   2.898  -2.330  -8.739
  782    HA   HIS 102           HA       HIS 102   4.575  -0.511 -10.220
  783   1HB   HIS 102          HB2       HIS 102   2.550  -0.175  -8.013
  784   2HB   HIS 102          HB1       HIS 102   3.512   1.198  -8.561
  785    HD1  HIS 102           HD1      HIS 102   3.104   2.076 -10.956
  786    HD2  HIS 102           HD2      HIS 102   0.671  -1.143  -9.922
  787    HE1  HIS 102           HE1      HIS 102   1.335   1.917 -12.758
  788    H    LEU 103           HN       LEU 103   4.707  -1.672  -6.848
  789    HA   LEU 103           HA       LEU 103   6.601   0.233  -5.919
  790   1HB   LEU 103          HB2       LEU 103   6.174  -2.658  -5.133
  791   2HB   LEU 103          HB1       LEU 103   7.257  -1.571  -4.267
  792    HG   LEU 103           HG       LEU 103   4.327  -0.981  -4.751
  793   1HD1  LEU 103          HD11      LEU 103   4.314  -2.896  -3.347
  794   2HD1  LEU 103          HD12      LEU 103   4.187  -1.536  -2.233
  795   3HD1  LEU 103          HD13      LEU 103   5.734  -2.353  -2.455
  796   1HD2  LEU 103          HD21      LEU 103   6.549   0.364  -3.223
  797   2HD2  LEU 103          HD22      LEU 103   4.897   0.503  -2.627
  798   3HD2  LEU 103          HD23      LEU 103   5.299   1.082  -4.238
  799    H    LYS 104           HN       LYS 104   7.274  -3.027  -7.303
  800    HA   LYS 104           HA       LYS 104  10.129  -2.561  -7.238
  801   1HB   LYS 104          HB2       LYS 104  10.353  -4.605  -8.477
  802   2HB   LYS 104          HB1       LYS 104   9.057  -4.833  -7.306
  803   1HG   LYS 104          HG2       LYS 104   7.425  -4.208  -9.135
  804   2HG   LYS 104          HG1       LYS 104   8.779  -4.277 -10.267
  805   1HD   LYS 104          HD2       LYS 104   9.234  -6.622  -9.429
  806   2HD   LYS 104          HD1       LYS 104   7.706  -6.532  -8.552
  807   1HE   LYS 104          HE2       LYS 104   7.142  -7.569 -10.598
  808   2HE   LYS 104          HE1       LYS 104   6.658  -5.890 -10.815
  809   1HZ   LYS 104          HZ1       LYS 104   9.172  -5.775 -11.642
  810   2HZ   LYS 104          HZ2       LYS 104   7.865  -6.093 -12.679
  811   3HZ   LYS 104          HZ3       LYS 104   8.807  -7.373 -12.079
  812    H    LYS 105           HN       LYS 105   7.631  -1.641  -9.456
  813    HA   LYS 105           HA       LYS 105   9.202  -1.382 -11.830
  814   1HB   LYS 105          HB2       LYS 105   6.744  -1.276 -11.833
  815   2HB   LYS 105          HB1       LYS 105   6.804   0.238 -10.931
  816   1HG   LYS 105          HG2       LYS 105   7.935   1.354 -12.764
  817   2HG   LYS 105          HG1       LYS 105   8.082  -0.165 -13.649
  818   1HD   LYS 105          HD2       LYS 105   5.649  -0.330 -13.837
  819   2HD   LYS 105          HD1       LYS 105   5.453   1.133 -12.871
  820   1HE   LYS 105          HE2       LYS 105   5.242   1.695 -15.240
  821   2HE   LYS 105          HE1       LYS 105   6.726   2.403 -14.600
  822   1HZ   LYS 105          HZ1       LYS 105   8.026   0.776 -15.614
  823   2HZ   LYS 105          HZ2       LYS 105   6.871   1.166 -16.798
  824   3HZ   LYS 105          HZ3       LYS 105   6.709  -0.258 -15.885
  825    H    LEU 106           HN       LEU 106   8.417   1.086  -9.333
  826    HA   LEU 106           HA       LEU 106   9.977   3.161 -10.531
  827   1HB   LEU 106          HB2       LEU 106   8.986   2.665  -7.730
  828   2HB   LEU 106          HB1       LEU 106  10.050   4.026  -8.059
  829    HG   LEU 106           HG       LEU 106   7.553   4.526  -8.148
  830   1HD1  LEU 106          HD11      LEU 106   9.486   5.789  -9.408
  831   2HD1  LEU 106          HD12      LEU 106   7.809   6.138  -9.811
  832   3HD1  LEU 106          HD13      LEU 106   8.759   5.083 -10.852
  833   1HD2  LEU 106          HD21      LEU 106   7.659   3.128 -10.825
  834   2HD2  LEU 106          HD22      LEU 106   6.246   3.757  -9.979
  835   3HD2  LEU 106          HD23      LEU 106   7.074   2.328  -9.369
  836    H    PHE 107           HN       PHE 107  10.875   0.456  -8.491
  837    HA   PHE 107           HA       PHE 107  13.403   1.393  -7.599
  838   1HB   PHE 107          HB2       PHE 107  12.400  -0.690  -6.753
  839   2HB   PHE 107          HB1       PHE 107  12.602  -1.438  -8.340
  840    HD1  PHE 107           HD1      PHE 107  14.490   0.159  -5.544
  841    HD2  PHE 107           HD2      PHE 107  14.664  -2.426  -8.966
  842    HE1  PHE 107           HE1      PHE 107  16.822  -0.434  -4.971
  843    HE2  PHE 107           HE2      PHE 107  16.998  -3.031  -8.388
  844    HZ   PHE 107           HZ       PHE 107  18.079  -2.036  -6.389
  845    H    ARG 108           HN       ARG 108  12.452  -0.172 -10.636
  846    HA   ARG 108           HA       ARG 108  15.053  -0.530 -11.726
  847   1HB   ARG 108          HB2       ARG 108  12.383   0.018 -13.051
  848   2HB   ARG 108          HB1       ARG 108  13.844  -0.391 -13.950
  849   1HG   ARG 108          HG2       ARG 108  14.033  -2.495 -12.689
  850   2HG   ARG 108          HG1       ARG 108  12.568  -2.100 -11.795
  851   1HD   ARG 108          HD2       ARG 108  11.402  -1.919 -14.056
  852   2HD   ARG 108          HD1       ARG 108  12.833  -2.662 -14.763
  853    HE   ARG 108           HE       ARG 108  10.696  -4.015 -13.399
  854   1HH1  ARG 108          HH21      ARG 108  14.144  -3.986 -13.593
  855   2HH1  ARG 108          HH22      ARG 108  14.318  -5.542 -12.855
  856   1HH2  ARG 108          HH11      ARG 108  10.914  -6.032 -12.455
  857   2HH2  ARG 108          HH12      ARG 108  12.494  -6.700 -12.216
  858    H    GLU 109           HN       GLU 109  12.899   2.292 -11.685
  859    HA   GLU 109           HA       GLU 109  14.734   3.855 -13.366
  860   1HB   GLU 109          HB2       GLU 109  12.195   4.549 -11.869
  861   2HB   GLU 109          HB1       GLU 109  13.116   5.722 -12.813
  862   1HG   GLU 109          HG2       GLU 109  12.820   4.416 -14.835
  863   2HG   GLU 109          HG1       GLU 109  12.057   3.111 -13.927
  864    H    GLY 110           HN       GLY 110  14.503   3.097 -10.038
  865   1HA   GLY 110          HA2       GLY 110  15.816   3.830  -8.236
  866   2HA   GLY 110          HA1       GLY 110  16.783   4.734  -9.400
  867    H    ARG 111           HN       ARG 111  13.584   5.636  -9.823
  868    HA   ARG 111           HA       ARG 111  14.053   8.152  -8.302
  869   1HB   ARG 111          HB2       ARG 111  11.996   7.366 -10.386
  870   2HB   ARG 111          HB1       ARG 111  11.980   8.914  -9.540
  871   1HG   ARG 111          HG2       ARG 111  14.251   9.396 -10.373
  872   2HG   ARG 111          HG1       ARG 111  14.269   7.852 -11.225
  873   1HD   ARG 111          HD2       ARG 111  12.311   8.562 -12.554
  874   2HD   ARG 111          HD1       ARG 111  12.302  10.110 -11.709
  875    HE   ARG 111           HE       ARG 111  14.861   9.961 -12.737
  876   1HH1  ARG 111          HH21      ARG 111  11.660   9.604 -13.968
  877   2HH1  ARG 111          HH22      ARG 111  12.055  10.199 -15.546
  878   1HH2  ARG 111          HH11      ARG 111  15.397  10.738 -14.791
  879   2HH2  ARG 111          HH12      ARG 111  14.173  10.842 -16.012
  880    H    PHE 112           HN       PHE 112  13.550   7.708  -6.186
  881    HA   PHE 112           HA       PHE 112  11.022   6.279  -5.549
  882   1HB   PHE 112          HB2       PHE 112  13.195   7.311  -3.701
  883   2HB   PHE 112          HB1       PHE 112  11.897   6.186  -3.286
  884    HD1  PHE 112           HD1      PHE 112  11.811   3.929  -4.359
  885    HD2  PHE 112           HD2      PHE 112  15.156   6.573  -4.860
  886    HE1  PHE 112           HE1      PHE 112  13.189   2.038  -5.178
  887    HE2  PHE 112           HE2      PHE 112  16.531   4.678  -5.679
  888    HZ   PHE 112           HZ       PHE 112  15.547   2.410  -5.836
  889    H    ASN 113           HN       ASN 113   9.236   7.364  -4.841
  890    HA   ASN 113           HA       ASN 113   7.849   9.191  -4.357
  891   1HB   ASN 113          HB2       ASN 113   9.261   8.916  -2.232
  892   2HB   ASN 113          HB1       ASN 113  10.226  10.268  -2.828
  893   1HD2  ASN 113          HD21      ASN 113   9.314  11.339  -0.762
  894   2HD2  ASN 113          HD22      ASN 113   7.799  12.096  -0.881
  Start of MODEL   26
    1   1H    MET   1           HT1      MET   1  22.010   7.111   9.369
    2   2H    MET   1           HT2      MET   1  23.434   6.498  10.064
    3   3H    MET   1           HT3      MET   1  23.328   8.142   9.647
    4    HA   MET   1           HA       MET   1  22.394   6.770  12.007
    5   1HB   MET   1          HB2       MET   1  22.958   9.665  11.291
    6   2HB   MET   1          HB1       MET   1  22.623   9.076  12.920
    7   1HG   MET   1          HG2       MET   1  24.904   8.091  11.183
    8   2HG   MET   1          HG1       MET   1  25.074   9.312  12.442
    9   1HE   MET   1          HE1       MET   1  23.124   7.964  14.996
   10   2HE   MET   1          HE2       MET   1  24.389   9.140  14.654
   11   3HE   MET   1          HE3       MET   1  24.740   7.756  15.683
   12    H    GLY   2           HN       GLY   2  21.079   9.118   9.668
   13   1HA   GLY   2          HA2       GLY   2  18.587   9.480  11.093
   14   2HA   GLY   2          HA1       GLY   2  18.885   9.925   9.410
   15    HA   PRO   3           HA       PRO   3  15.925   6.183   9.866
   16   1HB   PRO   3          HB2       PRO   3  14.656   7.628   7.604
   17   2HB   PRO   3          HB1       PRO   3  13.918   6.972   9.071
   18   1HG   PRO   3          HG2       PRO   3  14.383   9.683   8.586
   19   2HG   PRO   3          HG1       PRO   3  14.084   8.970  10.176
   20   1HD   PRO   3          HD2       PRO   3  16.578  10.103   9.135
   21   2HD   PRO   3          HD1       PRO   3  16.214   9.565  10.794
   22    H    VAL   4           HN       VAL   4  15.221   4.845   7.730
   23    HA   VAL   4           HA       VAL   4  17.714   4.269   6.363
   24    HB   VAL   4           HB       VAL   4  16.166   2.611   5.104
   25   1HG1  VAL   4          HG11      VAL   4  17.608   1.893   6.931
   26   2HG1  VAL   4          HG12      VAL   4  16.022   1.147   7.131
   27   3HG1  VAL   4          HG13      VAL   4  16.475   2.535   8.120
   28   1HG2  VAL   4          HG21      VAL   4  13.976   2.275   5.988
   29   2HG2  VAL   4          HG22      VAL   4  14.113   4.017   5.748
   30   3HG2  VAL   4          HG23      VAL   4  14.288   3.333   7.364
   31    HA   PRO   5           HA       PRO   5  17.012   6.985   2.888
   32   1HB   PRO   5          HB2       PRO   5  18.216   5.376   0.886
   33   2HB   PRO   5          HB1       PRO   5  19.025   6.583   1.892
   34   1HG   PRO   5          HG2       PRO   5  19.098   3.637   2.090
   35   2HG   PRO   5          HG1       PRO   5  20.246   4.828   2.710
   36   1HD   PRO   5          HD2       PRO   5  18.417   3.372   4.276
   37   2HD   PRO   5          HD1       PRO   5  19.245   4.868   4.780
   38    HA   PRO   6           HA       PRO   6  13.362   5.751   0.711
   39   1HB   PRO   6          HB2       PRO   6  14.149   6.482  -1.951
   40   2HB   PRO   6          HB1       PRO   6  13.210   7.441  -0.803
   41   1HG   PRO   6          HG2       PRO   6  16.011   7.755  -1.602
   42   2HG   PRO   6          HG1       PRO   6  14.980   8.877  -0.706
   43   1HD   PRO   6          HD2       PRO   6  17.118   7.370   0.375
   44   2HD   PRO   6          HD1       PRO   6  15.858   8.214   1.310
   45    H    SER   7           HN       SER   7  16.193   4.910  -1.325
   46    HA   SER   7           HA       SER   7  14.932   2.744  -2.674
   47   1HB   SER   7          HB2       SER   7  17.174   2.066  -3.327
   48   2HB   SER   7          HB1       SER   7  17.079   3.824  -3.371
   49    HG   SER   7           HG       SER   7  17.760   3.068  -0.912
   50    H    THR   8           HN       THR   8  16.815   2.806   0.354
   51    HA   THR   8           HA       THR   8  16.771  -0.067   0.683
   52    HB   THR   8           HB       THR   8  17.116   2.116   2.758
   53    HG1  THR   8           HG1      THR   8  19.369   1.162   2.407
   54   1HG2  THR   8          HG21      THR   8  18.350   0.183   3.935
   55   2HG2  THR   8          HG22      THR   8  17.480  -0.880   2.828
   56   3HG2  THR   8          HG23      THR   8  16.588   0.144   3.953
   57    H    ALA   9           HN       ALA   9  14.693   2.561   1.875
   58    HA   ALA   9           HA       ALA   9  13.043   0.943   3.550
   59   1HB   ALA   9          HB1       ALA   9  12.902   3.340   3.728
   60   2HB   ALA   9          HB2       ALA   9  11.332   2.774   3.156
   61   3HB   ALA   9          HB3       ALA   9  12.476   3.497   2.025
   62    H    LEU  10           HN       LEU  10  12.827   1.770   0.100
   63    HA   LEU  10           HA       LEU  10  10.327   0.507  -0.415
   64   1HB   LEU  10          HB2       LEU  10  11.506   2.021  -2.016
   65   2HB   LEU  10          HB1       LEU  10  12.715   0.766  -2.272
   66    HG   LEU  10           HG       LEU  10  10.766  -0.770  -2.964
   67   1HD1  LEU  10          HD11      LEU  10   8.815   0.620  -3.917
   68   2HD1  LEU  10          HD12      LEU  10   9.367   1.907  -2.849
   69   3HD1  LEU  10          HD13      LEU  10   8.840   0.366  -2.175
   70   1HD2  LEU  10          HD21      LEU  10  11.244   1.671  -4.689
   71   2HD2  LEU  10          HD22      LEU  10  10.800   0.055  -5.233
   72   3HD2  LEU  10          HD23      LEU  10  12.386   0.337  -4.524
   73    H    ARG  11           HN       ARG  11  13.662  -0.752  -0.744
   74    HA   ARG  11           HA       ARG  11  12.932  -3.372  -1.569
   75   1HB   ARG  11          HB2       ARG  11  15.341  -2.353  -0.036
   76   2HB   ARG  11          HB1       ARG  11  15.201  -4.009  -0.631
   77   1HG   ARG  11          HG2       ARG  11  14.907  -3.164  -2.931
   78   2HG   ARG  11          HG1       ARG  11  15.048  -1.508  -2.341
   79   1HD   ARG  11          HD2       ARG  11  17.190  -3.639  -2.082
   80   2HD   ARG  11          HD1       ARG  11  17.193  -2.332  -3.268
   81    HE   ARG  11           HE       ARG  11  16.954  -1.012  -0.850
   82   1HH1  ARG  11          HH21      ARG  11  19.050  -3.395  -2.186
   83   2HH1  ARG  11          HH22      ARG  11  20.435  -2.875  -1.286
   84   1HH2  ARG  11          HH11      ARG  11  18.751  -0.314   0.334
   85   2HH2  ARG  11          HH12      ARG  11  20.266  -1.131   0.142
   86    H    GLU  12           HN       GLU  12  13.413  -2.011   1.682
   87    HA   GLU  12           HA       GLU  12  12.952  -4.464   3.102
   88   1HB   GLU  12          HB2       GLU  12  12.563  -1.558   3.888
   89   2HB   GLU  12          HB1       GLU  12  12.360  -2.903   5.013
   90   1HG   GLU  12          HG2       GLU  12  14.678  -3.617   4.599
   91   2HG   GLU  12          HG1       GLU  12  14.889  -2.294   3.453
   92    H    LEU  13           HN       LEU  13  10.849  -1.935   1.842
   93    HA   LEU  13           HA       LEU  13   8.413  -2.901   3.034
   94   1HB   LEU  13          HB2       LEU  13   8.654  -0.594   2.224
   95   2HB   LEU  13          HB1       LEU  13   8.897  -1.179   0.582
   96    HG   LEU  13           HG       LEU  13   6.613  -2.122   0.574
   97   1HD1  LEU  13          HD11      LEU  13   5.121  -1.266   2.531
   98   2HD1  LEU  13          HD12      LEU  13   6.640  -1.096   3.409
   99   3HD1  LEU  13          HD13      LEU  13   6.134  -2.679   2.817
  100   1HD2  LEU  13          HD21      LEU  13   6.569   0.754   1.522
  101   2HD2  LEU  13          HD22      LEU  13   5.442  -0.023   0.411
  102   3HD2  LEU  13          HD23      LEU  13   7.108   0.274  -0.087
  103    H    ILE  14           HN       ILE  14   9.684  -3.184  -0.314
  104    HA   ILE  14           HA       ILE  14   7.598  -4.849  -1.289
  105    HB   ILE  14           HB       ILE  14  10.500  -4.615  -2.128
  106   1HG1  ILE  14          HG12      ILE  14   7.972  -3.571  -3.438
  107   2HG1  ILE  14          HG11      ILE  14   8.952  -2.614  -2.327
  108   1HG2  ILE  14          HG21      ILE  14   8.198  -6.179  -3.311
  109   2HG2  ILE  14          HG22      ILE  14   9.839  -6.730  -2.975
  110   3HG2  ILE  14          HG23      ILE  14   9.539  -5.623  -4.313
  111   1HD1  ILE  14          HD11      ILE  14   9.884  -3.832  -4.943
  112   2HD1  ILE  14          HD12      ILE  14  10.920  -2.962  -3.812
  113   3HD1  ILE  14          HD13      ILE  14   9.606  -2.118  -4.630
  114    H    GLU  15           HN       GLU  15  10.783  -5.793   0.058
  115    HA   GLU  15           HA       GLU  15  10.408  -8.591  -0.238
  116   1HB   GLU  15          HB2       GLU  15  12.017  -7.002   1.774
  117   2HB   GLU  15          HB1       GLU  15  12.091  -8.760   1.647
  118   1HG   GLU  15          HG2       GLU  15  12.766  -8.566  -0.720
  119   2HG   GLU  15          HG1       GLU  15  12.695  -6.808  -0.594
  120    H    GLU  16           HN       GLU  16   9.472  -6.419   2.423
  121    HA   GLU  16           HA       GLU  16   8.534  -8.541   4.139
  122   1HB   GLU  16          HB2       GLU  16   9.119  -6.246   4.924
  123   2HB   GLU  16          HB1       GLU  16   7.689  -5.631   4.094
  124   1HG   GLU  16          HG2       GLU  16   6.226  -6.956   5.484
  125   2HG   GLU  16          HG1       GLU  16   7.597  -7.799   6.207
  126    H    LEU  17           HN       LEU  17   6.863  -6.382   1.827
  127    HA   LEU  17           HA       LEU  17   4.220  -7.318   2.360
  128   1HB   LEU  17          HB2       LEU  17   5.457  -6.171  -0.154
  129   2HB   LEU  17          HB1       LEU  17   3.736  -6.500   0.011
  130    HG   LEU  17           HG       LEU  17   5.298  -4.708   1.895
  131   1HD1  LEU  17          HD11      LEU  17   4.250  -2.833   0.673
  132   2HD1  LEU  17          HD12      LEU  17   3.535  -3.976  -0.464
  133   3HD1  LEU  17          HD13      LEU  17   5.286  -3.786  -0.391
  134   1HD2  LEU  17          HD21      LEU  17   3.361  -5.304   3.066
  135   2HD2  LEU  17          HD22      LEU  17   2.399  -5.490   1.601
  136   3HD2  LEU  17          HD23      LEU  17   2.793  -3.881   2.200
  137    H    VAL  18           HN       VAL  18   6.678  -8.472   0.069
  138    HA   VAL  18           HA       VAL  18   4.979 -10.415  -1.188
  139    HB   VAL  18           HB       VAL  18   7.992 -10.240  -0.927
  140   1HG1  VAL  18          HG11      VAL  18   7.504 -12.547  -1.365
  141   2HG1  VAL  18          HG12      VAL  18   7.927 -11.828  -2.919
  142   3HG1  VAL  18          HG13      VAL  18   6.236 -12.124  -2.516
  143   1HG2  VAL  18          HG21      VAL  18   6.102  -9.630  -3.222
  144   2HG2  VAL  18          HG22      VAL  18   7.853  -9.425  -3.239
  145   3HG2  VAL  18          HG23      VAL  18   6.859  -8.420  -2.186
  146    H    ASN  19           HN       ASN  19   7.198 -10.611   1.585
  147    HA   ASN  19           HA       ASN  19   7.094 -13.421   1.947
  148   1HB   ASN  19          HB2       ASN  19   8.679 -11.963   3.140
  149   2HB   ASN  19          HB1       ASN  19   7.345 -11.252   4.050
  150   1HD2  ASN  19          HD21      ASN  19   8.707 -12.177   5.946
  151   2HD2  ASN  19          HD22      ASN  19   8.405 -13.785   6.396
  152    H    ILE  20           HN       ILE  20   4.893 -10.885   3.171
  153    HA   ILE  20           HA       ILE  20   3.332 -12.819   4.694
  154    HB   ILE  20           HB       ILE  20   1.765 -10.915   5.045
  155   1HG1  ILE  20          HG12      ILE  20   3.741  -9.430   3.284
  156   2HG1  ILE  20          HG11      ILE  20   2.085  -9.836   2.840
  157   1HG2  ILE  20          HG21      ILE  20   4.640 -10.047   5.409
  158   2HG2  ILE  20          HG22      ILE  20   3.898 -11.311   6.390
  159   3HG2  ILE  20          HG23      ILE  20   3.258  -9.669   6.437
  160   1HD1  ILE  20          HD11      ILE  20   1.964  -7.592   3.611
  161   2HD1  ILE  20          HD12      ILE  20   3.028  -7.921   4.978
  162   3HD1  ILE  20          HD13      ILE  20   1.384  -8.560   4.967
  163    H    THR  21           HN       THR  21   3.224 -11.735   1.366
  164    HA   THR  21           HA       THR  21   0.440 -12.796   1.070
  165    HB   THR  21           HB       THR  21   0.600 -11.872  -1.240
  166    HG1  THR  21           HG1      THR  21   2.930 -10.539  -0.456
  167   1HG2  THR  21          HG21      THR  21   1.436  -9.671   0.619
  168   2HG2  THR  21          HG22      THR  21  -0.072 -10.532   0.930
  169   3HG2  THR  21          HG23      THR  21   0.161  -9.680  -0.595
  170    H    GLN  22           HN       GLN  22   3.599 -13.976   0.795
  171    HA   GLN  22           HA       GLN  22   3.100 -15.647  -1.561
  172   1HB   GLN  22          HB2       GLN  22   5.334 -15.450   0.453
  173   2HB   GLN  22          HB1       GLN  22   5.267 -16.801  -0.679
  174   1HG   GLN  22          HG2       GLN  22   5.068 -13.932  -1.605
  175   2HG   GLN  22          HG1       GLN  22   6.619 -14.752  -1.433
  176   1HE2  GLN  22          HE21      GLN  22   4.584 -13.930  -3.810
  177   2HE2  GLN  22          HE22      GLN  22   4.704 -15.283  -4.828
  178    H    ASN  23           HN       ASN  23   3.065 -16.126   1.964
  179    HA   ASN  23           HA       ASN  23   2.107 -18.934   1.526
  180   1HB   ASN  23          HB2       ASN  23   3.284 -17.596   3.972
  181   2HB   ASN  23          HB1       ASN  23   2.731 -19.270   3.904
  182   1HD2  ASN  23          HD21      ASN  23   3.694 -20.260   1.561
  183   2HD2  ASN  23          HD22      ASN  23   5.382 -20.105   1.463
  184    H    GLN  24           HN       GLN  24   0.429 -16.227   1.634
  185    HA   GLN  24           HA       GLN  24  -1.204 -16.772   4.023
  186   1HB   GLN  24          HB2       GLN  24  -2.359 -14.793   3.576
  187   2HB   GLN  24          HB1       GLN  24  -0.776 -14.441   2.903
  188   1HG   GLN  24          HG2       GLN  24  -3.190 -15.360   1.286
  189   2HG   GLN  24          HG1       GLN  24  -2.617 -13.712   1.419
  190   1HE2  GLN  24          HE21      GLN  24  -0.918 -16.849   0.791
  191   2HE2  GLN  24          HE22      GLN  24  -0.108 -16.278  -0.587
  192    H    LYS  25           HN       LYS  25  -2.984 -18.072   4.088
  193    HA   LYS  25           HA       LYS  25  -3.784 -19.445   1.589
  194   1HB   LYS  25          HB2       LYS  25  -3.500 -20.691   3.773
  195   2HB   LYS  25          HB1       LYS  25  -4.903 -19.820   4.387
  196   1HG   LYS  25          HG2       LYS  25  -6.275 -20.717   2.539
  197   2HG   LYS  25          HG1       LYS  25  -4.873 -21.595   1.927
  198   1HD   LYS  25          HD2       LYS  25  -4.736 -22.858   4.045
  199   2HD   LYS  25          HD1       LYS  25  -6.140 -21.983   4.657
  200   1HE   LYS  25          HE2       LYS  25  -7.364 -22.839   2.550
  201   2HE   LYS  25          HE1       LYS  25  -6.019 -23.968   2.385
  202   1HZ   LYS  25          HZ1       LYS  25  -7.274 -23.751   5.011
  203   2HZ   LYS  25          HZ2       LYS  25  -6.622 -25.109   4.226
  204   3HZ   LYS  25          HZ3       LYS  25  -8.161 -24.533   3.795
  205    H    ALA  26           HN       ALA  26  -5.887 -18.340   4.231
  206    HA   ALA  26           HA       ALA  26  -7.858 -17.383   2.288
  207   1HB   ALA  26          HB1       ALA  26  -9.325 -17.297   4.112
  208   2HB   ALA  26          HB2       ALA  26  -8.057 -16.827   5.242
  209   3HB   ALA  26          HB3       ALA  26  -8.175 -18.496   4.692
  210    HA   PRO  27           HA       PRO  27  -6.405 -13.195   1.987
  211   1HB   PRO  27          HB2       PRO  27  -8.925 -11.981   2.833
  212   2HB   PRO  27          HB1       PRO  27  -8.213 -12.034   1.217
  213   1HG   PRO  27          HG2       PRO  27 -10.432 -13.585   2.234
  214   2HG   PRO  27          HG1       PRO  27  -9.760 -13.588   0.600
  215   1HD   PRO  27          HD2       PRO  27  -9.578 -15.696   2.505
  216   2HD   PRO  27          HD1       PRO  27  -8.690 -15.591   0.968
  217    H    LEU  28           HN       LEU  28  -5.496 -11.633   3.422
  218    HA   LEU  28           HA       LEU  28  -5.290 -12.337   6.178
  219   1HB   LEU  28          HB2       LEU  28  -4.832  -9.636   4.866
  220   2HB   LEU  28          HB1       LEU  28  -4.268 -10.093   6.471
  221    HG   LEU  28           HG       LEU  28  -3.499 -11.560   3.928
  222   1HD1  LEU  28          HD11      LEU  28  -2.665  -9.213   3.958
  223   2HD1  LEU  28          HD12      LEU  28  -1.357 -10.390   4.079
  224   3HD1  LEU  28          HD13      LEU  28  -1.902  -9.527   5.517
  225   1HD2  LEU  28          HD21      LEU  28  -2.704 -11.768   6.837
  226   2HD2  LEU  28          HD22      LEU  28  -1.579 -12.263   5.573
  227   3HD2  LEU  28          HD23      LEU  28  -3.145 -13.055   5.714
  228    H    CYS  29           HN       CYS  29  -7.193  -9.801   4.563
  229    HA   CYS  29           HA       CYS  29  -8.643  -9.206   7.056
  230   1HB   CYS  29          HB2       CYS  29  -8.998  -8.194   4.218
  231   2HB   CYS  29          HB1       CYS  29  -9.923  -7.631   5.608
  232    H    ASN  30           HN       ASN  30 -11.040  -9.431   7.125
  233    HA   ASN  30           HA       ASN  30 -11.861 -12.047   6.216
  234   1HB   ASN  30          HB2       ASN  30 -12.731 -10.949   8.288
  235   2HB   ASN  30          HB1       ASN  30 -13.595  -9.795   7.271
  236   1HD2  ASN  30          HD21      ASN  30 -13.378 -13.282   8.056
  237   2HD2  ASN  30          HD22      ASN  30 -14.941 -13.663   7.516
  238    H    GLY  31           HN       GLY  31 -11.274 -11.424   3.854
  239   1HA   GLY  31          HA2       GLY  31 -12.043 -11.034   1.671
  240   2HA   GLY  31          HA1       GLY  31 -13.666 -11.237   2.329
  241    H    SER  32           HN       SER  32 -11.634  -8.735   3.660
  242    HA   SER  32           HA       SER  32 -13.553  -6.690   3.113
  243   1HB   SER  32          HB2       SER  32 -10.606  -6.401   3.751
  244   2HB   SER  32          HB1       SER  32 -11.802  -5.113   3.848
  245    HG   SER  32           HG       SER  32 -12.504  -5.922   5.664
  246    H    MET  33           HN       MET  33 -13.585  -5.053   1.565
  247    HA   MET  33           HA       MET  33 -11.824  -5.460  -0.835
  248   1HB   MET  33          HB2       MET  33 -14.689  -4.500  -0.596
  249   2HB   MET  33          HB1       MET  33 -13.744  -4.387  -2.079
  250   1HG   MET  33          HG2       MET  33 -13.409  -6.836  -2.055
  251   2HG   MET  33          HG1       MET  33 -14.354  -6.948  -0.571
  252   1HE   MET  33          HE1       MET  33 -14.884  -7.096  -4.613
  253   2HE   MET  33          HE2       MET  33 -14.052  -5.679  -3.983
  254   3HE   MET  33          HE3       MET  33 -15.666  -5.512  -4.666
  255    H    VAL  34           HN       VAL  34 -11.023  -3.547  -1.846
  256    HA   VAL  34           HA       VAL  34 -11.364  -0.998  -0.298
  257    HB   VAL  34           HB       VAL  34  -8.943  -0.543  -0.728
  258   1HG1  VAL  34          HG11      VAL  34  -8.119  -2.091   1.008
  259   2HG1  VAL  34          HG12      VAL  34  -9.548  -3.102   0.784
  260   3HG1  VAL  34          HG13      VAL  34  -9.716  -1.470   1.426
  261   1HG2  VAL  34          HG21      VAL  34  -8.825  -3.479  -1.481
  262   2HG2  VAL  34          HG22      VAL  34  -7.494  -2.323  -1.484
  263   3HG2  VAL  34          HG23      VAL  34  -8.791  -2.175  -2.667
  264    H    TRP  35           HN       TRP  35 -10.883   0.939  -1.575
  265    HA   TRP  35           HA       TRP  35 -12.029   0.775  -4.236
  266   1HB   TRP  35          HB2       TRP  35 -10.663   3.064  -2.791
  267   2HB   TRP  35          HB1       TRP  35 -11.532   3.215  -4.316
  268    HD1  TRP  35           HD1      TRP  35 -12.080   2.572  -0.597
  269    HE1  TRP  35           HE1      TRP  35 -14.564   2.955  -0.047
  270    HE3  TRP  35           HE3      TRP  35 -13.928   3.178  -5.313
  271    HZ2  TRP  35           HZ2      TRP  35 -17.022   3.446  -1.432
  272    HZ3  TRP  35           HZ3      TRP  35 -16.344   3.588  -5.673
  273    HH2  TRP  35           HH2      TRP  35 -17.893   3.727  -3.740
  274    H    SER  36           HN       SER  36 -10.955   0.656  -6.178
  275    HA   SER  36           HA       SER  36  -8.101   0.154  -6.203
  276   1HB   SER  36          HB2       SER  36  -8.373   0.178  -8.676
  277   2HB   SER  36          HB1       SER  36  -9.570  -0.852  -7.897
  278    HG   SER  36           HG       SER  36  -9.872   1.759  -8.949
  279    H    ILE  37           HN       ILE  37  -6.476   1.574  -7.122
  280    HA   ILE  37           HA       ILE  37  -7.292   4.454  -7.363
  281    HB   ILE  37           HB       ILE  37  -5.121   5.010  -6.212
  282   1HG1  ILE  37          HG12      ILE  37  -5.167   2.154  -5.214
  283   2HG1  ILE  37          HG11      ILE  37  -4.232   2.599  -6.638
  284   1HG2  ILE  37          HG21      ILE  37  -7.082   3.363  -4.585
  285   2HG2  ILE  37          HG22      ILE  37  -7.312   5.051  -5.041
  286   3HG2  ILE  37          HG23      ILE  37  -5.993   4.602  -3.960
  287   1HD1  ILE  37          HD11      ILE  37  -3.964   4.063  -4.007
  288   2HD1  ILE  37          HD12      ILE  37  -2.884   4.131  -5.399
  289   3HD1  ILE  37          HD13      ILE  37  -2.971   2.666  -4.422
  290    H    ASN  38           HN       ASN  38  -5.667   5.755  -8.547
  291    HA   ASN  38           HA       ASN  38  -4.525   4.190 -10.792
  292   1HB   ASN  38          HB2       ASN  38  -5.853   6.303 -11.192
  293   2HB   ASN  38          HB1       ASN  38  -4.559   7.200 -10.396
  294   1HD2  ASN  38          HD21      ASN  38  -4.617   8.149 -12.795
  295   2HD2  ASN  38          HD22      ASN  38  -3.557   7.404 -13.890
  296    H    LEU  39           HN       LEU  39  -2.470   3.491 -10.557
  297    HA   LEU  39           HA       LEU  39  -0.726   4.609  -8.498
  298   1HB   LEU  39          HB2       LEU  39  -0.276   2.503 -10.630
  299   2HB   LEU  39          HB1       LEU  39   0.905   2.914  -9.393
  300    HG   LEU  39           HG       LEU  39  -0.361   0.918  -8.742
  301   1HD1  LEU  39          HD11      LEU  39  -0.754   1.503  -6.534
  302   2HD1  LEU  39          HD12      LEU  39  -1.469   3.058  -6.950
  303   3HD1  LEU  39          HD13      LEU  39   0.277   2.828  -7.063
  304   1HD2  LEU  39          HD21      LEU  39  -2.455   1.772 -10.068
  305   2HD2  LEU  39          HD22      LEU  39  -2.885   2.539  -8.539
  306   3HD2  LEU  39          HD23      LEU  39  -2.688   0.793  -8.622
  307    H    THR  40           HN       THR  40   0.308   6.510  -8.890
  308    HA   THR  40           HA       THR  40   1.850   6.799 -11.405
  309    HB   THR  40           HB       THR  40   0.956   9.167 -11.655
  310    HG1  THR  40           HG1      THR  40  -1.207   8.200 -10.128
  311   1HG2  THR  40          HG21      THR  40   0.228   7.181 -13.046
  312   2HG2  THR  40          HG22      THR  40  -0.963   8.476 -12.928
  313   3HG2  THR  40          HG23      THR  40  -1.149   7.014 -11.958
  314    H    ALA  41           HN       ALA  41   0.923   9.316  -9.084
  315    HA   ALA  41           HA       ALA  41   3.781   9.422  -8.155
  316   1HB   ALA  41          HB1       ALA  41   1.716  11.621  -8.460
  317   2HB   ALA  41          HB2       ALA  41   3.205  11.428  -9.386
  318   3HB   ALA  41          HB3       ALA  41   3.279  11.838  -7.673
  319    H    GLY  42           HN       GLY  42   0.588  10.571  -6.985
  320   1HA   GLY  42          HA2       GLY  42   1.342  10.273  -4.212
  321   2HA   GLY  42          HA1       GLY  42  -0.299  10.540  -4.805
  322    H    MET  43           HN       MET  43   1.878   7.874  -5.640
  323    HA   MET  43           HA       MET  43  -0.103   5.853  -5.447
  324   1HB   MET  43          HB2       MET  43   2.907   5.708  -5.161
  325   2HB   MET  43          HB1       MET  43   1.869   4.302  -5.360
  326   1HG   MET  43          HG2       MET  43   1.415   4.792  -7.587
  327   2HG   MET  43          HG1       MET  43   1.633   6.526  -7.363
  328   1HE   MET  43          HE1       MET  43   4.482   4.137  -5.811
  329   2HE   MET  43          HE2       MET  43   5.010   3.420  -7.329
  330   3HE   MET  43          HE3       MET  43   3.341   3.219  -6.805
  331    H    TYR  44           HN       TYR  44   2.476   6.730  -3.127
  332    HA   TYR  44           HA       TYR  44   1.686   4.836  -1.132
  333   1HB   TYR  44          HB2       TYR  44   3.229   7.436  -0.917
  334   2HB   TYR  44          HB1       TYR  44   3.059   6.275   0.401
  335    HD1  TYR  44           HD1      TYR  44   4.136   4.091   0.314
  336    HD2  TYR  44           HD2      TYR  44   4.542   6.888  -2.920
  337    HE1  TYR  44           HE1      TYR  44   5.989   2.738  -0.621
  338    HE2  TYR  44           HE2      TYR  44   6.399   5.535  -3.856
  339    HH   TYR  44           HH       TYR  44   6.963   2.627  -3.394
  340    H    CYS  45           HN       CYS  45   0.910   8.299  -1.530
  341    HA   CYS  45           HA       CYS  45  -0.707   8.432   0.852
  342   1HB   CYS  45          HB2       CYS  45  -0.753  10.159  -1.641
  343   2HB   CYS  45          HB1       CYS  45  -1.551  10.553  -0.118
  344    H    ALA  46           HN       ALA  46  -1.525   8.026  -2.604
  345    HA   ALA  46           HA       ALA  46  -4.343   7.857  -2.264
  346   1HB   ALA  46          HB1       ALA  46  -3.276   8.087  -4.476
  347   2HB   ALA  46          HB2       ALA  46  -4.344   6.684  -4.440
  348   3HB   ALA  46          HB3       ALA  46  -2.598   6.467  -4.318
  349    H    ALA  47           HN       ALA  47  -1.865   5.293  -2.289
  350    HA   ALA  47           HA       ALA  47  -3.696   3.140  -1.856
  351   1HB   ALA  47          HB1       ALA  47  -1.577   2.001  -0.895
  352   2HB   ALA  47          HB2       ALA  47  -0.743   3.491  -1.338
  353   3HB   ALA  47          HB3       ALA  47  -1.528   2.518  -2.581
  354    H    LEU  48           HN       LEU  48  -1.900   5.231   0.385
  355    HA   LEU  48           HA       LEU  48  -2.525   3.852   2.778
  356   1HB   LEU  48          HB2       LEU  48  -0.852   5.645   2.661
  357   2HB   LEU  48          HB1       LEU  48  -2.118   6.825   2.336
  358    HG   LEU  48           HG       LEU  48  -3.131   6.332   4.551
  359   1HD1  LEU  48          HD11      LEU  48  -2.553   4.110   5.072
  360   2HD1  LEU  48          HD12      LEU  48  -1.513   5.039   6.146
  361   3HD1  LEU  48          HD13      LEU  48  -0.855   4.353   4.660
  362   1HD2  LEU  48          HD21      LEU  48  -1.347   7.379   5.904
  363   2HD2  LEU  48          HD22      LEU  48  -1.478   8.147   4.322
  364   3HD2  LEU  48          HD23      LEU  48  -0.173   7.005   4.642
  365    H    GLU  49           HN       GLU  49  -4.318   6.604   1.274
  366    HA   GLU  49           HA       GLU  49  -6.351   6.681   3.263
  367   1HB   GLU  49          HB2       GLU  49  -7.797   7.689   1.459
  368   2HB   GLU  49          HB1       GLU  49  -6.249   8.494   1.704
  369   1HG   GLU  49          HG2       GLU  49  -5.295   7.345  -0.203
  370   2HG   GLU  49          HG1       GLU  49  -6.766   6.397  -0.420
  371    H    SER  50           HN       SER  50  -6.031   4.642   0.381
  372    HA   SER  50           HA       SER  50  -8.675   3.527   0.568
  373   1HB   SER  50          HB2       SER  50  -7.829   1.779  -0.917
  374   2HB   SER  50          HB1       SER  50  -7.215   3.341  -1.450
  375    HG   SER  50           HG       SER  50  -5.665   2.042   0.426
  376    H    LEU  51           HN       LEU  51  -5.536   2.563   1.956
  377    HA   LEU  51           HA       LEU  51  -6.537   0.138   3.175
  378   1HB   LEU  51          HB2       LEU  51  -4.117   1.846   3.829
  379   2HB   LEU  51          HB1       LEU  51  -4.440   0.272   4.550
  380    HG   LEU  51           HG       LEU  51  -4.195   0.736   1.561
  381   1HD1  LEU  51          HD11      LEU  51  -2.128  -0.371   3.485
  382   2HD1  LEU  51          HD12      LEU  51  -2.080   1.243   2.777
  383   3HD1  LEU  51          HD13      LEU  51  -1.938  -0.177   1.742
  384   1HD2  LEU  51          HD21      LEU  51  -5.349  -1.295   1.822
  385   2HD2  LEU  51          HD22      LEU  51  -4.520  -1.693   3.326
  386   3HD2  LEU  51          HD23      LEU  51  -3.675  -1.840   1.787
  387    H    ILE  52           HN       ILE  52  -6.177   3.486   4.281
  388    HA   ILE  52           HA       ILE  52  -6.754   3.127   7.018
  389    HB   ILE  52           HB       ILE  52  -7.376   5.386   5.101
  390   1HG1  ILE  52          HG12      ILE  52  -5.001   5.004   5.615
  391   2HG1  ILE  52          HG11      ILE  52  -5.544   6.521   6.304
  392   1HG2  ILE  52          HG21      ILE  52  -7.902   5.250   8.075
  393   2HG2  ILE  52          HG22      ILE  52  -9.040   5.652   6.790
  394   3HG2  ILE  52          HG23      ILE  52  -7.743   6.773   7.199
  395   1HD1  ILE  52          HD11      ILE  52  -4.465   5.701   8.153
  396   2HD1  ILE  52          HD12      ILE  52  -4.665   4.024   7.654
  397   3HD1  ILE  52          HD13      ILE  52  -6.000   4.877   8.420
  398    H    ASN  53           HN       ASN  53  -8.793   2.589   4.304
  399    HA   ASN  53           HA       ASN  53 -11.295   2.951   5.819
  400   1HB   ASN  53          HB2       ASN  53 -10.741   1.791   3.067
  401   2HB   ASN  53          HB1       ASN  53 -12.351   2.024   3.751
  402   1HD2  ASN  53          HD21      ASN  53 -11.118   3.404   1.374
  403   2HD2  ASN  53          HD22      ASN  53 -11.183   5.062   1.736
  404    H    VAL  54           HN       VAL  54  -8.937   0.517   5.394
  405    HA   VAL  54           HA       VAL  54 -10.795  -1.713   5.987
  406    HB   VAL  54           HB       VAL  54  -7.778  -1.668   5.660
  407   1HG1  VAL  54          HG11      VAL  54  -8.144  -4.150   5.337
  408   2HG1  VAL  54          HG12      VAL  54  -9.794  -3.914   5.912
  409   3HG1  VAL  54          HG13      VAL  54  -8.432  -3.577   6.980
  410   1HG2  VAL  54          HG21      VAL  54  -8.270  -2.657   3.447
  411   2HG2  VAL  54          HG22      VAL  54  -8.989  -1.054   3.603
  412   3HG2  VAL  54          HG23      VAL  54  -9.997  -2.493   3.761
  413    H    SER  55           HN       SER  55 -11.273  -2.217   8.063
  414    HA   SER  55           HA       SER  55  -9.318  -1.464  10.223
  415   1HB   SER  55          HB2       SER  55 -12.349  -1.483  10.292
  416   2HB   SER  55          HB1       SER  55 -11.318  -1.227  11.698
  417    HG   SER  55           HG       SER  55 -12.126   0.682  10.439
  418    H    GLY  56           HN       GLY  56  -9.059  -2.971  11.910
  419   1HA   GLY  56          HA2       GLY  56  -9.481  -5.032  13.070
  420   2HA   GLY  56          HA1       GLY  56 -10.514  -5.552  11.739
  421    H    CYS  57           HN       CYS  57  -8.019  -4.407  10.069
  422    HA   CYS  57           HA       CYS  57  -6.683  -7.073   9.961
  423   1HB   CYS  57          HB2       CYS  57  -6.390  -4.699   8.097
  424   2HB   CYS  57          HB1       CYS  57  -5.783  -6.332   7.828
  425    H    SER  58           HN       SER  58  -5.369  -6.834  11.861
  426    HA   SER  58           HA       SER  58  -3.619  -4.549  12.200
  427   1HB   SER  58          HB2       SER  58  -4.365  -5.961  14.105
  428   2HB   SER  58          HB1       SER  58  -3.443  -7.309  13.446
  429    HG   SER  58           HG       SER  58  -2.212  -4.817  13.889
  430    H    ALA  59           HN       ALA  59  -3.327  -7.723  10.718
  431    HA   ALA  59           HA       ALA  59  -0.566  -8.005  10.470
  432   1HB   ALA  59          HB1       ALA  59  -2.489  -8.574   8.205
  433   2HB   ALA  59          HB2       ALA  59  -2.374  -9.591   9.641
  434   3HB   ALA  59          HB3       ALA  59  -0.980  -9.408   8.576
  435    H    ILE  60           HN       ILE  60  -2.543  -5.545   9.024
  436    HA   ILE  60           HA       ILE  60  -0.258  -4.746   7.239
  437    HB   ILE  60           HB       ILE  60  -1.942  -3.486   5.934
  438   1HG1  ILE  60          HG12      ILE  60  -3.975  -4.879   7.699
  439   2HG1  ILE  60          HG11      ILE  60  -3.554  -3.174   7.846
  440   1HG2  ILE  60          HG21      ILE  60  -2.791  -6.367   6.314
  441   2HG2  ILE  60          HG22      ILE  60  -1.331  -5.892   5.447
  442   3HG2  ILE  60          HG23      ILE  60  -2.914  -5.400   4.844
  443   1HD1  ILE  60          HD11      ILE  60  -4.153  -2.936   5.385
  444   2HD1  ILE  60          HD12      ILE  60  -5.508  -3.259   6.466
  445   3HD1  ILE  60          HD13      ILE  60  -4.836  -4.560   5.483
  446    H    GLU  61           HN       GLU  61  -1.345  -4.131  10.206
  447    HA   GLU  61           HA       GLU  61  -1.761  -1.309  10.304
  448   1HB   GLU  61          HB2       GLU  61  -1.922  -3.130  12.191
  449   2HB   GLU  61          HB1       GLU  61  -0.220  -2.794  12.446
  450   1HG   GLU  61          HG2       GLU  61  -0.753  -0.406  12.747
  451   2HG   GLU  61          HG1       GLU  61  -2.464  -0.767  12.512
  452    H    LYS  62           HN       LYS  62   1.148  -3.294  10.603
  453    HA   LYS  62           HA       LYS  62   3.042  -1.168  10.826
  454   1HB   LYS  62          HB2       LYS  62   3.294  -3.992   9.761
  455   2HB   LYS  62          HB1       LYS  62   4.672  -2.908   9.971
  456   1HG   LYS  62          HG2       LYS  62   4.128  -2.671  12.363
  457   2HG   LYS  62          HG1       LYS  62   2.751  -3.755  12.158
  458   1HD   LYS  62          HD2       LYS  62   4.267  -5.562  11.451
  459   2HD   LYS  62          HD1       LYS  62   5.650  -4.482  11.633
  460   1HE   LYS  62          HE2       LYS  62   3.748  -5.058  13.912
  461   2HE   LYS  62          HE1       LYS  62   5.176  -6.048  13.604
  462   1HZ   LYS  62          HZ1       LYS  62   6.196  -3.578  13.486
  463   2HZ   LYS  62          HZ2       LYS  62   6.184  -4.536  14.889
  464   3HZ   LYS  62          HZ3       LYS  62   4.984  -3.358  14.651
  465    H    THR  63           HN       THR  63   1.634  -2.809   8.025
  466    HA   THR  63           HA       THR  63   3.296  -1.696   6.012
  467    HB   THR  63           HB       THR  63   0.345  -2.389   5.867
  468    HG1  THR  63           HG1      THR  63   2.338  -3.914   6.396
  469   1HG2  THR  63          HG21      THR  63   0.913  -1.094   3.940
  470   2HG2  THR  63          HG22      THR  63   0.958  -2.781   3.429
  471   3HG2  THR  63          HG23      THR  63   2.461  -1.919   3.759
  472    H    GLN  64           HN       GLN  64   0.327  -0.414   7.531
  473    HA   GLN  64           HA       GLN  64   0.034   1.860   5.851
  474   1HB   GLN  64          HB2       GLN  64  -0.712   1.416   8.748
  475   2HB   GLN  64          HB1       GLN  64  -1.168   2.861   7.844
  476   1HG   GLN  64          HG2       GLN  64  -2.420   1.562   6.249
  477   2HG   GLN  64          HG1       GLN  64  -1.803   0.050   6.917
  478   1HE2  GLN  64          HE21      GLN  64  -4.635   0.690   6.758
  479   2HE2  GLN  64          HE22      GLN  64  -5.223   0.797   8.347
  480    H    ARG  65           HN       ARG  65   1.782   1.592   8.989
  481    HA   ARG  65           HA       ARG  65   2.692   4.302   8.994
  482   1HB   ARG  65          HB2       ARG  65   2.834   2.780  10.967
  483   2HB   ARG  65          HB1       ARG  65   4.109   1.878  10.147
  484   1HG   ARG  65          HG2       ARG  65   5.493   3.923  10.045
  485   2HG   ARG  65          HG1       ARG  65   4.218   4.824  10.866
  486   1HD   ARG  65          HD2       ARG  65   4.418   3.286  12.809
  487   2HD   ARG  65          HD1       ARG  65   5.744   2.457  11.992
  488    HE   ARG  65           HE       ARG  65   6.535   5.114  12.018
  489   1HH1  ARG  65          HH21      ARG  65   5.469   2.790  14.328
  490   2HH1  ARG  65          HH22      ARG  65   6.384   3.470  15.632
  491   1HH2  ARG  65          HH11      ARG  65   7.738   6.015  13.706
  492   2HH2  ARG  65          HH12      ARG  65   7.671   5.294  15.279
  493    H    MET  66           HN       MET  66   4.103   1.340   7.649
  494    HA   MET  66           HA       MET  66   6.558   2.482   6.761
  495   1HB   MET  66          HB2       MET  66   4.896   0.163   5.739
  496   2HB   MET  66          HB1       MET  66   6.496   0.546   5.105
  497   1HG   MET  66          HG2       MET  66   7.561  -0.282   6.964
  498   2HG   MET  66          HG1       MET  66   6.387   0.423   8.072
  499   1HE   MET  66          HE1       MET  66   6.290  -3.551   5.871
  500   2HE   MET  66          HE2       MET  66   7.148  -2.067   5.466
  501   3HE   MET  66          HE3       MET  66   5.445  -2.236   5.043
  502    H    LEU  67           HN       LEU  67   3.363   2.252   5.224
  503    HA   LEU  67           HA       LEU  67   4.154   3.461   2.724
  504   1HB   LEU  67          HB2       LEU  67   1.479   3.254   4.130
  505   2HB   LEU  67          HB1       LEU  67   1.667   3.935   2.518
  506    HG   LEU  67           HG       LEU  67   2.596   1.143   3.254
  507   1HD1  LEU  67          HD11      LEU  67   0.200   1.213   3.583
  508   2HD1  LEU  67          HD12      LEU  67   0.506   0.421   2.037
  509   3HD1  LEU  67          HD13      LEU  67  -0.025   2.102   2.076
  510   1HD2  LEU  67          HD21      LEU  67   2.290   2.701   0.677
  511   2HD2  LEU  67          HD22      LEU  67   2.252   0.940   0.671
  512   3HD2  LEU  67          HD23      LEU  67   3.684   1.783   1.246
  513    H    SER  68           HN       SER  68   2.973   4.698   5.808
  514    HA   SER  68           HA       SER  68   2.497   7.383   5.041
  515   1HB   SER  68          HB2       SER  68   3.477   6.284   7.688
  516   2HB   SER  68          HB1       SER  68   2.896   7.928   7.443
  517    HG   SER  68           HG       SER  68   1.144   6.221   6.386
  518    H    GLY  69           HN       GLY  69   5.492   5.740   5.999
  519   1HA   GLY  69          HA2       GLY  69   7.199   7.941   6.295
  520   2HA   GLY  69          HA1       GLY  69   7.721   6.406   5.596
  521    H    PHE  70           HN       PHE  70   5.776   6.634   3.360
  522    HA   PHE  70           HA       PHE  70   7.379   8.472   1.654
  523   1HB   PHE  70          HB2       PHE  70   5.329   6.338   0.994
  524   2HB   PHE  70          HB1       PHE  70   6.147   7.330  -0.212
  525    HD1  PHE  70           HD1      PHE  70   8.532   7.060  -0.667
  526    HD2  PHE  70           HD2      PHE  70   6.542   4.628   2.262
  527    HE1  PHE  70           HE1      PHE  70  10.472   5.515  -0.629
  528    HE2  PHE  70           HE2      PHE  70   8.483   3.085   2.300
  529    HZ   PHE  70           HZ       PHE  70  10.447   3.529   0.853
  530    H    CYS  71           HN       CYS  71   4.612   8.591   3.484
  531    HA   CYS  71           HA       CYS  71   3.468  10.809   1.826
  532   1HB   CYS  71          HB2       CYS  71   2.137   8.635   1.683
  533   2HB   CYS  71          HB1       CYS  71   1.790   8.847   3.397
  534    HA   PRO  72           HA       PRO  72   4.732  12.065   6.178
  535   1HB   PRO  72          HB2       PRO  72   4.573  14.714   4.831
  536   2HB   PRO  72          HB1       PRO  72   5.861  14.039   5.840
  537   1HG   PRO  72          HG2       PRO  72   6.066  14.272   3.125
  538   2HG   PRO  72          HG1       PRO  72   6.909  13.024   4.053
  539   1HD   PRO  72          HD2       PRO  72   4.589  12.743   2.225
  540   2HD   PRO  72          HD1       PRO  72   5.750  11.501   2.765
  541    H    HIS  73           HN       HIS  73   2.011  13.059   4.162
  542    HA   HIS  73           HA       HIS  73   0.710  14.367   6.498
  543   1HB   HIS  73          HB2       HIS  73  -0.744  15.387   5.006
  544   2HB   HIS  73          HB1       HIS  73   0.665  15.181   3.973
  545    HD1  HIS  73           HD1      HIS  73  -2.825  13.968   4.513
  546    HD2  HIS  73           HD2      HIS  73   0.363  13.159   1.960
  547    HE1  HIS  73           HE1      HIS  73  -3.757  12.549   2.633
  548    H    LYS  74           HN       LYS  74  -0.392  13.105   7.876
  549    HA   LYS  74           HA       LYS  74  -1.197  10.398   7.152
  550   1HB   LYS  74          HB2       LYS  74  -1.745  12.057   9.633
  551   2HB   LYS  74          HB1       LYS  74  -2.111  10.339   9.468
  552   1HG   LYS  74          HG2       LYS  74   0.277   9.867   9.054
  553   2HG   LYS  74          HG1       LYS  74   0.644  11.584   9.223
  554   1HD   LYS  74          HD2       LYS  74  -0.211  11.542  11.537
  555   2HD   LYS  74          HD1       LYS  74  -0.576   9.825  11.370
  556   1HE   LYS  74          HE2       LYS  74   1.595  10.198  12.517
  557   2HE   LYS  74          HE1       LYS  74   1.797   9.332  10.994
  558   1HZ   LYS  74          HZ1       LYS  74   2.038  12.275  11.192
  559   2HZ   LYS  74          HZ2       LYS  74   2.545  11.265   9.924
  560   3HZ   LYS  74          HZ3       LYS  74   3.364  11.241  11.412
  561    H    VAL  75           HN       VAL  75  -3.210   9.723   6.525
  562    HA   VAL  75           HA       VAL  75  -5.385  11.786   6.363
  563    HB   VAL  75           HB       VAL  75  -4.393  10.905   4.196
  564   1HG1  VAL  75          HG11      VAL  75  -5.956   8.398   4.813
  565   2HG1  VAL  75          HG12      VAL  75  -4.239   8.524   5.191
  566   3HG1  VAL  75          HG13      VAL  75  -4.786   8.674   3.523
  567   1HG2  VAL  75          HG21      VAL  75  -7.328  10.444   4.806
  568   2HG2  VAL  75          HG22      VAL  75  -6.653  10.524   3.178
  569   3HG2  VAL  75          HG23      VAL  75  -6.591  11.939   4.229
  570    H    SER  76           HN       SER  76  -7.216  11.357   7.475
  571    HA   SER  76           HA       SER  76  -7.459   8.727   8.837
  572   1HB   SER  76          HB2       SER  76  -9.186   9.826  10.183
  573   2HB   SER  76          HB1       SER  76  -7.725  10.810  10.165
  574    HG   SER  76           HG       SER  76  -9.920  11.795   9.691
  575    H    ALA  77           HN       ALA  77  -9.855   7.932   8.980
  576    HA   ALA  77           HA       ALA  77 -10.715   7.220   6.364
  577   1HB   ALA  77          HB1       ALA  77 -12.625   6.223   7.419
  578   2HB   ALA  77          HB2       ALA  77 -12.489   7.291   8.816
  579   3HB   ALA  77          HB3       ALA  77 -11.281   6.034   8.545
  580    H    GLY  78           HN       GLY  78 -11.896   9.767   8.558
  581   1HA   GLY  78          HA2       GLY  78 -14.092  10.610   6.969
  582   2HA   GLY  78          HA1       GLY  78 -13.227  11.641   8.109
  583    H    GLN  79           HN       GLN  79 -10.658  11.534   6.855
  584    HA   GLN  79           HA       GLN  79 -11.162  13.432   4.655
  585   1HB   GLN  79          HB2       GLN  79  -8.643  12.520   6.069
  586   2HB   GLN  79          HB1       GLN  79  -8.650  13.686   4.746
  587   1HG   GLN  79          HG2       GLN  79 -10.069  15.197   6.010
  588   2HG   GLN  79          HG1       GLN  79 -10.253  14.006   7.297
  589   1HE2  GLN  79          HE21      GLN  79  -9.147  16.633   7.760
  590   2HE2  GLN  79          HE22      GLN  79  -7.521  16.441   8.206
  591    H    PHE  80           HN       PHE  80 -10.864  12.985   2.514
  592    HA   PHE  80           HA       PHE  80  -9.530  10.408   1.743
  593   1HB   PHE  80          HB2       PHE  80 -12.110  11.580   0.671
  594   2HB   PHE  80          HB1       PHE  80 -11.227  10.275  -0.118
  595    HD1  PHE  80           HD1      PHE  80 -13.479  11.174   2.572
  596    HD2  PHE  80           HD2      PHE  80 -10.821   8.109   1.139
  597    HE1  PHE  80           HE1      PHE  80 -14.546   9.535   4.098
  598    HE2  PHE  80           HE2      PHE  80 -11.911   6.473   2.644
  599    HZ   PHE  80           HZ       PHE  80 -13.770   7.181   4.123
  600    H    SER  81           HN       SER  81  -8.457  10.486  -0.323
  601    HA   SER  81           HA       SER  81  -8.025  13.265  -1.387
  602   1HB   SER  81          HB2       SER  81  -6.026  11.003  -1.162
  603   2HB   SER  81          HB1       SER  81  -5.716  12.579  -1.884
  604    HG   SER  81           HG       SER  81  -6.832  12.835   0.559
  605    H    SER  82           HN       SER  82  -7.750   9.798  -2.332
  606    HA   SER  82           HA       SER  82  -8.156  10.639  -5.178
  607   1HB   SER  82          HB2       SER  82  -6.143   9.239  -4.421
  608   2HB   SER  82          HB1       SER  82  -7.284   7.911  -4.235
  609    HG   SER  82           HG       SER  82  -7.016   7.666  -6.304
  610    H    LEU  83           HN       LEU  83 -10.090   9.478  -2.703
  611    HA   LEU  83           HA       LEU  83 -11.561   7.538  -4.379
  612   1HB   LEU  83          HB2       LEU  83 -11.825   8.519  -1.541
  613   2HB   LEU  83          HB1       LEU  83 -13.168   7.665  -2.298
  614    HG   LEU  83           HG       LEU  83 -11.545   5.806  -2.878
  615   1HD1  LEU  83          HD11      LEU  83  -9.445   6.977  -2.757
  616   2HD1  LEU  83          HD12      LEU  83  -9.450   5.787  -1.456
  617   3HD1  LEU  83          HD13      LEU  83  -9.759   7.486  -1.097
  618   1HD2  LEU  83          HD21      LEU  83 -12.130   6.577  -0.015
  619   2HD2  LEU  83          HD22      LEU  83 -11.349   5.049  -0.419
  620   3HD2  LEU  83          HD23      LEU  83 -12.968   5.400  -1.023
  621    H    HIS  84           HN       HIS  84 -11.359  10.530  -5.015
  622    HA   HIS  84           HA       HIS  84 -14.093  11.516  -4.733
  623   1HB   HIS  84          HB2       HIS  84 -12.014  12.495  -6.705
  624   2HB   HIS  84          HB1       HIS  84 -13.375  13.393  -6.036
  625    HD1  HIS  84           HD1      HIS  84 -12.423  11.796  -3.159
  626    HD2  HIS  84           HD2      HIS  84 -10.502  14.728  -5.415
  627    HE1  HIS  84           HE1      HIS  84 -10.767  12.925  -1.611
  628    H    VAL  85           HN       VAL  85 -12.160   9.960  -7.250
  629    HA   VAL  85           HA       VAL  85 -14.251  10.089  -9.261
  630    HB   VAL  85           HB       VAL  85 -12.806   8.419 -10.462
  631   1HG1  VAL  85          HG11      VAL  85 -10.908   9.941 -10.775
  632   2HG1  VAL  85          HG12      VAL  85 -11.301  10.769  -9.268
  633   3HG1  VAL  85          HG13      VAL  85 -12.403  10.868 -10.642
  634   1HG2  VAL  85          HG21      VAL  85 -10.633   7.835  -9.434
  635   2HG2  VAL  85          HG22      VAL  85 -11.974   7.230  -8.462
  636   3HG2  VAL  85          HG23      VAL  85 -11.104   8.680  -7.960
  637    H    ARG  86           HN       ARG  86 -15.575   8.286  -9.948
  638    HA   ARG  86           HA       ARG  86 -16.303   6.508  -7.699
  639   1HB   ARG  86          HB2       ARG  86 -17.553   7.045 -10.405
  640   2HB   ARG  86          HB1       ARG  86 -18.187   5.861  -9.261
  641   1HG   ARG  86          HG2       ARG  86 -18.441   7.629  -7.562
  642   2HG   ARG  86          HG1       ARG  86 -17.804   8.817  -8.701
  643   1HD   ARG  86          HD2       ARG  86 -20.259   8.890  -8.689
  644   2HD   ARG  86          HD1       ARG  86 -19.673   8.320 -10.249
  645    HE   ARG  86           HE       ARG  86 -20.091   5.997  -8.772
  646   1HH1  ARG  86          HH21      ARG  86 -21.909   8.780  -9.690
  647   2HH1  ARG  86          HH22      ARG  86 -23.427   7.947  -9.709
  648   1HH2  ARG  86          HH11      ARG  86 -22.066   4.893  -8.795
  649   2HH2  ARG  86          HH12      ARG  86 -23.515   5.749  -9.203
  650    H    ASP  87           HN       ASP  87 -14.151   5.367  -7.999
  651    HA   ASP  87           HA       ASP  87 -13.923   3.605 -10.338
  652   1HB   ASP  87          HB2       ASP  87 -12.313   3.889  -7.788
  653   2HB   ASP  87          HB1       ASP  87 -11.962   2.669  -9.012
  654    H    THR  88           HN       THR  88 -13.575   1.188  -9.853
  655    HA   THR  88           HA       THR  88 -15.866   0.255  -8.214
  656    HB   THR  88           HB       THR  88 -14.027  -1.376  -9.988
  657    HG1  THR  88           HG1      THR  88 -14.960   0.226 -11.231
  658   1HG2  THR  88          HG21      THR  88 -16.071  -2.829 -10.106
  659   2HG2  THR  88          HG22      THR  88 -16.817  -1.794  -8.889
  660   3HG2  THR  88          HG23      THR  88 -15.370  -2.721  -8.491
  661    H    LYS  89           HN       LYS  89 -15.579  -1.364  -6.560
  662    HA   LYS  89           HA       LYS  89 -13.009  -1.123  -5.153
  663   1HB   LYS  89          HB2       LYS  89 -15.492  -2.720  -4.462
  664   2HB   LYS  89          HB1       LYS  89 -14.098  -2.500  -3.410
  665   1HG   LYS  89          HG2       LYS  89 -14.482  -0.064  -3.400
  666   2HG   LYS  89          HG1       LYS  89 -15.884  -0.286  -4.453
  667   1HD   LYS  89          HD2       LYS  89 -16.940  -1.725  -2.746
  668   2HD   LYS  89          HD1       LYS  89 -15.546  -1.498  -1.694
  669   1HE   LYS  89          HE2       LYS  89 -16.993   0.923  -2.720
  670   2HE   LYS  89          HE1       LYS  89 -17.689   0.010  -1.383
  671   1HZ   LYS  89          HZ1       LYS  89 -16.255   1.734  -0.547
  672   2HZ   LYS  89          HZ2       LYS  89 -14.954   1.162  -1.478
  673   3HZ   LYS  89          HZ3       LYS  89 -15.572   0.219  -0.207
  674    H    ILE  90           HN       ILE  90 -11.701  -2.931  -4.564
  675    HA   ILE  90           HA       ILE  90 -12.130  -5.445  -6.122
  676    HB   ILE  90           HB       ILE  90  -9.703  -5.474  -6.652
  677   1HG1  ILE  90          HG12      ILE  90  -9.721  -2.615  -5.626
  678   2HG1  ILE  90          HG11      ILE  90  -9.022  -3.972  -4.745
  679   1HG2  ILE  90          HG21      ILE  90 -11.052  -2.924  -7.585
  680   2HG2  ILE  90          HG22      ILE  90 -11.416  -4.526  -8.226
  681   3HG2  ILE  90          HG23      ILE  90  -9.807  -3.837  -8.438
  682   1HD1  ILE  90          HD11      ILE  90  -7.620  -4.423  -6.835
  683   2HD1  ILE  90          HD12      ILE  90  -7.203  -2.978  -5.915
  684   3HD1  ILE  90          HD13      ILE  90  -8.141  -2.836  -7.402
  685    H    GLU  91           HN       GLU  91 -10.917  -7.281  -5.178
  686    HA   GLU  91           HA       GLU  91 -11.138  -7.350  -2.318
  687   1HB   GLU  91          HB2       GLU  91  -9.788  -9.210  -4.292
  688   2HB   GLU  91          HB1       GLU  91  -9.922  -9.559  -2.567
  689   1HG   GLU  91          HG2       GLU  91 -12.363  -9.418  -2.696
  690   2HG   GLU  91          HG1       GLU  91 -12.267  -8.993  -4.405
  691    H    VAL  92           HN       VAL  92  -9.492  -7.343  -0.722
  692    HA   VAL  92           HA       VAL  92  -7.344  -5.538  -1.114
  693    HB   VAL  92           HB       VAL  92  -7.765  -7.697   0.968
  694   1HG1  VAL  92          HG11      VAL  92  -5.414  -7.315   1.001
  695   2HG1  VAL  92          HG12      VAL  92  -6.063  -6.284   2.277
  696   3HG1  VAL  92          HG13      VAL  92  -5.615  -5.584   0.721
  697   1HG2  VAL  92          HG21      VAL  92  -7.934  -4.704   1.330
  698   2HG2  VAL  92          HG22      VAL  92  -8.657  -5.976   2.314
  699   3HG2  VAL  92          HG23      VAL  92  -9.312  -5.617   0.717
  700    H    ALA  93           HN       ALA  93  -7.367  -9.105  -1.246
  701    HA   ALA  93           HA       ALA  93  -4.602  -9.562  -1.450
  702   1HB   ALA  93          HB1       ALA  93  -6.634 -11.031  -3.138
  703   2HB   ALA  93          HB2       ALA  93  -6.497 -11.286  -1.398
  704   3HB   ALA  93          HB3       ALA  93  -5.133 -11.655  -2.453
  705    H    GLN  94           HN       GLN  94  -6.884  -8.581  -3.991
  706    HA   GLN  94           HA       GLN  94  -4.887  -8.674  -6.104
  707   1HB   GLN  94          HB2       GLN  94  -7.593  -7.310  -5.922
  708   2HB   GLN  94          HB1       GLN  94  -6.612  -7.357  -7.386
  709   1HG   GLN  94          HG2       GLN  94  -6.664  -9.826  -7.341
  710   2HG   GLN  94          HG1       GLN  94  -7.651  -9.776  -5.881
  711   1HE2  GLN  94          HE21      GLN  94  -8.298 -10.749  -8.724
  712   2HE2  GLN  94          HE22      GLN  94  -9.723  -9.922  -9.130
  713    H    PHE  95           HN       PHE  95  -6.152  -6.238  -3.899
  714    HA   PHE  95           HA       PHE  95  -4.994  -3.923  -5.075
  715   1HB   PHE  95          HB2       PHE  95  -6.631  -3.790  -3.256
  716   2HB   PHE  95          HB1       PHE  95  -5.499  -4.576  -2.157
  717    HD1  PHE  95           HD1      PHE  95  -6.341  -1.470  -3.916
  718    HD2  PHE  95           HD2      PHE  95  -3.476  -3.421  -1.379
  719    HE1  PHE  95           HE1      PHE  95  -5.330   0.725  -3.364
  720    HE2  PHE  95           HE2      PHE  95  -2.466  -1.226  -0.831
  721    HZ   PHE  95           HZ       PHE  95  -3.392   0.844  -1.823
  722    H    VAL  96           HN       VAL  96  -3.690  -6.067  -2.514
  723    HA   VAL  96           HA       VAL  96  -1.206  -4.706  -2.232
  724    HB   VAL  96           HB       VAL  96  -1.838  -7.645  -1.835
  725   1HG1  VAL  96          HG11      VAL  96   0.159  -7.388  -0.206
  726   2HG1  VAL  96          HG12      VAL  96   0.548  -5.934  -1.123
  727   3HG1  VAL  96          HG13      VAL  96   0.522  -7.504  -1.927
  728   1HG2  VAL  96          HG21      VAL  96  -3.237  -6.251  -0.433
  729   2HG2  VAL  96          HG22      VAL  96  -1.857  -5.254   0.029
  730   3HG2  VAL  96          HG23      VAL  96  -1.958  -6.928   0.576
  731    H    LYS  97           HN       LYS  97  -2.047  -7.541  -4.260
  732    HA   LYS  97           HA       LYS  97   0.544  -7.881  -5.378
  733   1HB   LYS  97          HB2       LYS  97  -2.204  -8.521  -6.479
  734   2HB   LYS  97          HB1       LYS  97  -0.706  -9.008  -7.277
  735   1HG   LYS  97          HG2       LYS  97  -0.003 -10.206  -5.236
  736   2HG   LYS  97          HG1       LYS  97  -1.499  -9.725  -4.438
  737   1HD   LYS  97          HD2       LYS  97  -2.804 -10.945  -6.144
  738   2HD   LYS  97          HD1       LYS  97  -1.305 -11.429  -6.938
  739   1HE   LYS  97          HE2       LYS  97  -0.591 -12.598  -4.881
  740   2HE   LYS  97          HE1       LYS  97  -2.097 -12.125  -4.094
  741   1HZ   LYS  97          HZ1       LYS  97  -1.655 -14.064  -6.252
  742   2HZ   LYS  97          HZ2       LYS  97  -3.140 -13.239  -6.186
  743   3HZ   LYS  97          HZ3       LYS  97  -2.633 -14.190  -4.872
  744    H    ASP  98           HN       ASP  98  -2.207  -5.900  -6.545
  745    HA   ASP  98           HA       ASP  98  -0.920  -4.996  -8.929
  746   1HB   ASP  98          HB2       ASP  98  -2.979  -3.659  -7.147
  747   2HB   ASP  98          HB1       ASP  98  -2.463  -3.000  -8.700
  748    H    LEU  99           HN       LEU  99  -0.868  -3.810  -5.606
  749    HA   LEU  99           HA       LEU  99   0.679  -1.461  -6.066
  750   1HB   LEU  99          HB2       LEU  99  -0.539  -1.888  -3.959
  751   2HB   LEU  99          HB1       LEU  99   0.541  -3.234  -3.603
  752    HG   LEU  99           HG       LEU  99   2.463  -1.658  -3.580
  753   1HD1  LEU  99          HD11      LEU  99   1.695   0.844  -3.339
  754   2HD1  LEU  99          HD12      LEU  99   0.279   0.310  -4.245
  755   3HD1  LEU  99          HD13      LEU  99   1.888   0.159  -4.951
  756   1HD2  LEU  99          HD21      LEU  99   0.164  -0.888  -1.759
  757   2HD2  LEU  99          HD22      LEU  99   1.869  -0.556  -1.452
  758   3HD2  LEU  99          HD23      LEU  99   1.289  -2.220  -1.491
  759    H    LEU 100           HN       LEU 100   1.592  -4.829  -5.433
  760    HA   LEU 100           HA       LEU 100   4.364  -4.490  -5.033
  761   1HB   LEU 100          HB2       LEU 100   3.313  -6.629  -4.637
  762   2HB   LEU 100          HB1       LEU 100   2.841  -6.766  -6.327
  763    HG   LEU 100           HG       LEU 100   5.166  -6.960  -7.023
  764   1HD1  LEU 100          HD11      LEU 100   6.903  -7.152  -5.095
  765   2HD1  LEU 100          HD12      LEU 100   5.709  -6.281  -4.132
  766   3HD1  LEU 100          HD13      LEU 100   6.384  -5.541  -5.581
  767   1HD2  LEU 100          HD21      LEU 100   4.362  -8.709  -4.689
  768   2HD2  LEU 100          HD22      LEU 100   5.811  -9.019  -5.644
  769   3HD2  LEU 100          HD23      LEU 100   4.223  -9.063  -6.411
  770    H    LEU 101           HN       LEU 101   2.621  -4.883  -8.155
  771    HA   LEU 101           HA       LEU 101   4.981  -4.986  -9.752
  772   1HB   LEU 101          HB2       LEU 101   2.161  -4.086 -10.323
  773   2HB   LEU 101          HB1       LEU 101   3.406  -3.934 -11.556
  774    HG   LEU 101           HG       LEU 101   2.001  -6.073 -11.616
  775   1HD1  LEU 101          HD11      LEU 101   3.781  -7.373 -12.422
  776   2HD1  LEU 101          HD12      LEU 101   4.928  -6.713 -11.262
  777   3HD1  LEU 101          HD13      LEU 101   4.373  -5.726 -12.613
  778   1HD2  LEU 101          HD21      LEU 101   3.772  -6.918  -9.315
  779   2HD2  LEU 101          HD22      LEU 101   2.421  -7.797 -10.027
  780   3HD2  LEU 101          HD23      LEU 101   2.126  -6.340  -9.089
  781    H    HIS 102           HN       HIS 102   3.073  -2.144  -8.719
  782    HA   HIS 102           HA       HIS 102   4.787  -0.276 -10.097
  783   1HB   HIS 102          HB2       HIS 102   2.684   0.006  -7.957
  784   2HB   HIS 102          HB1       HIS 102   3.662   1.393  -8.440
  785    HD1  HIS 102           HD1      HIS 102   3.371   2.291 -10.852
  786    HD2  HIS 102           HD2      HIS 102   0.872  -0.913  -9.943
  787    HE1  HIS 102           HE1      HIS 102   1.696   2.142 -12.743
  788    H    LEU 103           HN       LEU 103   4.795  -1.453  -6.716
  789    HA   LEU 103           HA       LEU 103   6.688   0.420  -5.737
  790   1HB   LEU 103          HB2       LEU 103   6.267  -2.487  -5.000
  791   2HB   LEU 103          HB1       LEU 103   7.338  -1.409  -4.110
  792    HG   LEU 103           HG       LEU 103   4.394  -0.878  -4.584
  793   1HD1  LEU 103          HD11      LEU 103   4.528  -2.800  -3.169
  794   2HD1  LEU 103          HD12      LEU 103   4.261  -1.430  -2.091
  795   3HD1  LEU 103          HD13      LEU 103   5.875  -2.120  -2.256
  796   1HD2  LEU 103          HD21      LEU 103   5.267   1.226  -4.103
  797   2HD2  LEU 103          HD22      LEU 103   6.604   0.579  -3.154
  798   3HD2  LEU 103          HD23      LEU 103   4.983   0.646  -2.466
  799    H    LYS 104           HN       LYS 104   7.331  -2.814  -7.138
  800    HA   LYS 104           HA       LYS 104  10.190  -2.481  -7.060
  801   1HB   LYS 104          HB2       LYS 104  10.237  -4.438  -8.560
  802   2HB   LYS 104          HB1       LYS 104   9.135  -4.694  -7.206
  803   1HG   LYS 104          HG2       LYS 104   7.286  -3.821  -8.748
  804   2HG   LYS 104          HG1       LYS 104   8.442  -4.014 -10.066
  805   1HD   LYS 104          HD2       LYS 104   7.482  -6.188  -8.181
  806   2HD   LYS 104          HD1       LYS 104   7.070  -6.027  -9.888
  807   1HE   LYS 104          HE2       LYS 104   8.803  -7.573 -10.009
  808   2HE   LYS 104          HE1       LYS 104   9.705  -6.071 -10.201
  809   1HZ   LYS 104          HZ1       LYS 104   9.225  -7.243  -7.534
  810   2HZ   LYS 104          HZ2       LYS 104  10.420  -6.133  -8.006
  811   3HZ   LYS 104          HZ3       LYS 104  10.525  -7.756  -8.493
  812    H    LYS 105           HN       LYS 105   7.735  -1.498  -9.368
  813    HA   LYS 105           HA       LYS 105   9.418  -1.169 -11.651
  814   1HB   LYS 105          HB2       LYS 105   6.936  -1.075 -11.731
  815   2HB   LYS 105          HB1       LYS 105   6.983   0.464 -10.870
  816   1HG   LYS 105          HG2       LYS 105   8.304   1.456 -12.709
  817   2HG   LYS 105          HG1       LYS 105   8.258  -0.082 -13.570
  818   1HD   LYS 105          HD2       LYS 105   5.846   0.039 -13.774
  819   2HD   LYS 105          HD1       LYS 105   5.790   1.475 -12.750
  820   1HE   LYS 105          HE2       LYS 105   5.636   2.180 -15.070
  821   2HE   LYS 105          HE1       LYS 105   7.210   2.664 -14.440
  822   1HZ   LYS 105          HZ1       LYS 105   6.549   0.506 -16.325
  823   2HZ   LYS 105          HZ2       LYS 105   7.936   0.369 -15.353
  824   3HZ   LYS 105          HZ3       LYS 105   7.770   1.680 -16.421
  825    H    LEU 106           HN       LEU 106   8.536   1.170  -9.082
  826    HA   LEU 106           HA       LEU 106  10.052   3.338 -10.146
  827   1HB   LEU 106          HB2       LEU 106   9.070   2.650  -7.379
  828   2HB   LEU 106          HB1       LEU 106  10.118   4.042  -7.615
  829    HG   LEU 106           HG       LEU 106   7.559   4.426  -7.651
  830   1HD1  LEU 106          HD11      LEU 106   8.759   6.297  -8.275
  831   2HD1  LEU 106          HD12      LEU 106   7.889   5.984  -9.774
  832   3HD1  LEU 106          HD13      LEU 106   9.571   5.487  -9.609
  833   1HD2  LEU 106          HD21      LEU 106   7.818   3.536 -10.534
  834   2HD2  LEU 106          HD22      LEU 106   6.359   3.962  -9.648
  835   3HD2  LEU 106          HD23      LEU 106   7.206   2.469  -9.274
  836    H    PHE 107           HN       PHE 107  11.006   0.543  -8.250
  837    HA   PHE 107           HA       PHE 107  13.548   1.478  -7.368
  838   1HB   PHE 107          HB2       PHE 107  12.556  -0.671  -6.600
  839   2HB   PHE 107          HB1       PHE 107  12.805  -1.342  -8.213
  840    HD1  PHE 107           HD1      PHE 107  14.646   0.369  -5.451
  841    HD2  PHE 107           HD2      PHE 107  14.862  -2.382  -8.739
  842    HE1  PHE 107           HE1      PHE 107  16.993  -0.133  -4.865
  843    HE2  PHE 107           HE2      PHE 107  17.218  -2.897  -8.150
  844    HZ   PHE 107           HZ       PHE 107  18.285  -1.772  -6.212
  845    H    ARG 108           HN       ARG 108  12.527  -0.008 -10.413
  846    HA   ARG 108           HA       ARG 108  15.088  -0.328 -11.594
  847   1HB   ARG 108          HB2       ARG 108  12.374   0.226 -12.818
  848   2HB   ARG 108          HB1       ARG 108  13.808  -0.156 -13.772
  849   1HG   ARG 108          HG2       ARG 108  14.052  -2.292 -12.565
  850   2HG   ARG 108          HG1       ARG 108  12.619  -1.915 -11.607
  851   1HD   ARG 108          HD2       ARG 108  11.926  -3.362 -13.416
  852   2HD   ARG 108          HD1       ARG 108  11.319  -1.744 -13.760
  853    HE   ARG 108           HE       ARG 108  13.792  -1.851 -15.039
  854   1HH1  ARG 108          HH21      ARG 108  10.863  -3.670 -15.013
  855   2HH1  ARG 108          HH22      ARG 108  11.024  -4.203 -16.653
  856   1HH2  ARG 108          HH11      ARG 108  14.015  -2.530 -17.182
  857   2HH2  ARG 108          HH12      ARG 108  12.808  -3.556 -17.882
  858    H    GLU 109           HN       GLU 109  12.919   2.498 -11.515
  859    HA   GLU 109           HA       GLU 109  14.746   4.061 -13.208
  860   1HB   GLU 109          HB2       GLU 109  12.220   4.780 -11.696
  861   2HB   GLU 109          HB1       GLU 109  13.118   5.915 -12.705
  862   1HG   GLU 109          HG2       GLU 109  12.811   4.456 -14.656
  863   2HG   GLU 109          HG1       GLU 109  11.953   3.282 -13.657
  864    H    GLY 110           HN       GLY 110  14.535   3.346  -9.859
  865   1HA   GLY 110          HA2       GLY 110  15.830   4.150  -8.072
  866   2HA   GLY 110          HA1       GLY 110  16.769   5.068  -9.254
  867    H    ARG 111           HN       ARG 111  13.633   5.848  -9.850
  868    HA   ARG 111           HA       ARG 111  13.858   8.379  -8.298
  869   1HB   ARG 111          HB2       ARG 111  12.029   7.509 -10.562
  870   2HB   ARG 111          HB1       ARG 111  11.885   9.058  -9.731
  871   1HG   ARG 111          HG2       ARG 111  14.209   9.604 -10.358
  872   2HG   ARG 111          HG1       ARG 111  14.338   8.073 -11.218
  873   1HD   ARG 111          HD2       ARG 111  12.321   8.798 -12.577
  874   2HD   ARG 111          HD1       ARG 111  12.497  10.396 -11.863
  875    HE   ARG 111           HE       ARG 111  13.993   9.338 -14.071
  876   1HH1  ARG 111          HH21      ARG 111  14.470  11.126 -11.152
  877   2HH1  ARG 111          HH22      ARG 111  16.025  11.718 -11.629
  878   1HH2  ARG 111          HH11      ARG 111  15.994  10.119 -14.697
  879   2HH2  ARG 111          HH12      ARG 111  16.880  11.157 -13.632
  880    H    PHE 112           HN       PHE 112  13.175   7.888  -6.246
  881    HA   PHE 112           HA       PHE 112  10.803   6.184  -5.825
  882   1HB   PHE 112          HB2       PHE 112  12.601   7.597  -3.836
  883   2HB   PHE 112          HB1       PHE 112  11.441   6.311  -3.479
  884    HD1  PHE 112           HD1      PHE 112  11.779   4.028  -4.372
  885    HD2  PHE 112           HD2      PHE 112  14.723   7.107  -4.885
  886    HE1  PHE 112           HE1      PHE 112  13.463   2.322  -4.995
  887    HE2  PHE 112           HE2      PHE 112  16.404   5.393  -5.517
  888    HZ   PHE 112           HZ       PHE 112  15.772   2.999  -5.563
  889    H    ASN 113           HN       ASN 113   8.797   6.999  -5.570
  890    HA   ASN 113           HA       ASN 113   8.355   9.572  -4.249
  891   1HB   ASN 113          HB2       ASN 113   8.863  10.086  -6.707
  892   2HB   ASN 113          HB1       ASN 113   7.346   9.267  -7.082
  893   1HD2  ASN 113          HD21      ASN 113   7.517  11.992  -7.698
  894   2HD2  ASN 113          HD22      ASN 113   6.565  12.889  -6.616
  Start of MODEL   27
    1   1H    MET   1           HT1      MET   1  22.201   6.424  15.292
    2   2H    MET   1           HT2      MET   1  20.624   6.015  14.809
    3   3H    MET   1           HT3      MET   1  21.044   7.642  15.059
    4    HA   MET   1           HA       MET   1  22.721   7.382  13.224
    5   1HB   MET   1          HB2       MET   1  21.116   4.829  12.928
    6   2HB   MET   1          HB1       MET   1  22.107   5.507  11.636
    7   1HG   MET   1          HG2       MET   1  24.077   5.442  13.169
    8   2HG   MET   1          HG1       MET   1  23.072   4.645  14.377
    9   1HE   MET   1          HE1       MET   1  21.713   2.786  14.027
   10   2HE   MET   1          HE2       MET   1  22.299   1.295  13.296
   11   3HE   MET   1          HE3       MET   1  21.289   2.389  12.356
   12    H    GLY   2           HN       GLY   2  21.939   7.914  10.990
   13   1HA   GLY   2          HA2       GLY   2  19.542   9.512  11.125
   14   2HA   GLY   2          HA1       GLY   2  20.499   9.226   9.670
   15    HA   PRO   3           HA       PRO   3  16.341   6.733   9.900
   16   1HB   PRO   3          HB2       PRO   3  15.502   8.111   7.497
   17   2HB   PRO   3          HB1       PRO   3  14.755   8.158   9.097
   18   1HG   PRO   3          HG2       PRO   3  16.385  10.195   7.792
   19   2HG   PRO   3          HG1       PRO   3  15.454  10.319   9.289
   20   1HD   PRO   3          HD2       PRO   3  18.283  10.244   9.088
   21   2HD   PRO   3          HD1       PRO   3  17.335  10.035  10.581
   22    H    VAL   4           HN       VAL   4  15.497   5.518   7.751
   23    HA   VAL   4           HA       VAL   4  17.858   4.237   6.635
   24    HB   VAL   4           HB       VAL   4  16.063   2.894   5.374
   25   1HG1  VAL   4          HG11      VAL   4  16.090   3.045   8.401
   26   2HG1  VAL   4          HG12      VAL   4  17.105   2.022   7.385
   27   3HG1  VAL   4          HG13      VAL   4  15.370   1.721   7.485
   28   1HG2  VAL   4          HG21      VAL   4  13.782   3.156   6.079
   29   2HG2  VAL   4          HG22      VAL   4  14.352   4.765   5.641
   30   3HG2  VAL   4          HG23      VAL   4  14.238   4.303   7.338
   31    HA   PRO   5           HA       PRO   5  18.132   6.842   2.989
   32   1HB   PRO   5          HB2       PRO   5  18.730   4.545   1.269
   33   2HB   PRO   5          HB1       PRO   5  19.801   5.854   1.780
   34   1HG   PRO   5          HG2       PRO   5  19.821   3.152   2.705
   35   2HG   PRO   5          HG1       PRO   5  20.807   4.491   3.298
   36   1HD   PRO   5          HD2       PRO   5  18.627   3.164   4.665
   37   2HD   PRO   5          HD1       PRO   5  19.619   4.526   5.246
   38    HA   PRO   6           HA       PRO   6  14.266   6.357   0.824
   39   1HB   PRO   6          HB2       PRO   6  14.985   7.147  -1.769
   40   2HB   PRO   6          HB1       PRO   6  14.577   8.236  -0.437
   41   1HG   PRO   6          HG2       PRO   6  17.233   7.604  -1.592
   42   2HG   PRO   6          HG1       PRO   6  16.709   9.039  -0.701
   43   1HD   PRO   6          HD2       PRO   6  18.324   6.969   0.337
   44   2HD   PRO   6          HD1       PRO   6  17.450   8.188   1.300
   45    H    SER   7           HN       SER   7  16.805   5.273  -1.460
   46    HA   SER   7           HA       SER   7  15.188   3.367  -2.817
   47   1HB   SER   7          HB2       SER   7  17.247   2.501  -3.724
   48   2HB   SER   7          HB1       SER   7  17.434   4.246  -3.571
   49    HG   SER   7           HG       SER   7  18.257   2.359  -1.614
   50    H    THR   8           HN       THR   8  17.258   3.034   0.045
   51    HA   THR   8           HA       THR   8  16.979   0.184   0.270
   52    HB   THR   8           HB       THR   8  17.548   2.243   2.420
   53    HG1  THR   8           HG1      THR   8  18.930   1.769   0.381
   54   1HG2  THR   8          HG21      THR   8  18.694   0.200   3.468
   55   2HG2  THR   8          HG22      THR   8  17.758  -0.768   2.328
   56   3HG2  THR   8          HG23      THR   8  16.931   0.232   3.523
   57    H    ALA   9           HN       ALA   9  15.102   2.894   1.631
   58    HA   ALA   9           HA       ALA   9  13.445   1.353   3.352
   59   1HB   ALA   9          HB1       ALA   9  11.796   3.209   3.088
   60   2HB   ALA   9          HB2       ALA   9  12.772   3.856   1.769
   61   3HB   ALA   9          HB3       ALA   9  13.425   3.804   3.406
   62    H    LEU  10           HN       LEU  10  13.013   2.225  -0.082
   63    HA   LEU  10           HA       LEU  10  10.511   0.927  -0.455
   64   1HB   LEU  10          HB2       LEU  10  11.493   2.479  -2.101
   65   2HB   LEU  10          HB1       LEU  10  12.774   1.319  -2.437
   66    HG   LEU  10           HG       LEU  10  11.065  -0.319  -3.204
   67   1HD1  LEU  10          HD11      LEU  10   8.759   0.843  -3.717
   68   2HD1  LEU  10          HD12      LEU  10   9.218   1.919  -2.397
   69   3HD1  LEU  10          HD13      LEU  10   9.061   0.185  -2.111
   70   1HD2  LEU  10          HD21      LEU  10  11.129   2.419  -4.485
   71   2HD2  LEU  10          HD22      LEU  10  10.371   1.025  -5.254
   72   3HD2  LEU  10          HD23      LEU  10  12.094   1.003  -4.895
   73    H    ARG  11           HN       ARG  11  13.826  -0.300  -1.028
   74    HA   ARG  11           HA       ARG  11  13.065  -2.910  -1.858
   75   1HB   ARG  11          HB2       ARG  11  15.550  -1.902  -0.445
   76   2HB   ARG  11          HB1       ARG  11  15.389  -3.542  -1.076
   77   1HG   ARG  11          HG2       ARG  11  14.956  -2.641  -3.331
   78   2HG   ARG  11          HG1       ARG  11  15.115  -1.000  -2.706
   79   1HD   ARG  11          HD2       ARG  11  17.305  -3.081  -2.500
   80   2HD   ARG  11          HD1       ARG  11  17.204  -1.897  -3.804
   81    HE   ARG  11           HE       ARG  11  17.077  -0.350  -1.516
   82   1HH1  ARG  11          HH21      ARG  11  19.150  -2.828  -2.717
   83   2HH1  ARG  11          HH22      ARG  11  20.573  -2.183  -1.970
   84   1HH2  ARG  11          HH11      ARG  11  18.922   0.509  -0.537
   85   2HH2  ARG  11          HH12      ARG  11  20.444  -0.294  -0.735
   86    H    GLU  12           HN       GLU  12  13.794  -1.641   1.391
   87    HA   GLU  12           HA       GLU  12  13.472  -4.111   2.788
   88   1HB   GLU  12          HB2       GLU  12  13.077  -1.234   3.651
   89   2HB   GLU  12          HB1       GLU  12  12.963  -2.597   4.766
   90   1HG   GLU  12          HG2       GLU  12  15.255  -3.273   4.204
   91   2HG   GLU  12          HG1       GLU  12  15.382  -1.943   3.055
   92    H    LEU  13           HN       LEU  13  11.153  -1.599   1.842
   93    HA   LEU  13           HA       LEU  13   8.905  -2.778   3.203
   94   1HB   LEU  13          HB2       LEU  13   8.947  -0.419   2.476
   95   2HB   LEU  13          HB1       LEU  13   8.996  -0.937   0.793
   96    HG   LEU  13           HG       LEU  13   6.789  -2.038   1.077
   97   1HD1  LEU  13          HD11      LEU  13   6.605  -2.633   3.342
   98   2HD1  LEU  13          HD12      LEU  13   5.536  -1.238   3.237
   99   3HD1  LEU  13          HD13      LEU  13   7.159  -1.055   3.904
  100   1HD2  LEU  13          HD21      LEU  13   7.030   0.884   1.827
  101   2HD2  LEU  13          HD22      LEU  13   5.488   0.119   1.442
  102   3HD2  LEU  13          HD23      LEU  13   6.761   0.201   0.223
  103    H    ILE  14           HN       ILE  14  10.042  -2.958  -0.189
  104    HA   ILE  14           HA       ILE  14   7.914  -4.596  -1.129
  105    HB   ILE  14           HB       ILE  14  10.793  -4.369  -2.051
  106   1HG1  ILE  14          HG12      ILE  14   8.223  -3.347  -3.299
  107   2HG1  ILE  14          HG11      ILE  14   9.228  -2.374  -2.226
  108   1HG2  ILE  14          HG21      ILE  14   9.837  -5.413  -4.183
  109   2HG2  ILE  14          HG22      ILE  14   8.447  -5.893  -3.210
  110   3HG2  ILE  14          HG23      ILE  14  10.051  -6.513  -2.821
  111   1HD1  ILE  14          HD11      ILE  14  10.124  -3.629  -4.837
  112   2HD1  ILE  14          HD12      ILE  14  11.148  -2.683  -3.757
  113   3HD1  ILE  14          HD13      ILE  14   9.787  -1.918  -4.576
  114    H    GLU  15           HN       GLU  15  11.090  -5.509   0.228
  115    HA   GLU  15           HA       GLU  15  10.783  -8.322  -0.038
  116   1HB   GLU  15          HB2       GLU  15  12.285  -6.663   2.003
  117   2HB   GLU  15          HB1       GLU  15  12.408  -8.419   1.903
  118   1HG   GLU  15          HG2       GLU  15  13.242  -8.281  -0.378
  119   2HG   GLU  15          HG1       GLU  15  12.998  -6.534  -0.396
  120    H    GLU  16           HN       GLU  16   9.784  -6.128   2.584
  121    HA   GLU  16           HA       GLU  16   8.845  -8.251   4.297
  122   1HB   GLU  16          HB2       GLU  16   9.432  -5.964   5.101
  123   2HB   GLU  16          HB1       GLU  16   8.008  -5.338   4.270
  124   1HG   GLU  16          HG2       GLU  16   6.554  -6.774   5.626
  125   2HG   GLU  16          HG1       GLU  16   7.964  -7.465   6.431
  126    H    LEU  17           HN       LEU  17   7.192  -6.087   1.980
  127    HA   LEU  17           HA       LEU  17   4.552  -7.034   2.494
  128   1HB   LEU  17          HB2       LEU  17   5.804  -5.895  -0.015
  129   2HB   LEU  17          HB1       LEU  17   4.082  -6.237   0.137
  130    HG   LEU  17           HG       LEU  17   5.632  -4.417   2.006
  131   1HD1  LEU  17          HD11      LEU  17   4.512  -2.571   0.803
  132   2HD1  LEU  17          HD12      LEU  17   3.803  -3.734  -0.317
  133   3HD1  LEU  17          HD13      LEU  17   5.551  -3.501  -0.278
  134   1HD2  LEU  17          HD21      LEU  17   2.766  -5.319   1.813
  135   2HD2  LEU  17          HD22      LEU  17   3.080  -3.662   2.328
  136   3HD2  LEU  17          HD23      LEU  17   3.750  -5.007   3.243
  137    H    VAL  18           HN       VAL  18   7.021  -8.157   0.195
  138    HA   VAL  18           HA       VAL  18   5.390 -10.169  -1.032
  139    HB   VAL  18           HB       VAL  18   8.391  -9.875  -0.742
  140   1HG1  VAL  18          HG11      VAL  18   8.071 -12.204  -1.086
  141   2HG1  VAL  18          HG12      VAL  18   8.398 -11.549  -2.689
  142   3HG1  VAL  18          HG13      VAL  18   6.744 -11.938  -2.216
  143   1HG2  VAL  18          HG21      VAL  18   7.197  -8.172  -2.100
  144   2HG2  VAL  18          HG22      VAL  18   6.508  -9.462  -3.086
  145   3HG2  VAL  18          HG23      VAL  18   8.249  -9.181  -3.092
  146    H    ASN  19           HN       ASN  19   7.638 -10.296   1.725
  147    HA   ASN  19           HA       ASN  19   7.572 -13.099   2.131
  148   1HB   ASN  19          HB2       ASN  19   9.167 -11.610   3.256
  149   2HB   ASN  19          HB1       ASN  19   7.853 -10.894   4.189
  150   1HD2  ASN  19          HD21      ASN  19   9.819 -12.026   5.713
  151   2HD2  ASN  19          HD22      ASN  19   9.322 -13.517   6.354
  152    H    ILE  20           HN       ILE  20   5.361 -10.588   3.380
  153    HA   ILE  20           HA       ILE  20   3.889 -12.518   4.984
  154    HB   ILE  20           HB       ILE  20   2.326 -10.653   5.399
  155   1HG1  ILE  20          HG12      ILE  20   4.111  -9.041   3.557
  156   2HG1  ILE  20          HG11      ILE  20   2.550  -9.682   3.059
  157   1HG2  ILE  20          HG21      ILE  20   4.525 -10.907   6.616
  158   2HG2  ILE  20          HG22      ILE  20   3.897  -9.259   6.584
  159   3HG2  ILE  20          HG23      ILE  20   5.209  -9.725   5.500
  160   1HD1  ILE  20          HD11      ILE  20   1.374  -8.361   4.649
  161   2HD1  ILE  20          HD12      ILE  20   2.556  -7.270   3.926
  162   3HD1  ILE  20          HD13      ILE  20   2.852  -7.957   5.522
  163    H    THR  21           HN       THR  21   3.658 -11.526   1.641
  164    HA   THR  21           HA       THR  21   0.870 -12.574   1.466
  165    HB   THR  21           HB       THR  21   0.929 -11.734  -0.858
  166    HG1  THR  21           HG1      THR  21   2.745 -10.694  -1.586
  167   1HG2  THR  21          HG21      THR  21   0.614  -9.509  -0.277
  168   2HG2  THR  21          HG22      THR  21   2.002  -9.483   0.803
  169   3HG2  THR  21          HG23      THR  21   0.507 -10.264   1.312
  170    H    GLN  22           HN       GLN  22   4.095 -13.673   0.895
  171    HA   GLN  22           HA       GLN  22   3.385 -15.535  -1.227
  172   1HB   GLN  22          HB2       GLN  22   5.769 -15.307   0.614
  173   2HB   GLN  22          HB1       GLN  22   5.597 -16.641  -0.526
  174   1HG   GLN  22          HG2       GLN  22   5.539 -15.124  -2.403
  175   2HG   GLN  22          HG1       GLN  22   5.463 -13.725  -1.336
  176   1HE2  GLN  22          HE21      GLN  22   7.575 -14.033  -3.257
  177   2HE2  GLN  22          HE22      GLN  22   9.030 -14.267  -2.415
  178    H    ASN  23           HN       ASN  23   3.387 -15.638   2.289
  179    HA   ASN  23           HA       ASN  23   2.811 -18.553   2.263
  180   1HB   ASN  23          HB2       ASN  23   3.002 -18.402   4.693
  181   2HB   ASN  23          HB1       ASN  23   4.395 -17.630   3.935
  182   1HD2  ASN  23          HD21      ASN  23   4.882 -15.636   4.852
  183   2HD2  ASN  23          HD22      ASN  23   3.754 -14.579   5.553
  184    H    GLN  24           HN       GLN  24   0.985 -15.685   2.084
  185    HA   GLN  24           HA       GLN  24  -1.219 -16.696   3.756
  186   1HB   GLN  24          HB2       GLN  24  -2.315 -14.654   3.356
  187   2HB   GLN  24          HB1       GLN  24  -0.615 -14.198   3.346
  188   1HG   GLN  24          HG2       GLN  24  -0.655 -14.401   0.833
  189   2HG   GLN  24          HG1       GLN  24  -2.399 -14.631   0.932
  190   1HE2  GLN  24          HE21      GLN  24  -2.954 -12.612  -0.081
  191   2HE2  GLN  24          HE22      GLN  24  -2.658 -11.117   0.667
  192    H    LYS  25           HN       LYS  25  -2.824 -18.005   3.042
  193    HA   LYS  25           HA       LYS  25  -2.901 -18.720   0.164
  194   1HB   LYS  25          HB2       LYS  25  -3.052 -20.506   1.916
  195   2HB   LYS  25          HB1       LYS  25  -4.559 -19.789   2.481
  196   1HG   LYS  25          HG2       LYS  25  -5.559 -20.128   0.244
  197   2HG   LYS  25          HG1       LYS  25  -4.051 -20.854  -0.313
  198   1HD   LYS  25          HD2       LYS  25  -4.272 -22.629   1.389
  199   2HD   LYS  25          HD1       LYS  25  -5.782 -21.906   1.943
  200   1HE   LYS  25          HE2       LYS  25  -5.415 -22.704  -0.945
  201   2HE   LYS  25          HE1       LYS  25  -5.940 -23.874   0.264
  202   1HZ   LYS  25          HZ1       LYS  25  -7.351 -21.364   0.366
  203   2HZ   LYS  25          HZ2       LYS  25  -7.952 -22.953   0.394
  204   3HZ   LYS  25          HZ3       LYS  25  -7.572 -22.211  -1.086
  205    H    ALA  26           HN       ALA  26  -5.618 -18.357   2.413
  206    HA   ALA  26           HA       ALA  26  -7.163 -16.937   0.377
  207   1HB   ALA  26          HB1       ALA  26  -8.723 -16.782   2.593
  208   2HB   ALA  26          HB2       ALA  26  -7.655 -18.090   3.093
  209   3HB   ALA  26          HB3       ALA  26  -8.615 -18.254   1.626
  210    HA   PRO  27           HA       PRO  27  -6.179 -12.724   1.376
  211   1HB   PRO  27          HB2       PRO  27  -8.957 -12.258   2.330
  212   2HB   PRO  27          HB1       PRO  27  -8.064 -11.446   1.038
  213   1HG   PRO  27          HG2       PRO  27 -10.081 -13.351   0.655
  214   2HG   PRO  27          HG1       PRO  27  -8.903 -12.850  -0.564
  215   1HD   PRO  27          HD2       PRO  27  -9.105 -15.430   0.769
  216   2HD   PRO  27          HD1       PRO  27  -7.974 -14.946  -0.517
  217    H    LEU  28           HN       LEU  28  -5.355 -11.713   3.223
  218    HA   LEU  28           HA       LEU  28  -5.344 -13.116   5.711
  219   1HB   LEU  28          HB2       LEU  28  -4.727 -10.197   5.161
  220   2HB   LEU  28          HB1       LEU  28  -4.257 -11.082   6.608
  221    HG   LEU  28           HG       LEU  28  -3.431 -11.939   3.821
  222   1HD1  LEU  28          HD11      LEU  28  -2.023 -10.131   5.804
  223   2HD1  LEU  28          HD12      LEU  28  -2.520  -9.727   4.160
  224   3HD1  LEU  28          HD13      LEU  28  -1.219 -10.887   4.429
  225   1HD2  LEU  28          HD21      LEU  28  -3.152 -13.744   5.355
  226   2HD2  LEU  28          HD22      LEU  28  -2.588 -12.675   6.638
  227   3HD2  LEU  28          HD23      LEU  28  -1.558 -13.004   5.248
  228    H    CYS  29           HN       CYS  29  -7.200 -10.303   4.598
  229    HA   CYS  29           HA       CYS  29  -8.582 -10.055   7.175
  230   1HB   CYS  29          HB2       CYS  29  -9.008  -8.697   4.498
  231   2HB   CYS  29          HB1       CYS  29  -9.908  -8.308   5.964
  232    H    ASN  30           HN       ASN  30 -10.996 -10.145   7.249
  233    HA   ASN  30           HA       ASN  30 -11.965 -12.670   6.269
  234   1HB   ASN  30          HB2       ASN  30 -13.464 -10.294   7.420
  235   2HB   ASN  30          HB1       ASN  30 -14.160 -11.893   7.161
  236   1HD2  ASN  30          HD21      ASN  30 -12.472 -13.701   8.145
  237   2HD2  ASN  30          HD22      ASN  30 -12.008 -13.374   9.745
  238    H    GLY  31           HN       GLY  31 -11.036 -11.244   4.045
  239   1HA   GLY  31          HA2       GLY  31 -11.789 -10.955   1.821
  240   2HA   GLY  31          HA1       GLY  31 -13.440 -11.232   2.382
  241    H    SER  32           HN       SER  32 -11.349  -8.865   3.902
  242    HA   SER  32           HA       SER  32 -13.260  -6.768   3.699
  243   1HB   SER  32          HB2       SER  32 -10.265  -6.707   4.147
  244   2HB   SER  32          HB1       SER  32 -11.282  -5.273   4.247
  245    HG   SER  32           HG       SER  32 -11.452  -5.958   6.253
  246    H    MET  33           HN       MET  33 -13.564  -5.157   2.193
  247    HA   MET  33           HA       MET  33 -12.057  -5.415  -0.384
  248   1HB   MET  33          HB2       MET  33 -14.772  -4.189   0.193
  249   2HB   MET  33          HB1       MET  33 -14.024  -4.332  -1.395
  250   1HG   MET  33          HG2       MET  33 -14.579  -6.707   0.390
  251   2HG   MET  33          HG1       MET  33 -15.702  -6.151  -0.847
  252   1HE   MET  33          HE1       MET  33 -15.306  -5.833  -3.099
  253   2HE   MET  33          HE2       MET  33 -14.302  -6.850  -4.126
  254   3HE   MET  33          HE3       MET  33 -13.641  -5.359  -3.464
  255    H    VAL  34           HN       VAL  34 -11.234  -3.531  -1.375
  256    HA   VAL  34           HA       VAL  34 -11.278  -1.017   0.264
  257    HB   VAL  34           HB       VAL  34  -8.869  -0.718  -0.545
  258   1HG1  VAL  34          HG11      VAL  34  -9.459  -3.049   1.307
  259   2HG1  VAL  34          HG12      VAL  34  -9.502  -1.349   1.776
  260   3HG1  VAL  34          HG13      VAL  34  -7.979  -2.089   1.282
  261   1HG2  VAL  34          HG21      VAL  34  -9.131  -3.710  -1.000
  262   2HG2  VAL  34          HG22      VAL  34  -7.667  -2.744  -1.184
  263   3HG2  VAL  34          HG23      VAL  34  -9.020  -2.513  -2.291
  264    H    TRP  35           HN       TRP  35 -10.827   0.929  -1.033
  265    HA   TRP  35           HA       TRP  35 -12.209   0.835  -3.593
  266   1HB   TRP  35          HB2       TRP  35 -10.731   3.046  -2.141
  267   2HB   TRP  35          HB1       TRP  35 -11.574   3.282  -3.669
  268    HD1  TRP  35           HD1      TRP  35 -12.160   2.731   0.033
  269    HE1  TRP  35           HE1      TRP  35 -14.648   3.129   0.561
  270    HE3  TRP  35           HE3      TRP  35 -14.010   3.112  -4.706
  271    HZ2  TRP  35           HZ2      TRP  35 -17.105   3.544  -0.842
  272    HZ3  TRP  35           HZ3      TRP  35 -16.427   3.499  -5.083
  273    HH2  TRP  35           HH2      TRP  35 -17.976   3.718  -3.160
  274    H    SER  36           HN       SER  36 -11.278   0.564  -5.575
  275    HA   SER  36           HA       SER  36  -8.423   0.120  -5.810
  276   1HB   SER  36          HB2       SER  36  -8.861  -0.232  -8.156
  277   2HB   SER  36          HB1       SER  36 -10.205  -0.942  -7.268
  278    HG   SER  36           HG       SER  36 -10.870   0.394  -9.033
  279    H    ILE  37           HN       ILE  37  -6.898   1.496  -6.897
  280    HA   ILE  37           HA       ILE  37  -7.793   4.310  -7.415
  281    HB   ILE  37           HB       ILE  37  -5.625   5.065  -6.369
  282   1HG1  ILE  37          HG12      ILE  37  -5.582   2.358  -5.017
  283   2HG1  ILE  37          HG11      ILE  37  -4.676   2.642  -6.502
  284   1HG2  ILE  37          HG21      ILE  37  -6.465   4.898  -4.065
  285   2HG2  ILE  37          HG22      ILE  37  -7.548   3.591  -4.543
  286   3HG2  ILE  37          HG23      ILE  37  -7.791   5.217  -5.183
  287   1HD1  ILE  37          HD11      ILE  37  -4.416   4.373  -4.029
  288   2HD1  ILE  37          HD12      ILE  37  -3.405   4.420  -5.474
  289   3HD1  ILE  37          HD13      ILE  37  -3.340   3.025  -4.397
  290    H    ASN  38           HN       ASN  38  -6.224   5.501  -8.795
  291    HA   ASN  38           HA       ASN  38  -5.149   3.719 -10.885
  292   1HB   ASN  38          HB2       ASN  38  -5.260   6.742 -10.613
  293   2HB   ASN  38          HB1       ASN  38  -4.580   5.905 -12.010
  294   1HD2  ASN  38          HD21      ASN  38  -6.368   3.853 -12.481
  295   2HD2  ASN  38          HD22      ASN  38  -7.919   4.469 -12.792
  296    H    LEU  39           HN       LEU  39  -3.042   3.062 -10.869
  297    HA   LEU  39           HA       LEU  39  -1.267   4.079  -8.786
  298   1HB   LEU  39          HB2       LEU  39  -0.920   1.995 -10.954
  299   2HB   LEU  39          HB1       LEU  39   0.366   2.429  -9.836
  300    HG   LEU  39           HG       LEU  39  -1.101   0.377  -9.250
  301   1HD1  LEU  39          HD11      LEU  39  -0.914   0.787  -6.888
  302   2HD1  LEU  39          HD12      LEU  39  -0.893   2.530  -7.132
  303   3HD1  LEU  39          HD13      LEU  39   0.464   1.546  -7.676
  304   1HD2  LEU  39          HD21      LEU  39  -3.275   1.548  -9.719
  305   2HD2  LEU  39          HD22      LEU  39  -2.993   2.536  -8.281
  306   3HD2  LEU  39          HD23      LEU  39  -3.193   0.795  -8.129
  307    H    THR  40           HN       THR  40  -0.147   5.932  -9.086
  308    HA   THR  40           HA       THR  40   1.178   6.408 -11.716
  309    HB   THR  40           HB       THR  40   0.483   8.771 -11.668
  310    HG1  THR  40           HG1      THR  40  -0.333   8.017  -9.189
  311   1HG2  THR  40          HG21      THR  40  -0.915   7.035 -12.824
  312   2HG2  THR  40          HG22      THR  40  -1.832   8.447 -12.297
  313   3HG2  THR  40          HG23      THR  40  -1.915   6.946 -11.375
  314    H    ALA  41           HN       ALA  41   1.033   8.957  -9.388
  315    HA   ALA  41           HA       ALA  41   3.847   8.336  -8.530
  316   1HB   ALA  41          HB1       ALA  41   2.494  11.044  -8.700
  317   2HB   ALA  41          HB2       ALA  41   3.542  10.379  -9.953
  318   3HB   ALA  41          HB3       ALA  41   4.195  10.731  -8.353
  319    H    GLY  42           HN       GLY  42   0.957  10.144  -7.395
  320   1HA   GLY  42          HA2       GLY  42   1.797   9.994  -4.621
  321   2HA   GLY  42          HA1       GLY  42   0.212  10.521  -5.190
  322    H    MET  43           HN       MET  43   1.739   7.413  -5.905
  323    HA   MET  43           HA       MET  43  -0.606   5.904  -5.346
  324   1HB   MET  43          HB2       MET  43   2.289   5.003  -5.319
  325   2HB   MET  43          HB1       MET  43   0.887   3.940  -5.436
  326   1HG   MET  43          HG2       MET  43   0.217   5.243  -7.498
  327   2HG   MET  43          HG1       MET  43   1.791   6.023  -7.433
  328   1HE   MET  43          HE1       MET  43   3.853   4.858  -7.065
  329   2HE   MET  43          HE2       MET  43   4.354   3.400  -7.918
  330   3HE   MET  43          HE3       MET  43   3.618   3.269  -6.323
  331    H    TYR  44           HN       TYR  44   2.234   6.610  -3.315
  332    HA   TYR  44           HA       TYR  44   1.568   4.899  -1.151
  333   1HB   TYR  44          HB2       TYR  44   3.053   7.536  -1.192
  334   2HB   TYR  44          HB1       TYR  44   2.965   6.481   0.219
  335    HD1  TYR  44           HD1      TYR  44   4.085   4.305   0.249
  336    HD2  TYR  44           HD2      TYR  44   4.296   6.871  -3.190
  337    HE1  TYR  44           HE1      TYR  44   5.936   2.930  -0.666
  338    HE2  TYR  44           HE2      TYR  44   6.146   5.496  -4.104
  339    HH   TYR  44           HH       TYR  44   7.056   2.453  -2.663
  340    H    CYS  45           HN       CYS  45   0.775   8.371  -1.577
  341    HA   CYS  45           HA       CYS  45  -0.764   8.517   0.846
  342   1HB   CYS  45          HB2       CYS  45  -0.764  10.223  -1.654
  343   2HB   CYS  45          HB1       CYS  45  -1.713  10.609  -0.218
  344    H    ALA  46           HN       ALA  46  -1.777   8.174  -2.569
  345    HA   ALA  46           HA       ALA  46  -4.568   7.960  -2.051
  346   1HB   ALA  46          HB1       ALA  46  -2.971   6.609  -4.250
  347   2HB   ALA  46          HB2       ALA  46  -3.566   8.268  -4.313
  348   3HB   ALA  46          HB3       ALA  46  -4.707   6.924  -4.269
  349    H    ALA  47           HN       ALA  47  -2.065   5.430  -2.307
  350    HA   ALA  47           HA       ALA  47  -3.811   3.218  -1.873
  351   1HB   ALA  47          HB1       ALA  47  -0.867   3.572  -1.256
  352   2HB   ALA  47          HB2       ALA  47  -1.566   2.842  -2.701
  353   3HB   ALA  47          HB3       ALA  47  -1.713   2.031  -1.142
  354    H    LEU  48           HN       LEU  48  -2.028   5.296   0.382
  355    HA   LEU  48           HA       LEU  48  -2.508   3.828   2.755
  356   1HB   LEU  48          HB2       LEU  48  -0.924   5.703   2.627
  357   2HB   LEU  48          HB1       LEU  48  -2.256   6.827   2.381
  358    HG   LEU  48           HG       LEU  48  -3.162   6.243   4.613
  359   1HD1  LEU  48          HD11      LEU  48  -2.499   4.033   5.060
  360   2HD1  LEU  48          HD12      LEU  48  -1.436   4.962   6.112
  361   3HD1  LEU  48          HD13      LEU  48  -0.828   4.332   4.581
  362   1HD2  LEU  48          HD21      LEU  48  -1.390   7.333   5.929
  363   2HD2  LEU  48          HD22      LEU  48  -1.565   8.114   4.357
  364   3HD2  LEU  48          HD23      LEU  48  -0.225   7.004   4.646
  365    H    GLU  49           HN       GLU  49  -4.459   6.543   1.404
  366    HA   GLU  49           HA       GLU  49  -6.404   6.503   3.472
  367   1HB   GLU  49          HB2       GLU  49  -7.949   7.510   1.711
  368   2HB   GLU  49          HB1       GLU  49  -6.438   8.370   1.999
  369   1HG   GLU  49          HG2       GLU  49  -5.428   7.348   0.045
  370   2HG   GLU  49          HG1       GLU  49  -6.864   6.355  -0.220
  371    H    SER  50           HN       SER  50  -6.226   4.588   0.473
  372    HA   SER  50           HA       SER  50  -8.817   3.405   0.747
  373   1HB   SER  50          HB2       SER  50  -6.302   2.248  -0.495
  374   2HB   SER  50          HB1       SER  50  -7.925   1.597  -0.706
  375    HG   SER  50           HG       SER  50  -6.832   3.383  -2.184
  376    H    LEU  51           HN       LEU  51  -5.640   2.472   2.061
  377    HA   LEU  51           HA       LEU  51  -6.558   0.009   3.252
  378   1HB   LEU  51          HB2       LEU  51  -4.202   1.789   3.938
  379   2HB   LEU  51          HB1       LEU  51  -4.462   0.185   4.617
  380    HG   LEU  51           HG       LEU  51  -4.214   0.761   1.647
  381   1HD1  LEU  51          HD11      LEU  51  -1.954  -0.018   1.776
  382   2HD1  LEU  51          HD12      LEU  51  -2.156  -0.537   3.449
  383   3HD1  LEU  51          HD13      LEU  51  -2.128   1.182   3.056
  384   1HD2  LEU  51          HD21      LEU  51  -4.593  -1.732   3.306
  385   2HD2  LEU  51          HD22      LEU  51  -3.686  -1.834   1.797
  386   3HD2  LEU  51          HD23      LEU  51  -5.356  -1.282   1.781
  387    H    ILE  52           HN       ILE  52  -6.451   3.359   4.347
  388    HA   ILE  52           HA       ILE  52  -6.913   2.974   7.106
  389    HB   ILE  52           HB       ILE  52  -7.821   5.141   5.197
  390   1HG1  ILE  52          HG12      ILE  52  -5.404   5.015   5.626
  391   2HG1  ILE  52          HG11      ILE  52  -6.081   6.472   6.333
  392   1HG2  ILE  52          HG21      ILE  52  -9.444   5.264   6.916
  393   2HG2  ILE  52          HG22      ILE  52  -8.240   6.486   7.326
  394   3HG2  ILE  52          HG23      ILE  52  -8.254   4.941   8.176
  395   1HD1  ILE  52          HD11      ILE  52  -6.288   4.807   8.469
  396   2HD1  ILE  52          HD12      ILE  52  -4.855   5.776   8.144
  397   3HD1  ILE  52          HD13      ILE  52  -4.900   4.084   7.658
  398    H    ASN  53           HN       ASN  53  -9.012   2.363   4.417
  399    HA   ASN  53           HA       ASN  53 -11.469   2.423   6.023
  400   1HB   ASN  53          HB2       ASN  53 -10.847   1.517   3.203
  401   2HB   ASN  53          HB1       ASN  53 -12.447   1.348   3.926
  402   1HD2  ASN  53          HD21      ASN  53 -12.657   3.739   5.384
  403   2HD2  ASN  53          HD22      ASN  53 -12.621   5.059   4.318
  404    H    VAL  54           HN       VAL  54  -8.918   0.228   5.658
  405    HA   VAL  54           HA       VAL  54 -10.590  -2.186   6.006
  406    HB   VAL  54           HB       VAL  54  -7.575  -1.866   6.058
  407   1HG1  VAL  54          HG11      VAL  54  -9.406  -4.278   5.929
  408   2HG1  VAL  54          HG12      VAL  54  -8.247  -3.889   7.199
  409   3HG1  VAL  54          HG13      VAL  54  -7.676  -4.347   5.593
  410   1HG2  VAL  54          HG21      VAL  54  -7.735  -2.821   3.751
  411   2HG2  VAL  54          HG22      VAL  54  -8.489  -1.233   3.884
  412   3HG2  VAL  54          HG23      VAL  54  -9.491  -2.683   3.850
  413    H    SER  55           HN       SER  55 -11.205  -2.880   7.977
  414    HA   SER  55           HA       SER  55  -9.570  -2.110  10.377
  415   1HB   SER  55          HB2       SER  55 -12.593  -2.243  10.153
  416   2HB   SER  55          HB1       SER  55 -11.695  -1.948  11.640
  417    HG   SER  55           HG       SER  55 -10.703  -0.235  10.030
  418    H    GLY  56           HN       GLY  56  -9.332  -3.744  11.923
  419   1HA   GLY  56          HA2       GLY  56  -9.725  -5.883  12.919
  420   2HA   GLY  56          HA1       GLY  56 -10.804  -6.289  11.584
  421    H    CYS  57           HN       CYS  57  -7.560  -4.981  11.100
  422    HA   CYS  57           HA       CYS  57  -6.526  -7.683  10.405
  423   1HB   CYS  57          HB2       CYS  57  -6.587  -5.338   8.480
  424   2HB   CYS  57          HB1       CYS  57  -5.701  -6.839   8.211
  425    H    SER  58           HN       SER  58  -5.012  -7.510  12.078
  426    HA   SER  58           HA       SER  58  -3.371  -5.183  12.532
  427   1HB   SER  58          HB2       SER  58  -3.734  -6.818  14.304
  428   2HB   SER  58          HB1       SER  58  -2.984  -8.079  13.328
  429    HG   SER  58           HG       SER  58  -1.102  -7.360  13.916
  430    H    ALA  59           HN       ALA  59  -2.956  -8.150  10.688
  431    HA   ALA  59           HA       ALA  59  -0.258  -8.149  10.093
  432   1HB   ALA  59          HB1       ALA  59  -1.920  -9.819   9.293
  433   2HB   ALA  59          HB2       ALA  59  -0.827  -9.283   8.017
  434   3HB   ALA  59          HB3       ALA  59  -2.472  -8.653   8.092
  435    H    ILE  60           HN       ILE  60  -2.668  -5.898   8.784
  436    HA   ILE  60           HA       ILE  60  -0.598  -4.780   6.944
  437    HB   ILE  60           HB       ILE  60  -2.459  -3.542   5.930
  438   1HG1  ILE  60          HG12      ILE  60  -4.253  -5.027   7.876
  439   2HG1  ILE  60          HG11      ILE  60  -3.796  -3.338   8.083
  440   1HG2  ILE  60          HG21      ILE  60  -2.002  -5.728   5.037
  441   2HG2  ILE  60          HG22      ILE  60  -3.754  -5.576   5.157
  442   3HG2  ILE  60          HG23      ILE  60  -2.865  -6.511   6.360
  443   1HD1  ILE  60          HD11      ILE  60  -5.267  -4.506   5.706
  444   2HD1  ILE  60          HD12      ILE  60  -4.743  -2.828   5.843
  445   3HD1  ILE  60          HD13      ILE  60  -5.957  -3.465   6.951
  446    H    GLU  61           HN       GLU  61  -1.772  -4.136  10.075
  447    HA   GLU  61           HA       GLU  61  -1.850  -1.283  10.018
  448   1HB   GLU  61          HB2       GLU  61  -1.078  -3.200  12.230
  449   2HB   GLU  61          HB1       GLU  61  -1.196  -1.455  12.466
  450   1HG   GLU  61          HG2       GLU  61  -3.532  -1.471  11.796
  451   2HG   GLU  61          HG1       GLU  61  -3.443  -3.185  11.396
  452    H    LYS  62           HN       LYS  62   0.866  -3.547  10.431
  453    HA   LYS  62           HA       LYS  62   2.874  -1.567  10.905
  454   1HB   LYS  62          HB2       LYS  62   3.019  -4.303   9.609
  455   2HB   LYS  62          HB1       LYS  62   4.439  -3.321   9.973
  456   1HG   LYS  62          HG2       LYS  62   3.939  -3.333  12.329
  457   2HG   LYS  62          HG1       LYS  62   2.370  -4.082  12.043
  458   1HD   LYS  62          HD2       LYS  62   3.829  -5.840  12.775
  459   2HD   LYS  62          HD1       LYS  62   3.607  -6.061  11.042
  460   1HE   LYS  62          HE2       LYS  62   5.938  -4.462  12.104
  461   2HE   LYS  62          HE1       LYS  62   6.018  -6.218  11.996
  462   1HZ   LYS  62          HZ1       LYS  62   6.043  -4.238   9.891
  463   2HZ   LYS  62          HZ2       LYS  62   5.044  -5.579   9.589
  464   3HZ   LYS  62          HZ3       LYS  62   6.695  -5.803   9.919
  465    H    THR  63           HN       THR  63   1.530  -2.952   7.940
  466    HA   THR  63           HA       THR  63   3.286  -1.680   6.096
  467    HB   THR  63           HB       THR  63   0.365  -2.416   5.737
  468    HG1  THR  63           HG1      THR  63   2.787  -3.810   5.260
  469   1HG2  THR  63          HG21      THR  63   1.098  -0.901   3.985
  470   2HG2  THR  63          HG22      THR  63   1.024  -2.533   3.322
  471   3HG2  THR  63          HG23      THR  63   2.581  -1.829   3.756
  472    H    GLN  64           HN       GLN  64   0.271  -0.586   7.611
  473    HA   GLN  64           HA       GLN  64  -0.090   1.782   6.103
  474   1HB   GLN  64          HB2       GLN  64  -0.839   1.098   8.952
  475   2HB   GLN  64          HB1       GLN  64  -1.354   2.582   8.149
  476   1HG   GLN  64          HG2       GLN  64  -2.515   1.338   6.436
  477   2HG   GLN  64          HG1       GLN  64  -1.848  -0.185   7.022
  478   1HE2  GLN  64          HE21      GLN  64  -4.703   0.339   6.837
  479   2HE2  GLN  64          HE22      GLN  64  -5.328   0.322   8.415
  480    H    ARG  65           HN       ARG  65   1.796   1.351   9.149
  481    HA   ARG  65           HA       ARG  65   2.443   4.154   9.303
  482   1HB   ARG  65          HB2       ARG  65   4.373   3.332  10.771
  483   2HB   ARG  65          HB1       ARG  65   2.745   2.928  11.310
  484   1HG   ARG  65          HG2       ARG  65   2.943   0.695  10.363
  485   2HG   ARG  65          HG1       ARG  65   4.532   1.086   9.702
  486   1HD   ARG  65          HD2       ARG  65   3.918   1.283  12.655
  487   2HD   ARG  65          HD1       ARG  65   4.526  -0.199  11.914
  488    HE   ARG  65           HE       ARG  65   6.311   1.727  11.057
  489   1HH1  ARG  65          HH21      ARG  65   5.008   0.718  14.083
  490   2HH1  ARG  65          HH22      ARG  65   6.433   1.121  14.982
  491   1HH2  ARG  65          HH11      ARG  65   8.177   2.259  12.207
  492   2HH2  ARG  65          HH12      ARG  65   8.228   1.998  13.918
  493    H    MET  66           HN       MET  66   4.141   1.386   7.815
  494    HA   MET  66           HA       MET  66   6.473   2.876   7.071
  495   1HB   MET  66          HB2       MET  66   5.209   0.400   5.870
  496   2HB   MET  66          HB1       MET  66   6.753   1.058   5.325
  497   1HG   MET  66          HG2       MET  66   7.570   0.913   7.704
  498   2HG   MET  66          HG1       MET  66   6.078   0.067   8.111
  499   1HE   MET  66          HE1       MET  66   6.181  -3.252   6.476
  500   2HE   MET  66          HE2       MET  66   5.541  -1.903   5.544
  501   3HE   MET  66          HE3       MET  66   5.283  -1.961   7.285
  502    H    LEU  67           HN       LEU  67   3.372   2.333   5.413
  503    HA   LEU  67           HA       LEU  67   4.065   3.608   2.955
  504   1HB   LEU  67          HB2       LEU  67   1.412   3.375   4.397
  505   2HB   LEU  67          HB1       LEU  67   1.570   4.061   2.785
  506    HG   LEU  67           HG       LEU  67   2.543   1.283   3.515
  507   1HD1  LEU  67          HD11      LEU  67   0.170   1.250   3.834
  508   2HD1  LEU  67          HD12      LEU  67   0.458   0.568   2.233
  509   3HD1  LEU  67          HD13      LEU  67  -0.103   2.232   2.396
  510   1HD2  LEU  67          HD21      LEU  67   2.295   2.868   0.957
  511   2HD2  LEU  67          HD22      LEU  67   2.174   1.111   0.907
  512   3HD2  LEU  67          HD23      LEU  67   3.636   1.872   1.520
  513    H    SER  68           HN       SER  68   2.854   4.899   6.025
  514    HA   SER  68           HA       SER  68   2.413   7.569   5.216
  515   1HB   SER  68          HB2       SER  68   3.449   6.510   7.859
  516   2HB   SER  68          HB1       SER  68   2.902   8.163   7.600
  517    HG   SER  68           HG       SER  68   1.464   5.939   8.058
  518    H    GLY  69           HN       GLY  69   5.410   5.877   6.016
  519   1HA   GLY  69          HA2       GLY  69   7.192   8.022   6.274
  520   2HA   GLY  69          HA1       GLY  69   7.630   6.488   5.518
  521    H    PHE  70           HN       PHE  70   5.641   6.759   3.366
  522    HA   PHE  70           HA       PHE  70   7.154   8.684   1.665
  523   1HB   PHE  70          HB2       PHE  70   5.182   6.487   0.962
  524   2HB   PHE  70          HB1       PHE  70   5.978   7.531  -0.215
  525    HD1  PHE  70           HD1      PHE  70   8.411   7.374  -0.602
  526    HD2  PHE  70           HD2      PHE  70   6.402   4.746   2.139
  527    HE1  PHE  70           HE1      PHE  70  10.384   5.877  -0.596
  528    HE2  PHE  70           HE2      PHE  70   8.380   3.250   2.149
  529    HZ   PHE  70           HZ       PHE  70  10.370   3.815   0.781
  530    H    CYS  71           HN       CYS  71   4.428   8.681   3.554
  531    HA   CYS  71           HA       CYS  71   3.185  10.882   1.949
  532   1HB   CYS  71          HB2       CYS  71   1.936   8.668   1.717
  533   2HB   CYS  71          HB1       CYS  71   1.569   8.805   3.435
  534    HA   PRO  72           HA       PRO  72   4.216  12.076   6.352
  535   1HB   PRO  72          HB2       PRO  72   4.002  14.792   5.186
  536   2HB   PRO  72          HB1       PRO  72   5.328  14.064   6.103
  537   1HG   PRO  72          HG2       PRO  72   5.423  14.536   3.392
  538   2HG   PRO  72          HG1       PRO  72   6.382  13.294   4.210
  539   1HD   PRO  72          HD2       PRO  72   4.030  12.965   2.431
  540   2HD   PRO  72          HD1       PRO  72   5.294  11.780   2.852
  541    H    HIS  73           HN       HIS  73   1.538  12.977   4.256
  542    HA   HIS  73           HA       HIS  73   0.073  14.191   6.538
  543   1HB   HIS  73          HB2       HIS  73  -1.493  14.989   4.980
  544   2HB   HIS  73          HB1       HIS  73   0.028  15.078   4.101
  545    HD1  HIS  73           HD1      HIS  73  -3.120  12.995   4.353
  546    HD2  HIS  73           HD2      HIS  73   0.163  13.423   1.824
  547    HE1  HIS  73           HE1      HIS  73  -3.637  11.653   2.268
  548    H    LYS  74           HN       LYS  74  -0.761  12.740   7.935
  549    HA   LYS  74           HA       LYS  74  -1.508  10.046   7.119
  550   1HB   LYS  74          HB2       LYS  74  -1.937  11.566   9.708
  551   2HB   LYS  74          HB1       LYS  74  -2.330   9.860   9.483
  552   1HG   LYS  74          HG2       LYS  74   0.025   9.390   8.911
  553   2HG   LYS  74          HG1       LYS  74   0.420  11.094   9.141
  554   1HD   LYS  74          HD2       LYS  74  -0.309  10.944  11.498
  555   2HD   LYS  74          HD1       LYS  74  -0.686   9.236  11.267
  556   1HE   LYS  74          HE2       LYS  74   2.054  10.475  10.886
  557   2HE   LYS  74          HE1       LYS  74   1.549   9.556  12.303
  558   1HZ   LYS  74          HZ1       LYS  74   2.760   8.189  10.705
  559   2HZ   LYS  74          HZ2       LYS  74   1.593   8.526   9.517
  560   3HZ   LYS  74          HZ3       LYS  74   1.168   7.642  10.905
  561    H    VAL  75           HN       VAL  75  -3.576   9.242   6.797
  562    HA   VAL  75           HA       VAL  75  -5.778  11.273   6.602
  563    HB   VAL  75           HB       VAL  75  -5.502   8.592   5.211
  564   1HG1  VAL  75          HG11      VAL  75  -7.819   9.280   5.496
  565   2HG1  VAL  75          HG12      VAL  75  -7.355   9.520   3.812
  566   3HG1  VAL  75          HG13      VAL  75  -7.441  10.899   4.907
  567   1HG2  VAL  75          HG21      VAL  75  -3.817  10.018   4.299
  568   2HG2  VAL  75          HG22      VAL  75  -4.878  11.426   4.348
  569   3HG2  VAL  75          HG23      VAL  75  -5.179  10.135   3.185
  570    H    SER  76           HN       SER  76  -7.506  11.004   7.955
  571    HA   SER  76           HA       SER  76  -7.555   8.603   9.704
  572   1HB   SER  76          HB2       SER  76  -9.121   9.880  11.066
  573   2HB   SER  76          HB1       SER  76  -7.722  10.884  10.696
  574    HG   SER  76           HG       SER  76 -10.289  11.329  10.147
  575    H    ALA  77           HN       ALA  77  -9.814   7.736  10.211
  576    HA   ALA  77           HA       ALA  77 -11.008   6.709   7.834
  577   1HB   ALA  77          HB1       ALA  77 -11.920   6.790  10.710
  578   2HB   ALA  77          HB2       ALA  77 -11.259   5.421   9.817
  579   3HB   ALA  77          HB3       ALA  77 -12.877   6.016   9.447
  580    H    GLY  78           HN       GLY  78 -11.495   9.712   9.458
  581   1HA   GLY  78          HA2       GLY  78 -14.183  10.090   8.241
  582   2HA   GLY  78          HA1       GLY  78 -13.393  11.195   9.366
  583    H    GLN  79           HN       GLN  79 -10.849  11.219   7.923
  584    HA   GLN  79           HA       GLN  79 -11.635  13.133   5.796
  585   1HB   GLN  79          HB2       GLN  79  -8.918  12.464   6.963
  586   2HB   GLN  79          HB1       GLN  79  -9.257  13.769   5.825
  587   1HG   GLN  79          HG2       GLN  79 -10.549  13.510   8.554
  588   2HG   GLN  79          HG1       GLN  79  -9.166  14.547   8.204
  589   1HE2  GLN  79          HE21      GLN  79 -12.176  15.093   8.877
  590   2HE2  GLN  79          HE22      GLN  79 -12.631  16.228   7.701
  591    H    PHE  80           HN       PHE  80 -11.568  12.577   3.685
  592    HA   PHE  80           HA       PHE  80  -9.797  10.316   2.815
  593   1HB   PHE  80          HB2       PHE  80 -12.665  10.845   1.978
  594   2HB   PHE  80          HB1       PHE  80 -11.588   9.704   1.171
  595    HD1  PHE  80           HD1      PHE  80 -13.843  10.210   3.920
  596    HD2  PHE  80           HD2      PHE  80 -10.525   7.833   2.579
  597    HE1  PHE  80           HE1      PHE  80 -14.407   8.479   5.601
  598    HE2  PHE  80           HE2      PHE  80 -11.083   6.104   4.268
  599    HZ   PHE  80           HZ       PHE  80 -13.026   6.425   5.779
  600    H    SER  81           HN       SER  81  -8.947  10.596   0.668
  601    HA   SER  81           HA       SER  81  -9.295  13.373  -0.441
  602   1HB   SER  81          HB2       SER  81  -6.823  11.654  -0.199
  603   2HB   SER  81          HB1       SER  81  -6.905  13.070  -1.244
  604    HG   SER  81           HG       SER  81  -6.654  12.896   1.464
  605    H    SER  82           HN       SER  82  -8.330  10.038  -1.376
  606    HA   SER  82           HA       SER  82  -8.954  10.709  -4.194
  607   1HB   SER  82          HB2       SER  82  -6.884   9.411  -3.454
  608   2HB   SER  82          HB1       SER  82  -7.969   8.060  -3.139
  609    HG   SER  82           HG       SER  82  -8.645   8.218  -5.324
  610    H    LEU  83           HN       LEU  83 -10.801   9.610  -1.648
  611    HA   LEU  83           HA       LEU  83 -12.271   7.583  -3.215
  612   1HB   LEU  83          HB2       LEU  83 -13.006   8.787  -0.536
  613   2HB   LEU  83          HB1       LEU  83 -13.661   7.317  -1.250
  614    HG   LEU  83           HG       LEU  83 -10.858   7.785  -0.211
  615   1HD1  LEU  83          HD11      LEU  83 -11.381   6.067   1.344
  616   2HD1  LEU  83          HD12      LEU  83 -12.788   5.548   0.419
  617   3HD1  LEU  83          HD13      LEU  83 -12.825   7.079   1.291
  618   1HD2  LEU  83          HD21      LEU  83 -10.440   6.557  -2.199
  619   2HD2  LEU  83          HD22      LEU  83 -11.918   5.610  -2.025
  620   3HD2  LEU  83          HD23      LEU  83 -10.551   5.318  -0.950
  621    H    HIS  84           HN       HIS  84 -12.126  10.566  -3.964
  622    HA   HIS  84           HA       HIS  84 -14.850  11.552  -3.624
  623   1HB   HIS  84          HB2       HIS  84 -12.820  12.425  -5.700
  624   2HB   HIS  84          HB1       HIS  84 -14.196  13.348  -5.101
  625    HD1  HIS  84           HD1      HIS  84 -13.294  12.039  -2.103
  626    HD2  HIS  84           HD2      HIS  84 -11.280  14.707  -4.591
  627    HE1  HIS  84           HE1      HIS  84 -11.631  13.262  -0.649
  628    H    VAL  85           HN       VAL  85 -13.037   9.939  -6.195
  629    HA   VAL  85           HA       VAL  85 -15.257  10.007  -8.077
  630    HB   VAL  85           HB       VAL  85 -12.831   8.204  -8.177
  631   1HG1  VAL  85          HG11      VAL  85 -14.677   9.405 -10.261
  632   2HG1  VAL  85          HG12      VAL  85 -14.517   7.699  -9.844
  633   3HG1  VAL  85          HG13      VAL  85 -13.190   8.540 -10.645
  634   1HG2  VAL  85          HG21      VAL  85 -11.867  10.124  -9.569
  635   2HG2  VAL  85          HG22      VAL  85 -11.932  10.391  -7.827
  636   3HG2  VAL  85          HG23      VAL  85 -13.139  11.132  -8.879
  637    H    ARG  86           HN       ARG  86 -16.518   8.171  -8.743
  638    HA   ARG  86           HA       ARG  86 -16.974   6.226  -6.556
  639   1HB   ARG  86          HB2       ARG  86 -18.462   6.827  -9.129
  640   2HB   ARG  86          HB1       ARG  86 -18.925   5.538  -8.017
  641   1HG   ARG  86          HG2       ARG  86 -19.141   7.199  -6.196
  642   2HG   ARG  86          HG1       ARG  86 -18.725   8.482  -7.325
  643   1HD   ARG  86          HD2       ARG  86 -21.116   6.640  -7.512
  644   2HD   ARG  86          HD1       ARG  86 -21.167   8.340  -7.068
  645    HE   ARG  86           HE       ARG  86 -21.158   7.237  -9.734
  646   1HH1  ARG  86          HH21      ARG  86 -19.756   9.812  -7.899
  647   2HH1  ARG  86          HH22      ARG  86 -19.333  10.735  -9.302
  648   1HH2  ARG  86          HH11      ARG  86 -20.627   8.436 -11.543
  649   2HH2  ARG  86          HH12      ARG  86 -19.826   9.961 -11.357
  650    H    ASP  87           HN       ASP  87 -14.781   5.255  -7.081
  651    HA   ASP  87           HA       ASP  87 -14.601   3.680  -9.555
  652   1HB   ASP  87          HB2       ASP  87 -12.832   3.899  -7.104
  653   2HB   ASP  87          HB1       ASP  87 -12.472   2.839  -8.468
  654    H    THR  88           HN       THR  88 -13.893   1.241  -9.131
  655    HA   THR  88           HA       THR  88 -16.096   0.047  -7.533
  656    HB   THR  88           HB       THR  88 -14.117  -1.459  -9.255
  657    HG1  THR  88           HG1      THR  88 -16.250  -1.046 -10.651
  658   1HG2  THR  88          HG21      THR  88 -15.711  -2.691  -7.763
  659   2HG2  THR  88          HG22      THR  88 -15.958  -3.028  -9.476
  660   3HG2  THR  88          HG23      THR  88 -17.045  -1.929  -8.629
  661    H    LYS  89           HN       LYS  89 -15.701  -1.470  -5.864
  662    HA   LYS  89           HA       LYS  89 -13.103  -1.142  -4.508
  663   1HB   LYS  89          HB2       LYS  89 -15.574  -2.711  -3.705
  664   2HB   LYS  89          HB1       LYS  89 -14.163  -2.430  -2.690
  665   1HG   LYS  89          HG2       LYS  89 -14.556   0.001  -2.796
  666   2HG   LYS  89          HG1       LYS  89 -15.972  -0.276  -3.815
  667   1HD   LYS  89          HD2       LYS  89 -17.008  -1.614  -2.018
  668   2HD   LYS  89          HD1       LYS  89 -15.598  -1.338  -0.997
  669   1HE   LYS  89          HE2       LYS  89 -16.075   0.952  -0.747
  670   2HE   LYS  89          HE1       LYS  89 -17.147   0.980  -2.149
  671   1HZ   LYS  89          HZ1       LYS  89 -18.000   0.801   0.367
  672   2HZ   LYS  89          HZ2       LYS  89 -17.896  -0.848  -0.025
  673   3HZ   LYS  89          HZ3       LYS  89 -18.863   0.191  -0.959
  674    H    ILE  90           HN       ILE  90 -11.718  -2.916  -3.987
  675    HA   ILE  90           HA       ILE  90 -12.225  -5.474  -5.463
  676    HB   ILE  90           HB       ILE  90  -9.791  -5.492  -6.048
  677   1HG1  ILE  90          HG12      ILE  90  -9.925  -2.607  -5.104
  678   2HG1  ILE  90          HG11      ILE  90  -9.067  -3.906  -4.274
  679   1HG2  ILE  90          HG21      ILE  90 -11.262  -3.047  -7.072
  680   2HG2  ILE  90          HG22      ILE  90 -11.596  -4.694  -7.608
  681   3HG2  ILE  90          HG23      ILE  90 -10.019  -3.968  -7.919
  682   1HD1  ILE  90          HD11      ILE  90  -8.501  -2.900  -7.079
  683   2HD1  ILE  90          HD12      ILE  90  -7.682  -4.259  -6.307
  684   3HD1  ILE  90          HD13      ILE  90  -7.498  -2.632  -5.655
  685    H    GLU  91           HN       GLU  91 -10.949  -7.288  -4.591
  686    HA   GLU  91           HA       GLU  91 -11.030  -7.382  -1.725
  687   1HB   GLU  91          HB2       GLU  91  -9.754  -9.209  -3.778
  688   2HB   GLU  91          HB1       GLU  91  -9.802  -9.573  -2.052
  689   1HG   GLU  91          HG2       GLU  91 -12.242  -9.485  -2.062
  690   2HG   GLU  91          HG1       GLU  91 -12.240  -9.018  -3.764
  691    H    VAL  92           HN       VAL  92  -9.317  -7.346  -0.212
  692    HA   VAL  92           HA       VAL  92  -7.175  -5.561  -0.734
  693    HB   VAL  92           HB       VAL  92  -7.554  -7.635   1.435
  694   1HG1  VAL  92          HG11      VAL  92  -5.778  -6.127   2.611
  695   2HG1  VAL  92          HG12      VAL  92  -5.337  -5.633   0.976
  696   3HG1  VAL  92          HG13      VAL  92  -5.212  -7.327   1.450
  697   1HG2  VAL  92          HG21      VAL  92  -8.275  -5.774   2.760
  698   2HG2  VAL  92          HG22      VAL  92  -9.100  -5.609   1.210
  699   3HG2  VAL  92          HG23      VAL  92  -7.690  -4.613   1.568
  700    H    ALA  93           HN       ALA  93  -7.224  -9.131  -0.802
  701    HA   ALA  93           HA       ALA  93  -4.466  -9.614  -1.043
  702   1HB   ALA  93          HB1       ALA  93  -6.285 -11.355  -0.904
  703   2HB   ALA  93          HB2       ALA  93  -5.040 -11.702  -2.103
  704   3HB   ALA  93          HB3       ALA  93  -6.605 -11.071  -2.616
  705    H    GLN  94           HN       GLN  94  -6.769  -8.776  -3.640
  706    HA   GLN  94           HA       GLN  94  -4.733  -8.870  -5.710
  707   1HB   GLN  94          HB2       GLN  94  -7.498  -7.623  -5.631
  708   2HB   GLN  94          HB1       GLN  94  -6.489  -7.688  -7.076
  709   1HG   GLN  94          HG2       GLN  94  -7.230 -10.156  -5.489
  710   2HG   GLN  94          HG1       GLN  94  -8.193  -9.571  -6.845
  711   1HE2  GLN  94          HE21      GLN  94  -6.365  -8.847  -8.750
  712   2HE2  GLN  94          HE22      GLN  94  -5.357 -10.149  -9.161
  713    H    PHE  95           HN       PHE  95  -6.075  -6.392  -3.603
  714    HA   PHE  95           HA       PHE  95  -5.018  -4.077  -4.876
  715   1HB   PHE  95          HB2       PHE  95  -6.630  -3.968  -3.016
  716   2HB   PHE  95          HB1       PHE  95  -5.420  -4.641  -1.926
  717    HD1  PHE  95           HD1      PHE  95  -6.476  -1.664  -3.797
  718    HD2  PHE  95           HD2      PHE  95  -3.461  -3.342  -1.240
  719    HE1  PHE  95           HE1      PHE  95  -5.575   0.605  -3.369
  720    HE2  PHE  95           HE2      PHE  95  -2.561  -1.073  -0.813
  721    HZ   PHE  95           HZ       PHE  95  -3.619   0.898  -1.877
  722    H    VAL  96           HN       VAL  96  -3.624  -6.110  -2.285
  723    HA   VAL  96           HA       VAL  96  -1.176  -4.681  -2.046
  724    HB   VAL  96           HB       VAL  96  -1.704  -7.634  -1.601
  725   1HG1  VAL  96          HG11      VAL  96   0.583  -5.798  -0.883
  726   2HG1  VAL  96          HG12      VAL  96   0.642  -7.393  -1.632
  727   3HG1  VAL  96          HG13      VAL  96   0.239  -7.237   0.077
  728   1HG2  VAL  96          HG21      VAL  96  -3.203  -6.249  -0.269
  729   2HG2  VAL  96          HG22      VAL  96  -1.858  -5.235   0.251
  730   3HG2  VAL  96          HG23      VAL  96  -1.954  -6.914   0.783
  731    H    LYS  97           HN       LYS  97  -1.985  -7.550  -4.025
  732    HA   LYS  97           HA       LYS  97   0.615  -7.864  -5.149
  733   1HB   LYS  97          HB2       LYS  97  -2.117  -8.576  -6.251
  734   2HB   LYS  97          HB1       LYS  97  -0.594  -9.096  -6.977
  735   1HG   LYS  97          HG2       LYS  97   0.048 -10.191  -4.860
  736   2HG   LYS  97          HG1       LYS  97  -1.473  -9.677  -4.133
  737   1HD   LYS  97          HD2       LYS  97  -2.723 -10.974  -5.815
  738   2HD   LYS  97          HD1       LYS  97  -1.204 -11.493  -6.546
  739   1HE   LYS  97          HE2       LYS  97  -2.236 -12.146  -3.777
  740   2HE   LYS  97          HE1       LYS  97  -1.898 -13.271  -5.094
  741   1HZ   LYS  97          HZ1       LYS  97  -0.034 -13.431  -3.755
  742   2HZ   LYS  97          HZ2       LYS  97   0.002 -11.768  -3.410
  743   3HZ   LYS  97          HZ3       LYS  97   0.465 -12.331  -4.945
  744    H    ASP  98           HN       ASP  98  -2.197  -5.987  -6.323
  745    HA   ASP  98           HA       ASP  98  -1.009  -5.101  -8.761
  746   1HB   ASP  98          HB2       ASP  98  -3.040  -3.787  -6.932
  747   2HB   ASP  98          HB1       ASP  98  -2.602  -3.142  -8.513
  748    H    LEU  99           HN       LEU  99  -0.934  -3.780  -5.485
  749    HA   LEU  99           HA       LEU  99   0.564  -1.424  -6.094
  750   1HB   LEU  99          HB2       LEU  99  -0.731  -1.861  -3.979
  751   2HB   LEU  99          HB1       LEU  99   0.523  -3.001  -3.506
  752    HG   LEU  99           HG       LEU  99   2.180  -1.056  -3.826
  753   1HD1  LEU  99          HD11      LEU  99   1.024   1.196  -3.363
  754   2HD1  LEU  99          HD12      LEU  99  -0.460   0.417  -3.902
  755   3HD1  LEU  99          HD13      LEU  99   0.907   0.572  -5.005
  756   1HD2  LEU  99          HD21      LEU  99   1.722  -1.819  -1.616
  757   2HD2  LEU  99          HD22      LEU  99   0.096  -1.139  -1.640
  758   3HD2  LEU  99          HD23      LEU  99   1.498  -0.071  -1.565
  759    H    LEU 100           HN       LEU 100   1.508  -4.735  -5.306
  760    HA   LEU 100           HA       LEU 100   4.267  -4.319  -4.827
  761   1HB   LEU 100          HB2       LEU 100   3.172  -6.443  -4.355
  762   2HB   LEU 100          HB1       LEU 100   2.846  -6.691  -6.067
  763    HG   LEU 100           HG       LEU 100   5.253  -6.823  -6.535
  764   1HD1  LEU 100          HD11      LEU 100   6.324  -5.407  -4.999
  765   2HD1  LEU 100          HD12      LEU 100   6.739  -7.005  -4.381
  766   3HD1  LEU 100          HD13      LEU 100   5.448  -6.074  -3.620
  767   1HD2  LEU 100          HD21      LEU 100   5.689  -8.941  -5.439
  768   2HD2  LEU 100          HD22      LEU 100   3.966  -8.850  -5.805
  769   3HD2  LEU 100          HD23      LEU 100   4.534  -8.563  -4.160
  770    H    LEU 101           HN       LEU 101   2.602  -4.933  -7.944
  771    HA   LEU 101           HA       LEU 101   4.975  -5.076  -9.513
  772   1HB   LEU 101          HB2       LEU 101   2.131  -4.289 -10.136
  773   2HB   LEU 101          HB1       LEU 101   3.371  -4.147 -11.374
  774    HG   LEU 101           HG       LEU 101   1.972  -6.328 -11.279
  775   1HD1  LEU 101          HD11      LEU 101   4.171  -7.701 -11.695
  776   2HD1  LEU 101          HD12      LEU 101   4.959  -6.135 -11.530
  777   3HD1  LEU 101          HD13      LEU 101   3.747  -6.378 -12.778
  778   1HD2  LEU 101          HD21      LEU 101   3.999  -7.104  -9.167
  779   2HD2  LEU 101          HD22      LEU 101   2.607  -8.018  -9.733
  780   3HD2  LEU 101          HD23      LEU 101   2.369  -6.574  -8.757
  781    H    HIS 102           HN       HIS 102   2.991  -2.254  -8.632
  782    HA   HIS 102           HA       HIS 102   4.624  -0.391 -10.103
  783   1HB   HIS 102          HB2       HIS 102   2.554  -0.097  -7.932
  784   2HB   HIS 102          HB1       HIS 102   3.466   1.302  -8.503
  785    HD1  HIS 102           HD1      HIS 102   3.062   2.096 -10.922
  786    HD2  HIS 102           HD2      HIS 102   0.736  -1.182  -9.839
  787    HE1  HIS 102           HE1      HIS 102   1.334   1.822 -12.748
  788    H    LEU 103           HN       LEU 103   4.733  -1.468  -6.692
  789    HA   LEU 103           HA       LEU 103   6.552   0.528  -5.811
  790   1HB   LEU 103          HB2       LEU 103   6.208  -2.340  -4.919
  791   2HB   LEU 103          HB1       LEU 103   7.263  -1.198  -4.093
  792    HG   LEU 103           HG       LEU 103   4.320  -0.701  -4.596
  793   1HD1  LEU 103          HD11      LEU 103   4.118  -1.211  -2.117
  794   2HD1  LEU 103          HD12      LEU 103   5.754  -1.866  -2.199
  795   3HD1  LEU 103          HD13      LEU 103   4.459  -2.608  -3.139
  796   1HD2  LEU 103          HD21      LEU 103   6.503   0.763  -3.129
  797   2HD2  LEU 103          HD22      LEU 103   4.853   0.871  -2.523
  798   3HD2  LEU 103          HD23      LEU 103   5.223   1.407  -4.156
  799    H    LYS 104           HN       LYS 104   7.349  -2.746  -7.105
  800    HA   LYS 104           HA       LYS 104  10.184  -2.183  -7.002
  801   1HB   LYS 104          HB2       LYS 104  10.448  -4.196  -8.417
  802   2HB   LYS 104          HB1       LYS 104   9.408  -4.495  -7.027
  803   1HG   LYS 104          HG2       LYS 104   7.418  -4.236  -8.426
  804   2HG   LYS 104          HG1       LYS 104   8.429  -3.854  -9.823
  805   1HD   LYS 104          HD2       LYS 104   9.491  -6.071  -9.676
  806   2HD   LYS 104          HD1       LYS 104   8.504  -6.461  -8.270
  807   1HE   LYS 104          HE2       LYS 104   6.585  -6.747  -9.531
  808   2HE   LYS 104          HE1       LYS 104   7.082  -5.576 -10.754
  809   1HZ   LYS 104          HZ1       LYS 104   8.631  -8.046 -10.456
  810   2HZ   LYS 104          HZ2       LYS 104   8.349  -7.104 -11.841
  811   3HZ   LYS 104          HZ3       LYS 104   7.130  -8.124 -11.241
  812    H    LYS 105           HN       LYS 105   7.699  -1.365  -9.282
  813    HA   LYS 105           HA       LYS 105   9.351  -1.087 -11.613
  814   1HB   LYS 105          HB2       LYS 105   6.827  -1.098 -11.564
  815   2HB   LYS 105          HB1       LYS 105   6.896   0.553 -10.949
  816   1HG   LYS 105          HG2       LYS 105   8.187   1.249 -12.935
  817   2HG   LYS 105          HG1       LYS 105   8.112  -0.395 -13.565
  818   1HD   LYS 105          HD2       LYS 105   5.557   1.043 -12.860
  819   2HD   LYS 105          HD1       LYS 105   6.361   1.399 -14.386
  820   1HE   LYS 105          HE2       LYS 105   5.800  -1.455 -13.581
  821   2HE   LYS 105          HE1       LYS 105   4.563  -0.475 -14.362
  822   1HZ   LYS 105          HZ1       LYS 105   5.600  -1.397 -16.159
  823   2HZ   LYS 105          HZ2       LYS 105   7.129  -1.424 -15.420
  824   3HZ   LYS 105          HZ3       LYS 105   6.493   0.038 -16.009
  825    H    LEU 106           HN       LEU 106   8.356   1.329  -9.155
  826    HA   LEU 106           HA       LEU 106   9.748   3.519 -10.338
  827   1HB   LEU 106          HB2       LEU 106   8.860   2.914  -7.520
  828   2HB   LEU 106          HB1       LEU 106   9.822   4.347  -7.850
  829    HG   LEU 106           HG       LEU 106   7.259   4.623  -7.854
  830   1HD1  LEU 106          HD11      LEU 106   8.975   6.220  -8.878
  831   2HD1  LEU 106          HD12      LEU 106   7.335   6.323  -9.509
  832   3HD1  LEU 106          HD13      LEU 106   8.579   5.488 -10.432
  833   1HD2  LEU 106          HD21      LEU 106   7.469   3.498 -10.652
  834   2HD2  LEU 106          HD22      LEU 106   6.018   3.930  -9.753
  835   3HD2  LEU 106          HD23      LEU 106   6.954   2.519  -9.283
  836    H    PHE 107           HN       PHE 107  10.879   0.830  -8.414
  837    HA   PHE 107           HA       PHE 107  13.348   1.922  -7.528
  838   1HB   PHE 107          HB2       PHE 107  12.494  -0.272  -6.760
  839   2HB   PHE 107          HB1       PHE 107  12.766  -0.931  -8.372
  840    HD1  PHE 107           HD1      PHE 107  14.532   0.844  -5.598
  841    HD2  PHE 107           HD2      PHE 107  14.868  -1.836  -8.936
  842    HE1  PHE 107           HE1      PHE 107  16.908   0.436  -5.029
  843    HE2  PHE 107           HE2      PHE 107  17.245  -2.250  -8.365
  844    HZ   PHE 107           HZ       PHE 107  18.266  -1.114  -6.411
  845    H    ARG 108           HN       ARG 108  12.474   0.370 -10.604
  846    HA   ARG 108           HA       ARG 108  15.107   0.289 -11.696
  847   1HB   ARG 108          HB2       ARG 108  12.394   0.485 -13.023
  848   2HB   ARG 108          HB1       ARG 108  13.896   0.268 -13.923
  849   1HG   ARG 108          HG2       ARG 108  14.365  -1.794 -12.650
  850   2HG   ARG 108          HG1       ARG 108  12.861  -1.583 -11.753
  851   1HD   ARG 108          HD2       ARG 108  11.589  -1.721 -13.874
  852   2HD   ARG 108          HD1       ARG 108  13.097  -1.965 -14.753
  853    HE   ARG 108           HE       ARG 108  13.104  -3.966 -12.825
  854   1HH1  ARG 108          HH21      ARG 108  10.960  -2.849 -15.282
  855   2HH1  ARG 108          HH22      ARG 108  10.282  -4.413 -15.588
  856   1HH2  ARG 108          HH11      ARG 108  12.230  -6.017 -13.210
  857   2HH2  ARG 108          HH12      ARG 108  10.999  -6.206 -14.413
  858    H    GLU 109           HN       GLU 109  12.704   2.876 -11.544
  859    HA   GLU 109           HA       GLU 109  14.306   4.632 -13.281
  860   1HB   GLU 109          HB2       GLU 109  11.778   5.064 -11.672
  861   2HB   GLU 109          HB1       GLU 109  12.548   6.333 -12.623
  862   1HG   GLU 109          HG2       GLU 109  11.726   3.660 -13.783
  863   2HG   GLU 109          HG1       GLU 109  10.695   5.091 -13.824
  864    H    GLY 110           HN       GLY 110  14.267   3.811  -9.959
  865   1HA   GLY 110          HA2       GLY 110  15.493   4.677  -8.160
  866   2HA   GLY 110          HA1       GLY 110  16.428   5.583  -9.350
  867    H    ARG 111           HN       ARG 111  13.150   6.251  -9.739
  868    HA   ARG 111           HA       ARG 111  13.499   8.889  -8.405
  869   1HB   ARG 111          HB2       ARG 111  11.418   7.818 -10.336
  870   2HB   ARG 111          HB1       ARG 111  11.328   9.417  -9.597
  871   1HG   ARG 111          HG2       ARG 111  13.525   9.992 -10.564
  872   2HG   ARG 111          HG1       ARG 111  13.613   8.395 -11.307
  873   1HD   ARG 111          HD2       ARG 111  12.825   9.988 -12.968
  874   2HD   ARG 111          HD1       ARG 111  11.499   8.906 -12.542
  875    HE   ARG 111           HE       ARG 111  11.147  11.033 -10.822
  876   1HH1  ARG 111          HH21      ARG 111  11.611  10.654 -14.219
  877   2HH1  ARG 111          HH22      ARG 111  10.653  12.034 -14.639
  878   1HH2  ARG 111          HH11      ARG 111   9.888  12.839 -11.355
  879   2HH2  ARG 111          HH12      ARG 111   9.678  13.269 -13.020
  880    H    PHE 112           HN       PHE 112  13.145   8.478  -6.235
  881    HA   PHE 112           HA       PHE 112  10.745   6.931  -5.425
  882   1HB   PHE 112          HB2       PHE 112  12.902   8.172  -3.691
  883   2HB   PHE 112          HB1       PHE 112  11.735   6.929  -3.226
  884    HD1  PHE 112           HD1      PHE 112  11.820   4.670  -4.309
  885    HD2  PHE 112           HD2      PHE 112  14.892   7.610  -4.908
  886    HE1  PHE 112           HE1      PHE 112  13.333   2.916  -5.191
  887    HE2  PHE 112           HE2      PHE 112  16.402   5.848  -5.790
  888    HZ   PHE 112           HZ       PHE 112  15.623   3.502  -5.927
  889    H    ASN 113           HN       ASN 113   8.923   7.906  -4.689
  890    HA   ASN 113           HA       ASN 113   7.413   9.635  -4.218
  891   1HB   ASN 113          HB2       ASN 113   8.926   9.521  -2.141
  892   2HB   ASN 113          HB1       ASN 113   9.736  10.946  -2.790
  893   1HD2  ASN 113          HD21      ASN 113   8.944  12.448  -1.199
  894   2HD2  ASN 113          HD22      ASN 113   7.301  12.849  -1.060
  Start of MODEL   28
    1   1H    MET   1           HT1      MET   1  23.923   5.762  13.696
    2   2H    MET   1           HT2      MET   1  24.924   6.880  12.899
    3   3H    MET   1           HT3      MET   1  25.447   5.279  13.131
    4    HA   MET   1           HA       MET   1  24.678   5.784  10.827
    5   1HB   MET   1          HB2       MET   1  23.219   3.687  12.463
    6   2HB   MET   1          HB1       MET   1  23.270   3.715  10.701
    7   1HG   MET   1          HG2       MET   1  25.731   3.559  10.765
    8   2HG   MET   1          HG1       MET   1  25.685   3.529  12.529
    9   1HE   MET   1          HE1       MET   1  27.172   1.691  12.251
   10   2HE   MET   1          HE2       MET   1  27.024   0.925  10.672
   11   3HE   MET   1          HE3       MET   1  26.684  -0.005  12.128
   12    H    GLY   2           HN       GLY   2  23.295   7.190   9.861
   13   1HA   GLY   2          HA2       GLY   2  20.924   8.197  11.182
   14   2HA   GLY   2          HA1       GLY   2  21.389   8.530   9.513
   15    HA   PRO   3           HA       PRO   3  17.608   5.559  10.008
   16   1HB   PRO   3          HB2       PRO   3  16.454   7.340   7.973
   17   2HB   PRO   3          HB1       PRO   3  15.807   6.892   9.555
   18   1HG   PRO   3          HG2       PRO   3  17.020   9.384   8.812
   19   2HG   PRO   3          HG1       PRO   3  16.433   8.909  10.410
   20   1HD   PRO   3          HD2       PRO   3  19.167   9.290   9.628
   21   2HD   PRO   3          HD1       PRO   3  18.581   8.649  11.182
   22    H    VAL   4           HN       VAL   4  16.604   4.420   7.976
   23    HA   VAL   4           HA       VAL   4  18.814   3.669   6.246
   24    HB   VAL   4           HB       VAL   4  17.069   2.146   5.219
   25   1HG1  VAL   4          HG11      VAL   4  18.509   1.358   7.019
   26   2HG1  VAL   4          HG12      VAL   4  16.876   0.742   7.273
   27   3HG1  VAL   4          HG13      VAL   4  17.461   2.109   8.222
   28   1HG2  VAL   4          HG21      VAL   4  15.139   3.657   5.790
   29   2HG2  VAL   4          HG22      VAL   4  15.361   3.216   7.482
   30   3HG2  VAL   4          HG23      VAL   4  14.904   1.988   6.303
   31    HA   PRO   5           HA       PRO   5  17.836   6.592   3.006
   32   1HB   PRO   5          HB2       PRO   5  18.614   4.986   0.799
   33   2HB   PRO   5          HB1       PRO   5  19.646   6.097   1.707
   34   1HG   PRO   5          HG2       PRO   5  19.549   3.147   1.801
   35   2HG   PRO   5          HG1       PRO   5  20.846   4.240   2.296
   36   1HD   PRO   5          HD2       PRO   5  19.148   2.831   4.049
   37   2HD   PRO   5          HD1       PRO   5  20.151   4.239   4.486
   38    HA   PRO   6           HA       PRO   6  13.843   5.639   1.312
   39   1HB   PRO   6          HB2       PRO   6  14.211   6.572  -1.350
   40   2HB   PRO   6          HB1       PRO   6  13.601   7.500   0.024
   41   1HG   PRO   6          HG2       PRO   6  16.246   7.616  -1.265
   42   2HG   PRO   6          HG1       PRO   6  15.476   8.789  -0.189
   43   1HD   PRO   6          HD2       PRO   6  17.614   7.084   0.506
   44   2HD   PRO   6          HD1       PRO   6  16.573   7.963   1.654
   45    H    SER   7           HN       SER   7  16.485   4.770  -0.919
   46    HA   SER   7           HA       SER   7  15.013   2.841  -2.430
   47   1HB   SER   7          HB2       SER   7  17.213   1.987  -3.118
   48   2HB   SER   7          HB1       SER   7  17.211   3.748  -3.143
   49    HG   SER   7           HG       SER   7  18.203   2.053  -1.087
   50    H    THR   8           HN       THR   8  16.903   2.590   0.554
   51    HA   THR   8           HA       THR   8  16.702  -0.281   0.774
   52    HB   THR   8           HB       THR   8  17.102   1.840   2.901
   53    HG1  THR   8           HG1      THR   8  18.673   0.747   1.014
   54   1HG2  THR   8          HG21      THR   8  16.335  -0.092   4.045
   55   2HG2  THR   8          HG22      THR   8  18.093  -0.168   4.155
   56   3HG2  THR   8          HG23      THR   8  17.238  -1.175   2.986
   57    H    ALA   9           HN       ALA   9  14.749   2.403   2.046
   58    HA   ALA   9           HA       ALA   9  12.965   0.835   3.610
   59   1HB   ALA   9          HB1       ALA   9  12.157   3.314   2.076
   60   2HB   ALA   9          HB2       ALA   9  13.184   3.398   3.508
   61   3HB   ALA   9          HB3       ALA   9  11.548   2.751   3.632
   62    H    LEU  10           HN       LEU  10  12.733   1.926   0.217
   63    HA   LEU  10           HA       LEU  10  10.268   0.633  -0.368
   64   1HB   LEU  10          HB2       LEU  10  11.281   2.319  -1.854
   65   2HB   LEU  10          HB1       LEU  10  12.610   1.218  -2.209
   66    HG   LEU  10           HG       LEU  10  10.986  -0.403  -3.176
   67   1HD1  LEU  10          HD11      LEU  10   8.666   0.705  -3.703
   68   2HD1  LEU  10          HD12      LEU  10   9.034   1.723  -2.311
   69   3HD1  LEU  10          HD13      LEU  10   8.929  -0.028  -2.123
   70   1HD2  LEU  10          HD21      LEU  10  10.261   1.169  -5.126
   71   2HD2  LEU  10          HD22      LEU  10  11.978   0.956  -4.806
   72   3HD2  LEU  10          HD23      LEU  10  11.155   2.412  -4.248
   73    H    ARG  11           HN       ARG  11  13.636  -0.502  -0.798
   74    HA   ARG  11           HA       ARG  11  12.967  -3.041  -1.890
   75   1HB   ARG  11          HB2       ARG  11  15.337  -2.149  -0.226
   76   2HB   ARG  11          HB1       ARG  11  15.230  -3.739  -0.972
   77   1HG   ARG  11          HG2       ARG  11  14.855  -1.238  -2.622
   78   2HG   ARG  11          HG1       ARG  11  16.469  -1.842  -2.267
   79   1HD   ARG  11          HD2       ARG  11  14.256  -3.310  -3.740
   80   2HD   ARG  11          HD1       ARG  11  15.793  -2.758  -4.398
   81    HE   ARG  11           HE       ARG  11  16.566  -4.451  -2.369
   82   1HH1  ARG  11          HH21      ARG  11  14.415  -4.624  -5.055
   83   2HH1  ARG  11          HH22      ARG  11  14.633  -6.327  -5.292
   84   1HH2  ARG  11          HH11      ARG  11  16.865  -6.675  -2.662
   85   2HH2  ARG  11          HH12      ARG  11  16.020  -7.487  -3.938
   86    H    GLU  12           HN       GLU  12  13.385  -2.018   1.500
   87    HA   GLU  12           HA       GLU  12  12.950  -4.622   2.628
   88   1HB   GLU  12          HB2       GLU  12  12.546  -1.835   3.749
   89   2HB   GLU  12          HB1       GLU  12  12.308  -3.298   4.707
   90   1HG   GLU  12          HG2       GLU  12  14.877  -2.648   3.235
   91   2HG   GLU  12          HG1       GLU  12  14.602  -2.285   4.939
   92    H    LEU  13           HN       LEU  13  10.758  -1.974   1.780
   93    HA   LEU  13           HA       LEU  13   8.386  -3.136   2.880
   94   1HB   LEU  13          HB2       LEU  13   8.539  -0.769   2.237
   95   2HB   LEU  13          HB1       LEU  13   8.759  -1.222   0.551
   96    HG   LEU  13           HG       LEU  13   6.497  -2.262   0.559
   97   1HD1  LEU  13          HD11      LEU  13   5.037  -1.496   2.577
   98   2HD1  LEU  13          HD12      LEU  13   6.575  -1.320   3.424
   99   3HD1  LEU  13          HD13      LEU  13   6.088  -2.895   2.794
  100   1HD2  LEU  13          HD21      LEU  13   6.736   0.050  -0.184
  101   2HD2  LEU  13          HD22      LEU  13   6.657   0.624   1.482
  102   3HD2  LEU  13          HD23      LEU  13   5.237  -0.107   0.734
  103    H    ILE  14           HN       ILE  14   9.704  -3.194  -0.448
  104    HA   ILE  14           HA       ILE  14   7.675  -4.842  -1.569
  105    HB   ILE  14           HB       ILE  14  10.587  -4.454  -2.301
  106   1HG1  ILE  14          HG12      ILE  14   8.059  -3.500  -3.669
  107   2HG1  ILE  14          HG11      ILE  14   8.916  -2.544  -2.460
  108   1HG2  ILE  14          HG21      ILE  14   9.831  -5.421  -4.541
  109   2HG2  ILE  14          HG22      ILE  14   8.406  -6.026  -3.697
  110   3HG2  ILE  14          HG23      ILE  14  10.011  -6.588  -3.229
  111   1HD1  ILE  14          HD11      ILE  14   9.656  -1.880  -4.691
  112   2HD1  ILE  14          HD12      ILE  14  10.054  -3.554  -5.083
  113   3HD1  ILE  14          HD13      ILE  14  10.978  -2.692  -3.853
  114    H    GLU  15           HN       GLU  15  10.863  -5.789  -0.224
  115    HA   GLU  15           HA       GLU  15  10.539  -8.578  -0.645
  116   1HB   GLU  15          HB2       GLU  15  12.118  -7.053   1.440
  117   2HB   GLU  15          HB1       GLU  15  12.227  -8.802   1.228
  118   1HG   GLU  15          HG2       GLU  15  12.894  -8.480  -1.127
  119   2HG   GLU  15          HG1       GLU  15  12.788  -6.732  -0.916
  120    H    GLU  16           HN       GLU  16   9.569  -6.556   2.125
  121    HA   GLU  16           HA       GLU  16   8.690  -8.797   3.722
  122   1HB   GLU  16          HB2       GLU  16   9.262  -6.557   4.657
  123   2HB   GLU  16          HB1       GLU  16   7.818  -5.904   3.889
  124   1HG   GLU  16          HG2       GLU  16   6.412  -7.463   5.179
  125   2HG   GLU  16          HG1       GLU  16   7.854  -8.130   5.944
  126    H    LEU  17           HN       LEU  17   6.936  -6.506   1.590
  127    HA   LEU  17           HA       LEU  17   4.323  -7.524   2.099
  128   1HB   LEU  17          HB2       LEU  17   5.502  -6.249  -0.378
  129   2HB   LEU  17          HB1       LEU  17   3.792  -6.631  -0.215
  130    HG   LEU  17           HG       LEU  17   5.336  -4.873   1.716
  131   1HD1  LEU  17          HD11      LEU  17   5.214  -3.876  -0.543
  132   2HD1  LEU  17          HD12      LEU  17   4.213  -2.986   0.604
  133   3HD1  LEU  17          HD13      LEU  17   3.464  -4.097  -0.542
  134   1HD2  LEU  17          HD21      LEU  17   2.486  -5.819   1.513
  135   2HD2  LEU  17          HD22      LEU  17   2.763  -4.171   2.072
  136   3HD2  LEU  17          HD23      LEU  17   3.474  -5.525   2.943
  137    H    VAL  18           HN       VAL  18   6.761  -8.492  -0.284
  138    HA   VAL  18           HA       VAL  18   5.164 -10.452  -1.621
  139    HB   VAL  18           HB       VAL  18   8.162 -10.191  -1.250
  140   1HG1  VAL  18          HG11      VAL  18   8.220 -11.730  -3.286
  141   2HG1  VAL  18          HG12      VAL  18   6.535 -12.105  -2.933
  142   3HG1  VAL  18          HG13      VAL  18   7.789 -12.498  -1.757
  143   1HG2  VAL  18          HG21      VAL  18   6.466  -9.678  -3.703
  144   2HG2  VAL  18          HG22      VAL  18   8.137  -9.192  -3.424
  145   3HG2  VAL  18          HG23      VAL  18   6.833  -8.420  -2.523
  146    H    ASN  19           HN       ASN  19   7.316 -10.627   1.179
  147    HA   ASN  19           HA       ASN  19   7.351 -13.433   1.536
  148   1HB   ASN  19          HB2       ASN  19   7.513 -11.150   3.518
  149   2HB   ASN  19          HB1       ASN  19   7.809 -12.833   3.954
  150   1HD2  ASN  19          HD21      ASN  19   9.843 -10.751   4.071
  151   2HD2  ASN  19          HD22      ASN  19  11.047 -11.155   2.943
  152    H    ILE  20           HN       ILE  20   5.063 -11.029   2.882
  153    HA   ILE  20           HA       ILE  20   3.551 -13.094   4.273
  154    HB   ILE  20           HB       ILE  20   1.978 -11.224   4.785
  155   1HG1  ILE  20          HG12      ILE  20   3.968  -9.526   3.257
  156   2HG1  ILE  20          HG11      ILE  20   2.414 -10.025   2.602
  157   1HG2  ILE  20          HG21      ILE  20   4.929 -10.656   5.202
  158   2HG2  ILE  20          HG22      ILE  20   3.909 -11.656   6.236
  159   3HG2  ILE  20          HG23      ILE  20   3.614  -9.922   6.121
  160   1HD1  ILE  20          HD11      ILE  20   2.884  -8.329   5.064
  161   2HD1  ILE  20          HD12      ILE  20   1.307  -8.968   4.599
  162   3HD1  ILE  20          HD13      ILE  20   2.137  -7.819   3.549
  163    H    THR  21           HN       THR  21   3.365 -11.696   1.066
  164    HA   THR  21           HA       THR  21   0.582 -12.721   0.722
  165    HB   THR  21           HB       THR  21   0.714 -11.598  -1.501
  166    HG1  THR  21           HG1      THR  21   3.195 -11.808  -1.241
  167   1HG2  THR  21          HG21      THR  21   1.645  -9.556   0.482
  168   2HG2  THR  21          HG22      THR  21   0.156 -10.434   0.829
  169   3HG2  THR  21          HG23      THR  21   0.297  -9.478  -0.645
  170    H    GLN  22           HN       GLN  22   3.695 -13.953   0.345
  171    HA   GLN  22           HA       GLN  22   3.113 -15.454  -2.128
  172   1HB   GLN  22          HB2       GLN  22   5.464 -15.303  -0.250
  173   2HB   GLN  22          HB1       GLN  22   5.355 -16.612  -1.428
  174   1HG   GLN  22          HG2       GLN  22   5.020 -13.721  -2.238
  175   2HG   GLN  22          HG1       GLN  22   6.609 -14.483  -2.166
  176   1HE2  GLN  22          HE21      GLN  22   6.145 -17.023  -3.176
  177   2HE2  GLN  22          HE22      GLN  22   5.545 -16.933  -4.761
  178    H    ASN  23           HN       ASN  23   3.809 -16.364   1.260
  179    HA   ASN  23           HA       ASN  23   2.607 -19.038   0.749
  180   1HB   ASN  23          HB2       ASN  23   3.636 -19.690   2.845
  181   2HB   ASN  23          HB1       ASN  23   4.832 -18.817   1.885
  182   1HD2  ASN  23          HD21      ASN  23   2.932 -16.340   2.667
  183   2HD2  ASN  23          HD22      ASN  23   3.573 -15.884   4.172
  184    H    GLN  24           HN       GLN  24   0.858 -16.640   0.995
  185    HA   GLN  24           HA       GLN  24  -0.342 -16.834   3.660
  186   1HB   GLN  24          HB2       GLN  24  -1.822 -15.119   2.955
  187   2HB   GLN  24          HB1       GLN  24  -0.290 -14.741   2.174
  188   1HG   GLN  24          HG2       GLN  24  -2.741 -16.011   0.922
  189   2HG   GLN  24          HG1       GLN  24  -1.983 -14.480   0.498
  190   1HE2  GLN  24          HE21      GLN  24  -2.393 -17.249  -0.978
  191   2HE2  GLN  24          HE22      GLN  24  -0.864 -17.526  -1.663
  192    H    LYS  25           HN       LYS  25  -1.951 -18.205   4.251
  193    HA   LYS  25           HA       LYS  25  -3.040 -20.069   2.239
  194   1HB   LYS  25          HB2       LYS  25  -2.377 -20.893   4.492
  195   2HB   LYS  25          HB1       LYS  25  -3.594 -19.844   5.219
  196   1HG   LYS  25          HG2       LYS  25  -5.366 -21.020   3.960
  197   2HG   LYS  25          HG1       LYS  25  -4.149 -22.070   3.233
  198   1HD   LYS  25          HD2       LYS  25  -3.515 -22.892   5.472
  199   2HD   LYS  25          HD1       LYS  25  -4.733 -21.844   6.201
  200   1HE   LYS  25          HE2       LYS  25  -5.606 -24.130   5.957
  201   2HE   LYS  25          HE1       LYS  25  -6.497 -23.014   4.922
  202   1HZ   LYS  25          HZ1       LYS  25  -5.795 -25.139   3.844
  203   2HZ   LYS  25          HZ2       LYS  25  -4.186 -24.612   3.977
  204   3HZ   LYS  25          HZ3       LYS  25  -5.297 -23.735   3.035
  205    H    ALA  26           HN       ALA  26  -4.703 -18.334   4.878
  206    HA   ALA  26           HA       ALA  26  -7.068 -17.981   3.183
  207   1HB   ALA  26          HB1       ALA  26  -7.235 -16.439   5.626
  208   2HB   ALA  26          HB2       ALA  26  -6.493 -17.994   5.997
  209   3HB   ALA  26          HB3       ALA  26  -8.077 -17.939   5.230
  210    HA   PRO  27           HA       PRO  27  -6.241 -13.958   1.558
  211   1HB   PRO  27          HB2       PRO  27  -8.526 -12.559   2.613
  212   2HB   PRO  27          HB1       PRO  27  -8.346 -13.281   1.011
  213   1HG   PRO  27          HG2       PRO  27  -9.881 -14.265   3.305
  214   2HG   PRO  27          HG1       PRO  27  -9.941 -14.796   1.620
  215   1HD   PRO  27          HD2       PRO  27  -8.828 -16.255   3.767
  216   2HD   PRO  27          HD1       PRO  27  -8.557 -16.588   2.038
  217    H    LEU  28           HN       LEU  28  -5.851 -11.611   2.208
  218    HA   LEU  28           HA       LEU  28  -4.384 -11.495   4.687
  219   1HB   LEU  28          HB2       LEU  28  -5.285  -9.287   2.812
  220   2HB   LEU  28          HB1       LEU  28  -4.144  -9.069   4.136
  221    HG   LEU  28           HG       LEU  28  -3.751 -11.020   1.845
  222   1HD1  LEU  28          HD11      LEU  28  -2.089  -9.393   1.013
  223   2HD1  LEU  28          HD12      LEU  28  -2.531  -8.281   2.310
  224   3HD1  LEU  28          HD13      LEU  28  -3.703  -8.688   1.056
  225   1HD2  LEU  28          HD21      LEU  28  -2.396 -11.841   3.564
  226   2HD2  LEU  28          HD22      LEU  28  -2.143 -10.247   4.275
  227   3HD2  LEU  28          HD23      LEU  28  -1.292 -10.703   2.801
  228    H    CYS  29           HN       CYS  29  -7.678 -10.883   3.836
  229    HA   CYS  29           HA       CYS  29  -8.242 -10.141   6.657
  230   1HB   CYS  29          HB2       CYS  29  -8.937  -8.476   4.231
  231   2HB   CYS  29          HB1       CYS  29  -9.848  -8.353   5.737
  232    H    ASN  30           HN       ASN  30 -10.706 -10.159   6.991
  233    HA   ASN  30           HA       ASN  30 -11.750 -12.662   6.046
  234   1HB   ASN  30          HB2       ASN  30 -12.417 -11.667   8.203
  235   2HB   ASN  30          HB1       ASN  30 -13.194 -10.334   7.348
  236   1HD2  ASN  30          HD21      ASN  30 -13.312 -13.923   7.626
  237   2HD2  ASN  30          HD22      ASN  30 -14.968 -14.043   7.272
  238    H    GLY  31           HN       GLY  31 -11.121 -11.503   3.706
  239   1HA   GLY  31          HA2       GLY  31 -12.095 -11.167   1.590
  240   2HA   GLY  31          HA1       GLY  31 -13.677 -11.354   2.345
  241    H    SER  32           HN       SER  32 -11.711  -9.013   3.891
  242    HA   SER  32           HA       SER  32 -13.524  -6.882   3.334
  243   1HB   SER  32          HB2       SER  32 -10.635  -6.765   4.234
  244   2HB   SER  32          HB1       SER  32 -11.743  -5.397   4.243
  245    HG   SER  32           HG       SER  32 -13.129  -6.796   5.564
  246    H    MET  33           HN       MET  33 -13.511  -5.283   1.785
  247    HA   MET  33           HA       MET  33 -11.455  -5.513  -0.395
  248   1HB   MET  33          HB2       MET  33 -14.336  -4.602  -0.651
  249   2HB   MET  33          HB1       MET  33 -13.192  -4.849  -1.964
  250   1HG   MET  33          HG2       MET  33 -13.058  -7.309  -0.826
  251   2HG   MET  33          HG1       MET  33 -14.703  -6.873  -0.369
  252   1HE   MET  33          HE1       MET  33 -15.834  -5.149  -2.339
  253   2HE   MET  33          HE2       MET  33 -16.717  -6.642  -2.046
  254   3HE   MET  33          HE3       MET  33 -16.438  -6.101  -3.699
  255    H    VAL  34           HN       VAL  34 -10.989  -3.455  -1.495
  256    HA   VAL  34           HA       VAL  34 -11.492  -1.027   0.203
  257    HB   VAL  34           HB       VAL  34  -9.109  -0.360  -0.616
  258   1HG1  VAL  34          HG11      VAL  34  -9.649  -2.506   1.447
  259   2HG1  VAL  34          HG12      VAL  34  -9.462  -0.773   1.710
  260   3HG1  VAL  34          HG13      VAL  34  -8.068  -1.750   1.251
  261   1HG2  VAL  34          HG21      VAL  34  -9.117  -2.405  -2.209
  262   2HG2  VAL  34          HG22      VAL  34  -8.768  -3.361  -0.769
  263   3HG2  VAL  34          HG23      VAL  34  -7.646  -2.102  -1.284
  264    H    TRP  35           HN       TRP  35 -11.286   1.009  -1.043
  265    HA   TRP  35           HA       TRP  35 -12.601   0.816  -3.617
  266   1HB   TRP  35          HB2       TRP  35 -11.292   3.154  -2.197
  267   2HB   TRP  35          HB1       TRP  35 -12.230   3.296  -3.681
  268    HD1  TRP  35           HD1      TRP  35 -12.581   2.636   0.047
  269    HE1  TRP  35           HE1      TRP  35 -15.069   2.812   0.697
  270    HE3  TRP  35           HE3      TRP  35 -14.676   3.001  -4.592
  271    HZ2  TRP  35           HZ2      TRP  35 -17.617   3.078  -0.586
  272    HZ3  TRP  35           HZ3      TRP  35 -17.137   3.217  -4.846
  273    HH2  TRP  35           HH2      TRP  35 -18.604   3.254  -2.855
  274    H    SER  36           HN       SER  36 -11.675   0.948  -5.670
  275    HA   SER  36           HA       SER  36  -8.844   0.415  -5.920
  276   1HB   SER  36          HB2       SER  36  -9.231   0.430  -8.303
  277   2HB   SER  36          HB1       SER  36 -10.618  -0.348  -7.547
  278    HG   SER  36           HG       SER  36 -11.704   1.660  -7.684
  279    H    ILE  37           HN       ILE  37  -7.236   1.813  -6.875
  280    HA   ILE  37           HA       ILE  37  -7.907   4.740  -6.868
  281    HB   ILE  37           HB       ILE  37  -5.630   5.133  -5.899
  282   1HG1  ILE  37          HG12      ILE  37  -5.663   2.199  -5.166
  283   2HG1  ILE  37          HG11      ILE  37  -4.829   2.773  -6.602
  284   1HG2  ILE  37          HG21      ILE  37  -7.713   5.093  -4.517
  285   2HG2  ILE  37          HG22      ILE  37  -6.276   4.613  -3.614
  286   3HG2  ILE  37          HG23      ILE  37  -7.413   3.388  -4.179
  287   1HD1  ILE  37          HD11      ILE  37  -3.366   2.602  -4.551
  288   2HD1  ILE  37          HD12      ILE  37  -4.328   3.897  -3.839
  289   3HD1  ILE  37          HD13      ILE  37  -3.390   4.198  -5.302
  290    H    ASN  38           HN       ASN  38  -6.338   6.029  -8.149
  291    HA   ASN  38           HA       ASN  38  -5.500   4.526 -10.569
  292   1HB   ASN  38          HB2       ASN  38  -5.566   7.494  -9.926
  293   2HB   ASN  38          HB1       ASN  38  -5.034   6.824 -11.468
  294   1HD2  ASN  38          HD21      ASN  38  -6.983   4.721 -11.719
  295   2HD2  ASN  38          HD22      ASN  38  -8.506   5.438 -11.930
  296    H    LEU  39           HN       LEU  39  -3.408   3.796 -10.663
  297    HA   LEU  39           HA       LEU  39  -1.462   4.725  -8.689
  298   1HB   LEU  39          HB2       LEU  39  -1.240   2.791 -11.014
  299   2HB   LEU  39          HB1       LEU  39   0.084   3.143  -9.908
  300    HG   LEU  39           HG       LEU  39  -1.107   1.077  -9.262
  301   1HD1  LEU  39          HD11      LEU  39  -0.179   2.877  -7.566
  302   2HD1  LEU  39          HD12      LEU  39  -1.093   1.492  -6.983
  303   3HD1  LEU  39          HD13      LEU  39  -1.880   3.059  -7.141
  304   1HD2  LEU  39          HD21      LEU  39  -3.394   0.984  -8.767
  305   2HD2  LEU  39          HD22      LEU  39  -3.361   2.055 -10.166
  306   3HD2  LEU  39          HD23      LEU  39  -3.524   2.727  -8.544
  307    H    THR  40           HN       THR  40  -0.344   6.602  -9.005
  308    HA   THR  40           HA       THR  40   0.766   7.161 -11.706
  309    HB   THR  40           HB       THR  40  -0.012   9.520 -11.588
  310    HG1  THR  40           HG1      THR  40  -1.043  10.208  -9.889
  311   1HG2  THR  40          HG21      THR  40  -1.313   7.620 -12.723
  312   2HG2  THR  40          HG22      THR  40  -2.221   9.085 -12.350
  313   3HG2  THR  40          HG23      THR  40  -2.378   7.664 -11.318
  314    H    ALA  41           HN       ALA  41   0.475   9.325  -8.902
  315    HA   ALA  41           HA       ALA  41   3.455   9.128  -8.525
  316   1HB   ALA  41          HB1       ALA  41   3.288  11.543  -7.803
  317   2HB   ALA  41          HB2       ALA  41   1.622  11.536  -8.380
  318   3HB   ALA  41          HB3       ALA  41   2.950  11.270  -9.511
  319    H    GLY  42           HN       GLY  42   0.891  10.784  -6.687
  320   1HA   GLY  42          HA2       GLY  42   2.000   9.980  -4.158
  321   2HA   GLY  42          HA1       GLY  42   0.410  10.709  -4.389
  322    H    MET  43           HN       MET  43   1.740   7.651  -5.643
  323    HA   MET  43           HA       MET  43  -0.667   6.187  -5.265
  324   1HB   MET  43          HB2       MET  43   2.175   5.130  -5.284
  325   2HB   MET  43          HB1       MET  43   0.716   4.195  -5.615
  326   1HG   MET  43          HG2       MET  43   0.233   5.768  -7.519
  327   2HG   MET  43          HG1       MET  43   1.811   6.500  -7.247
  328   1HE   MET  43          HE1       MET  43   3.547   3.620  -6.426
  329   2HE   MET  43          HE2       MET  43   3.854   5.270  -6.965
  330   3HE   MET  43          HE3       MET  43   4.372   3.914  -7.963
  331    H    TYR  44           HN       TYR  44   2.177   6.591  -3.167
  332    HA   TYR  44           HA       TYR  44   1.414   4.704  -1.173
  333   1HB   TYR  44          HB2       TYR  44   3.078   7.229  -1.006
  334   2HB   TYR  44          HB1       TYR  44   2.889   6.103   0.340
  335    HD1  TYR  44           HD1      TYR  44   3.836   3.844   0.245
  336    HD2  TYR  44           HD2      TYR  44   4.324   6.602  -3.011
  337    HE1  TYR  44           HE1      TYR  44   5.602   2.394  -0.718
  338    HE2  TYR  44           HE2      TYR  44   6.092   5.153  -3.974
  339    HH   TYR  44           HH       TYR  44   7.153   3.200  -3.821
  340    H    CYS  45           HN       CYS  45   0.763   8.224  -1.372
  341    HA   CYS  45           HA       CYS  45  -0.721   8.283   1.093
  342   1HB   CYS  45          HB2       CYS  45  -0.692  10.153  -1.286
  343   2HB   CYS  45          HB1       CYS  45  -1.594  10.475   0.196
  344    H    ALA  46           HN       ALA  46  -1.798   8.101  -2.328
  345    HA   ALA  46           HA       ALA  46  -4.589   7.989  -1.747
  346   1HB   ALA  46          HB1       ALA  46  -3.698   8.307  -4.036
  347   2HB   ALA  46          HB2       ALA  46  -4.820   6.949  -3.970
  348   3HB   ALA  46          HB3       ALA  46  -3.081   6.655  -4.019
  349    H    ALA  47           HN       ALA  47  -2.121   5.452  -1.991
  350    HA   ALA  47           HA       ALA  47  -3.895   3.242  -1.611
  351   1HB   ALA  47          HB1       ALA  47  -0.938   3.653  -1.172
  352   2HB   ALA  47          HB2       ALA  47  -1.740   2.697  -2.418
  353   3HB   ALA  47          HB3       ALA  47  -1.711   2.126  -0.749
  354    H    LEU  48           HN       LEU  48  -2.086   5.280   0.668
  355    HA   LEU  48           HA       LEU  48  -2.623   3.798   3.021
  356   1HB   LEU  48          HB2       LEU  48  -0.988   5.637   2.919
  357   2HB   LEU  48          HB1       LEU  48  -2.292   6.795   2.684
  358    HG   LEU  48           HG       LEU  48  -3.221   6.182   4.906
  359   1HD1  LEU  48          HD11      LEU  48  -0.884   4.276   4.861
  360   2HD1  LEU  48          HD12      LEU  48  -2.560   3.962   5.313
  361   3HD1  LEU  48          HD13      LEU  48  -1.514   4.877   6.393
  362   1HD2  LEU  48          HD21      LEU  48  -1.484   7.276   6.232
  363   2HD2  LEU  48          HD22      LEU  48  -1.578   8.039   4.644
  364   3HD2  LEU  48          HD23      LEU  48  -0.276   6.905   5.000
  365    H    GLU  49           HN       GLU  49  -4.475   6.581   1.683
  366    HA   GLU  49           HA       GLU  49  -6.481   6.563   3.698
  367   1HB   GLU  49          HB2       GLU  49  -7.932   7.677   1.918
  368   2HB   GLU  49          HB1       GLU  49  -6.391   8.465   2.259
  369   1HG   GLU  49          HG2       GLU  49  -5.381   7.326   0.329
  370   2HG   GLU  49          HG1       GLU  49  -6.929   6.563  -0.034
  371    H    SER  50           HN       SER  50  -6.199   4.648   0.732
  372    HA   SER  50           HA       SER  50  -8.871   3.592   0.824
  373   1HB   SER  50          HB2       SER  50  -8.016   1.850  -0.677
  374   2HB   SER  50          HB1       SER  50  -7.393   3.424  -1.166
  375    HG   SER  50           HG       SER  50  -6.076   1.422   0.359
  376    H    LEU  51           HN       LEU  51  -5.798   2.500   2.239
  377    HA   LEU  51           HA       LEU  51  -6.882   0.063   3.349
  378   1HB   LEU  51          HB2       LEU  51  -4.440   1.688   4.109
  379   2HB   LEU  51          HB1       LEU  51  -4.814   0.097   4.765
  380    HG   LEU  51           HG       LEU  51  -4.471   0.682   1.806
  381   1HD1  LEU  51          HD11      LEU  51  -2.263  -0.252   1.981
  382   2HD1  LEU  51          HD12      LEU  51  -2.529  -0.722   3.659
  383   3HD1  LEU  51          HD13      LEU  51  -2.392   0.983   3.233
  384   1HD2  LEU  51          HD21      LEU  51  -5.729  -1.293   1.896
  385   2HD2  LEU  51          HD22      LEU  51  -5.029  -1.798   3.433
  386   3HD2  LEU  51          HD23      LEU  51  -4.094  -1.941   1.947
  387    H    ILE  52           HN       ILE  52  -6.494   3.365   4.580
  388    HA   ILE  52           HA       ILE  52  -7.060   2.938   7.292
  389    HB   ILE  52           HB       ILE  52  -7.782   5.223   5.442
  390   1HG1  ILE  52          HG12      ILE  52  -5.388   4.883   5.933
  391   2HG1  ILE  52          HG11      ILE  52  -5.969   6.381   6.643
  392   1HG2  ILE  52          HG21      ILE  52  -8.136   6.519   7.627
  393   2HG2  ILE  52          HG22      ILE  52  -8.328   4.941   8.392
  394   3HG2  ILE  52          HG23      ILE  52  -9.433   5.440   7.112
  395   1HD1  ILE  52          HD11      ILE  52  -4.859   5.565   8.479
  396   2HD1  ILE  52          HD12      ILE  52  -5.020   3.889   7.964
  397   3HD1  ILE  52          HD13      ILE  52  -6.372   4.704   8.746
  398    H    ASN  53           HN       ASN  53  -9.091   2.300   4.621
  399    HA   ASN  53           HA       ASN  53 -11.594   2.535   6.179
  400   1HB   ASN  53          HB2       ASN  53 -10.960   1.640   3.359
  401   2HB   ASN  53          HB1       ASN  53 -12.566   1.448   4.061
  402   1HD2  ASN  53          HD21      ASN  53 -12.943   3.785   5.486
  403   2HD2  ASN  53          HD22      ASN  53 -12.850   5.134   4.459
  404    H    VAL  54           HN       VAL  54  -9.113   0.247   5.718
  405    HA   VAL  54           HA       VAL  54 -10.847  -2.104   6.174
  406    HB   VAL  54           HB       VAL  54  -7.821  -1.898   6.067
  407   1HG1  VAL  54          HG11      VAL  54  -8.065  -4.379   5.589
  408   2HG1  VAL  54          HG12      VAL  54  -9.757  -4.228   6.062
  409   3HG1  VAL  54          HG13      VAL  54  -8.481  -3.896   7.234
  410   1HG2  VAL  54          HG21      VAL  54  -8.085  -2.800   3.776
  411   2HG2  VAL  54          HG22      VAL  54  -8.877  -1.232   3.938
  412   3HG2  VAL  54          HG23      VAL  54  -9.838  -2.711   3.946
  413    H    SER  55           HN       SER  55 -11.316  -2.844   8.178
  414    HA   SER  55           HA       SER  55  -9.542  -2.069  10.474
  415   1HB   SER  55          HB2       SER  55 -12.576  -2.151  10.418
  416   2HB   SER  55          HB1       SER  55 -11.601  -1.909  11.866
  417    HG   SER  55           HG       SER  55 -12.390   0.034  10.738
  418    H    GLY  56           HN       GLY  56  -9.342  -3.690  12.092
  419   1HA   GLY  56          HA2       GLY  56  -9.638  -5.849  13.049
  420   2HA   GLY  56          HA1       GLY  56 -10.826  -6.213  11.798
  421    H    CYS  57           HN       CYS  57  -7.567  -4.987  11.153
  422    HA   CYS  57           HA       CYS  57  -6.688  -7.690  10.266
  423   1HB   CYS  57          HB2       CYS  57  -7.049  -5.271   8.495
  424   2HB   CYS  57          HB1       CYS  57  -5.879  -6.523   8.092
  425    H    SER  58           HN       SER  58  -5.102  -7.519  11.979
  426    HA   SER  58           HA       SER  58  -3.281  -5.239  12.061
  427   1HB   SER  58          HB2       SER  58  -3.779  -6.521  14.109
  428   2HB   SER  58          HB1       SER  58  -3.082  -7.964  13.381
  429    HG   SER  58           HG       SER  58  -1.667  -6.669  14.786
  430    H    ALA  59           HN       ALA  59  -3.323  -8.393  10.534
  431    HA   ALA  59           HA       ALA  59  -0.634  -8.870  10.015
  432   1HB   ALA  59          HB1       ALA  59  -1.368  -9.917   7.881
  433   2HB   ALA  59          HB2       ALA  59  -2.955  -9.179   8.091
  434   3HB   ALA  59          HB3       ALA  59  -2.386 -10.384   9.245
  435    H    ILE  60           HN       ILE  60  -2.376  -6.091   9.114
  436    HA   ILE  60           HA       ILE  60  -0.214  -5.323   7.174
  437    HB   ILE  60           HB       ILE  60  -1.907  -3.850   6.087
  438   1HG1  ILE  60          HG12      ILE  60  -3.894  -5.381   7.788
  439   2HG1  ILE  60          HG11      ILE  60  -3.419  -3.713   8.092
  440   1HG2  ILE  60          HG21      ILE  60  -2.893  -6.708   6.157
  441   2HG2  ILE  60          HG22      ILE  60  -1.381  -6.256   5.370
  442   3HG2  ILE  60          HG23      ILE  60  -2.908  -5.586   4.798
  443   1HD1  ILE  60          HD11      ILE  60  -4.675  -4.726   5.523
  444   2HD1  ILE  60          HD12      ILE  60  -4.231  -3.055   5.869
  445   3HD1  ILE  60          HD13      ILE  60  -5.522  -3.833   6.785
  446    H    GLU  61           HN       GLU  61  -1.007  -4.953  10.223
  447    HA   GLU  61           HA       GLU  61  -1.350  -2.156  10.666
  448   1HB   GLU  61          HB2       GLU  61  -1.444  -4.070  12.387
  449   2HB   GLU  61          HB1       GLU  61   0.308  -3.986  12.423
  450   1HG   GLU  61          HG2       GLU  61   0.190  -1.631  13.065
  451   2HG   GLU  61          HG1       GLU  61  -1.571  -1.688  12.990
  452    H    LYS  62           HN       LYS  62   1.549  -4.176  10.448
  453    HA   LYS  62           HA       LYS  62   3.476  -2.077  10.721
  454   1HB   LYS  62          HB2       LYS  62   3.611  -4.756   9.311
  455   2HB   LYS  62          HB1       LYS  62   5.004  -3.692   9.511
  456   1HG   LYS  62          HG2       LYS  62   4.711  -3.757  11.957
  457   2HG   LYS  62          HG1       LYS  62   3.320  -4.826  11.762
  458   1HD   LYS  62          HD2       LYS  62   4.758  -6.505  10.666
  459   2HD   LYS  62          HD1       LYS  62   6.151  -5.440  10.866
  460   1HE   LYS  62          HE2       LYS  62   4.465  -6.547  13.130
  461   2HE   LYS  62          HE1       LYS  62   6.051  -7.154  12.653
  462   1HZ   LYS  62          HZ1       LYS  62   6.735  -5.684  14.195
  463   2HZ   LYS  62          HZ2       LYS  62   5.345  -4.715  14.068
  464   3HZ   LYS  62          HZ3       LYS  62   6.589  -4.574  12.921
  465    H    THR  63           HN       THR  63   1.821  -3.447   7.903
  466    HA   THR  63           HA       THR  63   3.253  -2.083   5.876
  467    HB   THR  63           HB       THR  63   0.316  -2.832   5.940
  468    HG1  THR  63           HG1      THR  63   2.008  -4.369   4.486
  469   1HG2  THR  63          HG21      THR  63   2.177  -1.922   3.752
  470   2HG2  THR  63          HG22      THR  63   0.526  -1.403   4.096
  471   3HG2  THR  63          HG23      THR  63   0.822  -2.989   3.385
  472    H    GLN  64           HN       GLN  64   0.464  -1.057   7.822
  473    HA   GLN  64           HA       GLN  64  -0.052   1.386   6.460
  474   1HB   GLN  64          HB2       GLN  64  -0.421   0.588   9.360
  475   2HB   GLN  64          HB1       GLN  64  -1.013   2.109   8.690
  476   1HG   GLN  64          HG2       GLN  64  -1.713  -0.581   7.496
  477   2HG   GLN  64          HG1       GLN  64  -2.704   0.203   8.727
  478   1HE2  GLN  64          HE21      GLN  64  -2.974   2.761   8.074
  479   2HE2  GLN  64          HE22      GLN  64  -3.508   2.989   6.480
  480    H    ARG  65           HN       ARG  65   2.205   0.625   9.113
  481    HA   ARG  65           HA       ARG  65   3.057   3.322   9.559
  482   1HB   ARG  65          HB2       ARG  65   4.428   0.669  10.059
  483   2HB   ARG  65          HB1       ARG  65   5.103   2.218  10.567
  484   1HG   ARG  65          HG2       ARG  65   3.032   2.677  11.857
  485   2HG   ARG  65          HG1       ARG  65   2.411   1.093  11.392
  486   1HD   ARG  65          HD2       ARG  65   3.390   0.876  13.589
  487   2HD   ARG  65          HD1       ARG  65   4.466   0.071  12.442
  488    HE   ARG  65           HE       ARG  65   5.506   2.610  12.560
  489   1HH1  ARG  65          HH21      ARG  65   4.563   0.237  14.880
  490   2HH1  ARG  65          HH22      ARG  65   5.753   0.712  16.045
  491   1HH2  ARG  65          HH11      ARG  65   7.070   3.237  14.067
  492   2HH2  ARG  65          HH12      ARG  65   7.173   2.408  15.585
  493    H    MET  66           HN       MET  66   4.543   0.725   7.573
  494    HA   MET  66           HA       MET  66   6.717   2.309   6.644
  495   1HB   MET  66          HB2       MET  66   5.321  -0.078   5.415
  496   2HB   MET  66          HB1       MET  66   6.778   0.644   4.731
  497   1HG   MET  66          HG2       MET  66   7.940   0.300   6.904
  498   2HG   MET  66          HG1       MET  66   6.498  -0.491   7.532
  499   1HE   MET  66          HE1       MET  66   5.428  -2.407   5.121
  500   2HE   MET  66          HE2       MET  66   5.524  -2.507   6.875
  501   3HE   MET  66          HE3       MET  66   6.209  -3.793   5.887
  502    H    LEU  67           HN       LEU  67   3.442   1.889   5.307
  503    HA   LEU  67           HA       LEU  67   3.885   3.335   2.888
  504   1HB   LEU  67          HB2       LEU  67   1.394   3.007   4.575
  505   2HB   LEU  67          HB1       LEU  67   1.394   3.777   2.992
  506    HG   LEU  67           HG       LEU  67   2.419   0.969   3.495
  507   1HD1  LEU  67          HD11      LEU  67   0.041   1.042   4.011
  508   2HD1  LEU  67          HD12      LEU  67   0.269   0.241   2.455
  509   3HD1  LEU  67          HD13      LEU  67  -0.288   1.913   2.513
  510   1HD2  LEU  67          HD21      LEU  67   1.987   2.678   1.046
  511   2HD2  LEU  67          HD22      LEU  67   1.837   0.928   0.914
  512   3HD2  LEU  67          HD23      LEU  67   3.354   1.639   1.448
  513    H    SER  68           HN       SER  68   2.988   4.429   6.140
  514    HA   SER  68           HA       SER  68   2.486   7.148   5.520
  515   1HB   SER  68          HB2       SER  68   3.638   5.867   8.009
  516   2HB   SER  68          HB1       SER  68   3.203   7.572   7.912
  517    HG   SER  68           HG       SER  68   1.487   5.353   7.440
  518    H    GLY  69           HN       GLY  69   5.523   5.431   6.135
  519   1HA   GLY  69          HA2       GLY  69   7.306   7.570   6.367
  520   2HA   GLY  69          HA1       GLY  69   7.721   6.053   5.570
  521    H    PHE  70           HN       PHE  70   5.665   6.403   3.456
  522    HA   PHE  70           HA       PHE  70   7.186   8.353   1.784
  523   1HB   PHE  70          HB2       PHE  70   5.156   6.224   1.041
  524   2HB   PHE  70          HB1       PHE  70   5.970   7.282  -0.110
  525    HD1  PHE  70           HD1      PHE  70   8.435   7.131  -0.431
  526    HD2  PHE  70           HD2      PHE  70   6.297   4.360   2.058
  527    HE1  PHE  70           HE1      PHE  70  10.366   5.582  -0.503
  528    HE2  PHE  70           HE2      PHE  70   8.232   2.810   1.992
  529    HZ   PHE  70           HZ       PHE  70  10.265   3.420   0.709
  530    H    CYS  71           HN       CYS  71   4.545   8.381   3.741
  531    HA   CYS  71           HA       CYS  71   3.231  10.577   2.178
  532   1HB   CYS  71          HB2       CYS  71   1.983   8.315   2.225
  533   2HB   CYS  71          HB1       CYS  71   1.707   8.650   3.932
  534    HA   PRO  72           HA       PRO  72   4.826  11.895   6.407
  535   1HB   PRO  72          HB2       PRO  72   4.659  14.540   5.069
  536   2HB   PRO  72          HB1       PRO  72   6.010  13.802   5.941
  537   1HG   PRO  72          HG2       PRO  72   5.936  14.062   3.211
  538   2HG   PRO  72          HG1       PRO  72   6.852  12.800   4.047
  539   1HD   PRO  72          HD2       PRO  72   4.351  12.555   2.467
  540   2HD   PRO  72          HD1       PRO  72   5.547  11.299   2.880
  541    H    HIS  73           HN       HIS  73   1.850  11.989   5.038
  542    HA   HIS  73           HA       HIS  73   0.745  13.617   7.300
  543   1HB   HIS  73          HB2       HIS  73  -0.763  14.778   5.917
  544   2HB   HIS  73          HB1       HIS  73   0.730  14.798   4.985
  545    HD1  HIS  73           HD1      HIS  73  -2.762  13.607   4.915
  546    HD2  HIS  73           HD2      HIS  73   0.736  12.863   2.776
  547    HE1  HIS  73           HE1      HIS  73  -3.459  12.417   2.792
  548    H    LYS  74           HN       LYS  74  -0.536  12.361   8.510
  549    HA   LYS  74           HA       LYS  74  -1.420   9.749   7.548
  550   1HB   LYS  74          HB2       LYS  74  -1.871  11.250  10.140
  551   2HB   LYS  74          HB1       LYS  74  -2.500   9.632   9.833
  552   1HG   LYS  74          HG2       LYS  74  -0.212   8.802   9.440
  553   2HG   LYS  74          HG1       LYS  74   0.425  10.422   9.714
  554   1HD   LYS  74          HD2       LYS  74   0.717   9.495  11.833
  555   2HD   LYS  74          HD1       LYS  74  -0.878  10.218  12.020
  556   1HE   LYS  74          HE2       LYS  74  -1.785   7.916  11.225
  557   2HE   LYS  74          HE1       LYS  74  -0.167   7.318  11.586
  558   1HZ   LYS  74          HZ1       LYS  74  -0.374   8.009  13.832
  559   2HZ   LYS  74          HZ2       LYS  74  -1.780   7.135  13.450
  560   3HZ   LYS  74          HZ3       LYS  74  -1.824   8.833  13.524
  561    H    VAL  75           HN       VAL  75  -3.570   9.110   7.159
  562    HA   VAL  75           HA       VAL  75  -5.513  11.347   6.716
  563    HB   VAL  75           HB       VAL  75  -5.624   8.524   5.615
  564   1HG1  VAL  75          HG11      VAL  75  -7.329   9.398   4.160
  565   2HG1  VAL  75          HG12      VAL  75  -7.001  11.051   4.668
  566   3HG1  VAL  75          HG13      VAL  75  -7.753   9.918   5.788
  567   1HG2  VAL  75          HG21      VAL  75  -3.609   9.897   4.863
  568   2HG2  VAL  75          HG22      VAL  75  -4.756  11.038   4.164
  569   3HG2  VAL  75          HG23      VAL  75  -4.690   9.379   3.571
  570    H    SER  76           HN       SER  76  -7.485  11.303   7.751
  571    HA   SER  76           HA       SER  76  -7.792   9.294   9.922
  572   1HB   SER  76          HB2       SER  76  -8.025  11.657  10.538
  573   2HB   SER  76          HB1       SER  76  -9.286  11.869   9.328
  574    HG   SER  76           HG       SER  76  -9.782  11.328  11.707
  575    H    ALA  77           HN       ALA  77  -9.925   8.287  10.227
  576    HA   ALA  77           HA       ALA  77 -10.932   7.062   7.871
  577   1HB   ALA  77          HB1       ALA  77 -11.193   6.113  10.150
  578   2HB   ALA  77          HB2       ALA  77 -12.738   6.218   9.306
  579   3HB   ALA  77          HB3       ALA  77 -12.328   7.406  10.543
  580    H    GLY  78           HN       GLY  78 -11.487  10.195   9.093
  581   1HA   GLY  78          HA2       GLY  78 -14.111  10.446   7.682
  582   2HA   GLY  78          HA1       GLY  78 -13.447  11.613   8.823
  583    H    GLN  79           HN       GLN  79 -10.744  11.366   7.455
  584    HA   GLN  79           HA       GLN  79 -11.312  13.382   5.354
  585   1HB   GLN  79          HB2       GLN  79  -8.708  12.426   6.577
  586   2HB   GLN  79          HB1       GLN  79  -8.847  13.716   5.382
  587   1HG   GLN  79          HG2       GLN  79 -10.299  13.736   8.041
  588   2HG   GLN  79          HG1       GLN  79  -8.745  14.528   7.772
  589   1HE2  GLN  79          HE21      GLN  79 -11.661  15.582   8.215
  590   2HE2  GLN  79          HE22      GLN  79 -11.843  16.733   6.981
  591    H    PHE  80           HN       PHE  80 -11.416  12.803   3.256
  592    HA   PHE  80           HA       PHE  80  -9.836  10.433   2.305
  593   1HB   PHE  80          HB2       PHE  80 -12.673  11.190   1.547
  594   2HB   PHE  80          HB1       PHE  80 -11.720   9.932   0.766
  595    HD1  PHE  80           HD1      PHE  80 -13.780  10.789   3.618
  596    HD2  PHE  80           HD2      PHE  80 -10.912   7.962   2.127
  597    HE1  PHE  80           HE1      PHE  80 -14.462   9.175   5.372
  598    HE2  PHE  80           HE2      PHE  80 -11.593   6.346   3.879
  599    HZ   PHE  80           HZ       PHE  80 -13.368   6.950   5.500
  600    H    SER  81           HN       SER  81  -8.822  10.743   0.303
  601    HA   SER  81           HA       SER  81  -9.246  13.414  -1.014
  602   1HB   SER  81          HB2       SER  81  -6.632  11.906  -0.932
  603   2HB   SER  81          HB1       SER  81  -6.908  13.573  -1.431
  604    HG   SER  81           HG       SER  81  -7.324  14.122   0.663
  605    H    SER  82           HN       SER  82  -8.294  10.000  -1.591
  606    HA   SER  82           HA       SER  82  -8.573  10.454  -4.516
  607   1HB   SER  82          HB2       SER  82  -6.647   9.148  -3.403
  608   2HB   SER  82          HB1       SER  82  -7.814   7.844  -3.211
  609    HG   SER  82           HG       SER  82  -8.153   8.569  -5.638
  610    H    LEU  83           HN       LEU  83 -10.582   9.318  -1.998
  611    HA   LEU  83           HA       LEU  83 -12.007   7.339  -3.642
  612   1HB   LEU  83          HB2       LEU  83 -12.461   8.568  -0.922
  613   2HB   LEU  83          HB1       LEU  83 -13.702   7.581  -1.679
  614    HG   LEU  83           HG       LEU  83 -11.962   5.762  -1.961
  615   1HD1  LEU  83          HD11      LEU  83 -10.007   6.010  -0.321
  616   2HD1  LEU  83          HD12      LEU  83 -10.389   7.730  -0.281
  617   3HD1  LEU  83          HD13      LEU  83  -9.909   6.969  -1.797
  618   1HD2  LEU  83          HD21      LEU  83 -13.648   5.859  -0.087
  619   2HD2  LEU  83          HD22      LEU  83 -12.417   6.640   0.903
  620   3HD2  LEU  83          HD23      LEU  83 -12.167   4.994   0.327
  621    H    HIS  84           HN       HIS  84 -11.726  10.116  -4.657
  622    HA   HIS  84           HA       HIS  84 -14.365  11.352  -4.460
  623   1HB   HIS  84          HB2       HIS  84 -12.074  11.881  -6.379
  624   2HB   HIS  84          HB1       HIS  84 -13.487  12.913  -6.161
  625    HD1  HIS  84           HD1      HIS  84 -12.904  11.734  -2.918
  626    HD2  HIS  84           HD2      HIS  84 -10.917  14.521  -5.295
  627    HE1  HIS  84           HE1      HIS  84 -11.536  13.166  -1.350
  628    H    VAL  85           HN       VAL  85 -12.717   9.172  -6.670
  629    HA   VAL  85           HA       VAL  85 -14.738   9.379  -8.765
  630    HB   VAL  85           HB       VAL  85 -13.568   7.349  -9.687
  631   1HG1  VAL  85          HG11      VAL  85 -12.853   9.741 -10.128
  632   2HG1  VAL  85          HG12      VAL  85 -11.577   8.538 -10.317
  633   3HG1  VAL  85          HG13      VAL  85 -11.642   9.536  -8.863
  634   1HG2  VAL  85          HG21      VAL  85 -12.894   6.378  -7.518
  635   2HG2  VAL  85          HG22      VAL  85 -11.819   7.746  -7.237
  636   3HG2  VAL  85          HG23      VAL  85 -11.492   6.627  -8.559
  637    H    ARG  86           HN       ARG  86 -16.368   7.820  -9.240
  638    HA   ARG  86           HA       ARG  86 -17.255   6.255  -6.879
  639   1HB   ARG  86          HB2       ARG  86 -18.587   6.871  -9.536
  640   2HB   ARG  86          HB1       ARG  86 -19.315   5.874  -8.276
  641   1HG   ARG  86          HG2       ARG  86 -19.161   7.749  -6.691
  642   2HG   ARG  86          HG1       ARG  86 -18.433   8.753  -7.935
  643   1HD   ARG  86          HD2       ARG  86 -21.222   7.591  -7.905
  644   2HD   ARG  86          HD1       ARG  86 -20.790   9.295  -7.854
  645    HE   ARG  86           HE       ARG  86 -21.183   7.698 -10.206
  646   1HH1  ARG  86          HH21      ARG  86 -18.986  10.050  -8.938
  647   2HH1  ARG  86          HH22      ARG  86 -18.340  10.452 -10.492
  648   1HH2  ARG  86          HH11      ARG  86 -20.370   8.241 -12.214
  649   2HH2  ARG  86          HH12      ARG  86 -19.127   9.440 -12.341
  650    H    ASP  87           HN       ASP  87 -15.054   5.062  -7.635
  651    HA   ASP  87           HA       ASP  87 -15.495   3.055  -9.733
  652   1HB   ASP  87          HB2       ASP  87 -13.255   3.545  -7.754
  653   2HB   ASP  87          HB1       ASP  87 -13.260   2.182  -8.873
  654    H    THR  88           HN       THR  88 -15.004   0.668  -9.033
  655    HA   THR  88           HA       THR  88 -16.866   0.053  -6.808
  656    HB   THR  88           HB       THR  88 -16.703  -2.271  -7.645
  657    HG1  THR  88           HG1      THR  88 -14.507  -2.006  -8.389
  658   1HG2  THR  88          HG21      THR  88 -17.171  -0.177  -9.784
  659   2HG2  THR  88          HG22      THR  88 -18.365  -0.774  -8.633
  660   3HG2  THR  88          HG23      THR  88 -17.718  -1.852  -9.869
  661    H    LYS  89           HN       LYS  89 -16.225  -1.761  -5.311
  662    HA   LYS  89           HA       LYS  89 -13.538  -1.220  -4.224
  663   1HB   LYS  89          HB2       LYS  89 -15.791  -2.988  -3.227
  664   2HB   LYS  89          HB1       LYS  89 -14.285  -2.689  -2.363
  665   1HG   LYS  89          HG2       LYS  89 -14.790  -0.282  -2.291
  666   2HG   LYS  89          HG1       LYS  89 -16.300  -0.572  -3.156
  667   1HD   LYS  89          HD2       LYS  89 -17.089  -2.018  -1.328
  668   2HD   LYS  89          HD1       LYS  89 -15.574  -1.761  -0.461
  669   1HE   LYS  89          HE2       LYS  89 -16.036   0.583  -0.188
  670   2HE   LYS  89          HE1       LYS  89 -17.419   0.495  -1.278
  671   1HZ   LYS  89          HZ1       LYS  89 -17.150  -0.705   1.416
  672   2HZ   LYS  89          HZ2       LYS  89 -18.386  -1.143   0.335
  673   3HZ   LYS  89          HZ3       LYS  89 -18.273   0.455   0.902
  674    H    ILE  90           HN       ILE  90 -11.977  -2.907  -3.848
  675    HA   ILE  90           HA       ILE  90 -12.385  -5.411  -5.451
  676    HB   ILE  90           HB       ILE  90 -10.012  -5.241  -6.157
  677   1HG1  ILE  90          HG12      ILE  90 -10.129  -2.445  -4.978
  678   2HG1  ILE  90          HG11      ILE  90  -9.297  -3.795  -4.209
  679   1HG2  ILE  90          HG21      ILE  90 -11.655  -2.777  -6.814
  680   2HG2  ILE  90          HG22      ILE  90 -11.840  -4.353  -7.583
  681   3HG2  ILE  90          HG23      ILE  90 -10.344  -3.443  -7.791
  682   1HD1  ILE  90          HD11      ILE  90  -7.652  -2.572  -5.469
  683   2HD1  ILE  90          HD12      ILE  90  -8.679  -2.566  -6.903
  684   3HD1  ILE  90          HD13      ILE  90  -7.965  -4.075  -6.335
  685    H    GLU  91           HN       GLU  91 -10.998  -7.200  -4.741
  686    HA   GLU  91           HA       GLU  91 -10.995  -7.517  -1.903
  687   1HB   GLU  91          HB2       GLU  91  -9.588  -9.061  -4.095
  688   2HB   GLU  91          HB1       GLU  91  -9.604  -9.566  -2.405
  689   1HG   GLU  91          HG2       GLU  91 -12.118  -9.025  -4.006
  690   2HG   GLU  91          HG1       GLU  91 -11.403 -10.629  -3.831
  691    H    VAL  92           HN       VAL  92  -9.377  -7.290  -0.386
  692    HA   VAL  92           HA       VAL  92  -7.309  -5.396  -0.830
  693    HB   VAL  92           HB       VAL  92  -7.669  -7.511   1.311
  694   1HG1  VAL  92          HG11      VAL  92  -6.027  -5.977   2.583
  695   2HG1  VAL  92          HG12      VAL  92  -5.579  -5.351   0.995
  696   3HG1  VAL  92          HG13      VAL  92  -5.343  -7.057   1.370
  697   1HG2  VAL  92          HG21      VAL  92  -9.284  -5.488   0.991
  698   2HG2  VAL  92          HG22      VAL  92  -7.944  -4.515   1.594
  699   3HG2  VAL  92          HG23      VAL  92  -8.636  -5.786   2.602
  700    H    ALA  93           HN       ALA  93  -7.243  -8.957  -0.896
  701    HA   ALA  93           HA       ALA  93  -4.451  -9.325  -1.128
  702   1HB   ALA  93          HB1       ALA  93  -5.010 -11.438  -2.313
  703   2HB   ALA  93          HB2       ALA  93  -6.681 -10.893  -2.460
  704   3HB   ALA  93          HB3       ALA  93  -5.992 -11.210  -0.867
  705    H    GLN  94           HN       GLN  94  -6.846  -8.533  -3.641
  706    HA   GLN  94           HA       GLN  94  -4.901  -8.634  -5.803
  707   1HB   GLN  94          HB2       GLN  94  -7.328  -8.920  -6.220
  708   2HB   GLN  94          HB1       GLN  94  -7.613  -7.269  -5.672
  709   1HG   GLN  94          HG2       GLN  94  -6.208  -6.401  -7.497
  710   2HG   GLN  94          HG1       GLN  94  -5.874  -8.048  -8.035
  711   1HE2  GLN  94          HE21      GLN  94  -7.159  -6.172  -9.772
  712   2HE2  GLN  94          HE22      GLN  94  -8.760  -6.678 -10.021
  713    H    PHE  95           HN       PHE  95  -6.146  -6.186  -3.617
  714    HA   PHE  95           HA       PHE  95  -5.136  -3.871  -4.922
  715   1HB   PHE  95          HB2       PHE  95  -6.673  -3.710  -3.032
  716   2HB   PHE  95          HB1       PHE  95  -5.488  -4.461  -1.968
  717    HD1  PHE  95           HD1      PHE  95  -6.399  -1.412  -3.801
  718    HD2  PHE  95           HD2      PHE  95  -3.489  -3.267  -1.246
  719    HE1  PHE  95           HE1      PHE  95  -5.388   0.801  -3.338
  720    HE2  PHE  95           HE2      PHE  95  -2.477  -1.051  -0.788
  721    HZ   PHE  95           HZ       PHE  95  -3.428   0.980  -1.838
  722    H    VAL  96           HN       VAL  96  -3.630  -5.974  -2.453
  723    HA   VAL  96           HA       VAL  96  -1.165  -4.545  -2.301
  724    HB   VAL  96           HB       VAL  96  -1.710  -7.497  -1.864
  725   1HG1  VAL  96          HG11      VAL  96   0.666  -5.725  -1.293
  726   2HG1  VAL  96          HG12      VAL  96   0.633  -7.319  -2.045
  727   3HG1  VAL  96          HG13      VAL  96   0.352  -7.158  -0.313
  728   1HG2  VAL  96          HG21      VAL  96  -1.736  -6.764   0.554
  729   2HG2  VAL  96          HG22      VAL  96  -3.086  -6.152  -0.401
  730   3HG2  VAL  96          HG23      VAL  96  -1.730  -5.094  -0.015
  731    H    LYS  97           HN       LYS  97  -2.138  -7.320  -4.326
  732    HA   LYS  97           HA       LYS  97   0.391  -7.722  -5.564
  733   1HB   LYS  97          HB2       LYS  97  -2.425  -8.231  -6.564
  734   2HB   LYS  97          HB1       LYS  97  -0.972  -8.804  -7.390
  735   1HG   LYS  97          HG2       LYS  97  -0.280 -10.010  -5.354
  736   2HG   LYS  97          HG1       LYS  97  -1.727  -9.446  -4.522
  737   1HD   LYS  97          HD2       LYS  97  -3.132 -10.621  -6.186
  738   2HD   LYS  97          HD1       LYS  97  -1.674 -11.207  -6.990
  739   1HE   LYS  97          HE2       LYS  97  -2.382 -11.759  -4.093
  740   2HE   LYS  97          HE1       LYS  97  -2.638 -12.893  -5.419
  741   1HZ   LYS  97          HZ1       LYS  97   0.029 -11.778  -5.229
  742   2HZ   LYS  97          HZ2       LYS  97  -0.466 -13.372  -5.545
  743   3HZ   LYS  97          HZ3       LYS  97  -0.416 -12.796  -3.948
  744    H    ASP  98           HN       ASP  98  -2.364  -5.681  -6.610
  745    HA   ASP  98           HA       ASP  98  -1.132  -4.713  -8.999
  746   1HB   ASP  98          HB2       ASP  98  -3.144  -3.433  -7.121
  747   2HB   ASP  98          HB1       ASP  98  -2.672  -2.722  -8.665
  748    H    LEU  99           HN       LEU  99  -1.012  -3.622  -5.646
  749    HA   LEU  99           HA       LEU  99   0.549  -1.267  -6.083
  750   1HB   LEU  99          HB2       LEU  99  -0.709  -1.717  -3.995
  751   2HB   LEU  99          HB1       LEU  99   0.379  -3.052  -3.632
  752    HG   LEU  99           HG       LEU  99   2.287  -1.449  -3.596
  753   1HD1  LEU  99          HD11      LEU  99   0.068   0.480  -4.255
  754   2HD1  LEU  99          HD12      LEU  99   1.696   0.384  -4.928
  755   3HD1  LEU  99          HD13      LEU  99   1.450   1.037  -3.311
  756   1HD2  LEU  99          HD21      LEU  99   1.697  -0.424  -1.442
  757   2HD2  LEU  99          HD22      LEU  99   1.073  -2.072  -1.522
  758   3HD2  LEU  99          HD23      LEU  99  -0.013  -0.704  -1.764
  759    H    LEU 100           HN       LEU 100   1.410  -4.662  -5.566
  760    HA   LEU 100           HA       LEU 100   4.181  -4.354  -5.085
  761   1HB   LEU 100          HB2       LEU 100   3.005  -6.487  -4.798
  762   2HB   LEU 100          HB1       LEU 100   2.735  -6.591  -6.534
  763    HG   LEU 100           HG       LEU 100   5.183  -6.693  -6.910
  764   1HD1  LEU 100          HD11      LEU 100   5.228  -6.371  -3.909
  765   2HD1  LEU 100          HD12      LEU 100   6.172  -5.507  -5.123
  766   3HD1  LEU 100          HD13      LEU 100   6.551  -7.185  -4.746
  767   1HD2  LEU 100          HD21      LEU 100   5.539  -8.932  -5.804
  768   2HD2  LEU 100          HD22      LEU 100   4.014  -8.796  -6.679
  769   3HD2  LEU 100          HD23      LEU 100   4.036  -8.670  -4.920
  770    H    LEU 101           HN       LEU 101   2.473  -4.644  -8.235
  771    HA   LEU 101           HA       LEU 101   4.839  -4.709  -9.832
  772   1HB   LEU 101          HB2       LEU 101   2.014  -3.814 -10.357
  773   2HB   LEU 101          HB1       LEU 101   3.246  -3.560 -11.586
  774    HG   LEU 101           HG       LEU 101   1.910  -5.723 -11.781
  775   1HD1  LEU 101          HD11      LEU 101   4.372  -5.246 -12.629
  776   2HD1  LEU 101          HD12      LEU 101   3.711  -6.875 -12.696
  777   3HD1  LEU 101          HD13      LEU 101   4.810  -6.427 -11.395
  778   1HD2  LEU 101          HD21      LEU 101   3.655  -6.685  -9.508
  779   2HD2  LEU 101          HD22      LEU 101   2.285  -7.502 -10.258
  780   3HD2  LEU 101          HD23      LEU 101   2.019  -6.090  -9.239
  781    H    HIS 102           HN       HIS 102   2.925  -1.893  -8.730
  782    HA   HIS 102           HA       HIS 102   4.636   0.020 -10.039
  783   1HB   HIS 102          HB2       HIS 102   2.570   0.219  -7.853
  784   2HB   HIS 102          HB1       HIS 102   3.529   1.624  -8.319
  785    HD1  HIS 102           HD1      HIS 102   3.180   2.586 -10.697
  786    HD2  HIS 102           HD2      HIS 102   0.691  -0.634  -9.807
  787    HE1  HIS 102           HE1      HIS 102   1.415   2.539 -12.503
  788    H    LEU 103           HN       LEU 103   4.647  -1.277  -6.699
  789    HA   LEU 103           HA       LEU 103   6.545   0.552  -5.666
  790   1HB   LEU 103          HB2       LEU 103   6.091  -2.364  -5.011
  791   2HB   LEU 103          HB1       LEU 103   7.184  -1.334  -4.094
  792    HG   LEU 103           HG       LEU 103   4.260  -0.671  -4.547
  793   1HD1  LEU 103          HD11      LEU 103   5.646  -2.183  -2.321
  794   2HD1  LEU 103          HD12      LEU 103   4.260  -2.698  -3.281
  795   3HD1  LEU 103          HD13      LEU 103   4.079  -1.405  -2.096
  796   1HD2  LEU 103          HD21      LEU 103   5.351   1.327  -3.902
  797   2HD2  LEU 103          HD22      LEU 103   6.486   0.482  -2.853
  798   3HD2  LEU 103          HD23      LEU 103   4.806   0.677  -2.360
  799    H    LYS 104           HN       LYS 104   7.230  -2.641  -7.187
  800    HA   LYS 104           HA       LYS 104  10.075  -2.156  -7.054
  801   1HB   LYS 104          HB2       LYS 104  10.305  -4.105  -8.543
  802   2HB   LYS 104          HB1       LYS 104   9.221  -4.442  -7.197
  803   1HG   LYS 104          HG2       LYS 104   7.274  -4.079  -8.638
  804   2HG   LYS 104          HG1       LYS 104   8.331  -3.656  -9.986
  805   1HD   LYS 104          HD2       LYS 104   9.304  -5.874 -10.008
  806   2HD   LYS 104          HD1       LYS 104   8.441  -6.318  -8.538
  807   1HE   LYS 104          HE2       LYS 104   6.378  -6.455  -9.638
  808   2HE   LYS 104          HE1       LYS 104   6.906  -5.428 -10.972
  809   1HZ   LYS 104          HZ1       LYS 104   8.641  -7.459 -11.130
  810   2HZ   LYS 104          HZ2       LYS 104   7.194  -7.374 -12.015
  811   3HZ   LYS 104          HZ3       LYS 104   7.261  -8.272 -10.575
  812    H    LYS 105           HN       LYS 105   7.611  -1.051  -9.205
  813    HA   LYS 105           HA       LYS 105   9.212  -0.698 -11.564
  814   1HB   LYS 105          HB2       LYS 105   6.743  -0.550 -11.597
  815   2HB   LYS 105          HB1       LYS 105   6.822   0.922 -10.631
  816   1HG   LYS 105          HG2       LYS 105   8.095   2.048 -12.418
  817   2HG   LYS 105          HG1       LYS 105   8.061   0.572 -13.381
  818   1HD   LYS 105          HD2       LYS 105   5.598   0.674 -13.454
  819   2HD   LYS 105          HD1       LYS 105   5.630   2.146 -12.481
  820   1HE   LYS 105          HE2       LYS 105   5.426   2.846 -14.769
  821   2HE   LYS 105          HE1       LYS 105   7.090   3.176 -14.287
  822   1HZ   LYS 105          HZ1       LYS 105   7.170   0.614 -15.196
  823   2HZ   LYS 105          HZ2       LYS 105   7.659   1.991 -16.063
  824   3HZ   LYS 105          HZ3       LYS 105   6.093   1.366 -16.270
  825    H    LEU 106           HN       LEU 106   8.480   1.573  -8.875
  826    HA   LEU 106           HA       LEU 106  10.004   3.737  -9.958
  827   1HB   LEU 106          HB2       LEU 106   9.113   3.041  -7.163
  828   2HB   LEU 106          HB1       LEU 106  10.145   4.437  -7.448
  829    HG   LEU 106           HG       LEU 106   7.647   4.920  -7.417
  830   1HD1  LEU 106          HD11      LEU 106   9.515   6.251  -8.715
  831   2HD1  LEU 106          HD12      LEU 106   7.819   6.614  -9.004
  832   3HD1  LEU 106          HD13      LEU 106   8.710   5.617 -10.148
  833   1HD2  LEU 106          HD21      LEU 106   7.092   2.800  -8.689
  834   2HD2  LEU 106          HD22      LEU 106   7.676   3.602 -10.142
  835   3HD2  LEU 106          HD23      LEU 106   6.287   4.252  -9.273
  836    H    PHE 107           HN       PHE 107  10.971   0.895  -8.142
  837    HA   PHE 107           HA       PHE 107  13.535   1.778  -7.279
  838   1HB   PHE 107          HB2       PHE 107  12.447  -0.394  -6.618
  839   2HB   PHE 107          HB1       PHE 107  12.818  -1.013  -8.226
  840    HD1  PHE 107           HD1      PHE 107  14.461   0.657  -5.304
  841    HD2  PHE 107           HD2      PHE 107  14.893  -2.064  -8.601
  842    HE1  PHE 107           HE1      PHE 107  16.757   0.113  -4.553
  843    HE2  PHE 107           HE2      PHE 107  17.190  -2.614  -7.845
  844    HZ   PHE 107           HZ       PHE 107  18.123  -1.527  -5.820
  845    H    ARG 108           HN       ARG 108  12.457   0.395 -10.359
  846    HA   ARG 108           HA       ARG 108  15.013   0.104 -11.562
  847   1HB   ARG 108          HB2       ARG 108  12.302   0.696 -12.776
  848   2HB   ARG 108          HB1       ARG 108  13.736   0.309 -13.729
  849   1HG   ARG 108          HG2       ARG 108  13.961  -1.834 -12.523
  850   2HG   ARG 108          HG1       ARG 108  12.519  -1.452 -11.582
  851   1HD   ARG 108          HD2       ARG 108  11.904  -2.925 -13.420
  852   2HD   ARG 108          HD1       ARG 108  11.218  -1.323 -13.712
  853    HE   ARG 108           HE       ARG 108  13.607  -1.188 -15.047
  854   1HH1  ARG 108          HH21      ARG 108  10.992  -3.434 -14.932
  855   2HH1  ARG 108          HH22      ARG 108  11.191  -3.952 -16.573
  856   1HH2  ARG 108          HH11      ARG 108  13.877  -1.849 -17.192
  857   2HH2  ARG 108          HH12      ARG 108  12.821  -3.051 -17.853
  858    H    GLU 109           HN       GLU 109  12.839   2.920 -11.381
  859    HA   GLU 109           HA       GLU 109  14.686   4.553 -12.991
  860   1HB   GLU 109          HB2       GLU 109  12.158   5.241 -11.465
  861   2HB   GLU 109          HB1       GLU 109  13.063   6.387 -12.456
  862   1HG   GLU 109          HG2       GLU 109  12.743   4.937 -14.428
  863   2HG   GLU 109          HG1       GLU 109  11.833   3.794 -13.439
  864    H    GLY 110           HN       GLY 110  14.364   3.696  -9.678
  865   1HA   GLY 110          HA2       GLY 110  15.636   4.360  -7.824
  866   2HA   GLY 110          HA1       GLY 110  16.647   5.286  -8.935
  867    H    ARG 111           HN       ARG 111  13.367   6.098  -9.276
  868    HA   ARG 111           HA       ARG 111  13.857   8.666  -7.855
  869   1HB   ARG 111          HB2       ARG 111  11.722   7.768  -9.806
  870   2HB   ARG 111          HB1       ARG 111  11.699   9.338  -8.999
  871   1HG   ARG 111          HG2       ARG 111  13.931   9.846  -9.937
  872   2HG   ARG 111          HG1       ARG 111  13.934   8.288 -10.763
  873   1HD   ARG 111          HD2       ARG 111  13.217   9.953 -12.355
  874   2HD   ARG 111          HD1       ARG 111  11.802   8.994 -11.916
  875    HE   ARG 111           HE       ARG 111  11.758  11.114 -10.126
  876   1HH1  ARG 111          HH21      ARG 111  11.933  10.724 -13.546
  877   2HH1  ARG 111          HH22      ARG 111  11.097  12.202 -13.890
  878   1HH2  ARG 111          HH11      ARG 111  10.666  13.042 -10.554
  879   2HH2  ARG 111          HH12      ARG 111  10.381  13.516 -12.196
  880    H    PHE 112           HN       PHE 112  13.502   8.289  -5.711
  881    HA   PHE 112           HA       PHE 112  11.065   6.822  -4.855
  882   1HB   PHE 112          HB2       PHE 112  13.316   7.964  -3.171
  883   2HB   PHE 112          HB1       PHE 112  12.108   6.773  -2.677
  884    HD1  PHE 112           HD1      PHE 112  12.071   4.516  -3.719
  885    HD2  PHE 112           HD2      PHE 112  15.227   7.320  -4.498
  886    HE1  PHE 112           HE1      PHE 112  13.467   2.693  -4.651
  887    HE2  PHE 112           HE2      PHE 112  16.620   5.490  -5.435
  888    HZ   PHE 112           HZ       PHE 112  15.739   3.176  -5.506
  889    H    ASN 113           HN       ASN 113   9.256   7.977  -4.436
  890    HA   ASN 113           HA       ASN 113   7.871   9.830  -4.032
  891   1HB   ASN 113          HB2       ASN 113   8.854   9.336  -1.757
  892   2HB   ASN 113          HB1       ASN 113  10.058  10.585  -2.078
  893   1HD2  ASN 113          HD21      ASN 113   6.471  10.160  -2.101
  894   2HD2  ASN 113          HD22      ASN 113   6.138  11.734  -1.562
  Start of MODEL   29
    1   1H    MET   1           HT1      MET   1  19.462   3.530  15.289
    2   2H    MET   1           HT2      MET   1  19.458   3.347  13.600
    3   3H    MET   1           HT3      MET   1  18.196   4.185  14.371
    4    HA   MET   1           HA       MET   1  20.193   5.656  15.228
    5   1HB   MET   1          HB2       MET   1  21.075   4.581  12.531
    6   2HB   MET   1          HB1       MET   1  21.845   5.901  13.408
    7   1HG   MET   1          HG2       MET   1  21.511   3.109  14.529
    8   2HG   MET   1          HG1       MET   1  22.974   3.668  13.723
    9   1HE   MET   1          HE1       MET   1  23.532   6.694  14.772
   10   2HE   MET   1          HE2       MET   1  24.505   5.275  14.394
   11   3HE   MET   1          HE3       MET   1  24.673   6.057  15.962
   12    H    GLY   2           HN       GLY   2  20.734   6.930  12.466
   13   1HA   GLY   2          HA2       GLY   2  18.402   8.625  12.462
   14   2HA   GLY   2          HA1       GLY   2  19.708   8.681  11.279
   15    HA   PRO   3           HA       PRO   3  15.574   6.767   9.639
   16   1HB   PRO   3          HB2       PRO   3  15.771   8.785   7.536
   17   2HB   PRO   3          HB1       PRO   3  14.459   8.512   8.686
   18   1HG   PRO   3          HG2       PRO   3  16.405  10.633   8.708
   19   2HG   PRO   3          HG1       PRO   3  15.097  10.352   9.862
   20   1HD   PRO   3          HD2       PRO   3  17.914  10.036  10.331
   21   2HD   PRO   3          HD1       PRO   3  16.584   9.619  11.442
   22    H    VAL   4           HN       VAL   4  15.505   5.441   7.739
   23    HA   VAL   4           HA       VAL   4  18.124   4.785   6.624
   24    HB   VAL   4           HB       VAL   4  16.722   3.059   5.345
   25   1HG1  VAL   4          HG11      VAL   4  17.908   2.637   7.527
   26   2HG1  VAL   4          HG12      VAL   4  16.467   1.650   7.299
   27   3HG1  VAL   4          HG13      VAL   4  16.412   3.057   8.359
   28   1HG2  VAL   4          HG21      VAL   4  14.428   2.789   5.937
   29   2HG2  VAL   4          HG22      VAL   4  14.623   4.509   5.603
   30   3HG2  VAL   4          HG23      VAL   4  14.563   3.936   7.270
   31    HA   PRO   5           HA       PRO   5  17.730   7.340   2.999
   32   1HB   PRO   5          HB2       PRO   5  18.747   5.469   1.086
   33   2HB   PRO   5          HB1       PRO   5  19.649   6.721   1.945
   34   1HG   PRO   5          HG2       PRO   5  19.639   3.824   2.399
   35   2HG   PRO   5          HG1       PRO   5  20.773   5.039   2.998
   36   1HD   PRO   5          HD2       PRO   5  18.813   3.694   4.540
   37   2HD   PRO   5          HD1       PRO   5  19.720   5.145   5.032
   38    HA   PRO   6           HA       PRO   6  13.987   6.325   0.841
   39   1HB   PRO   6          HB2       PRO   6  14.600   7.188  -1.763
   40   2HB   PRO   6          HB1       PRO   6  14.019   8.210  -0.442
   41   1HG   PRO   6          HG2       PRO   6  16.756   7.962  -1.560
   42   2HG   PRO   6          HG1       PRO   6  16.012   9.319  -0.703
   43   1HD   PRO   6          HD2       PRO   6  17.904   7.564   0.400
   44   2HD   PRO   6          HD1       PRO   6  16.799   8.601   1.338
   45    H    SER   7           HN       SER   7  16.696   5.494  -1.360
   46    HA   SER   7           HA       SER   7  15.293   3.499  -2.815
   47   1HB   SER   7          HB2       SER   7  17.489   2.719  -3.544
   48   2HB   SER   7          HB1       SER   7  17.472   4.480  -3.512
   49    HG   SER   7           HG       SER   7  19.154   2.910  -2.301
   50    H    THR   8           HN       THR   8  17.202   3.257   0.167
   51    HA   THR   8           HA       THR   8  17.069   0.385   0.334
   52    HB   THR   8           HB       THR   8  17.373   2.442   2.540
   53    HG1  THR   8           HG1      THR   8  19.186   1.057   0.875
   54   1HG2  THR   8          HG21      THR   8  16.742   0.320   3.498
   55   2HG2  THR   8          HG22      THR   8  18.480   0.514   3.728
   56   3HG2  THR   8          HG23      THR   8  17.872  -0.544   2.454
   57    H    ALA   9           HN       ALA   9  15.000   2.980   1.622
   58    HA   ALA   9           HA       ALA   9  13.294   1.337   3.191
   59   1HB   ALA   9          HB1       ALA   9  13.251   3.780   3.339
   60   2HB   ALA   9          HB2       ALA   9  11.642   3.171   2.951
   61   3HB   ALA   9          HB3       ALA   9  12.642   3.887   1.688
   62    H    LEU  10           HN       LEU  10  12.953   2.336  -0.237
   63    HA   LEU  10           HA       LEU  10  10.481   1.005  -0.682
   64   1HB   LEU  10          HB2       LEU  10  11.478   2.621  -2.287
   65   2HB   LEU  10          HB1       LEU  10  12.741   1.450  -2.660
   66    HG   LEU  10           HG       LEU  10  10.940  -0.164  -3.391
   67   1HD1  LEU  10          HD11      LEU  10   8.738   1.114  -4.007
   68   2HD1  LEU  10          HD12      LEU  10   9.230   2.232  -2.736
   69   3HD1  LEU  10          HD13      LEU  10   8.951   0.532  -2.358
   70   1HD2  LEU  10          HD21      LEU  10  10.434   1.093  -5.511
   71   2HD2  LEU  10          HD22      LEU  10  12.137   1.090  -5.061
   72   3HD2  LEU  10          HD23      LEU  10  11.152   2.523  -4.768
   73    H    ARG  11           HN       ARG  11  13.825  -0.153  -1.231
   74    HA   ARG  11           HA       ARG  11  13.121  -2.746  -2.156
   75   1HB   ARG  11          HB2       ARG  11  15.562  -1.750  -0.662
   76   2HB   ARG  11          HB1       ARG  11  15.437  -3.375  -1.338
   77   1HG   ARG  11          HG2       ARG  11  15.069  -2.440  -3.578
   78   2HG   ARG  11          HG1       ARG  11  15.139  -0.805  -2.919
   79   1HD   ARG  11          HD2       ARG  11  17.305  -1.359  -3.880
   80   2HD   ARG  11          HD1       ARG  11  17.462  -1.271  -2.126
   81    HE   ARG  11           HE       ARG  11  16.948  -3.947  -2.596
   82   1HH1  ARG  11          HH21      ARG  11  19.163  -1.586  -3.779
   83   2HH1  ARG  11          HH22      ARG  11  20.434  -2.727  -4.068
   84   1HH2  ARG  11          HH11      ARG  11  18.595  -5.453  -2.968
   85   2HH2  ARG  11          HH12      ARG  11  20.113  -4.916  -3.607
   86    H    GLU  12           HN       GLU  12  13.696  -1.545   1.146
   87    HA   GLU  12           HA       GLU  12  13.395  -4.078   2.451
   88   1HB   GLU  12          HB2       GLU  12  12.924  -1.244   3.420
   89   2HB   GLU  12          HB1       GLU  12  12.820  -2.656   4.473
   90   1HG   GLU  12          HG2       GLU  12  15.263  -1.994   2.807
   91   2HG   GLU  12          HG1       GLU  12  15.072  -1.504   4.490
   92    H    LEU  13           HN       LEU  13  11.081  -1.583   1.483
   93    HA   LEU  13           HA       LEU  13   8.797  -2.786   2.763
   94   1HB   LEU  13          HB2       LEU  13   8.872  -0.412   2.076
   95   2HB   LEU  13          HB1       LEU  13   8.970  -0.900   0.389
   96    HG   LEU  13           HG       LEU  13   6.745  -2.029   0.632
   97   1HD1  LEU  13          HD11      LEU  13   6.497  -2.519   2.919
   98   2HD1  LEU  13          HD12      LEU  13   5.429  -1.134   2.709
   99   3HD1  LEU  13          HD13      LEU  13   7.027  -0.914   3.421
  100   1HD2  LEU  13          HD21      LEU  13   5.467   0.027   0.544
  101   2HD2  LEU  13          HD22      LEU  13   7.041   0.334  -0.189
  102   3HD2  LEU  13          HD23      LEU  13   6.710   0.890   1.451
  103    H    ILE  14           HN       ILE  14  10.095  -2.962  -0.566
  104    HA   ILE  14           HA       ILE  14   8.005  -4.561  -1.657
  105    HB   ILE  14           HB       ILE  14  10.948  -4.365  -2.363
  106   1HG1  ILE  14          HG12      ILE  14   8.484  -3.320  -3.788
  107   2HG1  ILE  14          HG11      ILE  14   9.422  -2.363  -2.642
  108   1HG2  ILE  14          HG21      ILE  14  10.234  -6.511  -3.188
  109   2HG2  ILE  14          HG22      ILE  14  10.185  -5.405  -4.559
  110   3HG2  ILE  14          HG23      ILE  14   8.692  -5.854  -3.735
  111   1HD1  ILE  14          HD11      ILE  14  11.457  -2.780  -4.051
  112   2HD1  ILE  14          HD12      ILE  14  10.206  -1.852  -4.878
  113   3HD1  ILE  14          HD13      ILE  14  10.416  -3.565  -5.239
  114    H    GLU  15           HN       GLU  15  11.111  -5.539  -0.215
  115    HA   GLU  15           HA       GLU  15  10.732  -8.341  -0.451
  116   1HB   GLU  15          HB2       GLU  15  12.284  -6.697   1.566
  117   2HB   GLU  15          HB1       GLU  15  12.376  -8.456   1.471
  118   1HG   GLU  15          HG2       GLU  15  12.943  -6.620  -0.873
  119   2HG   GLU  15          HG1       GLU  15  14.194  -7.258   0.192
  120    H    GLU  16           HN       GLU  16   9.751  -6.089   2.127
  121    HA   GLU  16           HA       GLU  16   8.802  -8.138   3.909
  122   1HB   GLU  16          HB2       GLU  16   9.336  -5.764   4.561
  123   2HB   GLU  16          HB1       GLU  16   7.863  -5.264   3.735
  124   1HG   GLU  16          HG2       GLU  16   7.373  -5.521   6.100
  125   2HG   GLU  16          HG1       GLU  16   6.564  -6.813   5.214
  126    H    LEU  17           HN       LEU  17   7.129  -6.138   1.449
  127    HA   LEU  17           HA       LEU  17   4.504  -7.107   2.020
  128   1HB   LEU  17          HB2       LEU  17   5.731  -6.047  -0.533
  129   2HB   LEU  17          HB1       LEU  17   4.024  -6.450  -0.393
  130    HG   LEU  17           HG       LEU  17   5.420  -4.526   1.491
  131   1HD1  LEU  17          HD11      LEU  17   3.773  -3.856  -0.968
  132   2HD1  LEU  17          HD12      LEU  17   5.531  -3.740  -0.884
  133   3HD1  LEU  17          HD13      LEU  17   4.530  -2.707   0.136
  134   1HD2  LEU  17          HD21      LEU  17   2.910  -3.733   1.606
  135   2HD2  LEU  17          HD22      LEU  17   3.387  -5.169   2.502
  136   3HD2  LEU  17          HD23      LEU  17   2.553  -5.333   0.959
  137    H    VAL  18           HN       VAL  18   7.029  -8.350  -0.135
  138    HA   VAL  18           HA       VAL  18   5.436 -10.417  -1.323
  139    HB   VAL  18           HB       VAL  18   8.425 -10.127  -0.913
  140   1HG1  VAL  18          HG11      VAL  18   8.072 -12.479  -1.161
  141   2HG1  VAL  18          HG12      VAL  18   8.533 -11.889  -2.757
  142   3HG1  VAL  18          HG13      VAL  18   6.841 -12.234  -2.400
  143   1HG2  VAL  18          HG21      VAL  18   6.596  -9.742  -3.304
  144   2HG2  VAL  18          HG22      VAL  18   8.354  -9.603  -3.347
  145   3HG2  VAL  18          HG23      VAL  18   7.402  -8.465  -2.394
  146    H    ASN  19           HN       ASN  19   7.619 -10.433   1.492
  147    HA   ASN  19           HA       ASN  19   7.471 -13.200   2.070
  148   1HB   ASN  19          HB2       ASN  19   9.093 -11.688   3.123
  149   2HB   ASN  19          HB1       ASN  19   7.788 -10.884   3.995
  150   1HD2  ASN  19          HD21      ASN  19   8.145 -11.558   6.149
  151   2HD2  ASN  19          HD22      ASN  19   8.247 -13.183   6.629
  152    H    ILE  20           HN       ILE  20   5.327 -10.565   3.179
  153    HA   ILE  20           HA       ILE  20   3.812 -12.348   4.894
  154    HB   ILE  20           HB       ILE  20   2.275 -10.440   5.157
  155   1HG1  ILE  20          HG12      ILE  20   4.051  -9.103   3.093
  156   2HG1  ILE  20          HG11      ILE  20   2.403  -9.647   2.796
  157   1HG2  ILE  20          HG21      ILE  20   3.872  -8.944   6.194
  158   2HG2  ILE  20          HG22      ILE  20   5.173  -9.554   5.171
  159   3HG2  ILE  20          HG23      ILE  20   4.457 -10.595   6.400
  160   1HD1  ILE  20          HD11      ILE  20   1.728  -8.178   4.793
  161   2HD1  ILE  20          HD12      ILE  20   2.182  -7.344   3.307
  162   3HD1  ILE  20          HD13      ILE  20   3.327  -7.449   4.643
  163    H    THR  21           HN       THR  21   3.572 -11.527   1.495
  164    HA   THR  21           HA       THR  21   0.802 -12.624   1.388
  165    HB   THR  21           HB       THR  21   0.837 -11.881  -0.972
  166    HG1  THR  21           HG1      THR  21   3.386 -12.003  -0.674
  167   1HG2  THR  21          HG21      THR  21   1.875  -9.519   0.535
  168   2HG2  THR  21          HG22      THR  21   0.440 -10.321   1.173
  169   3HG2  THR  21          HG23      THR  21   0.432  -9.665  -0.462
  170    H    GLN  22           HN       GLN  22   4.046 -13.642   0.831
  171    HA   GLN  22           HA       GLN  22   3.393 -15.661  -1.161
  172   1HB   GLN  22          HB2       GLN  22   5.800 -15.113   0.573
  173   2HB   GLN  22          HB1       GLN  22   5.701 -16.586  -0.393
  174   1HG   GLN  22          HG2       GLN  22   5.303 -13.821  -1.563
  175   2HG   GLN  22          HG1       GLN  22   6.868 -14.635  -1.525
  176   1HE2  GLN  22          HE21      GLN  22   6.232 -17.265  -2.158
  177   2HE2  GLN  22          HE22      GLN  22   5.510 -17.345  -3.692
  178    H    ASN  23           HN       ASN  23   3.789 -15.665   2.371
  179    HA   ASN  23           HA       ASN  23   3.137 -18.563   2.455
  180   1HB   ASN  23          HB2       ASN  23   3.777 -18.449   4.788
  181   2HB   ASN  23          HB1       ASN  23   5.007 -17.626   3.827
  182   1HD2  ASN  23          HD21      ASN  23   4.475 -17.069   6.653
  183   2HD2  ASN  23          HD22      ASN  23   3.943 -15.461   6.752
  184    H    GLN  24           HN       GLN  24   1.225 -15.906   2.219
  185    HA   GLN  24           HA       GLN  24  -0.581 -16.515   4.460
  186   1HB   GLN  24          HB2       GLN  24  -1.851 -14.649   3.795
  187   2HB   GLN  24          HB1       GLN  24  -0.205 -14.188   3.380
  188   1HG   GLN  24          HG2       GLN  24  -0.651 -14.981   1.027
  189   2HG   GLN  24          HG1       GLN  24  -2.339 -15.221   1.485
  190   1HE2  GLN  24          HE21      GLN  24  -2.695 -13.479  -0.252
  191   2HE2  GLN  24          HE22      GLN  24  -2.576 -11.857   0.234
  192    H    LYS  25           HN       LYS  25  -2.265 -17.919   4.395
  193    HA   LYS  25           HA       LYS  25  -2.804 -19.344   1.851
  194   1HB   LYS  25          HB2       LYS  25  -2.525 -20.601   4.011
  195   2HB   LYS  25          HB1       LYS  25  -3.986 -19.817   4.608
  196   1HG   LYS  25          HG2       LYS  25  -5.277 -20.779   2.740
  197   2HG   LYS  25          HG1       LYS  25  -3.817 -21.560   2.129
  198   1HD   LYS  25          HD2       LYS  25  -3.612 -22.819   4.250
  199   2HD   LYS  25          HD1       LYS  25  -5.093 -22.060   4.835
  200   1HE   LYS  25          HE2       LYS  25  -4.901 -23.758   2.329
  201   2HE   LYS  25          HE1       LYS  25  -5.500 -24.330   3.885
  202   1HZ   LYS  25          HZ1       LYS  25  -7.430 -23.249   3.634
  203   2HZ   LYS  25          HZ2       LYS  25  -7.038 -23.250   1.981
  204   3HZ   LYS  25          HZ3       LYS  25  -6.711 -21.882   2.934
  205    H    ALA  26           HN       ALA  26  -5.121 -18.433   4.389
  206    HA   ALA  26           HA       ALA  26  -7.047 -17.600   2.344
  207   1HB   ALA  26          HB1       ALA  26  -8.245 -16.906   4.686
  208   2HB   ALA  26          HB2       ALA  26  -7.057 -18.054   5.296
  209   3HB   ALA  26          HB3       ALA  26  -8.232 -18.566   4.086
  210    HA   PRO  27           HA       PRO  27  -6.178 -13.253   2.093
  211   1HB   PRO  27          HB2       PRO  27  -8.809 -12.572   3.280
  212   2HB   PRO  27          HB1       PRO  27  -8.169 -12.183   1.678
  213   1HG   PRO  27          HG2       PRO  27 -10.103 -14.159   2.262
  214   2HG   PRO  27          HG1       PRO  27  -9.242 -13.963   0.731
  215   1HD   PRO  27          HD2       PRO  27  -8.972 -16.121   2.641
  216   2HD   PRO  27          HD1       PRO  27  -8.092 -15.912   1.108
  217    H    LEU  28           HN       LEU  28  -5.205 -11.743   3.497
  218    HA   LEU  28           HA       LEU  28  -4.780 -12.477   6.222
  219   1HB   LEU  28          HB2       LEU  28  -4.453  -9.780   4.868
  220   2HB   LEU  28          HB1       LEU  28  -3.821 -10.181   6.463
  221    HG   LEU  28           HG       LEU  28  -3.101 -11.663   3.915
  222   1HD1  LEU  28          HD11      LEU  28  -0.870 -10.492   4.270
  223   2HD1  LEU  28          HD12      LEU  28  -1.695  -9.451   5.429
  224   3HD1  LEU  28          HD13      LEU  28  -2.191  -9.452   3.737
  225   1HD2  LEU  28          HD21      LEU  28  -2.287 -11.899   6.811
  226   2HD2  LEU  28          HD22      LEU  28  -1.127 -12.319   5.550
  227   3HD2  LEU  28          HD23      LEU  28  -2.661 -13.175   5.652
  228    H    CYS  29           HN       CYS  29  -6.948 -10.076   4.750
  229    HA   CYS  29           HA       CYS  29  -8.154  -9.466   7.375
  230   1HB   CYS  29          HB2       CYS  29  -8.669  -8.473   4.563
  231   2HB   CYS  29          HB1       CYS  29  -9.668  -8.007   5.940
  232    H    ASN  30           HN       ASN  30 -10.554  -9.669   7.622
  233    HA   ASN  30           HA       ASN  30 -11.434 -12.335   6.990
  234   1HB   ASN  30          HB2       ASN  30 -12.903  -9.910   8.056
  235   2HB   ASN  30          HB1       ASN  30 -13.655 -11.495   7.878
  236   1HD2  ASN  30          HD21      ASN  30 -13.273 -10.213  10.451
  237   2HD2  ASN  30          HD22      ASN  30 -12.181 -11.160  11.339
  238    H    GLY  31           HN       GLY  31 -10.743 -11.174   4.550
  239   1HA   GLY  31          HA2       GLY  31 -11.678 -11.225   2.370
  240   2HA   GLY  31          HA1       GLY  31 -13.272 -11.439   3.095
  241    H    SER  32           HN       SER  32 -11.270  -8.857   4.255
  242    HA   SER  32           HA       SER  32 -13.240  -6.866   3.700
  243   1HB   SER  32          HB2       SER  32 -10.281  -6.518   4.248
  244   2HB   SER  32          HB1       SER  32 -11.493  -5.244   4.338
  245    HG   SER  32           HG       SER  32 -12.549  -6.947   5.817
  246    H    MET  33           HN       MET  33 -13.336  -5.282   2.112
  247    HA   MET  33           HA       MET  33 -11.648  -5.743  -0.328
  248   1HB   MET  33          HB2       MET  33 -14.490  -4.733  -0.020
  249   2HB   MET  33          HB1       MET  33 -13.589  -4.674  -1.535
  250   1HG   MET  33          HG2       MET  33 -13.263  -7.145  -1.391
  251   2HG   MET  33          HG1       MET  33 -14.267  -7.164   0.056
  252   1HE   MET  33          HE1       MET  33 -15.375  -5.966  -4.179
  253   2HE   MET  33          HE2       MET  33 -14.593  -7.527  -3.952
  254   3HE   MET  33          HE3       MET  33 -13.793  -6.061  -3.395
  255    H    VAL  34           HN       VAL  34 -11.043  -3.791  -1.504
  256    HA   VAL  34           HA       VAL  34 -11.167  -1.266   0.116
  257    HB   VAL  34           HB       VAL  34  -8.822  -0.824  -0.759
  258   1HG1  VAL  34          HG11      VAL  34  -9.069  -1.423   1.545
  259   2HG1  VAL  34          HG12      VAL  34  -7.784  -2.453   0.915
  260   3HG1  VAL  34          HG13      VAL  34  -9.406  -3.106   1.142
  261   1HG2  VAL  34          HG21      VAL  34  -8.848  -2.513  -2.561
  262   2HG2  VAL  34          HG22      VAL  34  -8.993  -3.797  -1.362
  263   3HG2  VAL  34          HG23      VAL  34  -7.526  -2.824  -1.437
  264    H    TRP  35           HN       TRP  35 -10.884   0.686  -1.218
  265    HA   TRP  35           HA       TRP  35 -12.376   0.474  -3.703
  266   1HB   TRP  35          HB2       TRP  35 -11.004   2.783  -2.318
  267   2HB   TRP  35          HB1       TRP  35 -11.889   2.958  -3.833
  268    HD1  TRP  35           HD1      TRP  35 -12.387   2.211  -0.129
  269    HE1  TRP  35           HE1      TRP  35 -14.878   2.490   0.451
  270    HE3  TRP  35           HE3      TRP  35 -14.311   2.823  -4.821
  271    HZ2  TRP  35           HZ2      TRP  35 -17.366   2.914  -0.902
  272    HZ3  TRP  35           HZ3      TRP  35 -16.744   3.151  -5.146
  273    HH2  TRP  35           HH2      TRP  35 -18.274   3.200  -3.194
  274    H    SER  36           HN       SER  36 -11.556   0.281  -5.733
  275    HA   SER  36           HA       SER  36  -8.718  -0.075  -6.146
  276   1HB   SER  36          HB2       SER  36 -10.421  -1.202  -7.556
  277   2HB   SER  36          HB1       SER  36 -10.927   0.362  -8.181
  278    HG   SER  36           HG       SER  36  -8.569   0.559  -8.731
  279    H    ILE  37           HN       ILE  37  -7.221   1.400  -6.907
  280    HA   ILE  37           HA       ILE  37  -8.176   4.189  -7.494
  281    HB   ILE  37           HB       ILE  37  -6.028   4.938  -6.394
  282   1HG1  ILE  37          HG12      ILE  37  -5.986   2.199  -5.109
  283   2HG1  ILE  37          HG11      ILE  37  -5.066   2.515  -6.576
  284   1HG2  ILE  37          HG21      ILE  37  -8.242   5.009  -5.257
  285   2HG2  ILE  37          HG22      ILE  37  -6.914   4.746  -4.126
  286   3HG2  ILE  37          HG23      ILE  37  -7.938   3.396  -4.613
  287   1HD1  ILE  37          HD11      ILE  37  -3.713   4.144  -5.524
  288   2HD1  ILE  37          HD12      ILE  37  -3.849   2.857  -4.327
  289   3HD1  ILE  37          HD13      ILE  37  -4.826   4.316  -4.166
  290    H    ASN  38           HN       ASN  38  -6.559   5.434  -8.786
  291    HA   ASN  38           HA       ASN  38  -5.422   3.720 -10.902
  292   1HB   ASN  38          HB2       ASN  38  -6.669   5.899 -11.355
  293   2HB   ASN  38          HB1       ASN  38  -5.284   6.742 -10.662
  294   1HD2  ASN  38          HD21      ASN  38  -5.844   4.117 -13.090
  295   2HD2  ASN  38          HD22      ASN  38  -4.698   4.703 -14.196
  296    H    LEU  39           HN       LEU  39  -3.324   3.064 -10.807
  297    HA   LEU  39           HA       LEU  39  -1.609   4.031  -8.660
  298   1HB   LEU  39          HB2       LEU  39  -1.138   2.087 -10.935
  299   2HB   LEU  39          HB1       LEU  39   0.063   2.444  -9.700
  300    HG   LEU  39           HG       LEU  39  -1.214   0.378  -9.191
  301   1HD1  LEU  39          HD11      LEU  39  -0.388   2.112  -7.401
  302   2HD1  LEU  39          HD12      LEU  39  -1.423   0.779  -6.912
  303   3HD1  LEU  39          HD13      LEU  39  -2.109   2.385  -7.137
  304   1HD2  LEU  39          HD21      LEU  39  -3.535   0.327  -8.871
  305   2HD2  LEU  39          HD22      LEU  39  -3.367   1.384 -10.269
  306   3HD2  LEU  39          HD23      LEU  39  -3.652   2.074  -8.670
  307    H    THR  40           HN       THR  40  -0.496   5.911  -8.852
  308    HA   THR  40           HA       THR  40   0.883   6.516 -11.415
  309    HB   THR  40           HB       THR  40   0.077   8.865 -11.327
  310    HG1  THR  40           HG1      THR  40  -2.053   8.585  -9.825
  311   1HG2  THR  40          HG21      THR  40  -2.286   6.986 -11.297
  312   2HG2  THR  40          HG22      THR  40  -1.105   6.985 -12.607
  313   3HG2  THR  40          HG23      THR  40  -2.058   8.432 -12.280
  314    H    ALA  41           HN       ALA  41   0.790   9.252  -9.528
  315    HA   ALA  41           HA       ALA  41   3.535   8.757  -8.558
  316   1HB   ALA  41          HB1       ALA  41   3.576  11.157  -8.108
  317   2HB   ALA  41          HB2       ALA  41   1.845  11.268  -8.424
  318   3HB   ALA  41          HB3       ALA  41   2.956  10.867  -9.733
  319    H    GLY  42           HN       GLY  42   0.996  10.634  -6.917
  320   1HA   GLY  42          HA2       GLY  42   1.930   9.970  -4.303
  321   2HA   GLY  42          HA1       GLY  42   0.362  10.687  -4.660
  322    H    MET  43           HN       MET  43   1.612   7.514  -5.678
  323    HA   MET  43           HA       MET  43  -0.819   6.136  -5.114
  324   1HB   MET  43          HB2       MET  43   2.023   5.126  -5.316
  325   2HB   MET  43          HB1       MET  43   0.604   4.079  -5.261
  326   1HG   MET  43          HG2       MET  43  -0.293   5.280  -7.247
  327   2HG   MET  43          HG1       MET  43   1.215   6.179  -7.347
  328   1HE   MET  43          HE1       MET  43   3.389   5.184  -7.219
  329   2HE   MET  43          HE2       MET  43   3.906   3.762  -8.121
  330   3HE   MET  43          HE3       MET  43   3.363   3.588  -6.455
  331    H    TYR  44           HN       TYR  44   2.127   6.575  -3.170
  332    HA   TYR  44           HA       TYR  44   1.490   4.788  -1.070
  333   1HB   TYR  44          HB2       TYR  44   3.007   7.410  -1.054
  334   2HB   TYR  44          HB1       TYR  44   2.930   6.329   0.336
  335    HD1  TYR  44           HD1      TYR  44   4.028   4.142   0.304
  336    HD2  TYR  44           HD2      TYR  44   4.213   6.776  -3.085
  337    HE1  TYR  44           HE1      TYR  44   5.853   2.770  -0.663
  338    HE2  TYR  44           HE2      TYR  44   6.039   5.403  -4.051
  339    HH   TYR  44           HH       TYR  44   6.825   2.985  -3.846
  340    H    CYS  45           HN       CYS  45   0.707   8.257  -1.406
  341    HA   CYS  45           HA       CYS  45  -0.782   8.366   1.060
  342   1HB   CYS  45          HB2       CYS  45  -0.804  10.137  -1.398
  343   2HB   CYS  45          HB1       CYS  45  -1.703  10.500   0.076
  344    H    ALA  46           HN       ALA  46  -1.791   8.044  -2.364
  345    HA   ALA  46           HA       ALA  46  -4.593   7.850  -1.850
  346   1HB   ALA  46          HB1       ALA  46  -3.089   6.435  -4.066
  347   2HB   ALA  46          HB2       ALA  46  -3.497   8.151  -4.113
  348   3HB   ALA  46          HB3       ALA  46  -4.779   6.939  -4.074
  349    H    ALA  47           HN       ALA  47  -2.123   5.294  -2.200
  350    HA   ALA  47           HA       ALA  47  -3.909   3.113  -1.732
  351   1HB   ALA  47          HB1       ALA  47  -1.693   2.739  -2.684
  352   2HB   ALA  47          HB2       ALA  47  -1.833   1.837  -1.175
  353   3HB   ALA  47          HB3       ALA  47  -0.929   3.351  -1.217
  354    H    LEU  48           HN       LEU  48  -1.982   5.121   0.465
  355    HA   LEU  48           HA       LEU  48  -2.388   3.614   2.827
  356   1HB   LEU  48          HB2       LEU  48  -0.772   5.452   2.692
  357   2HB   LEU  48          HB1       LEU  48  -2.083   6.613   2.500
  358    HG   LEU  48           HG       LEU  48  -2.942   6.025   4.747
  359   1HD1  LEU  48          HD11      LEU  48  -1.223   4.645   6.170
  360   2HD1  LEU  48          HD12      LEU  48  -0.684   4.027   4.608
  361   3HD1  LEU  48          HD13      LEU  48  -2.351   3.783   5.127
  362   1HD2  LEU  48          HD21      LEU  48  -0.926   6.874   6.045
  363   2HD2  LEU  48          HD22      LEU  48  -1.398   7.865   4.663
  364   3HD2  LEU  48          HD23      LEU  48  -0.014   6.778   4.538
  365    H    GLU  49           HN       GLU  49  -4.342   6.383   1.600
  366    HA   GLU  49           HA       GLU  49  -6.216   6.322   3.739
  367   1HB   GLU  49          HB2       GLU  49  -7.791   7.435   2.104
  368   2HB   GLU  49          HB1       GLU  49  -6.227   8.227   2.290
  369   1HG   GLU  49          HG2       GLU  49  -5.412   7.239   0.252
  370   2HG   GLU  49          HG1       GLU  49  -6.862   6.249   0.088
  371    H    SER  50           HN       SER  50  -6.114   4.443   0.726
  372    HA   SER  50           HA       SER  50  -8.735   3.332   0.941
  373   1HB   SER  50          HB2       SER  50  -6.193   2.134  -0.202
  374   2HB   SER  50          HB1       SER  50  -7.800   1.450  -0.425
  375    HG   SER  50           HG       SER  50  -8.395   3.242  -1.563
  376    H    LEU  51           HN       LEU  51  -5.625   2.300   2.335
  377    HA   LEU  51           HA       LEU  51  -6.683  -0.091   3.563
  378   1HB   LEU  51          HB2       LEU  51  -4.212   1.563   4.132
  379   2HB   LEU  51          HB1       LEU  51  -4.571   0.046   4.951
  380    HG   LEU  51           HG       LEU  51  -4.371   0.337   1.937
  381   1HD1  LEU  51          HD11      LEU  51  -2.320  -0.723   3.904
  382   2HD1  LEU  51          HD12      LEU  51  -2.209   0.811   3.041
  383   3HD1  LEU  51          HD13      LEU  51  -2.158  -0.709   2.149
  384   1HD2  LEU  51          HD21      LEU  51  -4.859  -1.958   3.826
  385   2HD2  LEU  51          HD22      LEU  51  -3.942  -2.267   2.353
  386   3HD2  LEU  51          HD23      LEU  51  -5.578  -1.631   2.250
  387    H    ILE  52           HN       ILE  52  -6.437   3.279   4.589
  388    HA   ILE  52           HA       ILE  52  -6.848   2.983   7.358
  389    HB   ILE  52           HB       ILE  52  -7.861   5.108   5.446
  390   1HG1  ILE  52          HG12      ILE  52  -5.425   4.996   5.665
  391   2HG1  ILE  52          HG11      ILE  52  -6.031   6.454   6.431
  392   1HG2  ILE  52          HG21      ILE  52  -7.998   5.008   8.465
  393   2HG2  ILE  52          HG22      ILE  52  -9.329   5.233   7.331
  394   3HG2  ILE  52          HG23      ILE  52  -8.129   6.506   7.544
  395   1HD1  ILE  52          HD11      ILE  52  -4.622   5.736   8.105
  396   2HD1  ILE  52          HD12      ILE  52  -4.781   4.040   7.658
  397   3HD1  ILE  52          HD13      ILE  52  -6.054   4.828   8.584
  398    H    ASN  53           HN       ASN  53  -9.068   2.399   4.734
  399    HA   ASN  53           HA       ASN  53 -11.427   2.393   6.490
  400   1HB   ASN  53          HB2       ASN  53 -10.994   1.554   3.607
  401   2HB   ASN  53          HB1       ASN  53 -12.544   1.401   4.435
  402   1HD2  ASN  53          HD21      ASN  53 -11.820   3.209   2.138
  403   2HD2  ASN  53          HD22      ASN  53 -12.166   4.779   2.680
  404    H    VAL  54           HN       VAL  54  -8.877   0.259   5.816
  405    HA   VAL  54           HA       VAL  54 -10.476  -2.191   6.296
  406    HB   VAL  54           HB       VAL  54  -7.484  -1.872   5.913
  407   1HG1  VAL  54          HG11      VAL  54  -7.686  -4.316   5.316
  408   2HG1  VAL  54          HG12      VAL  54  -9.353  -4.259   5.890
  409   3HG1  VAL  54          HG13      VAL  54  -8.023  -3.959   7.010
  410   1HG2  VAL  54          HG21      VAL  54  -8.951  -1.113   3.980
  411   2HG2  VAL  54          HG22      VAL  54  -9.564  -2.764   3.896
  412   3HG2  VAL  54          HG23      VAL  54  -7.855  -2.442   3.603
  413    H    SER  55           HN       SER  55 -10.800  -2.923   8.322
  414    HA   SER  55           HA       SER  55  -8.784  -2.285  10.453
  415   1HB   SER  55          HB2       SER  55 -11.805  -2.166  10.610
  416   2HB   SER  55          HB1       SER  55 -10.770  -2.216  12.035
  417    HG   SER  55           HG       SER  55 -10.424  -0.174  11.743
  418    H    GLY  56           HN       GLY  56  -8.662  -3.908  12.141
  419   1HA   GLY  56          HA2       GLY  56  -8.991  -6.079  13.062
  420   2HA   GLY  56          HA1       GLY  56 -10.137  -6.430  11.766
  421    H    CYS  57           HN       CYS  57  -6.920  -5.133  11.180
  422    HA   CYS  57           HA       CYS  57  -5.944  -7.809  10.306
  423   1HB   CYS  57          HB2       CYS  57  -5.918  -5.344   8.535
  424   2HB   CYS  57          HB1       CYS  57  -5.273  -6.934   8.121
  425    H    SER  58           HN       SER  58  -4.388  -7.738  11.961
  426    HA   SER  58           HA       SER  58  -2.706  -5.452  12.480
  427   1HB   SER  58          HB2       SER  58  -3.043  -7.148  14.192
  428   2HB   SER  58          HB1       SER  58  -2.352  -8.385  13.146
  429    HG   SER  58           HG       SER  58  -1.123  -6.563  14.740
  430    H    ALA  59           HN       ALA  59  -2.335  -8.348  10.485
  431    HA   ALA  59           HA       ALA  59   0.377  -8.268   9.882
  432   1HB   ALA  59          HB1       ALA  59  -1.005 -10.052   9.055
  433   2HB   ALA  59          HB2       ALA  59  -0.270  -9.257   7.662
  434   3HB   ALA  59          HB3       ALA  59  -1.954  -8.933   8.076
  435    H    ILE  60           HN       ILE  60  -2.023  -5.934   8.867
  436    HA   ILE  60           HA       ILE  60  -0.079  -4.786   6.894
  437    HB   ILE  60           HB       ILE  60  -1.983  -3.503   6.023
  438   1HG1  ILE  60          HG12      ILE  60  -3.687  -5.064   7.974
  439   2HG1  ILE  60          HG11      ILE  60  -3.208  -3.391   8.250
  440   1HG2  ILE  60          HG21      ILE  60  -1.549  -5.715   5.085
  441   2HG2  ILE  60          HG22      ILE  60  -3.289  -5.440   5.161
  442   3HG2  ILE  60          HG23      ILE  60  -2.506  -6.472   6.359
  443   1HD1  ILE  60          HD11      ILE  60  -5.405  -3.403   7.214
  444   2HD1  ILE  60          HD12      ILE  60  -4.823  -4.445   5.915
  445   3HD1  ILE  60          HD13      ILE  60  -4.232  -2.788   6.048
  446    H    GLU  61           HN       GLU  61  -1.110  -4.317  10.098
  447    HA   GLU  61           HA       GLU  61  -1.175  -1.468  10.228
  448   1HB   GLU  61          HB2       GLU  61  -0.391  -3.575  12.250
  449   2HB   GLU  61          HB1       GLU  61  -0.388  -1.854  12.642
  450   1HG   GLU  61          HG2       GLU  61  -2.747  -1.672  12.065
  451   2HG   GLU  61          HG1       GLU  61  -2.780  -3.351  11.532
  452    H    LYS  62           HN       LYS  62   1.574  -3.745  10.430
  453    HA   LYS  62           HA       LYS  62   3.557  -1.716  10.877
  454   1HB   LYS  62          HB2       LYS  62   3.743  -4.452   9.580
  455   2HB   LYS  62          HB1       LYS  62   5.147  -3.428   9.887
  456   1HG   LYS  62          HG2       LYS  62   4.588  -3.373  12.287
  457   2HG   LYS  62          HG1       LYS  62   3.185  -4.398  11.985
  458   1HD   LYS  62          HD2       LYS  62   4.669  -6.186  11.148
  459   2HD   LYS  62          HD1       LYS  62   6.073  -5.162  11.455
  460   1HE   LYS  62          HE2       LYS  62   5.671  -5.173  13.822
  461   2HE   LYS  62          HE1       LYS  62   4.088  -5.922  13.611
  462   1HZ   LYS  62          HZ1       LYS  62   6.411  -7.240  14.091
  463   2HZ   LYS  62          HZ2       LYS  62   6.214  -7.429  12.414
  464   3HZ   LYS  62          HZ3       LYS  62   4.991  -7.937  13.478
  465    H    THR  63           HN       THR  63   2.118  -3.099   7.963
  466    HA   THR  63           HA       THR  63   3.736  -1.774   6.034
  467    HB   THR  63           HB       THR  63   0.810  -2.549   5.846
  468    HG1  THR  63           HG1      THR  63   2.307  -4.199   4.531
  469   1HG2  THR  63          HG21      THR  63   1.373  -2.661   3.383
  470   2HG2  THR  63          HG22      THR  63   2.886  -1.839   3.766
  471   3HG2  THR  63          HG23      THR  63   1.345  -1.035   4.063
  472    H    GLN  64           HN       GLN  64   0.845  -0.725   7.798
  473    HA   GLN  64           HA       GLN  64   0.331   1.662   6.344
  474   1HB   GLN  64          HB2       GLN  64  -0.098   0.978   9.265
  475   2HB   GLN  64          HB1       GLN  64  -0.700   2.456   8.519
  476   1HG   GLN  64          HG2       GLN  64  -1.329  -0.295   7.433
  477   2HG   GLN  64          HG1       GLN  64  -2.358   0.528   8.606
  478   1HE2  GLN  64          HE21      GLN  64  -1.508   0.346   5.242
  479   2HE2  GLN  64          HE22      GLN  64  -2.494   1.622   4.711
  480    H    ARG  65           HN       ARG  65   2.513   1.076   9.115
  481    HA   ARG  65           HA       ARG  65   3.273   3.815   9.429
  482   1HB   ARG  65          HB2       ARG  65   3.723   1.959  11.090
  483   2HB   ARG  65          HB1       ARG  65   4.993   1.387  10.012
  484   1HG   ARG  65          HG2       ARG  65   6.198   2.741  11.495
  485   2HG   ARG  65          HG1       ARG  65   5.884   3.855  10.169
  486   1HD   ARG  65          HD2       ARG  65   3.879   4.703  11.416
  487   2HD   ARG  65          HD1       ARG  65   4.316   3.649  12.758
  488    HE   ARG  65           HE       ARG  65   6.613   5.121  12.310
  489   1HH1  ARG  65          HH21      ARG  65   3.272   5.800  12.822
  490   2HH1  ARG  65          HH22      ARG  65   3.563   7.316  13.608
  491   1HH2  ARG  65          HH11      ARG  65   7.012   7.100  13.332
  492   2HH2  ARG  65          HH12      ARG  65   5.679   8.051  13.896
  493    H    MET  66           HN       MET  66   4.772   1.156   7.560
  494    HA   MET  66           HA       MET  66   6.945   2.722   6.565
  495   1HB   MET  66          HB2       MET  66   5.554   0.338   5.305
  496   2HB   MET  66          HB1       MET  66   7.107   0.992   4.786
  497   1HG   MET  66          HG2       MET  66   7.834   0.665   7.263
  498   2HG   MET  66          HG1       MET  66   6.426  -0.391   7.379
  499   1HE   MET  66          HE1       MET  66   7.060  -3.290   5.072
  500   2HE   MET  66          HE2       MET  66   5.913  -1.961   5.196
  501   3HE   MET  66          HE3       MET  66   6.397  -2.833   6.646
  502    H    LEU  67           HN       LEU  67   3.664   2.166   5.283
  503    HA   LEU  67           HA       LEU  67   4.029   3.596   2.830
  504   1HB   LEU  67          HB2       LEU  67   1.567   3.151   4.540
  505   2HB   LEU  67          HB1       LEU  67   1.514   3.919   2.957
  506    HG   LEU  67           HG       LEU  67   2.671   1.156   3.446
  507   1HD1  LEU  67          HD11      LEU  67   0.317   1.072   3.993
  508   2HD1  LEU  67          HD12      LEU  67   0.516   0.375   2.385
  509   3HD1  LEU  67          HD13      LEU  67  -0.098   2.018   2.564
  510   1HD2  LEU  67          HD21      LEU  67   3.542   1.885   1.385
  511   2HD2  LEU  67          HD22      LEU  67   2.115   2.845   1.003
  512   3HD2  LEU  67          HD23      LEU  67   2.058   1.088   0.877
  513    H    SER  68           HN       SER  68   3.088   4.631   6.081
  514    HA   SER  68           HA       SER  68   2.479   7.342   5.462
  515   1HB   SER  68          HB2       SER  68   3.593   6.064   7.973
  516   2HB   SER  68          HB1       SER  68   3.114   7.757   7.883
  517    HG   SER  68           HG       SER  68   1.364   6.578   8.600
  518    H    GLY  69           HN       GLY  69   5.548   5.722   6.214
  519   1HA   GLY  69          HA2       GLY  69   7.253   7.929   6.452
  520   2HA   GLY  69          HA1       GLY  69   7.744   6.406   5.706
  521    H    PHE  70           HN       PHE  70   5.685   6.646   3.577
  522    HA   PHE  70           HA       PHE  70   7.177   8.547   1.829
  523   1HB   PHE  70          HB2       PHE  70   5.118   6.421   1.156
  524   2HB   PHE  70          HB1       PHE  70   6.004   7.392  -0.018
  525    HD1  PHE  70           HD1      PHE  70   8.472   7.147  -0.240
  526    HD2  PHE  70           HD2      PHE  70   6.141   4.558   2.269
  527    HE1  PHE  70           HE1      PHE  70  10.344   5.525  -0.177
  528    HE2  PHE  70           HE2      PHE  70   8.015   2.934   2.337
  529    HZ   PHE  70           HZ       PHE  70  10.117   3.418   1.113
  530    H    CYS  71           HN       CYS  71   4.480   8.580   3.771
  531    HA   CYS  71           HA       CYS  71   3.211  10.758   2.153
  532   1HB   CYS  71          HB2       CYS  71   1.985   8.522   1.988
  533   2HB   CYS  71          HB1       CYS  71   1.635   8.700   3.707
  534    HA   PRO  72           HA       PRO  72   4.357  12.009   6.536
  535   1HB   PRO  72          HB2       PRO  72   4.166  14.678   5.238
  536   2HB   PRO  72          HB1       PRO  72   5.461  14.002   6.237
  537   1HG   PRO  72          HG2       PRO  72   5.663  14.313   3.520
  538   2HG   PRO  72          HG1       PRO  72   6.553  13.082   4.429
  539   1HD   PRO  72          HD2       PRO  72   4.254  12.741   2.583
  540   2HD   PRO  72          HD1       PRO  72   5.461  11.537   3.109
  541    H    HIS  73           HN       HIS  73   1.705  12.921   4.414
  542    HA   HIS  73           HA       HIS  73   0.233  14.154   6.687
  543   1HB   HIS  73          HB2       HIS  73  -1.237  15.076   5.117
  544   2HB   HIS  73          HB1       HIS  73   0.291  15.078   4.246
  545    HD1  HIS  73           HD1      HIS  73  -3.095  13.505   4.295
  546    HD2  HIS  73           HD2      HIS  73   0.441  13.142   2.120
  547    HE1  HIS  73           HE1      HIS  73  -3.657  12.143   2.235
  548    H    LYS  74           HN       LYS  74  -0.715  12.714   8.019
  549    HA   LYS  74           HA       LYS  74  -1.499  10.056   7.129
  550   1HB   LYS  74          HB2       LYS  74  -1.979  11.556   9.723
  551   2HB   LYS  74          HB1       LYS  74  -2.446   9.877   9.462
  552   1HG   LYS  74          HG2       LYS  74   0.395  10.733   8.935
  553   2HG   LYS  74          HG1       LYS  74  -0.126  10.422  10.588
  554   1HD   LYS  74          HD2       LYS  74  -0.785   8.359   8.496
  555   2HD   LYS  74          HD1       LYS  74   0.878   8.462   9.064
  556   1HE   LYS  74          HE2       LYS  74   0.116   8.192  11.388
  557   2HE   LYS  74          HE1       LYS  74  -1.559   8.120  10.838
  558   1HZ   LYS  74          HZ1       LYS  74  -1.028   6.153   9.557
  559   2HZ   LYS  74          HZ2       LYS  74  -0.626   5.912  11.190
  560   3HZ   LYS  74          HZ3       LYS  74   0.593   6.230  10.050
  561    H    VAL  75           HN       VAL  75  -3.574   9.300   6.729
  562    HA   VAL  75           HA       VAL  75  -5.706  11.389   6.454
  563    HB   VAL  75           HB       VAL  75  -5.464   8.664   5.141
  564   1HG1  VAL  75          HG11      VAL  75  -7.510  10.884   5.012
  565   2HG1  VAL  75          HG12      VAL  75  -7.774   9.161   5.279
  566   3HG1  VAL  75          HG13      VAL  75  -7.314   9.745   3.681
  567   1HG2  VAL  75          HG21      VAL  75  -4.847  11.482   4.227
  568   2HG2  VAL  75          HG22      VAL  75  -5.209  10.199   3.072
  569   3HG2  VAL  75          HG23      VAL  75  -3.815  10.054   4.142
  570    H    SER  76           HN       SER  76  -7.435  11.250   7.788
  571    HA   SER  76           HA       SER  76  -7.574   8.999   9.695
  572   1HB   SER  76          HB2       SER  76  -9.072  10.360  10.945
  573   2HB   SER  76          HB1       SER  76  -7.861  11.473  10.316
  574    HG   SER  76           HG       SER  76 -10.538  11.296   9.798
  575    H    ALA  77           HN       ALA  77  -9.852   8.163  10.181
  576    HA   ALA  77           HA       ALA  77 -10.900   6.849   7.892
  577   1HB   ALA  77          HB1       ALA  77 -12.813   6.258   9.394
  578   2HB   ALA  77          HB2       ALA  77 -12.157   7.366  10.599
  579   3HB   ALA  77          HB3       ALA  77 -11.237   5.940  10.118
  580    H    GLY  78           HN       GLY  78 -11.990   9.805   9.555
  581   1HA   GLY  78          HA2       GLY  78 -14.280  10.096   7.756
  582   2HA   GLY  78          HA1       GLY  78 -13.752  11.274   8.957
  583    H    GLN  79           HN       GLN  79 -10.933  10.871   7.634
  584    HA   GLN  79           HA       GLN  79 -11.340  13.024   5.616
  585   1HB   GLN  79          HB2       GLN  79  -8.881  11.948   7.014
  586   2HB   GLN  79          HB1       GLN  79  -8.817  13.166   5.740
  587   1HG   GLN  79          HG2       GLN  79 -10.145  14.703   7.046
  588   2HG   GLN  79          HG1       GLN  79 -10.468  13.467   8.262
  589   1HE2  GLN  79          HE21      GLN  79  -9.189  15.989   8.892
  590   2HE2  GLN  79          HE22      GLN  79  -7.604  15.651   9.396
  591    H    PHE  80           HN       PHE  80 -11.215  12.577   3.467
  592    HA   PHE  80           HA       PHE  80  -9.800  10.086   2.582
  593   1HB   PHE  80          HB2       PHE  80 -12.534  11.082   1.747
  594   2HB   PHE  80          HB1       PHE  80 -11.633   9.852   0.856
  595    HD1  PHE  80           HD1      PHE  80 -13.803  10.473   3.659
  596    HD2  PHE  80           HD2      PHE  80 -10.785   7.806   2.159
  597    HE1  PHE  80           HE1      PHE  80 -14.525   8.739   5.281
  598    HE2  PHE  80           HE2      PHE  80 -11.514   6.076   3.767
  599    HZ   PHE  80           HZ       PHE  80 -13.383   6.537   5.332
  600    H    SER  81           HN       SER  81  -8.895  10.201   0.442
  601    HA   SER  81           HA       SER  81  -8.598  13.008  -0.594
  602   1HB   SER  81          HB2       SER  81  -6.533  10.817  -0.792
  603   2HB   SER  81          HB1       SER  81  -6.324  12.531  -1.132
  604    HG   SER  81           HG       SER  81  -7.102  12.680   1.214
  605    H    SER  82           HN       SER  82  -8.218   9.587  -1.707
  606    HA   SER  82           HA       SER  82  -9.149  10.512  -4.413
  607   1HB   SER  82          HB2       SER  82  -6.771   9.553  -4.080
  608   2HB   SER  82          HB1       SER  82  -7.571   7.994  -3.903
  609    HG   SER  82           HG       SER  82  -7.070   8.314  -6.063
  610    H    LEU  83           HN       LEU  83 -10.517   9.092  -1.866
  611    HA   LEU  83           HA       LEU  83 -11.695   6.768  -3.257
  612   1HB   LEU  83          HB2       LEU  83 -11.873   7.978  -0.510
  613   2HB   LEU  83          HB1       LEU  83 -13.169   6.905  -1.034
  614    HG   LEU  83           HG       LEU  83 -11.346   5.210  -1.640
  615   1HD1  LEU  83          HD11      LEU  83  -9.693   7.176  -0.028
  616   2HD1  LEU  83          HD12      LEU  83  -9.458   6.752  -1.724
  617   3HD1  LEU  83          HD13      LEU  83  -9.174   5.548  -0.467
  618   1HD2  LEU  83          HD21      LEU  83 -12.014   6.091   1.157
  619   2HD2  LEU  83          HD22      LEU  83 -10.868   4.775   0.919
  620   3HD2  LEU  83          HD23      LEU  83 -12.510   4.638   0.296
  621    H    HIS  84           HN       HIS  84 -12.049   9.914  -3.656
  622    HA   HIS  84           HA       HIS  84 -14.973  10.152  -3.565
  623   1HB   HIS  84          HB2       HIS  84 -13.088  12.090  -4.912
  624   2HB   HIS  84          HB1       HIS  84 -14.603  12.427  -4.064
  625    HD1  HIS  84           HD1      HIS  84 -11.900  13.808  -3.192
  626    HD2  HIS  84           HD2      HIS  84 -13.433  10.332  -1.496
  627    HE1  HIS  84           HE1      HIS  84 -10.836  13.569  -0.901
  628    H    VAL  85           HN       VAL  85 -12.755   8.770  -5.575
  629    HA   VAL  85           HA       VAL  85 -13.984   9.400  -8.148
  630    HB   VAL  85           HB       VAL  85 -12.087   7.139  -7.470
  631   1HG1  VAL  85          HG11      VAL  85 -11.395   7.493  -9.835
  632   2HG1  VAL  85          HG12      VAL  85 -12.659   8.712  -9.997
  633   3HG1  VAL  85          HG13      VAL  85 -13.090   7.028  -9.696
  634   1HG2  VAL  85          HG21      VAL  85 -11.504  10.044  -8.130
  635   2HG2  VAL  85          HG22      VAL  85 -10.288   8.767  -8.074
  636   3HG2  VAL  85          HG23      VAL  85 -11.152   9.228  -6.608
  637    H    ARG  86           HN       ARG  86 -15.217   7.851  -9.398
  638    HA   ARG  86           HA       ARG  86 -16.880   6.094  -7.705
  639   1HB   ARG  86          HB2       ARG  86 -16.998   6.887 -10.629
  640   2HB   ARG  86          HB1       ARG  86 -18.136   5.763  -9.883
  641   1HG   ARG  86          HG2       ARG  86 -18.776   7.494  -8.245
  642   2HG   ARG  86          HG1       ARG  86 -17.640   8.619  -8.989
  643   1HD   ARG  86          HD2       ARG  86 -18.890   8.348 -11.153
  644   2HD   ARG  86          HD1       ARG  86 -20.092   7.391 -10.282
  645    HE   ARG  86           HE       ARG  86 -19.951   9.721  -8.811
  646   1HH1  ARG  86          HH21      ARG  86 -20.403   8.915 -12.136
  647   2HH1  ARG  86          HH22      ARG  86 -21.389  10.297 -12.472
  648   1HH2  ARG  86          HH11      ARG  86 -21.232  11.529  -9.234
  649   2HH2  ARG  86          HH12      ARG  86 -21.858  11.779 -10.830
  650    H    ASP  87           HN       ASP  87 -14.408   5.078  -7.647
  651    HA   ASP  87           HA       ASP  87 -14.003   3.101  -9.779
  652   1HB   ASP  87          HB2       ASP  87 -12.598   3.640  -7.148
  653   2HB   ASP  87          HB1       ASP  87 -12.127   2.350  -8.251
  654    H    THR  88           HN       THR  88 -13.865   0.759  -9.215
  655    HA   THR  88           HA       THR  88 -16.152   0.003  -7.483
  656    HB   THR  88           HB       THR  88 -14.434  -1.671  -9.342
  657    HG1  THR  88           HG1      THR  88 -16.580  -0.006  -9.695
  658   1HG2  THR  88          HG21      THR  88 -16.430  -3.227  -9.141
  659   2HG2  THR  88          HG22      THR  88 -16.969  -2.228  -7.791
  660   3HG2  THR  88          HG23      THR  88 -15.433  -3.091  -7.692
  661    H    LYS  89           HN       LYS  89 -15.870  -1.786  -5.914
  662    HA   LYS  89           HA       LYS  89 -13.321  -1.498  -4.456
  663   1HB   LYS  89          HB2       LYS  89 -15.796  -3.119  -3.791
  664   2HB   LYS  89          HB1       LYS  89 -14.429  -2.841  -2.716
  665   1HG   LYS  89          HG2       LYS  89 -14.862  -0.418  -2.773
  666   2HG   LYS  89          HG1       LYS  89 -16.234  -0.687  -3.852
  667   1HD   LYS  89          HD2       LYS  89 -17.310  -2.092  -2.122
  668   2HD   LYS  89          HD1       LYS  89 -15.945  -1.804  -1.045
  669   1HE   LYS  89          HE2       LYS  89 -16.473   0.485  -0.800
  670   2HE   LYS  89          HE1       LYS  89 -17.524   0.482  -2.217
  671   1HZ   LYS  89          HZ1       LYS  89 -18.125  -0.216   0.494
  672   2HZ   LYS  89          HZ2       LYS  89 -18.600  -1.422  -0.603
  673   3HZ   LYS  89          HZ3       LYS  89 -19.175   0.167  -0.781
  674    H    ILE  90           HN       ILE  90 -11.875  -3.194  -4.068
  675    HA   ILE  90           HA       ILE  90 -12.327  -5.753  -5.561
  676    HB   ILE  90           HB       ILE  90  -9.891  -5.688  -6.158
  677   1HG1  ILE  90          HG12      ILE  90 -10.079  -2.782  -5.301
  678   2HG1  ILE  90          HG11      ILE  90  -9.298  -4.033  -4.335
  679   1HG2  ILE  90          HG21      ILE  90 -11.675  -3.436  -7.127
  680   2HG2  ILE  90          HG22      ILE  90 -11.517  -5.045  -7.832
  681   3HG2  ILE  90          HG23      ILE  90 -10.173  -3.908  -7.922
  682   1HD1  ILE  90          HD11      ILE  90  -8.538  -3.374  -7.194
  683   2HD1  ILE  90          HD12      ILE  90  -7.701  -4.484  -6.107
  684   3HD1  ILE  90          HD13      ILE  90  -7.695  -2.751  -5.775
  685    H    GLU  91           HN       GLU  91 -10.956  -7.537  -4.716
  686    HA   GLU  91           HA       GLU  91 -11.033  -7.641  -1.845
  687   1HB   GLU  91          HB2       GLU  91  -9.733  -9.440  -3.903
  688   2HB   GLU  91          HB1       GLU  91  -9.753  -9.802  -2.176
  689   1HG   GLU  91          HG2       GLU  91 -12.219  -9.712  -2.179
  690   2HG   GLU  91          HG1       GLU  91 -12.204  -9.350  -3.905
  691    H    VAL  92           HN       VAL  92  -9.350  -7.536  -0.333
  692    HA   VAL  92           HA       VAL  92  -7.246  -5.700  -0.826
  693    HB   VAL  92           HB       VAL  92  -7.590  -7.823   1.306
  694   1HG1  VAL  92          HG11      VAL  92  -5.240  -7.404   1.262
  695   2HG1  VAL  92          HG12      VAL  92  -5.877  -6.389   2.555
  696   3HG1  VAL  92          HG13      VAL  92  -5.479  -5.678   0.991
  697   1HG2  VAL  92          HG21      VAL  92  -8.485  -6.092   2.634
  698   2HG2  VAL  92          HG22      VAL  92  -9.162  -5.755   1.042
  699   3HG2  VAL  92          HG23      VAL  92  -7.785  -4.825   1.626
  700    H    ALA  93           HN       ALA  93  -7.208  -9.267  -0.878
  701    HA   ALA  93           HA       ALA  93  -4.444  -9.693  -1.155
  702   1HB   ALA  93          HB1       ALA  93  -5.996 -11.555  -0.931
  703   2HB   ALA  93          HB2       ALA  93  -5.076 -11.757  -2.422
  704   3HB   ALA  93          HB3       ALA  93  -6.737 -11.166  -2.483
  705    H    GLN  94           HN       GLN  94  -6.816  -8.931  -3.708
  706    HA   GLN  94           HA       GLN  94  -4.854  -9.019  -5.836
  707   1HB   GLN  94          HB2       GLN  94  -7.297  -9.298  -6.219
  708   2HB   GLN  94          HB1       GLN  94  -7.544  -7.615  -5.751
  709   1HG   GLN  94          HG2       GLN  94  -6.165  -6.850  -7.607
  710   2HG   GLN  94          HG1       GLN  94  -5.772  -8.515  -8.039
  711   1HE2  GLN  94          HE21      GLN  94  -8.361  -6.087  -8.077
  712   2HE2  GLN  94          HE22      GLN  94  -9.393  -6.953  -9.109
  713    H    PHE  95           HN       PHE  95  -6.173  -6.495  -3.761
  714    HA   PHE  95           HA       PHE  95  -5.071  -4.216  -5.064
  715   1HB   PHE  95          HB2       PHE  95  -6.728  -4.068  -3.253
  716   2HB   PHE  95          HB1       PHE  95  -5.554  -4.725  -2.114
  717    HD1  PHE  95           HD1      PHE  95  -6.672  -1.762  -3.910
  718    HD2  PHE  95           HD2      PHE  95  -3.488  -3.432  -1.562
  719    HE1  PHE  95           HE1      PHE  95  -5.786   0.515  -3.492
  720    HE2  PHE  95           HE2      PHE  95  -2.601  -1.156  -1.144
  721    HZ   PHE  95           HZ       PHE  95  -3.752   0.817  -2.106
  722    H    VAL  96           HN       VAL  96  -3.696  -6.287  -2.489
  723    HA   VAL  96           HA       VAL  96  -1.287  -4.797  -2.190
  724    HB   VAL  96           HB       VAL  96  -1.777  -7.755  -1.753
  725   1HG1  VAL  96          HG11      VAL  96   0.182  -7.378  -0.111
  726   2HG1  VAL  96          HG12      VAL  96   0.503  -5.908  -1.029
  727   3HG1  VAL  96          HG13      VAL  96   0.576  -7.480  -1.827
  728   1HG2  VAL  96          HG21      VAL  96  -2.193  -7.142   0.550
  729   2HG2  VAL  96          HG22      VAL  96  -3.224  -6.133  -0.464
  730   3HG2  VAL  96          HG23      VAL  96  -1.748  -5.465   0.234
  731    H    LYS  97           HN       LYS  97  -1.907  -7.733  -4.186
  732    HA   LYS  97           HA       LYS  97   0.726  -7.858  -5.266
  733   1HB   LYS  97          HB2       LYS  97  -1.918  -8.760  -6.416
  734   2HB   LYS  97          HB1       LYS  97  -0.367  -9.107  -7.176
  735   1HG   LYS  97          HG2       LYS  97   0.397 -10.214  -5.092
  736   2HG   LYS  97          HG1       LYS  97  -1.181  -9.916  -4.367
  737   1HD   LYS  97          HD2       LYS  97  -0.961 -11.390  -6.992
  738   2HD   LYS  97          HD1       LYS  97  -0.727 -12.242  -5.468
  739   1HE   LYS  97          HE2       LYS  97  -2.952 -11.424  -4.702
  740   2HE   LYS  97          HE1       LYS  97  -3.194 -10.673  -6.278
  741   1HZ   LYS  97          HZ1       LYS  97  -2.752 -12.960  -7.223
  742   2HZ   LYS  97          HZ2       LYS  97  -4.232 -12.746  -6.416
  743   3HZ   LYS  97          HZ3       LYS  97  -2.949 -13.550  -5.645
  744    H    ASP  98           HN       ASP  98  -2.144  -6.087  -6.448
  745    HA   ASP  98           HA       ASP  98  -0.984  -5.187  -8.892
  746   1HB   ASP  98          HB2       ASP  98  -3.029  -3.898  -7.062
  747   2HB   ASP  98          HB1       ASP  98  -2.609  -3.256  -8.651
  748    H    LEU  99           HN       LEU  99  -0.873  -3.896  -5.612
  749    HA   LEU  99           HA       LEU  99   0.531  -1.488  -6.207
  750   1HB   LEU  99          HB2       LEU  99  -0.599  -1.922  -4.047
  751   2HB   LEU  99          HB1       LEU  99   0.572  -3.190  -3.694
  752    HG   LEU  99           HG       LEU  99   2.401  -1.494  -3.803
  753   1HD1  LEU  99          HD11      LEU  99   1.618   0.258  -5.165
  754   2HD1  LEU  99          HD12      LEU  99   1.480   0.951  -3.552
  755   3HD1  LEU  99          HD13      LEU  99   0.049   0.312  -4.361
  756   1HD2  LEU  99          HD21      LEU  99   0.154  -0.846  -1.873
  757   2HD2  LEU  99          HD22      LEU  99   1.851  -0.420  -1.655
  758   3HD2  LEU  99          HD23      LEU  99   1.360  -2.114  -1.653
  759    H    LEU 100           HN       LEU 100   1.644  -4.780  -5.463
  760    HA   LEU 100           HA       LEU 100   4.401  -4.286  -5.189
  761   1HB   LEU 100          HB2       LEU 100   3.447  -6.459  -4.681
  762   2HB   LEU 100          HB1       LEU 100   2.977  -6.689  -6.362
  763    HG   LEU 100           HG       LEU 100   5.306  -6.789  -7.060
  764   1HD1  LEU 100          HD11      LEU 100   7.056  -6.809  -5.129
  765   2HD1  LEU 100          HD12      LEU 100   5.821  -5.956  -4.203
  766   3HD1  LEU 100          HD13      LEU 100   6.457  -5.249  -5.689
  767   1HD2  LEU 100          HD21      LEU 100   4.287  -8.865  -6.190
  768   2HD2  LEU 100          HD22      LEU 100   4.834  -8.453  -4.565
  769   3HD2  LEU 100          HD23      LEU 100   6.012  -8.811  -5.827
  770    H    LEU 101           HN       LEU 101   2.546  -4.808  -8.210
  771    HA   LEU 101           HA       LEU 101   4.820  -4.895  -9.933
  772   1HB   LEU 101          HB2       LEU 101   1.946  -4.107 -10.346
  773   2HB   LEU 101          HB1       LEU 101   3.103  -3.892 -11.652
  774    HG   LEU 101           HG       LEU 101   1.818  -6.093 -11.658
  775   1HD1  LEU 101          HD11      LEU 101   3.603  -7.284 -12.571
  776   2HD1  LEU 101          HD12      LEU 101   4.764  -6.666 -11.401
  777   3HD1  LEU 101          HD13      LEU 101   4.180  -5.625 -12.698
  778   1HD2  LEU 101          HD21      LEU 101   2.020  -6.363  -9.148
  779   2HD2  LEU 101          HD22      LEU 101   3.694  -6.837  -9.402
  780   3HD2  LEU 101          HD23      LEU 101   2.389  -7.802 -10.088
  781    H    HIS 102           HN       HIS 102   2.874  -2.060  -8.925
  782    HA   HIS 102           HA       HIS 102   4.531  -0.212 -10.395
  783   1HB   HIS 102          HB2       HIS 102   2.469   0.100  -8.222
  784   2HB   HIS 102          HB1       HIS 102   3.432   1.487  -8.734
  785    HD1  HIS 102           HD1      HIS 102   3.088   2.373 -11.130
  786    HD2  HIS 102           HD2      HIS 102   0.631  -0.850 -10.175
  787    HE1  HIS 102           HE1      HIS 102   1.368   2.230 -12.973
  788    H    LEU 103           HN       LEU 103   4.687  -1.380  -7.031
  789    HA   LEU 103           HA       LEU 103   6.514   0.573  -6.087
  790   1HB   LEU 103          HB2       LEU 103   6.210  -2.342  -5.345
  791   2HB   LEU 103          HB1       LEU 103   7.271  -1.234  -4.479
  792    HG   LEU 103           HG       LEU 103   4.308  -0.762  -4.896
  793   1HD1  LEU 103          HD11      LEU 103   4.261  -1.310  -2.375
  794   2HD1  LEU 103          HD12      LEU 103   5.839  -2.052  -2.634
  795   3HD1  LEU 103          HD13      LEU 103   4.424  -2.668  -3.488
  796   1HD2  LEU 103          HD21      LEU 103   6.510   0.718  -3.484
  797   2HD2  LEU 103          HD22      LEU 103   4.900   0.750  -2.772
  798   3HD2  LEU 103          HD23      LEU 103   5.149   1.350  -4.406
  799    H    LYS 104           HN       LYS 104   7.281  -2.609  -7.561
  800    HA   LYS 104           HA       LYS 104  10.121  -2.158  -7.492
  801   1HB   LYS 104          HB2       LYS 104  10.233  -4.024  -9.127
  802   2HB   LYS 104          HB1       LYS 104   9.203  -4.406  -7.749
  803   1HG   LYS 104          HG2       LYS 104   7.205  -3.782  -9.077
  804   2HG   LYS 104          HG1       LYS 104   8.243  -3.423 -10.456
  805   1HD   LYS 104          HD2       LYS 104   7.569  -5.613 -10.932
  806   2HD   LYS 104          HD1       LYS 104   9.107  -5.882 -10.118
  807   1HE   LYS 104          HE2       LYS 104   7.474  -5.907  -7.953
  808   2HE   LYS 104          HE1       LYS 104   6.339  -6.472  -9.175
  809   1HZ   LYS 104          HZ1       LYS 104   8.767  -7.780  -9.586
  810   2HZ   LYS 104          HZ2       LYS 104   7.286  -8.446  -9.088
  811   3HZ   LYS 104          HZ3       LYS 104   8.403  -7.894  -7.933
  812    H    LYS 105           HN       LYS 105   7.622  -1.053  -9.641
  813    HA   LYS 105           HA       LYS 105   9.216  -0.581 -11.970
  814   1HB   LYS 105          HB2       LYS 105   6.716  -0.558 -11.897
  815   2HB   LYS 105          HB1       LYS 105   6.796   0.987 -11.050
  816   1HG   LYS 105          HG2       LYS 105   8.028   1.971 -12.949
  817   2HG   LYS 105          HG1       LYS 105   7.949   0.427 -13.798
  818   1HD   LYS 105          HD2       LYS 105   5.529   0.534 -13.885
  819   2HD   LYS 105          HD1       LYS 105   5.517   1.986 -12.884
  820   1HE   LYS 105          HE2       LYS 105   6.930   1.837 -15.556
  821   2HE   LYS 105          HE1       LYS 105   5.272   2.409 -15.375
  822   1HZ   LYS 105          HZ1       LYS 105   7.158   4.116 -15.310
  823   2HZ   LYS 105          HZ2       LYS 105   7.451   3.538 -13.739
  824   3HZ   LYS 105          HZ3       LYS 105   5.946   4.223 -14.128
  825    H    LEU 106           HN       LEU 106   8.351   1.660  -9.286
  826    HA   LEU 106           HA       LEU 106   9.753   3.897 -10.352
  827   1HB   LEU 106          HB2       LEU 106   8.976   3.117  -7.545
  828   2HB   LEU 106          HB1       LEU 106   9.940   4.561  -7.831
  829    HG   LEU 106           HG       LEU 106   7.449   4.976  -7.735
  830   1HD1  LEU 106          HD11      LEU 106   8.297   5.677 -10.528
  831   2HD1  LEU 106          HD12      LEU 106   9.264   6.293  -9.191
  832   3HD1  LEU 106          HD13      LEU 106   7.552   6.682  -9.290
  833   1HD2  LEU 106          HD21      LEU 106   6.040   4.244  -9.543
  834   2HD2  LEU 106          HD22      LEU 106   6.883   2.825  -8.931
  835   3HD2  LEU 106          HD23      LEU 106   7.416   3.585 -10.427
  836    H    PHE 107           HN       PHE 107  10.905   1.112  -8.545
  837    HA   PHE 107           HA       PHE 107  13.459   2.133  -7.808
  838   1HB   PHE 107          HB2       PHE 107  12.535  -0.055  -7.019
  839   2HB   PHE 107          HB1       PHE 107  12.807  -0.713  -8.630
  840    HD1  PHE 107           HD1      PHE 107  14.594   1.110  -5.890
  841    HD2  PHE 107           HD2      PHE 107  14.889  -1.683  -9.140
  842    HE1  PHE 107           HE1      PHE 107  16.963   0.684  -5.307
  843    HE2  PHE 107           HE2      PHE 107  17.261  -2.111  -8.557
  844    HZ   PHE 107           HZ       PHE 107  18.300  -0.926  -6.641
  845    H    ARG 108           HN       ARG 108  12.271   0.720 -10.814
  846    HA   ARG 108           HA       ARG 108  14.756   0.414 -12.145
  847   1HB   ARG 108          HB2       ARG 108  11.989   1.043 -13.206
  848   2HB   ARG 108          HB1       ARG 108  13.357   0.666 -14.247
  849   1HG   ARG 108          HG2       ARG 108  12.563  -1.193 -12.004
  850   2HG   ARG 108          HG1       ARG 108  11.755  -1.269 -13.568
  851   1HD   ARG 108          HD2       ARG 108  14.038  -1.517 -14.637
  852   2HD   ARG 108          HD1       ARG 108  14.706  -1.688 -13.015
  853    HE   ARG 108           HE       ARG 108  12.697  -3.571 -13.063
  854   1HH1  ARG 108          HH21      ARG 108  15.367  -2.743 -15.080
  855   2HH1  ARG 108          HH22      ARG 108  15.641  -4.368 -15.612
  856   1HH2  ARG 108          HH11      ARG 108  13.047  -5.703 -13.738
  857   2HH2  ARG 108          HH12      ARG 108  14.335  -6.045 -14.845
  858    H    GLU 109           HN       GLU 109  12.628   3.280 -11.890
  859    HA   GLU 109           HA       GLU 109  14.523   4.838 -13.550
  860   1HB   GLU 109          HB2       GLU 109  11.939   5.621 -12.172
  861   2HB   GLU 109          HB1       GLU 109  12.897   6.695 -13.191
  862   1HG   GLU 109          HG2       GLU 109  11.792   4.033 -14.123
  863   2HG   GLU 109          HG1       GLU 109  11.000   5.583 -14.408
  864    H    GLY 110           HN       GLY 110  14.088   4.131 -10.220
  865   1HA   GLY 110          HA2       GLY 110  15.377   4.860  -8.395
  866   2HA   GLY 110          HA1       GLY 110  16.316   5.842  -9.516
  867    H    ARG 111           HN       ARG 111  12.945   6.421  -9.755
  868    HA   ARG 111           HA       ARG 111  13.322   9.035  -8.368
  869   1HB   ARG 111          HB2       ARG 111  11.067   8.022 -10.128
  870   2HB   ARG 111          HB1       ARG 111  11.157   9.639  -9.430
  871   1HG   ARG 111          HG2       ARG 111  13.543   9.666 -10.615
  872   2HG   ARG 111          HG1       ARG 111  12.812   8.429 -11.630
  873   1HD   ARG 111          HD2       ARG 111  12.036  11.310 -11.309
  874   2HD   ARG 111          HD1       ARG 111  12.298  10.404 -12.794
  875    HE   ARG 111           HE       ARG 111   9.798  10.783 -11.449
  876   1HH1  ARG 111          HH21      ARG 111  11.664   8.271 -12.908
  877   2HH1  ARG 111          HH22      ARG 111  10.306   7.222 -13.123
  878   1HH2  ARG 111          HH11      ARG 111   8.033   9.442 -11.740
  879   2HH2  ARG 111          HH12      ARG 111   8.250   7.886 -12.469
  880    H    PHE 112           HN       PHE 112  13.085   8.588  -6.201
  881    HA   PHE 112           HA       PHE 112  10.801   6.939  -5.280
  882   1HB   PHE 112          HB2       PHE 112  13.002   8.288  -3.689
  883   2HB   PHE 112          HB1       PHE 112  11.887   7.044  -3.112
  884    HD1  PHE 112           HD1      PHE 112  11.957   4.753  -4.065
  885    HD2  PHE 112           HD2      PHE 112  14.886   7.721  -5.082
  886    HE1  PHE 112           HE1      PHE 112  13.426   2.989  -4.996
  887    HE2  PHE 112           HE2      PHE 112  16.356   5.950  -6.014
  888    HZ   PHE 112           HZ       PHE 112  15.626   3.583  -5.965
  889    H    ASN 113           HN       ASN 113   9.056   7.765  -4.177
  890    HA   ASN 113           HA       ASN 113   7.423   9.407  -3.764
  891   1HB   ASN 113          HB2       ASN 113   8.174  11.056  -2.043
  892   2HB   ASN 113          HB1       ASN 113   8.618   9.396  -1.649
  893   1HD2  ASN 113          HD21      ASN 113  10.900   8.795  -1.832
  894   2HD2  ASN 113          HD22      ASN 113  12.114   9.976  -1.940
  Start of MODEL   30
    1   1H    MET   1           HT1      MET   1  20.407   4.231  14.920
    2   2H    MET   1           HT2      MET   1  21.484   3.254  14.040
    3   3H    MET   1           HT3      MET   1  20.098   3.888  13.288
    4    HA   MET   1           HA       MET   1  22.049   5.741  14.464
    5   1HB   MET   1          HB2       MET   1  23.156   3.940  12.926
    6   2HB   MET   1          HB1       MET   1  22.309   4.760  11.616
    7   1HG   MET   1          HG2       MET   1  23.360   6.928  12.459
    8   2HG   MET   1          HG1       MET   1  24.369   5.931  13.502
    9   1HE   MET   1          HE1       MET   1  25.057   3.287  11.613
   10   2HE   MET   1          HE2       MET   1  25.828   4.212  12.899
   11   3HE   MET   1          HE3       MET   1  26.662   3.987  11.365
   12    H    GLY   2           HN       GLY   2  21.937   6.624  11.430
   13   1HA   GLY   2          HA2       GLY   2  19.679   8.437  11.821
   14   2HA   GLY   2          HA1       GLY   2  20.747   8.403  10.415
   15    HA   PRO   3           HA       PRO   3  16.366   6.406   9.753
   16   1HB   PRO   3          HB2       PRO   3  16.430   8.200   7.404
   17   2HB   PRO   3          HB1       PRO   3  15.163   7.994   8.620
   18   1HG   PRO   3          HG2       PRO   3  16.972  10.174   8.419
   19   2HG   PRO   3          HG1       PRO   3  15.860   9.848   9.754
   20   1HD   PRO   3          HD2       PRO   3  18.747   9.681   9.791
   21   2HD   PRO   3          HD1       PRO   3  17.621   9.308  11.122
   22    H    VAL   4           HN       VAL   4  15.893   5.062   7.771
   23    HA   VAL   4           HA       VAL   4  18.353   3.907   6.732
   24    HB   VAL   4           HB       VAL   4  16.657   2.446   5.450
   25   1HG1  VAL   4          HG11      VAL   4  16.092   1.182   7.481
   26   2HG1  VAL   4          HG12      VAL   4  16.480   2.587   8.475
   27   3HG1  VAL   4          HG13      VAL   4  17.753   1.769   7.570
   28   1HG2  VAL   4          HG21      VAL   4  14.860   4.258   5.699
   29   2HG2  VAL   4          HG22      VAL   4  14.718   3.738   7.378
   30   3HG2  VAL   4          HG23      VAL   4  14.358   2.610   6.073
   31    HA   PRO   5           HA       PRO   5  18.616   6.303   2.976
   32   1HB   PRO   5          HB2       PRO   5  18.988   3.937   1.283
   33   2HB   PRO   5          HB1       PRO   5  20.161   5.185   1.714
   34   1HG   PRO   5          HG2       PRO   5  20.067   2.512   2.696
   35   2HG   PRO   5          HG1       PRO   5  21.136   3.809   3.240
   36   1HD   PRO   5          HD2       PRO   5  18.915   2.620   4.680
   37   2HD   PRO   5          HD1       PRO   5  20.018   3.910   5.224
   38    HA   PRO   6           HA       PRO   6  14.617   6.042   1.016
   39   1HB   PRO   6          HB2       PRO   6  15.243   6.844  -1.590
   40   2HB   PRO   6          HB1       PRO   6  14.994   7.935  -0.221
   41   1HG   PRO   6          HG2       PRO   6  17.536   7.093  -1.517
   42   2HG   PRO   6          HG1       PRO   6  17.156   8.591  -0.657
   43   1HD   PRO   6          HD2       PRO   6  18.685   6.490   0.395
   44   2HD   PRO   6          HD1       PRO   6  17.866   7.741   1.366
   45    H    SER   7           HN       SER   7  17.019   4.906  -1.377
   46    HA   SER   7           HA       SER   7  15.285   3.079  -2.700
   47   1HB   SER   7          HB2       SER   7  17.290   2.163  -3.702
   48   2HB   SER   7          HB1       SER   7  17.494   3.908  -3.567
   49    HG   SER   7           HG       SER   7  18.444   3.229  -1.387
   50    H    THR   8           HN       THR   8  17.469   2.626   0.068
   51    HA   THR   8           HA       THR   8  17.110  -0.229   0.210
   52    HB   THR   8           HB       THR   8  17.872   1.733   2.393
   53    HG1  THR   8           HG1      THR   8  19.419   1.854   0.893
   54   1HG2  THR   8          HG21      THR   8  19.006  -0.396   3.289
   55   2HG2  THR   8          HG22      THR   8  17.953  -1.278   2.184
   56   3HG2  THR   8          HG23      THR   8  17.255  -0.288   3.467
   57    H    ALA   9           HN       ALA   9  15.422   2.497   1.779
   58    HA   ALA   9           HA       ALA   9  13.804   0.928   3.520
   59   1HB   ALA   9          HB1       ALA   9  12.412   2.853   3.739
   60   2HB   ALA   9          HB2       ALA   9  12.858   3.451   2.141
   61   3HB   ALA   9          HB3       ALA   9  14.033   3.488   3.457
   62    H    LEU  10           HN       LEU  10  13.319   1.965   0.155
   63    HA   LEU  10           HA       LEU  10  10.721   0.799  -0.161
   64   1HB   LEU  10          HB2       LEU  10  11.817   2.442  -1.747
   65   2HB   LEU  10          HB1       LEU  10  12.853   1.126  -2.292
   66    HG   LEU  10           HG       LEU  10  10.739  -0.190  -2.806
   67   1HD1  LEU  10          HD11      LEU  10   9.544   2.452  -2.006
   68   2HD1  LEU  10          HD12      LEU  10   8.960   0.817  -1.701
   69   3HD1  LEU  10          HD13      LEU  10   8.784   1.530  -3.301
   70   1HD2  LEU  10          HD21      LEU  10  10.357   1.025  -4.932
   71   2HD2  LEU  10          HD22      LEU  10  12.070   0.882  -4.549
   72   3HD2  LEU  10          HD23      LEU  10  11.234   2.410  -4.282
   73    H    ARG  11           HN       ARG  11  14.004  -0.434  -0.796
   74    HA   ARG  11           HA       ARG  11  13.256  -2.977  -1.830
   75   1HB   ARG  11          HB2       ARG  11  15.685  -2.080  -0.247
   76   2HB   ARG  11          HB1       ARG  11  15.551  -3.677  -0.977
   77   1HG   ARG  11          HG2       ARG  11  15.098  -1.229  -2.678
   78   2HG   ARG  11          HG1       ARG  11  16.743  -1.727  -2.299
   79   1HD   ARG  11          HD2       ARG  11  14.685  -3.600  -3.505
   80   2HD   ARG  11          HD1       ARG  11  15.839  -2.673  -4.459
   81    HE   ARG  11           HE       ARG  11  17.406  -3.992  -2.579
   82   1HH1  ARG  11          HH21      ARG  11  15.046  -4.836  -4.947
   83   2HH1  ARG  11          HH22      ARG  11  15.713  -6.407  -5.244
   84   1HH2  ARG  11          HH11      ARG  11  18.287  -6.038  -2.949
   85   2HH2  ARG  11          HH12      ARG  11  17.548  -7.088  -4.112
   86    H    GLU  12           HN       GLU  12  13.924  -1.922   1.500
   87    HA   GLU  12           HA       GLU  12  13.504  -4.461   2.742
   88   1HB   GLU  12          HB2       GLU  12  13.223  -1.625   3.774
   89   2HB   GLU  12          HB1       GLU  12  13.074  -3.050   4.806
   90   1HG   GLU  12          HG2       GLU  12  15.341  -3.764   4.174
   91   2HG   GLU  12          HG1       GLU  12  15.494  -2.367   3.110
   92    H    LEU  13           HN       LEU  13  11.290  -1.798   1.963
   93    HA   LEU  13           HA       LEU  13   8.992  -2.948   3.266
   94   1HB   LEU  13          HB2       LEU  13   9.149  -0.556   2.686
   95   2HB   LEU  13          HB1       LEU  13   9.183  -0.967   0.975
   96    HG   LEU  13           HG       LEU  13   6.915  -1.977   1.195
   97   1HD1  LEU  13          HD11      LEU  13   5.682  -1.210   3.368
   98   2HD1  LEU  13          HD12      LEU  13   7.301  -1.101   4.058
   99   3HD1  LEU  13          HD13      LEU  13   6.703  -2.644   3.446
  100   1HD2  LEU  13          HD21      LEU  13   7.059   0.865   2.240
  101   2HD2  LEU  13          HD22      LEU  13   5.728   0.139   1.338
  102   3HD2  LEU  13          HD23      LEU  13   7.281   0.417   0.549
  103    H    ILE  14           HN       ILE  14  10.188  -3.062  -0.097
  104    HA   ILE  14           HA       ILE  14   7.971  -4.498  -1.174
  105    HB   ILE  14           HB       ILE  14  10.886  -4.389  -1.995
  106   1HG1  ILE  14          HG12      ILE  14   8.432  -3.201  -3.312
  107   2HG1  ILE  14          HG11      ILE  14   9.374  -2.329  -2.103
  108   1HG2  ILE  14          HG21      ILE  14   8.524  -5.795  -3.251
  109   2HG2  ILE  14          HG22      ILE  14  10.138  -6.432  -2.938
  110   3HG2  ILE  14          HG23      ILE  14   9.892  -5.252  -4.224
  111   1HD1  ILE  14          HD11      ILE  14  10.073  -1.782  -4.434
  112   2HD1  ILE  14          HD12      ILE  14  10.508  -3.475  -4.671
  113   3HD1  ILE  14          HD13      ILE  14  11.378  -2.498  -3.488
  114    H    GLU  15           HN       GLU  15  11.017  -5.646   0.274
  115    HA   GLU  15           HA       GLU  15  10.590  -8.427  -0.137
  116   1HB   GLU  15          HB2       GLU  15  12.079  -6.926   2.032
  117   2HB   GLU  15          HB1       GLU  15  12.123  -8.683   1.865
  118   1HG   GLU  15          HG2       GLU  15  13.006  -8.475  -0.408
  119   2HG   GLU  15          HG1       GLU  15  12.907  -6.716  -0.307
  120    H    GLU  16           HN       GLU  16   9.529  -6.287   2.506
  121    HA   GLU  16           HA       GLU  16   8.395  -8.417   4.097
  122   1HB   GLU  16          HB2       GLU  16   8.969  -6.168   5.008
  123   2HB   GLU  16          HB1       GLU  16   7.671  -5.471   4.043
  124   1HG   GLU  16          HG2       GLU  16   6.863  -5.836   6.313
  125   2HG   GLU  16          HG1       GLU  16   6.044  -6.960   5.232
  126    H    LEU  17           HN       LEU  17   6.993  -6.096   1.771
  127    HA   LEU  17           HA       LEU  17   4.302  -6.997   2.009
  128   1HB   LEU  17          HB2       LEU  17   5.791  -5.696  -0.281
  129   2HB   LEU  17          HB1       LEU  17   4.054  -5.997  -0.312
  130    HG   LEU  17           HG       LEU  17   5.463  -4.422   1.864
  131   1HD1  LEU  17          HD11      LEU  17   3.911  -3.417  -0.541
  132   2HD1  LEU  17          HD12      LEU  17   5.654  -3.281  -0.311
  133   3HD1  LEU  17          HD13      LEU  17   4.553  -2.415   0.760
  134   1HD2  LEU  17          HD21      LEU  17   2.899  -3.595   1.971
  135   2HD2  LEU  17          HD22      LEU  17   3.454  -5.011   2.854
  136   3HD2  LEU  17          HD23      LEU  17   2.616  -5.208   1.317
  137    H    VAL  18           HN       VAL  18   6.930  -8.075  -0.135
  138    HA   VAL  18           HA       VAL  18   5.308  -9.930  -1.620
  139    HB   VAL  18           HB       VAL  18   8.294  -9.757  -1.135
  140   1HG1  VAL  18          HG11      VAL  18   6.680 -11.673  -2.830
  141   2HG1  VAL  18          HG12      VAL  18   7.930 -12.052  -1.644
  142   3HG1  VAL  18          HG13      VAL  18   8.371 -11.309  -3.180
  143   1HG2  VAL  18          HG21      VAL  18   8.330  -8.875  -3.402
  144   2HG2  VAL  18          HG22      VAL  18   7.164  -7.950  -2.456
  145   3HG2  VAL  18          HG23      VAL  18   6.603  -9.183  -3.586
  146    H    ASN  19           HN       ASN  19   7.401 -10.332   1.234
  147    HA   ASN  19           HA       ASN  19   7.182 -13.145   1.465
  148   1HB   ASN  19          HB2       ASN  19   8.786 -11.778   2.750
  149   2HB   ASN  19          HB1       ASN  19   7.451 -11.108   3.689
  150   1HD2  ASN  19          HD21      ASN  19   9.129 -14.183   2.949
  151   2HD2  ASN  19          HD22      ASN  19   8.645 -14.974   4.371
  152    H    ILE  20           HN       ILE  20   5.039 -10.613   2.792
  153    HA   ILE  20           HA       ILE  20   3.439 -12.530   4.260
  154    HB   ILE  20           HB       ILE  20   1.916 -10.632   4.653
  155   1HG1  ILE  20          HG12      ILE  20   3.781  -9.117   2.803
  156   2HG1  ILE  20          HG11      ILE  20   2.147  -9.618   2.381
  157   1HG2  ILE  20          HG21      ILE  20   3.500  -9.270   5.882
  158   2HG2  ILE  20          HG22      ILE  20   4.826  -9.805   4.849
  159   3HG2  ILE  20          HG23      ILE  20   4.049 -10.945   5.949
  160   1HD1  ILE  20          HD11      ILE  20   2.882  -7.777   4.674
  161   2HD1  ILE  20          HD12      ILE  20   1.249  -8.294   4.258
  162   3HD1  ILE  20          HD13      ILE  20   2.163  -7.278   3.143
  163    H    THR  21           HN       THR  21   3.337 -11.443   0.936
  164    HA   THR  21           HA       THR  21   0.542 -12.448   0.639
  165    HB   THR  21           HB       THR  21   0.758 -11.586  -1.699
  166    HG1  THR  21           HG1      THR  21   3.261 -10.666  -0.737
  167   1HG2  THR  21          HG21      THR  21   1.644  -9.379   0.132
  168   2HG2  THR  21          HG22      THR  21   0.099 -10.176   0.427
  169   3HG2  THR  21          HG23      THR  21   0.394  -9.361  -1.108
  170    H    GLN  22           HN       GLN  22   3.833 -13.415   0.003
  171    HA   GLN  22           HA       GLN  22   3.096 -15.423  -1.987
  172   1HB   GLN  22          HB2       GLN  22   5.616 -14.943  -0.385
  173   2HB   GLN  22          HB1       GLN  22   5.448 -16.275  -1.528
  174   1HG   GLN  22          HG2       GLN  22   5.002 -14.702  -3.347
  175   2HG   GLN  22          HG1       GLN  22   5.068 -13.347  -2.221
  176   1HE2  GLN  22          HE21      GLN  22   6.870 -13.652  -4.494
  177   2HE2  GLN  22          HE22      GLN  22   8.438 -13.835  -3.871
  178    H    ASN  23           HN       ASN  23   3.433 -15.298   1.502
  179    HA   ASN  23           HA       ASN  23   3.139 -18.247   1.722
  180   1HB   ASN  23          HB2       ASN  23   3.568 -17.901   4.100
  181   2HB   ASN  23          HB1       ASN  23   4.788 -17.050   3.150
  182   1HD2  ASN  23          HD21      ASN  23   4.610 -15.986   5.602
  183   2HD2  ASN  23          HD22      ASN  23   3.685 -14.563   5.629
  184    H    GLN  24           HN       GLN  24   0.993 -15.825   1.208
  185    HA   GLN  24           HA       GLN  24  -0.927 -16.531   3.324
  186   1HB   GLN  24          HB2       GLN  24  -2.310 -14.822   2.462
  187   2HB   GLN  24          HB1       GLN  24  -0.677 -14.214   2.208
  188   1HG   GLN  24          HG2       GLN  24  -0.862 -15.293  -0.146
  189   2HG   GLN  24          HG1       GLN  24  -2.592 -15.365   0.178
  190   1HE2  GLN  24          HE21      GLN  24  -1.530 -13.701  -1.909
  191   2HE2  GLN  24          HE22      GLN  24  -1.799 -12.081  -1.477
  192    H    LYS  25           HN       LYS  25  -2.095 -18.361   3.196
  193    HA   LYS  25           HA       LYS  25  -2.452 -19.740   0.619
  194   1HB   LYS  25          HB2       LYS  25  -1.977 -20.947   2.781
  195   2HB   LYS  25          HB1       LYS  25  -3.579 -20.468   3.341
  196   1HG   LYS  25          HG2       LYS  25  -4.541 -21.572   1.287
  197   2HG   LYS  25          HG1       LYS  25  -2.932 -22.196   0.936
  198   1HD   LYS  25          HD2       LYS  25  -4.367 -22.677   3.561
  199   2HD   LYS  25          HD1       LYS  25  -4.453 -23.792   2.201
  200   1HE   LYS  25          HE2       LYS  25  -1.998 -23.010   3.795
  201   2HE   LYS  25          HE1       LYS  25  -2.717 -24.608   3.634
  202   1HZ   LYS  25          HZ1       LYS  25  -2.238 -23.852   1.067
  203   2HZ   LYS  25          HZ2       LYS  25  -1.281 -24.910   1.988
  204   3HZ   LYS  25          HZ3       LYS  25  -0.884 -23.261   1.899
  205    H    ALA  26           HN       ALA  26  -4.186 -17.620   2.726
  206    HA   ALA  26           HA       ALA  26  -6.492 -17.636   0.847
  207   1HB   ALA  26          HB1       ALA  26  -6.497 -18.512   3.674
  208   2HB   ALA  26          HB2       ALA  26  -7.687 -18.826   2.413
  209   3HB   ALA  26          HB3       ALA  26  -7.739 -17.313   3.317
  210    HA   PRO  27           HA       PRO  27  -6.386 -13.220   0.960
  211   1HB   PRO  27          HB2       PRO  27  -8.980 -13.114   2.405
  212   2HB   PRO  27          HB1       PRO  27  -8.545 -12.436   0.832
  213   1HG   PRO  27          HG2       PRO  27 -10.077 -14.767   1.264
  214   2HG   PRO  27          HG1       PRO  27  -9.367 -14.259  -0.274
  215   1HD   PRO  27          HD2       PRO  27  -8.620 -16.545   1.327
  216   2HD   PRO  27          HD1       PRO  27  -7.871 -15.998  -0.191
  217    H    LEU  28           HN       LEU  28  -5.591 -11.660   2.382
  218    HA   LEU  28           HA       LEU  28  -4.852 -12.498   5.045
  219   1HB   LEU  28          HB2       LEU  28  -4.735  -9.800   3.670
  220   2HB   LEU  28          HB1       LEU  28  -4.055 -10.114   5.264
  221    HG   LEU  28           HG       LEU  28  -3.292 -11.633   2.751
  222   1HD1  LEU  28          HD11      LEU  28  -1.137 -10.304   3.016
  223   2HD1  LEU  28          HD12      LEU  28  -2.009  -9.276   4.152
  224   3HD1  LEU  28          HD13      LEU  28  -2.535  -9.377   2.472
  225   1HD2  LEU  28          HD21      LEU  28  -2.677 -13.062   4.490
  226   2HD2  LEU  28          HD22      LEU  28  -2.448 -11.747   5.641
  227   3HD2  LEU  28          HD23      LEU  28  -1.234 -12.058   4.402
  228    H    CYS  29           HN       CYS  29  -7.784 -11.423   3.865
  229    HA   CYS  29           HA       CYS  29  -8.679 -10.717   6.612
  230   1HB   CYS  29          HB2       CYS  29  -9.099  -8.967   4.174
  231   2HB   CYS  29          HB1       CYS  29  -9.922  -8.743   5.718
  232    H    ASN  30           HN       ASN  30 -11.143 -10.514   6.618
  233    HA   ASN  30           HA       ASN  30 -12.287 -12.893   5.486
  234   1HB   ASN  30          HB2       ASN  30 -13.549 -10.454   6.770
  235   2HB   ASN  30          HB1       ASN  30 -14.447 -11.908   6.332
  236   1HD2  ASN  30          HD21      ASN  30 -13.845 -10.784   9.083
  237   2HD2  ASN  30          HD22      ASN  30 -13.073 -12.049   9.912
  238    H    GLY  31           HN       GLY  31 -11.184 -11.428   3.353
  239   1HA   GLY  31          HA2       GLY  31 -11.865 -11.007   1.124
  240   2HA   GLY  31          HA1       GLY  31 -13.543 -11.162   1.642
  241    H    SER  32           HN       SER  32 -11.266  -9.011   3.242
  242    HA   SER  32           HA       SER  32 -13.005  -6.764   3.090
  243   1HB   SER  32          HB2       SER  32 -10.010  -6.928   3.516
  244   2HB   SER  32          HB1       SER  32 -10.925  -5.431   3.656
  245    HG   SER  32           HG       SER  32 -11.986  -6.233   5.383
  246    H    MET  33           HN       MET  33 -13.176  -5.106   1.606
  247    HA   MET  33           HA       MET  33 -11.513  -5.314  -0.890
  248   1HB   MET  33          HB2       MET  33 -14.401  -4.424  -0.596
  249   2HB   MET  33          HB1       MET  33 -13.487  -4.481  -2.103
  250   1HG   MET  33          HG2       MET  33 -13.147  -6.934  -1.759
  251   2HG   MET  33          HG1       MET  33 -14.178  -6.842  -0.332
  252   1HE   MET  33          HE1       MET  33 -13.643  -6.023  -3.849
  253   2HE   MET  33          HE2       MET  33 -15.209  -5.904  -4.644
  254   3HE   MET  33          HE3       MET  33 -14.498  -7.488  -4.352
  255    H    VAL  34           HN       VAL  34 -10.904  -3.299  -1.849
  256    HA   VAL  34           HA       VAL  34 -11.305  -0.869  -0.129
  257    HB   VAL  34           HB       VAL  34  -8.938  -0.248  -0.779
  258   1HG1  VAL  34          HG11      VAL  34  -9.473  -1.148   1.446
  259   2HG1  VAL  34          HG12      VAL  34  -7.911  -1.754   0.899
  260   3HG1  VAL  34          HG13      VAL  34  -9.334  -2.793   0.826
  261   1HG2  VAL  34          HG21      VAL  34  -8.776  -1.813  -2.706
  262   2HG2  VAL  34          HG22      VAL  34  -8.846  -3.175  -1.587
  263   3HG2  VAL  34          HG23      VAL  34  -7.473  -2.068  -1.545
  264    H    TRP  35           HN       TRP  35 -10.942   1.169  -1.337
  265    HA   TRP  35           HA       TRP  35 -12.322   1.116  -3.881
  266   1HB   TRP  35          HB2       TRP  35 -10.860   3.329  -2.416
  267   2HB   TRP  35          HB1       TRP  35 -11.803   3.574  -3.884
  268    HD1  TRP  35           HD1      TRP  35 -12.150   2.862  -0.174
  269    HE1  TRP  35           HE1      TRP  35 -14.623   3.109   0.502
  270    HE3  TRP  35           HE3      TRP  35 -14.270   3.336  -4.790
  271    HZ2  TRP  35           HZ2      TRP  35 -17.171   3.457  -0.754
  272    HZ3  TRP  35           HZ3      TRP  35 -16.724   3.617  -5.023
  273    HH2  TRP  35           HH2      TRP  35 -18.174   3.680  -3.014
  274    H    SER  36           HN       SER  36 -11.469   1.169  -5.931
  275    HA   SER  36           HA       SER  36  -8.655   0.594  -6.305
  276   1HB   SER  36          HB2       SER  36  -9.162   0.510  -8.639
  277   2HB   SER  36          HB1       SER  36 -10.589  -0.123  -7.823
  278    HG   SER  36           HG       SER  36 -10.349   2.027  -9.415
  279    H    ILE  37           HN       ILE  37  -7.069   1.994  -7.266
  280    HA   ILE  37           HA       ILE  37  -7.786   4.892  -7.452
  281    HB   ILE  37           HB       ILE  37  -5.651   5.434  -6.254
  282   1HG1  ILE  37          HG12      ILE  37  -5.693   2.553  -5.326
  283   2HG1  ILE  37          HG11      ILE  37  -4.700   3.071  -6.685
  284   1HG2  ILE  37          HG21      ILE  37  -7.433   3.729  -4.506
  285   2HG2  ILE  37          HG22      ILE  37  -7.976   5.273  -5.162
  286   3HG2  ILE  37          HG23      ILE  37  -6.584   5.215  -4.083
  287   1HD1  ILE  37          HD11      ILE  37  -3.653   4.796  -5.208
  288   2HD1  ILE  37          HD12      ILE  37  -3.354   3.146  -4.662
  289   3HD1  ILE  37          HD13      ILE  37  -4.568   4.136  -3.852
  290    H    ASN  38           HN       ASN  38  -5.991   6.143  -8.541
  291    HA   ASN  38           HA       ASN  38  -4.995   4.585 -10.847
  292   1HB   ASN  38          HB2       ASN  38  -6.017   6.833 -11.191
  293   2HB   ASN  38          HB1       ASN  38  -4.729   7.546 -10.218
  294   1HD2  ASN  38          HD21      ASN  38  -4.479   4.921 -12.661
  295   2HD2  ASN  38          HD22      ASN  38  -3.401   5.756 -13.672
  296    H    LEU  39           HN       LEU  39  -2.976   3.705 -10.783
  297    HA   LEU  39           HA       LEU  39  -1.187   4.369  -8.577
  298   1HB   LEU  39          HB2       LEU  39  -0.896   2.491 -10.932
  299   2HB   LEU  39          HB1       LEU  39   0.324   2.682  -9.679
  300    HG   LEU  39           HG       LEU  39  -1.159   0.727  -9.274
  301   1HD1  LEU  39          HD11      LEU  39  -0.138   2.287  -7.415
  302   2HD1  LEU  39          HD12      LEU  39  -1.292   1.034  -6.977
  303   3HD1  LEU  39          HD13      LEU  39  -1.824   2.708  -7.111
  304   1HD2  LEU  39          HD21      LEU  39  -3.396   2.648  -8.641
  305   2HD2  LEU  39          HD22      LEU  39  -3.470   0.911  -8.929
  306   3HD2  LEU  39          HD23      LEU  39  -3.198   2.011 -10.276
  307    H    THR  40           HN       THR  40   0.109   6.153  -8.681
  308    HA   THR  40           HA       THR  40   1.589   6.681 -11.211
  309    HB   THR  40           HB       THR  40   1.077   9.123 -11.008
  310    HG1  THR  40           HG1      THR  40  -0.122   8.201  -8.763
  311   1HG2  THR  40          HG21      THR  40  -0.177   7.647 -12.564
  312   2HG2  THR  40          HG22      THR  40  -1.169   8.976 -11.963
  313   3HG2  THR  40          HG23      THR  40  -1.367   7.355 -11.297
  314    H    ALA  41           HN       ALA  41   1.511   9.177  -8.828
  315    HA   ALA  41           HA       ALA  41   4.173   8.259  -7.761
  316   1HB   ALA  41          HB1       ALA  41   3.197  11.105  -8.139
  317   2HB   ALA  41          HB2       ALA  41   4.281  10.265  -9.247
  318   3HB   ALA  41          HB3       ALA  41   4.799  10.606  -7.595
  319    H    GLY  42           HN       GLY  42   1.363  10.343  -6.926
  320   1HA   GLY  42          HA2       GLY  42   2.000  10.311  -4.095
  321   2HA   GLY  42          HA1       GLY  42   0.482  10.870  -4.801
  322    H    MET  43           HN       MET  43   1.757   7.682  -5.449
  323    HA   MET  43           HA       MET  43  -0.656   6.344  -4.792
  324   1HB   MET  43          HB2       MET  43   2.176   5.288  -4.935
  325   2HB   MET  43          HB1       MET  43   0.721   4.288  -4.931
  326   1HG   MET  43          HG2       MET  43  -0.061   5.466  -6.962
  327   2HG   MET  43          HG1       MET  43   1.432   6.392  -6.990
  328   1HE   MET  43          HE1       MET  43   4.199   4.157  -7.772
  329   2HE   MET  43          HE2       MET  43   3.684   3.892  -6.109
  330   3HE   MET  43          HE3       MET  43   3.589   5.507  -6.805
  331    H    TYR  44           HN       TYR  44   2.302   6.862  -2.887
  332    HA   TYR  44           HA       TYR  44   1.633   5.175  -0.709
  333   1HB   TYR  44          HB2       TYR  44   3.203   7.769  -0.781
  334   2HB   TYR  44          HB1       TYR  44   3.154   6.684   0.610
  335    HD1  TYR  44           HD1      TYR  44   4.228   4.489   0.541
  336    HD2  TYR  44           HD2      TYR  44   4.319   7.115  -2.857
  337    HE1  TYR  44           HE1      TYR  44   5.990   3.086  -0.496
  338    HE2  TYR  44           HE2      TYR  44   6.082   5.712  -3.894
  339    HH   TYR  44           HH       TYR  44   7.579   4.054  -3.504
  340    H    CYS  45           HN       CYS  45   0.883   8.602  -1.294
  341    HA   CYS  45           HA       CYS  45  -0.560   8.992   1.178
  342   1HB   CYS  45          HB2       CYS  45  -1.088  10.528  -1.365
  343   2HB   CYS  45          HB1       CYS  45  -1.104  11.106   0.303
  344    H    ALA  46           HN       ALA  46  -1.698   8.576  -2.192
  345    HA   ALA  46           HA       ALA  46  -4.464   8.304  -1.538
  346   1HB   ALA  46          HB1       ALA  46  -3.769   8.809  -3.807
  347   2HB   ALA  46          HB2       ALA  46  -4.638   7.274  -3.818
  348   3HB   ALA  46          HB3       ALA  46  -2.878   7.290  -3.912
  349    H    ALA  47           HN       ALA  47  -1.930   5.832  -2.022
  350    HA   ALA  47           HA       ALA  47  -3.669   3.586  -1.752
  351   1HB   ALA  47          HB1       ALA  47  -0.741   3.766  -0.982
  352   2HB   ALA  47          HB2       ALA  47  -1.338   3.431  -2.609
  353   3HB   ALA  47          HB3       ALA  47  -1.642   2.287  -1.302
  354    H    LEU  48           HN       LEU  48  -1.861   5.459   0.661
  355    HA   LEU  48           HA       LEU  48  -2.371   3.769   2.873
  356   1HB   LEU  48          HB2       LEU  48  -0.740   5.604   2.941
  357   2HB   LEU  48          HB1       LEU  48  -2.044   6.782   2.823
  358    HG   LEU  48           HG       LEU  48  -2.970   5.977   4.971
  359   1HD1  LEU  48          HD11      LEU  48  -1.254   4.470   6.298
  360   2HD1  LEU  48          HD12      LEU  48  -0.738   3.978   4.685
  361   3HD1  LEU  48          HD13      LEU  48  -2.407   3.724   5.195
  362   1HD2  LEU  48          HD21      LEU  48  -1.239   6.907   6.400
  363   2HD2  LEU  48          HD22      LEU  48  -1.226   7.791   4.873
  364   3HD2  LEU  48          HD23      LEU  48  -0.003   6.562   5.191
  365    H    GLU  49           HN       GLU  49  -4.288   6.627   1.781
  366    HA   GLU  49           HA       GLU  49  -6.260   6.412   3.819
  367   1HB   GLU  49          HB2       GLU  49  -7.797   7.552   2.113
  368   2HB   GLU  49          HB1       GLU  49  -6.306   8.400   2.518
  369   1HG   GLU  49          HG2       GLU  49  -5.229   7.488   0.510
  370   2HG   GLU  49          HG1       GLU  49  -6.713   6.624   0.099
  371    H    SER  50           HN       SER  50  -5.964   4.693   0.734
  372    HA   SER  50           HA       SER  50  -8.578   3.526   0.759
  373   1HB   SER  50          HB2       SER  50  -7.738   1.987  -0.863
  374   2HB   SER  50          HB1       SER  50  -6.851   3.483  -1.138
  375    HG   SER  50           HG       SER  50  -6.008   1.152   0.239
  376    H    LEU  51           HN       LEU  51  -5.508   2.529   2.227
  377    HA   LEU  51           HA       LEU  51  -6.492   0.018   3.254
  378   1HB   LEU  51          HB2       LEU  51  -4.166   1.747   4.147
  379   2HB   LEU  51          HB1       LEU  51  -4.451   0.091   4.680
  380    HG   LEU  51           HG       LEU  51  -4.056   0.935   1.792
  381   1HD1  LEU  51          HD11      LEU  51  -1.874  -0.338   2.091
  382   2HD1  LEU  51          HD12      LEU  51  -2.181  -0.294   3.826
  383   3HD1  LEU  51          HD13      LEU  51  -1.965   1.210   2.930
  384   1HD2  LEU  51          HD21      LEU  51  -3.618  -1.699   1.738
  385   2HD2  LEU  51          HD22      LEU  51  -5.252  -1.057   1.618
  386   3HD2  LEU  51          HD23      LEU  51  -4.661  -1.678   3.161
  387    H    ILE  52           HN       ILE  52  -6.451   3.319   4.512
  388    HA   ILE  52           HA       ILE  52  -7.009   2.773   7.232
  389    HB   ILE  52           HB       ILE  52  -7.926   5.068   5.476
  390   1HG1  ILE  52          HG12      ILE  52  -5.498   4.911   5.710
  391   2HG1  ILE  52          HG11      ILE  52  -6.100   6.290   6.613
  392   1HG2  ILE  52          HG21      ILE  52  -9.419   5.031   7.351
  393   2HG2  ILE  52          HG22      ILE  52  -8.218   6.279   7.675
  394   3HG2  ILE  52          HG23      ILE  52  -8.097   4.711   8.473
  395   1HD1  ILE  52          HD11      ILE  52  -6.163   4.483   8.600
  396   2HD1  ILE  52          HD12      ILE  52  -4.701   5.383   8.209
  397   3HD1  ILE  52          HD13      ILE  52  -4.908   3.739   7.610
  398    H    ASN  53           HN       ASN  53  -9.023   2.344   4.445
  399    HA   ASN  53           HA       ASN  53 -11.525   2.325   5.988
  400   1HB   ASN  53          HB2       ASN  53 -10.844   1.553   3.139
  401   2HB   ASN  53          HB1       ASN  53 -12.464   1.400   3.817
  402   1HD2  ASN  53          HD21      ASN  53 -12.519   3.772   5.413
  403   2HD2  ASN  53          HD22      ASN  53 -12.479   5.115   4.377
  404    H    VAL  54           HN       VAL  54  -8.953   0.188   5.497
  405    HA   VAL  54           HA       VAL  54 -10.588  -2.268   5.732
  406    HB   VAL  54           HB       VAL  54  -7.573  -1.920   5.719
  407   1HG1  VAL  54          HG11      VAL  54  -8.261  -4.053   6.674
  408   2HG1  VAL  54          HG12      VAL  54  -7.648  -4.333   5.044
  409   3HG1  VAL  54          HG13      VAL  54  -9.385  -4.324   5.343
  410   1HG2  VAL  54          HG21      VAL  54  -7.805  -2.665   3.329
  411   2HG2  VAL  54          HG22      VAL  54  -8.517  -1.081   3.638
  412   3HG2  VAL  54          HG23      VAL  54  -9.554  -2.499   3.492
  413    H    SER  55           HN       SER  55 -11.183  -3.006   7.696
  414    HA   SER  55           HA       SER  55  -9.457  -2.390  10.077
  415   1HB   SER  55          HB2       SER  55 -12.487  -2.413   9.958
  416   2HB   SER  55          HB1       SER  55 -11.522  -2.164  11.409
  417    HG   SER  55           HG       SER  55 -12.278  -0.381   9.592
  418    H    GLY  56           HN       GLY  56  -9.411  -4.038  11.680
  419   1HA   GLY  56          HA2       GLY  56  -9.891  -6.188  12.597
  420   2HA   GLY  56          HA1       GLY  56 -10.915  -6.535  11.202
  421    H    CYS  57           HN       CYS  57  -7.701  -5.253  10.726
  422    HA   CYS  57           HA       CYS  57  -6.609  -7.962  10.170
  423   1HB   CYS  57          HB2       CYS  57  -6.865  -5.740   8.127
  424   2HB   CYS  57          HB1       CYS  57  -5.784  -7.120   7.930
  425    H    SER  58           HN       SER  58  -5.115  -7.622  11.845
  426    HA   SER  58           HA       SER  58  -3.509  -5.232  12.082
  427   1HB   SER  58          HB2       SER  58  -3.887  -6.742  13.988
  428   2HB   SER  58          HB1       SER  58  -3.042  -8.037  13.146
  429    HG   SER  58           HG       SER  58  -1.809  -5.538  13.539
  430    H    ALA  59           HN       ALA  59  -3.044  -8.375  10.543
  431    HA   ALA  59           HA       ALA  59  -0.358  -8.410   9.934
  432   1HB   ALA  59          HB1       ALA  59  -2.557  -9.065   7.960
  433   2HB   ALA  59          HB2       ALA  59  -2.038 -10.130   9.267
  434   3HB   ALA  59          HB3       ALA  59  -0.918  -9.718   7.967
  435    H    ILE  60           HN       ILE  60  -2.492  -5.912   8.946
  436    HA   ILE  60           HA       ILE  60  -0.498  -5.001   6.877
  437    HB   ILE  60           HB       ILE  60  -2.411  -3.789   5.820
  438   1HG1  ILE  60          HG12      ILE  60  -4.138  -5.497   7.623
  439   2HG1  ILE  60          HG11      ILE  60  -3.803  -3.801   7.960
  440   1HG2  ILE  60          HG21      ILE  60  -1.660  -6.026   5.032
  441   2HG2  ILE  60          HG22      ILE  60  -3.389  -5.781   4.785
  442   3HG2  ILE  60          HG23      ILE  60  -2.823  -6.780   6.123
  443   1HD1  ILE  60          HD11      ILE  60  -4.717  -3.218   5.712
  444   2HD1  ILE  60          HD12      ILE  60  -5.917  -3.976   6.758
  445   3HD1  ILE  60          HD13      ILE  60  -5.144  -4.913   5.479
  446    H    GLU  61           HN       GLU  61  -1.788  -4.322   9.929
  447    HA   GLU  61           HA       GLU  61  -2.012  -1.483   9.824
  448   1HB   GLU  61          HB2       GLU  61  -1.906  -1.513  12.197
  449   2HB   GLU  61          HB1       GLU  61  -2.632  -3.057  11.767
  450   1HG   GLU  61          HG2       GLU  61  -0.308  -4.073  11.900
  451   2HG   GLU  61          HG1       GLU  61   0.245  -2.542  12.577
  452    H    LYS  62           HN       LYS  62   0.787  -3.598  10.313
  453    HA   LYS  62           HA       LYS  62   2.704  -1.545  10.841
  454   1HB   LYS  62          HB2       LYS  62   2.983  -4.281   9.562
  455   2HB   LYS  62          HB1       LYS  62   4.358  -3.251   9.966
  456   1HG   LYS  62          HG2       LYS  62   3.639  -3.211  12.327
  457   2HG   LYS  62          HG1       LYS  62   2.266  -4.243  11.925
  458   1HD   LYS  62          HD2       LYS  62   3.811  -6.012  11.169
  459   2HD   LYS  62          HD1       LYS  62   5.187  -4.984  11.574
  460   1HE   LYS  62          HE2       LYS  62   4.760  -6.568  13.399
  461   2HE   LYS  62          HE1       LYS  62   4.423  -4.922  13.935
  462   1HZ   LYS  62          HZ1       LYS  62   2.356  -6.779  12.894
  463   2HZ   LYS  62          HZ2       LYS  62   2.104  -5.263  13.621
  464   3HZ   LYS  62          HZ3       LYS  62   2.689  -6.565  14.544
  465    H    THR  63           HN       THR  63   1.495  -2.988   7.841
  466    HA   THR  63           HA       THR  63   3.270  -1.704   6.039
  467    HB   THR  63           HB       THR  63   0.370  -2.473   5.614
  468    HG1  THR  63           HG1      THR  63   1.105  -4.429   5.296
  469   1HG2  THR  63          HG21      THR  63   2.625  -1.915   3.671
  470   2HG2  THR  63          HG22      THR  63   1.148  -0.971   3.862
  471   3HG2  THR  63          HG23      THR  63   1.069  -2.611   3.221
  472    H    GLN  64           HN       GLN  64   0.187  -0.611   7.443
  473    HA   GLN  64           HA       GLN  64  -0.067   1.785   5.926
  474   1HB   GLN  64          HB2       GLN  64  -0.940   1.110   8.746
  475   2HB   GLN  64          HB1       GLN  64  -1.384   2.609   7.929
  476   1HG   GLN  64          HG2       GLN  64  -2.539   1.395   6.188
  477   2HG   GLN  64          HG1       GLN  64  -1.947  -0.149   6.805
  478   1HE2  GLN  64          HE21      GLN  64  -4.748   0.300   6.574
  479   2HE2  GLN  64          HE22      GLN  64  -5.417   0.412   8.131
  480    H    ARG  65           HN       ARG  65   1.662   1.131   8.968
  481    HA   ARG  65           HA       ARG  65   2.463   3.838   9.447
  482   1HB   ARG  65          HB2       ARG  65   3.658   1.187  10.291
  483   2HB   ARG  65          HB1       ARG  65   4.258   2.744  10.864
  484   1HG   ARG  65          HG2       ARG  65   2.021   3.287  11.752
  485   2HG   ARG  65          HG1       ARG  65   1.415   1.733  11.180
  486   1HD   ARG  65          HD2       ARG  65   1.976   1.599  13.569
  487   2HD   ARG  65          HD1       ARG  65   3.051   0.569  12.628
  488    HE   ARG  65           HE       ARG  65   4.398   3.000  12.817
  489   1HH1  ARG  65          HH21      ARG  65   2.976   0.714  14.976
  490   2HH1  ARG  65          HH22      ARG  65   4.079   1.052  16.268
  491   1HH2  ARG  65          HH11      ARG  65   5.840   3.455  14.497
  492   2HH2  ARG  65          HH12      ARG  65   5.697   2.602  15.998
  493    H    MET  66           HN       MET  66   4.132   1.154   7.763
  494    HA   MET  66           HA       MET  66   6.496   2.664   7.180
  495   1HB   MET  66          HB2       MET  66   5.291   0.227   5.852
  496   2HB   MET  66          HB1       MET  66   6.851   0.910   5.384
  497   1HG   MET  66          HG2       MET  66   7.625   0.678   7.741
  498   2HG   MET  66          HG1       MET  66   6.095  -0.095   8.147
  499   1HE   MET  66          HE1       MET  66   6.062  -3.443   6.604
  500   2HE   MET  66          HE2       MET  66   5.521  -2.129   5.563
  501   3HE   MET  66          HE3       MET  66   5.197  -2.063   7.294
  502    H    LEU  67           HN       LEU  67   3.471   2.219   5.357
  503    HA   LEU  67           HA       LEU  67   4.295   3.529   2.964
  504   1HB   LEU  67          HB2       LEU  67   1.590   3.337   4.303
  505   2HB   LEU  67          HB1       LEU  67   1.821   4.040   2.706
  506    HG   LEU  67           HG       LEU  67   2.721   1.234   3.431
  507   1HD1  LEU  67          HD11      LEU  67   0.342   1.221   3.687
  508   2HD1  LEU  67          HD12      LEU  67   0.659   0.567   2.080
  509   3HD1  LEU  67          HD13      LEU  67   0.114   2.234   2.263
  510   1HD2  LEU  67          HD21      LEU  67   3.871   1.838   1.471
  511   2HD2  LEU  67          HD22      LEU  67   2.553   2.851   0.884
  512   3HD2  LEU  67          HD23      LEU  67   2.417   1.096   0.813
  513    H    SER  68           HN       SER  68   2.968   4.825   5.989
  514    HA   SER  68           HA       SER  68   2.651   7.517   5.134
  515   1HB   SER  68          HB2       SER  68   3.348   6.381   7.854
  516   2HB   SER  68          HB1       SER  68   2.950   8.074   7.576
  517    HG   SER  68           HG       SER  68   0.918   7.494   6.971
  518    H    GLY  69           HN       GLY  69   5.482   5.788   6.404
  519   1HA   GLY  69          HA2       GLY  69   7.272   7.896   6.778
  520   2HA   GLY  69          HA1       GLY  69   7.766   6.318   6.165
  521    H    PHE  70           HN       PHE  70   5.936   6.710   3.775
  522    HA   PHE  70           HA       PHE  70   7.881   8.282   2.162
  523   1HB   PHE  70          HB2       PHE  70   5.620   6.400   1.439
  524   2HB   PHE  70          HB1       PHE  70   6.519   7.328   0.239
  525    HD1  PHE  70           HD1      PHE  70   8.841   6.839  -0.260
  526    HD2  PHE  70           HD2      PHE  70   6.707   4.607   2.722
  527    HE1  PHE  70           HE1      PHE  70  10.639   5.140  -0.253
  528    HE2  PHE  70           HE2      PHE  70   8.505   2.901   2.734
  529    HZ   PHE  70           HZ       PHE  70  10.474   3.165   1.246
  530    H    CYS  71           HN       CYS  71   4.708   8.504   3.505
  531    HA   CYS  71           HA       CYS  71   4.339  11.138   2.164
  532   1HB   CYS  71          HB2       CYS  71   3.026   9.322   0.963
  533   2HB   CYS  71          HB1       CYS  71   2.068   9.171   2.437
  534    HA   PRO  72           HA       PRO  72   3.745  11.520   6.779
  535   1HB   PRO  72          HB2       PRO  72   3.785  14.396   6.009
  536   2HB   PRO  72          HB1       PRO  72   4.746  13.544   7.226
  537   1HG   PRO  72          HG2       PRO  72   5.793  14.409   4.868
  538   2HG   PRO  72          HG1       PRO  72   6.400  12.978   5.714
  539   1HD   PRO  72          HD2       PRO  72   4.757  13.135   3.232
  540   2HD   PRO  72          HD1       PRO  72   5.877  11.852   3.765
  541    H    HIS  73           HN       HIS  73   1.509  11.106   4.889
  542    HA   HIS  73           HA       HIS  73  -0.387  13.282   5.477
  543   1HB   HIS  73          HB2       HIS  73  -0.045  11.482   3.368
  544   2HB   HIS  73          HB1       HIS  73  -1.486  10.873   4.168
  545    HD1  HIS  73           HD1      HIS  73  -3.589  12.372   4.133
  546    HD2  HIS  73           HD2      HIS  73  -0.280  14.077   2.272
  547    HE1  HIS  73           HE1      HIS  73  -4.453  14.402   2.909
  548    H    LYS  74           HN       LYS  74  -1.282  13.246   7.488
  549    HA   LYS  74           HA       LYS  74  -1.875  10.699   8.845
  550   1HB   LYS  74          HB2       LYS  74  -2.431  13.594   9.567
  551   2HB   LYS  74          HB1       LYS  74  -2.914  12.230  10.572
  552   1HG   LYS  74          HG2       LYS  74  -0.562  11.516  10.745
  553   2HG   LYS  74          HG1       LYS  74  -0.073  12.883   9.740
  554   1HD   LYS  74          HD2       LYS  74  -0.999  14.446  11.404
  555   2HD   LYS  74          HD1       LYS  74  -1.495  13.086  12.411
  556   1HE   LYS  74          HE2       LYS  74   0.874  12.374  12.586
  557   2HE   LYS  74          HE1       LYS  74   1.351  13.776  11.626
  558   1HZ   LYS  74          HZ1       LYS  74   0.647  15.239  13.291
  559   2HZ   LYS  74          HZ2       LYS  74   1.470  14.009  14.128
  560   3HZ   LYS  74          HZ3       LYS  74  -0.229  14.041  14.112
  561    H    VAL  75           HN       VAL  75  -3.436   9.727   7.474
  562    HA   VAL  75           HA       VAL  75  -5.872  11.289   6.802
  563    HB   VAL  75           HB       VAL  75  -6.400   9.058   5.574
  564   1HG1  VAL  75          HG11      VAL  75  -4.800   9.696   3.727
  565   2HG1  VAL  75          HG12      VAL  75  -4.067  10.841   4.845
  566   3HG1  VAL  75          HG13      VAL  75  -5.749  11.042   4.358
  567   1HG2  VAL  75          HG21      VAL  75  -3.414   8.660   5.776
  568   2HG2  VAL  75          HG22      VAL  75  -4.655   7.521   5.258
  569   3HG2  VAL  75          HG23      VAL  75  -4.487   7.922   6.964
  570    H    SER  76           HN       SER  76  -7.662  11.118   8.021
  571    HA   SER  76           HA       SER  76  -7.820   8.971  10.080
  572   1HB   SER  76          HB2       SER  76  -9.619  10.359  11.046
  573   2HB   SER  76          HB1       SER  76  -8.150  11.304  10.823
  574    HG   SER  76           HG       SER  76 -10.532  11.299   9.306
  575    H    ALA  77           HN       ALA  77 -10.018   7.964  10.376
  576    HA   ALA  77           HA       ALA  77 -10.933   6.755   7.969
  577   1HB   ALA  77          HB1       ALA  77 -12.838   5.947   9.350
  578   2HB   ALA  77          HB2       ALA  77 -12.359   7.058  10.633
  579   3HB   ALA  77          HB3       ALA  77 -11.294   5.729  10.174
  580    H    GLY  78           HN       GLY  78 -11.598   9.843   9.310
  581   1HA   GLY  78          HA2       GLY  78 -14.144  10.126   7.784
  582   2HA   GLY  78          HA1       GLY  78 -13.529  11.265   8.981
  583    H    GLN  79           HN       GLN  79 -10.796  11.267   7.816
  584    HA   GLN  79           HA       GLN  79 -11.356  13.228   5.676
  585   1HB   GLN  79          HB2       GLN  79  -8.786  12.408   7.061
  586   2HB   GLN  79          HB1       GLN  79  -8.886  13.651   5.815
  587   1HG   GLN  79          HG2       GLN  79 -10.432  13.705   8.424
  588   2HG   GLN  79          HG1       GLN  79  -8.945  14.602   8.121
  589   1HE2  GLN  79          HE21      GLN  79 -12.193  15.086   8.220
  590   2HE2  GLN  79          HE22      GLN  79 -12.353  16.304   7.049
  591    H    PHE  80           HN       PHE  80 -11.329  12.676   3.593
  592    HA   PHE  80           HA       PHE  80  -9.592  10.405   2.684
  593   1HB   PHE  80          HB2       PHE  80 -12.434  11.049   1.848
  594   2HB   PHE  80          HB1       PHE  80 -11.390   9.894   1.029
  595    HD1  PHE  80           HD1      PHE  80 -13.617  10.437   3.812
  596    HD2  PHE  80           HD2      PHE  80 -10.454   7.925   2.348
  597    HE1  PHE  80           HE1      PHE  80 -14.252   8.686   5.447
  598    HE2  PHE  80           HE2      PHE  80 -11.084   6.177   3.987
  599    HZ   PHE  80           HZ       PHE  80 -12.985   6.555   5.537
  600    H    SER  81           HN       SER  81  -8.588  10.771   0.653
  601    HA   SER  81           HA       SER  81  -8.991  13.519  -0.505
  602   1HB   SER  81          HB2       SER  81  -6.408  11.957  -0.502
  603   2HB   SER  81          HB1       SER  81  -6.645  13.646  -0.935
  604    HG   SER  81           HG       SER  81  -7.446  13.856   1.310
  605    H    SER  82           HN       SER  82  -8.030  10.152  -1.317
  606    HA   SER  82           HA       SER  82  -8.388  10.806  -4.199
  607   1HB   SER  82          HB2       SER  82  -6.360   9.596  -3.514
  608   2HB   SER  82          HB1       SER  82  -7.353   8.291  -2.872
  609    HG   SER  82           HG       SER  82  -7.859   7.681  -4.862
  610    H    LEU  83           HN       LEU  83 -10.434   9.686  -1.794
  611    HA   LEU  83           HA       LEU  83 -11.776   7.645  -3.474
  612   1HB   LEU  83          HB2       LEU  83 -12.272   8.768  -0.719
  613   2HB   LEU  83          HB1       LEU  83 -13.496   7.796  -1.520
  614    HG   LEU  83           HG       LEU  83 -11.749   6.001  -1.840
  615   1HD1  LEU  83          HD11      LEU  83  -9.783   6.196  -0.236
  616   2HD1  LEU  83          HD12      LEU  83 -10.188   7.904  -0.075
  617   3HD1  LEU  83          HD13      LEU  83  -9.711   7.254  -1.644
  618   1HD2  LEU  83          HD21      LEU  83 -12.425   6.907   0.974
  619   2HD2  LEU  83          HD22      LEU  83 -11.788   5.311   0.576
  620   3HD2  LEU  83          HD23      LEU  83 -13.366   5.809  -0.035
  621    H    HIS  84           HN       HIS  84 -11.560  10.580  -4.262
  622    HA   HIS  84           HA       HIS  84 -14.261  11.642  -4.070
  623   1HB   HIS  84          HB2       HIS  84 -12.063  12.418  -6.009
  624   2HB   HIS  84          HB1       HIS  84 -13.481  13.378  -5.586
  625    HD1  HIS  84           HD1      HIS  84 -12.783  12.044  -2.484
  626    HD2  HIS  84           HD2      HIS  84 -10.742  14.845  -4.800
  627    HE1  HIS  84           HE1      HIS  84 -11.288  13.332  -0.900
  628    H    VAL  85           HN       VAL  85 -12.448   9.775  -6.462
  629    HA   VAL  85           HA       VAL  85 -14.514   9.973  -8.500
  630    HB   VAL  85           HB       VAL  85 -13.233   8.188  -9.640
  631   1HG1  VAL  85          HG11      VAL  85 -12.470  10.576  -9.729
  632   2HG1  VAL  85          HG12      VAL  85 -11.157   9.416  -9.926
  633   3HG1  VAL  85          HG13      VAL  85 -11.384  10.237  -8.381
  634   1HG2  VAL  85          HG21      VAL  85 -12.624   6.809  -7.746
  635   2HG2  VAL  85          HG22      VAL  85 -11.718   8.136  -7.015
  636   3HG2  VAL  85          HG23      VAL  85 -11.133   7.380  -8.497
  637    H    ARG  86           HN       ARG  86 -16.166   8.486  -8.925
  638    HA   ARG  86           HA       ARG  86 -16.859   6.676  -6.686
  639   1HB   ARG  86          HB2       ARG  86 -18.387   7.237  -9.250
  640   2HB   ARG  86          HB1       ARG  86 -19.014   6.457  -7.803
  641   1HG   ARG  86          HG2       ARG  86 -17.894   9.265  -7.744
  642   2HG   ARG  86          HG1       ARG  86 -19.577   8.953  -8.129
  643   1HD   ARG  86          HD2       ARG  86 -18.134   8.243  -5.565
  644   2HD   ARG  86          HD1       ARG  86 -19.405   9.441  -5.751
  645    HE   ARG  86           HE       ARG  86 -19.755   6.630  -5.260
  646   1HH1  ARG  86          HH21      ARG  86 -21.047   9.186  -7.193
  647   2HH1  ARG  86          HH22      ARG  86 -22.501   8.325  -7.570
  648   1HH2  ARG  86          HH11      ARG  86 -21.645   5.522  -5.727
  649   2HH2  ARG  86          HH12      ARG  86 -22.843   6.263  -6.737
  650    H    ASP  87           HN       ASP  87 -14.708   5.556  -7.596
  651    HA   ASP  87           HA       ASP  87 -15.172   3.807  -9.903
  652   1HB   ASP  87          HB2       ASP  87 -12.930   3.977  -7.865
  653   2HB   ASP  87          HB1       ASP  87 -12.956   2.809  -9.187
  654    H    THR  88           HN       THR  88 -14.615   1.352  -9.435
  655    HA   THR  88           HA       THR  88 -16.562   0.464  -7.387
  656    HB   THR  88           HB       THR  88 -16.460  -1.678  -8.487
  657    HG1  THR  88           HG1      THR  88 -14.853  -1.659 -10.369
  658   1HG2  THR  88          HG21      THR  88 -17.187  -1.098 -10.676
  659   2HG2  THR  88          HG22      THR  88 -16.158   0.334 -10.719
  660   3HG2  THR  88          HG23      THR  88 -17.579   0.301  -9.676
  661    H    LYS  89           HN       LYS  89 -15.943  -1.300  -5.890
  662    HA   LYS  89           HA       LYS  89 -13.260  -0.829  -4.769
  663   1HB   LYS  89          HB2       LYS  89 -15.569  -2.573  -3.867
  664   2HB   LYS  89          HB1       LYS  89 -14.051  -2.409  -2.989
  665   1HG   LYS  89          HG2       LYS  89 -14.430   0.015  -2.763
  666   2HG   LYS  89          HG1       LYS  89 -15.954  -0.144  -3.642
  667   1HD   LYS  89          HD2       LYS  89 -16.796  -1.688  -1.909
  668   2HD   LYS  89          HD1       LYS  89 -15.277  -1.525  -1.028
  669   1HE   LYS  89          HE2       LYS  89 -15.677   0.823  -0.635
  670   2HE   LYS  89          HE1       LYS  89 -17.087   0.810  -1.695
  671   1HZ   LYS  89          HZ1       LYS  89 -18.307   0.257   0.050
  672   2HZ   LYS  89          HZ2       LYS  89 -16.932   0.153   1.044
  673   3HZ   LYS  89          HZ3       LYS  89 -17.459  -1.207   0.172
  674    H    ILE  90           HN       ILE  90 -11.790  -2.620  -4.308
  675    HA   ILE  90           HA       ILE  90 -12.168  -5.038  -6.035
  676    HB   ILE  90           HB       ILE  90  -9.782  -4.884  -6.685
  677   1HG1  ILE  90          HG12      ILE  90  -9.855  -2.138  -5.387
  678   2HG1  ILE  90          HG11      ILE  90  -9.082  -3.541  -4.652
  679   1HG2  ILE  90          HG21      ILE  90 -11.503  -3.916  -8.146
  680   2HG2  ILE  90          HG22      ILE  90 -10.035  -2.940  -8.207
  681   3HG2  ILE  90          HG23      ILE  90 -11.419  -2.394  -7.259
  682   1HD1  ILE  90          HD11      ILE  90  -7.506  -3.726  -6.454
  683   2HD1  ILE  90          HD12      ILE  90  -7.522  -2.033  -5.961
  684   3HD1  ILE  90          HD13      ILE  90  -8.376  -2.534  -7.418
  685    H    GLU  91           HN       GLU  91 -10.824  -6.883  -5.302
  686    HA   GLU  91           HA       GLU  91 -10.924  -7.191  -2.445
  687   1HB   GLU  91          HB2       GLU  91  -9.509  -8.858  -4.549
  688   2HB   GLU  91          HB1       GLU  91  -9.732  -9.339  -2.870
  689   1HG   GLU  91          HG2       GLU  91 -11.538 -10.376  -3.975
  690   2HG   GLU  91          HG1       GLU  91 -12.259  -8.920  -3.290
  691    H    VAL  92           HN       VAL  92  -9.231  -7.229  -0.927
  692    HA   VAL  92           HA       VAL  92  -7.117  -5.375  -1.280
  693    HB   VAL  92           HB       VAL  92  -7.500  -7.633   0.700
  694   1HG1  VAL  92          HG11      VAL  92  -5.143  -7.305   0.695
  695   2HG1  VAL  92          HG12      VAL  92  -5.731  -6.309   2.026
  696   3HG1  VAL  92          HG13      VAL  92  -5.306  -5.561   0.486
  697   1HG2  VAL  92          HG21      VAL  92  -8.281  -5.934   2.164
  698   2HG2  VAL  92          HG22      VAL  92  -9.016  -5.535   0.613
  699   3HG2  VAL  92          HG23      VAL  92  -7.600  -4.646   1.170
  700    H    ALA  93           HN       ALA  93  -7.147  -8.919  -1.611
  701    HA   ALA  93           HA       ALA  93  -4.396  -9.387  -1.936
  702   1HB   ALA  93          HB1       ALA  93  -6.686 -10.678  -3.448
  703   2HB   ALA  93          HB2       ALA  93  -6.064 -11.195  -1.881
  704   3HB   ALA  93          HB3       ALA  93  -5.052 -11.332  -3.321
  705    H    GLN  94           HN       GLN  94  -6.750  -8.212  -4.321
  706    HA   GLN  94           HA       GLN  94  -4.836  -8.174  -6.513
  707   1HB   GLN  94          HB2       GLN  94  -7.480  -6.721  -6.158
  708   2HB   GLN  94          HB1       GLN  94  -6.585  -6.848  -7.672
  709   1HG   GLN  94          HG2       GLN  94  -6.851  -9.255  -7.698
  710   2HG   GLN  94          HG1       GLN  94  -7.578  -9.232  -6.090
  711   1HE2  GLN  94          HE21      GLN  94  -9.224 -10.392  -7.861
  712   2HE2  GLN  94          HE22      GLN  94 -10.450  -9.346  -8.392
  713    H    PHE  95           HN       PHE  95  -6.070  -5.859  -4.163
  714    HA   PHE  95           HA       PHE  95  -4.932  -3.485  -5.217
  715   1HB   PHE  95          HB2       PHE  95  -6.580  -3.540  -3.376
  716   2HB   PHE  95          HB1       PHE  95  -5.372  -4.279  -2.328
  717    HD1  PHE  95           HD1      PHE  95  -6.493  -1.190  -3.931
  718    HD2  PHE  95           HD2      PHE  95  -3.388  -3.014  -1.592
  719    HE1  PHE  95           HE1      PHE  95  -5.630   1.053  -3.328
  720    HE2  PHE  95           HE2      PHE  95  -2.523  -0.776  -0.988
  721    HZ   PHE  95           HZ       PHE  95  -3.648   1.258  -1.855
  722    H    VAL  96           HN       VAL  96  -3.602  -5.781  -2.817
  723    HA   VAL  96           HA       VAL  96  -1.134  -4.396  -2.448
  724    HB   VAL  96           HB       VAL  96  -1.705  -7.363  -2.186
  725   1HG1  VAL  96          HG11      VAL  96   0.654  -7.093  -2.188
  726   2HG1  VAL  96          HG12      VAL  96   0.210  -7.122  -0.481
  727   3HG1  VAL  96          HG13      VAL  96   0.564  -5.587  -1.274
  728   1HG2  VAL  96          HG21      VAL  96  -3.170  -5.806  -0.838
  729   2HG2  VAL  96          HG22      VAL  96  -1.707  -5.199  -0.062
  730   3HG2  VAL  96          HG23      VAL  96  -2.175  -6.887   0.139
  731    H    LYS  97           HN       LYS  97  -1.944  -7.137  -4.628
  732    HA   LYS  97           HA       LYS  97   0.682  -7.374  -5.721
  733   1HB   LYS  97          HB2       LYS  97  -2.031  -8.073  -6.870
  734   2HB   LYS  97          HB1       LYS  97  -0.506  -8.477  -7.666
  735   1HG   LYS  97          HG2       LYS  97   0.220  -9.722  -5.667
  736   2HG   LYS  97          HG1       LYS  97  -1.298  -9.325  -4.863
  737   1HD   LYS  97          HD2       LYS  97  -2.543 -10.515  -6.640
  738   2HD   LYS  97          HD1       LYS  97  -1.017 -10.932  -7.420
  739   1HE   LYS  97          HE2       LYS  97  -0.321 -12.074  -5.286
  740   2HE   LYS  97          HE1       LYS  97  -1.947 -11.791  -4.666
  741   1HZ   LYS  97          HZ1       LYS  97  -1.796 -13.007  -7.295
  742   2HZ   LYS  97          HZ2       LYS  97  -2.825 -13.356  -5.989
  743   3HZ   LYS  97          HZ3       LYS  97  -1.243 -13.972  -6.015
  744    H    ASP  98           HN       ASP  98  -2.105  -5.402  -6.809
  745    HA   ASP  98           HA       ASP  98  -0.886  -4.419  -9.199
  746   1HB   ASP  98          HB2       ASP  98  -2.894  -3.153  -7.308
  747   2HB   ASP  98          HB1       ASP  98  -2.415  -2.416  -8.836
  748    H    LEU  99           HN       LEU  99  -0.832  -3.229  -5.868
  749    HA   LEU  99           HA       LEU  99   0.757  -0.908  -6.365
  750   1HB   LEU  99          HB2       LEU  99  -0.551  -1.243  -4.297
  751   2HB   LEU  99          HB1       LEU  99   0.495  -2.588  -3.851
  752    HG   LEU  99           HG       LEU  99   2.430  -1.058  -3.763
  753   1HD1  LEU  99          HD11      LEU  99   0.361   0.908  -4.736
  754   2HD1  LEU  99          HD12      LEU  99   2.029   0.692  -5.268
  755   3HD1  LEU  99          HD13      LEU  99   1.693   1.483  -3.732
  756   1HD2  LEU  99          HD21      LEU  99   1.706   0.205  -1.754
  757   2HD2  LEU  99          HD22      LEU  99   1.098  -1.450  -1.731
  758   3HD2  LEU  99          HD23      LEU  99   0.023  -0.123  -2.167
  759    H    LEU 100           HN       LEU 100   1.602  -4.264  -5.565
  760    HA   LEU 100           HA       LEU 100   4.345  -3.966  -5.057
  761   1HB   LEU 100          HB2       LEU 100   3.247  -6.094  -4.729
  762   2HB   LEU 100          HB1       LEU 100   2.868  -6.215  -6.444
  763    HG   LEU 100           HG       LEU 100   5.221  -6.443  -7.009
  764   1HD1  LEU 100          HD11      LEU 100   6.855  -6.647  -4.997
  765   2HD1  LEU 100          HD12      LEU 100   5.620  -5.772  -4.090
  766   3HD1  LEU 100          HD13      LEU 100   6.372  -5.028  -5.501
  767   1HD2  LEU 100          HD21      LEU 100   4.079  -8.493  -6.338
  768   2HD2  LEU 100          HD22      LEU 100   4.429  -8.165  -4.642
  769   3HD2  LEU 100          HD23      LEU 100   5.743  -8.538  -5.757
  770    H    LEU 101           HN       LEU 101   2.767  -4.367  -8.259
  771    HA   LEU 101           HA       LEU 101   5.194  -4.427  -9.757
  772   1HB   LEU 101          HB2       LEU 101   2.371  -3.612 -10.411
  773   2HB   LEU 101          HB1       LEU 101   3.641  -3.359 -11.600
  774    HG   LEU 101           HG       LEU 101   2.337  -5.558 -11.764
  775   1HD1  LEU 101          HD11      LEU 101   4.715  -5.050 -12.688
  776   2HD1  LEU 101          HD12      LEU 101   4.195  -6.728 -12.585
  777   3HD1  LEU 101          HD13      LEU 101   5.282  -6.072 -11.367
  778   1HD2  LEU 101          HD21      LEU 101   2.467  -5.897  -9.219
  779   2HD2  LEU 101          HD22      LEU 101   4.115  -6.453  -9.492
  780   3HD2  LEU 101          HD23      LEU 101   2.761  -7.307 -10.229
  781    H    HIS 102           HN       HIS 102   3.179  -1.635  -8.802
  782    HA   HIS 102           HA       HIS 102   4.850   0.297 -10.113
  783   1HB   HIS 102          HB2       HIS 102   2.777   0.474  -7.929
  784   2HB   HIS 102          HB1       HIS 102   3.706   1.896  -8.409
  785    HD1  HIS 102           HD1      HIS 102   3.281   2.878 -10.750
  786    HD2  HIS 102           HD2      HIS 102   0.995  -0.512  -9.948
  787    HE1  HIS 102           HE1      HIS 102   1.581   2.711 -12.616
  788    H    LEU 103           HN       LEU 103   4.901  -0.993  -6.786
  789    HA   LEU 103           HA       LEU 103   6.800   0.859  -5.771
  790   1HB   LEU 103          HB2       LEU 103   6.369  -2.062  -5.085
  791   2HB   LEU 103          HB1       LEU 103   7.389  -0.974  -4.147
  792    HG   LEU 103           HG       LEU 103   4.459  -0.456  -4.726
  793   1HD1  LEU 103          HD11      LEU 103   5.832  -1.815  -2.404
  794   2HD1  LEU 103          HD12      LEU 103   4.465  -2.392  -3.355
  795   3HD1  LEU 103          HD13      LEU 103   4.250  -1.056  -2.227
  796   1HD2  LEU 103          HD21      LEU 103   6.575   0.923  -3.086
  797   2HD2  LEU 103          HD22      LEU 103   4.894   1.019  -2.577
  798   3HD2  LEU 103          HD23      LEU 103   5.368   1.627  -4.159
  799    H    LYS 104           HN       LYS 104   7.400  -2.339  -7.296
  800    HA   LYS 104           HA       LYS 104  10.268  -2.007  -7.235
  801   1HB   LYS 104          HB2       LYS 104  10.320  -3.899  -8.821
  802   2HB   LYS 104          HB1       LYS 104   9.254  -4.229  -7.460
  803   1HG   LYS 104          HG2       LYS 104   7.294  -3.635  -8.820
  804   2HG   LYS 104          HG1       LYS 104   8.338  -3.219 -10.175
  805   1HD   LYS 104          HD2       LYS 104   7.707  -5.400 -10.728
  806   2HD   LYS 104          HD1       LYS 104   9.237  -5.674  -9.902
  807   1HE   LYS 104          HE2       LYS 104   7.600  -5.802  -7.761
  808   2HE   LYS 104          HE1       LYS 104   6.460  -6.309  -9.005
  809   1HZ   LYS 104          HZ1       LYS 104   8.212  -7.935  -7.794
  810   2HZ   LYS 104          HZ2       LYS 104   9.074  -7.521  -9.198
  811   3HZ   LYS 104          HZ3       LYS 104   7.533  -8.227  -9.320
  812    H    LYS 105           HN       LYS 105   7.775  -0.881  -9.381
  813    HA   LYS 105           HA       LYS 105   9.346  -0.490 -11.732
  814   1HB   LYS 105          HB2       LYS 105   6.871  -0.385 -11.665
  815   2HB   LYS 105          HB1       LYS 105   6.975   1.123 -10.758
  816   1HG   LYS 105          HG2       LYS 105   8.171   2.185 -12.627
  817   2HG   LYS 105          HG1       LYS 105   8.108   0.673 -13.535
  818   1HD   LYS 105          HD2       LYS 105   5.669   0.746 -13.565
  819   2HD   LYS 105          HD1       LYS 105   5.672   2.195 -12.558
  820   1HE   LYS 105          HE2       LYS 105   7.063   3.302 -14.391
  821   2HE   LYS 105          HE1       LYS 105   6.666   1.911 -15.401
  822   1HZ   LYS 105          HZ1       LYS 105   4.445   2.450 -15.429
  823   2HZ   LYS 105          HZ2       LYS 105   5.161   3.990 -15.456
  824   3HZ   LYS 105          HZ3       LYS 105   4.525   3.371 -14.008
  825    H    LEU 106           HN       LEU 106   8.575   1.848  -9.106
  826    HA   LEU 106           HA       LEU 106  10.142   3.966 -10.212
  827   1HB   LEU 106          HB2       LEU 106   9.228   3.348  -7.395
  828   2HB   LEU 106          HB1       LEU 106  10.228   4.752  -7.738
  829    HG   LEU 106           HG       LEU 106   7.654   5.067  -7.673
  830   1HD1  LEU 106          HD11      LEU 106   7.799   6.596  -9.775
  831   2HD1  LEU 106          HD12      LEU 106   9.481   6.083  -9.842
  832   3HD1  LEU 106          HD13      LEU 106   8.873   6.917  -8.417
  833   1HD2  LEU 106          HD21      LEU 106   7.867   4.009 -10.506
  834   2HD2  LEU 106          HD22      LEU 106   6.419   4.550  -9.666
  835   3HD2  LEU 106          HD23      LEU 106   7.223   3.070  -9.164
  836    H    PHE 107           HN       PHE 107  11.004   1.181  -8.272
  837    HA   PHE 107           HA       PHE 107  13.587   2.007  -7.401
  838   1HB   PHE 107          HB2       PHE 107  12.494  -0.066  -6.600
  839   2HB   PHE 107          HB1       PHE 107  12.678  -0.776  -8.201
  840    HD1  PHE 107           HD1      PHE 107  14.610   0.705  -5.371
  841    HD2  PHE 107           HD2      PHE 107  14.703  -1.835  -8.833
  842    HE1  PHE 107           HE1      PHE 107  16.915   0.008  -4.795
  843    HE2  PHE 107           HE2      PHE 107  17.010  -2.538  -8.252
  844    HZ   PHE 107           HZ       PHE 107  18.116  -1.617  -6.232
  845    H    ARG 108           HN       ARG 108  12.474   0.631 -10.451
  846    HA   ARG 108           HA       ARG 108  14.995   0.056 -11.614
  847   1HB   ARG 108          HB2       ARG 108  12.448   1.022 -12.951
  848   2HB   ARG 108          HB1       ARG 108  13.795   0.241 -13.775
  849   1HG   ARG 108          HG2       ARG 108  12.453  -1.125 -11.442
  850   2HG   ARG 108          HG1       ARG 108  11.732  -1.208 -13.047
  851   1HD   ARG 108          HD2       ARG 108  14.539  -2.097 -12.309
  852   2HD   ARG 108          HD1       ARG 108  13.177  -3.149 -12.685
  853    HE   ARG 108           HE       ARG 108  13.401  -1.533 -14.923
  854   1HH1  ARG 108          HH21      ARG 108  15.487  -3.576 -13.083
  855   2HH1  ARG 108          HH22      ARG 108  16.485  -3.994 -14.436
  856   1HH2  ARG 108          HH11      ARG 108  14.688  -2.072 -16.694
  857   2HH2  ARG 108          HH12      ARG 108  16.030  -3.145 -16.480
  858    H    GLU 109           HN       GLU 109  13.125   3.091 -11.546
  859    HA   GLU 109           HA       GLU 109  15.176   4.476 -13.146
  860   1HB   GLU 109          HB2       GLU 109  12.672   5.443 -11.738
  861   2HB   GLU 109          HB1       GLU 109  13.727   6.479 -12.702
  862   1HG   GLU 109          HG2       GLU 109  13.351   5.064 -14.672
  863   2HG   GLU 109          HG1       GLU 109  12.327   3.989 -13.717
  864    H    GLY 110           HN       GLY 110  14.566   3.827  -9.811
  865   1HA   GLY 110          HA2       GLY 110  15.891   4.383  -7.944
  866   2HA   GLY 110          HA1       GLY 110  16.982   5.242  -9.033
  867    H    ARG 111           HN       ARG 111  13.808   6.247  -9.552
  868    HA   ARG 111           HA       ARG 111  14.338   8.793  -8.105
  869   1HB   ARG 111          HB2       ARG 111  12.249   7.970 -10.150
  870   2HB   ARG 111          HB1       ARG 111  12.278   9.552  -9.370
  871   1HG   ARG 111          HG2       ARG 111  14.553   9.936 -10.232
  872   2HG   ARG 111          HG1       ARG 111  14.527   8.363 -11.022
  873   1HD   ARG 111          HD2       ARG 111  12.499   9.104 -12.293
  874   2HD   ARG 111          HD1       ARG 111  12.688  10.712 -11.605
  875    HE   ARG 111           HE       ARG 111  14.113   9.608 -13.860
  876   1HH1  ARG 111          HH21      ARG 111  14.612  11.527 -11.037
  877   2HH1  ARG 111          HH22      ARG 111  16.125  12.164 -11.589
  878   1HH2  ARG 111          HH11      ARG 111  16.070  10.430 -14.585
  879   2HH2  ARG 111          HH12      ARG 111  16.947  11.546 -13.592
  880    H    PHE 112           HN       PHE 112  13.868   8.272  -5.956
  881    HA   PHE 112           HA       PHE 112  11.318   6.924  -5.307
  882   1HB   PHE 112          HB2       PHE 112  13.487   7.973  -3.467
  883   2HB   PHE 112          HB1       PHE 112  12.187   6.853  -3.043
  884    HD1  PHE 112           HD1      PHE 112  12.100   4.583  -4.077
  885    HD2  PHE 112           HD2      PHE 112  15.435   7.223  -4.661
  886    HE1  PHE 112           HE1      PHE 112  13.466   2.687  -4.905
  887    HE2  PHE 112           HE2      PHE 112  16.796   5.321  -5.491
  888    HZ   PHE 112           HZ       PHE 112  15.809   3.052  -5.610
  889    H    ASN 113           HN       ASN 113   9.648   7.897  -4.133
  890    HA   ASN 113           HA       ASN 113   8.200   9.647  -3.584
  891   1HB   ASN 113          HB2       ASN 113  10.836  10.858  -2.696
  892   2HB   ASN 113          HB1       ASN 113   9.249  11.507  -2.283
  893   1HD2  ASN 113          HD21      ASN 113  11.534   9.986  -0.703
  894   2HD2  ASN 113          HD22      ASN 113  10.655   8.841   0.191