*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   15-OCT-09   2KPI              
*TITLE     SOLUTION NMR STRUCTURE OF STREPTOMYCES COELICOLOR SCO3027             
*TITLE    2 MODELED WITH ZN+2 BOUND, NORTHEAST STRUCTURAL GENOMICS               
*TITLE    3 CONSORTIUM TARGET RR58                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UNCHARACTERIZED PROTEIN SCO3027;                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: STREPTOMYCES COELICOLOR;                        
*SOURCE   3 ORGANISM_TAXID: 1902;                                                
*SOURCE   4 GENE: SCD84.08C, SCE34.08C, SCO3027;                                 
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) GOLD PMGK;                       
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: P15TV                                      
*KEYWDS    ZINC FINGER, PSI-2, NESG, ALL BETA, STRUCTURAL GENOMICS,              
*KEYWDS   2 PROTEIN STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS          
*KEYWDS   3 CONSORTIUM                                                           
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    T.A.RAMELOT, J.R.CORT, M.GARCIA, A.YEE, C.H.ARROWMITH,                
*AUTHOR   2 G.T.MONTELIONE, M.A.KENNEDY, NORTHEAST STRUCTURAL GENOMICS           
*AUTHOR   3 CONSORTIUM (NESG)                                                    
*REVDAT   1   02-FEB-10 2KPI    0                                                


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assign (resid   30  and name  HN )(resid   31  and name  HN  )  1.8 0.0 2.46
!nrassign (resid   30  and name  HN )(resid   36  and name  HN  )  1.8 0.0 4.25
assign (resid   31  and name  HA* )(resid   32  and name  HN  )  1.8 0.0 1.42
assign (resid   32  and name  HA )(resid   34  and name  HN  )  1.8 0.0 3.28
assign (resid   32  and name  HN )(resid   32  and name  HB*  )  1.8 0.0 1.82
assign (resid   32  and name  HN )(resid   32  and name  HG*  )  1.8 0.0 2.89
assign (resid   32  and name  HN )(resid   33  and name  HN  )  1.8 0.0 2.55
assign (resid   33  and name  HN )(resid   34  and name  HN  )  1.8 0.0 2.08
assign (resid   34  and name  HB1 )(resid   35  and name  HN  )  1.8 0.0 2.93
assign (resid   34  and name  HB2 )(resid   35  and name  HN  )  1.8 0.0 2.93
assign (resid   34  and name  HN )(resid   35  and name  HN  )  1.8 0.0 3.41
!nassign (resid   35  and name  HN )(resid   36  and name  HB*  )  1.8 0.0 4.14
!nassign (resid   35  and name  HN )(resid   36  and name  HD2*  )  1.8 0.0 3.52
assign (resid   35  and name  HN )(resid   36  and name  HN  )  1.8 0.0 2.64
assign (resid   36  and name  HA )(resid   36  and name  HD1*  )  1.8 0.0 3.24
assign (resid   36  and name  HA )(resid   36  and name  HD2*  )  1.8 0.0 1.81
assign (resid   36  and name  HA )(resid   37  and name  HN  )  1.8 0.0 1.63
assign (resid   36  and name  HA )(resid   54  and name  HA  )  1.8 0.0 2.88
assign (resid   36  and name  HA )(resid   55  and name  HD*  )  1.8 0.0 3.22
assign (resid   36  and name  HB* )(resid   36  and name  HD1*  )  1.8 0.0 2.2
assign (resid   36  and name  HB* )(resid   36  and name  HD2*  )  1.8 0.0 2.45
assign (resid   36  and name  HB* )(resid   52  and name  HB*  )  1.8 0.0 2.44
assign (resid   36  and name  HB1 )(resid   37  and name  HN  )  1.8 0.0 4.25
assign (resid   36  and name  HB2 )(resid   37  and name  HN  )  1.8 0.0 4.25
assign (resid   36  and name  HD1* )(resid   49  and name  HA  )  1.8 0.0 3.35
assign (resid   36  and name  HD1* )(resid   49  and name  HG1*  )  1.8 0.0 4.00
assign (resid   36  and name  HD1* )(resid   49  and name  HG2*  )  1.8 0.0 3.00
assign (resid   36  and name  HD2* )(resid   37  and name  HN  )  1.8 0.0 4.24
!nassign (resid   36  and name  HD2* )(resid   49  and name  HG1*  )  1.8 0.0 3.43
assign (resid   36  and name  HD2* )(resid   52  and name  HB*  )  1.8 0.0 2.9
assign (resid   36  and name  HD2* )(resid   54  and name  HA  )  1.8 0.0 2.53
assign (resid   36  and name  HD2* )(resid   54  and name  HD*  )  1.8 0.0 3.33
assign (resid   36  and name  HD2* )(resid   54  and name  HG*  )  1.8 0.0 2.58
assign (resid   36  and name  HD2* )(resid   55  and name  HD*  )  1.8 0.0 2.93
assign (resid   36  and name  HN )(resid   36  and name  HB*  )  1.8 0.0 1.98
assign (resid   36  and name  HN )(resid   36  and name  HD1*  )  1.8 0.0 3.15
assign (resid   36  and name  HN )(resid   36  and name  HD2*  )  1.8 0.0 3.3
assign (resid   36  and name  HN )(resid   36  and name  HG  )  1.8 0.0 2.02
assign (resid   36  and name  HN )(resid   37  and name  HN  )  1.8 0.0 3.3
assign (resid   37  and name  HA )(resid   38  and name  HD*  )  1.8 0.0 3.66
assign (resid   37  and name  HA )(resid   38  and name  HN  )  1.8 0.0 1.71
assign (resid   37  and name  HB* )(resid   53  and name  HB*  )  1.8 0.0 2.53
assign (resid   37  and name  HN )(resid   52  and name  HB*  )  1.8 0.0 3.69
assign (resid   37  and name  HN )(resid   53  and name  HN  )  1.8 0.0 2.8
!nassign (resid   37  and name  HN )(resid   54  and name  HA  )  1.8 0.0 5.04
assign (resid   38  and name  HA )(resid   39  and name  HD*  )  1.8 0.0 1.60
!nassign (resid   38  and name  HA )(resid   39  and name  HG*  )  1.8 0.0 3.5
assign (resid   38  and name  HA )(resid   52  and name  HA  )  1.8 0.0 2.81
assign (resid   38  and name  HA )(resid   52  and name  HB*  )  1.8 0.0 3.69
assign (resid   38  and name  HA )(resid   53  and name  HN  )  1.8 0.0 3.89
!olassign (resid   38  and name  HB* )(resid   39  and name  HD*  )  1.8 0.0 2.86
assign (resid   38  and name  HB* )(resid   47  and name  HA  )  1.8 0.0 3.28
assign (resid   38  and name  HB1 )(resid   47  and name  HD2*  )  1.8 0.0 3.03
assign (resid   38  and name  HB2 )(resid   47  and name  HD2*  )  1.8 0.0 3.03
assign (resid   38  and name  HD* )(resid   47  and name  HA  )  1.8 0.0 2.74
assign (resid   38  and name  HD* )(resid   47  and name  HD2*  )  1.8 0.0 3.39
assign (resid   38  and name  HE* )(resid   49  and name  HA  )  1.8 0.0 2.57
assign (resid   38  and name  HE* )(resid   52  and name  HB*  )  1.8 0.0 3.42
assign (resid   38  and name  HN )(resid   38  and name  HD*  )  1.8 0.0 2.52
assign (resid   39  and name  HA )(resid   40  and name  HN  )  1.8 0.0 1.65
assign (resid   39  and name  HD* )(resid   40  and name  HN  )  1.8 0.0 4.25
assign (resid   39  and name  HD* )(resid   46  and name  HB  )  1.8 0.0 4.05
assign (resid   39  and name  HD1 )(resid   52  and name  HA  )  1.8 0.0 3.17
assign (resid   39  and name  HD2 )(resid   52  and name  HA  )  1.8 0.0 3.17
assign (resid   40  and name  HA )(resid   40  and name  HG1*  )  1.8 0.0 2.14
assign (resid   40  and name  HA )(resid   40  and name  HG2*  )  1.8 0.0 2.26
assign (resid   40  and name  HA )(resid   41  and name  HN  )  1.8 0.0 1.79
assign (resid   40  and name  HA )(resid   45  and name  HA  )  1.8 0.0 1.8
assign (resid   40  and name  HA )(resid   46  and name  HG2*  )  1.8 0.0 3.26
assign (resid   40  and name  HA )(resid   46  and name  HN  )  1.8 0.0 3.06
!nrassign (resid   40  and name  HB )(resid   43  and name  HA*  )  1.8 0.0 4.1
assign (resid   40  and name  HG1* )(resid   41  and name  HN  )  1.8 0.0 2.67
assign (resid   40  and name  HG1* )(resid   43  and name  HA*  )  1.8 0.0 3.33
assign (resid   40  and name  HG1* )(resid   43  and name  HN  )  1.8 0.0 2.66
assign (resid   40  and name  HG1* )(resid   44  and name  HN  )  1.8 0.0 2.93
assign (resid   40  and name  HG1* )(resid   45  and name  HA  )  1.8 0.0 2.77
assign (resid   40  and name  HG1* )(resid   45  and name  HD*  )  1.8 0.0 3.25
assign (resid   40  and name  HG2* )(resid   41  and name  HN  )  1.8 0.0 3.38
assign (resid   40  and name  HG2* )(resid   45  and name  HA  )  1.8 0.0 2.19
assign (resid   40  and name  HG2* )(resid   45  and name  HB*  )  1.8 0.0 2.81
assign (resid   40  and name  HG2* )(resid   45  and name  HG*  )  1.8 0.0 3.26
assign (resid   40  and name  HG2* )(resid   46  and name  HN  )  1.8 0.0 3.32
assign (resid   40  and name  HN )(resid   40  and name  HB  )  1.8 0.0 2.18
assign (resid   40  and name  HN )(resid   40  and name  HG2*  )  1.8 0.0 2.59
assign (resid   41  and name  HA )(resid   41  and name  HG*  )  1.8 0.0 2.06
assign (resid   41  and name  HA )(resid   42  and name  HN  )  1.8 0.0 1.89
assign (resid   41  and name  HB* )(resid   46  and name  HG2*  )  1.8 0.0 2.75
assign (resid   41  and name  HG* )(resid   46  and name  HG2*  )  1.8 0.0 3.61
assign (resid   41  and name  HD* )(resid   46  and name  HG2*  )  1.8 0.0 3.00
assign (resid   41  and name  HN )(resid   41  and name  HG*  )  1.8 0.0 3.59
!nassign (resid   41  and name  HN )(resid   44  and name  HG2*  )  1.8 0.0 4.02
assign (resid   41  and name  HN )(resid   44  and name  HN  )  1.8 0.0 2.7
assign (resid   41  and name  HN )(resid   45  and name  HA  )  1.8 0.0 3.52
!nassign (resid   41  and name  HN )(resid   46  and name  HG2*  )  1.8 0.0 3.64
assign (resid   42  and name  HN )(resid   43  and name  HN  )  1.8 0.0 2.64
assign (resid   43  and name  HN )(resid   44  and name  HN  )  1.8 0.0 2.69
assign (resid   44  and name  HA )(resid   44  and name  HD1*  )  1.8 0.0 2.86
assign (resid   44  and name  HA )(resid   45  and name  HD1  )  1.8 0.0 1.65
assign (resid   44  and name  HA )(resid   45  and name  HD2  )  1.8 0.0 1.65
assign (resid   44  and name  HA )(resid   45  and name  HG*  )  1.8 0.0 4.01
assign (resid   44  and name  HD1* )(resid   45  and name  HD*  )  1.8 0.0 3.72
assign (resid   44  and name  HG2* )(resid   44  and name  HG1*  )  1.8 0.0 1.73
assign (resid   44  and name  HG2* )(resid   45  and name  HD*  )  1.8 0.0 1.96
assign (resid   44  and name  HN )(resid   44  and name  HB  )  1.8 0.0 2.15
assign (resid   44  and name  HN )(resid   44  and name  HD1*  )  1.8 0.0 3.56
assign (resid   44  and name  HN )(resid   44  and name  HG1*  )  1.8 0.0 2.43
assign (resid   45  and name  HA )(resid   46  and name  HG2*  )  1.8 0.0 3.20
assign (resid   45  and name  HA )(resid   46  and name  HN  )  1.8 0.0 1.69
assign (resid   45  and name  HB* )(resid   47  and name  HG  )  1.8 0.0 2.89
assign (resid   45  and name  HB1 )(resid   47  and name  HD2*  )  1.8 0.0 3.36
assign (resid   45  and name  HB2 )(resid   47  and name  HD2*  )  1.8 0.0 3.36
assign (resid   45  and name  HG* )(resid   47  and name  HD1*  )  1.8 0.0 3.68
assign (resid   45  and name  HG* )(resid   47  and name  HG  )  1.8 0.0 3.53
assign (resid   46  and name  HA )(resid   46  and name  HG1*  )  1.8 0.0 1.93
assign (resid   46  and name  HA )(resid   46  and name  HG2*  )  1.8 0.0 2.14
assign (resid   46  and name  HA )(resid   47  and name  HN  )  1.8 0.0 1.6
!nassign (resid   46  and name  HB )(resid   47  and name  HA  )  1.8 0.0 4.25
!nassign (resid   46  and name  HG1* )(resid   47  and name  HA  )  1.8 0.0 3.23
assign (resid   46  and name  HG1* )(resid   47  and name  HN  )  1.8 0.0 2.48
assign (resid   46  and name  HG1* )(resid   48  and name  HB*  )  1.8 0.0 2.29
assign (resid   46  and name  HG1* )(resid   48  and name  HG  )  1.8 0.0 2.72
assign (resid   46  and name  HG1* )(resid   48  and name  HN  )  1.8 0.0 2.85
assign (resid   46  and name  HG1* )(resid   51  and name  HB*  )  1.8 0.0 2.12
assign (resid   46  and name  HG1* )(resid   51  and name  HG*  )  1.8 0.0 2.36
assign (resid   46  and name  HN )(resid   46  and name  HB  )  1.8 0.0 2.41
assign (resid   46  and name  HN )(resid   46  and name  HG2*  )  1.8 0.0 2.38
assign (resid   47  and name  HA )(resid   47  and name  HD2*  )  1.8 0.0 2.08
assign (resid   47  and name  HA )(resid   48  and name  HN  )  1.8 0.0 1.95
assign (resid   47  and name  HB* )(resid   47  and name  HD2*  )  1.8 0.0 2.3
assign (resid   47  and name  HB1 )(resid   47  and name  HD1*  )  1.8 0.0 2.61
assign (resid   47  and name  HB2 )(resid   47  and name  HD1*  )  1.8 0.0 2.61
assign (resid   47  and name  HN )(resid   47  and name  HD2*  )  1.8 0.0 3.72
assign (resid   47  and name  HN )(resid   47  and name  HG  )  1.8 0.0 2.81
assign (resid   48  and name  HA )(resid   48  and name  HD2*  )  1.8 0.0 1.85
assign (resid   48  and name  HA )(resid   49  and name  HN  )  1.8 0.0 1.69
assign (resid   48  and name  HB* )(resid   48  and name  HD2*  )  1.8 0.0 1.84
assign (resid   48  and name  HB* )(resid   50  and name  HN  )  1.8 0.0 3.51
assign (resid   48  and name  HB* )(resid   51  and name  HB*  )  1.8 0.0 2.77
assign (resid   48  and name  HB* )(resid   51  and name  HG*  )  1.8 0.0 2.29
assign (resid   48  and name  HB* )(resid   51  and name  HN  )  1.8 0.0 3.20
assign (resid   48  and name  HB1 )(resid   48  and name  HD1*  )  1.8 0.0 2.3
assign (resid   48  and name  HB1 )(resid   49  and name  HN  )  1.8 0.0 3.38
assign (resid   48  and name  HB2 )(resid   48  and name  HD1*  )  1.8 0.0 2.3
assign (resid   48  and name  HB2 )(resid   49  and name  HN  )  1.8 0.0 3.38
!nassign (resid   48  and name  HD1* )(resid   51  and name  HB*  )  1.8 0.0 3.39
assign (resid   48  and name  HD1* )(resid   51  and name  HG*  )  1.8 0.0 2.33
assign (resid   48  and name  HD2* )(resid   49  and name  HN  )  1.8 0.0 3.23
!nassign (resid   48  and name  HD2* )(resid   50  and name  HN  )  1.8 0.0 3.64
assign (resid   48  and name  HN )(resid   48  and name  HB*  )  1.8 0.0 2.04
assign (resid   49  and name  HA )(resid   49  and name  HG1*  )  1.8 0.0 1.92
assign (resid   49  and name  HA )(resid   49  and name  HG2*  )  1.8 0.0 2.03
!olassign (resid   49  and name  HA )(resid   52  and name  HB*  )  1.8 0.0 2.36
assign (resid   49  and name  HA )(resid   52  and name  HN  )  1.8 0.0 3.20
!nassign (resid   49  and name  HB )(resid   50  and name  HB*  )  1.8 0.0 2.74
assign (resid   49  and name  HB )(resid   50  and name  HN  )  1.8 0.0 2.51
assign (resid   49  and name  HG1* )(resid   50  and name  HA  )  1.8 0.0 3.48
assign (resid   49  and name  HG1* )(resid   50  and name  HN  )  1.8 0.0 3.29
assign (resid   49  and name  HG2* )(resid   50  and name  HN  )  1.8 0.0 3.07
assign (resid   49  and name  HN )(resid   49  and name  HB  )  1.8 0.0 2.19
assign (resid   49  and name  HN )(resid   49  and name  HG1*  )  1.8 0.0 3.34
assign (resid   49  and name  HN )(resid   49  and name  HG2*  )  1.8 0.0 2.19
assign (resid   49  and name  HN )(resid   50  and name  HN  )  1.8 0.0 2.23
assign (resid   50  and name  HN )(resid   50  and name  HB*  )  1.8 0.0 1.97
assign (resid   50  and name  HN )(resid   51  and name  HN  )  1.8 0.0 2.47
assign (resid   50  and name  HN )(resid   52  and name  HN  )  1.8 0.0 3.56
assign (resid   51  and name  HA )(resid   51  and name  HG*  )  1.8 0.0 2.1
assign (resid   51  and name  HN )(resid   51  and name  HB*  )  1.8 0.0 2.05
assign (resid   51  and name  HN )(resid   51  and name  HG*  )  1.8 0.0 2.86
assign (resid   51  and name  HN )(resid   52  and name  HN  )  1.8 0.0 1.7
!nrassign (resid   52  and name  HA )(resid   53  and name  HB1  )  1.8 0.0 3.46
!nrassign (resid   52  and name  HA )(resid   53  and name  HB2  )  1.8 0.0 3.46
assign (resid   52  and name  HA )(resid   53  and name  HN  )  1.8 0.0 1.75
assign (resid   52  and name  HB* )(resid   53  and name  HN  )  1.8 0.0 2.42
assign (resid   53  and name  HA )(resid   54  and name  HN  )  1.8 0.0 1.65
assign (resid   53  and name  HG* )(resid   54  and name  HN  )  1.8 0.0 2.86
assign (resid   54  and name  HA )(resid   54  and name  HD*  )  1.8 0.0 3.22
assign (resid   54  and name  HA )(resid   55  and name  HD*  )  1.8 0.0 1.7
assign (resid   54  and name  HB* )(resid   54  and name  HD*  )  1.8 0.0 1.9
!nrassign (resid   54  and name  HB* )(resid   55  and name  HB*  )  1.8 0.0 3.85
assign (resid   54  and name  HB* )(resid   55  and name  HD*  )  1.8 0.0 2.63
assign (resid   54  and name  HN )(resid   54  and name  HB*  )  1.8 0.0 1.85
assign (resid   54  and name  HN )(resid   54  and name  HG*  )  1.8 0.0 3.16
assign (resid   21      and name HN     )(resid  28     and name O      ) 1.7  0.0  0.6
assign (resid   21      and name N      )(resid  28     and name O      ) 2.7  0.0  0.6
assign (resid   23      and name HN     )(resid  26     and name O      ) 1.7  0.0  0.6
assign (resid   23      and name N      )(resid  26     and name O      ) 2.7  0.0  0.6
assign (resid   26      and name HN     )(resid  23     and name O      ) 1.7  0.0  0.6
assign (resid   26      and name N      )(resid  23     and name O      ) 2.7  0.0  0.6
assign (resid   27      and name HN     )(resid  38     and name O      ) 1.7  0.0  0.6
assign (resid   27      and name N      )(resid  38     and name O      ) 2.7  0.0  0.6
assign (resid   28      and name HN     )(resid  21     and name O      ) 1.7  0.0  0.6
assign (resid   28      and name N      )(resid  21     and name O      ) 2.7  0.0  0.6
assign (resid   29      and name HN     )(resid  36     and name O      ) 1.7  0.0  0.6
assign (resid   29      and name N      )(resid  36     and name O      ) 2.7  0.0  0.6
assign (resid   30      and name HN     )(resid  19     and name O      ) 1.7  0.0  0.6
assign (resid   30      and name N      )(resid  19     and name O      ) 2.7  0.0  0.6
assign (resid   37      and name HN     )(resid  53     and name O      ) 1.7  0.0  0.6
assign (resid   37      and name N      )(resid  53     and name O      ) 2.7  0.0  0.6
assign (resid   38      and name HN     )(resid  27     and name O      ) 1.7  0.0  0.6
assign (resid   38      and name N      )(resid  27     and name O      ) 2.7  0.0  0.6
assign (resid   41      and name HN     )(resid  44     and name O      ) 1.7  0.0  0.6
assign (resid   41      and name N      )(resid  44     and name O      ) 2.7  0.0  0.6
assign (resid   44      and name HN     )(resid  41     and name O      ) 1.7  0.0  0.6
assign (resid   44      and name N      )(resid  41     and name O      ) 2.7  0.0  0.6
assign (resid   53      and name HN     )(resid  37     and name O      ) 1.7  0.0  0.6
assign (resid   53      and name N      )(resid  37     and name O      ) 2.7  0.0  0.6
remarks RR58 Zn constraints

class zn

assign (resid  150 and  name ZN   )(resid   13 and  name SG   ) 2.3 0.0 0.1
assign (resid  150 and  name ZN   )(resid   16 and  name SG   ) 2.3 0.0 0.1
assign (resid  150 and  name ZN   )(resid   29 and  name SG   ) 2.3 0.0 0.1
assign (resid  150 and  name ZN   )(resid   34 and  name SG   ) 2.3 0.0 0.1
assign (resid   13 and  name SG   )(resid   16 and  name SG   ) 3.6 0.0 0.25
assign (resid   13 and  name SG   )(resid   29 and  name SG   ) 3.6 0.0 0.25
assign (resid   13 and  name SG   )(resid   34 and  name SG   ) 3.6 0.0 0.25
assign (resid   16 and  name SG   )(resid   29 and  name SG   ) 3.6 0.0 0.25
assign (resid   16 and  name SG   )(resid   34 and  name SG   ) 3.6 0.0 0.25
assign (resid   29 and  name SG   )(resid   34 and  name SG   ) 3.6 0.0 0.25
!assign (resid    7 and name C    ) (resid    8 and name N    )
!       (resid    8 and name CA   ) (resid    8 and name C    )    1.0  -72.3   30.0 2
!assign (resid    8 and name N    ) (resid    8 and name CA   )
!       (resid    8 and name C    ) (resid    9 and name N    )    1.0  -38.0   30.0 2
!assign (resid    8 and name C    ) (resid    9 and name N    )
!       (resid    9 and name CA   ) (resid    9 and name C    )    1.0  -83.7   46.6 2
!assign (resid    9 and name N    ) (resid    9 and name CA   )
!       (resid    9 and name C    ) (resid   10 and name N    )    1.0  -24.3   44.1 2
assign (resid   10 and name C    ) (resid   11 and name N    )
       (resid   11 and name CA   ) (resid   11 and name C    )    1.0 -106.8   70.0 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
       (resid   11 and name C    ) (resid   12 and name N    )    1.0  138.2   48.3 2
assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )    1.0 -113.4   42.1 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )    1.0  127.3   30.0 2
assign (resid   12 and name C    ) (resid   13 and name N    )
       (resid   13 and name CA   ) (resid   13 and name C    )    1.0 -101.5   42.2 2
!assign (resid   13 and name N    ) (resid   13 and name CA   )
!       (resid   13 and name C    ) (resid   14 and name N    )    1.0  120.4   31.3 2
!assign (resid   13 and name C    ) (resid   14 and name N    )
!       (resid   14 and name CA   ) (resid   14 and name C    )    1.0  -60.9   30.0 2
!assign (resid   14 and name N    ) (resid   14 and name CA   )
!       (resid   14 and name C    ) (resid   15 and name N    )    1.0  146.7   30.0 2
!assign (resid   14 and name C    ) (resid   15 and name N    )
!       (resid   15 and name CA   ) (resid   15 and name C    )    1.0  -83.2   35.1 2
!assign (resid   15 and name N    ) (resid   15 and name CA   )
!       (resid   15 and name C    ) (resid   16 and name N    )    1.0  -22.4   30.0 2
!assign (resid   16 and name C    ) (resid   17 and name N    )
!       (resid   17 and name CA   ) (resid   17 and name C    )    1.0  -89.1   70.0 2
!assign (resid   17 and name N    ) (resid   17 and name CA   )
!       (resid   17 and name C    ) (resid   18 and name N    )    1.0  141.4   60.6 2
!assign (resid   17 and name C    ) (resid   18 and name N    )
!       (resid   18 and name CA   ) (resid   18 and name C    )    1.0  -84.5   70.0 2
!assign (resid   18 and name N    ) (resid   18 and name CA   )
!       (resid   18 and name C    ) (resid   19 and name N    )    1.0  143.4   70.0 2
!assign (resid   18 and name C    ) (resid   19 and name N    )
!       (resid   19 and name CA   ) (resid   19 and name C    )    1.0  -66.8   30.0 2
assign (resid   19 and name N    ) (resid   19 and name CA   )
       (resid   19 and name C    ) (resid   20 and name N    )    1.0  149.2   30.0 2
assign (resid   19 and name C    ) (resid   20 and name N    )
       (resid   20 and name CA   ) (resid   20 and name C    )    1.0 -105.5   47.9 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name C    ) (resid   21 and name N    )    1.0  147.8   31.6 2
assign (resid   20 and name C    ) (resid   21 and name N    )
       (resid   21 and name CA   ) (resid   21 and name C    )    1.0 -132.1   30.0 2
assign (resid   21 and name N    ) (resid   21 and name CA   )
       (resid   21 and name C    ) (resid   22 and name N    )    1.0  136.7   30.0 2
assign (resid   21 and name C    ) (resid   22 and name N    )
       (resid   22 and name CA   ) (resid   22 and name C    )    1.0  -90.7   30.0 2
assign (resid   22 and name N    ) (resid   22 and name CA   )
       (resid   22 and name C    ) (resid   23 and name N    )    1.0  124.6   30.0 2
assign (resid   22 and name C    ) (resid   23 and name N    )
       (resid   23 and name CA   ) (resid   23 and name C    )    1.0 -134.9   44.5 2
assign (resid   23 and name N    ) (resid   23 and name CA   )
       (resid   23 and name C    ) (resid   24 and name N    )    1.0  133.7   30.0 2
assign (resid   25 and name C    ) (resid   26 and name N    )
       (resid   26 and name CA   ) (resid   26 and name C    )    1.0 -142.5   39.3 2
assign (resid   26 and name N    ) (resid   26 and name CA   )
       (resid   26 and name C    ) (resid   27 and name N    )    1.0  155.7   30.0 2
assign (resid   26 and name C    ) (resid   27 and name N    )
       (resid   27 and name CA   ) (resid   27 and name C    )    1.0 -120.0   30.0 2
assign (resid   27 and name N    ) (resid   27 and name CA   )
       (resid   27 and name C    ) (resid   28 and name N    )    1.0  130.1   30.0 2
assign (resid   27 and name C    ) (resid   28 and name N    )
       (resid   28 and name CA   ) (resid   28 and name C    )    1.0 -112.7   33.7 2
assign (resid   28 and name N    ) (resid   28 and name CA   )
       (resid   28 and name C    ) (resid   29 and name N    )    1.0  130.7   46.7 2
!assign (resid   29 and name C    ) (resid   30 and name N    )
!       (resid   30 and name CA   ) (resid   30 and name C    )    1.0 -100.3   49.9 2
!assign (resid   30 and name N    ) (resid   30 and name CA   )
!       (resid   30 and name C    ) (resid   31 and name N    )    1.0  129.9   37.6 2
!assign (resid   30 and name C    ) (resid   31 and name N    )
!       (resid   31 and name CA   ) (resid   31 and name C    )    1.0  -22.8   70.0 2
!assign (resid   31 and name N    ) (resid   31 and name CA   )
!       (resid   31 and name C    ) (resid   32 and name N    )    1.0  169.3   70.0 2
assign (resid   31 and name C    ) (resid   32 and name N    )
       (resid   32 and name CA   ) (resid   32 and name C    )    1.0  -61.9   30.0 2
assign (resid   32 and name N    ) (resid   32 and name CA   )
       (resid   32 and name C    ) (resid   33 and name N    )    1.0  -27.5   30.0 2
assign (resid   32 and name C    ) (resid   33 and name N    )
       (resid   33 and name CA   ) (resid   33 and name C    )    1.0  -96.7   30.0 2
assign (resid   33 and name N    ) (resid   33 and name CA   )
       (resid   33 and name C    ) (resid   34 and name N    )    1.0    9.3   32.4 2
assign (resid   36 and name C    ) (resid   37 and name N    )
       (resid   37 and name CA   ) (resid   37 and name C    )    1.0 -128.6   70.0 2
assign (resid   37 and name N    ) (resid   37 and name CA   )
       (resid   37 and name C    ) (resid   38 and name N    )    1.0  135.9   30.0 2
assign (resid   37 and name C    ) (resid   38 and name N    )
       (resid   38 and name CA   ) (resid   38 and name C    )    1.0 -100.3   42.7 2
assign (resid   38 and name N    ) (resid   38 and name CA   )
       (resid   38 and name C    ) (resid   39 and name N    )    1.0  137.5   36.2 2
assign (resid   38 and name C    ) (resid   39 and name N    )
       (resid   39 and name CA   ) (resid   39 and name C    )    1.0  -74.5   30.0 2
assign (resid   39 and name N    ) (resid   39 and name CA   )
       (resid   39 and name C    ) (resid   40 and name N    )    1.0  151.9   30.0 2
assign (resid   39 and name C    ) (resid   40 and name N    )
       (resid   40 and name CA   ) (resid   40 and name C    )    1.0  -91.2   36.3 2
assign (resid   40 and name N    ) (resid   40 and name CA   )
       (resid   40 and name C    ) (resid   41 and name N    )    1.0  128.0   31.4 2
assign (resid   40 and name C    ) (resid   41 and name N    )
       (resid   41 and name CA   ) (resid   41 and name C    )    1.0 -128.4   45.6 2
assign (resid   41 and name N    ) (resid   41 and name CA   )
       (resid   41 and name C    ) (resid   42 and name N    )    1.0  125.0   30.0 2
assign (resid   42 and name C    ) (resid   43 and name N    )
       (resid   43 and name CA   ) (resid   43 and name C    )    1.0   81.3   30.0 2
assign (resid   43 and name N    ) (resid   43 and name CA   )
       (resid   43 and name C    ) (resid   44 and name N    )    1.0   -2.4   32.8 2
assign (resid   43 and name C    ) (resid   44 and name N    )
       (resid   44 and name CA   ) (resid   44 and name C    )    1.0 -104.2   35.1 2
assign (resid   44 and name N    ) (resid   44 and name CA   )
       (resid   44 and name C    ) (resid   45 and name N    )    1.0  126.7   40.2 2
assign (resid   44 and name C    ) (resid   45 and name N    )
       (resid   45 and name CA   ) (resid   45 and name C    )    1.0  -65.7   30.0 2
assign (resid   45 and name N    ) (resid   45 and name CA   )
       (resid   45 and name C    ) (resid   46 and name N    )    1.0  148.9   30.0 2
assign (resid   45 and name C    ) (resid   46 and name N    )
       (resid   46 and name CA   ) (resid   46 and name C    )    1.0 -111.9   54.8 2
assign (resid   46 and name N    ) (resid   46 and name CA   )
       (resid   46 and name C    ) (resid   47 and name N    )    1.0  120.8   30.0 2
!assign (resid   46 and name C    ) (resid   47 and name N    )
!       (resid   47 and name CA   ) (resid   47 and name C    )    1.0 -101.0   50.5 2
!assign (resid   47 and name N    ) (resid   47 and name CA   )
!       (resid   47 and name C    ) (resid   48 and name N    )    1.0  141.2   60.0 2
assign (resid   47 and name C    ) (resid   48 and name N    )
       (resid   48 and name CA   ) (resid   48 and name C    )    1.0 -100.5   58.2 2
assign (resid   48 and name N    ) (resid   48 and name CA   )
       (resid   48 and name C    ) (resid   49 and name N    )    1.0  155.6   38.1 2
assign (resid   48 and name C    ) (resid   49 and name N    )
       (resid   49 and name CA   ) (resid   49 and name C    )    1.0  -56.7   30.0 2
assign (resid   49 and name N    ) (resid   49 and name CA   )
       (resid   49 and name C    ) (resid   50 and name N    )    1.0  -43.7   30.0 2
assign (resid   49 and name C    ) (resid   50 and name N    )
       (resid   50 and name CA   ) (resid   50 and name C    )    1.0  -67.6   30.0 2
assign (resid   50 and name N    ) (resid   50 and name CA   )
       (resid   50 and name C    ) (resid   51 and name N    )    1.0  -15.7   30.0 2
assign (resid   50 and name C    ) (resid   51 and name N    )
       (resid   51 and name CA   ) (resid   51 and name C    )    1.0 -102.0   30.0 2
assign (resid   51 and name N    ) (resid   51 and name CA   )
       (resid   51 and name C    ) (resid   52 and name N    )    1.0   -2.7   35.9 2
assign (resid   51 and name C    ) (resid   52 and name N    )
       (resid   52 and name CA   ) (resid   52 and name C    )    1.0  -96.4   70.0 2
assign (resid   52 and name N    ) (resid   52 and name CA   )
       (resid   52 and name C    ) (resid   53 and name N    )    1.0  130.9   44.2 2
assign (resid   52 and name C    ) (resid   53 and name N    )
       (resid   53 and name CA   ) (resid   53 and name C    )    1.0 -119.3   40.9 2
assign (resid   53 and name N    ) (resid   53 and name CA   )
       (resid   53 and name C    ) (resid   54 and name N    )    1.0  140.5   40.7 2
assign (resid   53 and name C    ) (resid   54 and name N    )
       (resid   54 and name CA   ) (resid   54 and name C    )    1.0  -80.0   30.0 2
assign (resid   54 and name N    ) (resid   54 and name CA   )
       (resid   54 and name C    ) (resid   55 and name N    )    1.0  144.9   30.0 2
assign (resid   54 and name C    ) (resid   55 and name N    )
       (resid   55 and name CA   ) (resid   55 and name C    )    1.0  -61.8   30.0 2
assign (resid   55 and name N    ) (resid   55 and name CA   )
       (resid   55 and name C    ) (resid   56 and name N    )    1.0  139.7   46.5 2
! created by  AutoStructure/RPF Version 2.2.1 Copyright(C) 2007

! PRO 2
 assign (resid   1 and name C ) (resid   2 and name N ) (resid   2 and name CA )
        (resid   2 and name C ) (resid   3 and name N ) 63.1 32.04
! LEU 3
 assign (resid   2 and name C ) (resid   3 and name N ) (resid   3 and name CA )
        (resid   3 and name C ) (resid   4 and name N ) 55.4 42.45
! GLU 4
 assign (resid   3 and name C ) (resid   4 and name N ) (resid   4 and name CA )
        (resid   4 and name C ) (resid   5 and name N ) 56.66 30.14
! ALA 5
 assign (resid   4 and name C ) (resid   5 and name N ) (resid   5 and name CA )
        (resid   5 and name C ) (resid   6 and name N ) 53.5 19
! GLY 6
 assign (resid   5 and name C ) (resid   6 and name N ) (resid   6 and name CA )
        (resid   6 and name C ) (resid   7 and name N ) 45.6  $noexpectation
! LEU 7
 assign (resid   6 and name C ) (resid   7 and name N ) (resid   7 and name CA )
        (resid   7 and name C ) (resid   8 and name N ) 55.88 42.45
! LEU 8
 assign (resid   7 and name C ) (resid   8 and name N ) (resid   8 and name CA )
        (resid   8 and name C ) (resid   9 and name N ) 56.1 42.16
! GLU 9
 assign (resid   8 and name C ) (resid   9 and name N ) (resid   9 and name CA )
        (resid   9 and name C ) (resid  10 and name N ) 57 30.2
! ILE 10
 assign (resid   9 and name C ) (resid  10 and name N ) (resid  10 and name CA )
        (resid  10 and name C ) (resid  11 and name N ) 60.8 38.9
! LEU 11
 assign (resid  10 and name C ) (resid  11 and name N ) (resid  11 and name CA )
        (resid  11 and name C ) (resid  12 and name N ) 54.4 43.4
! ALA 12
 assign (resid  11 and name C ) (resid  12 and name N ) (resid  12 and name CA )
        (resid  12 and name C ) (resid  13 and name N ) 50.1 22
! CYS 13
 assign (resid  12 and name C ) (resid  13 and name N ) (resid  13 and name CA )
        (resid  13 and name C ) (resid  14 and name N ) 56.9 31.6
! PRO 14
 assign (resid  13 and name C ) (resid  14 and name N ) (resid  14 and name CA )
        (resid  14 and name C ) (resid  15 and name N ) 64.2 31.85
! ALA 15
 assign (resid  14 and name C ) (resid  15 and name N ) (resid  15 and name CA )
        (resid  15 and name C ) (resid  16 and name N ) 54.3 20.1
! CYS 16
 assign (resid  15 and name C ) (resid  16 and name N ) (resid  16 and name CA )
        (resid  16 and name C ) (resid  17 and name N ) 58.8 32.6
! HIS 17
 assign (resid  16 and name C ) (resid  17 and name N ) (resid  17 and name CA )
        (resid  17 and name C ) (resid  18 and name N ) 57.7 26.5
! ALA 18
 assign (resid  17 and name C ) (resid  18 and name N ) (resid  18 and name CA )
        (resid  18 and name C ) (resid  19 and name N ) 52.1 19
! PRO 19
 assign (resid  18 and name C ) (resid  19 and name N ) (resid  19 and name CA )
        (resid  19 and name C ) (resid  20 and name N ) 63.3 32.5
! LEU 20
 assign (resid  19 and name C ) (resid  20 and name N ) (resid  20 and name CA )
        (resid  20 and name C ) (resid  21 and name N ) 53.3 44.8
! GLU 21
 assign (resid  20 and name C ) (resid  21 and name N ) (resid  21 and name CA )
        (resid  21 and name C ) (resid  22 and name N ) 54.1 33
! GLU 22
 assign (resid  21 and name C ) (resid  22 and name N ) (resid  22 and name CA )
        (resid  22 and name C ) (resid  23 and name N ) 56.8 30.2
! ARG 23
 assign (resid  22 and name C ) (resid  23 and name N ) (resid  23 and name CA )
        (resid  23 and name C ) (resid  24 and name N ) 55.6 32.1
! ASP 24
 assign (resid  23 and name C ) (resid  24 and name N ) (resid  24 and name CA )
        (resid  24 and name C ) (resid  25 and name N ) 56.6 39.6
! ALA 25
 assign (resid  24 and name C ) (resid  25 and name N ) (resid  25 and name CA )
        (resid  25 and name C ) (resid  26 and name N ) 52.6 18.1
! GLU 26
 assign (resid  25 and name C ) (resid  26 and name N ) (resid  26 and name CA )
        (resid  26 and name C ) (resid  27 and name N ) 54.7 35.1
! LEU 27
 assign (resid  26 and name C ) (resid  27 and name N ) (resid  27 and name CA )
        (resid  27 and name C ) (resid  28 and name N ) 53.27 44.4
! ILE 28
 assign (resid  27 and name C ) (resid  28 and name N ) (resid  28 and name CA )
        (resid  28 and name C ) (resid  29 and name N ) 60 39.7
! CYS 29
 assign (resid  28 and name C ) (resid  29 and name N ) (resid  29 and name CA )
        (resid  29 and name C ) (resid  30 and name N ) 62 30.4
! THR 30
 assign (resid  29 and name C ) (resid  30 and name N ) (resid  30 and name CA )
        (resid  30 and name C ) (resid  31 and name N ) 62.4 70.5
! GLY 31
 assign (resid  30 and name C ) (resid  31 and name N ) (resid  31 and name CA )
        (resid  31 and name C ) (resid  32 and name N ) 45.3  $noexpectation
! GLN 32
 assign (resid  31 and name C ) (resid  32 and name N ) (resid  32 and name CA )
        (resid  32 and name C ) (resid  33 and name N ) 58.2 28.8
! ASP 33
 assign (resid  32 and name C ) (resid  33 and name N ) (resid  33 and name CA )
        (resid  33 and name C ) (resid  34 and name N ) 54 40.4
! CYS 34
 assign (resid  33 and name C ) (resid  34 and name N ) (resid  34 and name CA )
        (resid  34 and name C ) (resid  35 and name N ) 60.1 31.2
! GLY 35
 assign (resid  34 and name C ) (resid  35 and name N ) (resid  35 and name CA )
        (resid  35 and name C ) (resid  36 and name N ) 46.9  $noexpectation
! LEU 36
 assign (resid  35 and name C ) (resid  36 and name N ) (resid  36 and name CA )
        (resid  36 and name C ) (resid  37 and name N ) 56.48 43.3
! ALA 37
 assign (resid  36 and name C ) (resid  37 and name N ) (resid  37 and name CA )
        (resid  37 and name C ) (resid  38 and name N ) 49.8 22.2
! TYR 38
 assign (resid  37 and name C ) (resid  38 and name N ) (resid  38 and name CA )
        (resid  38 and name C ) (resid  39 and name N ) 55.96 38.8
! PRO 39
 assign (resid  38 and name C ) (resid  39 and name N ) (resid  39 and name CA )
        (resid  39 and name C ) (resid  40 and name N ) 63.1 32.96
! VAL 40
 assign (resid  39 and name C ) (resid  40 and name N ) (resid  40 and name CA )
        (resid  40 and name C ) (resid  41 and name N ) 62.1 32.3
! ARG 41
 assign (resid  40 and name C ) (resid  41 and name N ) (resid  41 and name CA )
        (resid  41 and name C ) (resid  42 and name N ) 55.1 32.2
! ASP 42
 assign (resid  41 and name C ) (resid  42 and name N ) (resid  42 and name CA )
        (resid  42 and name C ) (resid  43 and name N ) 55.4 39.7
! GLY 43
 assign (resid  42 and name C ) (resid  43 and name N ) (resid  43 and name CA )
        (resid  43 and name C ) (resid  44 and name N ) 45.2  $noexpectation
! ILE 44
 assign (resid  43 and name C ) (resid  44 and name N ) (resid  44 and name CA )
        (resid  44 and name C ) (resid  45 and name N ) 57.3 39.5
! PRO 45
 assign (resid  44 and name C ) (resid  45 and name N ) (resid  45 and name CA )
        (resid  45 and name C ) (resid  46 and name N ) 62.6 32.45
! VAL 46
 assign (resid  45 and name C ) (resid  46 and name N ) (resid  46 and name CA )
        (resid  46 and name C ) (resid  47 and name N ) 61.7 30.8
! LEU 47
 assign (resid  46 and name C ) (resid  47 and name N ) (resid  47 and name CA )
        (resid  47 and name C ) (resid  48 and name N ) 52.7 39.4
! LEU 48
 assign (resid  47 and name C ) (resid  48 and name N ) (resid  48 and name CA )
        (resid  48 and name C ) (resid  49 and name N ) 52.8 44.2
! VAL 49
 assign (resid  48 and name C ) (resid  49 and name N ) (resid  49 and name CA )
        (resid  49 and name C ) (resid  50 and name N ) 66.7 31.9
! ASP 50
 assign (resid  49 and name C ) (resid  50 and name N ) (resid  50 and name CA )
        (resid  50 and name C ) (resid  51 and name N ) 56.2 40.4
! GLU 51
 assign (resid  50 and name C ) (resid  51 and name N ) (resid  51 and name CA )
        (resid  51 and name C ) (resid  52 and name N ) 55.6 30.3
! ALA 52
 assign (resid  51 and name C ) (resid  52 and name N ) (resid  52 and name CA )
        (resid  52 and name C ) (resid  53 and name N ) 51.9 20.9
! ARG 53
 assign (resid  52 and name C ) (resid  53 and name N ) (resid  53 and name CA )
        (resid  53 and name C ) (resid  54 and name N ) 54.9 32.5
! ARG 54
 assign (resid  53 and name C ) (resid  54 and name N ) (resid  54 and name CA )
        (resid  54 and name C ) (resid  55 and name N ) 54 30.05
! PRO 55
 assign (resid  54 and name C ) (resid  55 and name N ) (resid  55 and name CA )
        (resid  55 and name C ) (resid  56 and name N ) 63.5 31.93

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1  38.339  21.584  12.961
    2    H2   MET   1           HT2      MET   1  39.070  22.805  12.033
    3    H3   MET   1           HT3      MET   1  39.788  21.268  12.138
    4    HA   MET   1           HA       MET   1  37.133  21.003  11.218
    5    HB2  MET   1           HB2      MET   1  38.918  23.004   9.815
    6    HB3  MET   1           HB1      MET   1  37.618  22.151   8.982
    7    HG2  MET   1           HG2      MET   1  37.127  23.659  11.555
    8    HG3  MET   1           HG1      MET   1  37.038  24.454   9.982
    9    HE1  MET   1           HE1      MET   1  35.671  23.253   7.936
   10    HE2  MET   1           HE2      MET   1  35.046  24.692   8.741
   11    HE3  MET   1           HE3      MET   1  33.951  23.373   8.335
   12    HA   PRO   2           HA       PRO   2  40.849  18.282  10.000
   13    HB2  PRO   2           HB2      PRO   2  40.038  16.049  11.439
   14    HB3  PRO   2           HB1      PRO   2  41.176  17.270  12.042
   15    HG2  PRO   2           HG2      PRO   2  38.258  16.972  12.593
   16    HG3  PRO   2           HG1      PRO   2  39.571  17.441  13.688
   17    HD2  PRO   2           HD2      PRO   2  37.861  19.268  12.611
   18    HD3  PRO   2           HD1      PRO   2  39.559  19.656  12.973
   19    H    LEU   3           HN       LEU   3  40.739  16.688   8.407
   20    HA   LEU   3           HA       LEU   3  38.203  16.445   7.007
   21    HB2  LEU   3           HB2      LEU   3  40.799  14.967   6.511
   22    HB3  LEU   3           HB1      LEU   3  39.468  15.169   5.370
   23    HG   LEU   3           HG       LEU   3  41.134  17.413   6.551
   24   HD11  LEU   3          HD11      LEU   3  41.050  16.224   3.761
   25   HD12  LEU   3          HD12      LEU   3  42.381  16.085   4.911
   26   HD13  LEU   3          HD13      LEU   3  41.967  17.657   4.227
   27   HD21  LEU   3          HD21      LEU   3  39.033  18.389   6.129
   28   HD22  LEU   3          HD22      LEU   3  38.717  17.346   4.741
   29   HD23  LEU   3          HD23      LEU   3  39.883  18.664   4.611
   30    H    GLU   4           HN       GLU   4  36.944  14.623   6.737
   31    HA   GLU   4           HA       GLU   4  36.748  12.825   8.960
   32    HB2  GLU   4           HB2      GLU   4  35.047  11.671   7.567
   33    HB3  GLU   4           HB1      GLU   4  34.806  13.418   7.595
   34    HG2  GLU   4           HG2      GLU   4  36.015  13.600   5.429
   35    HG3  GLU   4           HG1      GLU   4  36.170  11.843   5.390
   36    H    ALA   5           HN       ALA   5  37.465  10.746   9.217
   37    HA   ALA   5           HA       ALA   5  39.170   9.556   7.044
   38    HB1  ALA   5           HB1      ALA   5  40.456  10.389   9.036
   39    HB2  ALA   5           HB2      ALA   5  40.595   8.645   8.805
   40    HB3  ALA   5           HB3      ALA   5  39.519   9.289  10.044
   41    H    GLY   6           HN       GLY   6  37.705   8.513  10.140
   42    HA2  GLY   6           HA2      GLY   6  36.360   6.646  10.627
   43    HA3  GLY   6           HA1      GLY   6  35.782   6.744   8.963
   44    H    LEU   7           HN       LEU   7  38.864   5.928  10.568
   45    HA   LEU   7           HA       LEU   7  40.373   4.187  10.163
   46    HB2  LEU   7           HB2      LEU   7  37.677   2.894   9.753
   47    HB3  LEU   7           HB1      LEU   7  39.155   1.965   9.495
   48    HG   LEU   7           HG       LEU   7  39.907   2.507  11.773
   49   HD11  LEU   7          HD11      LEU   7  38.972   4.658  12.174
   50   HD12  LEU   7          HD12      LEU   7  38.130   3.586  13.292
   51   HD13  LEU   7          HD13      LEU   7  37.339   4.103  11.803
   52   HD21  LEU   7          HD21      LEU   7  37.050   1.485  11.737
   53   HD22  LEU   7          HD22      LEU   7  38.248   1.182  12.996
   54   HD23  LEU   7          HD23      LEU   7  38.474   0.508  11.381
   55    H    LEU   8           HN       LEU   8  41.701   4.454   8.508
   56    HA   LEU   8           HA       LEU   8  40.817   4.809   5.766
   57    HB2  LEU   8           HB2      LEU   8  43.171   4.989   5.239
   58    HB3  LEU   8           HB1      LEU   8  42.914   5.819   6.769
   59    HG   LEU   8           HG       LEU   8  43.940   2.959   6.518
   60   HD11  LEU   8          HD11      LEU   8  45.503   5.398   7.351
   61   HD12  LEU   8          HD12      LEU   8  45.465   4.816   5.687
   62   HD13  LEU   8          HD13      LEU   8  46.108   3.787   6.965
   63   HD21  LEU   8          HD21      LEU   8  42.927   3.115   8.649
   64   HD22  LEU   8          HD22      LEU   8  43.384   4.808   8.843
   65   HD23  LEU   8          HD23      LEU   8  44.603   3.541   8.980
   66    H    GLU   9           HN       GLU   9  41.034   2.121   7.696
   67    HA   GLU   9           HA       GLU   9  42.069   0.254   5.674
   68    HB2  GLU   9           HB2      GLU   9  40.778  -0.135   8.389
   69    HB3  GLU   9           HB1      GLU   9  41.331  -1.473   7.380
   70    HG2  GLU   9           HG2      GLU   9  43.614  -0.593   7.414
   71    HG3  GLU   9           HG1      GLU   9  43.081   0.811   8.337
   72    H    ILE  10           HN       ILE  10  39.192   1.868   6.175
   73    HA   ILE  10           HA       ILE  10  37.324  -0.237   5.493
   74    HB   ILE  10           HB       ILE  10  36.697   1.872   6.690
   75   HG12  ILE  10          HG12      ILE  10  35.201   1.556   4.075
   76   HG13  ILE  10          HG11      ILE  10  35.075   0.393   5.396
   77   HG21  ILE  10          HG21      ILE  10  38.136   3.304   5.110
   78   HG22  ILE  10          HG22      ILE  10  36.549   3.946   5.534
   79   HG23  ILE  10          HG23      ILE  10  36.800   3.181   3.965
   80   HD11  ILE  10          HD11      ILE  10  34.307   2.171   6.909
   81   HD12  ILE  10          HD12      ILE  10  33.258   2.067   5.495
   82   HD13  ILE  10          HD13      ILE  10  34.458   3.354   5.609
   83    H    LEU  11           HN       LEU  11  36.752  -0.966   3.511
   84    HA   LEU  11           HA       LEU  11  38.209   0.075   1.168
   85    HB2  LEU  11           HB2      LEU  11  36.815  -1.893   0.082
   86    HB3  LEU  11           HB1      LEU  11  38.199  -2.251   1.111
   87    HG   LEU  11           HG       LEU  11  35.544  -1.950   2.488
   88   HD11  LEU  11          HD11      LEU  11  36.289  -4.317   0.752
   89   HD12  LEU  11          HD12      LEU  11  34.845  -3.312   0.630
   90   HD13  LEU  11          HD13      LEU  11  35.059  -4.384   2.014
   91   HD21  LEU  11          HD21      LEU  11  37.828  -2.502   3.567
   92   HD22  LEU  11          HD22      LEU  11  37.659  -4.091   2.828
   93   HD23  LEU  11          HD23      LEU  11  36.471  -3.536   4.008
   94    H    ALA  12           HN       ALA  12  37.340   1.509  -0.206
   95    HA   ALA  12           HA       ALA  12  34.456   1.473  -0.786
   96    HB1  ALA  12           HB1      ALA  12  34.471   2.930   1.156
   97    HB2  ALA  12           HB2      ALA  12  34.214   3.913  -0.287
   98    HB3  ALA  12           HB3      ALA  12  35.801   3.872   0.482
   99    H    CYS  13           HN       CYS  13  34.081   2.151  -2.828
  100    HA   CYS  13           HA       CYS  13  36.230   2.397  -4.642
  101    HB2  CYS  13           HB2      CYS  13  33.693   3.710  -5.459
  102    HB3  CYS  13           HB1      CYS  13  34.605   2.433  -6.266
  103    HA   PRO  14           HA       PRO  14  37.676   6.591  -4.646
  104    HB2  PRO  14           HB2      PRO  14  36.831   6.826  -7.516
  105    HB3  PRO  14           HB1      PRO  14  38.420   7.132  -6.782
  106    HG2  PRO  14           HG2      PRO  14  37.967   4.941  -8.215
  107    HG3  PRO  14           HG1      PRO  14  38.980   4.893  -6.761
  108    HD2  PRO  14           HD2      PRO  14  36.171   3.922  -7.130
  109    HD3  PRO  14           HD1      PRO  14  37.485   3.256  -6.137
  110    H    ALA  15           HN       ALA  15  34.878   6.552  -6.876
  111    HA   ALA  15           HA       ALA  15  33.726   8.901  -5.393
  112    HB1  ALA  15           HB1      ALA  15  33.518   8.037  -8.287
  113    HB2  ALA  15           HB2      ALA  15  34.227   9.527  -7.665
  114    HB3  ALA  15           HB3      ALA  15  32.482   9.275  -7.581
  115    H    CYS  16           HN       CYS  16  32.776   6.008  -7.276
  116    HA   CYS  16           HA       CYS  16  30.066   6.047  -6.229
  117    HB2  CYS  16           HB2      CYS  16  29.879   3.812  -7.289
  118    HB3  CYS  16           HB1      CYS  16  30.574   4.998  -8.394
  119    H    HIS  17           HN       HIS  17  31.142   6.296  -3.957
  120    HA   HIS  17           HA       HIS  17  32.450   4.435  -2.461
  121    HB2  HIS  17           HB2      HIS  17  31.484   6.508  -1.534
  122    HB3  HIS  17           HB1      HIS  17  29.876   5.788  -1.612
  123    HD2  HIS  17           HD2      HIS  17  32.975   5.773   0.712
  124    HE1  HIS  17           HE1      HIS  17  30.329   2.825   2.175
  125    HE2  HIS  17           HE2      HIS  17  32.446   4.132   2.669
  126    H    ALA  18           HN       ALA  18  32.282   2.301  -2.510
  127    HA   ALA  18           HA       ALA  18  29.942   0.971  -1.589
  128    HB1  ALA  18           HB1      ALA  18  28.777   0.420  -3.486
  129    HB2  ALA  18           HB2      ALA  18  30.244  -0.079  -4.322
  130    HB3  ALA  18           HB3      ALA  18  29.766   1.618  -4.322
  131    HA   PRO  19           HA       PRO  19  32.704  -2.404  -0.888
  132    HB2  PRO  19           HB2      PRO  19  30.955  -4.261  -2.453
  133    HB3  PRO  19           HB1      PRO  19  31.501  -4.379  -0.768
  134    HG2  PRO  19           HG2      PRO  19  28.995  -3.693  -1.373
  135    HG3  PRO  19           HG1      PRO  19  29.849  -2.973   0.005
  136    HD2  PRO  19           HD2      PRO  19  29.241  -1.766  -2.668
  137    HD3  PRO  19           HD1      PRO  19  29.309  -1.011  -1.066
  138    H    LEU  20           HN       LEU  20  34.455  -3.447  -1.829
  139    HA   LEU  20           HA       LEU  20  34.658  -3.368  -4.830
  140    HB2  LEU  20           HB2      LEU  20  36.868  -2.990  -2.794
  141    HB3  LEU  20           HB1      LEU  20  37.034  -2.892  -4.549
  142    HG   LEU  20           HG       LEU  20  35.243  -1.100  -2.882
  143   HD11  LEU  20          HD11      LEU  20  37.649  -0.709  -2.459
  144   HD12  LEU  20          HD12      LEU  20  36.915   0.640  -3.318
  145   HD13  LEU  20          HD13      LEU  20  37.916  -0.518  -4.192
  146   HD21  LEU  20          HD21      LEU  20  35.415   0.244  -5.140
  147   HD22  LEU  20          HD22      LEU  20  34.298  -1.113  -5.041
  148   HD23  LEU  20          HD23      LEU  20  35.863  -1.315  -5.832
  149    H    GLU  21           HN       GLU  21  35.586  -5.125  -5.828
  150    HA   GLU  21           HA       GLU  21  36.211  -7.476  -4.059
  151    HB2  GLU  21           HB2      GLU  21  34.049  -7.667  -5.320
  152    HB3  GLU  21           HB1      GLU  21  34.969  -7.551  -6.819
  153    HG2  GLU  21           HG2      GLU  21  34.628  -9.895  -6.362
  154    HG3  GLU  21           HG1      GLU  21  36.323  -9.540  -6.030
  155    H    GLU  22           HN       GLU  22  38.266  -8.053  -4.232
  156    HA   GLU  22           HA       GLU  22  39.938  -7.055  -6.418
  157    HB2  GLU  22           HB2      GLU  22  41.776  -8.141  -5.170
  158    HB3  GLU  22           HB1      GLU  22  40.807  -7.113  -4.115
  159    HG2  GLU  22           HG2      GLU  22  39.511  -9.142  -3.411
  160    HG3  GLU  22           HG1      GLU  22  40.616 -10.130  -4.367
  161    H    ARG  23           HN       ARG  23  40.719  -8.239  -8.126
  162    HA   ARG  23           HA       ARG  23  40.241 -11.188  -8.128
  163    HB2  ARG  23           HB2      ARG  23  38.322 -10.107  -9.285
  164    HB3  ARG  23           HB1      ARG  23  39.454  -9.335 -10.396
  165    HG2  ARG  23           HG2      ARG  23  40.258 -11.560 -11.121
  166    HG3  ARG  23           HG1      ARG  23  39.119 -12.327 -10.014
  167    HD2  ARG  23           HD2      ARG  23  38.309 -10.452 -12.252
  168    HD3  ARG  23           HD1      ARG  23  38.286 -12.211 -12.374
  169    HE   ARG  23           HE       ARG  23  36.803 -11.523 -10.065
  170   HH11  ARG  23          HH21      ARG  23  36.739 -11.092 -13.486
  171   HH12  ARG  23          HH22      ARG  23  35.012 -11.023 -13.575
  172   HH21  ARG  23          HH11      ARG  23  34.556 -11.436 -10.166
  173   HH22  ARG  23          HH12      ARG  23  33.776 -11.218 -11.697
  174    H    ASP  24           HN       ASP  24  42.186 -12.022  -8.427
  175    HA   ASP  24           HA       ASP  24  44.394 -12.307  -9.168
  176    HB2  ASP  24           HB2      ASP  24  43.033 -11.166 -11.619
  177    HB3  ASP  24           HB1      ASP  24  44.692 -11.767 -11.636
  178    H    ALA  25           HN       ALA  25  44.649  -9.913 -11.488
  179    HA   ALA  25           HA       ALA  25  46.143  -8.128  -9.599
  180    HB1  ALA  25           HB1      ALA  25  46.494  -8.726 -12.549
  181    HB2  ALA  25           HB2      ALA  25  47.610  -9.114 -11.241
  182    HB3  ALA  25           HB3      ALA  25  47.356  -7.434 -11.714
  183    H    GLU  26           HN       GLU  26  43.194  -8.094 -10.307
  184    HA   GLU  26           HA       GLU  26  43.137  -5.222 -11.143
  185    HB2  GLU  26           HB2      GLU  26  41.281  -7.324 -12.298
  186    HB3  GLU  26           HB1      GLU  26  41.315  -5.607 -12.696
  187    HG2  GLU  26           HG2      GLU  26  42.554  -6.543 -14.455
  188    HG3  GLU  26           HG1      GLU  26  43.821  -6.047 -13.334
  189    H    LEU  27           HN       LEU  27  41.238  -4.114 -10.424
  190    HA   LEU  27           HA       LEU  27  39.828  -5.504  -8.160
  191    HB2  LEU  27           HB2      LEU  27  40.308  -2.548  -8.561
  192    HB3  LEU  27           HB1      LEU  27  39.602  -3.309  -7.139
  193    HG   LEU  27           HG       LEU  27  42.413  -3.783  -8.176
  194   HD11  LEU  27          HD11      LEU  27  41.317  -2.161  -5.867
  195   HD12  LEU  27          HD12      LEU  27  42.308  -1.593  -7.211
  196   HD13  LEU  27          HD13      LEU  27  43.009  -2.645  -5.982
  197   HD21  LEU  27          HD21      LEU  27  40.786  -4.961  -5.926
  198   HD22  LEU  27          HD22      LEU  27  42.537  -4.843  -5.767
  199   HD23  LEU  27          HD23      LEU  27  41.838  -5.782  -7.080
  200    H    ILE  28           HN       ILE  28  37.655  -5.613  -8.223
  201    HA   ILE  28           HA       ILE  28  36.254  -4.226 -10.486
  202    HB   ILE  28           HB       ILE  28  35.586  -6.804  -9.050
  203   HG12  ILE  28          HG12      ILE  28  36.318  -6.312 -11.950
  204   HG13  ILE  28          HG11      ILE  28  37.501  -6.780 -10.729
  205   HG21  ILE  28          HG21      ILE  28  34.164  -5.220 -11.203
  206   HG22  ILE  28          HG22      ILE  28  33.523  -5.721  -9.639
  207   HG23  ILE  28          HG23      ILE  28  33.830  -6.923 -10.893
  208   HD11  ILE  28          HD11      ILE  28  34.992  -8.358 -11.358
  209   HD12  ILE  28          HD12      ILE  28  36.304  -8.844 -10.284
  210   HD13  ILE  28          HD13      ILE  28  36.584  -8.724 -12.021
  211    H    CYS  29           HN       CYS  29  34.646  -2.845  -9.992
  212    HA   CYS  29           HA       CYS  29  34.167  -2.180  -7.190
  213    HB2  CYS  29           HB2      CYS  29  33.658  -1.008  -9.814
  214    HB3  CYS  29           HB1      CYS  29  32.261  -0.823  -8.772
  215    H    THR  30           HN       THR  30  32.471  -2.857  -5.922
  216    HA   THR  30           HA       THR  30  30.252  -4.374  -7.256
  217    HB   THR  30           HB       THR  30  30.207  -5.670  -5.045
  218    HG1  THR  30           HG1      THR  30  32.815  -4.564  -4.894
  219   HG21  THR  30          HG21      THR  30  32.747  -6.002  -6.655
  220   HG22  THR  30          HG22      THR  30  31.163  -6.475  -7.269
  221   HG23  THR  30          HG23      THR  30  31.816  -7.253  -5.832
  222    H    GLY  31           HN       GLY  31  28.251  -3.788  -6.652
  223    HA2  GLY  31           HA2      GLY  31  27.242  -2.829  -4.297
  224    HA3  GLY  31           HA1      GLY  31  27.933  -1.379  -5.028
  225    H    GLN  32           HN       GLN  32  25.675  -0.618  -5.079
  226    HA   GLN  32           HA       GLN  32  23.719  -1.939  -6.791
  227    HB2  GLN  32           HB2      GLN  32  23.854   0.830  -5.576
  228    HB3  GLN  32           HB1      GLN  32  22.462   0.219  -6.468
  229    HG2  GLN  32           HG2      GLN  32  22.205  -1.610  -4.863
  230    HG3  GLN  32           HG1      GLN  32  23.645  -1.079  -3.997
  231   HE21  GLN  32          HE21      GLN  32  20.489  -1.094  -3.475
  232   HE22  GLN  32          HE22      GLN  32  20.248   0.429  -2.766
  233    H    ASP  33           HN       ASP  33  25.444   1.184  -7.086
  234    HA   ASP  33           HA       ASP  33  24.914   1.160 -10.016
  235    HB2  ASP  33           HB2      ASP  33  26.105   3.275  -8.195
  236    HB3  ASP  33           HB1      ASP  33  25.804   3.487  -9.921
  237    H    CYS  34           HN       CYS  34  27.143  -0.175  -8.073
  238    HA   CYS  34           HA       CYS  34  29.617   0.690  -9.331
  239    HB2  CYS  34           HB2      CYS  34  28.780  -1.262  -7.285
  240    HB3  CYS  34           HB1      CYS  34  30.188  -1.776  -8.212
  241    H    GLY  35           HN       GLY  35  31.034  -1.218 -10.248
  242    HA2  GLY  35           HA2      GLY  35  30.482  -3.441 -11.577
  243    HA3  GLY  35           HA1      GLY  35  29.543  -2.324 -12.573
  244    H    LEU  36           HN       LEU  36  31.959  -0.455 -11.490
  245    HA   LEU  36           HA       LEU  36  33.383  -0.529 -14.020
  246    HB2  LEU  36           HB2      LEU  36  34.078   0.948 -11.472
  247    HB3  LEU  36           HB1      LEU  36  34.727   1.283 -13.078
  248    HG   LEU  36           HG       LEU  36  31.801   1.463 -12.301
  249   HD11  LEU  36          HD11      LEU  36  33.835   3.639 -12.878
  250   HD12  LEU  36          HD12      LEU  36  33.178   3.245 -11.288
  251   HD13  LEU  36          HD13      LEU  36  32.121   3.894 -12.543
  252   HD21  LEU  36          HD21      LEU  36  31.778   0.990 -14.603
  253   HD22  LEU  36          HD22      LEU  36  33.306   1.823 -14.891
  254   HD23  LEU  36          HD23      LEU  36  31.834   2.749 -14.601
  255    H    ALA  37           HN       ALA  37  35.652  -0.920 -14.298
  256    HA   ALA  37           HA       ALA  37  36.803  -2.821 -12.269
  257    HB1  ALA  37           HB1      ALA  37  36.171  -4.053 -14.251
  258    HB2  ALA  37           HB2      ALA  37  37.928  -3.898 -14.238
  259    HB3  ALA  37           HB3      ALA  37  36.958  -2.867 -15.289
  260    H    TYR  38           HN       TYR  38  38.880  -2.468 -11.673
  261    HA   TYR  38           HA       TYR  38  40.366  -0.248 -13.031
  262    HB2  TYR  38           HB2      TYR  38  40.448  -0.831 -10.076
  263    HB3  TYR  38           HB1      TYR  38  41.133   0.555 -10.920
  264    HD1  TYR  38           HD1      TYR  38  37.876  -1.191 -10.300
  265    HD2  TYR  38           HD2      TYR  38  39.862   2.512 -11.195
  266    HE1  TYR  38           HE1      TYR  38  35.729   0.019 -10.079
  267    HE2  TYR  38           HE2      TYR  38  37.712   3.721 -10.957
  268    HH   TYR  38           HH       TYR  38  34.864   2.173  -9.703
  269    HA   PRO  39           HA       PRO  39  43.224  -3.810 -13.040
  270    HB2  PRO  39           HB2      PRO  39  44.817  -2.996 -15.089
  271    HB3  PRO  39           HB1      PRO  39  43.206  -3.690 -15.359
  272    HG2  PRO  39           HG2      PRO  39  44.072  -0.839 -15.423
  273    HG3  PRO  39           HG1      PRO  39  42.896  -1.684 -16.444
  274    HD2  PRO  39           HD2      PRO  39  42.229  -0.062 -14.286
  275    HD3  PRO  39           HD1      PRO  39  41.166  -1.314 -14.963
  276    H    VAL  40           HN       VAL  40  45.477  -4.084 -12.465
  277    HA   VAL  40           HA       VAL  40  46.534  -1.801 -10.904
  278    HB   VAL  40           HB       VAL  40  47.366  -4.703 -11.099
  279   HG11  VAL  40          HG11      VAL  40  48.729  -4.038  -9.018
  280   HG12  VAL  40          HG12      VAL  40  48.498  -2.370  -9.541
  281   HG13  VAL  40          HG13      VAL  40  49.358  -3.507 -10.577
  282   HG21  VAL  40          HG21      VAL  40  46.064  -3.105  -8.873
  283   HG22  VAL  40          HG22      VAL  40  46.435  -4.828  -8.835
  284   HG23  VAL  40          HG23      VAL  40  45.212  -4.213  -9.947
  285    H    ARG  41           HN       ARG  41  48.261  -0.619 -11.529
  286    HA   ARG  41           HA       ARG  41  49.819  -1.545 -13.933
  287    HB2  ARG  41           HB2      ARG  41  49.072   1.255 -13.054
  288    HB3  ARG  41           HB1      ARG  41  50.168   0.889 -14.388
  289    HG2  ARG  41           HG2      ARG  41  48.397  -0.334 -15.551
  290    HG3  ARG  41           HG1      ARG  41  47.296  -0.070 -14.198
  291    HD2  ARG  41           HD2      ARG  41  46.824   1.563 -15.949
  292    HD3  ARG  41           HD1      ARG  41  47.512   2.392 -14.552
  293    HE   ARG  41           HE       ARG  41  49.589   1.643 -16.407
  294   HH11  ARG  41          HH21      ARG  41  47.004   3.854 -15.846
  295   HH12  ARG  41          HH22      ARG  41  47.708   5.118 -16.797
  296   HH21  ARG  41          HH11      ARG  41  50.516   3.276 -17.648
  297   HH22  ARG  41          HH12      ARG  41  49.694   4.791 -17.817
  298    H    ASP  42           HN       ASP  42  51.900  -1.887 -13.558
  299    HA   ASP  42           HA       ASP  42  53.969  -1.950 -12.484
  300    HB2  ASP  42           HB2      ASP  42  53.086   0.877 -11.840
  301    HB3  ASP  42           HB1      ASP  42  54.687   0.254 -11.442
  302    H    GLY  43           HN       GLY  43  51.564  -2.852 -11.034
  303    HA2  GLY  43           HA2      GLY  43  51.333  -3.892  -8.914
  304    HA3  GLY  43           HA1      GLY  43  52.817  -3.092  -8.395
  305    H    ILE  44           HN       ILE  44  50.823  -0.806  -9.816
  306    HA   ILE  44           HA       ILE  44  49.811   0.027  -7.126
  307    HB   ILE  44           HB       ILE  44  50.305   1.784  -9.532
  308   HG12  ILE  44          HG12      ILE  44  52.005   1.302  -7.062
  309   HG13  ILE  44          HG11      ILE  44  52.394   0.736  -8.688
  310   HG21  ILE  44          HG21      ILE  44  48.649   2.564  -7.803
  311   HG22  ILE  44          HG22      ILE  44  50.079   3.591  -7.902
  312   HG23  ILE  44          HG23      ILE  44  49.918   2.427  -6.588
  313   HD11  ILE  44          HD11      ILE  44  52.331   3.124  -9.461
  314   HD12  ILE  44          HD12      ILE  44  53.611   2.793  -8.293
  315   HD13  ILE  44          HD13      ILE  44  52.138   3.614  -7.778
  316    HA   PRO  45           HA       PRO  45  45.780  -0.657  -9.033
  317    HB2  PRO  45           HB2      PRO  45  44.197   0.253  -7.015
  318    HB3  PRO  45           HB1      PRO  45  45.081  -1.284  -6.911
  319    HG2  PRO  45           HG2      PRO  45  45.789   1.382  -5.757
  320    HG3  PRO  45           HG1      PRO  45  45.888  -0.227  -5.016
  321    HD2  PRO  45           HD2      PRO  45  48.060   1.048  -6.087
  322    HD3  PRO  45           HD1      PRO  45  47.903  -0.725  -6.044
  323    H    VAL  46           HN       VAL  46  44.067   0.588  -9.980
  324    HA   VAL  46           HA       VAL  46  44.722   3.488 -10.259
  325    HB   VAL  46           HB       VAL  46  42.977   1.638 -11.904
  326   HG11  VAL  46          HG11      VAL  46  43.559   4.602 -12.088
  327   HG12  VAL  46          HG12      VAL  46  41.987   3.802 -12.056
  328   HG13  VAL  46          HG13      VAL  46  43.017   3.664 -13.480
  329   HG21  VAL  46          HG21      VAL  46  45.577   3.052 -12.569
  330   HG22  VAL  46          HG22      VAL  46  44.727   1.877 -13.574
  331   HG23  VAL  46          HG23      VAL  46  45.474   1.367 -12.061
  332    H    LEU  47           HN       LEU  47  43.520   4.884  -9.137
  333    HA   LEU  47           HA       LEU  47  40.773   4.089  -8.222
  334    HB2  LEU  47           HB2      LEU  47  42.714   6.101  -7.042
  335    HB3  LEU  47           HB1      LEU  47  41.134   5.687  -6.376
  336    HG   LEU  47           HG       LEU  47  43.430   3.741  -6.764
  337   HD11  LEU  47          HD11      LEU  47  42.308   4.992  -4.239
  338   HD12  LEU  47          HD12      LEU  47  43.863   5.381  -4.974
  339   HD13  LEU  47          HD13      LEU  47  43.582   3.774  -4.305
  340   HD21  LEU  47          HD21      LEU  47  41.514   2.392  -6.863
  341   HD22  LEU  47          HD22      LEU  47  40.584   3.455  -5.806
  342   HD23  LEU  47          HD23      LEU  47  41.829   2.406  -5.129
  343    H    LEU  48           HN       LEU  48  41.810   5.431 -10.785
  344    HA   LEU  48           HA       LEU  48  40.410   8.057 -10.546
  345    HB2  LEU  48           HB2      LEU  48  42.411   6.895 -12.455
  346    HB3  LEU  48           HB1      LEU  48  41.384   8.220 -13.001
  347    HG   LEU  48           HG       LEU  48  43.584   8.957 -12.020
  348   HD11  LEU  48          HD11      LEU  48  42.660  10.890 -11.189
  349   HD12  LEU  48          HD12      LEU  48  41.567  10.041 -10.098
  350   HD13  LEU  48          HD13      LEU  48  41.166  10.192 -11.808
  351   HD21  LEU  48          HD21      LEU  48  43.466   7.060 -10.252
  352   HD22  LEU  48          HD22      LEU  48  42.431   8.160  -9.342
  353   HD23  LEU  48          HD23      LEU  48  44.088   8.625  -9.723
  354    H    VAL  49           HN       VAL  49  38.462   8.334 -11.343
  355    HA   VAL  49           HA       VAL  49  36.891   6.182 -12.373
  356    HB   VAL  49           HB       VAL  49  36.436   9.169 -12.463
  357   HG11  VAL  49          HG11      VAL  49  34.001   8.377 -12.667
  358   HG12  VAL  49          HG12      VAL  49  34.665   6.804 -13.108
  359   HG13  VAL  49          HG13      VAL  49  35.003   8.216 -14.110
  360   HG21  VAL  49          HG21      VAL  49  35.285   7.064 -10.611
  361   HG22  VAL  49          HG22      VAL  49  35.107   8.813 -10.476
  362   HG23  VAL  49          HG23      VAL  49  36.679   8.062 -10.201
  363    H    ASP  50           HN       ASP  50  38.487   8.931 -13.947
  364    HA   ASP  50           HA       ASP  50  37.497   8.464 -16.587
  365    HB2  ASP  50           HB2      ASP  50  39.964   9.801 -15.486
  366    HB3  ASP  50           HB1      ASP  50  39.726   9.655 -17.226
  367    H    GLU  51           HN       GLU  51  40.312   7.149 -14.870
  368    HA   GLU  51           HA       GLU  51  41.202   5.665 -17.255
  369    HB2  GLU  51           HB2      GLU  51  42.084   5.616 -14.358
  370    HB3  GLU  51           HB1      GLU  51  42.878   4.715 -15.648
  371    HG2  GLU  51           HG2      GLU  51  43.355   6.816 -16.838
  372    HG3  GLU  51           HG1      GLU  51  42.523   7.729 -15.577
  373    H    ALA  52           HN       ALA  52  38.859   5.245 -14.849
  374    HA   ALA  52           HA       ALA  52  38.989   2.468 -14.278
  375    HB1  ALA  52           HB1      ALA  52  36.653   2.627 -13.696
  376    HB2  ALA  52           HB2      ALA  52  36.460   4.074 -14.689
  377    HB3  ALA  52           HB3      ALA  52  37.436   4.131 -13.225
  378    H    ARG  53           HN       ARG  53  38.146   0.648 -15.304
  379    HA   ARG  53           HA       ARG  53  37.488   1.001 -18.207
  380    HB2  ARG  53           HB2      ARG  53  38.490  -1.409 -16.682
  381    HB3  ARG  53           HB1      ARG  53  38.195  -1.353 -18.420
  382    HG2  ARG  53           HG2      ARG  53  40.067   0.606 -17.081
  383    HG3  ARG  53           HG1      ARG  53  40.627  -0.980 -17.604
  384    HD2  ARG  53           HD2      ARG  53  39.768  -0.457 -19.907
  385    HD3  ARG  53           HD1      ARG  53  39.402   1.173 -19.363
  386    HE   ARG  53           HE       ARG  53  42.103   0.048 -19.773
  387   HH11  ARG  53          HH21      ARG  53  40.078   2.612 -18.627
  388   HH12  ARG  53          HH22      ARG  53  41.347   3.786 -18.660
  389   HH21  ARG  53          HH11      ARG  53  43.737   1.564 -19.818
  390   HH22  ARG  53          HH12      ARG  53  43.417   3.194 -19.331
  391    H    ARG  54           HN       ARG  54  35.725  -0.010 -19.088
  392    HA   ARG  54           HA       ARG  54  33.560  -0.550 -17.196
  393    HB2  ARG  54           HB2      ARG  54  33.776  -0.140 -20.163
  394    HB3  ARG  54           HB1      ARG  54  32.326  -0.911 -19.520
  395    HG2  ARG  54           HG2      ARG  54  32.079   1.561 -19.701
  396    HG3  ARG  54           HG1      ARG  54  31.938   0.992 -18.035
  397    HD2  ARG  54           HD2      ARG  54  34.166   1.682 -17.508
  398    HD3  ARG  54           HD1      ARG  54  34.554   1.951 -19.208
  399    HE   ARG  54           HE       ARG  54  32.344   3.609 -18.346
  400   HH11  ARG  54          HH21      ARG  54  35.769   3.199 -18.306
  401   HH12  ARG  54          HH22      ARG  54  36.097   4.892 -18.147
  402   HH21  ARG  54          HH11      ARG  54  32.755   5.806 -18.137
  403   HH22  ARG  54          HH12      ARG  54  34.390   6.368 -18.051
  404    HA   PRO  55           HA       PRO  55  33.585  -4.965 -17.049
  405    HB2  PRO  55           HB2      PRO  55  30.859  -4.899 -18.301
  406    HB3  PRO  55           HB1      PRO  55  31.404  -5.736 -16.834
  407    HG2  PRO  55           HG2      PRO  55  29.971  -3.457 -16.743
  408    HG3  PRO  55           HG1      PRO  55  31.195  -3.862 -15.527
  409    HD2  PRO  55           HD2      PRO  55  31.297  -1.805 -17.660
  410    HD3  PRO  55           HD1      PRO  55  32.207  -1.912 -16.138
  411    H    GLU  56           HN       GLU  56  34.222  -6.620 -18.386
  412    HA   GLU  56           HA       GLU  56  34.744  -6.067 -21.173
  413    HB2  GLU  56           HB2      GLU  56  34.885  -8.634 -19.565
  414    HB3  GLU  56           HB1      GLU  56  35.497  -8.462 -21.208
  415    HG2  GLU  56           HG2      GLU  56  36.403  -6.779 -18.850
  416    HG3  GLU  56           HG1      GLU  56  37.279  -8.177 -19.476
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1  39.465   8.919  14.580
    2    H2   MET   1           HT2      MET   1  39.928  10.318  15.425
    3    H3   MET   1           HT3      MET   1  38.291  10.046  15.058
    4    HA   MET   1           HA       MET   1  39.959   8.918  17.139
    5    HB2  MET   1           HB2      MET   1  37.142   9.900  16.776
    6    HB3  MET   1           HB1      MET   1  37.499   8.843  18.141
    7    HG2  MET   1           HG2      MET   1  39.108  10.363  19.028
    8    HG3  MET   1           HG1      MET   1  39.135  11.314  17.542
    9    HE1  MET   1           HE1      MET   1  36.098  11.274  20.925
   10    HE2  MET   1           HE2      MET   1  37.852  11.299  21.090
   11    HE3  MET   1           HE3      MET   1  37.065   9.909  20.350
   12    HA   PRO   2           HA       PRO   2  39.062   4.709  16.131
   13    HB2  PRO   2           HB2      PRO   2  38.916   3.584  18.646
   14    HB3  PRO   2           HB1      PRO   2  40.440   4.090  17.891
   15    HG2  PRO   2           HG2      PRO   2  38.773   5.517  19.921
   16    HG3  PRO   2           HG1      PRO   2  40.538   5.352  19.825
   17    HD2  PRO   2           HD2      PRO   2  39.245   7.608  19.028
   18    HD3  PRO   2           HD1      PRO   2  40.751   7.050  18.267
   19    H    LEU   3           HN       LEU   3  36.904   6.554  18.090
   20    HA   LEU   3           HA       LEU   3  34.761   4.492  17.996
   21    HB2  LEU   3           HB2      LEU   3  34.732   7.285  19.197
   22    HB3  LEU   3           HB1      LEU   3  33.533   6.016  19.449
   23    HG   LEU   3           HG       LEU   3  36.457   5.818  20.226
   24   HD11  LEU   3          HD11      LEU   3  35.246   7.414  21.644
   25   HD12  LEU   3          HD12      LEU   3  35.581   5.936  22.546
   26   HD13  LEU   3          HD13      LEU   3  33.964   6.231  21.905
   27   HD21  LEU   3          HD21      LEU   3  35.760   3.606  19.858
   28   HD22  LEU   3          HD22      LEU   3  34.102   3.934  20.366
   29   HD23  LEU   3          HD23      LEU   3  35.389   3.822  21.565
   30    H    GLU   4           HN       GLU   4  35.928   7.075  16.160
   31    HA   GLU   4           HA       GLU   4  33.252   7.475  14.841
   32    HB2  GLU   4           HB2      GLU   4  35.693   9.269  14.989
   33    HB3  GLU   4           HB1      GLU   4  34.302   9.582  13.949
   34    HG2  GLU   4           HG2      GLU   4  32.821   9.623  15.900
   35    HG3  GLU   4           HG1      GLU   4  34.181   9.255  16.960
   36    H    ALA   5           HN       ALA   5  36.754   7.396  14.109
   37    HA   ALA   5           HA       ALA   5  36.167   6.651  11.306
   38    HB1  ALA   5           HB1      ALA   5  38.510   6.987  10.915
   39    HB2  ALA   5           HB2      ALA   5  38.880   6.902  12.637
   40    HB3  ALA   5           HB3      ALA   5  37.999   8.288  11.992
   41    H    GLY   6           HN       GLY   6  38.311   5.355  13.852
   42    HA2  GLY   6           HA2      GLY   6  38.899   3.153  14.385
   43    HA3  GLY   6           HA1      GLY   6  37.332   2.680  13.734
   44    H    LEU   7           HN       LEU   7  37.720   1.062  12.372
   45    HA   LEU   7           HA       LEU   7  40.143   0.941  10.756
   46    HB2  LEU   7           HB2      LEU   7  38.522  -0.986  11.799
   47    HB3  LEU   7           HB1      LEU   7  37.848  -0.901  10.173
   48    HG   LEU   7           HG       LEU   7  40.389  -0.982   9.423
   49   HD11  LEU   7          HD11      LEU   7  41.893  -1.997  10.925
   50   HD12  LEU   7          HD12      LEU   7  40.605  -2.524  12.007
   51   HD13  LEU   7          HD13      LEU   7  41.049  -0.822  11.931
   52   HD21  LEU   7          HD21      LEU   7  38.874  -2.726   8.805
   53   HD22  LEU   7          HD22      LEU   7  38.775  -3.315  10.464
   54   HD23  LEU   7          HD23      LEU   7  40.267  -3.515   9.545
   55    H    LEU   8           HN       LEU   8  39.306  -0.097   8.386
   56    HA   LEU   8           HA       LEU   8  38.698   2.226   6.851
   57    HB2  LEU   8           HB2      LEU   8  38.594  -0.726   6.150
   58    HB3  LEU   8           HB1      LEU   8  38.406   0.566   4.971
   59    HG   LEU   8           HG       LEU   8  40.809   0.326   6.802
   60   HD11  LEU   8          HD11      LEU   8  40.881  -1.619   5.410
   61   HD12  LEU   8          HD12      LEU   8  41.960  -0.443   4.659
   62   HD13  LEU   8          HD13      LEU   8  40.348  -0.708   3.997
   63   HD21  LEU   8          HD21      LEU   8  40.821   2.527   6.048
   64   HD22  LEU   8          HD22      LEU   8  39.996   2.144   4.539
   65   HD23  LEU   8          HD23      LEU   8  41.701   1.759   4.736
   66    H    GLU   9           HN       GLU   9  36.729  -0.512   7.891
   67    HA   GLU   9           HA       GLU   9  34.420  -0.868   7.809
   68    HB2  GLU   9           HB2      GLU   9  34.573   2.103   8.359
   69    HB3  GLU   9           HB1      GLU   9  33.083   1.162   8.463
   70    HG2  GLU   9           HG2      GLU   9  34.099  -0.303  10.153
   71    HG3  GLU   9           HG1      GLU   9  35.617   0.586  10.031
   72    H    ILE  10           HN       ILE  10  33.951  -1.496   5.771
   73    HA   ILE  10           HA       ILE  10  33.161  -1.394   3.580
   74    HB   ILE  10           HB       ILE  10  31.955   1.157   4.679
   75   HG12  ILE  10          HG12      ILE  10  30.690  -1.564   4.238
   76   HG13  ILE  10          HG11      ILE  10  31.379  -1.067   5.785
   77   HG21  ILE  10          HG21      ILE  10  30.296   0.711   2.774
   78   HG22  ILE  10          HG22      ILE  10  31.510  -0.385   2.114
   79   HG23  ILE  10          HG23      ILE  10  31.878   1.330   2.301
   80   HD11  ILE  10          HD11      ILE  10  29.116   0.294   4.294
   81   HD12  ILE  10          HD12      ILE  10  29.870   0.932   5.756
   82   HD13  ILE  10          HD13      ILE  10  28.991  -0.597   5.811
   83    H    LEU  11           HN       LEU  11  34.640  -1.121   2.064
   84    HA   LEU  11           HA       LEU  11  36.331   1.251   1.912
   85    HB2  LEU  11           HB2      LEU  11  36.037  -1.259   0.253
   86    HB3  LEU  11           HB1      LEU  11  37.064   0.073  -0.286
   87    HG   LEU  11           HG       LEU  11  38.294  -0.027   1.865
   88   HD11  LEU  11          HD11      LEU  11  36.317  -2.255   2.369
   89   HD12  LEU  11          HD12      LEU  11  36.743  -0.901   3.417
   90   HD13  LEU  11          HD13      LEU  11  37.881  -2.227   3.186
   91   HD21  LEU  11          HD21      LEU  11  39.073  -1.315  -0.112
   92   HD22  LEU  11          HD22      LEU  11  38.121  -2.697   0.432
   93   HD23  LEU  11          HD23      LEU  11  39.480  -2.126   1.400
   94    H    ALA  12           HN       ALA  12  36.327   2.791   0.291
   95    HA   ALA  12           HA       ALA  12  33.791   2.997  -1.306
   96    HB1  ALA  12           HB1      ALA  12  35.535   5.251  -0.275
   97    HB2  ALA  12           HB2      ALA  12  34.049   4.702   0.499
   98    HB3  ALA  12           HB3      ALA  12  33.992   5.404  -1.116
   99    H    CYS  13           HN       CYS  13  33.960   3.798  -3.390
  100    HA   CYS  13           HA       CYS  13  36.680   3.877  -4.549
  101    HB2  CYS  13           HB2      CYS  13  34.916   2.997  -6.577
  102    HB3  CYS  13           HB1      CYS  13  36.118   2.022  -5.754
  103    HA   PRO  14           HA       PRO  14  35.695   7.620  -6.581
  104    HB2  PRO  14           HB2      PRO  14  36.346   6.469  -9.256
  105    HB3  PRO  14           HB1      PRO  14  37.134   7.795  -8.378
  106    HG2  PRO  14           HG2      PRO  14  38.303   5.407  -8.640
  107    HG3  PRO  14           HG1      PRO  14  38.469   6.370  -7.158
  108    HD2  PRO  14           HD2      PRO  14  36.712   3.990  -7.673
  109    HD3  PRO  14           HD1      PRO  14  37.683   4.405  -6.249
  110    H    ALA  15           HN       ALA  15  33.981   8.658  -7.493
  111    HA   ALA  15           HA       ALA  15  31.758   8.879  -8.218
  112    HB1  ALA  15           HB1      ALA  15  31.461   8.209 -10.528
  113    HB2  ALA  15           HB2      ALA  15  32.789   7.054 -10.406
  114    HB3  ALA  15           HB3      ALA  15  33.115   8.785 -10.322
  115    H    CYS  16           HN       CYS  16  32.627   6.332  -6.646
  116    HA   CYS  16           HA       CYS  16  29.998   5.205  -6.463
  117    HB2  CYS  16           HB2      CYS  16  30.439   2.978  -7.364
  118    HB3  CYS  16           HB1      CYS  16  30.645   4.188  -8.624
  119    H    HIS  17           HN       HIS  17  29.908   4.594  -4.417
  120    HA   HIS  17           HA       HIS  17  32.380   3.697  -3.008
  121    HB2  HIS  17           HB2      HIS  17  31.369   4.516  -0.960
  122    HB3  HIS  17           HB1      HIS  17  31.383   5.805  -2.161
  123    HD2  HIS  17           HD2      HIS  17  28.844   3.945   0.040
  124    HE1  HIS  17           HE1      HIS  17  26.593   6.030  -2.864
  125    HE2  HIS  17           HE2      HIS  17  26.464   4.720  -0.695
  126    H    ALA  18           HN       ALA  18  32.440   1.602  -2.709
  127    HA   ALA  18           HA       ALA  18  30.436   0.186  -1.308
  128    HB1  ALA  18           HB1      ALA  18  29.061  -0.667  -2.922
  129    HB2  ALA  18           HB2      ALA  18  30.432  -1.187  -3.908
  130    HB3  ALA  18           HB3      ALA  18  29.818   0.458  -4.035
  131    HA   PRO  19           HA       PRO  19  33.520  -2.881  -0.692
  132    HB2  PRO  19           HB2      PRO  19  31.866  -4.986  -2.038
  133    HB3  PRO  19           HB1      PRO  19  32.555  -4.968  -0.401
  134    HG2  PRO  19           HG2      PRO  19  29.951  -4.563  -0.819
  135    HG3  PRO  19           HG1      PRO  19  30.832  -3.693   0.450
  136    HD2  PRO  19           HD2      PRO  19  29.891  -2.703  -2.207
  137    HD3  PRO  19           HD1      PRO  19  30.013  -1.853  -0.655
  138    H    LEU  20           HN       LEU  20  35.285  -3.822  -1.696
  139    HA   LEU  20           HA       LEU  20  35.269  -3.845  -4.704
  140    HB2  LEU  20           HB2      LEU  20  37.592  -3.185  -2.858
  141    HB3  LEU  20           HB1      LEU  20  37.603  -3.145  -4.621
  142    HG   LEU  20           HG       LEU  20  35.812  -1.434  -2.865
  143   HD11  LEU  20          HD11      LEU  20  38.275  -0.710  -4.479
  144   HD12  LEU  20          HD12      LEU  20  38.195  -0.790  -2.718
  145   HD13  LEU  20          HD13      LEU  20  37.255   0.421  -3.591
  146   HD21  LEU  20          HD21      LEU  20  34.647  -1.600  -4.862
  147   HD22  LEU  20          HD22      LEU  20  36.103  -1.841  -5.833
  148   HD23  LEU  20          HD23      LEU  20  35.695  -0.240  -5.235
  149    H    GLU  21           HN       GLU  21  36.145  -5.554  -5.716
  150    HA   GLU  21           HA       GLU  21  37.307  -7.748  -3.997
  151    HB2  GLU  21           HB2      GLU  21  36.092  -9.384  -5.270
  152    HB3  GLU  21           HB1      GLU  21  34.930  -8.181  -4.723
  153    HG2  GLU  21           HG2      GLU  21  35.202  -7.032  -6.948
  154    HG3  GLU  21           HG1      GLU  21  36.160  -8.412  -7.483
  155    H    GLU  22           HN       GLU  22  39.127  -8.624  -4.742
  156    HA   GLU  22           HA       GLU  22  40.408  -7.437  -7.096
  157    HB2  GLU  22           HB2      GLU  22  41.683  -7.856  -5.009
  158    HB3  GLU  22           HB1      GLU  22  41.410  -9.589  -5.204
  159    HG2  GLU  22           HG2      GLU  22  42.596  -9.564  -7.347
  160    HG3  GLU  22           HG1      GLU  22  42.806  -7.819  -7.231
  161    H    ARG  23           HN       ARG  23  40.741  -8.396  -9.013
  162    HA   ARG  23           HA       ARG  23  40.629 -11.231  -9.479
  163    HB2  ARG  23           HB2      ARG  23  38.178 -10.651  -9.051
  164    HB3  ARG  23           HB1      ARG  23  38.237  -9.725 -10.550
  165    HG2  ARG  23           HG2      ARG  23  38.956 -11.745 -11.770
  166    HG3  ARG  23           HG1      ARG  23  38.889 -12.671 -10.269
  167    HD2  ARG  23           HD2      ARG  23  36.462 -12.024 -10.066
  168    HD3  ARG  23           HD1      ARG  23  36.574 -11.313 -11.676
  169    HE   ARG  23           HE       ARG  23  37.478 -14.083 -11.609
  170   HH11  ARG  23          HH21      ARG  23  34.766 -11.932 -11.819
  171   HH12  ARG  23          HH22      ARG  23  33.764 -13.083 -12.641
  172   HH21  ARG  23          HH11      ARG  23  36.172 -15.575 -12.673
  173   HH22  ARG  23          HH12      ARG  23  34.557 -15.136 -13.121
  174    H    ASP  24           HN       ASP  24  41.039 -11.745 -11.665
  175    HA   ASP  24           HA       ASP  24  42.120 -11.426 -13.705
  176    HB2  ASP  24           HB2      ASP  24  40.222  -9.082 -13.616
  177    HB3  ASP  24           HB1      ASP  24  41.239  -9.413 -15.017
  178    H    ALA  25           HN       ALA  25  43.401 -10.423 -11.323
  179    HA   ALA  25           HA       ALA  25  45.332  -9.230 -10.777
  180    HB1  ALA  25           HB1      ALA  25  45.575  -8.409 -13.666
  181    HB2  ALA  25           HB2      ALA  25  45.883 -10.073 -13.170
  182    HB3  ALA  25           HB3      ALA  25  46.850  -8.760 -12.501
  183    H    GLU  26           HN       GLU  26  42.554  -7.970 -11.200
  184    HA   GLU  26           HA       GLU  26  43.517  -5.166 -10.846
  185    HB2  GLU  26           HB2      GLU  26  41.571  -4.396 -12.250
  186    HB3  GLU  26           HB1      GLU  26  42.853  -5.193 -13.157
  187    HG2  GLU  26           HG2      GLU  26  41.585  -7.276 -13.169
  188    HG3  GLU  26           HG1      GLU  26  40.321  -6.545 -12.180
  189    H    LEU  27           HN       LEU  27  41.540  -3.774 -10.176
  190    HA   LEU  27           HA       LEU  27  40.113  -5.303  -8.014
  191    HB2  LEU  27           HB2      LEU  27  40.556  -2.316  -8.313
  192    HB3  LEU  27           HB1      LEU  27  39.879  -3.141  -6.911
  193    HG   LEU  27           HG       LEU  27  42.678  -3.548  -8.004
  194   HD11  LEU  27          HD11      LEU  27  41.873  -2.310  -5.367
  195   HD12  LEU  27          HD12      LEU  27  42.128  -1.340  -6.817
  196   HD13  LEU  27          HD13      LEU  27  43.457  -2.286  -6.142
  197   HD21  LEU  27          HD21      LEU  27  42.821  -4.692  -5.626
  198   HD22  LEU  27          HD22      LEU  27  42.150  -5.585  -6.983
  199   HD23  LEU  27          HD23      LEU  27  41.072  -4.839  -5.802
  200    H    ILE  28           HN       ILE  28  38.045  -5.691  -8.260
  201    HA   ILE  28           HA       ILE  28  36.484  -4.092 -10.264
  202    HB   ILE  28           HB       ILE  28  35.830  -6.831  -9.157
  203   HG12  ILE  28          HG12      ILE  28  37.944  -6.996 -10.349
  204   HG13  ILE  28          HG11      ILE  28  36.668  -7.653 -11.374
  205   HG21  ILE  28          HG21      ILE  28  34.415  -6.883 -11.238
  206   HG22  ILE  28          HG22      ILE  28  34.830  -5.190 -11.492
  207   HG23  ILE  28          HG23      ILE  28  33.911  -5.666 -10.064
  208   HD11  ILE  28          HD11      ILE  28  36.531  -5.219 -12.337
  209   HD12  ILE  28          HD12      ILE  28  37.845  -6.262 -12.854
  210   HD13  ILE  28          HD13      ILE  28  38.129  -5.034 -11.624
  211    H    CYS  29           HN       CYS  29  34.701  -3.054  -9.687
  212    HA   CYS  29           HA       CYS  29  34.186  -2.587  -6.872
  213    HB2  CYS  29           HB2      CYS  29  33.007  -1.646  -9.455
  214    HB3  CYS  29           HB1      CYS  29  32.106  -1.371  -7.970
  215    H    THR  30           HN       THR  30  32.927  -3.753  -5.578
  216    HA   THR  30           HA       THR  30  30.915  -5.611  -6.830
  217    HB   THR  30           HB       THR  30  32.352  -5.874  -4.168
  218    HG1  THR  30           HG1      THR  30  32.766  -7.034  -6.716
  219   HG21  THR  30          HG21      THR  30  30.511  -7.689  -5.740
  220   HG22  THR  30          HG22      THR  30  30.183  -6.955  -4.171
  221   HG23  THR  30          HG23      THR  30  31.428  -8.195  -4.322
  222    H    GLY  31           HN       GLY  31  29.006  -4.638  -6.681
  223    HA2  GLY  31           HA2      GLY  31  27.696  -4.309  -4.176
  224    HA3  GLY  31           HA1      GLY  31  28.192  -2.719  -4.751
  225    H    GLN  32           HN       GLN  32  25.613  -2.903  -4.539
  226    HA   GLN  32           HA       GLN  32  24.082  -4.126  -6.600
  227    HB2  GLN  32           HB2      GLN  32  23.603  -1.601  -4.978
  228    HB3  GLN  32           HB1      GLN  32  22.393  -2.320  -6.044
  229    HG2  GLN  32           HG2      GLN  32  22.459  -4.404  -4.770
  230    HG3  GLN  32           HG1      GLN  32  23.732  -3.756  -3.734
  231   HE21  GLN  32          HE21      GLN  32  20.444  -4.271  -3.796
  232   HE22  GLN  32          HE22      GLN  32  19.949  -3.053  -2.722
  233    H    ASP  33           HN       ASP  33  25.218  -0.741  -6.347
  234    HA   ASP  33           HA       ASP  33  24.811  -0.441  -9.299
  235    HB2  ASP  33           HB2      ASP  33  25.218   1.582  -7.074
  236    HB3  ASP  33           HB1      ASP  33  25.176   2.005  -8.787
  237    H    CYS  34           HN       CYS  34  27.183  -1.293  -7.144
  238    HA   CYS  34           HA       CYS  34  29.383   0.129  -8.545
  239    HB2  CYS  34           HB2      CYS  34  29.002  -0.857  -5.902
  240    HB3  CYS  34           HB1      CYS  34  30.299  -1.829  -6.586
  241    H    GLY  35           HN       GLY  35  30.061  -0.743 -10.359
  242    HA2  GLY  35           HA2      GLY  35  30.715  -3.630 -10.465
  243    HA3  GLY  35           HA1      GLY  35  29.562  -3.037 -11.663
  244    H    LEU  36           HN       LEU  36  31.733  -0.618 -10.795
  245    HA   LEU  36           HA       LEU  36  32.957  -0.551 -13.407
  246    HB2  LEU  36           HB2      LEU  36  33.781   0.920 -10.883
  247    HB3  LEU  36           HB1      LEU  36  34.226   1.344 -12.536
  248    HG   LEU  36           HG       LEU  36  31.394   1.273 -11.455
  249   HD11  LEU  36          HD11      LEU  36  32.913   3.145 -10.637
  250   HD12  LEU  36          HD12      LEU  36  31.468   3.670 -11.500
  251   HD13  LEU  36          HD13      LEU  36  33.031   3.670 -12.316
  252   HD21  LEU  36          HD21      LEU  36  31.111   2.595 -13.729
  253   HD22  LEU  36          HD22      LEU  36  31.154   0.838 -13.741
  254   HD23  LEU  36          HD23      LEU  36  32.596   1.756 -14.179
  255    H    ALA  37           HN       ALA  37  35.208  -0.727 -13.879
  256    HA   ALA  37           HA       ALA  37  36.636  -2.674 -12.080
  257    HB1  ALA  37           HB1      ALA  37  36.553  -2.424 -15.092
  258    HB2  ALA  37           HB2      ALA  37  36.061  -3.798 -14.107
  259    HB3  ALA  37           HB3      ALA  37  37.769  -3.380 -14.242
  260    H    TYR  38           HN       TYR  38  38.553  -2.101 -11.359
  261    HA   TYR  38           HA       TYR  38  39.869   0.304 -12.530
  262    HB2  TYR  38           HB2      TYR  38  39.726  -0.658  -9.692
  263    HB3  TYR  38           HB1      TYR  38  40.896   0.546 -10.232
  264    HD1  TYR  38           HD1      TYR  38  40.176   2.750 -11.015
  265    HD2  TYR  38           HD2      TYR  38  37.339  -0.164  -9.637
  266    HE1  TYR  38           HE1      TYR  38  38.437   4.512 -10.873
  267    HE2  TYR  38           HE2      TYR  38  35.599   1.596  -9.495
  268    HH   TYR  38           HH       TYR  38  36.082   4.767 -10.815
  269    HA   PRO  39           HA       PRO  39  43.012  -2.872 -13.268
  270    HB2  PRO  39           HB2      PRO  39  44.639  -1.394 -14.878
  271    HB3  PRO  39           HB1      PRO  39  43.112  -2.100 -15.444
  272    HG2  PRO  39           HG2      PRO  39  43.718   0.706 -14.654
  273    HG3  PRO  39           HG1      PRO  39  42.664   0.099 -15.942
  274    HD2  PRO  39           HD2      PRO  39  41.773   1.002 -13.476
  275    HD3  PRO  39           HD1      PRO  39  40.859  -0.100 -14.541
  276    H    VAL  40           HN       VAL  40  45.360  -3.066 -12.923
  277    HA   VAL  40           HA       VAL  40  46.360  -1.168 -10.838
  278    HB   VAL  40           HB       VAL  40  45.751  -3.494 -10.046
  279   HG11  VAL  40          HG11      VAL  40  46.651  -4.551 -12.204
  280   HG12  VAL  40          HG12      VAL  40  47.104  -5.347 -10.697
  281   HG13  VAL  40          HG13      VAL  40  48.261  -4.307 -11.527
  282   HG21  VAL  40          HG21      VAL  40  47.370  -1.999  -8.891
  283   HG22  VAL  40          HG22      VAL  40  48.671  -2.698  -9.855
  284   HG23  VAL  40          HG23      VAL  40  47.784  -3.702  -8.708
  285    H    ARG  41           HN       ARG  41  48.284  -0.270 -11.110
  286    HA   ARG  41           HA       ARG  41  49.801  -1.020 -13.575
  287    HB2  ARG  41           HB2      ARG  41  49.772   1.463 -11.844
  288    HB3  ARG  41           HB1      ARG  41  50.939   1.207 -13.141
  289    HG2  ARG  41           HG2      ARG  41  48.055   0.771 -13.852
  290    HG3  ARG  41           HG1      ARG  41  48.540   2.433 -13.543
  291    HD2  ARG  41           HD2      ARG  41  48.809   1.921 -15.921
  292    HD3  ARG  41           HD1      ARG  41  50.388   2.193 -15.186
  293    HE   ARG  41           HE       ARG  41  49.549  -0.621 -15.245
  294   HH11  ARG  41          HH21      ARG  41  51.172   1.995 -16.826
  295   HH12  ARG  41          HH22      ARG  41  52.154   0.953 -17.803
  296   HH21  ARG  41          HH11      ARG  41  50.827  -1.973 -16.506
  297   HH22  ARG  41          HH12      ARG  41  51.957  -1.285 -17.622
  298    H    ASP  42           HN       ASP  42  51.174  -2.596 -13.056
  299    HA   ASP  42           HA       ASP  42  52.949  -3.716 -12.039
  300    HB2  ASP  42           HB2      ASP  42  53.657  -0.829 -11.493
  301    HB3  ASP  42           HB1      ASP  42  54.733  -2.171 -11.106
  302    H    GLY  43           HN       GLY  43  50.548  -3.446 -10.525
  303    HA2  GLY  43           HA2      GLY  43  50.014  -4.294  -8.368
  304    HA3  GLY  43           HA1      GLY  43  51.658  -3.951  -7.836
  305    H    ILE  44           HN       ILE  44  50.421  -1.329  -9.534
  306    HA   ILE  44           HA       ILE  44  49.730   0.074  -6.971
  307    HB   ILE  44           HB       ILE  44  50.643   1.333  -9.551
  308   HG12  ILE  44          HG12      ILE  44  52.416  -0.136  -8.732
  309   HG13  ILE  44          HG11      ILE  44  52.843   1.533  -8.359
  310   HG21  ILE  44          HG21      ILE  44  50.414   2.279  -6.675
  311   HG22  ILE  44          HG22      ILE  44  49.425   2.817  -8.031
  312   HG23  ILE  44          HG23      ILE  44  51.142   3.217  -7.977
  313   HD11  ILE  44          HD11      ILE  44  53.279   0.440  -6.329
  314   HD12  ILE  44          HD12      ILE  44  51.900  -0.635  -6.499
  315   HD13  ILE  44          HD13      ILE  44  51.651   1.048  -6.059
  316    HA   PRO  45           HA       PRO  45  45.630  -0.204  -9.021
  317    HB2  PRO  45           HB2      PRO  45  44.945   1.025  -6.385
  318    HB3  PRO  45           HB1      PRO  45  44.177  -0.334  -7.229
  319    HG2  PRO  45           HG2      PRO  45  45.753  -0.745  -5.131
  320    HG3  PRO  45           HG1      PRO  45  45.778  -1.845  -6.525
  321    HD2  PRO  45           HD2      PRO  45  47.757   0.267  -5.754
  322    HD3  PRO  45           HD1      PRO  45  48.015  -1.325  -6.499
  323    H    VAL  46           HN       VAL  46  44.705   1.353 -10.244
  324    HA   VAL  46           HA       VAL  46  45.441   4.216  -9.672
  325    HB   VAL  46           HB       VAL  46  44.592   4.430 -12.152
  326   HG11  VAL  46          HG11      VAL  46  47.168   2.979 -11.478
  327   HG12  VAL  46          HG12      VAL  46  46.926   4.724 -11.400
  328   HG13  VAL  46          HG13      VAL  46  46.849   3.895 -12.951
  329   HG21  VAL  46          HG21      VAL  46  45.423   1.519 -12.174
  330   HG22  VAL  46          HG22      VAL  46  44.682   2.456 -13.469
  331   HG23  VAL  46          HG23      VAL  46  43.729   2.001 -12.056
  332    H    LEU  47           HN       LEU  47  43.841   4.797  -8.280
  333    HA   LEU  47           HA       LEU  47  41.030   4.166  -8.744
  334    HB2  LEU  47           HB2      LEU  47  42.265   6.215  -6.872
  335    HB3  LEU  47           HB1      LEU  47  40.626   5.571  -6.790
  336    HG   LEU  47           HG       LEU  47  43.156   3.926  -6.504
  337   HD11  LEU  47          HD11      LEU  47  42.583   5.521  -4.604
  338   HD12  LEU  47          HD12      LEU  47  42.659   3.815  -4.163
  339   HD13  LEU  47          HD13      LEU  47  41.096   4.597  -4.392
  340   HD21  LEU  47          HD21      LEU  47  41.554   2.430  -7.336
  341   HD22  LEU  47          HD22      LEU  47  40.211   3.272  -6.561
  342   HD23  LEU  47          HD23      LEU  47  41.305   2.280  -5.600
  343    H    LEU  48           HN       LEU  48  42.063   5.316 -11.019
  344    HA   LEU  48           HA       LEU  48  40.948   8.104 -11.023
  345    HB2  LEU  48           HB2      LEU  48  42.812   6.762 -13.000
  346    HB3  LEU  48           HB1      LEU  48  42.265   8.437 -13.064
  347    HG   LEU  48           HG       LEU  48  43.855   7.211 -10.792
  348   HD11  LEU  48          HD11      LEU  48  44.663   9.052 -13.062
  349   HD12  LEU  48          HD12      LEU  48  45.251   7.414 -12.773
  350   HD13  LEU  48          HD13      LEU  48  45.671   8.713 -11.656
  351   HD21  LEU  48          HD21      LEU  48  42.647   9.928 -11.303
  352   HD22  LEU  48          HD22      LEU  48  44.129   9.801 -10.355
  353   HD23  LEU  48          HD23      LEU  48  42.670   8.981  -9.816
  354    H    VAL  49           HN       VAL  49  39.197   8.516 -12.158
  355    HA   VAL  49           HA       VAL  49  37.563   6.428 -13.225
  356    HB   VAL  49           HB       VAL  49  37.410   9.440 -13.565
  357   HG11  VAL  49          HG11      VAL  49  35.526   7.208 -14.354
  358   HG12  VAL  49          HG12      VAL  49  36.174   8.490 -15.377
  359   HG13  VAL  49          HG13      VAL  49  34.979   8.870 -14.135
  360   HG21  VAL  49          HG21      VAL  49  35.691   9.275 -11.829
  361   HG22  VAL  49          HG22      VAL  49  37.182   8.537 -11.242
  362   HG23  VAL  49          HG23      VAL  49  35.854   7.520 -11.801
  363    H    ASP  50           HN       ASP  50  39.785   8.738 -14.686
  364    HA   ASP  50           HA       ASP  50  39.084   8.347 -17.413
  365    HB2  ASP  50           HB2      ASP  50  41.716   9.075 -16.089
  366    HB3  ASP  50           HB1      ASP  50  41.504   9.045 -17.839
  367    H    GLU  51           HN       GLU  51  41.313   6.597 -15.292
  368    HA   GLU  51           HA       GLU  51  42.010   4.708 -17.465
  369    HB2  GLU  51           HB2      GLU  51  42.924   5.056 -14.593
  370    HB3  GLU  51           HB1      GLU  51  43.412   3.672 -15.569
  371    HG2  GLU  51           HG2      GLU  51  45.158   5.213 -15.918
  372    HG3  GLU  51           HG1      GLU  51  44.147   5.447 -17.338
  373    H    ALA  52           HN       ALA  52  39.576   5.063 -15.228
  374    HA   ALA  52           HA       ALA  52  39.218   2.327 -14.378
  375    HB1  ALA  52           HB1      ALA  52  36.936   3.065 -13.759
  376    HB2  ALA  52           HB2      ALA  52  37.210   4.588 -14.604
  377    HB3  ALA  52           HB3      ALA  52  38.164   4.184 -13.175
  378    H    ARG  53           HN       ARG  53  37.849   0.761 -15.195
  379    HA   ARG  53           HA       ARG  53  36.914   1.192 -18.024
  380    HB2  ARG  53           HB2      ARG  53  38.820  -0.386 -17.808
  381    HB3  ARG  53           HB1      ARG  53  37.845  -1.384 -16.730
  382    HG2  ARG  53           HG2      ARG  53  36.170  -1.695 -18.501
  383    HG3  ARG  53           HG1      ARG  53  37.106  -0.658 -19.579
  384    HD2  ARG  53           HD2      ARG  53  39.003  -2.229 -19.431
  385    HD3  ARG  53           HD1      ARG  53  38.054  -3.275 -18.374
  386    HE   ARG  53           HE       ARG  53  37.712  -2.975 -21.280
  387   HH11  ARG  53          HH21      ARG  53  36.379  -3.974 -18.243
  388   HH12  ARG  53          HH22      ARG  53  35.242  -5.065 -18.965
  389   HH21  ARG  53          HH11      ARG  53  36.242  -4.392 -22.214
  390   HH22  ARG  53          HH12      ARG  53  35.166  -5.300 -21.205
  391    H    ARG  54           HN       ARG  54  34.900   0.569 -18.541
  392    HA   ARG  54           HA       ARG  54  33.092  -0.084 -16.299
  393    HB2  ARG  54           HB2      ARG  54  32.680   0.948 -19.108
  394    HB3  ARG  54           HB1      ARG  54  31.325   0.330 -18.169
  395    HG2  ARG  54           HG2      ARG  54  31.724   1.940 -16.406
  396    HG3  ARG  54           HG1      ARG  54  33.208   2.488 -17.187
  397    HD2  ARG  54           HD2      ARG  54  30.514   2.634 -18.554
  398    HD3  ARG  54           HD1      ARG  54  31.140   3.949 -17.560
  399    HE   ARG  54           HE       ARG  54  33.178   3.311 -19.401
  400   HH11  ARG  54          HH21      ARG  54  29.893   4.419 -19.393
  401   HH12  ARG  54          HH22      ARG  54  30.065   5.317 -20.865
  402   HH21  ARG  54          HH11      ARG  54  33.398   4.479 -21.315
  403   HH22  ARG  54          HH12      ARG  54  32.041   5.350 -21.948
  404    HA   PRO  55           HA       PRO  55  32.669  -4.318 -17.492
  405    HB2  PRO  55           HB2      PRO  55  30.027  -4.775 -16.800
  406    HB3  PRO  55           HB1      PRO  55  31.359  -4.679 -15.630
  407    HG2  PRO  55           HG2      PRO  55  29.354  -2.600 -16.388
  408    HG3  PRO  55           HG1      PRO  55  30.030  -2.990 -14.796
  409    HD2  PRO  55           HD2      PRO  55  30.876  -0.859 -16.253
  410    HD3  PRO  55           HD1      PRO  55  31.948  -1.746 -15.152
  411    H    GLU  56           HN       GLU  56  31.952  -5.598 -19.179
  412    HA   GLU  56           HA       GLU  56  30.891  -4.231 -21.505
  413    HB2  GLU  56           HB2      GLU  56  31.432  -7.173 -20.969
  414    HB3  GLU  56           HB1      GLU  56  31.006  -6.506 -22.545
  415    HG2  GLU  56           HG2      GLU  56  33.405  -5.627 -20.912
  416    HG3  GLU  56           HG1      GLU  56  33.476  -6.787 -22.239
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1  25.236 -12.666  18.860
    2    H2   MET   1           HT2      MET   1  26.366 -11.425  19.126
    3    H3   MET   1           HT3      MET   1  26.726 -13.019  19.590
    4    HA   MET   1           HA       MET   1  27.633 -11.970  17.353
    5    HB2  MET   1           HB2      MET   1  27.983 -14.283  18.399
    6    HB3  MET   1           HB1      MET   1  26.614 -14.813  17.421
    7    HG2  MET   1           HG2      MET   1  28.566 -15.283  16.122
    8    HG3  MET   1           HG1      MET   1  27.845 -13.840  15.408
    9    HE1  MET   1           HE1      MET   1  31.328 -12.743  14.762
   10    HE2  MET   1           HE2      MET   1  29.683 -12.179  14.481
   11    HE3  MET   1           HE3      MET   1  30.073 -13.881  14.253
   12    HA   PRO   2           HA       PRO   2  23.270 -11.876  15.502
   13    HB2  PRO   2           HB2      PRO   2  23.177  -9.150  15.059
   14    HB3  PRO   2           HB1      PRO   2  22.574  -9.932  16.534
   15    HG2  PRO   2           HG2      PRO   2  25.167  -8.528  16.063
   16    HG3  PRO   2           HG1      PRO   2  24.110  -8.499  17.486
   17    HD2  PRO   2           HD2      PRO   2  26.386 -10.003  17.385
   18    HD3  PRO   2           HD1      PRO   2  24.959 -10.489  18.329
   19    H    LEU   3           HN       LEU   3  22.815 -11.597  13.290
   20    HA   LEU   3           HA       LEU   3  25.193 -11.513  11.554
   21    HB2  LEU   3           HB2      LEU   3  22.269 -12.184  11.154
   22    HB3  LEU   3           HB1      LEU   3  23.340 -11.974   9.771
   23    HG   LEU   3           HG       LEU   3  23.144 -14.362  10.554
   24   HD11  LEU   3          HD11      LEU   3  25.314 -13.109   9.527
   25   HD12  LEU   3          HD12      LEU   3  25.334 -14.808   9.982
   26   HD13  LEU   3          HD13      LEU   3  25.997 -13.603  11.077
   27   HD21  LEU   3          HD21      LEU   3  24.045 -15.028  12.663
   28   HD22  LEU   3          HD22      LEU   3  23.043 -13.621  13.022
   29   HD23  LEU   3          HD23      LEU   3  24.797 -13.456  12.924
   30    H    GLU   4           HN       GLU   4  23.102  -9.273  12.812
   31    HA   GLU   4           HA       GLU   4  22.884  -7.567  10.421
   32    HB2  GLU   4           HB2      GLU   4  22.215  -7.057  13.342
   33    HB3  GLU   4           HB1      GLU   4  21.837  -5.960  12.014
   34    HG2  GLU   4           HG2      GLU   4  20.873  -8.826  12.194
   35    HG3  GLU   4           HG1      GLU   4  19.909  -7.421  12.649
   36    H    ALA   5           HN       ALA   5  23.809  -6.318  13.556
   37    HA   ALA   5           HA       ALA   5  25.565  -4.932  14.209
   38    HB1  ALA   5           HB1      ALA   5  27.249  -6.395  12.180
   39    HB2  ALA   5           HB2      ALA   5  26.773  -7.130  13.711
   40    HB3  ALA   5           HB3      ALA   5  27.756  -5.667  13.705
   41    H    GLY   6           HN       GLY   6  26.849  -3.141  13.542
   42    HA2  GLY   6           HA2      GLY   6  25.722  -1.698  11.306
   43    HA3  GLY   6           HA1      GLY   6  27.036  -1.139  12.339
   44    H    LEU   7           HN       LEU   7  27.072  -0.685   9.630
   45    HA   LEU   7           HA       LEU   7  28.527  -2.679   8.169
   46    HB2  LEU   7           HB2      LEU   7  27.223  -0.914   7.041
   47    HB3  LEU   7           HB1      LEU   7  28.310   0.313   7.691
   48    HG   LEU   7           HG       LEU   7  30.203  -0.718   6.472
   49   HD11  LEU   7          HD11      LEU   7  28.076  -2.740   5.795
   50   HD12  LEU   7          HD12      LEU   7  29.757  -2.999   6.267
   51   HD13  LEU   7          HD13      LEU   7  29.379  -2.444   4.643
   52   HD21  LEU   7          HD21      LEU   7  27.904  -0.334   4.554
   53   HD22  LEU   7          HD22      LEU   7  29.606   0.053   4.307
   54   HD23  LEU   7          HD23      LEU   7  28.638   1.013   5.426
   55    H    LEU   8           HN       LEU   8  30.646  -3.100   8.148
   56    HA   LEU   8           HA       LEU   8  32.459  -1.406   9.808
   57    HB2  LEU   8           HB2      LEU   8  34.005  -3.394   9.530
   58    HB3  LEU   8           HB1      LEU   8  32.526  -3.719  10.431
   59    HG   LEU   8           HG       LEU   8  32.380  -4.150   7.461
   60   HD11  LEU   8          HD11      LEU   8  34.564  -5.123   7.929
   61   HD12  LEU   8          HD12      LEU   8  33.389  -6.419   7.697
   62   HD13  LEU   8          HD13      LEU   8  33.916  -5.984   9.325
   63   HD21  LEU   8          HD21      LEU   8  30.551  -4.570   9.244
   64   HD22  LEU   8          HD22      LEU   8  31.508  -5.970   9.717
   65   HD23  LEU   8          HD23      LEU   8  30.851  -5.863   8.084
   66    H    GLU   9           HN       GLU   9  31.774  -2.358   6.539
   67    HA   GLU   9           HA       GLU   9  34.294  -1.956   5.304
   68    HB2  GLU   9           HB2      GLU   9  31.499  -1.416   4.252
   69    HB3  GLU   9           HB1      GLU   9  32.950  -1.422   3.249
   70    HG2  GLU   9           HG2      GLU   9  32.046  -3.763   4.949
   71    HG3  GLU   9           HG1      GLU   9  31.725  -3.610   3.222
   72    H    ILE  10           HN       ILE  10  35.521  -0.217   5.233
   73    HA   ILE  10           HA       ILE  10  34.295   2.488   5.641
   74    HB   ILE  10           HB       ILE  10  37.218   1.701   5.862
   75   HG12  ILE  10          HG12      ILE  10  36.405   2.088   8.450
   76   HG13  ILE  10          HG11      ILE  10  34.928   1.399   7.781
   77   HG21  ILE  10          HG21      ILE  10  36.789   4.081   5.510
   78   HG22  ILE  10          HG22      ILE  10  37.313   3.811   7.174
   79   HG23  ILE  10          HG23      ILE  10  35.607   4.083   6.819
   80   HD11  ILE  10          HD11      ILE  10  36.253  -0.520   6.909
   81   HD12  ILE  10          HD12      ILE  10  36.363  -0.376   8.661
   82   HD13  ILE  10          HD13      ILE  10  37.696   0.171   7.647
   83    H    LEU  11           HN       LEU  11  35.935   0.453   3.391
   84    HA   LEU  11           HA       LEU  11  37.050   2.553   1.732
   85    HB2  LEU  11           HB2      LEU  11  36.331  -0.294   0.960
   86    HB3  LEU  11           HB1      LEU  11  37.436   0.782   0.103
   87    HG   LEU  11           HG       LEU  11  37.813  -0.195   2.949
   88   HD11  LEU  11          HD11      LEU  11  38.136  -1.989   1.295
   89   HD12  LEU  11          HD12      LEU  11  39.683  -1.501   1.986
   90   HD13  LEU  11          HD13      LEU  11  39.227  -0.953   0.373
   91   HD21  LEU  11          HD21      LEU  11  38.926   1.869   2.864
   92   HD22  LEU  11          HD22      LEU  11  39.328   1.702   1.155
   93   HD23  LEU  11          HD23      LEU  11  40.200   0.759   2.365
   94    H    ALA  12           HN       ALA  12  36.261   3.359  -0.206
   95    HA   ALA  12           HA       ALA  12  33.427   2.729  -0.915
   96    HB1  ALA  12           HB1      ALA  12  32.901   5.107  -1.089
   97    HB2  ALA  12           HB2      ALA  12  34.534   5.531  -0.576
   98    HB3  ALA  12           HB3      ALA  12  33.434   4.734   0.549
   99    H    CYS  13           HN       CYS  13  33.076   2.662  -3.042
  100    HA   CYS  13           HA       CYS  13  35.340   2.849  -4.820
  101    HB2  CYS  13           HB2      CYS  13  33.422   2.373  -6.561
  102    HB3  CYS  13           HB1      CYS  13  33.989   1.112  -5.467
  103    HA   PRO  14           HA       PRO  14  34.702   7.269  -5.609
  104    HB2  PRO  14           HB2      PRO  14  36.252   6.547  -8.075
  105    HB3  PRO  14           HB1      PRO  14  36.542   7.848  -6.905
  106    HG2  PRO  14           HG2      PRO  14  38.029   5.617  -6.947
  107    HG3  PRO  14           HG1      PRO  14  37.642   6.465  -5.439
  108    HD2  PRO  14           HD2      PRO  14  36.564   3.898  -6.481
  109    HD3  PRO  14           HD1      PRO  14  36.757   4.468  -4.806
  110    H    ALA  15           HN       ALA  15  33.299   8.429  -6.873
  111    HA   ALA  15           HA       ALA  15  31.798   8.939  -8.614
  112    HB1  ALA  15           HB1      ALA  15  33.516   7.374  -9.942
  113    HB2  ALA  15           HB2      ALA  15  31.981   7.858 -10.658
  114    HB3  ALA  15           HB3      ALA  15  32.150   6.261  -9.927
  115    H    CYS  16           HN       CYS  16  31.819   5.685  -7.238
  116    HA   CYS  16           HA       CYS  16  28.815   5.815  -7.088
  117    HB2  CYS  16           HB2      CYS  16  29.256   3.165  -6.961
  118    HB3  CYS  16           HB1      CYS  16  29.049   3.996  -8.492
  119    H    HIS  17           HN       HIS  17  28.347   3.762  -5.434
  120    HA   HIS  17           HA       HIS  17  29.944   4.259  -2.956
  121    HB2  HIS  17           HB2      HIS  17  26.942   4.465  -3.288
  122    HB3  HIS  17           HB1      HIS  17  27.733   4.301  -1.718
  123    HD2  HIS  17           HD2      HIS  17  29.032   6.623  -0.795
  124    HE1  HIS  17           HE1      HIS  17  28.143   9.049  -4.137
  125    HE2  HIS  17           HE2      HIS  17  29.102   9.033  -1.788
  126    H    ALA  18           HN       ALA  18  30.833   2.252  -2.959
  127    HA   ALA  18           HA       ALA  18  29.325   0.138  -1.868
  128    HB1  ALA  18           HB1      ALA  18  28.860  -1.307  -3.626
  129    HB2  ALA  18           HB2      ALA  18  30.230  -0.747  -4.588
  130    HB3  ALA  18           HB3      ALA  18  28.761   0.216  -4.500
  131    HA   PRO  19           HA       PRO  19  33.396  -1.364  -1.035
  132    HB2  PRO  19           HB2      PRO  19  32.740  -4.196  -1.457
  133    HB3  PRO  19           HB1      PRO  19  32.959  -3.324   0.070
  134    HG2  PRO  19           HG2      PRO  19  30.550  -4.266  -0.789
  135    HG3  PRO  19           HG1      PRO  19  30.732  -2.860   0.277
  136    HD2  PRO  19           HD2      PRO  19  30.217  -2.933  -2.679
  137    HD3  PRO  19           HD1      PRO  19  29.534  -1.884  -1.430
  138    H    LEU  20           HN       LEU  20  35.218  -2.830  -1.814
  139    HA   LEU  20           HA       LEU  20  35.232  -2.960  -4.817
  140    HB2  LEU  20           HB2      LEU  20  37.530  -2.505  -2.895
  141    HB3  LEU  20           HB1      LEU  20  37.672  -2.641  -4.647
  142    HG   LEU  20           HG       LEU  20  35.879  -0.599  -3.316
  143   HD11  LEU  20          HD11      LEU  20  38.112  -0.099  -2.562
  144   HD12  LEU  20          HD12      LEU  20  37.734   1.022  -3.871
  145   HD13  LEU  20          HD13      LEU  20  38.774  -0.370  -4.175
  146   HD21  LEU  20          HD21      LEU  20  36.368   0.518  -5.619
  147   HD22  LEU  20          HD22      LEU  20  35.252  -0.836  -5.579
  148   HD23  LEU  20          HD23      LEU  20  36.909  -1.082  -6.122
  149    H    GLU  21           HN       GLU  21  35.671  -4.842  -5.753
  150    HA   GLU  21           HA       GLU  21  36.398  -7.152  -3.958
  151    HB2  GLU  21           HB2      GLU  21  35.389  -8.503  -5.899
  152    HB3  GLU  21           HB1      GLU  21  34.266  -7.586  -4.897
  153    HG2  GLU  21           HG2      GLU  21  34.190  -5.793  -6.541
  154    HG3  GLU  21           HG1      GLU  21  35.432  -6.586  -7.498
  155    H    GLU  22           HN       GLU  22  38.180  -8.276  -4.402
  156    HA   GLU  22           HA       GLU  22  39.898  -7.359  -6.634
  157    HB2  GLU  22           HB2      GLU  22  41.718  -8.449  -5.445
  158    HB3  GLU  22           HB1      GLU  22  40.841  -7.387  -4.344
  159    HG2  GLU  22           HG2      GLU  22  39.488  -9.411  -3.629
  160    HG3  GLU  22           HG1      GLU  22  40.610 -10.399  -4.565
  161    H    ARG  23           HN       ARG  23  40.397  -8.591  -8.332
  162    HA   ARG  23           HA       ARG  23  39.709 -11.503  -8.244
  163    HB2  ARG  23           HB2      ARG  23  39.007  -9.525 -10.432
  164    HB3  ARG  23           HB1      ARG  23  38.855 -11.274 -10.584
  165    HG2  ARG  23           HG2      ARG  23  37.523  -9.762  -8.329
  166    HG3  ARG  23           HG1      ARG  23  36.731  -9.974  -9.887
  167    HD2  ARG  23           HD2      ARG  23  37.173 -12.484  -9.615
  168    HD3  ARG  23           HD1      ARG  23  37.602 -12.129  -7.945
  169    HE   ARG  23           HE       ARG  23  35.012 -11.053  -8.716
  170   HH11  ARG  23          HH21      ARG  23  36.822 -13.766  -7.550
  171   HH12  ARG  23          HH22      ARG  23  35.459 -14.494  -6.767
  172   HH21  ARG  23          HH11      ARG  23  33.242 -12.000  -7.704
  173   HH22  ARG  23          HH12      ARG  23  33.440 -13.496  -6.854
  174    H    ASP  24           HN       ASP  24  41.346 -12.687  -8.792
  175    HA   ASP  24           HA       ASP  24  43.470 -13.309  -9.546
  176    HB2  ASP  24           HB2      ASP  24  42.412 -11.680 -11.865
  177    HB3  ASP  24           HB1      ASP  24  43.927 -12.583 -11.937
  178    H    ALA  25           HN       ALA  25  44.240 -10.798 -11.595
  179    HA   ALA  25           HA       ALA  25  45.969  -9.513  -9.503
  180    HB1  ALA  25           HB1      ALA  25  46.380  -9.896 -12.483
  181    HB2  ALA  25           HB2      ALA  25  47.289 -10.658 -11.178
  182    HB3  ALA  25           HB3      ALA  25  47.432  -8.923 -11.456
  183    H    GLU  26           HN       GLU  26  43.131  -8.880 -10.441
  184    HA   GLU  26           HA       GLU  26  43.658  -5.974 -10.921
  185    HB2  GLU  26           HB2      GLU  26  41.733  -7.695 -12.500
  186    HB3  GLU  26           HB1      GLU  26  41.756  -5.930 -12.537
  187    HG2  GLU  26           HG2      GLU  26  44.081  -5.953 -13.318
  188    HG3  GLU  26           HG1      GLU  26  44.100  -7.713 -13.243
  189    H    LEU  27           HN       LEU  27  41.772  -4.619 -10.410
  190    HA   LEU  27           HA       LEU  27  40.076  -5.884  -8.281
  191    HB2  LEU  27           HB2      LEU  27  40.911  -2.993  -8.515
  192    HB3  LEU  27           HB1      LEU  27  40.067  -3.744  -7.165
  193    HG   LEU  27           HG       LEU  27  42.848  -4.493  -8.108
  194   HD11  LEU  27          HD11      LEU  27  42.604  -2.209  -7.036
  195   HD12  LEU  27          HD12      LEU  27  43.670  -3.321  -6.177
  196   HD13  LEU  27          HD13      LEU  27  42.036  -3.032  -5.583
  197   HD21  LEU  27          HD21      LEU  27  41.026  -5.472  -5.909
  198   HD22  LEU  27          HD22      LEU  27  42.776  -5.597  -5.740
  199   HD23  LEU  27          HD23      LEU  27  41.964  -6.412  -7.071
  200    H    ILE  28           HN       ILE  28  37.924  -5.352  -8.184
  201    HA   ILE  28           HA       ILE  28  36.816  -3.733 -10.435
  202    HB   ILE  28           HB       ILE  28  36.012  -6.541  -9.668
  203   HG12  ILE  28          HG12      ILE  28  36.706  -5.362 -12.359
  204   HG13  ILE  28          HG11      ILE  28  37.893  -6.142 -11.314
  205   HG21  ILE  28          HG21      ILE  28  34.555  -4.418 -11.244
  206   HG22  ILE  28          HG22      ILE  28  33.942  -5.406  -9.919
  207   HG23  ILE  28          HG23      ILE  28  34.243  -6.135 -11.496
  208   HD11  ILE  28          HD11      ILE  28  35.326  -7.532 -12.084
  209   HD12  ILE  28          HD12      ILE  28  36.813  -8.240 -11.453
  210   HD13  ILE  28          HD13      ILE  28  36.765  -7.614 -13.099
  211    H    CYS  29           HN       CYS  29  34.787  -2.827 -10.049
  212    HA   CYS  29           HA       CYS  29  34.340  -2.035  -7.320
  213    HB2  CYS  29           HB2      CYS  29  33.635  -1.023  -9.766
  214    HB3  CYS  29           HB1      CYS  29  32.095  -1.681  -9.229
  215    H    THR  30           HN       THR  30  33.074  -2.925  -5.771
  216    HA   THR  30           HA       THR  30  31.646  -5.416  -6.443
  217    HB   THR  30           HB       THR  30  31.871  -4.185  -3.692
  218    HG1  THR  30           HG1      THR  30  33.934  -4.338  -4.922
  219   HG21  THR  30          HG21      THR  30  30.462  -6.137  -3.877
  220   HG22  THR  30          HG22      THR  30  31.958  -6.608  -3.075
  221   HG23  THR  30          HG23      THR  30  31.707  -7.003  -4.774
  222    H    GLY  31           HN       GLY  31  29.537  -5.723  -5.380
  223    HA2  GLY  31           HA2      GLY  31  27.360  -5.046  -4.747
  224    HA3  GLY  31           HA1      GLY  31  27.875  -3.362  -4.858
  225    H    GLN  32           HN       GLN  32  25.499  -4.723  -5.963
  226    HA   GLN  32           HA       GLN  32  25.828  -4.882  -8.852
  227    HB2  GLN  32           HB2      GLN  32  23.272  -4.843  -8.790
  228    HB3  GLN  32           HB1      GLN  32  24.033  -6.166  -7.909
  229    HG2  GLN  32           HG2      GLN  32  23.396  -3.594  -6.463
  230    HG3  GLN  32           HG1      GLN  32  22.114  -4.770  -6.755
  231   HE21  GLN  32          HE21      GLN  32  23.963  -3.897  -4.290
  232   HE22  GLN  32          HE22      GLN  32  24.335  -5.398  -3.590
  233    H    ASP  33           HN       ASP  33  25.632  -2.354  -6.626
  234    HA   ASP  33           HA       ASP  33  24.223  -0.436  -8.339
  235    HB2  ASP  33           HB2      ASP  33  24.202  -0.279  -5.841
  236    HB3  ASP  33           HB1      ASP  33  25.933   0.058  -5.877
  237    H    CYS  34           HN       CYS  34  27.248  -1.823  -8.395
  238    HA   CYS  34           HA       CYS  34  28.385   0.507  -9.916
  239    HB2  CYS  34           HB2      CYS  34  29.992  -1.422  -8.230
  240    HB3  CYS  34           HB1      CYS  34  30.548   0.042  -9.038
  241    H    GLY  35           HN       GLY  35  30.789  -1.210 -10.341
  242    HA2  GLY  35           HA2      GLY  35  30.642  -3.629 -11.505
  243    HA3  GLY  35           HA1      GLY  35  29.747  -2.678 -12.694
  244    H    LEU  36           HN       LEU  36  31.626  -0.368 -11.738
  245    HA   LEU  36           HA       LEU  36  33.320  -0.247 -13.951
  246    HB2  LEU  36           HB2      LEU  36  33.978   0.837 -11.198
  247    HB3  LEU  36           HB1      LEU  36  34.604   1.425 -12.740
  248    HG   LEU  36           HG       LEU  36  31.680   1.434 -11.932
  249   HD11  LEU  36          HD11      LEU  36  32.049   3.943 -11.963
  250   HD12  LEU  36          HD12      LEU  36  33.779   3.612 -12.028
  251   HD13  LEU  36          HD13      LEU  36  32.834   3.092 -10.632
  252   HD21  LEU  36          HD21      LEU  36  33.180   2.200 -14.435
  253   HD22  LEU  36          HD22      LEU  36  31.703   3.065 -14.008
  254   HD23  LEU  36          HD23      LEU  36  31.660   1.327 -14.269
  255    H    ALA  37           HN       ALA  37  35.475  -0.735 -14.340
  256    HA   ALA  37           HA       ALA  37  36.599  -2.895 -12.569
  257    HB1  ALA  37           HB1      ALA  37  37.903  -3.203 -14.968
  258    HB2  ALA  37           HB2      ALA  37  36.333  -2.604 -15.501
  259    HB3  ALA  37           HB3      ALA  37  36.427  -4.067 -14.529
  260    H    TYR  38           HN       TYR  38  38.572  -2.653 -11.755
  261    HA   TYR  38           HA       TYR  38  40.197  -0.306 -12.655
  262    HB2  TYR  38           HB2      TYR  38  40.061  -1.371  -9.852
  263    HB3  TYR  38           HB1      TYR  38  40.858   0.098 -10.409
  264    HD1  TYR  38           HD1      TYR  38  39.453   1.960 -11.400
  265    HD2  TYR  38           HD2      TYR  38  37.749  -1.386  -9.314
  266    HE1  TYR  38           HE1      TYR  38  37.340   3.224 -11.086
  267    HE2  TYR  38           HE2      TYR  38  35.641  -0.119  -9.004
  268    HH   TYR  38           HH       TYR  38  35.372   3.100  -9.299
  269    HA   PRO  39           HA       PRO  39  42.962  -3.916 -13.079
  270    HB2  PRO  39           HB2      PRO  39  44.563  -2.884 -15.027
  271    HB3  PRO  39           HB1      PRO  39  42.961  -3.568 -15.370
  272    HG2  PRO  39           HG2      PRO  39  43.804  -0.721 -15.195
  273    HG3  PRO  39           HG1      PRO  39  42.594  -1.478 -16.244
  274    HD2  PRO  39           HD2      PRO  39  42.034  -0.047 -13.910
  275    HD3  PRO  39           HD1      PRO  39  40.915  -1.175 -14.704
  276    H    VAL  40           HN       VAL  40  45.430  -4.063 -13.030
  277    HA   VAL  40           HA       VAL  40  46.498  -2.039 -11.097
  278    HB   VAL  40           HB       VAL  40  47.158  -4.961 -11.524
  279   HG11  VAL  40          HG11      VAL  40  48.545  -2.804  -9.918
  280   HG12  VAL  40          HG12      VAL  40  49.259  -3.926 -11.077
  281   HG13  VAL  40          HG13      VAL  40  48.701  -4.514  -9.512
  282   HG21  VAL  40          HG21      VAL  40  46.191  -3.462  -9.073
  283   HG22  VAL  40          HG22      VAL  40  46.320  -5.210  -9.268
  284   HG23  VAL  40          HG23      VAL  40  45.116  -4.305 -10.185
  285    H    ARG  41           HN       ARG  41  48.217  -0.879 -11.643
  286    HA   ARG  41           HA       ARG  41  49.812  -1.682 -14.059
  287    HB2  ARG  41           HB2      ARG  41  49.035   1.124 -13.202
  288    HB3  ARG  41           HB1      ARG  41  50.014   0.701 -14.606
  289    HG2  ARG  41           HG2      ARG  41  47.227  -0.413 -14.238
  290    HG3  ARG  41           HG1      ARG  41  47.499   1.145 -15.017
  291    HD2  ARG  41           HD2      ARG  41  49.084  -0.013 -16.607
  292    HD3  ARG  41           HD1      ARG  41  48.577  -1.549 -15.907
  293    HE   ARG  41           HE       ARG  41  46.359   0.097 -16.852
  294   HH11  ARG  41          HH21      ARG  41  48.761  -2.293 -17.574
  295   HH12  ARG  41          HH22      ARG  41  47.883  -2.945 -18.917
  296   HH21  ARG  41          HH11      ARG  41  45.222  -0.747 -18.598
  297   HH22  ARG  41          HH12      ARG  41  45.887  -2.072 -19.495
  298    H    ASP  42           HN       ASP  42  51.864  -1.931 -13.671
  299    HA   ASP  42           HA       ASP  42  53.936  -1.900 -12.604
  300    HB2  ASP  42           HB2      ASP  42  53.649   0.538 -13.206
  301    HB3  ASP  42           HB1      ASP  42  53.061   0.802 -11.563
  302    H    GLY  43           HN       GLY  43  51.529  -2.907 -11.205
  303    HA2  GLY  43           HA2      GLY  43  51.309  -4.037  -9.136
  304    HA3  GLY  43           HA1      GLY  43  52.759  -3.209  -8.561
  305    H    ILE  44           HN       ILE  44  50.695  -0.973  -9.963
  306    HA   ILE  44           HA       ILE  44  49.622  -0.251  -7.281
  307    HB   ILE  44           HB       ILE  44  50.155   1.619  -9.580
  308   HG12  ILE  44          HG12      ILE  44  51.779   1.046  -7.078
  309   HG13  ILE  44          HG11      ILE  44  52.232   0.570  -8.715
  310   HG21  ILE  44          HG21      ILE  44  49.673   2.136  -6.628
  311   HG22  ILE  44          HG22      ILE  44  48.424   2.280  -7.864
  312   HG23  ILE  44          HG23      ILE  44  49.826   3.347  -7.900
  313   HD11  ILE  44          HD11      ILE  44  52.135   3.001  -9.367
  314   HD12  ILE  44          HD12      ILE  44  53.399   2.622  -8.197
  315   HD13  ILE  44          HD13      ILE  44  51.904   3.391  -7.663
  316    HA   PRO  45           HA       PRO  45  45.647  -0.951  -9.262
  317    HB2  PRO  45           HB2      PRO  45  44.054  -0.027  -7.236
  318    HB3  PRO  45           HB1      PRO  45  44.867  -1.601  -7.194
  319    HG2  PRO  45           HG2      PRO  45  45.644   0.962  -5.880
  320    HG3  PRO  45           HG1      PRO  45  45.734  -0.696  -5.260
  321    HD2  PRO  45           HD2      PRO  45  47.889   0.655  -6.247
  322    HD3  PRO  45           HD1      PRO  45  47.743  -1.119  -6.298
  323    H    VAL  46           HN       VAL  46  44.038   0.234 -10.304
  324    HA   VAL  46           HA       VAL  46  44.636   3.122 -10.625
  325    HB   VAL  46           HB       VAL  46  42.739   1.284 -12.114
  326   HG11  VAL  46          HG11      VAL  46  42.851   3.235 -13.783
  327   HG12  VAL  46          HG12      VAL  46  43.501   4.191 -12.451
  328   HG13  VAL  46          HG13      VAL  46  41.885   3.495 -12.331
  329   HG21  VAL  46          HG21      VAL  46  45.270   0.917 -12.310
  330   HG22  VAL  46          HG22      VAL  46  45.341   2.515 -13.053
  331   HG23  VAL  46          HG23      VAL  46  44.417   1.224 -13.822
  332    H    LEU  47           HN       LEU  47  43.711   4.330  -9.088
  333    HA   LEU  47           HA       LEU  47  40.887   3.778  -8.273
  334    HB2  LEU  47           HB2      LEU  47  43.228   5.176  -6.987
  335    HB3  LEU  47           HB1      LEU  47  41.596   5.640  -6.508
  336    HG   LEU  47           HG       LEU  47  42.603   3.813  -5.088
  337   HD11  LEU  47          HD11      LEU  47  40.287   2.503  -6.461
  338   HD12  LEU  47          HD12      LEU  47  40.004   4.138  -5.865
  339   HD13  LEU  47          HD13      LEU  47  40.527   2.874  -4.759
  340   HD21  LEU  47          HD21      LEU  47  42.141   1.990  -7.459
  341   HD22  LEU  47          HD22      LEU  47  43.048   1.669  -5.983
  342   HD23  LEU  47          HD23      LEU  47  43.713   2.754  -7.204
  343    H    LEU  48           HN       LEU  48  42.149   5.247 -10.706
  344    HA   LEU  48           HA       LEU  48  40.705   7.852 -10.380
  345    HB2  LEU  48           HB2      LEU  48  42.636   6.974 -12.542
  346    HB3  LEU  48           HB1      LEU  48  41.966   8.589 -12.332
  347    HG   LEU  48           HG       LEU  48  43.710   7.146 -10.316
  348   HD11  LEU  48          HD11      LEU  48  44.866   7.903 -12.421
  349   HD12  LEU  48          HD12      LEU  48  45.450   8.701 -10.961
  350   HD13  LEU  48          HD13      LEU  48  44.351   9.549 -12.049
  351   HD21  LEU  48          HD21      LEU  48  42.401   8.605  -9.031
  352   HD22  LEU  48          HD22      LEU  48  42.253   9.787 -10.332
  353   HD23  LEU  48          HD23      LEU  48  43.767   9.638  -9.441
  354    H    VAL  49           HN       VAL  49  38.906   8.229 -11.460
  355    HA   VAL  49           HA       VAL  49  37.460   6.141 -12.767
  356    HB   VAL  49           HB       VAL  49  37.030   9.143 -12.825
  357   HG11  VAL  49          HG11      VAL  49  35.815   8.191 -14.659
  358   HG12  VAL  49          HG12      VAL  49  34.647   8.400 -13.354
  359   HG13  VAL  49          HG13      VAL  49  35.316   6.804 -13.693
  360   HG21  VAL  49          HG21      VAL  49  35.938   6.911 -11.085
  361   HG22  VAL  49          HG22      VAL  49  35.272   8.544 -11.113
  362   HG23  VAL  49          HG23      VAL  49  36.927   8.274 -10.564
  363    H    ASP  50           HN       ASP  50  39.332   8.883 -13.993
  364    HA   ASP  50           HA       ASP  50  38.663   8.642 -16.743
  365    HB2  ASP  50           HB2      ASP  50  41.034   9.734 -15.231
  366    HB3  ASP  50           HB1      ASP  50  41.126   9.619 -16.989
  367    H    GLU  51           HN       GLU  51  41.161   7.020 -14.822
  368    HA   GLU  51           HA       GLU  51  42.062   5.486 -17.199
  369    HB2  GLU  51           HB2      GLU  51  42.992   5.538 -14.311
  370    HB3  GLU  51           HB1      GLU  51  43.702   4.510 -15.554
  371    HG2  GLU  51           HG2      GLU  51  44.295   6.471 -16.886
  372    HG3  GLU  51           HG1      GLU  51  43.521   7.533 -15.711
  373    H    ALA  52           HN       ALA  52  39.662   5.274 -14.897
  374    HA   ALA  52           HA       ALA  52  39.714   2.447 -14.299
  375    HB1  ALA  52           HB1      ALA  52  37.385   4.384 -14.269
  376    HB2  ALA  52           HB2      ALA  52  38.472   4.064 -12.919
  377    HB3  ALA  52           HB3      ALA  52  37.409   2.791 -13.513
  378    H    ARG  53           HN       ARG  53  38.306   0.826 -15.130
  379    HA   ARG  53           HA       ARG  53  37.692   1.219 -18.028
  380    HB2  ARG  53           HB2      ARG  53  38.042  -1.259 -16.325
  381    HB3  ARG  53           HB1      ARG  53  37.527  -1.302 -18.012
  382    HG2  ARG  53           HG2      ARG  53  39.599  -0.109 -18.660
  383    HG3  ARG  53           HG1      ARG  53  40.118  -0.110 -16.974
  384    HD2  ARG  53           HD2      ARG  53  39.508  -2.617 -18.572
  385    HD3  ARG  53           HD1      ARG  53  41.129  -1.972 -18.317
  386    HE   ARG  53           HE       ARG  53  39.926  -2.258 -15.766
  387   HH11  ARG  53          HH21      ARG  53  40.962  -4.168 -18.464
  388   HH12  ARG  53          HH22      ARG  53  41.313  -5.562 -17.497
  389   HH21  ARG  53          HH11      ARG  53  40.381  -4.069 -14.512
  390   HH22  ARG  53          HH12      ARG  53  40.986  -5.504 -15.269
  391    H    ARG  54           HN       ARG  54  35.691   1.055 -18.813
  392    HA   ARG  54           HA       ARG  54  33.447   1.590 -17.291
  393    HB2  ARG  54           HB2      ARG  54  33.981   0.680 -20.039
  394    HB3  ARG  54           HB1      ARG  54  32.412   0.130 -19.476
  395    HG2  ARG  54           HG2      ARG  54  31.898   2.495 -18.785
  396    HG3  ARG  54           HG1      ARG  54  33.423   2.989 -19.517
  397    HD2  ARG  54           HD2      ARG  54  31.254   1.510 -21.019
  398    HD3  ARG  54           HD1      ARG  54  31.410   3.268 -21.010
  399    HE   ARG  54           HE       ARG  54  33.933   2.295 -21.752
  400   HH11  ARG  54          HH21      ARG  54  30.657   2.113 -22.856
  401   HH12  ARG  54          HH22      ARG  54  31.100   1.948 -24.524
  402   HH21  ARG  54          HH11      ARG  54  34.510   2.082 -23.917
  403   HH22  ARG  54          HH12      ARG  54  33.274   1.931 -25.120
  404    HA   PRO  55           HA       PRO  55  31.860  -1.897 -15.210
  405    HB2  PRO  55           HB2      PRO  55  29.565  -2.038 -17.136
  406    HB3  PRO  55           HB1      PRO  55  29.542  -2.007 -15.360
  407    HG2  PRO  55           HG2      PRO  55  28.930   0.158 -16.787
  408    HG3  PRO  55           HG1      PRO  55  29.833   0.280 -15.268
  409    HD2  PRO  55           HD2      PRO  55  30.800   0.582 -18.062
  410    HD3  PRO  55           HD1      PRO  55  31.386   1.353 -16.578
  411    H    GLU  56           HN       GLU  56  32.336  -4.016 -15.267
  412    HA   GLU  56           HA       GLU  56  33.108  -6.060 -16.122
  413    HB2  GLU  56           HB2      GLU  56  30.681  -6.233 -16.617
  414    HB3  GLU  56           HB1      GLU  56  30.971  -5.516 -18.203
  415    HG2  GLU  56           HG2      GLU  56  32.478  -7.367 -18.786
  416    HG3  GLU  56           HG1      GLU  56  32.253  -8.070 -17.185
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1  41.239 -11.240  21.532
    2    H2   MET   1           HT2      MET   1  40.239 -12.161  20.512
    3    H3   MET   1           HT3      MET   1  39.873 -12.021  22.166
    4    HA   MET   1           HA       MET   1  38.834 -10.494  20.171
    5    HB2  MET   1           HB2      MET   1  38.088 -10.955  22.596
    6    HB3  MET   1           HB1      MET   1  39.098  -9.579  23.041
    7    HG2  MET   1           HG2      MET   1  37.839  -8.221  21.314
    8    HG3  MET   1           HG1      MET   1  36.732  -9.584  21.151
    9    HE1  MET   1           HE1      MET   1  34.395  -7.382  23.122
   10    HE2  MET   1           HE2      MET   1  34.511  -8.704  21.962
   11    HE3  MET   1           HE3      MET   1  35.355  -7.189  21.648
   12    HA   PRO   2           HA       PRO   2  42.818  -7.903  20.448
   13    HB2  PRO   2           HB2      PRO   2  43.472  -8.134  17.754
   14    HB3  PRO   2           HB1      PRO   2  44.124  -9.171  19.037
   15    HG2  PRO   2           HG2      PRO   2  41.908  -9.709  17.114
   16    HG3  PRO   2           HG1      PRO   2  43.155 -10.805  17.734
   17    HD2  PRO   2           HD2      PRO   2  40.594 -10.835  18.671
   18    HD3  PRO   2           HD1      PRO   2  41.987 -11.240  19.698
   19    H    LEU   3           HN       LEU   3  42.918  -5.759  19.821
   20    HA   LEU   3           HA       LEU   3  42.111  -3.695  19.099
   21    HB2  LEU   3           HB2      LEU   3  40.923  -5.276  16.794
   22    HB3  LEU   3           HB1      LEU   3  41.320  -3.558  16.816
   23    HG   LEU   3           HG       LEU   3  43.312  -5.825  17.116
   24   HD11  LEU   3          HD11      LEU   3  44.111  -5.047  14.899
   25   HD12  LEU   3          HD12      LEU   3  42.777  -3.896  14.838
   26   HD13  LEU   3          HD13      LEU   3  42.447  -5.628  14.831
   27   HD21  LEU   3          HD21      LEU   3  43.536  -2.817  17.278
   28   HD22  LEU   3          HD22      LEU   3  44.904  -3.770  16.702
   29   HD23  LEU   3          HD23      LEU   3  44.263  -4.041  18.320
   30    H    GLU   4           HN       GLU   4  40.487  -2.621  20.005
   31    HA   GLU   4           HA       GLU   4  37.958  -3.997  20.619
   32    HB2  GLU   4           HB2      GLU   4  38.969  -1.201  21.234
   33    HB3  GLU   4           HB1      GLU   4  37.451  -1.865  21.837
   34    HG2  GLU   4           HG2      GLU   4  40.182  -3.088  22.341
   35    HG3  GLU   4           HG1      GLU   4  39.319  -2.065  23.490
   36    H    ALA   5           HN       ALA   5  39.181  -2.293  18.028
   37    HA   ALA   5           HA       ALA   5  36.958  -0.622  17.315
   38    HB1  ALA   5           HB1      ALA   5  39.285  -0.529  16.325
   39    HB2  ALA   5           HB2      ALA   5  37.977  -0.475  15.142
   40    HB3  ALA   5           HB3      ALA   5  38.872  -1.973  15.402
   41    H    GLY   6           HN       GLY   6  35.113  -1.066  16.179
   42    HA2  GLY   6           HA2      GLY   6  34.378  -3.914  15.882
   43    HA3  GLY   6           HA1      GLY   6  33.281  -2.541  15.757
   44    H    LEU   7           HN       LEU   7  34.788  -4.890  14.008
   45    HA   LEU   7           HA       LEU   7  35.203  -5.237  11.732
   46    HB2  LEU   7           HB2      LEU   7  32.823  -3.381  11.785
   47    HB3  LEU   7           HB1      LEU   7  33.484  -3.956  10.253
   48    HG   LEU   7           HG       LEU   7  33.235  -6.297  11.042
   49   HD11  LEU   7          HD11      LEU   7  31.708  -6.552  13.113
   50   HD12  LEU   7          HD12      LEU   7  32.154  -4.888  13.489
   51   HD13  LEU   7          HD13      LEU   7  33.396  -6.138  13.403
   52   HD21  LEU   7          HD21      LEU   7  30.735  -4.586  11.195
   53   HD22  LEU   7          HD22      LEU   7  30.739  -6.338  10.992
   54   HD23  LEU   7          HD23      LEU   7  31.426  -5.303   9.740
   55    H    LEU   8           HN       LEU   8  37.149  -4.517  11.119
   56    HA   LEU   8           HA       LEU   8  37.954  -1.759  11.116
   57    HB2  LEU   8           HB2      LEU   8  39.150  -4.068   9.567
   58    HB3  LEU   8           HB1      LEU   8  39.957  -2.554   9.982
   59    HG   LEU   8           HG       LEU   8  38.911  -4.598  11.967
   60   HD11  LEU   8          HD11      LEU   8  41.404  -4.800  12.472
   61   HD12  LEU   8          HD12      LEU   8  41.687  -3.915  10.973
   62   HD13  LEU   8          HD13      LEU   8  40.878  -5.482  10.932
   63   HD21  LEU   8          HD21      LEU   8  40.152  -1.861  12.251
   64   HD22  LEU   8          HD22      LEU   8  40.409  -3.073  13.507
   65   HD23  LEU   8          HD23      LEU   8  38.775  -2.551  13.112
   66    H    GLU   9           HN       GLU   9  37.971  -0.264   9.509
   67    HA   GLU   9           HA       GLU   9  36.075  -0.522   7.366
   68    HB2  GLU   9           HB2      GLU   9  38.264   1.510   7.872
   69    HB3  GLU   9           HB1      GLU   9  37.026   1.678   6.626
   70    HG2  GLU   9           HG2      GLU   9  36.441   1.328   9.581
   71    HG3  GLU   9           HG1      GLU   9  36.454   2.882   8.749
   72    H    ILE  10           HN       ILE  10  36.365  -1.000   5.242
   73    HA   ILE  10           HA       ILE  10  39.086  -1.928   4.401
   74    HB   ILE  10           HB       ILE  10  37.838  -3.290   2.725
   75   HG12  ILE  10          HG12      ILE  10  35.389  -2.394   4.284
   76   HG13  ILE  10          HG11      ILE  10  35.810  -1.803   2.675
   77   HG21  ILE  10          HG21      ILE  10  37.042  -4.945   4.325
   78   HG22  ILE  10          HG22      ILE  10  36.936  -3.716   5.587
   79   HG23  ILE  10          HG23      ILE  10  38.510  -4.191   4.948
   80   HD11  ILE  10          HD11      ILE  10  35.241  -4.681   3.438
   81   HD12  ILE  10          HD12      ILE  10  35.773  -4.153   1.842
   82   HD13  ILE  10          HD13      ILE  10  34.208  -3.633   2.465
   83    H    LEU  11           HN       LEU  11  38.628  -2.038   1.686
   84    HA   LEU  11           HA       LEU  11  39.065   0.722   0.936
   85    HB2  LEU  11           HB2      LEU  11  38.620  -1.697  -0.826
   86    HB3  LEU  11           HB1      LEU  11  39.325  -0.160  -1.328
   87    HG   LEU  11           HG       LEU  11  40.475  -2.013   0.781
   88   HD11  LEU  11          HD11      LEU  11  41.454  -1.381  -2.019
   89   HD12  LEU  11          HD12      LEU  11  40.646  -2.877  -1.548
   90   HD13  LEU  11          HD13      LEU  11  42.222  -2.473  -0.867
   91   HD21  LEU  11          HD21      LEU  11  41.255   0.709  -0.263
   92   HD22  LEU  11          HD22      LEU  11  42.502  -0.394   0.318
   93   HD23  LEU  11          HD23      LEU  11  41.219   0.129   1.404
   94    H    ALA  12           HN       ALA  12  37.833   1.942  -0.580
   95    HA   ALA  12           HA       ALA  12  34.987   1.117  -0.934
   96    HB1  ALA  12           HB1      ALA  12  34.880   2.540   0.989
   97    HB2  ALA  12           HB2      ALA  12  34.366   3.523  -0.384
   98    HB3  ALA  12           HB3      ALA  12  35.995   3.700   0.268
   99    H    CYS  13           HN       CYS  13  34.104   1.825  -2.860
  100    HA   CYS  13           HA       CYS  13  36.049   2.857  -4.806
  101    HB2  CYS  13           HB2      CYS  13  33.977   2.552  -6.371
  102    HB3  CYS  13           HB1      CYS  13  34.800   1.130  -5.736
  103    HA   PRO  14           HA       PRO  14  34.553   7.032  -4.501
  104    HB2  PRO  14           HB2      PRO  14  35.517   8.054  -6.829
  105    HB3  PRO  14           HB1      PRO  14  36.578   7.603  -5.477
  106    HG2  PRO  14           HG2      PRO  14  35.931   6.063  -7.959
  107    HG3  PRO  14           HG1      PRO  14  37.501   6.322  -7.180
  108    HD2  PRO  14           HD2      PRO  14  36.062   4.025  -6.840
  109    HD3  PRO  14           HD1      PRO  14  37.133   4.685  -5.582
  110    H    ALA  15           HN       ALA  15  32.942   8.417  -5.319
  111    HA   ALA  15           HA       ALA  15  31.028   9.043  -6.508
  112    HB1  ALA  15           HB1      ALA  15  31.596   6.985  -8.624
  113    HB2  ALA  15           HB2      ALA  15  32.672   8.371  -8.457
  114    HB3  ALA  15           HB3      ALA  15  30.961   8.619  -8.796
  115    H    CYS  16           HN       CYS  16  31.314   5.591  -7.334
  116    HA   CYS  16           HA       CYS  16  28.517   5.100  -6.819
  117    HB2  CYS  16           HB2      CYS  16  29.529   2.604  -6.734
  118    HB3  CYS  16           HB1      CYS  16  29.324   3.472  -8.253
  119    H    HIS  17           HN       HIS  17  31.405   4.952  -4.822
  120    HA   HIS  17           HA       HIS  17  31.663   4.462  -2.547
  121    HB2  HIS  17           HB2      HIS  17  30.196   6.419  -2.342
  122    HB3  HIS  17           HB1      HIS  17  28.774   5.383  -2.492
  123    HD2  HIS  17           HD2      HIS  17  27.935   4.297  -0.079
  124    HE1  HIS  17           HE1      HIS  17  31.412   5.130   2.167
  125    HE2  HIS  17           HE2      HIS  17  29.050   4.215   2.277
  126    H    ALA  18           HN       ALA  18  31.907   2.171  -2.789
  127    HA   ALA  18           HA       ALA  18  29.938   0.668  -1.354
  128    HB1  ALA  18           HB1      ALA  18  28.706  -0.402  -2.989
  129    HB2  ALA  18           HB2      ALA  18  30.067  -0.467  -4.110
  130    HB3  ALA  18           HB3      ALA  18  29.138   1.016  -3.938
  131    HA   PRO  19           HA       PRO  19  33.228  -2.216  -0.794
  132    HB2  PRO  19           HB2      PRO  19  31.683  -4.540  -1.828
  133    HB3  PRO  19           HB1      PRO  19  32.367  -4.271  -0.214
  134    HG2  PRO  19           HG2      PRO  19  29.726  -4.124  -0.694
  135    HG3  PRO  19           HG1      PRO  19  30.527  -3.106   0.516
  136    HD2  PRO  19           HD2      PRO  19  29.565  -2.376  -2.221
  137    HD3  PRO  19           HD1      PRO  19  29.580  -1.411  -0.733
  138    H    LEU  20           HN       LEU  20  34.952  -3.188  -1.846
  139    HA   LEU  20           HA       LEU  20  34.804  -3.309  -4.838
  140    HB2  LEU  20           HB2      LEU  20  36.886  -2.329  -2.921
  141    HB3  LEU  20           HB1      LEU  20  37.421  -3.003  -4.461
  142    HG   LEU  20           HG       LEU  20  35.190  -0.971  -4.463
  143   HD11  LEU  20          HD11      LEU  20  36.776   0.204  -3.131
  144   HD12  LEU  20          HD12      LEU  20  37.022   0.776  -4.780
  145   HD13  LEU  20          HD13      LEU  20  38.133  -0.398  -4.084
  146   HD21  LEU  20          HD21      LEU  20  35.849  -0.652  -6.706
  147   HD22  LEU  20          HD22      LEU  20  36.170  -2.368  -6.475
  148   HD23  LEU  20          HD23      LEU  20  37.492  -1.209  -6.404
  149    H    GLU  21           HN       GLU  21  35.605  -5.054  -5.869
  150    HA   GLU  21           HA       GLU  21  36.420  -7.378  -4.153
  151    HB2  GLU  21           HB2      GLU  21  34.847  -7.119  -6.704
  152    HB3  GLU  21           HB1      GLU  21  35.732  -8.612  -6.397
  153    HG2  GLU  21           HG2      GLU  21  33.829  -7.388  -4.386
  154    HG3  GLU  21           HG1      GLU  21  33.322  -8.593  -5.573
  155    H    GLU  22           HN       GLU  22  38.524  -7.732  -4.225
  156    HA   GLU  22           HA       GLU  22  40.147  -6.730  -6.478
  157    HB2  GLU  22           HB2      GLU  22  40.859  -7.966  -3.815
  158    HB3  GLU  22           HB1      GLU  22  42.056  -7.487  -5.020
  159    HG2  GLU  22           HG2      GLU  22  41.225  -5.187  -4.966
  160    HG3  GLU  22           HG1      GLU  22  39.975  -5.644  -3.813
  161    H    ARG  23           HN       ARG  23  40.834  -8.013  -8.101
  162    HA   ARG  23           HA       ARG  23  41.001 -10.965  -7.613
  163    HB2  ARG  23           HB2      ARG  23  39.620  -9.572  -9.919
  164    HB3  ARG  23           HB1      ARG  23  40.092 -11.272  -9.964
  165    HG2  ARG  23           HG2      ARG  23  38.748 -11.667  -7.905
  166    HG3  ARG  23           HG1      ARG  23  38.231  -9.982  -7.945
  167    HD2  ARG  23           HD2      ARG  23  37.247 -10.352 -10.185
  168    HD3  ARG  23           HD1      ARG  23  37.731 -12.043 -10.108
  169    HE   ARG  23           HE       ARG  23  36.124 -11.279  -7.817
  170   HH11  ARG  23          HH21      ARG  23  36.081 -12.193 -11.142
  171   HH12  ARG  23          HH22      ARG  23  34.490 -12.871 -11.067
  172   HH21  ARG  23          HH11      ARG  23  34.056 -12.156  -7.706
  173   HH22  ARG  23          HH12      ARG  23  33.343 -12.851  -9.123
  174    H    ASP  24           HN       ASP  24  42.843 -11.806  -8.353
  175    HA   ASP  24           HA       ASP  24  45.081 -11.741  -9.099
  176    HB2  ASP  24           HB2      ASP  24  45.200 -11.381 -11.582
  177    HB3  ASP  24           HB1      ASP  24  43.945 -12.521 -11.098
  178    H    ALA  25           HN       ALA  25  44.999  -9.506 -11.541
  179    HA   ALA  25           HA       ALA  25  46.208  -7.389  -9.792
  180    HB1  ALA  25           HB1      ALA  25  46.648  -7.731 -12.759
  181    HB2  ALA  25           HB2      ALA  25  47.622  -8.589 -11.567
  182    HB3  ALA  25           HB3      ALA  25  47.633  -6.826 -11.609
  183    H    GLU  26           HN       GLU  26  43.404  -7.538 -10.088
  184    HA   GLU  26           HA       GLU  26  42.924  -4.911 -11.337
  185    HB2  GLU  26           HB2      GLU  26  42.564  -6.483 -13.208
  186    HB3  GLU  26           HB1      GLU  26  41.391  -7.367 -12.229
  187    HG2  GLU  26           HG2      GLU  26  39.955  -5.399 -12.090
  188    HG3  GLU  26           HG1      GLU  26  41.149  -4.428 -12.947
  189    H    LEU  27           HN       LEU  27  41.044  -3.908 -10.559
  190    HA   LEU  27           HA       LEU  27  39.736  -5.279  -8.232
  191    HB2  LEU  27           HB2      LEU  27  40.240  -2.331  -8.685
  192    HB3  LEU  27           HB1      LEU  27  39.405  -3.027  -7.299
  193    HG   LEU  27           HG       LEU  27  41.652  -4.489  -7.135
  194   HD11  LEU  27          HD11      LEU  27  42.541  -1.943  -8.521
  195   HD12  LEU  27          HD12      LEU  27  42.756  -3.591  -9.104
  196   HD13  LEU  27          HD13      LEU  27  43.623  -3.047  -7.673
  197   HD21  LEU  27          HD21      LEU  27  40.741  -2.945  -5.397
  198   HD22  LEU  27          HD22      LEU  27  41.539  -1.600  -6.212
  199   HD23  LEU  27          HD23      LEU  27  42.501  -2.893  -5.494
  200    H    ILE  28           HN       ILE  28  37.579  -5.424  -8.246
  201    HA   ILE  28           HA       ILE  28  36.098  -4.091 -10.482
  202    HB   ILE  28           HB       ILE  28  35.532  -6.685  -9.046
  203   HG12  ILE  28          HG12      ILE  28  36.292  -6.121 -11.934
  204   HG13  ILE  28          HG11      ILE  28  37.422  -6.688 -10.705
  205   HG21  ILE  28          HG21      ILE  28  33.742  -6.867 -10.840
  206   HG22  ILE  28          HG22      ILE  28  34.039  -5.168 -11.205
  207   HG23  ILE  28          HG23      ILE  28  33.432  -5.639  -9.616
  208   HD11  ILE  28          HD11      ILE  28  36.735  -8.673 -11.785
  209   HD12  ILE  28          HD12      ILE  28  35.059  -8.135 -11.895
  210   HD13  ILE  28          HD13      ILE  28  35.727  -8.619 -10.337
  211    H    CYS  29           HN       CYS  29  34.482  -2.745  -9.960
  212    HA   CYS  29           HA       CYS  29  34.012  -2.014  -7.196
  213    HB2  CYS  29           HB2      CYS  29  33.296  -1.050  -9.852
  214    HB3  CYS  29           HB1      CYS  29  31.916  -0.951  -8.775
  215    H    THR  30           HN       THR  30  32.607  -2.989  -5.777
  216    HA   THR  30           HA       THR  30  30.501  -4.773  -6.947
  217    HB   THR  30           HB       THR  30  31.438  -5.015  -4.110
  218    HG1  THR  30           HG1      THR  30  33.365  -5.509  -4.705
  219   HG21  THR  30          HG21      THR  30  30.806  -7.277  -4.391
  220   HG22  THR  30          HG22      THR  30  30.916  -7.176  -6.148
  221   HG23  THR  30          HG23      THR  30  29.586  -6.384  -5.302
  222    H    GLY  31           HN       GLY  31  28.454  -4.176  -6.565
  223    HA2  GLY  31           HA2      GLY  31  27.350  -3.258  -4.182
  224    HA3  GLY  31           HA1      GLY  31  27.838  -1.792  -5.030
  225    H    GLN  32           HN       GLN  32  25.517  -1.315  -5.074
  226    HA   GLN  32           HA       GLN  32  23.723  -2.994  -6.661
  227    HB2  GLN  32           HB2      GLN  32  23.001  -1.494  -4.752
  228    HB3  GLN  32           HB1      GLN  32  23.358  -0.118  -5.795
  229    HG2  GLN  32           HG2      GLN  32  20.995  -0.588  -5.982
  230    HG3  GLN  32           HG1      GLN  32  21.764  -1.080  -7.491
  231   HE21  GLN  32          HE21      GLN  32  20.414  -2.849  -8.067
  232   HE22  GLN  32          HE22      GLN  32  20.218  -4.226  -7.094
  233    H    ASP  33           HN       ASP  33  24.959   0.335  -7.079
  234    HA   ASP  33           HA       ASP  33  24.418   0.146  -9.998
  235    HB2  ASP  33           HB2      ASP  33  25.265   2.452  -8.220
  236    HB3  ASP  33           HB1      ASP  33  25.016   2.587  -9.961
  237    H    CYS  34           HN       CYS  34  26.780  -0.884  -8.093
  238    HA   CYS  34           HA       CYS  34  29.124   0.294  -9.373
  239    HB2  CYS  34           HB2      CYS  34  28.559  -1.636  -7.224
  240    HB3  CYS  34           HB1      CYS  34  30.004  -2.032  -8.139
  241    H    GLY  35           HN       GLY  35  30.755  -1.263 -10.370
  242    HA2  GLY  35           HA2      GLY  35  30.429  -3.682 -11.545
  243    HA3  GLY  35           HA1      GLY  35  29.441  -2.664 -12.597
  244    H    LEU  36           HN       LEU  36  31.657  -0.555 -11.559
  245    HA   LEU  36           HA       LEU  36  33.146  -0.594 -14.035
  246    HB2  LEU  36           HB2      LEU  36  33.750   0.937 -11.494
  247    HB3  LEU  36           HB1      LEU  36  34.344   1.312 -13.113
  248    HG   LEU  36           HG       LEU  36  31.427   1.289 -12.280
  249   HD11  LEU  36          HD11      LEU  36  33.388   3.544 -12.780
  250   HD12  LEU  36          HD12      LEU  36  32.529   3.187 -11.281
  251   HD13  LEU  36          HD13      LEU  36  31.642   3.773 -12.688
  252   HD21  LEU  36          HD21      LEU  36  32.859   1.759 -14.897
  253   HD22  LEU  36          HD22      LEU  36  31.314   2.550 -14.581
  254   HD23  LEU  36          HD23      LEU  36  31.416   0.793 -14.581
  255    H    ALA  37           HN       ALA  37  35.434  -0.890 -14.289
  256    HA   ALA  37           HA       ALA  37  36.668  -2.646 -12.189
  257    HB1  ALA  37           HB1      ALA  37  37.211  -2.884 -15.141
  258    HB2  ALA  37           HB2      ALA  37  35.884  -3.754 -14.374
  259    HB3  ALA  37           HB3      ALA  37  37.545  -4.055 -13.865
  260    H    TYR  38           HN       TYR  38  38.729  -2.207 -11.635
  261    HA   TYR  38           HA       TYR  38  40.099   0.014 -13.097
  262    HB2  TYR  38           HB2      TYR  38  40.358  -0.529 -10.147
  263    HB3  TYR  38           HB1      TYR  38  40.923   0.879 -11.047
  264    HD1  TYR  38           HD2      TYR  38  37.814  -1.020 -10.210
  265    HD2  TYR  38           HD1      TYR  38  39.532   2.762 -11.302
  266    HE1  TYR  38           HE2      TYR  38  35.619   0.072  -9.887
  267    HE2  TYR  38           HE1      TYR  38  37.332   3.856 -10.970
  268    HH   TYR  38           HH       TYR  38  35.270   3.536  -9.899
  269    HA   PRO  39           HA       PRO  39  43.154  -3.342 -13.325
  270    HB2  PRO  39           HB2      PRO  39  44.904  -2.155 -15.031
  271    HB3  PRO  39           HB1      PRO  39  43.337  -2.794 -15.571
  272    HG2  PRO  39           HG2      PRO  39  44.129   0.023 -14.988
  273    HG3  PRO  39           HG1      PRO  39  43.121  -0.614 -16.299
  274    HD2  PRO  39           HD2      PRO  39  42.105   0.548 -14.011
  275    HD3  PRO  39           HD1      PRO  39  41.216  -0.634 -14.999
  276    H    VAL  40           HN       VAL  40  45.427  -3.664 -12.747
  277    HA   VAL  40           HA       VAL  40  46.354  -1.669 -10.736
  278    HB   VAL  40           HB       VAL  40  46.998  -4.592 -11.143
  279   HG11  VAL  40          HG11      VAL  40  48.245  -4.229  -8.918
  280   HG12  VAL  40          HG12      VAL  40  48.191  -2.510  -9.302
  281   HG13  VAL  40          HG13      VAL  40  49.033  -3.626 -10.375
  282   HG21  VAL  40          HG21      VAL  40  45.646  -3.085  -8.884
  283   HG22  VAL  40          HG22      VAL  40  45.901  -4.827  -8.957
  284   HG23  VAL  40          HG23      VAL  40  44.813  -4.047 -10.103
  285    H    ARG  41           HN       ARG  41  48.182  -0.526 -11.083
  286    HA   ARG  41           HA       ARG  41  49.754  -1.158 -13.548
  287    HB2  ARG  41           HB2      ARG  41  49.612   1.369 -11.890
  288    HB3  ARG  41           HB1      ARG  41  50.520   1.179 -13.388
  289    HG2  ARG  41           HG2      ARG  41  47.559   0.586 -13.320
  290    HG3  ARG  41           HG1      ARG  41  48.128   2.245 -13.490
  291    HD2  ARG  41           HD2      ARG  41  49.454   1.580 -15.469
  292    HD3  ARG  41           HD1      ARG  41  48.854  -0.067 -15.317
  293    HE   ARG  41           HE       ARG  41  46.785   0.641 -16.207
  294   HH11  ARG  41          HH21      ARG  41  48.799   3.287 -15.290
  295   HH12  ARG  41          HH22      ARG  41  47.797   4.477 -16.051
  296   HH21  ARG  41          HH11      ARG  41  45.483   2.169 -17.202
  297   HH22  ARG  41          HH12      ARG  41  45.918   3.843 -17.134
  298    H    ASP  42           HN       ASP  42  51.342  -2.527 -12.995
  299    HA   ASP  42           HA       ASP  42  53.227  -3.377 -11.912
  300    HB2  ASP  42           HB2      ASP  42  54.020  -1.139 -12.793
  301    HB3  ASP  42           HB1      ASP  42  53.740  -0.484 -11.178
  302    H    GLY  43           HN       GLY  43  50.850  -3.407 -10.366
  303    HA2  GLY  43           HA2      GLY  43  50.458  -4.160  -8.139
  304    HA3  GLY  43           HA1      GLY  43  52.049  -3.556  -7.675
  305    H    ILE  44           HN       ILE  44  50.431  -1.227  -9.482
  306    HA   ILE  44           HA       ILE  44  49.609   0.203  -6.976
  307    HB   ILE  44           HB       ILE  44  50.261   1.416  -9.657
  308   HG12  ILE  44          HG12      ILE  44  52.034   1.181  -7.206
  309   HG13  ILE  44          HG11      ILE  44  52.201   0.166  -8.638
  310   HG21  ILE  44          HG21      ILE  44  49.969   2.509  -6.838
  311   HG22  ILE  44          HG22      ILE  44  48.885   2.815  -8.196
  312   HG23  ILE  44          HG23      ILE  44  50.530   3.455  -8.217
  313   HD11  ILE  44          HD11      ILE  44  52.660   2.093 -10.026
  314   HD12  ILE  44          HD12      ILE  44  53.742   2.139  -8.633
  315   HD13  ILE  44          HD13      ILE  44  52.328   3.190  -8.686
  316    HA   PRO  45           HA       PRO  45  45.505  -0.756  -8.864
  317    HB2  PRO  45           HB2      PRO  45  44.719   0.687  -6.360
  318    HB3  PRO  45           HB1      PRO  45  44.078  -0.825  -7.036
  319    HG2  PRO  45           HG2      PRO  45  45.719  -0.866  -4.954
  320    HG3  PRO  45           HG1      PRO  45  45.849  -2.084  -6.238
  321    HD2  PRO  45           HD2      PRO  45  47.608   0.290  -5.714
  322    HD3  PRO  45           HD1      PRO  45  48.032  -1.327  -6.319
  323    H    VAL  46           HN       VAL  46  44.227   0.563 -10.141
  324    HA   VAL  46           HA       VAL  46  44.968   3.421 -10.265
  325    HB   VAL  46           HB       VAL  46  43.149   1.708 -11.978
  326   HG11  VAL  46          HG11      VAL  46  43.412   3.695 -13.565
  327   HG12  VAL  46          HG12      VAL  46  44.013   4.600 -12.175
  328   HG13  VAL  46          HG13      VAL  46  42.370   3.961 -12.168
  329   HG21  VAL  46          HG21      VAL  46  44.966   1.652 -13.528
  330   HG22  VAL  46          HG22      VAL  46  45.683   1.296 -11.956
  331   HG23  VAL  46          HG23      VAL  46  45.843   2.909 -12.655
  332    H    LEU  47           HN       LEU  47  43.827   4.899  -9.170
  333    HA   LEU  47           HA       LEU  47  41.013   4.280  -8.339
  334    HB2  LEU  47           HB2      LEU  47  42.897   6.356  -7.188
  335    HB3  LEU  47           HB1      LEU  47  41.362   5.815  -6.505
  336    HG   LEU  47           HG       LEU  47  43.834   4.096  -6.891
  337   HD11  LEU  47          HD11      LEU  47  43.934   4.096  -4.438
  338   HD12  LEU  47          HD12      LEU  47  42.511   5.135  -4.366
  339   HD13  LEU  47          HD13      LEU  47  44.017   5.748  -5.052
  340   HD21  LEU  47          HD21      LEU  47  41.012   3.512  -5.990
  341   HD22  LEU  47          HD22      LEU  47  42.352   2.549  -5.367
  342   HD23  LEU  47          HD23      LEU  47  42.035   2.596  -7.099
  343    H    LEU  48           HN       LEU  48  42.102   5.422 -10.944
  344    HA   LEU  48           HA       LEU  48  40.895   8.149 -10.857
  345    HB2  LEU  48           HB2      LEU  48  42.791   6.733 -12.703
  346    HB3  LEU  48           HB1      LEU  48  41.856   8.093 -13.324
  347    HG   LEU  48           HG       LEU  48  44.102   8.744 -12.403
  348   HD11  LEU  48          HD11      LEU  48  43.300  10.774 -11.692
  349   HD12  LEU  48          HD12      LEU  48  42.211  10.057 -10.506
  350   HD13  LEU  48          HD13      LEU  48  41.746  10.121 -12.205
  351   HD21  LEU  48          HD21      LEU  48  44.627   8.488 -10.104
  352   HD22  LEU  48          HD22      LEU  48  43.885   6.947 -10.536
  353   HD23  LEU  48          HD23      LEU  48  42.948   8.165  -9.671
  354    H    VAL  49           HN       VAL  49  38.935   8.473 -11.575
  355    HA   VAL  49           HA       VAL  49  37.251   6.377 -12.550
  356    HB   VAL  49           HB       VAL  49  36.927   9.381 -12.606
  357   HG11  VAL  49          HG11      VAL  49  34.453   8.716 -12.840
  358   HG12  VAL  49          HG12      VAL  49  35.045   7.126 -13.323
  359   HG13  VAL  49          HG13      VAL  49  35.454   8.548 -14.283
  360   HG21  VAL  49          HG21      VAL  49  35.896   7.202 -10.765
  361   HG22  VAL  49          HG22      VAL  49  35.373   8.885 -10.700
  362   HG23  VAL  49          HG23      VAL  49  37.051   8.469 -10.351
  363    H    ASP  50           HN       ASP  50  38.937   9.043 -14.169
  364    HA   ASP  50           HA       ASP  50  37.869   8.626 -16.778
  365    HB2  ASP  50           HB2      ASP  50  39.189  10.624 -16.113
  366    HB3  ASP  50           HB1      ASP  50  40.631   9.612 -16.025
  367    H    GLU  51           HN       GLU  51  40.548   7.070 -15.079
  368    HA   GLU  51           HA       GLU  51  41.318   5.533 -17.483
  369    HB2  GLU  51           HB2      GLU  51  42.265   5.474 -14.606
  370    HB3  GLU  51           HB1      GLU  51  42.950   4.475 -15.889
  371    HG2  GLU  51           HG2      GLU  51  43.565   6.493 -17.151
  372    HG3  GLU  51           HG1      GLU  51  42.840   7.506 -15.903
  373    H    ALA  52           HN       ALA  52  39.045   5.284 -14.973
  374    HA   ALA  52           HA       ALA  52  38.996   2.508 -14.405
  375    HB1  ALA  52           HB1      ALA  52  36.608   4.345 -14.703
  376    HB2  ALA  52           HB2      ALA  52  37.603   4.209 -13.257
  377    HB3  ALA  52           HB3      ALA  52  36.653   2.829 -13.802
  378    H    ARG  53           HN       ARG  53  37.949   0.752 -15.383
  379    HA   ARG  53           HA       ARG  53  37.167   1.174 -18.254
  380    HB2  ARG  53           HB2      ARG  53  39.190  -0.212 -17.875
  381    HB3  ARG  53           HB1      ARG  53  38.218  -1.324 -16.912
  382    HG2  ARG  53           HG2      ARG  53  36.776  -1.774 -18.848
  383    HG3  ARG  53           HG1      ARG  53  37.695  -0.621 -19.816
  384    HD2  ARG  53           HD2      ARG  53  39.745  -2.008 -19.406
  385    HD3  ARG  53           HD1      ARG  53  38.721  -3.203 -18.610
  386    HE   ARG  53           HE       ARG  53  37.625  -2.664 -21.182
  387   HH11  ARG  53          HH21      ARG  53  40.384  -4.069 -19.661
  388   HH12  ARG  53          HH22      ARG  53  40.686  -5.184 -20.950
  389   HH21  ARG  53          HH11      ARG  53  38.007  -4.110 -22.864
  390   HH22  ARG  53          HH12      ARG  53  39.341  -5.208 -22.762
  391    H    ARG  54           HN       ARG  54  35.247   0.379 -18.956
  392    HA   ARG  54           HA       ARG  54  33.307  -0.393 -16.889
  393    HB2  ARG  54           HB2      ARG  54  33.188   0.517 -19.741
  394    HB3  ARG  54           HB1      ARG  54  31.827  -0.427 -19.139
  395    HG2  ARG  54           HG2      ARG  54  31.510   1.146 -17.298
  396    HG3  ARG  54           HG1      ARG  54  32.928   2.063 -17.808
  397    HD2  ARG  54           HD2      ARG  54  31.014   3.221 -18.669
  398    HD3  ARG  54           HD1      ARG  54  31.766   2.404 -20.039
  399    HE   ARG  54           HE       ARG  54  29.838   0.626 -18.998
  400   HH11  ARG  54          HH21      ARG  54  30.036   3.762 -20.415
  401   HH12  ARG  54          HH22      ARG  54  28.460   3.682 -21.128
  402   HH21  ARG  54          HH11      ARG  54  27.785   0.507 -19.918
  403   HH22  ARG  54          HH12      ARG  54  27.185   1.840 -20.847
  404    HA   PRO  55           HA       PRO  55  33.434  -4.738 -17.605
  405    HB2  PRO  55           HB2      PRO  55  30.740  -5.388 -17.407
  406    HB3  PRO  55           HB1      PRO  55  31.791  -5.048 -16.019
  407    HG2  PRO  55           HG2      PRO  55  29.851  -3.249 -17.406
  408    HG3  PRO  55           HG1      PRO  55  30.184  -3.426 -15.673
  409    HD2  PRO  55           HD2      PRO  55  31.185  -1.361 -17.111
  410    HD3  PRO  55           HD1      PRO  55  32.088  -2.086 -15.765
  411    H    GLU  56           HN       GLU  56  33.295  -6.220 -19.273
  412    HA   GLU  56           HA       GLU  56  31.367  -5.953 -21.435
  413    HB2  GLU  56           HB2      GLU  56  33.023  -4.183 -22.030
  414    HB3  GLU  56           HB1      GLU  56  34.286  -5.417 -22.048
  415    HG2  GLU  56           HG2      GLU  56  33.119  -6.633 -23.821
  416    HG3  GLU  56           HG1      GLU  56  31.796  -5.467 -23.776
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1  48.905 -15.729   7.243
    2    H2   MET   1           HT2      MET   1  47.278 -15.242   7.192
    3    H3   MET   1           HT3      MET   1  47.676 -16.855   7.551
    4    HA   MET   1           HA       MET   1  47.362 -16.186   9.652
    5    HB2  MET   1           HB2      MET   1  50.153 -15.458   8.824
    6    HB3  MET   1           HB1      MET   1  49.648 -15.065  10.465
    7    HG2  MET   1           HG2      MET   1  49.030 -17.408  10.858
    8    HG3  MET   1           HG1      MET   1  49.474 -17.817   9.202
    9    HE1  MET   1           HE1      MET   1  52.172 -19.638  10.958
   10    HE2  MET   1           HE2      MET   1  50.461 -19.605  10.543
   11    HE3  MET   1           HE3      MET   1  50.976 -19.132  12.159
   12    HA   PRO   2           HA       PRO   2  45.731 -12.105  10.324
   13    HB2  PRO   2           HB2      PRO   2  47.454 -11.882  12.770
   14    HB3  PRO   2           HB1      PRO   2  45.706 -11.628  12.596
   15    HG2  PRO   2           HG2      PRO   2  46.717 -13.846  13.716
   16    HG3  PRO   2           HG1      PRO   2  45.231 -13.871  12.748
   17    HD2  PRO   2           HD2      PRO   2  47.939 -14.901  12.047
   18    HD3  PRO   2           HD1      PRO   2  46.341 -15.409  11.459
   19    H    LEU   3           HN       LEU   3  46.282 -10.059   9.634
   20    HA   LEU   3           HA       LEU   3  48.989  -8.992   9.997
   21    HB2  LEU   3           HB2      LEU   3  49.205 -10.422   7.954
   22    HB3  LEU   3           HB1      LEU   3  47.924  -9.481   7.197
   23    HG   LEU   3           HG       LEU   3  49.304  -7.425   7.471
   24   HD11  LEU   3          HD11      LEU   3  51.857  -8.069   7.885
   25   HD12  LEU   3          HD12      LEU   3  51.144  -9.399   8.794
   26   HD13  LEU   3          HD13      LEU   3  50.783  -7.730   9.239
   27   HD21  LEU   3          HD21      LEU   3  50.664  -9.718   6.022
   28   HD22  LEU   3          HD22      LEU   3  50.948  -8.006   5.713
   29   HD23  LEU   3          HD23      LEU   3  49.369  -8.713   5.373
   30    H    GLU   4           HN       GLU   4  45.763  -8.715   8.614
   31    HA   GLU   4           HA       GLU   4  45.961  -5.754   8.520
   32    HB2  GLU   4           HB2      GLU   4  43.469  -6.118   7.727
   33    HB3  GLU   4           HB1      GLU   4  44.794  -6.500   6.630
   34    HG2  GLU   4           HG2      GLU   4  43.084  -8.308   6.718
   35    HG3  GLU   4           HG1      GLU   4  44.670  -8.866   7.240
   36    H    ALA   5           HN       ALA   5  45.311  -8.067  10.801
   37    HA   ALA   5           HA       ALA   5  42.951  -7.170  12.090
   38    HB1  ALA   5           HB1      ALA   5  45.461  -8.466  13.160
   39    HB2  ALA   5           HB2      ALA   5  43.912  -9.234  12.812
   40    HB3  ALA   5           HB3      ALA   5  44.063  -8.128  14.179
   41    H    GLY   6           HN       GLY   6  42.547  -5.548  13.565
   42    HA2  GLY   6           HA2      GLY   6  43.129  -3.817  15.128
   43    HA3  GLY   6           HA1      GLY   6  44.794  -3.873  14.549
   44    H    LEU   7           HN       LEU   7  43.900  -3.813  11.699
   45    HA   LEU   7           HA       LEU   7  43.493  -0.872  11.547
   46    HB2  LEU   7           HB2      LEU   7  44.452  -2.986   9.615
   47    HB3  LEU   7           HB1      LEU   7  43.965  -1.391   9.039
   48    HG   LEU   7           HG       LEU   7  45.585  -0.339  10.582
   49   HD11  LEU   7          HD11      LEU   7  46.074  -3.222  11.345
   50   HD12  LEU   7          HD12      LEU   7  45.744  -1.847  12.398
   51   HD13  LEU   7          HD13      LEU   7  47.307  -1.987  11.597
   52   HD21  LEU   7          HD21      LEU   7  46.342  -0.847   8.323
   53   HD22  LEU   7          HD22      LEU   7  46.720  -2.507   8.786
   54   HD23  LEU   7          HD23      LEU   7  47.660  -1.170   9.450
   55    H    LEU   8           HN       LEU   8  41.507  -0.104  11.202
   56    HA   LEU   8           HA       LEU   8  39.315  -1.889  10.403
   57    HB2  LEU   8           HB2      LEU   8  39.296   1.107  10.879
   58    HB3  LEU   8           HB1      LEU   8  37.891   0.044  10.821
   59    HG   LEU   8           HG       LEU   8  40.141  -0.135  12.847
   60   HD11  LEU   8          HD11      LEU   8  37.319   0.955  13.006
   61   HD12  LEU   8          HD12      LEU   8  38.824   1.833  13.283
   62   HD13  LEU   8          HD13      LEU   8  38.303   0.595  14.426
   63   HD21  LEU   8          HD21      LEU   8  38.282  -1.632  13.958
   64   HD22  LEU   8          HD22      LEU   8  39.293  -2.321  12.692
   65   HD23  LEU   8          HD23      LEU   8  37.661  -1.771  12.313
   66    H    GLU   9           HN       GLU   9  39.965   1.403   9.241
   67    HA   GLU   9           HA       GLU   9  39.638   2.304   7.096
   68    HB2  GLU   9           HB2      GLU   9  41.358  -0.130   6.533
   69    HB3  GLU   9           HB1      GLU   9  41.074   1.167   5.371
   70    HG2  GLU   9           HG2      GLU   9  42.263   1.568   8.134
   71    HG3  GLU   9           HG1      GLU   9  43.206   1.463   6.648
   72    H    ILE  10           HN       ILE  10  37.462   2.114   6.666
   73    HA   ILE  10           HA       ILE  10  36.247  -0.391   5.845
   74    HB   ILE  10           HB       ILE  10  34.271   1.066   5.340
   75   HG12  ILE  10          HG12      ILE  10  36.093   3.290   6.314
   76   HG13  ILE  10          HG11      ILE  10  35.633   3.053   4.628
   77   HG21  ILE  10          HG21      ILE  10  35.568   1.703   8.002
   78   HG22  ILE  10          HG22      ILE  10  34.799   0.158   7.633
   79   HG23  ILE  10          HG23      ILE  10  33.841   1.640   7.647
   80   HD11  ILE  10          HD11      ILE  10  33.733   3.569   6.933
   81   HD12  ILE  10          HD12      ILE  10  33.245   3.272   5.265
   82   HD13  ILE  10          HD13      ILE  10  34.167   4.721   5.669
   83    H    LEU  11           HN       LEU  11  35.615  -0.992   3.753
   84    HA   LEU  11           HA       LEU  11  37.303   0.053   1.611
   85    HB2  LEU  11           HB2      LEU  11  35.250  -2.145   1.842
   86    HB3  LEU  11           HB1      LEU  11  35.873  -1.668   0.262
   87    HG   LEU  11           HG       LEU  11  38.177  -2.081   1.047
   88   HD11  LEU  11          HD11      LEU  11  38.071  -1.643   3.379
   89   HD12  LEU  11          HD12      LEU  11  38.345  -3.381   3.264
   90   HD13  LEU  11          HD13      LEU  11  36.730  -2.765   3.612
   91   HD21  LEU  11          HD21      LEU  11  37.896  -4.600   1.410
   92   HD22  LEU  11          HD22      LEU  11  37.143  -3.941  -0.042
   93   HD23  LEU  11          HD23      LEU  11  36.156  -4.311   1.372
   94    H    ALA  12           HN       ALA  12  36.680   1.397  -0.039
   95    HA   ALA  12           HA       ALA  12  33.815   1.983  -0.484
   96    HB1  ALA  12           HB1      ALA  12  34.556   3.581   1.297
   97    HB2  ALA  12           HB2      ALA  12  34.091   4.393  -0.197
   98    HB3  ALA  12           HB3      ALA  12  35.797   4.182   0.198
   99    H    CYS  13           HN       CYS  13  33.581   1.951  -2.664
  100    HA   CYS  13           HA       CYS  13  35.854   1.935  -4.425
  101    HB2  CYS  13           HB2      CYS  13  33.940   2.258  -6.195
  102    HB3  CYS  13           HB1      CYS  13  34.020   0.759  -5.265
  103    HA   PRO  14           HA       PRO  14  36.478   6.270  -5.163
  104    HB2  PRO  14           HB2      PRO  14  37.257   6.257  -7.810
  105    HB3  PRO  14           HB1      PRO  14  38.307   5.735  -6.477
  106    HG2  PRO  14           HG2      PRO  14  36.668   4.080  -8.351
  107    HG3  PRO  14           HG1      PRO  14  38.320   3.810  -7.759
  108    HD2  PRO  14           HD2      PRO  14  36.192   2.485  -6.715
  109    HD3  PRO  14           HD1      PRO  14  37.591   2.943  -5.719
  110    H    ALA  15           HN       ALA  15  35.335   8.070  -5.940
  111    HA   ALA  15           HA       ALA  15  33.597   9.276  -6.944
  112    HB1  ALA  15           HB1      ALA  15  34.580   7.983  -9.009
  113    HB2  ALA  15           HB2      ALA  15  32.996   8.747  -9.144
  114    HB3  ALA  15           HB3      ALA  15  33.115   7.009  -8.873
  115    H    CYS  16           HN       CYS  16  32.660   5.824  -7.159
  116    HA   CYS  16           HA       CYS  16  29.986   6.519  -6.115
  117    HB2  CYS  16           HB2      CYS  16  29.840   3.860  -6.406
  118    HB3  CYS  16           HB1      CYS  16  29.700   4.939  -7.789
  119    H    HIS  17           HN       HIS  17  29.253   4.456  -4.570
  120    HA   HIS  17           HA       HIS  17  31.302   4.174  -2.405
  121    HB2  HIS  17           HB2      HIS  17  28.414   5.022  -2.036
  122    HB3  HIS  17           HB1      HIS  17  29.553   4.677  -0.731
  123    HD2  HIS  17           HD2      HIS  17  28.490   7.658  -2.864
  124    HE1  HIS  17           HE1      HIS  17  32.280   8.660  -1.295
  125    HE2  HIS  17           HE2      HIS  17  30.244   9.557  -2.511
  126    H    ALA  18           HN       ALA  18  31.580   2.004  -2.347
  127    HA   ALA  18           HA       ALA  18  29.526   0.277  -1.448
  128    HB1  ALA  18           HB1      ALA  18  29.138   0.759  -4.129
  129    HB2  ALA  18           HB2      ALA  18  28.652  -0.729  -3.335
  130    HB3  ALA  18           HB3      ALA  18  30.178  -0.656  -4.209
  131    HA   PRO  19           HA       PRO  19  33.008  -2.383  -0.794
  132    HB2  PRO  19           HB2      PRO  19  31.784  -4.835  -1.881
  133    HB3  PRO  19           HB1      PRO  19  32.116  -4.408  -0.193
  134    HG2  PRO  19           HG2      PRO  19  29.607  -4.543  -1.222
  135    HG3  PRO  19           HG1      PRO  19  30.051  -3.466   0.115
  136    HD2  PRO  19           HD2      PRO  19  29.659  -2.799  -2.791
  137    HD3  PRO  19           HD1      PRO  19  29.204  -1.880  -1.349
  138    H    LEU  20           HN       LEU  20  34.752  -3.637  -1.758
  139    HA   LEU  20           HA       LEU  20  34.857  -3.468  -4.753
  140    HB2  LEU  20           HB2      LEU  20  36.948  -2.998  -2.624
  141    HB3  LEU  20           HB1      LEU  20  37.404  -3.355  -4.290
  142    HG   LEU  20           HG       LEU  20  35.396  -1.168  -3.746
  143   HD11  LEU  20          HD11      LEU  20  37.470   0.388  -3.805
  144   HD12  LEU  20          HD12      LEU  20  38.389  -1.043  -3.348
  145   HD13  LEU  20          HD13      LEU  20  37.112  -0.439  -2.291
  146   HD21  LEU  20          HD21      LEU  20  36.033  -0.393  -5.879
  147   HD22  LEU  20          HD22      LEU  20  36.145  -2.137  -6.082
  148   HD23  LEU  20          HD23      LEU  20  37.602  -1.191  -5.814
  149    H    GLU  21           HN       GLU  21  35.660  -5.250  -5.854
  150    HA   GLU  21           HA       GLU  21  36.271  -7.678  -4.181
  151    HB2  GLU  21           HB2      GLU  21  34.707  -7.394  -6.754
  152    HB3  GLU  21           HB1      GLU  21  35.366  -8.944  -6.223
  153    HG2  GLU  21           HG2      GLU  21  34.132  -8.770  -4.109
  154    HG3  GLU  21           HG1      GLU  21  33.516  -7.193  -4.580
  155    H    GLU  22           HN       GLU  22  38.342  -8.226  -4.376
  156    HA   GLU  22           HA       GLU  22  39.985  -7.209  -6.568
  157    HB2  GLU  22           HB2      GLU  22  40.913  -7.391  -4.292
  158    HB3  GLU  22           HB1      GLU  22  40.640  -9.133  -4.317
  159    HG2  GLU  22           HG2      GLU  22  42.208  -9.405  -6.158
  160    HG3  GLU  22           HG1      GLU  22  42.405  -7.660  -6.294
  161    H    ARG  23           HN       ARG  23  40.401  -8.290  -8.444
  162    HA   ARG  23           HA       ARG  23  39.933 -11.255  -8.496
  163    HB2  ARG  23           HB2      ARG  23  38.054  -9.865  -9.563
  164    HB3  ARG  23           HB1      ARG  23  39.236  -9.410 -10.785
  165    HG2  ARG  23           HG2      ARG  23  38.295 -11.286 -11.796
  166    HG3  ARG  23           HG1      ARG  23  39.643 -12.031 -10.940
  167    HD2  ARG  23           HD2      ARG  23  38.088 -12.529  -9.034
  168    HD3  ARG  23           HD1      ARG  23  36.761 -11.887  -9.999
  169    HE   ARG  23           HE       ARG  23  38.141 -13.901 -11.498
  170   HH11  ARG  23          HH21      ARG  23  36.074 -13.396  -8.792
  171   HH12  ARG  23          HH22      ARG  23  35.320 -14.951  -8.905
  172   HH21  ARG  23          HH11      ARG  23  37.174 -15.938 -11.666
  173   HH22  ARG  23          HH12      ARG  23  35.943 -16.392 -10.533
  174    H    ASP  24           HN       ASP  24  41.710 -12.282  -9.129
  175    HA   ASP  24           HA       ASP  24  43.844 -12.669 -10.019
  176    HB2  ASP  24           HB2      ASP  24  42.580 -10.918 -12.141
  177    HB3  ASP  24           HB1      ASP  24  44.158 -11.677 -12.343
  178    H    ALA  25           HN       ALA  25  43.883  -9.605 -11.625
  179    HA   ALA  25           HA       ALA  25  45.630  -8.427  -9.492
  180    HB1  ALA  25           HB1      ALA  25  47.017  -9.437 -11.324
  181    HB2  ALA  25           HB2      ALA  25  47.211  -7.688 -11.191
  182    HB3  ALA  25           HB3      ALA  25  46.207  -8.371 -12.471
  183    H    GLU  26           HN       GLU  26  42.807  -7.998 -10.308
  184    HA   GLU  26           HA       GLU  26  43.034  -5.060 -10.833
  185    HB2  GLU  26           HB2      GLU  26  41.017  -5.245 -12.341
  186    HB3  GLU  26           HB1      GLU  26  42.490  -5.945 -13.009
  187    HG2  GLU  26           HG2      GLU  26  41.772  -8.177 -12.363
  188    HG3  GLU  26           HG1      GLU  26  40.344  -7.518 -11.565
  189    H    LEU  27           HN       LEU  27  41.214  -3.843 -10.054
  190    HA   LEU  27           HA       LEU  27  39.736  -5.272  -7.868
  191    HB2  LEU  27           HB2      LEU  27  40.161  -2.299  -8.286
  192    HB3  LEU  27           HB1      LEU  27  39.456  -3.066  -6.866
  193    HG   LEU  27           HG       LEU  27  42.290  -3.485  -7.865
  194   HD11  LEU  27          HD11      LEU  27  42.994  -2.147  -6.001
  195   HD12  LEU  27          HD12      LEU  27  41.358  -2.089  -5.346
  196   HD13  LEU  27          HD13      LEU  27  41.742  -1.230  -6.837
  197   HD21  LEU  27          HD21      LEU  27  42.407  -4.511  -5.439
  198   HD22  LEU  27          HD22      LEU  27  41.755  -5.479  -6.754
  199   HD23  LEU  27          HD23      LEU  27  40.661  -4.682  -5.624
  200    H    ILE  28           HN       ILE  28  37.599  -5.573  -8.100
  201    HA   ILE  28           HA       ILE  28  36.192  -4.184 -10.341
  202    HB   ILE  28           HB       ILE  28  35.526  -6.744  -8.865
  203   HG12  ILE  28          HG12      ILE  28  36.385  -6.309 -11.740
  204   HG13  ILE  28          HG11      ILE  28  37.506  -6.746 -10.450
  205   HG21  ILE  28          HG21      ILE  28  33.862  -6.944 -10.800
  206   HG22  ILE  28          HG22      ILE  28  34.143  -5.227 -11.089
  207   HG23  ILE  28          HG23      ILE  28  33.460  -5.763  -9.554
  208   HD11  ILE  28          HD11      ILE  28  35.137  -8.353 -11.438
  209   HD12  ILE  28          HD12      ILE  28  36.042  -8.749  -9.977
  210   HD13  ILE  28          HD13      ILE  28  36.843  -8.785 -11.548
  211    H    CYS  29           HN       CYS  29  34.595  -2.788  -9.890
  212    HA   CYS  29           HA       CYS  29  34.076  -2.011  -7.152
  213    HB2  CYS  29           HB2      CYS  29  33.953  -0.696  -9.474
  214    HB3  CYS  29           HB1      CYS  29  32.263  -1.178  -9.393
  215    H    THR  30           HN       THR  30  32.601  -2.964  -5.776
  216    HA   THR  30           HA       THR  30  30.669  -4.892  -6.916
  217    HB   THR  30           HB       THR  30  30.830  -4.402  -3.968
  218    HG1  THR  30           HG1      THR  30  32.990  -4.985  -5.583
  219   HG21  THR  30          HG21      THR  30  30.926  -6.885  -5.702
  220   HG22  THR  30          HG22      THR  30  29.506  -6.260  -4.867
  221   HG23  THR  30          HG23      THR  30  30.870  -6.877  -3.941
  222    H    GLY  31           HN       GLY  31  28.549  -4.857  -5.437
  223    HA2  GLY  31           HA2      GLY  31  26.646  -3.685  -4.675
  224    HA3  GLY  31           HA1      GLY  31  27.561  -2.185  -4.805
  225    H    GLN  32           HN       GLN  32  24.832  -2.837  -5.750
  226    HA   GLN  32           HA       GLN  32  24.945  -2.965  -8.655
  227    HB2  GLN  32           HB2      GLN  32  22.690  -2.109  -6.811
  228    HB3  GLN  32           HB1      GLN  32  22.529  -2.486  -8.527
  229    HG2  GLN  32           HG2      GLN  32  21.893  -4.485  -7.415
  230    HG3  GLN  32           HG1      GLN  32  23.549  -4.778  -7.942
  231   HE21  GLN  32          HE21      GLN  32  24.374  -6.081  -6.257
  232   HE22  GLN  32          HE22      GLN  32  24.366  -5.633  -4.620
  233    H    ASP  33           HN       ASP  33  25.546  -0.560  -6.365
  234    HA   ASP  33           HA       ASP  33  24.623   1.706  -7.984
  235    HB2  ASP  33           HB2      ASP  33  26.345   1.529  -5.493
  236    HB3  ASP  33           HB1      ASP  33  25.869   3.049  -6.253
  237    H    CYS  34           HN       CYS  34  27.171  -0.425  -8.234
  238    HA   CYS  34           HA       CYS  34  28.687   1.514  -9.909
  239    HB2  CYS  34           HB2      CYS  34  30.344  -0.352  -8.258
  240    HB3  CYS  34           HB1      CYS  34  30.687   1.296  -8.794
  241    H    GLY  35           HN       GLY  35  30.840  -0.465 -10.211
  242    HA2  GLY  35           HA2      GLY  35  30.479  -2.999 -10.952
  243    HA3  GLY  35           HA1      GLY  35  29.484  -2.221 -12.185
  244    H    LEU  36           HN       LEU  36  31.912  -0.100 -11.410
  245    HA   LEU  36           HA       LEU  36  33.270  -0.482 -13.936
  246    HB2  LEU  36           HB2      LEU  36  34.077   1.226 -11.565
  247    HB3  LEU  36           HB1      LEU  36  34.660   1.395 -13.220
  248    HG   LEU  36           HG       LEU  36  31.777   1.718 -12.336
  249   HD11  LEU  36          HD11      LEU  36  33.729   3.815 -13.323
  250   HD12  LEU  36          HD12      LEU  36  33.390   3.523 -11.617
  251   HD13  LEU  36          HD13      LEU  36  32.105   4.083 -12.689
  252   HD21  LEU  36          HD21      LEU  36  31.727   2.767 -14.752
  253   HD22  LEU  36          HD22      LEU  36  31.635   1.019 -14.574
  254   HD23  LEU  36          HD23      LEU  36  33.165   1.780 -15.015
  255    H    ALA  37           HN       ALA  37  35.610  -0.843 -14.146
  256    HA   ALA  37           HA       ALA  37  36.706  -2.629 -11.987
  257    HB1  ALA  37           HB1      ALA  37  37.906  -3.781 -13.901
  258    HB2  ALA  37           HB2      ALA  37  36.875  -2.860 -14.998
  259    HB3  ALA  37           HB3      ALA  37  36.158  -4.011 -13.872
  260    H    TYR  38           HN       TYR  38  38.769  -2.206 -11.331
  261    HA   TYR  38           HA       TYR  38  40.281  -0.048 -12.762
  262    HB2  TYR  38           HB2      TYR  38  40.553  -0.599  -9.815
  263    HB3  TYR  38           HB1      TYR  38  40.969   0.862 -10.711
  264    HD1  TYR  38           HD2      TYR  38  39.105   2.248 -11.738
  265    HD2  TYR  38           HD1      TYR  38  38.372  -0.909  -8.918
  266    HE1  TYR  38           HE2      TYR  38  36.841   3.161 -11.303
  267    HE2  TYR  38           HE1      TYR  38  36.107   0.005  -8.487
  268    HH   TYR  38           HH       TYR  38  34.975   2.279  -8.682
  269    HA   PRO  39           HA       PRO  39  43.049  -3.683 -12.804
  270    HB2  PRO  39           HB2      PRO  39  44.573  -3.005 -14.934
  271    HB3  PRO  39           HB1      PRO  39  42.911  -3.601 -15.125
  272    HG2  PRO  39           HG2      PRO  39  43.943  -0.802 -15.245
  273    HG3  PRO  39           HG1      PRO  39  42.713  -1.594 -16.249
  274    HD2  PRO  39           HD2      PRO  39  42.135   0.075 -14.102
  275    HD3  PRO  39           HD1      PRO  39  41.017  -1.154 -14.740
  276    H    VAL  40           HN       VAL  40  45.212  -4.028 -12.107
  277    HA   VAL  40           HA       VAL  40  46.435  -1.744 -10.728
  278    HB   VAL  40           HB       VAL  40  47.212  -4.666 -10.914
  279   HG11  VAL  40          HG11      VAL  40  49.244  -3.498 -10.496
  280   HG12  VAL  40          HG12      VAL  40  48.675  -4.004  -8.905
  281   HG13  VAL  40          HG13      VAL  40  48.448  -2.336  -9.434
  282   HG21  VAL  40          HG21      VAL  40  46.385  -4.753  -8.609
  283   HG22  VAL  40          HG22      VAL  40  45.119  -4.133  -9.669
  284   HG23  VAL  40          HG23      VAL  40  46.036  -3.025  -8.648
  285    H    ARG  41           HN       ARG  41  48.198  -0.602 -11.462
  286    HA   ARG  41           HA       ARG  41  49.536  -1.614 -13.969
  287    HB2  ARG  41           HB2      ARG  41  48.158   0.439 -14.291
  288    HB3  ARG  41           HB1      ARG  41  49.150   1.261 -13.088
  289    HG2  ARG  41           HG2      ARG  41  51.162   0.847 -14.478
  290    HG3  ARG  41           HG1      ARG  41  50.148   0.063 -15.690
  291    HD2  ARG  41           HD2      ARG  41  49.779   2.920 -14.752
  292    HD3  ARG  41           HD1      ARG  41  50.647   2.462 -16.216
  293    HE   ARG  41           HE       ARG  41  47.732   2.381 -15.833
  294   HH11  ARG  41          HH21      ARG  41  50.503   1.331 -17.603
  295   HH12  ARG  41          HH22      ARG  41  49.608   0.958 -19.038
  296   HH21  ARG  41          HH11      ARG  41  46.554   1.895 -17.696
  297   HH22  ARG  41          HH12      ARG  41  47.374   1.275 -19.090
  298    H    ASP  42           HN       ASP  42  51.656  -2.012 -13.779
  299    HA   ASP  42           HA       ASP  42  53.798  -2.144 -12.851
  300    HB2  ASP  42           HB2      ASP  42  53.042   0.708 -12.157
  301    HB3  ASP  42           HB1      ASP  42  54.649   0.040 -11.883
  302    H    GLY  43           HN       GLY  43  51.494  -2.991 -11.207
  303    HA2  GLY  43           HA2      GLY  43  51.385  -3.978  -9.061
  304    HA3  GLY  43           HA1      GLY  43  52.938  -3.235  -8.681
  305    H    ILE  44           HN       ILE  44  50.879  -0.890  -9.928
  306    HA   ILE  44           HA       ILE  44  50.099  -0.020  -7.169
  307    HB   ILE  44           HB       ILE  44  50.595   1.759  -9.562
  308   HG12  ILE  44          HG12      ILE  44  52.437   1.075  -7.245
  309   HG13  ILE  44          HG11      ILE  44  52.662   0.548  -8.912
  310   HG21  ILE  44          HG21      ILE  44  50.435   2.333  -6.587
  311   HG22  ILE  44          HG22      ILE  44  49.135   2.634  -7.739
  312   HG23  ILE  44          HG23      ILE  44  50.650   3.526  -7.867
  313   HD11  ILE  44          HD11      ILE  44  52.749   3.380  -7.846
  314   HD12  ILE  44          HD12      ILE  44  52.666   3.006  -9.567
  315   HD13  ILE  44          HD13      ILE  44  54.054   2.479  -8.615
  316    HA   PRO  45           HA       PRO  45  45.962  -0.364  -8.941
  317    HB2  PRO  45           HB2      PRO  45  44.510   0.648  -6.868
  318    HB3  PRO  45           HB1      PRO  45  45.245  -0.967  -6.820
  319    HG2  PRO  45           HG2      PRO  45  46.206   1.583  -5.600
  320    HG3  PRO  45           HG1      PRO  45  46.208  -0.059  -4.929
  321    HD2  PRO  45           HD2      PRO  45  48.436   1.113  -6.032
  322    HD3  PRO  45           HD1      PRO  45  48.170  -0.646  -6.013
  323    H    VAL  46           HN       VAL  46  44.529   1.007 -10.048
  324    HA   VAL  46           HA       VAL  46  45.296   3.894 -10.094
  325    HB   VAL  46           HB       VAL  46  43.611   2.285 -12.032
  326   HG11  VAL  46          HG11      VAL  46  44.628   5.130 -11.988
  327   HG12  VAL  46          HG12      VAL  46  42.980   4.561 -12.254
  328   HG13  VAL  46          HG13      VAL  46  44.207   4.323 -13.500
  329   HG21  VAL  46          HG21      VAL  46  45.573   2.268 -13.454
  330   HG22  VAL  46          HG22      VAL  46  46.037   1.625 -11.878
  331   HG23  VAL  46          HG23      VAL  46  46.460   3.280 -12.313
  332    H    LEU  47           HN       LEU  47  43.960   5.351  -9.191
  333    HA   LEU  47           HA       LEU  47  41.143   4.538  -8.531
  334    HB2  LEU  47           HB2      LEU  47  42.923   6.599  -7.193
  335    HB3  LEU  47           HB1      LEU  47  41.297   6.148  -6.684
  336    HG   LEU  47           HG       LEU  47  43.658   4.244  -6.824
  337   HD11  LEU  47          HD11      LEU  47  43.420   4.321  -4.295
  338   HD12  LEU  47          HD12      LEU  47  42.370   5.720  -4.515
  339   HD13  LEU  47          HD13      LEU  47  44.054   5.794  -5.032
  340   HD21  LEU  47          HD21      LEU  47  40.749   3.955  -6.069
  341   HD22  LEU  47          HD22      LEU  47  41.954   2.930  -5.292
  342   HD23  LEU  47          HD23      LEU  47  41.757   2.883  -7.040
  343    H    LEU  48           HN       LEU  48  42.100   5.677 -11.077
  344    HA   LEU  48           HA       LEU  48  40.840   8.395 -11.001
  345    HB2  LEU  48           HB2      LEU  48  42.572   7.149 -13.152
  346    HB3  LEU  48           HB1      LEU  48  42.013   8.817 -13.093
  347    HG   LEU  48           HG       LEU  48  43.832   7.493 -11.059
  348   HD11  LEU  48          HD11      LEU  48  45.482   9.181 -11.992
  349   HD12  LEU  48          HD12      LEU  48  44.332   9.471 -13.298
  350   HD13  LEU  48          HD13      LEU  48  45.052   7.873 -13.093
  351   HD21  LEU  48          HD21      LEU  48  44.085  10.039 -10.432
  352   HD22  LEU  48          HD22      LEU  48  42.694   9.142  -9.834
  353   HD23  LEU  48          HD23      LEU  48  42.521  10.206 -11.231
  354    H    VAL  49           HN       VAL  49  38.941   8.692 -11.995
  355    HA   VAL  49           HA       VAL  49  37.406   6.493 -12.999
  356    HB   VAL  49           HB       VAL  49  37.001   9.477 -13.326
  357   HG11  VAL  49          HG11      VAL  49  35.196   7.099 -13.842
  358   HG12  VAL  49          HG12      VAL  49  35.676   8.352 -14.987
  359   HG13  VAL  49          HG13      VAL  49  34.589   8.744 -13.654
  360   HG21  VAL  49          HG21      VAL  49  35.774   7.503 -11.375
  361   HG22  VAL  49          HG22      VAL  49  35.512   9.246 -11.409
  362   HG23  VAL  49          HG23      VAL  49  37.096   8.600 -10.979
  363    H    ASP  50           HN       ASP  50  39.180   9.107 -14.630
  364    HA   ASP  50           HA       ASP  50  38.385   8.496 -17.288
  365    HB2  ASP  50           HB2      ASP  50  40.662   9.542 -17.874
  366    HB3  ASP  50           HB1      ASP  50  39.544  10.544 -16.948
  367    H    GLU  51           HN       GLU  51  40.453   6.787 -15.117
  368    HA   GLU  51           HA       GLU  51  41.626   5.161 -17.345
  369    HB2  GLU  51           HB2      GLU  51  42.256   5.215 -14.383
  370    HB3  GLU  51           HB1      GLU  51  43.109   4.262 -15.593
  371    HG2  GLU  51           HG2      GLU  51  42.892   7.284 -15.630
  372    HG3  GLU  51           HG1      GLU  51  44.293   6.391 -15.042
  373    H    ALA  52           HN       ALA  52  39.143   5.161 -15.003
  374    HA   ALA  52           HA       ALA  52  38.976   2.448 -14.228
  375    HB1  ALA  52           HB1      ALA  52  37.511   4.182 -13.291
  376    HB2  ALA  52           HB2      ALA  52  36.544   2.867 -13.956
  377    HB3  ALA  52           HB3      ALA  52  36.718   4.376 -14.852
  378    H    ARG  53           HN       ARG  53  38.029   0.623 -15.178
  379    HA   ARG  53           HA       ARG  53  37.487   0.843 -18.123
  380    HB2  ARG  53           HB2      ARG  53  39.389  -0.617 -17.460
  381    HB3  ARG  53           HB1      ARG  53  38.275  -1.595 -16.505
  382    HG2  ARG  53           HG2      ARG  53  36.987  -2.152 -18.501
  383    HG3  ARG  53           HG1      ARG  53  38.001  -1.091 -19.482
  384    HD2  ARG  53           HD2      ARG  53  39.045  -3.471 -17.924
  385    HD3  ARG  53           HD1      ARG  53  38.650  -3.508 -19.643
  386    HE   ARG  53           HE       ARG  53  40.409  -1.344 -19.300
  387   HH11  ARG  53          HH21      ARG  53  40.334  -4.750 -18.797
  388   HH12  ARG  53          HH22      ARG  53  42.033  -4.962 -19.067
  389   HH21  ARG  53          HH11      ARG  53  42.624  -1.595 -19.652
  390   HH22  ARG  53          HH12      ARG  53  43.330  -3.173 -19.552
  391    H    ARG  54           HN       ARG  54  35.555   0.119 -18.908
  392    HA   ARG  54           HA       ARG  54  33.426  -0.359 -16.952
  393    HB2  ARG  54           HB2      ARG  54  33.547   0.132 -19.921
  394    HB3  ARG  54           HB1      ARG  54  32.060  -0.477 -19.199
  395    HG2  ARG  54           HG2      ARG  54  32.034   1.428 -17.635
  396    HG3  ARG  54           HG1      ARG  54  33.521   2.042 -18.354
  397    HD2  ARG  54           HD2      ARG  54  31.808   3.272 -19.429
  398    HD3  ARG  54           HD1      ARG  54  32.235   2.018 -20.593
  399    HE   ARG  54           HE       ARG  54  30.057   1.165 -20.342
  400   HH11  ARG  54          HH21      ARG  54  30.993   3.076 -17.627
  401   HH12  ARG  54          HH22      ARG  54  29.443   2.985 -16.861
  402   HH21  ARG  54          HH11      ARG  54  28.028   1.042 -19.359
  403   HH22  ARG  54          HH12      ARG  54  27.764   1.834 -17.841
  404    HA   PRO  55           HA       PRO  55  33.171  -4.792 -17.004
  405    HB2  PRO  55           HB2      PRO  55  30.415  -4.492 -18.156
  406    HB3  PRO  55           HB1      PRO  55  30.953  -5.441 -16.755
  407    HG2  PRO  55           HG2      PRO  55  29.670  -3.073 -16.516
  408    HG3  PRO  55           HG1      PRO  55  30.864  -3.644 -15.339
  409    HD2  PRO  55           HD2      PRO  55  31.104  -1.435 -17.292
  410    HD3  PRO  55           HD1      PRO  55  32.064  -1.765 -15.833
  411    H    GLU  56           HN       GLU  56  33.656  -6.413 -18.450
  412    HA   GLU  56           HA       GLU  56  34.178  -7.446 -20.476
  413    HB2  GLU  56           HB2      GLU  56  31.686  -7.401 -20.701
  414    HB3  GLU  56           HB1      GLU  56  31.823  -5.859 -21.544
  415    HG2  GLU  56           HG2      GLU  56  33.212  -6.902 -23.278
  416    HG3  GLU  56           HG1      GLU  56  33.129  -8.445 -22.429
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1  31.893  -6.406  22.350
    2    H2   MET   1           HT2      MET   1  31.783  -4.838  22.994
    3    H3   MET   1           HT3      MET   1  32.929  -5.933  23.606
    4    HA   MET   1           HA       MET   1  34.345  -4.867  22.256
    5    HB2  MET   1           HB2      MET   1  32.771  -6.646  20.379
    6    HB3  MET   1           HB1      MET   1  34.255  -5.823  19.895
    7    HG2  MET   1           HG2      MET   1  34.827  -8.064  20.641
    8    HG3  MET   1           HG1      MET   1  35.421  -6.909  21.834
    9    HE1  MET   1           HE1      MET   1  34.161 -10.378  22.021
   10    HE2  MET   1           HE2      MET   1  34.409 -10.112  23.745
   11    HE3  MET   1           HE3      MET   1  35.560  -9.453  22.586
   12    HA   PRO   2           HA       PRO   2  31.300  -1.586  20.879
   13    HB2  PRO   2           HB2      PRO   2  33.428   0.100  22.139
   14    HB3  PRO   2           HB1      PRO   2  31.666   0.179  22.339
   15    HG2  PRO   2           HG2      PRO   2  33.224  -0.798  24.266
   16    HG3  PRO   2           HG1      PRO   2  31.640  -1.519  23.914
   17    HD2  PRO   2           HD2      PRO   2  34.372  -2.517  23.148
   18    HD3  PRO   2           HD1      PRO   2  32.952  -3.435  23.703
   19    H    LEU   3           HN       LEU   3  34.183  -2.774  19.940
   20    HA   LEU   3           HA       LEU   3  35.284  -0.604  18.367
   21    HB2  LEU   3           HB2      LEU   3  35.643  -3.597  18.027
   22    HB3  LEU   3           HB1      LEU   3  36.696  -2.339  17.384
   23    HG   LEU   3           HG       LEU   3  36.167  -2.839  20.329
   24   HD11  LEU   3          HD11      LEU   3  38.522  -3.501  18.539
   25   HD12  LEU   3          HD12      LEU   3  37.489  -4.641  19.402
   26   HD13  LEU   3          HD13      LEU   3  38.573  -3.579  20.300
   27   HD21  LEU   3          HD21      LEU   3  37.786  -0.799  18.801
   28   HD22  LEU   3          HD22      LEU   3  38.305  -1.302  20.410
   29   HD23  LEU   3          HD23      LEU   3  36.724  -0.558  20.189
   30    H    GLU   4           HN       GLU   4  34.192  -3.687  16.978
   31    HA   GLU   4           HA       GLU   4  33.014  -4.121  14.999
   32    HB2  GLU   4           HB2      GLU   4  31.150  -3.206  16.370
   33    HB3  GLU   4           HB1      GLU   4  31.528  -1.591  15.773
   34    HG2  GLU   4           HG2      GLU   4  31.100  -2.316  13.465
   35    HG3  GLU   4           HG1      GLU   4  30.775  -3.955  14.030
   36    H    ALA   5           HN       ALA   5  32.677  -0.606  14.802
   37    HA   ALA   5           HA       ALA   5  33.660  -0.562  12.087
   38    HB1  ALA   5           HB1      ALA   5  33.282   1.788  12.176
   39    HB2  ALA   5           HB2      ALA   5  33.468   1.828  13.929
   40    HB3  ALA   5           HB3      ALA   5  32.038   1.087  13.210
   41    H    GLY   6           HN       GLY   6  35.256  -0.745  15.062
   42    HA2  GLY   6           HA2      GLY   6  37.637   0.781  14.216
   43    HA3  GLY   6           HA1      GLY   6  37.457  -0.108  15.729
   44    H    LEU   7           HN       LEU   7  36.371  -2.324  13.730
   45    HA   LEU   7           HA       LEU   7  38.880  -3.800  13.668
   46    HB2  LEU   7           HB2      LEU   7  36.252  -4.449  12.301
   47    HB3  LEU   7           HB1      LEU   7  37.566  -5.574  12.637
   48    HG   LEU   7           HG       LEU   7  35.967  -4.076  14.733
   49   HD11  LEU   7          HD11      LEU   7  34.846  -6.141  15.163
   50   HD12  LEU   7          HD12      LEU   7  35.960  -7.042  14.136
   51   HD13  LEU   7          HD13      LEU   7  34.798  -5.930  13.413
   52   HD21  LEU   7          HD21      LEU   7  38.320  -5.967  14.836
   53   HD22  LEU   7          HD22      LEU   7  37.169  -5.930  16.171
   54   HD23  LEU   7          HD23      LEU   7  38.055  -4.472  15.735
   55    H    LEU   8           HN       LEU   8  36.678  -3.413  10.900
   56    HA   LEU   8           HA       LEU   8  39.030  -3.186   9.131
   57    HB2  LEU   8           HB2      LEU   8  37.215  -4.692   8.463
   58    HB3  LEU   8           HB1      LEU   8  36.064  -3.359   8.515
   59    HG   LEU   8           HG       LEU   8  37.237  -2.223   6.695
   60   HD11  LEU   8          HD11      LEU   8  39.237  -4.438   7.119
   61   HD12  LEU   8          HD12      LEU   8  39.517  -2.710   6.904
   62   HD13  LEU   8          HD13      LEU   8  39.075  -3.706   5.521
   63   HD21  LEU   8          HD21      LEU   8  36.839  -5.151   6.016
   64   HD22  LEU   8          HD22      LEU   8  36.718  -3.784   4.908
   65   HD23  LEU   8          HD23      LEU   8  35.528  -3.985   6.192
   66    H    GLU   9           HN       GLU   9  39.742  -1.295   8.345
   67    HA   GLU   9           HA       GLU   9  38.828   1.222   9.227
   68    HB2  GLU   9           HB2      GLU   9  40.354   0.487   6.712
   69    HB3  GLU   9           HB1      GLU   9  40.174   2.135   7.315
   70    HG2  GLU   9           HG2      GLU   9  41.392  -0.148   8.897
   71    HG3  GLU   9           HG1      GLU   9  42.323   1.074   8.029
   72    H    ILE  10           HN       ILE  10  38.359   2.928   7.231
   73    HA   ILE  10           HA       ILE  10  35.665   2.125   6.296
   74    HB   ILE  10           HB       ILE  10  36.040   4.335   7.414
   75   HG12  ILE  10          HG12      ILE  10  34.847   5.699   5.699
   76   HG13  ILE  10          HG11      ILE  10  35.192   4.460   4.499
   77   HG21  ILE  10          HG21      ILE  10  37.400   6.009   6.481
   78   HG22  ILE  10          HG22      ILE  10  37.448   5.234   4.900
   79   HG23  ILE  10          HG23      ILE  10  38.365   4.553   6.246
   80   HD11  ILE  10          HD11      ILE  10  32.889   4.480   5.843
   81   HD12  ILE  10          HD12      ILE  10  33.843   3.603   7.038
   82   HD13  ILE  10          HD13      ILE  10  33.673   2.967   5.401
   83    H    LEU  11           HN       LEU  11  35.379   1.395   4.254
   84    HA   LEU  11           HA       LEU  11  37.423   2.102   2.165
   85    HB2  LEU  11           HB2      LEU  11  37.327  -0.345   2.870
   86    HB3  LEU  11           HB1      LEU  11  35.688  -0.380   2.232
   87    HG   LEU  11           HG       LEU  11  36.568   0.381   0.026
   88   HD11  LEU  11          HD11      LEU  11  38.602   1.443   0.264
   89   HD12  LEU  11          HD12      LEU  11  39.218  -0.172  -0.066
   90   HD13  LEU  11          HD13      LEU  11  39.125   0.407   1.590
   91   HD21  LEU  11          HD21      LEU  11  36.184  -1.946   0.197
   92   HD22  LEU  11          HD22      LEU  11  37.542  -2.182   1.299
   93   HD23  LEU  11          HD23      LEU  11  37.837  -1.838  -0.402
   94    H    ALA  12           HN       ALA  12  36.580   3.327   0.567
   95    HA   ALA  12           HA       ALA  12  33.685   3.014  -0.140
   96    HB1  ALA  12           HB1      ALA  12  33.999   5.012   1.363
   97    HB2  ALA  12           HB2      ALA  12  33.409   5.430  -0.246
   98    HB3  ALA  12           HB3      ALA  12  35.106   5.681   0.165
   99    H    CYS  13           HN       CYS  13  33.263   3.407  -2.354
  100    HA   CYS  13           HA       CYS  13  35.696   3.410  -4.066
  101    HB2  CYS  13           HB2      CYS  13  33.879   2.822  -5.834
  102    HB3  CYS  13           HB1      CYS  13  34.408   1.602  -4.675
  103    HA   PRO  14           HA       PRO  14  34.757   7.829  -4.808
  104    HB2  PRO  14           HB2      PRO  14  36.553   7.349  -7.158
  105    HB3  PRO  14           HB1      PRO  14  36.613   8.636  -5.939
  106    HG2  PRO  14           HG2      PRO  14  38.331   6.575  -5.930
  107    HG3  PRO  14           HG1      PRO  14  37.761   7.338  -4.434
  108    HD2  PRO  14           HD2      PRO  14  37.032   4.683  -5.583
  109    HD3  PRO  14           HD1      PRO  14  37.039   5.228  -3.886
  110    H    ALA  15           HN       ALA  15  33.394   8.924  -6.246
  111    HA   ALA  15           HA       ALA  15  31.959   9.266  -8.073
  112    HB1  ALA  15           HB1      ALA  15  33.947   7.976  -9.297
  113    HB2  ALA  15           HB2      ALA  15  32.407   8.246 -10.112
  114    HB3  ALA  15           HB3      ALA  15  32.753   6.680  -9.385
  115    H    CYS  16           HN       CYS  16  32.205   6.012  -6.703
  116    HA   CYS  16           HA       CYS  16  29.205   5.836  -6.825
  117    HB2  CYS  16           HB2      CYS  16  29.830   3.256  -6.767
  118    HB3  CYS  16           HB1      CYS  16  29.792   4.127  -8.288
  119    H    HIS  17           HN       HIS  17  28.895   3.625  -5.204
  120    HA   HIS  17           HA       HIS  17  30.358   4.171  -2.676
  121    HB2  HIS  17           HB2      HIS  17  28.236   4.385  -1.419
  122    HB3  HIS  17           HB1      HIS  17  28.408   5.678  -2.605
  123    HD2  HIS  17           HD2      HIS  17  25.955   2.819  -1.762
  124    HE1  HIS  17           HE1      HIS  17  24.813   4.319  -5.541
  125    HE2  HIS  17           HE2      HIS  17  24.124   2.814  -3.620
  126    H    ALA  18           HN       ALA  18  31.067   2.155  -2.202
  127    HA   ALA  18           HA       ALA  18  29.518   0.109  -1.259
  128    HB1  ALA  18           HB1      ALA  18  28.337  -0.524  -3.143
  129    HB2  ALA  18           HB2      ALA  18  29.787  -1.476  -3.452
  130    HB3  ALA  18           HB3      ALA  18  29.574   0.088  -4.226
  131    HA   PRO  19           HA       PRO  19  33.524  -1.595  -0.402
  132    HB2  PRO  19           HB2      PRO  19  32.497  -4.323  -1.074
  133    HB3  PRO  19           HB1      PRO  19  33.235  -3.735   0.430
  134    HG2  PRO  19           HG2      PRO  19  30.614  -4.199   0.255
  135    HG3  PRO  19           HG1      PRO  19  31.257  -2.850   1.209
  136    HD2  PRO  19           HD2      PRO  19  29.922  -2.792  -1.476
  137    HD3  PRO  19           HD1      PRO  19  29.840  -1.633  -0.132
  138    H    LEU  20           HN       LEU  20  35.211  -3.229  -1.355
  139    HA   LEU  20           HA       LEU  20  35.158  -3.099  -4.360
  140    HB2  LEU  20           HB2      LEU  20  37.515  -2.858  -2.466
  141    HB3  LEU  20           HB1      LEU  20  37.623  -2.860  -4.225
  142    HG   LEU  20           HG       LEU  20  36.028  -0.854  -2.598
  143   HD11  LEU  20          HD11      LEU  20  38.798  -0.759  -3.798
  144   HD12  LEU  20          HD12      LEU  20  38.293  -0.359  -2.157
  145   HD13  LEU  20          HD13      LEU  20  37.873   0.709  -3.490
  146   HD21  LEU  20          HD21      LEU  20  36.317   0.325  -4.985
  147   HD22  LEU  20          HD22      LEU  20  35.004  -0.805  -4.681
  148   HD23  LEU  20          HD23      LEU  20  36.449  -1.342  -5.537
  149    H    GLU  21           HN       GLU  21  35.753  -4.965  -5.450
  150    HA   GLU  21           HA       GLU  21  36.462  -7.345  -3.743
  151    HB2  GLU  21           HB2      GLU  21  34.515  -7.092  -6.035
  152    HB3  GLU  21           HB1      GLU  21  35.216  -8.648  -5.604
  153    HG2  GLU  21           HG2      GLU  21  34.367  -8.409  -3.310
  154    HG3  GLU  21           HG1      GLU  21  33.685  -6.840  -3.720
  155    H    GLU  22           HN       GLU  22  38.187  -8.480  -4.367
  156    HA   GLU  22           HA       GLU  22  39.760  -7.500  -6.653
  157    HB2  GLU  22           HB2      GLU  22  41.515  -8.993  -5.773
  158    HB3  GLU  22           HB1      GLU  22  40.893  -7.921  -4.517
  159    HG2  GLU  22           HG2      GLU  22  39.373  -9.744  -3.758
  160    HG3  GLU  22           HG1      GLU  22  40.098 -10.814  -4.960
  161    H    ARG  23           HN       ARG  23  40.121  -8.636  -8.529
  162    HA   ARG  23           HA       ARG  23  39.030 -11.422  -8.707
  163    HB2  ARG  23           HB2      ARG  23  37.303  -9.845  -9.553
  164    HB3  ARG  23           HB1      ARG  23  38.471  -9.221 -10.717
  165    HG2  ARG  23           HG2      ARG  23  38.677 -11.440 -11.735
  166    HG3  ARG  23           HG1      ARG  23  37.565 -12.109 -10.541
  167    HD2  ARG  23           HD2      ARG  23  35.811 -10.525 -11.349
  168    HD3  ARG  23           HD1      ARG  23  36.923  -9.979 -12.600
  169    HE   ARG  23           HE       ARG  23  36.610 -12.048 -13.747
  170   HH11  ARG  23          HH21      ARG  23  35.152 -12.005 -10.612
  171   HH12  ARG  23          HH22      ARG  23  34.231 -13.445 -10.884
  172   HH21  ARG  23          HH11      ARG  23  35.420 -13.923 -14.105
  173   HH22  ARG  23          HH12      ARG  23  34.384 -14.531 -12.856
  174    H    ASP  24           HN       ASP  24  40.555 -12.703  -9.488
  175    HA   ASP  24           HA       ASP  24  42.504 -13.439 -10.556
  176    HB2  ASP  24           HB2      ASP  24  41.489 -11.362 -12.511
  177    HB3  ASP  24           HB1      ASP  24  42.869 -12.405 -12.849
  178    H    ALA  25           HN       ALA  25  43.001 -10.318 -11.979
  179    HA   ALA  25           HA       ALA  25  45.099  -9.650  -9.944
  180    HB1  ALA  25           HB1      ALA  25  46.509  -8.900 -11.939
  181    HB2  ALA  25           HB2      ALA  25  45.381  -9.799 -12.956
  182    HB3  ALA  25           HB3      ALA  25  46.340 -10.644 -11.741
  183    H    GLU  26           HN       GLU  26  42.331  -8.646 -10.562
  184    HA   GLU  26           HA       GLU  26  43.101  -5.765 -10.924
  185    HB2  GLU  26           HB2      GLU  26  40.765  -7.130 -12.303
  186    HB3  GLU  26           HB1      GLU  26  41.134  -5.404 -12.363
  187    HG2  GLU  26           HG2      GLU  26  43.343  -5.928 -13.376
  188    HG3  GLU  26           HG1      GLU  26  42.920  -7.637 -13.369
  189    H    LEU  27           HN       LEU  27  41.433  -4.274 -10.061
  190    HA   LEU  27           HA       LEU  27  39.885  -5.572  -7.835
  191    HB2  LEU  27           HB2      LEU  27  41.293  -2.928  -8.110
  192    HB3  LEU  27           HB1      LEU  27  39.993  -3.116  -6.934
  193    HG   LEU  27           HG       LEU  27  42.183  -5.194  -7.008
  194   HD11  LEU  27          HD11      LEU  27  43.591  -3.328  -6.898
  195   HD12  LEU  27          HD12      LEU  27  43.324  -3.714  -5.200
  196   HD13  LEU  27          HD13      LEU  27  42.442  -2.383  -5.953
  197   HD21  LEU  27          HD21      LEU  27  41.678  -5.270  -4.584
  198   HD22  LEU  27          HD22      LEU  27  40.215  -5.498  -5.538
  199   HD23  LEU  27          HD23      LEU  27  40.538  -3.941  -4.781
  200    H    ILE  28           HN       ILE  28  37.756  -5.654  -8.182
  201    HA   ILE  28           HA       ILE  28  36.547  -3.655 -10.053
  202    HB   ILE  28           HB       ILE  28  34.653  -5.413 -10.091
  203   HG12  ILE  28          HG12      ILE  28  36.929  -7.096  -8.998
  204   HG13  ILE  28          HG11      ILE  28  35.484  -6.648  -8.095
  205   HG21  ILE  28          HG21      ILE  28  36.284  -5.009 -11.944
  206   HG22  ILE  28          HG22      ILE  28  35.803  -6.698 -11.825
  207   HG23  ILE  28          HG23      ILE  28  37.371  -6.182 -11.203
  208   HD11  ILE  28          HD11      ILE  28  34.105  -7.751  -9.877
  209   HD12  ILE  28          HD12      ILE  28  35.159  -8.871  -9.012
  210   HD13  ILE  28          HD13      ILE  28  35.605  -8.307 -10.624
  211    H    CYS  29           HN       CYS  29  34.757  -2.490  -9.466
  212    HA   CYS  29           HA       CYS  29  34.505  -1.992  -6.635
  213    HB2  CYS  29           HB2      CYS  29  33.865  -0.674  -9.023
  214    HB3  CYS  29           HB1      CYS  29  32.308  -0.913  -8.245
  215    H    THR  30           HN       THR  30  33.038  -2.789  -5.179
  216    HA   THR  30           HA       THR  30  31.529  -5.134  -5.909
  217    HB   THR  30           HB       THR  30  31.241  -3.554  -3.348
  218    HG1  THR  30           HG1      THR  30  33.001  -5.100  -2.737
  219   HG21  THR  30          HG21      THR  30  31.120  -6.510  -4.003
  220   HG22  THR  30          HG22      THR  30  29.725  -5.469  -3.711
  221   HG23  THR  30          HG23      THR  30  30.869  -5.800  -2.409
  222    H    GLY  31           HN       GLY  31  29.331  -5.348  -6.027
  223    HA2  GLY  31           HA2      GLY  31  27.035  -4.526  -5.746
  224    HA3  GLY  31           HA1      GLY  31  27.630  -2.888  -5.963
  225    H    GLN  32           HN       GLN  32  25.600  -4.620  -7.436
  226    HA   GLN  32           HA       GLN  32  26.595  -5.162 -10.076
  227    HB2  GLN  32           HB2      GLN  32  23.792  -4.523  -9.107
  228    HB3  GLN  32           HB1      GLN  32  24.180  -5.163 -10.704
  229    HG2  GLN  32           HG2      GLN  32  23.595  -7.064  -9.398
  230    HG3  GLN  32           HG1      GLN  32  25.357  -7.082  -9.474
  231   HE21  GLN  32          HE21      GLN  32  25.868  -7.981  -7.425
  232   HE22  GLN  32          HE22      GLN  32  25.389  -7.291  -5.951
  233    H    ASP  33           HN       ASP  33  24.873  -2.360  -8.693
  234    HA   ASP  33           HA       ASP  33  25.018  -0.868 -11.202
  235    HB2  ASP  33           HB2      ASP  33  23.223  -0.583  -9.426
  236    HB3  ASP  33           HB1      ASP  33  24.444   0.208  -8.428
  237    H    CYS  34           HN       CYS  34  27.233  -1.624  -8.815
  238    HA   CYS  34           HA       CYS  34  28.712   0.930  -8.929
  239    HB2  CYS  34           HB2      CYS  34  28.496  -1.017  -7.014
  240    HB3  CYS  34           HB1      CYS  34  30.023  -1.474  -7.759
  241    H    GLY  35           HN       GLY  35  29.149  -2.452  -9.957
  242    HA2  GLY  35           HA2      GLY  35  30.723  -3.394 -11.448
  243    HA3  GLY  35           HA1      GLY  35  30.185  -2.070 -12.481
  244    H    LEU  36           HN       LEU  36  31.582  -0.453 -12.919
  245    HA   LEU  36           HA       LEU  36  33.710   0.486 -13.232
  246    HB2  LEU  36           HB2      LEU  36  32.828   0.818 -10.416
  247    HB3  LEU  36           HB1      LEU  36  34.526   1.194 -10.706
  248    HG   LEU  36           HG       LEU  36  32.380   2.312 -12.518
  249   HD11  LEU  36          HD11      LEU  36  31.745   2.885 -10.184
  250   HD12  LEU  36          HD12      LEU  36  32.248   4.304 -11.101
  251   HD13  LEU  36          HD13      LEU  36  33.350   3.573  -9.936
  252   HD21  LEU  36          HD21      LEU  36  34.026   3.888 -13.117
  253   HD22  LEU  36          HD22      LEU  36  34.966   2.412 -12.914
  254   HD23  LEU  36          HD23      LEU  36  34.955   3.629 -11.642
  255    H    ALA  37           HN       ALA  37  35.386  -0.672 -13.917
  256    HA   ALA  37           HA       ALA  37  36.606  -2.705 -12.095
  257    HB1  ALA  37           HB1      ALA  37  36.007  -3.751 -14.121
  258    HB2  ALA  37           HB2      ALA  37  37.729  -3.422 -14.308
  259    HB3  ALA  37           HB3      ALA  37  36.536  -2.377 -15.084
  260    H    TYR  38           HN       TYR  38  38.540  -2.285 -11.222
  261    HA   TYR  38           HA       TYR  38  40.175  -0.035 -12.329
  262    HB2  TYR  38           HB2      TYR  38  40.095  -1.128  -9.510
  263    HB3  TYR  38           HB1      TYR  38  41.026   0.264 -10.066
  264    HD1  TYR  38           HD2      TYR  38  39.805   2.284 -10.988
  265    HD2  TYR  38           HD1      TYR  38  37.786  -0.930  -8.978
  266    HE1  TYR  38           HE2      TYR  38  37.822   3.738 -10.647
  267    HE2  TYR  38           HE1      TYR  38  35.815   0.523  -8.644
  268    HH   TYR  38           HH       TYR  38  34.972   2.561  -8.862
  269    HA   PRO  39           HA       PRO  39  42.826  -3.714 -12.917
  270    HB2  PRO  39           HB2      PRO  39  44.291  -2.778 -15.015
  271    HB3  PRO  39           HB1      PRO  39  42.648  -3.421 -15.210
  272    HG2  PRO  39           HG2      PRO  39  43.583  -0.596 -15.182
  273    HG3  PRO  39           HG1      PRO  39  42.267  -1.342 -16.106
  274    HD2  PRO  39           HD2      PRO  39  41.945   0.163 -13.760
  275    HD3  PRO  39           HD1      PRO  39  40.729  -0.942 -14.440
  276    H    VAL  40           HN       VAL  40  45.284  -3.972 -12.896
  277    HA   VAL  40           HA       VAL  40  46.424  -2.025 -10.972
  278    HB   VAL  40           HB       VAL  40  47.376  -4.727 -11.950
  279   HG11  VAL  40          HG11      VAL  40  48.974  -4.457  -9.961
  280   HG12  VAL  40          HG12      VAL  40  48.575  -2.739 -10.012
  281   HG13  VAL  40          HG13      VAL  40  49.347  -3.508 -11.400
  282   HG21  VAL  40          HG21      VAL  40  46.679  -5.528  -9.800
  283   HG22  VAL  40          HG22      VAL  40  45.342  -4.559 -10.419
  284   HG23  VAL  40          HG23      VAL  40  46.426  -3.889  -9.201
  285    H    ARG  41           HN       ARG  41  47.968  -0.558 -11.532
  286    HA   ARG  41           HA       ARG  41  49.150  -0.777 -14.299
  287    HB2  ARG  41           HB2      ARG  41  47.654   1.182 -13.946
  288    HB3  ARG  41           HB1      ARG  41  48.691   1.706 -12.618
  289    HG2  ARG  41           HG2      ARG  41  50.602   1.878 -14.163
  290    HG3  ARG  41           HG1      ARG  41  49.582   1.330 -15.494
  291    HD2  ARG  41           HD2      ARG  41  49.043   3.811 -13.840
  292    HD3  ARG  41           HD1      ARG  41  49.839   3.819 -15.413
  293    HE   ARG  41           HE       ARG  41  46.975   3.390 -14.932
  294   HH11  ARG  41          HH21      ARG  41  49.701   2.980 -17.004
  295   HH12  ARG  41          HH22      ARG  41  48.752   2.858 -18.448
  296   HH21  ARG  41          HH11      ARG  41  45.720   3.231 -16.805
  297   HH22  ARG  41          HH12      ARG  41  46.498   3.000 -18.335
  298    H    ASP  42           HN       ASP  42  51.338  -0.969 -14.396
  299    HA   ASP  42           HA       ASP  42  53.561  -1.147 -13.680
  300    HB2  ASP  42           HB2      ASP  42  52.639   1.201 -11.995
  301    HB3  ASP  42           HB1      ASP  42  54.307   0.649 -12.057
  302    H    GLY  43           HN       GLY  43  51.058  -2.143 -11.888
  303    HA2  GLY  43           HA2      GLY  43  51.398  -4.064 -10.380
  304    HA3  GLY  43           HA1      GLY  43  52.840  -3.274  -9.753
  305    H    ILE  44           HN       ILE  44  50.821  -0.758 -10.066
  306    HA   ILE  44           HA       ILE  44  49.747  -1.103  -7.303
  307    HB   ILE  44           HB       ILE  44  51.439   0.792  -7.853
  308   HG12  ILE  44          HG12      ILE  44  48.810   1.584  -6.564
  309   HG13  ILE  44          HG11      ILE  44  50.015   0.568  -5.769
  310   HG21  ILE  44          HG21      ILE  44  50.026   1.498  -9.911
  311   HG22  ILE  44          HG22      ILE  44  50.629   2.772  -8.865
  312   HG23  ILE  44          HG23      ILE  44  48.948   2.254  -8.747
  313   HD11  ILE  44          HD11      ILE  44  50.533   3.361  -6.822
  314   HD12  ILE  44          HD12      ILE  44  51.684   2.342  -5.957
  315   HD13  ILE  44          HD13      ILE  44  50.250   2.952  -5.130
  316    HA   PRO  45           HA       PRO  45  45.568  -1.186  -9.049
  317    HB2  PRO  45           HB2      PRO  45  44.895   0.342  -6.559
  318    HB3  PRO  45           HB1      PRO  45  44.121  -1.101  -7.236
  319    HG2  PRO  45           HG2      PRO  45  45.745  -1.248  -5.126
  320    HG3  PRO  45           HG1      PRO  45  45.710  -2.521  -6.359
  321    HD2  PRO  45           HD2      PRO  45  47.800  -0.447  -5.869
  322    HD3  PRO  45           HD1      PRO  45  47.947  -2.085  -6.551
  323    H    VAL  46           HN       VAL  46  44.306   0.262 -10.243
  324    HA   VAL  46           HA       VAL  46  45.247   3.078 -10.352
  325    HB   VAL  46           HB       VAL  46  43.320   1.521 -12.107
  326   HG11  VAL  46          HG11      VAL  46  42.724   3.823 -12.283
  327   HG12  VAL  46          HG12      VAL  46  43.777   3.504 -13.662
  328   HG13  VAL  46          HG13      VAL  46  44.412   4.338 -12.245
  329   HG21  VAL  46          HG21      VAL  46  46.110   2.504 -12.743
  330   HG22  VAL  46          HG22      VAL  46  45.134   1.355 -13.657
  331   HG23  VAL  46          HG23      VAL  46  45.803   0.893 -12.092
  332    H    LEU  47           HN       LEU  47  44.243   4.408  -8.939
  333    HA   LEU  47           HA       LEU  47  41.402   3.907  -8.182
  334    HB2  LEU  47           HB2      LEU  47  43.413   5.898  -7.083
  335    HB3  LEU  47           HB1      LEU  47  41.833   5.526  -6.392
  336    HG   LEU  47           HG       LEU  47  44.099   3.536  -6.741
  337   HD11  LEU  47          HD11      LEU  47  44.471   5.320  -5.002
  338   HD12  LEU  47          HD12      LEU  47  44.400   3.683  -4.350
  339   HD13  LEU  47          HD13      LEU  47  43.009   4.756  -4.190
  340   HD21  LEU  47          HD21      LEU  47  41.262   3.336  -5.734
  341   HD22  LEU  47          HD22      LEU  47  42.500   2.281  -5.053
  342   HD23  LEU  47          HD23      LEU  47  42.153   2.230  -6.779
  343    H    LEU  48           HN       LEU  48  42.646   5.204 -10.750
  344    HA   LEU  48           HA       LEU  48  41.352   7.877 -10.610
  345    HB2  LEU  48           HB2      LEU  48  43.198   6.498 -12.551
  346    HB3  LEU  48           HB1      LEU  48  42.291   7.916 -13.066
  347    HG   LEU  48           HG       LEU  48  44.589   8.435 -12.175
  348   HD11  LEU  48          HD11      LEU  48  42.345   9.922 -11.919
  349   HD12  LEU  48          HD12      LEU  48  43.902  10.445 -11.291
  350   HD13  LEU  48          HD13      LEU  48  42.723   9.709 -10.210
  351   HD21  LEU  48          HD21      LEU  48  45.107   8.116  -9.869
  352   HD22  LEU  48          HD22      LEU  48  44.402   6.591 -10.400
  353   HD23  LEU  48          HD23      LEU  48  43.433   7.733  -9.469
  354    H    VAL  49           HN       VAL  49  39.359   8.184 -11.324
  355    HA   VAL  49           HA       VAL  49  37.712   6.071 -12.342
  356    HB   VAL  49           HB       VAL  49  37.299   9.073 -12.341
  357   HG11  VAL  49          HG11      VAL  49  35.774   8.159 -13.928
  358   HG12  VAL  49          HG12      VAL  49  34.851   8.329 -12.435
  359   HG13  VAL  49          HG13      VAL  49  35.458   6.747 -12.921
  360   HG21  VAL  49          HG21      VAL  49  36.229   6.946 -10.462
  361   HG22  VAL  49          HG22      VAL  49  36.064   8.694 -10.293
  362   HG23  VAL  49          HG23      VAL  49  37.646   7.935 -10.112
  363    H    ASP  50           HN       ASP  50  39.295   8.846 -13.900
  364    HA   ASP  50           HA       ASP  50  38.214   8.481 -16.504
  365    HB2  ASP  50           HB2      ASP  50  39.451  10.500 -15.862
  366    HB3  ASP  50           HB1      ASP  50  40.930   9.554 -15.687
  367    H    GLU  51           HN       GLU  51  41.041   7.004 -14.944
  368    HA   GLU  51           HA       GLU  51  41.700   5.503 -17.409
  369    HB2  GLU  51           HB2      GLU  51  42.899   5.438 -14.623
  370    HB3  GLU  51           HB1      GLU  51  43.549   4.589 -16.025
  371    HG2  GLU  51           HG2      GLU  51  43.137   7.588 -15.918
  372    HG3  GLU  51           HG1      GLU  51  44.669   6.799 -15.545
  373    H    ALA  52           HN       ALA  52  39.576   5.162 -14.825
  374    HA   ALA  52           HA       ALA  52  39.783   2.352 -14.267
  375    HB1  ALA  52           HB1      ALA  52  38.519   3.952 -12.856
  376    HB2  ALA  52           HB2      ALA  52  37.532   2.571 -13.333
  377    HB3  ALA  52           HB3      ALA  52  37.328   4.125 -14.143
  378    H    ARG  53           HN       ARG  53  38.418   0.627 -15.062
  379    HA   ARG  53           HA       ARG  53  37.592   1.039 -17.909
  380    HB2  ARG  53           HB2      ARG  53  38.268  -1.440 -16.314
  381    HB3  ARG  53           HB1      ARG  53  37.612  -1.490 -17.951
  382    HG2  ARG  53           HG2      ARG  53  39.506  -0.165 -18.767
  383    HG3  ARG  53           HG1      ARG  53  40.155  -0.059 -17.130
  384    HD2  ARG  53           HD2      ARG  53  40.398  -2.501 -17.051
  385    HD3  ARG  53           HD1      ARG  53  39.715  -2.632 -18.673
  386    HE   ARG  53           HE       ARG  53  41.923  -0.866 -18.834
  387   HH11  ARG  53          HH21      ARG  53  41.170  -4.138 -18.068
  388   HH12  ARG  53          HH22      ARG  53  42.694  -4.757 -18.613
  389   HH21  ARG  53          HH11      ARG  53  43.916  -1.650 -19.553
  390   HH22  ARG  53          HH12      ARG  53  44.248  -3.347 -19.454
  391    H    ARG  54           HN       ARG  54  35.520   0.596 -18.581
  392    HA   ARG  54           HA       ARG  54  33.468   0.485 -16.473
  393    HB2  ARG  54           HB2      ARG  54  33.453   0.977 -19.449
  394    HB3  ARG  54           HB1      ARG  54  31.945   0.669 -18.590
  395    HG2  ARG  54           HG2      ARG  54  32.347   2.556 -17.108
  396    HG3  ARG  54           HG1      ARG  54  33.940   2.819 -17.819
  397    HD2  ARG  54           HD2      ARG  54  32.253   4.388 -18.739
  398    HD3  ARG  54           HD1      ARG  54  32.911   3.331 -19.988
  399    HE   ARG  54           HE       ARG  54  30.645   1.995 -19.090
  400   HH11  ARG  54          HH21      ARG  54  31.420   5.134 -20.284
  401   HH12  ARG  54          HH22      ARG  54  29.871   5.382 -21.020
  402   HH21  ARG  54          HH11      ARG  54  28.618   2.299 -20.043
  403   HH22  ARG  54          HH12      ARG  54  28.285   3.777 -20.882
  404    HA   PRO  55           HA       PRO  55  32.704  -3.868 -16.868
  405    HB2  PRO  55           HB2      PRO  55  30.009  -3.984 -16.316
  406    HB3  PRO  55           HB1      PRO  55  31.248  -3.688 -15.080
  407    HG2  PRO  55           HG2      PRO  55  29.506  -1.724 -16.515
  408    HG3  PRO  55           HG1      PRO  55  29.940  -1.797 -14.796
  409    HD2  PRO  55           HD2      PRO  55  31.167  -0.084 -16.506
  410    HD3  PRO  55           HD1      PRO  55  32.030  -0.828 -15.141
  411    H    GLU  56           HN       GLU  56  31.978  -5.412 -18.365
  412    HA   GLU  56           HA       GLU  56  31.333  -6.162 -20.497
  413    HB2  GLU  56           HB2      GLU  56  29.112  -5.870 -19.396
  414    HB3  GLU  56           HB1      GLU  56  29.048  -4.224 -20.029
  415    HG2  GLU  56           HG2      GLU  56  29.159  -5.067 -22.324
  416    HG3  GLU  56           HG1      GLU  56  29.311  -6.721 -21.729
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1  32.386 -18.868   1.734
    2    H2   MET   1           HT2      MET   1  32.059 -18.338   0.154
    3    H3   MET   1           HT3      MET   1  31.134 -19.586   0.843
    4    HA   MET   1           HA       MET   1  29.741 -17.769   1.035
    5    HB2  MET   1           HB2      MET   1  30.004 -17.074   3.518
    6    HB3  MET   1           HB1      MET   1  29.749 -18.784   3.168
    7    HG2  MET   1           HG2      MET   1  32.077 -19.284   3.449
    8    HG3  MET   1           HG1      MET   1  32.507 -17.573   3.467
    9    HE1  MET   1           HE1      MET   1  30.418 -20.074   6.647
   10    HE2  MET   1           HE2      MET   1  30.635 -20.397   4.929
   11    HE3  MET   1           HE3      MET   1  29.369 -19.292   5.458
   12    HA   PRO   2           HA       PRO   2  32.787 -14.363   0.067
   13    HB2  PRO   2           HB2      PRO   2  30.627 -13.735  -1.907
   14    HB3  PRO   2           HB1      PRO   2  32.381 -13.853  -2.159
   15    HG2  PRO   2           HG2      PRO   2  30.746 -15.749  -3.054
   16    HG3  PRO   2           HG1      PRO   2  32.326 -16.162  -2.357
   17    HD2  PRO   2           HD2      PRO   2  29.604 -16.346  -1.080
   18    HD3  PRO   2           HD1      PRO   2  30.957 -17.502  -1.016
   19    H    LEU   3           HN       LEU   3  29.527 -14.599   1.082
   20    HA   LEU   3           HA       LEU   3  29.037 -11.730   1.355
   21    HB2  LEU   3           HB2      LEU   3  27.565 -14.020   2.688
   22    HB3  LEU   3           HB1      LEU   3  26.961 -12.390   2.387
   23    HG   LEU   3           HG       LEU   3  27.723 -14.408   0.254
   24   HD11  LEU   3          HD11      LEU   3  24.984 -13.306   0.910
   25   HD12  LEU   3          HD12      LEU   3  25.592 -14.815   1.593
   26   HD13  LEU   3          HD13      LEU   3  25.383 -14.659  -0.150
   27   HD21  LEU   3          HD21      LEU   3  26.458 -12.610  -1.168
   28   HD22  LEU   3          HD22      LEU   3  28.131 -12.301  -0.714
   29   HD23  LEU   3          HD23      LEU   3  26.820 -11.526   0.176
   30    H    GLU   4           HN       GLU   4  31.040 -13.825   2.948
   31    HA   GLU   4           HA       GLU   4  31.068 -12.086   5.372
   32    HB2  GLU   4           HB2      GLU   4  29.747 -14.130   5.924
   33    HB3  GLU   4           HB1      GLU   4  31.132 -15.121   5.467
   34    HG2  GLU   4           HG2      GLU   4  32.498 -14.058   7.207
   35    HG3  GLU   4           HG1      GLU   4  31.152 -13.004   7.639
   36    H    ALA   5           HN       ALA   5  32.651 -14.326   3.190
   37    HA   ALA   5           HA       ALA   5  35.194 -14.430   4.500
   38    HB1  ALA   5           HB1      ALA   5  34.600 -14.648   1.533
   39    HB2  ALA   5           HB2      ALA   5  34.488 -15.980   2.683
   40    HB3  ALA   5           HB3      ALA   5  36.047 -15.228   2.355
   41    H    GLY   6           HN       GLY   6  37.024 -13.162   4.258
   42    HA2  GLY   6           HA2      GLY   6  38.127 -11.088   4.075
   43    HA3  GLY   6           HA1      GLY   6  37.704 -11.272   2.374
   44    H    LEU   7           HN       LEU   7  37.506  -8.933   2.279
   45    HA   LEU   7           HA       LEU   7  36.105  -7.070   2.035
   46    HB2  LEU   7           HB2      LEU   7  34.268  -8.992   2.089
   47    HB3  LEU   7           HB1      LEU   7  33.928  -8.332   3.687
   48    HG   LEU   7           HG       LEU   7  33.955  -6.754   1.096
   49   HD11  LEU   7          HD11      LEU   7  31.535  -6.583   1.456
   50   HD12  LEU   7          HD12      LEU   7  31.671  -7.541   2.930
   51   HD13  LEU   7          HD13      LEU   7  32.014  -8.278   1.365
   52   HD21  LEU   7          HD21      LEU   7  32.888  -5.014   2.698
   53   HD22  LEU   7          HD22      LEU   7  34.632  -5.251   2.801
   54   HD23  LEU   7          HD23      LEU   7  33.568  -5.991   3.998
   55    H    LEU   8           HN       LEU   8  35.457  -8.560   5.231
   56    HA   LEU   8           HA       LEU   8  35.452  -7.569   7.362
   57    HB2  LEU   8           HB2      LEU   8  38.017  -6.634   6.083
   58    HB3  LEU   8           HB1      LEU   8  37.633  -6.227   7.752
   59    HG   LEU   8           HG       LEU   8  39.038  -8.288   7.526
   60   HD11  LEU   8          HD11      LEU   8  36.424  -9.291   8.587
   61   HD12  LEU   8          HD12      LEU   8  37.083  -7.832   9.325
   62   HD13  LEU   8          HD13      LEU   8  38.029  -9.316   9.315
   63   HD21  LEU   8          HD21      LEU   8  37.828  -8.964   5.357
   64   HD22  LEU   8          HD22      LEU   8  36.566  -9.616   6.405
   65   HD23  LEU   8          HD23      LEU   8  38.206 -10.257   6.494
   66    H    GLU   9           HN       GLU   9  37.224  -4.781   6.605
   67    HA   GLU   9           HA       GLU   9  35.148  -3.026   7.463
   68    HB2  GLU   9           HB2      GLU   9  37.566  -2.485   7.585
   69    HB3  GLU   9           HB1      GLU   9  37.607  -2.348   5.826
   70    HG2  GLU   9           HG2      GLU   9  35.987  -0.526   5.889
   71    HG3  GLU   9           HG1      GLU   9  35.820  -0.704   7.636
   72    H    ILE  10           HN       ILE  10  33.852  -1.580   6.300
   73    HA   ILE  10           HA       ILE  10  32.987  -2.544   3.685
   74    HB   ILE  10           HB       ILE  10  31.485  -0.406   3.910
   75   HG12  ILE  10          HG12      ILE  10  32.398  -0.657   6.788
   76   HG13  ILE  10          HG11      ILE  10  33.083   0.541   5.692
   77   HG21  ILE  10          HG21      ILE  10  31.379  -2.695   5.900
   78   HG22  ILE  10          HG22      ILE  10  30.627  -2.653   4.306
   79   HG23  ILE  10          HG23      ILE  10  30.043  -1.588   5.585
   80   HD11  ILE  10          HD11      ILE  10  31.194   1.435   7.055
   81   HD12  ILE  10          HD12      ILE  10  30.126   0.258   6.290
   82   HD13  ILE  10          HD13      ILE  10  30.888   1.522   5.321
   83    H    LEU  11           HN       LEU  11  34.692  -2.183   2.262
   84    HA   LEU  11           HA       LEU  11  36.046   0.387   2.069
   85    HB2  LEU  11           HB2      LEU  11  35.996  -1.944   0.124
   86    HB3  LEU  11           HB1      LEU  11  37.152  -0.612   0.115
   87    HG   LEU  11           HG       LEU  11  36.772  -2.584   2.390
   88   HD11  LEU  11          HD11      LEU  11  37.798  -3.665   0.473
   89   HD12  LEU  11          HD12      LEU  11  39.043  -3.367   1.686
   90   HD13  LEU  11          HD13      LEU  11  38.921  -2.322   0.270
   91   HD21  LEU  11          HD21      LEU  11  37.596  -0.653   3.429
   92   HD22  LEU  11          HD22      LEU  11  38.494  -0.137   2.001
   93   HD23  LEU  11          HD23      LEU  11  39.092  -1.470   2.990
   94    H    ALA  12           HN       ALA  12  35.923   1.805   0.211
   95    HA   ALA  12           HA       ALA  12  33.276   1.711  -1.216
   96    HB1  ALA  12           HB1      ALA  12  33.431   4.222  -1.205
   97    HB2  ALA  12           HB2      ALA  12  34.830   4.085  -0.139
   98    HB3  ALA  12           HB3      ALA  12  33.249   3.519   0.401
   99    H    CYS  13           HN       CYS  13  33.380   1.945  -3.416
  100    HA   CYS  13           HA       CYS  13  36.004   1.841  -4.670
  101    HB2  CYS  13           HB2      CYS  13  34.309   2.056  -6.783
  102    HB3  CYS  13           HB1      CYS  13  34.544   0.548  -5.908
  103    HA   PRO  14           HA       PRO  14  36.548   6.160  -5.500
  104    HB2  PRO  14           HB2      PRO  14  37.786   6.089  -7.971
  105    HB3  PRO  14           HB1      PRO  14  38.603   5.676  -6.450
  106    HG2  PRO  14           HG2      PRO  14  37.418   3.867  -8.510
  107    HG3  PRO  14           HG1      PRO  14  38.932   3.701  -7.604
  108    HD2  PRO  14           HD2      PRO  14  36.687   2.318  -6.930
  109    HD3  PRO  14           HD1      PRO  14  37.869   2.855  -5.714
  110    H    ALA  15           HN       ALA  15  35.436   7.859  -6.503
  111    HA   ALA  15           HA       ALA  15  33.880   8.947  -7.872
  112    HB1  ALA  15           HB1      ALA  15  33.734   8.333 -10.111
  113    HB2  ALA  15           HB2      ALA  15  33.795   6.605  -9.755
  114    HB3  ALA  15           HB3      ALA  15  35.259   7.581  -9.652
  115    H    CYS  16           HN       CYS  16  33.216   5.426  -7.835
  116    HA   CYS  16           HA       CYS  16  30.332   6.023  -7.429
  117    HB2  CYS  16           HB2      CYS  16  30.406   3.342  -7.515
  118    HB3  CYS  16           HB1      CYS  16  30.437   4.309  -8.986
  119    H    HIS  17           HN       HIS  17  29.444   4.025  -5.910
  120    HA   HIS  17           HA       HIS  17  31.053   4.024  -3.382
  121    HB2  HIS  17           HB2      HIS  17  29.209   5.782  -3.369
  122    HB3  HIS  17           HB1      HIS  17  28.054   4.451  -3.489
  123    HD2  HIS  17           HD2      HIS  17  30.590   5.930  -0.866
  124    HE1  HIS  17           HE1      HIS  17  28.319   2.922   1.043
  125    HE2  HIS  17           HE2      HIS  17  30.034   4.758   1.396
  126    H    ALA  18           HN       ALA  18  31.487   1.879  -3.139
  127    HA   ALA  18           HA       ALA  18  29.540   0.011  -2.434
  128    HB1  ALA  18           HB1      ALA  18  29.848  -1.459  -4.644
  129    HB2  ALA  18           HB2      ALA  18  30.107   0.130  -5.369
  130    HB3  ALA  18           HB3      ALA  18  28.591  -0.227  -4.543
  131    HA   PRO  19           HA       PRO  19  33.202  -2.157  -1.161
  132    HB2  PRO  19           HB2      PRO  19  31.989  -4.712  -2.131
  133    HB3  PRO  19           HB1      PRO  19  32.596  -4.294  -0.519
  134    HG2  PRO  19           HG2      PRO  19  29.967  -4.451  -1.073
  135    HG3  PRO  19           HG1      PRO  19  30.625  -3.315   0.118
  136    HD2  PRO  19           HD2      PRO  19  29.556  -2.759  -2.610
  137    HD3  PRO  19           HD1      PRO  19  29.620  -1.725  -1.170
  138    H    LEU  20           HN       LEU  20  35.096  -3.151  -1.992
  139    HA   LEU  20           HA       LEU  20  35.275  -3.215  -4.974
  140    HB2  LEU  20           HB2      LEU  20  37.285  -2.733  -2.768
  141    HB3  LEU  20           HB1      LEU  20  37.792  -3.066  -4.421
  142    HG   LEU  20           HG       LEU  20  35.813  -0.871  -3.763
  143   HD11  LEU  20          HD11      LEU  20  38.835  -0.829  -3.732
  144   HD12  LEU  20          HD12      LEU  20  37.716  -0.208  -2.518
  145   HD13  LEU  20          HD13      LEU  20  37.901   0.630  -4.057
  146   HD21  LEU  20          HD21      LEU  20  35.813  -1.359  -6.103
  147   HD22  LEU  20          HD22      LEU  20  37.558  -1.580  -6.141
  148   HD23  LEU  20          HD23      LEU  20  36.878   0.031  -5.939
  149    H    GLU  21           HN       GLU  21  35.806  -5.063  -5.995
  150    HA   GLU  21           HA       GLU  21  36.448  -7.472  -4.321
  151    HB2  GLU  21           HB2      GLU  21  35.117  -7.252  -7.047
  152    HB3  GLU  21           HB1      GLU  21  35.465  -8.761  -6.204
  153    HG2  GLU  21           HG2      GLU  21  33.716  -6.545  -5.109
  154    HG3  GLU  21           HG1      GLU  21  33.111  -8.018  -5.866
  155    H    GLU  22           HN       GLU  22  38.336  -8.449  -4.684
  156    HA   GLU  22           HA       GLU  22  40.203  -7.264  -6.641
  157    HB2  GLU  22           HB2      GLU  22  40.710  -9.540  -4.703
  158    HB3  GLU  22           HB1      GLU  22  41.901  -8.475  -5.449
  159    HG2  GLU  22           HG2      GLU  22  39.758  -7.599  -3.488
  160    HG3  GLU  22           HG1      GLU  22  41.460  -7.840  -3.097
  161    H    ARG  23           HN       ARG  23  40.612  -8.213  -8.596
  162    HA   ARG  23           HA       ARG  23  39.938 -11.136  -8.919
  163    HB2  ARG  23           HB2      ARG  23  38.279  -9.673 -10.065
  164    HB3  ARG  23           HB1      ARG  23  39.592  -8.947 -10.992
  165    HG2  ARG  23           HG2      ARG  23  40.156 -11.149 -11.936
  166    HG3  ARG  23           HG1      ARG  23  38.862 -11.891 -10.993
  167    HD2  ARG  23           HD2      ARG  23  37.224 -10.397 -12.149
  168    HD3  ARG  23           HD1      ARG  23  38.540  -9.788 -13.150
  169    HE   ARG  23           HE       ARG  23  38.563 -11.854 -14.330
  170   HH11  ARG  23          HH21      ARG  23  36.541 -11.920 -11.523
  171   HH12  ARG  23          HH22      ARG  23  35.767 -13.406 -11.961
  172   HH21  ARG  23          HH11      ARG  23  37.564 -13.793 -14.903
  173   HH22  ARG  23          HH12      ARG  23  36.346 -14.465 -13.871
  174    H    ASP  24           HN       ASP  24  41.908 -12.085  -9.006
  175    HA   ASP  24           HA       ASP  24  44.110 -12.545  -9.641
  176    HB2  ASP  24           HB2      ASP  24  43.056 -11.135 -12.100
  177    HB3  ASP  24           HB1      ASP  24  44.650 -11.883 -12.032
  178    H    ALA  25           HN       ALA  25  43.969  -9.535 -11.468
  179    HA   ALA  25           HA       ALA  25  45.681  -8.182  -9.428
  180    HB1  ALA  25           HB1      ALA  25  47.132  -9.292 -11.160
  181    HB2  ALA  25           HB2      ALA  25  47.306  -7.538 -11.108
  182    HB3  ALA  25           HB3      ALA  25  46.350  -8.292 -12.385
  183    H    GLU  26           HN       GLU  26  42.878  -7.935 -10.447
  184    HA   GLU  26           HA       GLU  26  43.018  -5.031 -11.208
  185    HB2  GLU  26           HB2      GLU  26  41.156  -7.108 -12.405
  186    HB3  GLU  26           HB1      GLU  26  41.130  -5.379 -12.753
  187    HG2  GLU  26           HG2      GLU  26  43.449  -5.519 -13.604
  188    HG3  GLU  26           HG1      GLU  26  43.455  -7.251 -13.282
  189    H    LEU  27           HN       LEU  27  41.140  -3.805 -10.554
  190    HA   LEU  27           HA       LEU  27  39.729  -5.034  -8.201
  191    HB2  LEU  27           HB2      LEU  27  40.019  -2.106  -8.926
  192    HB3  LEU  27           HB1      LEU  27  39.466  -2.779  -7.392
  193    HG   LEU  27           HG       LEU  27  42.238  -3.066  -8.581
  194   HD11  LEU  27          HD11      LEU  27  42.038  -0.891  -7.671
  195   HD12  LEU  27          HD12      LEU  27  42.790  -1.840  -6.387
  196   HD13  LEU  27          HD13      LEU  27  41.072  -1.454  -6.308
  197   HD21  LEU  27          HD21      LEU  27  40.891  -4.324  -6.193
  198   HD22  LEU  27          HD22      LEU  27  42.631  -4.041  -6.187
  199   HD23  LEU  27          HD23      LEU  27  41.915  -5.081  -7.414
  200    H    ILE  28           HN       ILE  28  37.575  -5.339  -8.315
  201    HA   ILE  28           HA       ILE  28  36.044  -3.926 -10.478
  202    HB   ILE  28           HB       ILE  28  35.756  -6.789  -9.558
  203   HG12  ILE  28          HG12      ILE  28  36.424  -5.632 -12.279
  204   HG13  ILE  28          HG11      ILE  28  37.649  -6.170 -11.128
  205   HG21  ILE  28          HG21      ILE  28  34.109  -5.056 -11.417
  206   HG22  ILE  28          HG22      ILE  28  33.551  -5.949 -10.002
  207   HG23  ILE  28          HG23      ILE  28  34.048  -6.817 -11.454
  208   HD11  ILE  28          HD11      ILE  28  37.154  -7.967 -12.711
  209   HD12  ILE  28          HD12      ILE  28  35.440  -7.874 -12.312
  210   HD13  ILE  28          HD13      ILE  28  36.599  -8.418 -11.100
  211    H    CYS  29           HN       CYS  29  34.306  -2.813  -9.793
  212    HA   CYS  29           HA       CYS  29  33.754  -2.547  -6.986
  213    HB2  CYS  29           HB2      CYS  29  32.242  -1.765  -9.482
  214    HB3  CYS  29           HB1      CYS  29  31.625  -1.410  -7.870
  215    H    THR  30           HN       THR  30  32.057  -3.438  -5.719
  216    HA   THR  30           HA       THR  30  31.260  -6.104  -6.300
  217    HB   THR  30           HB       THR  30  29.254  -4.899  -4.607
  218    HG1  THR  30           HG1      THR  30  31.214  -3.301  -4.790
  219   HG21  THR  30          HG21      THR  30  30.316  -6.191  -2.850
  220   HG22  THR  30          HG22      THR  30  31.792  -6.351  -3.802
  221   HG23  THR  30          HG23      THR  30  30.311  -7.151  -4.329
  222    H    GLY  31           HN       GLY  31  29.997  -3.100  -7.479
  223    HA2  GLY  31           HA2      GLY  31  28.410  -2.818  -9.215
  224    HA3  GLY  31           HA1      GLY  31  28.088  -4.550  -9.159
  225    H    GLN  32           HN       GLN  32  28.005  -3.243  -6.062
  226    HA   GLN  32           HA       GLN  32  25.228  -3.795  -5.701
  227    HB2  GLN  32           HB2      GLN  32  26.903  -3.731  -3.848
  228    HB3  GLN  32           HB1      GLN  32  27.001  -1.979  -4.032
  229    HG2  GLN  32           HG2      GLN  32  24.604  -1.772  -3.526
  230    HG3  GLN  32           HG1      GLN  32  24.476  -3.526  -3.381
  231   HE21  GLN  32          HE21      GLN  32  24.576  -4.223  -1.249
  232   HE22  GLN  32          HE22      GLN  32  25.437  -3.450  -0.006
  233    H    ASP  33           HN       ASP  33  27.003  -0.746  -6.209
  234    HA   ASP  33           HA       ASP  33  24.396   0.570  -6.929
  235    HB2  ASP  33           HB2      ASP  33  25.411   1.321  -4.711
  236    HB3  ASP  33           HB1      ASP  33  26.757   1.969  -5.647
  237    H    CYS  34           HN       CYS  34  27.502  -0.357  -7.895
  238    HA   CYS  34           HA       CYS  34  27.277   1.350 -10.336
  239    HB2  CYS  34           HB2      CYS  34  29.799   1.656 -10.210
  240    HB3  CYS  34           HB1      CYS  34  28.862   2.565  -9.029
  241    H    GLY  35           HN       GLY  35  30.262  -0.141 -10.100
  242    HA2  GLY  35           HA2      GLY  35  30.386  -2.742 -10.507
  243    HA3  GLY  35           HA1      GLY  35  29.363  -2.356 -11.892
  244    H    LEU  36           HN       LEU  36  31.666   0.036 -10.967
  245    HA   LEU  36           HA       LEU  36  33.009  -0.169 -13.529
  246    HB2  LEU  36           HB2      LEU  36  33.705   1.503 -11.094
  247    HB3  LEU  36           HB1      LEU  36  34.332   1.737 -12.725
  248    HG   LEU  36           HG       LEU  36  31.412   1.931 -11.924
  249   HD11  LEU  36          HD11      LEU  36  33.292   4.128 -12.821
  250   HD12  LEU  36          HD12      LEU  36  32.961   3.773 -11.126
  251   HD13  LEU  36          HD13      LEU  36  31.656   4.307 -12.186
  252   HD21  LEU  36          HD21      LEU  36  32.875   2.088 -14.558
  253   HD22  LEU  36          HD22      LEU  36  31.413   3.046 -14.320
  254   HD23  LEU  36          HD23      LEU  36  31.346   1.294 -14.177
  255    H    ALA  37           HN       ALA  37  35.312  -0.477 -13.799
  256    HA   ALA  37           HA       ALA  37  36.588  -2.114 -11.637
  257    HB1  ALA  37           HB1      ALA  37  36.595  -2.672 -14.613
  258    HB2  ALA  37           HB2      ALA  37  35.784  -3.636 -13.381
  259    HB3  ALA  37           HB3      ALA  37  37.545  -3.554 -13.417
  260    H    TYR  38           HN       TYR  38  38.834  -1.962 -11.488
  261    HA   TYR  38           HA       TYR  38  40.134   0.116 -13.194
  262    HB2  TYR  38           HB2      TYR  38  40.478  -0.061 -10.195
  263    HB3  TYR  38           HB1      TYR  38  41.123   1.179 -11.272
  264    HD1  TYR  38           HD1      TYR  38  37.929  -0.351 -10.094
  265    HD2  TYR  38           HD2      TYR  38  39.838   3.100 -11.795
  266    HE1  TYR  38           HE1      TYR  38  35.814   0.924  -9.876
  267    HE2  TYR  38           HE2      TYR  38  37.721   4.376 -11.578
  268    HH   TYR  38           HH       TYR  38  34.796   2.855 -10.206
  269    HA   PRO  39           HA       PRO  39  43.123  -3.268 -13.185
  270    HB2  PRO  39           HB2      PRO  39  44.932  -2.247 -14.925
  271    HB3  PRO  39           HB1      PRO  39  43.343  -2.832 -15.461
  272    HG2  PRO  39           HG2      PRO  39  44.257  -0.029 -14.972
  273    HG3  PRO  39           HG1      PRO  39  43.259  -0.674 -16.287
  274    HD2  PRO  39           HD2      PRO  39  42.220   0.621 -14.082
  275    HD3  PRO  39           HD1      PRO  39  41.319  -0.580 -15.038
  276    H    VAL  40           HN       VAL  40  45.503  -3.533 -12.674
  277    HA   VAL  40           HA       VAL  40  46.411  -1.431 -10.738
  278    HB   VAL  40           HB       VAL  40  46.924  -4.415 -10.859
  279   HG11  VAL  40          HG11      VAL  40  48.990  -3.520 -10.127
  280   HG12  VAL  40          HG12      VAL  40  48.136  -3.899  -8.631
  281   HG13  VAL  40          HG13      VAL  40  48.206  -2.234  -9.208
  282   HG21  VAL  40          HG21      VAL  40  44.740  -3.492  -9.912
  283   HG22  VAL  40          HG22      VAL  40  45.712  -2.743  -8.645
  284   HG23  VAL  40          HG23      VAL  40  45.682  -4.498  -8.813
  285    H    ARG  41           HN       ARG  41  48.312  -0.407 -11.148
  286    HA   ARG  41           HA       ARG  41  49.881  -1.339 -13.529
  287    HB2  ARG  41           HB2      ARG  41  48.987   0.987 -13.551
  288    HB3  ARG  41           HB1      ARG  41  49.916   1.338 -12.093
  289    HG2  ARG  41           HG2      ARG  41  52.004   0.870 -13.264
  290    HG3  ARG  41           HG1      ARG  41  51.115   0.384 -14.709
  291    HD2  ARG  41           HD2      ARG  41  51.889   2.680 -14.990
  292    HD3  ARG  41           HD1      ARG  41  50.132   2.681 -14.820
  293    HE   ARG  41           HE       ARG  41  51.340   3.014 -12.240
  294   HH11  ARG  41          HH21      ARG  41  50.776   4.580 -15.266
  295   HH12  ARG  41          HH22      ARG  41  50.770   6.175 -14.589
  296   HH21  ARG  41          HH11      ARG  41  51.334   5.091 -11.340
  297   HH22  ARG  41          HH12      ARG  41  51.085   6.463 -12.369
  298    H    ASP  42           HN       ASP  42  51.475  -2.701 -12.846
  299    HA   ASP  42           HA       ASP  42  53.317  -3.508 -11.642
  300    HB2  ASP  42           HB2      ASP  42  54.170  -1.290 -12.570
  301    HB3  ASP  42           HB1      ASP  42  53.817  -0.598 -10.986
  302    H    GLY  43           HN       GLY  43  50.873  -3.492 -10.175
  303    HA2  GLY  43           HA2      GLY  43  50.371  -4.067  -7.928
  304    HA3  GLY  43           HA1      GLY  43  51.975  -3.514  -7.456
  305    H    ILE  44           HN       ILE  44  50.621  -1.132  -9.360
  306    HA   ILE  44           HA       ILE  44  49.740   0.398  -6.936
  307    HB   ILE  44           HB       ILE  44  50.562   1.486  -9.632
  308   HG12  ILE  44          HG12      ILE  44  52.477   0.299  -8.715
  309   HG13  ILE  44          HG11      ILE  44  52.732   2.024  -8.452
  310   HG21  ILE  44          HG21      ILE  44  49.188   2.977  -8.264
  311   HG22  ILE  44          HG22      ILE  44  50.849   3.568  -8.309
  312   HG23  ILE  44          HG23      ILE  44  50.251   2.724  -6.880
  313   HD11  ILE  44          HD11      ILE  44  51.597   1.590  -6.135
  314   HD12  ILE  44          HD12      ILE  44  53.271   1.093  -6.365
  315   HD13  ILE  44          HD13      ILE  44  51.977  -0.101  -6.458
  316    HA   PRO  45           HA       PRO  45  45.638  -0.411  -8.874
  317    HB2  PRO  45           HB2      PRO  45  44.911   1.399  -6.598
  318    HB3  PRO  45           HB1      PRO  45  44.154  -0.116  -7.116
  319    HG2  PRO  45           HG2      PRO  45  45.716  -0.044  -4.976
  320    HG3  PRO  45           HG1      PRO  45  45.763  -1.424  -6.091
  321    HD2  PRO  45           HD2      PRO  45  47.737   0.805  -5.771
  322    HD3  PRO  45           HD1      PRO  45  48.011  -0.902  -6.194
  323    H    VAL  46           HN       VAL  46  44.573   0.826 -10.393
  324    HA   VAL  46           HA       VAL  46  45.495   3.608 -10.785
  325    HB   VAL  46           HB       VAL  46  43.646   1.853 -12.432
  326   HG11  VAL  46          HG11      VAL  46  43.102   4.088 -12.987
  327   HG12  VAL  46          HG12      VAL  46  44.294   3.621 -14.198
  328   HG13  VAL  46          HG13      VAL  46  44.774   4.626 -12.833
  329   HG21  VAL  46          HG21      VAL  46  45.576   1.550 -13.876
  330   HG22  VAL  46          HG22      VAL  46  46.039   1.108 -12.233
  331   HG23  VAL  46          HG23      VAL  46  46.531   2.664 -12.901
  332    H    LEU  47           HN       LEU  47  44.469   4.920  -9.321
  333    HA   LEU  47           HA       LEU  47  41.541   4.647  -8.894
  334    HB2  LEU  47           HB2      LEU  47  43.503   6.604  -7.654
  335    HB3  LEU  47           HB1      LEU  47  41.868   6.247  -7.097
  336    HG   LEU  47           HG       LEU  47  44.160   4.264  -7.202
  337   HD11  LEU  47          HD11      LEU  47  42.789   5.476  -4.788
  338   HD12  LEU  47          HD12      LEU  47  44.315   6.068  -5.447
  339   HD13  LEU  47          HD13      LEU  47  44.210   4.431  -4.799
  340   HD21  LEU  47          HD21      LEU  47  41.240   4.041  -6.468
  341   HD22  LEU  47          HD22      LEU  47  42.427   2.979  -5.709
  342   HD23  LEU  47          HD23      LEU  47  42.223   2.960  -7.457
  343    H    LEU  48           HN       LEU  48  42.533   5.484 -11.494
  344    HA   LEU  48           HA       LEU  48  41.828   8.390 -11.582
  345    HB2  LEU  48           HB2      LEU  48  42.959   6.604 -13.758
  346    HB3  LEU  48           HB1      LEU  48  42.799   8.357 -13.816
  347    HG   LEU  48           HG       LEU  48  44.521   6.809 -11.857
  348   HD11  LEU  48          HD11      LEU  48  46.403   7.752 -13.105
  349   HD12  LEU  48          HD12      LEU  48  45.291   8.585 -14.192
  350   HD13  LEU  48          HD13      LEU  48  45.371   6.823 -14.192
  351   HD21  LEU  48          HD21      LEU  48  45.413   9.257 -11.520
  352   HD22  LEU  48          HD22      LEU  48  43.933   8.768 -10.702
  353   HD23  LEU  48          HD23      LEU  48  43.846   9.734 -12.177
  354    H    VAL  49           HN       VAL  49  39.871   8.971 -12.262
  355    HA   VAL  49           HA       VAL  49  37.837   7.084 -12.950
  356    HB   VAL  49           HB       VAL  49  37.954  10.094 -13.313
  357   HG11  VAL  49          HG11      VAL  49  35.710   8.091 -13.600
  358   HG12  VAL  49          HG12      VAL  49  36.238   9.304 -14.766
  359   HG13  VAL  49          HG13      VAL  49  35.410   9.800 -13.289
  360   HG21  VAL  49          HG21      VAL  49  38.137   9.534 -10.993
  361   HG22  VAL  49          HG22      VAL  49  36.931   8.258 -11.137
  362   HG23  VAL  49          HG23      VAL  49  36.441   9.947 -11.254
  363    H    ASP  50           HN       ASP  50  39.774   9.337 -14.915
  364    HA   ASP  50           HA       ASP  50  38.491   8.835 -17.399
  365    HB2  ASP  50           HB2      ASP  50  40.711   9.577 -18.384
  366    HB3  ASP  50           HB1      ASP  50  40.004  10.693 -17.215
  367    H    GLU  51           HN       GLU  51  41.008   7.054 -15.676
  368    HA   GLU  51           HA       GLU  51  41.350   5.198 -17.966
  369    HB2  GLU  51           HB2      GLU  51  43.216   6.089 -16.331
  370    HB3  GLU  51           HB1      GLU  51  42.618   4.832 -15.252
  371    HG2  GLU  51           HG2      GLU  51  44.392   3.835 -16.520
  372    HG3  GLU  51           HG1      GLU  51  42.890   3.207 -17.201
  373    H    ALA  52           HN       ALA  52  38.974   5.555 -15.861
  374    HA   ALA  52           HA       ALA  52  38.743   3.077 -14.462
  375    HB1  ALA  52           HB1      ALA  52  36.491   4.790 -15.563
  376    HB2  ALA  52           HB2      ALA  52  37.324   5.099 -14.041
  377    HB3  ALA  52           HB3      ALA  52  36.378   3.627 -14.243
  378    H    ARG  53           HN       ARG  53  37.743   1.124 -15.041
  379    HA   ARG  53           HA       ARG  53  37.272   0.749 -17.989
  380    HB2  ARG  53           HB2      ARG  53  39.152  -0.564 -17.009
  381    HB3  ARG  53           HB1      ARG  53  38.011  -1.322 -15.898
  382    HG2  ARG  53           HG2      ARG  53  36.738  -2.230 -17.783
  383    HG3  ARG  53           HG1      ARG  53  37.821  -1.426 -18.921
  384    HD2  ARG  53           HD2      ARG  53  39.727  -2.719 -17.920
  385    HD3  ARG  53           HD1      ARG  53  38.551  -3.612 -16.953
  386    HE   ARG  53           HE       ARG  53  37.744  -3.761 -19.675
  387   HH11  ARG  53          HH21      ARG  53  40.264  -4.741 -17.534
  388   HH12  ARG  53          HH22      ARG  53  40.638  -6.181 -18.421
  389   HH21  ARG  53          HH11      ARG  53  38.216  -5.631 -20.847
  390   HH22  ARG  53          HH12      ARG  53  39.477  -6.684 -20.299
  391    H    ARG  54           HN       ARG  54  35.327  -0.036 -18.646
  392    HA   ARG  54           HA       ARG  54  33.180  -0.194 -16.642
  393    HB2  ARG  54           HB2      ARG  54  33.318  -0.095 -19.652
  394    HB3  ARG  54           HB1      ARG  54  31.826  -0.623 -18.873
  395    HG2  ARG  54           HG2      ARG  54  31.652   1.460 -17.651
  396    HG3  ARG  54           HG1      ARG  54  33.242   1.976 -18.214
  397    HD2  ARG  54           HD2      ARG  54  30.895   1.404 -20.042
  398    HD3  ARG  54           HD1      ARG  54  31.356   3.018 -19.498
  399    HE   ARG  54           HE       ARG  54  33.680   1.903 -20.604
  400   HH11  ARG  54          HH21      ARG  54  30.438   2.628 -21.547
  401   HH12  ARG  54          HH22      ARG  54  30.847   2.932 -23.203
  402   HH21  ARG  54          HH11      ARG  54  34.232   2.297 -22.760
  403   HH22  ARG  54          HH12      ARG  54  32.996   2.745 -23.889
  404    HA   PRO  55           HA       PRO  55  33.136  -4.621 -16.377
  405    HB2  PRO  55           HB2      PRO  55  30.432  -5.105 -16.066
  406    HB3  PRO  55           HB1      PRO  55  31.470  -4.457 -14.780
  407    HG2  PRO  55           HG2      PRO  55  29.628  -3.002 -16.634
  408    HG3  PRO  55           HG1      PRO  55  29.887  -2.772 -14.894
  409    HD2  PRO  55           HD2      PRO  55  31.017  -1.130 -16.731
  410    HD3  PRO  55           HD1      PRO  55  31.840  -1.541 -15.210
  411    H    GLU  56           HN       GLU  56  32.875  -6.444 -17.692
  412    HA   GLU  56           HA       GLU  56  30.959  -6.636 -19.833
  413    HB2  GLU  56           HB2      GLU  56  32.529  -4.909 -20.785
  414    HB3  GLU  56           HB1      GLU  56  33.817  -6.111 -20.703
  415    HG2  GLU  56           HG2      GLU  56  32.923  -6.182 -22.941
  416    HG3  GLU  56           HG1      GLU  56  32.356  -7.631 -22.114
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1  30.543 -12.107  14.401
    2    H2   MET   1           HT2      MET   1  29.075 -11.632  13.690
    3    H3   MET   1           HT3      MET   1  29.135 -12.026  15.342
    4    HA   MET   1           HA       MET   1  29.246  -9.526  14.382
    5    HB2  MET   1           HB2      MET   1  30.355  -9.039  16.666
    6    HB3  MET   1           HB1      MET   1  28.819  -9.905  16.683
    7    HG2  MET   1           HG2      MET   1  29.870 -11.992  17.090
    8    HG3  MET   1           HG1      MET   1  31.459 -11.373  16.643
    9    HE1  MET   1           HE1      MET   1  31.674 -12.252  20.434
   10    HE2  MET   1           HE2      MET   1  32.617 -12.261  18.946
   11    HE3  MET   1           HE3      MET   1  31.045 -13.053  18.988
   12    HA   PRO   2           HA       PRO   2  33.551 -10.150  12.670
   13    HB2  PRO   2           HB2      PRO   2  32.457  -8.168  10.717
   14    HB3  PRO   2           HB1      PRO   2  33.346  -9.675  10.417
   15    HG2  PRO   2           HG2      PRO   2  30.727  -9.516   9.966
   16    HG3  PRO   2           HG1      PRO   2  31.455 -10.990  10.634
   17    HD2  PRO   2           HD2      PRO   2  29.898  -8.849  12.062
   18    HD3  PRO   2           HD1      PRO   2  29.859 -10.614  12.291
   19    H    LEU   3           HN       LEU   3  35.309  -8.747  12.894
   20    HA   LEU   3           HA       LEU   3  34.940  -6.480  14.638
   21    HB2  LEU   3           HB2      LEU   3  37.390  -7.239  13.030
   22    HB3  LEU   3           HB1      LEU   3  37.348  -6.231  14.479
   23    HG   LEU   3           HG       LEU   3  36.532  -9.149  14.343
   24   HD11  LEU   3          HD11      LEU   3  38.943  -7.839  15.634
   25   HD12  LEU   3          HD12      LEU   3  38.976  -8.764  14.133
   26   HD13  LEU   3          HD13      LEU   3  38.559  -9.560  15.651
   27   HD21  LEU   3          HD21      LEU   3  35.239  -8.223  16.085
   28   HD22  LEU   3          HD22      LEU   3  36.502  -7.078  16.542
   29   HD23  LEU   3          HD23      LEU   3  36.676  -8.788  16.928
   30    H    GLU   4           HN       GLU   4  34.242  -4.552  14.017
   31    HA   GLU   4           HA       GLU   4  33.620  -2.785  12.589
   32    HB2  GLU   4           HB2      GLU   4  36.575  -3.142  12.014
   33    HB3  GLU   4           HB1      GLU   4  35.637  -1.724  11.543
   34    HG2  GLU   4           HG2      GLU   4  35.075  -1.280  13.882
   35    HG3  GLU   4           HG1      GLU   4  35.944  -2.732  14.383
   36    H    ALA   5           HN       ALA   5  35.714  -2.782  10.095
   37    HA   ALA   5           HA       ALA   5  33.856  -4.320   8.310
   38    HB1  ALA   5           HB1      ALA   5  33.788  -1.926   7.880
   39    HB2  ALA   5           HB2      ALA   5  34.611  -2.731   6.543
   40    HB3  ALA   5           HB3      ALA   5  35.546  -1.865   7.763
   41    H    GLY   6           HN       GLY   6  35.379  -6.141   9.065
   42    HA2  GLY   6           HA2      GLY   6  36.959  -7.714   8.311
   43    HA3  GLY   6           HA1      GLY   6  37.284  -6.658   6.939
   44    H    LEU   7           HN       LEU   7  37.481  -5.451  10.196
   45    HA   LEU   7           HA       LEU   7  39.269  -4.567  11.385
   46    HB2  LEU   7           HB2      LEU   7  39.894  -6.932  11.643
   47    HB3  LEU   7           HB1      LEU   7  40.737  -6.894  10.098
   48    HG   LEU   7           HG       LEU   7  42.319  -5.230  10.965
   49   HD11  LEU   7          HD11      LEU   7  40.459  -5.283  13.331
   50   HD12  LEU   7          HD12      LEU   7  41.195  -3.899  12.520
   51   HD13  LEU   7          HD13      LEU   7  42.167  -4.913  13.581
   52   HD21  LEU   7          HD21      LEU   7  42.939  -7.538  11.288
   53   HD22  LEU   7          HD22      LEU   7  41.909  -7.672  12.713
   54   HD23  LEU   7          HD23      LEU   7  43.360  -6.670  12.764
   55    H    LEU   8           HN       LEU   8  40.081  -2.679  10.817
   56    HA   LEU   8           HA       LEU   8  40.945  -0.986   9.434
   57    HB2  LEU   8           HB2      LEU   8  42.901  -2.548  10.487
   58    HB3  LEU   8           HB1      LEU   8  43.257  -2.779   8.780
   59    HG   LEU   8           HG       LEU   8  43.016  -0.132   8.679
   60   HD11  LEU   8          HD11      LEU   8  43.739  -0.640  11.581
   61   HD12  LEU   8          HD12      LEU   8  42.264   0.129  11.001
   62   HD13  LEU   8          HD13      LEU   8  43.820   0.923  10.771
   63   HD21  LEU   8          HD21      LEU   8  45.421  -1.552   9.875
   64   HD22  LEU   8          HD22      LEU   8  45.452   0.063   9.167
   65   HD23  LEU   8          HD23      LEU   8  45.087  -1.335   8.157
   66    H    GLU   9           HN       GLU   9  42.719  -1.190   7.258
   67    HA   GLU   9           HA       GLU   9  42.487  -1.099   4.926
   68    HB2  GLU   9           HB2      GLU   9  43.324  -3.399   5.349
   69    HB3  GLU   9           HB1      GLU   9  41.654  -3.971   5.419
   70    HG2  GLU   9           HG2      GLU   9  41.265  -3.258   3.125
   71    HG3  GLU   9           HG1      GLU   9  42.876  -2.543   3.043
   72    H    ILE  10           HN       ILE  10  40.616   0.361   5.093
   73    HA   ILE  10           HA       ILE  10  37.959  -0.902   4.769
   74    HB   ILE  10           HB       ILE  10  38.270   1.090   6.254
   75   HG12  ILE  10          HG12      ILE  10  36.320   2.360   5.325
   76   HG13  ILE  10          HG11      ILE  10  36.475   1.452   3.827
   77   HG21  ILE  10          HG21      ILE  10  39.978   2.137   4.641
   78   HG22  ILE  10          HG22      ILE  10  38.797   3.230   5.362
   79   HG23  ILE  10          HG23      ILE  10  38.588   2.679   3.701
   80   HD11  ILE  10          HD11      ILE  10  36.272  -0.126   6.366
   81   HD12  ILE  10          HD12      ILE  10  35.646  -0.493   4.761
   82   HD13  ILE  10          HD13      ILE  10  34.814   0.675   5.785
   83    H    LEU  11           HN       LEU  11  37.016  -1.165   2.817
   84    HA   LEU  11           HA       LEU  11  38.371   0.007   0.422
   85    HB2  LEU  11           HB2      LEU  11  36.375  -2.267   0.603
   86    HB3  LEU  11           HB1      LEU  11  37.281  -1.778  -0.830
   87    HG   LEU  11           HG       LEU  11  38.491  -2.797   1.758
   88   HD11  LEU  11          HD11      LEU  11  38.120  -4.079  -0.963
   89   HD12  LEU  11          HD12      LEU  11  37.405  -4.599   0.562
   90   HD13  LEU  11          HD13      LEU  11  39.144  -4.745   0.309
   91   HD21  LEU  11          HD21      LEU  11  40.545  -2.933   0.108
   92   HD22  LEU  11          HD22      LEU  11  40.147  -1.396   0.865
   93   HD23  LEU  11          HD23      LEU  11  39.660  -1.708  -0.802
   94    H    ALA  12           HN       ALA  12  37.312   1.509  -0.779
   95    HA   ALA  12           HA       ALA  12  34.364   1.678  -0.645
   96    HB1  ALA  12           HB1      ALA  12  34.393   4.064  -0.058
   97    HB2  ALA  12           HB2      ALA  12  36.150   4.022   0.089
   98    HB3  ALA  12           HB3      ALA  12  35.148   3.113   1.219
   99    H    CYS  13           HN       CYS  13  33.498   2.656  -2.491
  100    HA   CYS  13           HA       CYS  13  35.425   2.999  -4.700
  101    HB2  CYS  13           HB2      CYS  13  33.621   1.612  -5.318
  102    HB3  CYS  13           HB1      CYS  13  32.437   2.656  -4.533
  103    HA   PRO  14           HA       PRO  14  35.079   7.467  -4.364
  104    HB2  PRO  14           HB2      PRO  14  35.907   8.170  -6.909
  105    HB3  PRO  14           HB1      PRO  14  37.011   7.688  -5.610
  106    HG2  PRO  14           HG2      PRO  14  35.989   6.095  -7.913
  107    HG3  PRO  14           HG1      PRO  14  37.592   6.086  -7.155
  108    HD2  PRO  14           HD2      PRO  14  35.705   4.150  -6.686
  109    HD3  PRO  14           HD1      PRO  14  36.949   4.598  -5.498
  110    H    ALA  15           HN       ALA  15  32.679   5.898  -5.136
  111    HA   ALA  15           HA       ALA  15  31.169   8.097  -6.398
  112    HB1  ALA  15           HB1      ALA  15  30.179   6.622  -8.113
  113    HB2  ALA  15           HB2      ALA  15  31.223   5.303  -7.585
  114    HB3  ALA  15           HB3      ALA  15  31.925   6.740  -8.329
  115    H    CYS  16           HN       CYS  16  30.452   4.629  -6.041
  116    HA   CYS  16           HA       CYS  16  28.063   5.310  -4.449
  117    HB2  CYS  16           HB2      CYS  16  27.832   2.714  -4.530
  118    HB3  CYS  16           HB1      CYS  16  27.606   3.623  -6.024
  119    H    HIS  17           HN       HIS  17  31.198   5.134  -3.672
  120    HA   HIS  17           HA       HIS  17  32.387   4.640  -1.716
  121    HB2  HIS  17           HB2      HIS  17  29.579   4.830  -0.571
  122    HB3  HIS  17           HB1      HIS  17  31.050   4.783   0.397
  123    HD2  HIS  17           HD2      HIS  17  32.652   7.147   0.246
  124    HE1  HIS  17           HE1      HIS  17  29.843   9.407  -1.953
  125    HE2  HIS  17           HE2      HIS  17  32.013   9.514  -0.645
  126    H    ALA  18           HN       ALA  18  30.715   2.473  -3.307
  127    HA   ALA  18           HA       ALA  18  30.306   0.393  -1.346
  128    HB1  ALA  18           HB1      ALA  18  30.300  -1.065  -3.513
  129    HB2  ALA  18           HB2      ALA  18  30.381   0.479  -4.349
  130    HB3  ALA  18           HB3      ALA  18  29.018   0.123  -3.290
  131    HA   PRO  19           HA       PRO  19  34.468  -1.113  -0.992
  132    HB2  PRO  19           HB2      PRO  19  34.017  -3.815  -0.601
  133    HB3  PRO  19           HB1      PRO  19  33.776  -2.578   0.649
  134    HG2  PRO  19           HG2      PRO  19  31.762  -3.910  -1.100
  135    HG3  PRO  19           HG1      PRO  19  31.649  -3.460   0.607
  136    HD2  PRO  19           HD2      PRO  19  30.489  -1.978  -1.373
  137    HD3  PRO  19           HD1      PRO  19  31.096  -1.253   0.131
  138    H    LEU  20           HN       LEU  20  36.065  -2.557  -2.013
  139    HA   LEU  20           HA       LEU  20  35.373  -3.134  -4.869
  140    HB2  LEU  20           HB2      LEU  20  38.111  -2.738  -3.630
  141    HB3  LEU  20           HB1      LEU  20  37.709  -2.783  -5.348
  142    HG   LEU  20           HG       LEU  20  36.740  -0.703  -3.367
  143   HD11  LEU  20          HD11      LEU  20  38.227   0.822  -4.524
  144   HD12  LEU  20          HD12      LEU  20  38.673  -0.429  -5.684
  145   HD13  LEU  20          HD13      LEU  20  39.165  -0.576  -3.997
  146   HD21  LEU  20          HD21      LEU  20  35.045  -0.857  -4.996
  147   HD22  LEU  20          HD22      LEU  20  36.194  -1.208  -6.292
  148   HD23  LEU  20          HD23      LEU  20  36.080   0.419  -5.628
  149    H    GLU  21           HN       GLU  21  36.008  -5.105  -5.764
  150    HA   GLU  21           HA       GLU  21  36.738  -7.237  -3.780
  151    HB2  GLU  21           HB2      GLU  21  34.498  -7.466  -4.847
  152    HB3  GLU  21           HB1      GLU  21  35.285  -7.505  -6.426
  153    HG2  GLU  21           HG2      GLU  21  36.534  -9.508  -5.795
  154    HG3  GLU  21           HG1      GLU  21  35.850  -9.451  -4.170
  155    H    GLU  22           HN       GLU  22  38.558  -8.375  -4.152
  156    HA   GLU  22           HA       GLU  22  40.333  -7.525  -6.324
  157    HB2  GLU  22           HB2      GLU  22  40.641  -9.497  -4.044
  158    HB3  GLU  22           HB1      GLU  22  41.920  -9.138  -5.207
  159    HG2  GLU  22           HG2      GLU  22  41.883  -6.786  -4.574
  160    HG3  GLU  22           HG1      GLU  22  40.531  -7.069  -3.483
  161    H    ARG  23           HN       ARG  23  40.483  -8.564  -8.253
  162    HA   ARG  23           HA       ARG  23  39.705 -11.458  -8.373
  163    HB2  ARG  23           HB2      ARG  23  37.852 -10.054  -9.248
  164    HB3  ARG  23           HB1      ARG  23  38.968  -9.340 -10.413
  165    HG2  ARG  23           HG2      ARG  23  39.385 -11.540 -11.408
  166    HG3  ARG  23           HG1      ARG  23  38.342 -12.302 -10.207
  167    HD2  ARG  23           HD2      ARG  23  37.409 -10.169 -12.143
  168    HD3  ARG  23           HD1      ARG  23  37.217 -11.898 -12.420
  169    HE   ARG  23           HE       ARG  23  36.135 -11.302  -9.862
  170   HH11  ARG  23          HH21      ARG  23  35.625 -10.665 -13.210
  171   HH12  ARG  23          HH22      ARG  23  33.909 -10.493 -13.051
  172   HH21  ARG  23          HH11      ARG  23  33.902 -11.078  -9.636
  173   HH22  ARG  23          HH12      ARG  23  32.932 -10.727 -11.027
  174    H    ASP  24           HN       ASP  24  41.445 -12.550  -8.991
  175    HA   ASP  24           HA       ASP  24  43.484 -13.081 -10.001
  176    HB2  ASP  24           HB2      ASP  24  42.132 -11.426 -12.141
  177    HB3  ASP  24           HB1      ASP  24  43.665 -12.259 -12.402
  178    H    ALA  25           HN       ALA  25  43.417 -10.035 -11.712
  179    HA   ALA  25           HA       ALA  25  45.460  -8.898  -9.851
  180    HB1  ALA  25           HB1      ALA  25  46.877  -8.293 -11.746
  181    HB2  ALA  25           HB2      ALA  25  45.713  -8.989 -12.876
  182    HB3  ALA  25           HB3      ALA  25  46.602 -10.033 -11.767
  183    H    GLU  26           HN       GLU  26  42.579  -8.363 -10.391
  184    HA   GLU  26           HA       GLU  26  42.907  -5.453 -10.924
  185    HB2  GLU  26           HB2      GLU  26  40.873  -5.476 -12.404
  186    HB3  GLU  26           HB1      GLU  26  42.271  -6.287 -13.113
  187    HG2  GLU  26           HG2      GLU  26  41.381  -8.462 -12.364
  188    HG3  GLU  26           HG1      GLU  26  39.978  -7.645 -11.676
  189    H    LEU  27           HN       LEU  27  41.037  -4.189 -10.198
  190    HA   LEU  27           HA       LEU  27  39.603  -5.576  -7.949
  191    HB2  LEU  27           HB2      LEU  27  40.065  -2.608  -8.325
  192    HB3  LEU  27           HB1      LEU  27  39.490  -3.428  -6.872
  193    HG   LEU  27           HG       LEU  27  42.226  -3.719  -8.139
  194   HD11  LEU  27          HD11      LEU  27  42.154  -1.674  -6.935
  195   HD12  LEU  27          HD12      LEU  27  42.886  -2.832  -5.823
  196   HD13  LEU  27          HD13      LEU  27  41.193  -2.382  -5.636
  197   HD21  LEU  27          HD21      LEU  27  41.783  -5.855  -7.247
  198   HD22  LEU  27          HD22      LEU  27  40.840  -5.201  -5.906
  199   HD23  LEU  27          HD23      LEU  27  42.597  -5.036  -5.918
  200    H    ILE  28           HN       ILE  28  37.429  -5.639  -7.962
  201    HA   ILE  28           HA       ILE  28  35.999  -4.131 -10.128
  202    HB   ILE  28           HB       ILE  28  35.367  -6.805  -8.869
  203   HG12  ILE  28          HG12      ILE  28  35.934  -6.060 -11.752
  204   HG13  ILE  28          HG11      ILE  28  37.180  -6.632 -10.643
  205   HG21  ILE  28          HG21      ILE  28  33.256  -5.764  -9.232
  206   HG22  ILE  28          HG22      ILE  28  33.524  -6.760 -10.662
  207   HG23  ILE  28          HG23      ILE  28  33.795  -5.019 -10.737
  208   HD11  ILE  28          HD11      ILE  28  34.649  -8.223 -11.006
  209   HD12  ILE  28          HD12      ILE  28  36.245  -8.768 -10.490
  210   HD13  ILE  28          HD13      ILE  28  35.958  -8.356 -12.180
  211    H    CYS  29           HN       CYS  29  34.481  -2.703  -9.496
  212    HA   CYS  29           HA       CYS  29  34.126  -2.099  -6.718
  213    HB2  CYS  29           HB2      CYS  29  33.861  -0.491  -8.651
  214    HB3  CYS  29           HB1      CYS  29  32.318  -1.269  -8.995
  215    H    THR  30           HN       THR  30  32.677  -2.870  -5.247
  216    HA   THR  30           HA       THR  30  30.937  -5.086  -6.015
  217    HB   THR  30           HB       THR  30  30.311  -5.028  -3.609
  218    HG1  THR  30           HG1      THR  30  32.072  -3.205  -2.808
  219   HG21  THR  30          HG21      THR  30  32.690  -5.283  -2.724
  220   HG22  THR  30          HG22      THR  30  33.244  -4.788  -4.321
  221   HG23  THR  30          HG23      THR  30  32.302  -6.265  -4.134
  222    H    GLY  31           HN       GLY  31  30.640  -1.807  -6.385
  223    HA2  GLY  31           HA2      GLY  31  27.932  -1.372  -5.491
  224    HA3  GLY  31           HA1      GLY  31  28.816  -0.349  -6.622
  225    H    GLN  32           HN       GLN  32  26.059  -1.951  -6.466
  226    HA   GLN  32           HA       GLN  32  26.041  -3.599  -8.832
  227    HB2  GLN  32           HB2      GLN  32  24.335  -3.745  -7.026
  228    HB3  GLN  32           HB1      GLN  32  23.746  -2.148  -7.486
  229    HG2  GLN  32           HG2      GLN  32  23.159  -2.946  -9.706
  230    HG3  GLN  32           HG1      GLN  32  23.856  -4.529  -9.357
  231   HE21  GLN  32          HE21      GLN  32  22.069  -5.906  -9.216
  232   HE22  GLN  32          HE22      GLN  32  20.708  -5.622  -8.241
  233    H    ASP  33           HN       ASP  33  25.268  -0.187  -8.210
  234    HA   ASP  33           HA       ASP  33  24.528   0.268 -11.021
  235    HB2  ASP  33           HB2      ASP  33  24.859   2.127  -8.651
  236    HB3  ASP  33           HB1      ASP  33  24.345   2.656 -10.253
  237    H    CYS  34           HN       CYS  34  27.404  -0.029  -9.341
  238    HA   CYS  34           HA       CYS  34  28.860   1.994 -10.953
  239    HB2  CYS  34           HB2      CYS  34  29.211   1.228  -8.380
  240    HB3  CYS  34           HB1      CYS  34  30.330   0.109  -9.147
  241    H    GLY  35           HN       GLY  35  29.591  -1.399 -10.122
  242    HA2  GLY  35           HA2      GLY  35  30.385  -3.157 -11.452
  243    HA3  GLY  35           HA1      GLY  35  29.550  -2.387 -12.803
  244    H    LEU  36           HN       LEU  36  31.762  -0.347 -11.182
  245    HA   LEU  36           HA       LEU  36  33.442  -0.203 -13.550
  246    HB2  LEU  36           HB2      LEU  36  33.800   1.070 -10.824
  247    HB3  LEU  36           HB1      LEU  36  34.693   1.499 -12.284
  248    HG   LEU  36           HG       LEU  36  31.684   1.698 -11.949
  249   HD11  LEU  36          HD11      LEU  36  33.632   3.988 -12.246
  250   HD12  LEU  36          HD12      LEU  36  33.204   3.343 -10.661
  251   HD13  LEU  36          HD13      LEU  36  31.957   4.036 -11.698
  252   HD21  LEU  36          HD21      LEU  36  33.562   2.156 -14.261
  253   HD22  LEU  36          HD22      LEU  36  32.123   3.164 -14.120
  254   HD23  LEU  36          HD23      LEU  36  31.961   1.417 -14.252
  255    H    ALA  37           HN       ALA  37  35.634  -0.748 -13.725
  256    HA   ALA  37           HA       ALA  37  36.716  -2.533 -11.574
  257    HB1  ALA  37           HB1      ALA  37  36.746  -2.985 -14.567
  258    HB2  ALA  37           HB2      ALA  37  35.936  -3.979 -13.356
  259    HB3  ALA  37           HB3      ALA  37  37.698  -3.922 -13.414
  260    H    TYR  38           HN       TYR  38  38.901  -2.372 -11.208
  261    HA   TYR  38           HA       TYR  38  40.396  -0.361 -12.834
  262    HB2  TYR  38           HB2      TYR  38  40.859  -0.623  -9.880
  263    HB3  TYR  38           HB1      TYR  38  41.202   0.741 -10.946
  264    HD1  TYR  38           HD1      TYR  38  38.393  -1.296  -9.574
  265    HD2  TYR  38           HD2      TYR  38  39.640   2.498 -11.148
  266    HE1  TYR  38           HE1      TYR  38  36.175  -0.342  -9.025
  267    HE2  TYR  38           HE2      TYR  38  37.419   3.456 -10.599
  268    HH   TYR  38           HH       TYR  38  35.249   1.974  -8.537
  269    HA   PRO  39           HA       PRO  39  43.077  -4.039 -12.762
  270    HB2  PRO  39           HB2      PRO  39  44.735  -3.351 -14.800
  271    HB3  PRO  39           HB1      PRO  39  43.080  -3.930 -15.077
  272    HG2  PRO  39           HG2      PRO  39  44.144  -1.144 -15.126
  273    HG3  PRO  39           HG1      PRO  39  42.940  -1.912 -16.178
  274    HD2  PRO  39           HD2      PRO  39  42.305  -0.246 -14.054
  275    HD3  PRO  39           HD1      PRO  39  41.199  -1.469 -14.728
  276    H    VAL  40           HN       VAL  40  45.303  -4.491 -12.174
  277    HA   VAL  40           HA       VAL  40  46.495  -2.394 -10.515
  278    HB   VAL  40           HB       VAL  40  47.262  -5.254 -11.074
  279   HG11  VAL  40          HG11      VAL  40  48.767  -4.852  -9.024
  280   HG12  VAL  40          HG12      VAL  40  48.554  -3.132  -9.347
  281   HG13  VAL  40          HG13      VAL  40  49.318  -4.167 -10.553
  282   HG21  VAL  40          HG21      VAL  40  45.933  -3.792  -8.776
  283   HG22  VAL  40          HG22      VAL  40  46.591  -5.422  -8.619
  284   HG23  VAL  40          HG23      VAL  40  45.273  -5.107  -9.748
  285    H    ARG  41           HN       ARG  41  48.178  -1.066 -11.142
  286    HA   ARG  41           HA       ARG  41  49.730  -1.891 -13.581
  287    HB2  ARG  41           HB2      ARG  41  48.703   0.864 -12.844
  288    HB3  ARG  41           HB1      ARG  41  49.794   0.527 -14.186
  289    HG2  ARG  41           HG2      ARG  41  47.166  -0.945 -13.969
  290    HG3  ARG  41           HG1      ARG  41  47.214   0.680 -14.644
  291    HD2  ARG  41           HD2      ARG  41  48.827  -1.688 -15.656
  292    HD3  ARG  41           HD1      ARG  41  47.404  -1.004 -16.430
  293    HE   ARG  41           HE       ARG  41  49.257   1.102 -16.072
  294   HH11  ARG  41          HH21      ARG  41  48.913  -1.888 -17.743
  295   HH12  ARG  41          HH22      ARG  41  49.911  -1.411 -19.074
  296   HH21  ARG  41          HH11      ARG  41  50.562   1.744 -17.792
  297   HH22  ARG  41          HH12      ARG  41  50.847   0.649 -19.104
  298    H    ASP  42           HN       ASP  42  51.862  -1.840 -13.336
  299    HA   ASP  42           HA       ASP  42  53.935  -1.627 -12.296
  300    HB2  ASP  42           HB2      ASP  42  52.658   1.044 -11.668
  301    HB3  ASP  42           HB1      ASP  42  54.337   0.669 -11.275
  302    H    GLY  43           HN       GLY  43  51.674  -2.821 -10.743
  303    HA2  GLY  43           HA2      GLY  43  51.827  -3.911  -8.621
  304    HA3  GLY  43           HA1      GLY  43  53.028  -2.727  -8.116
  305    H    ILE  44           HN       ILE  44  50.668  -0.894  -9.486
  306    HA   ILE  44           HA       ILE  44  48.970  -0.837  -7.039
  307    HB   ILE  44           HB       ILE  44  50.785   0.858  -6.800
  308   HG12  ILE  44          HG12      ILE  44  47.947   1.882  -7.154
  309   HG13  ILE  44          HG11      ILE  44  48.663   1.238  -5.675
  310   HG21  ILE  44          HG21      ILE  44  50.893   2.751  -8.274
  311   HG22  ILE  44          HG22      ILE  44  49.436   2.250  -9.124
  312   HG23  ILE  44          HG23      ILE  44  50.918   1.315  -9.285
  313   HD11  ILE  44          HD11      ILE  44  49.313   3.825  -7.086
  314   HD12  ILE  44          HD12      ILE  44  50.395   3.116  -5.888
  315   HD13  ILE  44          HD13      ILE  44  48.762   3.595  -5.426
  316    HA   PRO  45           HA       PRO  45  45.926  -0.297 -10.328
  317    HB2  PRO  45           HB2      PRO  45  43.674  -0.184  -8.843
  318    HB3  PRO  45           HB1      PRO  45  44.589  -1.696  -9.027
  319    HG2  PRO  45           HG2      PRO  45  44.578   0.238  -6.748
  320    HG3  PRO  45           HG1      PRO  45  44.575  -1.534  -6.724
  321    HD2  PRO  45           HD2      PRO  45  46.853  -0.023  -6.356
  322    HD3  PRO  45           HD1      PRO  45  46.860  -1.685  -6.982
  323    H    VAL  46           HN       VAL  46  44.549   1.330 -11.181
  324    HA   VAL  46           HA       VAL  46  45.242   4.026 -10.203
  325    HB   VAL  46           HB       VAL  46  43.520   3.257 -12.574
  326   HG11  VAL  46          HG11      VAL  46  44.415   5.532 -13.349
  327   HG12  VAL  46          HG12      VAL  46  44.923   5.787 -11.684
  328   HG13  VAL  46          HG13      VAL  46  43.216   5.561 -12.061
  329   HG21  VAL  46          HG21      VAL  46  45.606   3.567 -13.894
  330   HG22  VAL  46          HG22      VAL  46  45.732   2.215 -12.768
  331   HG23  VAL  46          HG23      VAL  46  46.509   3.753 -12.390
  332    H    LEU  47           HN       LEU  47  43.894   5.266  -9.015
  333    HA   LEU  47           HA       LEU  47  41.146   4.245  -8.452
  334    HB2  LEU  47           HB2      LEU  47  42.791   6.357  -7.028
  335    HB3  LEU  47           HB1      LEU  47  41.262   5.675  -6.470
  336    HG   LEU  47           HG       LEU  47  43.820   4.108  -6.924
  337   HD11  LEU  47          HD11      LEU  47  42.441   4.938  -4.352
  338   HD12  LEU  47          HD12      LEU  47  43.952   5.606  -4.973
  339   HD13  LEU  47          HD13      LEU  47  43.876   3.918  -4.468
  340   HD21  LEU  47          HD21      LEU  47  41.013   3.341  -6.133
  341   HD22  LEU  47          HD22      LEU  47  42.372   2.408  -5.511
  342   HD23  LEU  47          HD23      LEU  47  42.115   2.533  -7.247
  343    H    LEU  48           HN       LEU  48  41.795   5.637 -10.946
  344    HA   LEU  48           HA       LEU  48  40.290   8.204 -10.564
  345    HB2  LEU  48           HB2      LEU  48  42.049   7.390 -12.892
  346    HB3  LEU  48           HB1      LEU  48  41.319   8.966 -12.623
  347    HG   LEU  48           HG       LEU  48  43.356   7.644 -10.811
  348   HD11  LEU  48          HD11      LEU  48  44.841   9.475 -11.609
  349   HD12  LEU  48          HD12      LEU  48  43.583   9.974 -12.740
  350   HD13  LEU  48          HD13      LEU  48  44.349   8.395 -12.915
  351   HD21  LEU  48          HD21      LEU  48  43.363  10.119  -9.912
  352   HD22  LEU  48          HD22      LEU  48  42.099   9.019  -9.378
  353   HD23  LEU  48          HD23      LEU  48  41.761  10.202 -10.642
  354    H    VAL  49           HN       VAL  49  38.404   8.490 -11.624
  355    HA   VAL  49           HA       VAL  49  36.971   6.226 -12.639
  356    HB   VAL  49           HB       VAL  49  36.440   9.193 -12.900
  357   HG11  VAL  49          HG11      VAL  49  34.765   6.759 -13.545
  358   HG12  VAL  49          HG12      VAL  49  35.166   8.111 -14.604
  359   HG13  VAL  49          HG13      VAL  49  34.055   8.348 -13.256
  360   HG21  VAL  49          HG21      VAL  49  34.800   8.699 -11.067
  361   HG22  VAL  49          HG22      VAL  49  36.478   8.459 -10.584
  362   HG23  VAL  49          HG23      VAL  49  35.464   7.068 -10.967
  363    H    ASP  50           HN       ASP  50  38.586   8.957 -14.252
  364    HA   ASP  50           HA       ASP  50  37.777   8.340 -16.906
  365    HB2  ASP  50           HB2      ASP  50  39.988   9.546 -17.503
  366    HB3  ASP  50           HB1      ASP  50  38.784  10.456 -16.589
  367    H    GLU  51           HN       GLU  51  40.398   7.034 -14.923
  368    HA   GLU  51           HA       GLU  51  41.397   5.419 -17.206
  369    HB2  GLU  51           HB2      GLU  51  42.284   5.568 -14.308
  370    HB3  GLU  51           HB1      GLU  51  43.118   4.689 -15.587
  371    HG2  GLU  51           HG2      GLU  51  42.596   7.676 -15.607
  372    HG3  GLU  51           HG1      GLU  51  44.131   6.932 -15.171
  373    H    ALA  52           HN       ALA  52  39.029   5.220 -14.819
  374    HA   ALA  52           HA       ALA  52  39.240   2.453 -14.076
  375    HB1  ALA  52           HB1      ALA  52  36.776   4.215 -14.173
  376    HB2  ALA  52           HB2      ALA  52  37.888   4.093 -12.810
  377    HB3  ALA  52           HB3      ALA  52  36.930   2.695 -13.293
  378    H    ARG  53           HN       ARG  53  38.077   0.638 -14.892
  379    HA   ARG  53           HA       ARG  53  37.285   0.921 -17.760
  380    HB2  ARG  53           HB2      ARG  53  38.034  -1.486 -16.086
  381    HB3  ARG  53           HB1      ARG  53  37.509  -1.569 -17.771
  382    HG2  ARG  53           HG2      ARG  53  39.377  -0.154 -18.459
  383    HG3  ARG  53           HG1      ARG  53  39.878   0.042 -16.779
  384    HD2  ARG  53           HD2      ARG  53  41.259  -1.672 -17.820
  385    HD3  ARG  53           HD1      ARG  53  40.199  -2.430 -16.631
  386    HE   ARG  53           HE       ARG  53  38.926  -2.463 -19.198
  387   HH11  ARG  53          HH21      ARG  53  41.514  -3.840 -17.386
  388   HH12  ARG  53          HH22      ARG  53  41.504  -5.337 -18.258
  389   HH21  ARG  53          HH11      ARG  53  38.900  -4.406 -20.348
  390   HH22  ARG  53          HH12      ARG  53  40.025  -5.657 -19.935
  391    H    ARG  54           HN       ARG  54  35.251   0.441 -18.423
  392    HA   ARG  54           HA       ARG  54  33.230  -0.001 -16.308
  393    HB2  ARG  54           HB2      ARG  54  31.771   0.396 -18.606
  394    HB3  ARG  54           HB1      ARG  54  32.309   1.698 -17.550
  395    HG2  ARG  54           HG2      ARG  54  34.278   2.067 -18.907
  396    HG3  ARG  54           HG1      ARG  54  33.916   0.647 -19.892
  397    HD2  ARG  54           HD2      ARG  54  32.146   3.098 -19.653
  398    HD3  ARG  54           HD1      ARG  54  33.211   2.746 -21.013
  399    HE   ARG  54           HE       ARG  54  31.656   0.484 -20.858
  400   HH11  ARG  54          HH21      ARG  54  31.034   3.872 -20.912
  401   HH12  ARG  54          HH22      ARG  54  29.506   3.715 -21.711
  402   HH21  ARG  54          HH11      ARG  54  29.664   0.257 -21.902
  403   HH22  ARG  54          HH12      ARG  54  28.729   1.669 -22.272
  404    HA   PRO  55           HA       PRO  55  32.262  -4.218 -17.259
  405    HB2  PRO  55           HB2      PRO  55  29.484  -3.380 -18.012
  406    HB3  PRO  55           HB1      PRO  55  30.012  -4.604 -16.841
  407    HG2  PRO  55           HG2      PRO  55  29.075  -2.208 -16.077
  408    HG3  PRO  55           HG1      PRO  55  30.340  -3.060 -15.174
  409    HD2  PRO  55           HD2      PRO  55  30.578  -0.650 -16.910
  410    HD3  PRO  55           HD1      PRO  55  31.574  -1.168 -15.535
  411    H    GLU  56           HN       GLU  56  32.396  -5.543 -19.058
  412    HA   GLU  56           HA       GLU  56  31.264  -4.775 -21.634
  413    HB2  GLU  56           HB2      GLU  56  33.361  -3.434 -21.586
  414    HB3  GLU  56           HB1      GLU  56  34.280  -4.919 -21.328
  415    HG2  GLU  56           HG2      GLU  56  33.509  -5.816 -23.463
  416    HG3  GLU  56           HG1      GLU  56  32.484  -4.403 -23.716
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1  48.078  -5.784  14.395
    2    H2   MET   1           HT2      MET   1  47.873  -4.469  15.447
    3    H3   MET   1           HT3      MET   1  47.821  -4.230  13.765
    4    HA   MET   1           HA       MET   1  45.720  -5.030  13.551
    5    HB2  MET   1           HB2      MET   1  44.764  -6.683  15.154
    6    HB3  MET   1           HB1      MET   1  46.247  -7.257  14.393
    7    HG2  MET   1           HG2      MET   1  47.331  -6.077  16.585
    8    HG3  MET   1           HG1      MET   1  45.752  -6.507  17.247
    9    HE1  MET   1           HE1      MET   1  45.090  -9.233  15.483
   10    HE2  MET   1           HE2      MET   1  44.674  -8.642  17.090
   11    HE3  MET   1           HE3      MET   1  45.435 -10.221  16.908
   12    HA   PRO   2           HA       PRO   2  45.250  -1.564  16.649
   13    HB2  PRO   2           HB2      PRO   2  43.742  -0.453  14.320
   14    HB3  PRO   2           HB1      PRO   2  44.959   0.328  15.353
   15    HG2  PRO   2           HG2      PRO   2  45.553  -0.428  12.871
   16    HG3  PRO   2           HG1      PRO   2  46.731  -0.591  14.187
   17    HD2  PRO   2           HD2      PRO   2  45.035  -2.718  12.906
   18    HD3  PRO   2           HD1      PRO   2  46.723  -2.807  13.453
   19    H    LEU   3           HN       LEU   3  43.445  -1.164  17.905
   20    HA   LEU   3           HA       LEU   3  41.214  -3.002  17.661
   21    HB2  LEU   3           HB2      LEU   3  41.512  -0.605  19.485
   22    HB3  LEU   3           HB1      LEU   3  40.397  -1.955  19.700
   23    HG   LEU   3           HG       LEU   3  43.425  -2.163  19.680
   24   HD11  LEU   3          HD11      LEU   3  42.458  -1.052  21.702
   25   HD12  LEU   3          HD12      LEU   3  43.216  -2.602  22.070
   26   HD13  LEU   3          HD13      LEU   3  41.460  -2.482  21.970
   27   HD21  LEU   3          HD21      LEU   3  42.667  -4.253  18.907
   28   HD22  LEU   3          HD22      LEU   3  41.190  -4.184  19.870
   29   HD23  LEU   3          HD23      LEU   3  42.739  -4.506  20.650
   30    H    GLU   4           HN       GLU   4  39.120  -2.591  17.120
   31    HA   GLU   4           HA       GLU   4  37.442  -1.628  15.808
   32    HB2  GLU   4           HB2      GLU   4  37.227  -0.382  17.943
   33    HB3  GLU   4           HB1      GLU   4  38.319   0.854  17.315
   34    HG2  GLU   4           HG2      GLU   4  36.770   1.308  15.464
   35    HG3  GLU   4           HG1      GLU   4  35.691   0.037  16.040
   36    H    ALA   5           HN       ALA   5  38.748  -1.949  13.872
   37    HA   ALA   5           HA       ALA   5  40.455   0.099  12.799
   38    HB1  ALA   5           HB1      ALA   5  38.904  -1.905  11.161
   39    HB2  ALA   5           HB2      ALA   5  40.321  -2.363  12.105
   40    HB3  ALA   5           HB3      ALA   5  40.472  -1.185  10.800
   41    H    GLY   6           HN       GLY   6  40.011   1.715  11.320
   42    HA2  GLY   6           HA2      GLY   6  37.208   2.142  10.432
   43    HA3  GLY   6           HA1      GLY   6  37.959   3.405  11.410
   44    H    LEU   7           HN       LEU   7  39.846   4.473  10.553
   45    HA   LEU   7           HA       LEU   7  39.709   4.788   7.634
   46    HB2  LEU   7           HB2      LEU   7  41.147   6.202   9.876
   47    HB3  LEU   7           HB1      LEU   7  41.566   6.536   8.193
   48    HG   LEU   7           HG       LEU   7  39.822   8.091   9.149
   49   HD11  LEU   7          HD11      LEU   7  39.996   7.115   6.610
   50   HD12  LEU   7          HD12      LEU   7  38.788   8.301   7.102
   51   HD13  LEU   7          HD13      LEU   7  38.356   6.595   7.013
   52   HD21  LEU   7          HD21      LEU   7  38.756   6.182  10.508
   53   HD22  LEU   7          HD22      LEU   7  37.971   5.699   9.006
   54   HD23  LEU   7          HD23      LEU   7  37.639   7.284   9.700
   55    H    LEU   8           HN       LEU   8  41.252   2.693   9.633
   56    HA   LEU   8           HA       LEU   8  43.811   2.692   8.168
   57    HB2  LEU   8           HB2      LEU   8  43.375   2.156  10.730
   58    HB3  LEU   8           HB1      LEU   8  43.030   0.540  10.113
   59    HG   LEU   8           HG       LEU   8  45.385   0.662  10.700
   60   HD11  LEU   8          HD11      LEU   8  46.321  -0.142   8.666
   61   HD12  LEU   8          HD12      LEU   8  45.269   0.884   7.691
   62   HD13  LEU   8          HD13      LEU   8  44.594  -0.503   8.546
   63   HD21  LEU   8          HD21      LEU   8  46.764   2.448  10.254
   64   HD22  LEU   8          HD22      LEU   8  45.255   3.335  10.055
   65   HD23  LEU   8          HD23      LEU   8  46.097   2.697   8.640
   66    H    GLU   9           HN       GLU   9  43.855   1.780   6.244
   67    HA   GLU   9           HA       GLU   9  43.517   0.270   4.505
   68    HB2  GLU   9           HB2      GLU   9  44.487  -1.282   6.234
   69    HB3  GLU   9           HB1      GLU   9  42.841  -1.700   6.712
   70    HG2  GLU   9           HG2      GLU   9  42.349  -2.493   4.455
   71    HG3  GLU   9           HG1      GLU   9  43.950  -1.992   3.906
   72    H    ILE  10           HN       ILE  10  41.551   1.752   4.270
   73    HA   ILE  10           HA       ILE  10  39.003   0.224   4.646
   74    HB   ILE  10           HB       ILE  10  39.081   2.462   5.705
   75   HG12  ILE  10          HG12      ILE  10  37.257   2.457   3.290
   76   HG13  ILE  10          HG11      ILE  10  36.991   1.420   4.692
   77   HG21  ILE  10          HG21      ILE  10  40.649   3.384   3.879
   78   HG22  ILE  10          HG22      ILE  10  39.362   4.453   4.440
   79   HG23  ILE  10          HG23      ILE  10  39.194   3.598   2.905
   80   HD11  ILE  10          HD11      ILE  10  36.746   3.308   6.149
   81   HD12  ILE  10          HD12      ILE  10  35.734   3.619   4.738
   82   HD13  ILE  10          HD13      ILE  10  37.297   4.421   4.898
   83    H    LEU  11           HN       LEU  11  38.014  -0.535   2.885
   84    HA   LEU  11           HA       LEU  11  39.050   0.273   0.199
   85    HB2  LEU  11           HB2      LEU  11  37.382  -2.132   0.984
   86    HB3  LEU  11           HB1      LEU  11  38.126  -1.843  -0.589
   87    HG   LEU  11           HG       LEU  11  39.626  -2.168   2.030
   88   HD11  LEU  11          HD11      LEU  11  39.206  -4.013  -0.337
   89   HD12  LEU  11          HD12      LEU  11  38.741  -4.301   1.340
   90   HD13  LEU  11          HD13      LEU  11  40.446  -4.273   0.890
   91   HD21  LEU  11          HD21      LEU  11  40.466  -1.532  -0.801
   92   HD22  LEU  11          HD22      LEU  11  41.568  -2.396   0.273
   93   HD23  LEU  11          HD23      LEU  11  41.001  -0.786   0.706
   94    H    ALA  12           HN       ALA  12  37.825   1.524  -1.028
   95    HA   ALA  12           HA       ALA  12  34.905   1.259  -1.027
   96    HB1  ALA  12           HB1      ALA  12  36.199   3.867  -0.197
   97    HB2  ALA  12           HB2      ALA  12  35.251   2.811   0.849
   98    HB3  ALA  12           HB3      ALA  12  34.485   3.629  -0.512
   99    H    CYS  13           HN       CYS  13  33.969   2.162  -2.885
  100    HA   CYS  13           HA       CYS  13  35.869   2.590  -5.073
  101    HB2  CYS  13           HB2      CYS  13  34.063   1.220  -5.682
  102    HB3  CYS  13           HB1      CYS  13  32.873   2.276  -4.919
  103    HA   PRO  14           HA       PRO  14  35.874   7.095  -4.500
  104    HB2  PRO  14           HB2      PRO  14  36.287   7.016  -7.470
  105    HB3  PRO  14           HB1      PRO  14  37.201   7.900  -6.233
  106    HG2  PRO  14           HG2      PRO  14  38.139   5.658  -7.384
  107    HG3  PRO  14           HG1      PRO  14  38.490   6.076  -5.698
  108    HD2  PRO  14           HD2      PRO  14  36.695   3.966  -6.767
  109    HD3  PRO  14           HD1      PRO  14  37.515   4.067  -5.199
  110    H    ALA  15           HN       ALA  15  33.905   5.304  -6.740
  111    HA   ALA  15           HA       ALA  15  32.150   7.618  -7.328
  112    HB1  ALA  15           HB1      ALA  15  31.099   6.200  -8.927
  113    HB2  ALA  15           HB2      ALA  15  31.701   4.742  -8.139
  114    HB3  ALA  15           HB3      ALA  15  32.813   5.785  -9.019
  115    H    CYS  16           HN       CYS  16  32.321   4.813  -5.266
  116    HA   CYS  16           HA       CYS  16  29.974   5.738  -3.779
  117    HB2  CYS  16           HB2      CYS  16  28.808   3.497  -3.990
  118    HB3  CYS  16           HB1      CYS  16  28.761   4.509  -5.435
  119    H    HIS  17           HN       HIS  17  29.614   4.403  -1.817
  120    HA   HIS  17           HA       HIS  17  32.146   3.638  -0.612
  121    HB2  HIS  17           HB2      HIS  17  29.277   3.437   0.335
  122    HB3  HIS  17           HB1      HIS  17  30.666   3.031   1.343
  123    HD2  HIS  17           HD2      HIS  17  32.251   5.275   2.142
  124    HE1  HIS  17           HE1      HIS  17  29.607   8.210   0.649
  125    HE2  HIS  17           HE2      HIS  17  31.669   7.815   2.074
  126    H    ALA  18           HN       ALA  18  30.270   2.104  -2.786
  127    HA   ALA  18           HA       ALA  18  29.779  -0.463  -1.822
  128    HB1  ALA  18           HB1      ALA  18  29.158   0.405  -4.080
  129    HB2  ALA  18           HB2      ALA  18  29.824  -1.227  -4.084
  130    HB3  ALA  18           HB3      ALA  18  30.823   0.137  -4.590
  131    HA   PRO  19           HA       PRO  19  33.938  -1.828  -0.656
  132    HB2  PRO  19           HB2      PRO  19  32.745  -4.523  -1.164
  133    HB3  PRO  19           HB1      PRO  19  33.622  -3.931   0.259
  134    HG2  PRO  19           HG2      PRO  19  30.949  -4.234   0.236
  135    HG3  PRO  19           HG1      PRO  19  31.755  -2.961   1.169
  136    HD2  PRO  19           HD2      PRO  19  30.158  -2.725  -1.330
  137    HD3  PRO  19           HD1      PRO  19  30.463  -1.531  -0.058
  138    H    LEU  20           HN       LEU  20  35.687  -3.110  -1.626
  139    HA   LEU  20           HA       LEU  20  35.429  -3.325  -4.605
  140    HB2  LEU  20           HB2      LEU  20  37.922  -2.886  -2.943
  141    HB3  LEU  20           HB1      LEU  20  37.815  -2.867  -4.706
  142    HG   LEU  20           HG       LEU  20  36.363  -0.961  -2.845
  143   HD11  LEU  20          HD11      LEU  20  37.912   0.724  -3.867
  144   HD12  LEU  20          HD12      LEU  20  38.781  -0.603  -4.637
  145   HD13  LEU  20          HD13      LEU  20  38.743  -0.477  -2.878
  146   HD21  LEU  20          HD21      LEU  20  34.998  -1.074  -4.749
  147   HD22  LEU  20          HD22      LEU  20  36.355  -1.396  -5.830
  148   HD23  LEU  20          HD23      LEU  20  36.101   0.228  -5.187
  149    H    GLU  21           HN       GLU  21  35.989  -5.174  -5.597
  150    HA   GLU  21           HA       GLU  21  36.839  -7.466  -3.850
  151    HB2  GLU  21           HB2      GLU  21  34.575  -7.678  -4.842
  152    HB3  GLU  21           HB1      GLU  21  35.286  -7.520  -6.450
  153    HG2  GLU  21           HG2      GLU  21  36.635  -9.528  -6.082
  154    HG3  GLU  21           HG1      GLU  21  36.012  -9.668  -4.438
  155    H    GLU  22           HN       GLU  22  38.833  -8.161  -4.227
  156    HA   GLU  22           HA       GLU  22  40.371  -7.193  -6.493
  157    HB2  GLU  22           HB2      GLU  22  41.391  -7.545  -4.264
  158    HB3  GLU  22           HB1      GLU  22  41.091  -9.276  -4.419
  159    HG2  GLU  22           HG2      GLU  22  42.524  -9.382  -6.398
  160    HG3  GLU  22           HG1      GLU  22  42.765  -7.636  -6.343
  161    H    ARG  23           HN       ARG  23  40.438  -8.108  -8.442
  162    HA   ARG  23           HA       ARG  23  39.937 -11.056  -8.654
  163    HB2  ARG  23           HB2      ARG  23  37.999  -9.586  -9.423
  164    HB3  ARG  23           HB1      ARG  23  39.070  -9.010 -10.702
  165    HG2  ARG  23           HG2      ARG  23  38.037 -10.793 -11.798
  166    HG3  ARG  23           HG1      ARG  23  39.446 -11.611 -11.123
  167    HD2  ARG  23           HD2      ARG  23  38.070 -12.283  -9.152
  168    HD3  ARG  23           HD1      ARG  23  36.668 -11.528  -9.906
  169    HE   ARG  23           HE       ARG  23  37.832 -13.408 -11.721
  170   HH11  ARG  23          HH21      ARG  23  36.056 -13.142  -8.772
  171   HH12  ARG  23          HH22      ARG  23  35.263 -14.670  -8.967
  172   HH21  ARG  23          HH11      ARG  23  36.815 -15.391 -11.980
  173   HH22  ARG  23          HH12      ARG  23  35.693 -15.941 -10.781
  174    H    ASP  24           HN       ASP  24  41.727 -11.988  -9.346
  175    HA   ASP  24           HA       ASP  24  43.783 -12.313 -10.423
  176    HB2  ASP  24           HB2      ASP  24  42.273 -12.338 -12.380
  177    HB3  ASP  24           HB1      ASP  24  42.441 -10.589 -12.525
  178    H    ALA  25           HN       ALA  25  43.895  -9.539 -12.324
  179    HA   ALA  25           HA       ALA  25  45.744  -8.192 -10.383
  180    HB1  ALA  25           HB1      ALA  25  47.028  -7.446 -12.296
  181    HB2  ALA  25           HB2      ALA  25  45.817  -8.080 -13.411
  182    HB3  ALA  25           HB3      ALA  25  46.792  -9.190 -12.451
  183    H    GLU  26           HN       GLU  26  42.762  -7.869 -10.824
  184    HA   GLU  26           HA       GLU  26  42.864  -4.910 -11.243
  185    HB2  GLU  26           HB2      GLU  26  40.787  -6.690 -12.534
  186    HB3  GLU  26           HB1      GLU  26  40.915  -4.938 -12.682
  187    HG2  GLU  26           HG2      GLU  26  43.173  -5.228 -13.704
  188    HG3  GLU  26           HG1      GLU  26  42.942  -6.973 -13.644
  189    H    LEU  27           HN       LEU  27  40.934  -3.830 -10.377
  190    HA   LEU  27           HA       LEU  27  39.738  -5.380  -8.092
  191    HB2  LEU  27           HB2      LEU  27  40.059  -2.383  -8.377
  192    HB3  LEU  27           HB1      LEU  27  39.518  -3.250  -6.941
  193    HG   LEU  27           HG       LEU  27  42.250  -3.498  -8.236
  194   HD11  LEU  27          HD11      LEU  27  41.955  -1.376  -7.052
  195   HD12  LEU  27          HD12      LEU  27  43.026  -2.433  -6.130
  196   HD13  LEU  27          HD13      LEU  27  41.347  -2.231  -5.634
  197   HD21  LEU  27          HD21      LEU  27  42.642  -4.733  -5.951
  198   HD22  LEU  27          HD22      LEU  27  41.867  -5.603  -7.272
  199   HD23  LEU  27          HD23      LEU  27  40.889  -4.941  -5.962
  200    H    ILE  28           HN       ILE  28  37.599  -5.675  -8.091
  201    HA   ILE  28           HA       ILE  28  35.966  -4.205 -10.129
  202    HB   ILE  28           HB       ILE  28  35.316  -6.810  -8.745
  203   HG12  ILE  28          HG12      ILE  28  37.336  -7.129 -10.061
  204   HG13  ILE  28          HG11      ILE  28  35.985  -7.832 -10.947
  205   HG21  ILE  28          HG21      ILE  28  34.200  -5.378 -11.171
  206   HG22  ILE  28          HG22      ILE  28  33.371  -5.640  -9.637
  207   HG23  ILE  28          HG23      ILE  28  33.742  -7.009 -10.685
  208   HD11  ILE  28          HD11      ILE  28  37.497  -5.289 -11.505
  209   HD12  ILE  28          HD12      ILE  28  35.847  -5.477 -12.100
  210   HD13  ILE  28          HD13      ILE  28  37.107  -6.605 -12.611
  211    H    CYS  29           HN       CYS  29  34.433  -2.866  -9.461
  212    HA   CYS  29           HA       CYS  29  34.089  -2.306  -6.644
  213    HB2  CYS  29           HB2      CYS  29  33.865  -0.632  -8.509
  214    HB3  CYS  29           HB1      CYS  29  32.341  -1.406  -8.944
  215    H    THR  30           HN       THR  30  32.618  -3.128  -5.236
  216    HA   THR  30           HA       THR  30  30.884  -5.312  -6.137
  217    HB   THR  30           HB       THR  30  30.279  -5.435  -3.721
  218    HG1  THR  30           HG1      THR  30  30.394  -3.211  -3.276
  219   HG21  THR  30          HG21      THR  30  32.344  -6.517  -4.609
  220   HG22  THR  30          HG22      THR  30  32.505  -6.036  -2.921
  221   HG23  THR  30          HG23      THR  30  33.253  -5.066  -4.189
  222    H    GLY  31           HN       GLY  31  30.584  -2.078  -6.400
  223    HA2  GLY  31           HA2      GLY  31  27.929  -1.577  -5.386
  224    HA3  GLY  31           HA1      GLY  31  28.766  -0.594  -6.590
  225    H    GLN  32           HN       GLN  32  25.989  -2.001  -6.278
  226    HA   GLN  32           HA       GLN  32  25.739  -3.814  -8.495
  227    HB2  GLN  32           HB2      GLN  32  23.734  -2.060  -7.057
  228    HB3  GLN  32           HB1      GLN  32  23.281  -3.230  -8.297
  229    HG2  GLN  32           HG2      GLN  32  24.264  -5.045  -6.977
  230    HG3  GLN  32           HG1      GLN  32  24.789  -3.891  -5.751
  231   HE21  GLN  32          HE21      GLN  32  22.285  -6.020  -6.527
  232   HE22  GLN  32          HE22      GLN  32  21.079  -5.364  -5.530
  233    H    ASP  33           HN       ASP  33  25.082  -0.324  -8.187
  234    HA   ASP  33           HA       ASP  33  24.513  -0.109 -11.070
  235    HB2  ASP  33           HB2      ASP  33  24.697   1.941  -8.845
  236    HB3  ASP  33           HB1      ASP  33  24.299   2.346 -10.516
  237    H    CYS  34           HN       CYS  34  27.265  -0.266  -9.196
  238    HA   CYS  34           HA       CYS  34  28.840   1.606 -10.884
  239    HB2  CYS  34           HB2      CYS  34  29.007   1.115  -8.224
  240    HB3  CYS  34           HB1      CYS  34  30.174  -0.075  -8.802
  241    H    GLY  35           HN       GLY  35  29.474  -1.670  -9.652
  242    HA2  GLY  35           HA2      GLY  35  30.562  -3.487 -10.673
  243    HA3  GLY  35           HA1      GLY  35  29.561  -3.090 -12.073
  244    H    LEU  36           HN       LEU  36  31.676  -0.631 -10.944
  245    HA   LEU  36           HA       LEU  36  33.118  -0.591 -13.463
  246    HB2  LEU  36           HB2      LEU  36  33.677   0.902 -10.887
  247    HB3  LEU  36           HB1      LEU  36  34.354   1.287 -12.472
  248    HG   LEU  36           HG       LEU  36  31.399   1.293 -11.780
  249   HD11  LEU  36          HD11      LEU  36  31.519   3.672 -11.776
  250   HD12  LEU  36          HD12      LEU  36  33.148   3.667 -12.450
  251   HD13  LEU  36          HD13      LEU  36  32.881   3.136 -10.790
  252   HD21  LEU  36          HD21      LEU  36  31.452   2.608 -14.080
  253   HD22  LEU  36          HD22      LEU  36  31.448   0.846 -14.079
  254   HD23  LEU  36          HD23      LEU  36  32.959   1.720 -14.326
  255    H    ALA  37           HN       ALA  37  35.329  -0.959 -13.806
  256    HA   ALA  37           HA       ALA  37  36.655  -2.680 -11.738
  257    HB1  ALA  37           HB1      ALA  37  37.550  -4.051 -13.481
  258    HB2  ALA  37           HB2      ALA  37  36.995  -2.932 -14.724
  259    HB3  ALA  37           HB3      ALA  37  35.823  -3.879 -13.810
  260    H    TYR  38           HN       TYR  38  38.591  -2.034 -11.099
  261    HA   TYR  38           HA       TYR  38  39.903   0.173 -12.634
  262    HB2  TYR  38           HB2      TYR  38  40.368  -0.544  -9.743
  263    HB3  TYR  38           HB1      TYR  38  40.889   0.912 -10.598
  264    HD1  TYR  38           HD1      TYR  38  39.139   2.489 -11.543
  265    HD2  TYR  38           HD2      TYR  38  38.191  -0.682  -8.806
  266    HE1  TYR  38           HE1      TYR  38  36.978   3.589 -11.019
  267    HE2  TYR  38           HE2      TYR  38  36.033   0.417  -8.280
  268    HH   TYR  38           HH       TYR  38  35.078   3.456  -9.886
  269    HA   PRO  39           HA       PRO  39  43.075  -2.970 -13.314
  270    HB2  PRO  39           HB2      PRO  39  44.733  -1.527 -14.901
  271    HB3  PRO  39           HB1      PRO  39  43.157  -2.117 -15.474
  272    HG2  PRO  39           HG2      PRO  39  43.924   0.609 -14.528
  273    HG3  PRO  39           HG1      PRO  39  42.890   0.140 -15.886
  274    HD2  PRO  39           HD2      PRO  39  41.922   0.943 -13.425
  275    HD3  PRO  39           HD1      PRO  39  41.029  -0.095 -14.553
  276    H    VAL  40           HN       VAL  40  45.367  -3.277 -12.825
  277    HA   VAL  40           HA       VAL  40  46.354  -1.401 -10.714
  278    HB   VAL  40           HB       VAL  40  46.799  -4.364 -11.112
  279   HG11  VAL  40          HG11      VAL  40  48.903  -3.541 -10.368
  280   HG12  VAL  40          HG12      VAL  40  48.087  -4.069  -8.894
  281   HG13  VAL  40          HG13      VAL  40  48.154  -2.353  -9.303
  282   HG21  VAL  40          HG21      VAL  40  44.660  -3.499 -10.034
  283   HG22  VAL  40          HG22      VAL  40  45.672  -2.841  -8.748
  284   HG23  VAL  40          HG23      VAL  40  45.621  -4.582  -9.026
  285    H    ARG  41           HN       ARG  41  48.234  -0.382 -11.043
  286    HA   ARG  41           HA       ARG  41  49.783  -1.093 -13.502
  287    HB2  ARG  41           HB2      ARG  41  49.661   1.442 -11.856
  288    HB3  ARG  41           HB1      ARG  41  50.741   1.206 -13.232
  289    HG2  ARG  41           HG2      ARG  41  48.829   0.826 -14.710
  290    HG3  ARG  41           HG1      ARG  41  47.718   0.960 -13.346
  291    HD2  ARG  41           HD2      ARG  41  47.771   3.081 -14.555
  292    HD3  ARG  41           HD1      ARG  41  48.524   3.296 -12.975
  293    HE   ARG  41           HE       ARG  41  50.519   2.614 -14.931
  294   HH11  ARG  41          HH21      ARG  41  48.431   5.146 -13.857
  295   HH12  ARG  41          HH22      ARG  41  49.476   6.412 -14.409
  296   HH21  ARG  41          HH11      ARG  41  51.881   4.252 -15.654
  297   HH22  ARG  41          HH12      ARG  41  51.425   5.907 -15.425
  298    H    ASP  42           HN       ASP  42  51.288  -2.559 -12.928
  299    HA   ASP  42           HA       ASP  42  53.102  -3.519 -11.820
  300    HB2  ASP  42           HB2      ASP  42  54.040  -1.338 -12.706
  301    HB3  ASP  42           HB1      ASP  42  53.801  -0.665 -11.093
  302    H    GLY  43           HN       GLY  43  50.738  -3.428 -10.299
  303    HA2  GLY  43           HA2      GLY  43  50.282  -4.152  -8.080
  304    HA3  GLY  43           HA1      GLY  43  51.902  -3.634  -7.601
  305    H    ILE  44           HN       ILE  44  50.429  -1.220  -9.427
  306    HA   ILE  44           HA       ILE  44  49.642   0.239  -6.927
  307    HB   ILE  44           HB       ILE  44  50.423   1.429  -9.592
  308   HG12  ILE  44          HG12      ILE  44  52.328   0.212  -8.691
  309   HG13  ILE  44          HG11      ILE  44  52.586   1.932  -8.403
  310   HG21  ILE  44          HG21      ILE  44  49.056   2.892  -8.177
  311   HG22  ILE  44          HG22      ILE  44  50.725   3.460  -8.147
  312   HG23  ILE  44          HG23      ILE  44  50.082   2.545  -6.785
  313   HD11  ILE  44          HD11      ILE  44  53.137   0.987  -6.320
  314   HD12  ILE  44          HD12      ILE  44  51.868  -0.231  -6.426
  315   HD13  ILE  44          HD13      ILE  44  51.449   1.448  -6.075
  316    HA   PRO  45           HA       PRO  45  45.534  -0.502  -8.809
  317    HB2  PRO  45           HB2      PRO  45  44.801   0.926  -6.287
  318    HB3  PRO  45           HB1      PRO  45  44.133  -0.568  -6.969
  319    HG2  PRO  45           HG2      PRO  45  45.786  -0.619  -4.882
  320    HG3  PRO  45           HG1      PRO  45  45.847  -1.870  -6.139
  321    HD2  PRO  45           HD2      PRO  45  47.716   0.414  -5.666
  322    HD3  PRO  45           HD1      PRO  45  48.047  -1.214  -6.284
  323    H    VAL  46           HN       VAL  46  44.317   0.900 -10.043
  324    HA   VAL  46           HA       VAL  46  45.114   3.766  -9.995
  325    HB   VAL  46           HB       VAL  46  43.473   2.213 -12.013
  326   HG11  VAL  46          HG11      VAL  46  42.885   4.503 -12.222
  327   HG12  VAL  46          HG12      VAL  46  44.154   4.269 -13.423
  328   HG13  VAL  46          HG13      VAL  46  44.527   5.044 -11.884
  329   HG21  VAL  46          HG21      VAL  46  45.758   1.398 -11.979
  330   HG22  VAL  46          HG22      VAL  46  46.391   3.043 -11.931
  331   HG23  VAL  46          HG23      VAL  46  45.582   2.451 -13.382
  332    H    LEU  47           HN       LEU  47  43.851   5.149  -8.945
  333    HA   LEU  47           HA       LEU  47  40.995   4.446  -8.408
  334    HB2  LEU  47           HB2      LEU  47  42.745   6.573  -7.131
  335    HB3  LEU  47           HB1      LEU  47  41.132   6.084  -6.599
  336    HG   LEU  47           HG       LEU  47  43.574   4.282  -6.682
  337   HD11  LEU  47          HD11      LEU  47  43.322   4.354  -4.186
  338   HD12  LEU  47          HD12      LEU  47  42.112   5.620  -4.390
  339   HD13  LEU  47          HD13      LEU  47  43.778   5.904  -4.892
  340   HD21  LEU  47          HD21      LEU  47  41.886   2.878  -5.206
  341   HD22  LEU  47          HD22      LEU  47  41.768   2.815  -6.962
  342   HD23  LEU  47          HD23      LEU  47  40.660   3.836  -6.044
  343    H    LEU  48           HN       LEU  48  41.906   5.415 -10.989
  344    HA   LEU  48           HA       LEU  48  40.707   8.164 -11.054
  345    HB2  LEU  48           HB2      LEU  48  42.415   6.787 -13.141
  346    HB3  LEU  48           HB1      LEU  48  41.872   8.465 -13.172
  347    HG   LEU  48           HG       LEU  48  43.667   7.243 -11.055
  348   HD11  LEU  48          HD11      LEU  48  44.221   9.063 -13.411
  349   HD12  LEU  48          HD12      LEU  48  44.905   7.466 -13.106
  350   HD13  LEU  48          HD13      LEU  48  45.355   8.829 -12.082
  351   HD21  LEU  48          HD21      LEU  48  42.399   9.957 -11.417
  352   HD22  LEU  48          HD22      LEU  48  43.958   9.823 -10.600
  353   HD23  LEU  48          HD23      LEU  48  42.550   8.988  -9.951
  354    H    VAL  49           HN       VAL  49  38.794   8.393 -11.954
  355    HA   VAL  49           HA       VAL  49  37.235   6.178 -12.900
  356    HB   VAL  49           HB       VAL  49  36.821   9.162 -13.188
  357   HG11  VAL  49          HG11      VAL  49  35.454   8.154 -14.852
  358   HG12  VAL  49          HG12      VAL  49  34.382   8.380 -13.470
  359   HG13  VAL  49          HG13      VAL  49  35.058   6.787 -13.811
  360   HG21  VAL  49          HG21      VAL  49  35.145   8.691 -11.336
  361   HG22  VAL  49          HG22      VAL  49  36.837   8.520 -10.869
  362   HG23  VAL  49          HG23      VAL  49  35.866   7.087 -11.199
  363    H    ASP  50           HN       ASP  50  38.987   8.771 -14.544
  364    HA   ASP  50           HA       ASP  50  38.101   8.271 -17.193
  365    HB2  ASP  50           HB2      ASP  50  39.443  10.248 -16.547
  366    HB3  ASP  50           HB1      ASP  50  40.832   9.199 -16.267
  367    H    GLU  51           HN       GLU  51  40.739   6.787 -15.342
  368    HA   GLU  51           HA       GLU  51  41.444   5.044 -17.632
  369    HB2  GLU  51           HB2      GLU  51  42.511   5.183 -14.795
  370    HB3  GLU  51           HB1      GLU  51  43.195   4.190 -16.083
  371    HG2  GLU  51           HG2      GLU  51  42.930   7.213 -16.185
  372    HG3  GLU  51           HG1      GLU  51  44.417   6.347 -15.802
  373    H    ALA  52           HN       ALA  52  39.215   5.056 -15.117
  374    HA   ALA  52           HA       ALA  52  39.236   2.271 -14.363
  375    HB1  ALA  52           HB1      ALA  52  37.014   2.712 -13.437
  376    HB2  ALA  52           HB2      ALA  52  36.928   4.234 -14.329
  377    HB3  ALA  52           HB3      ALA  52  38.112   4.034 -13.038
  378    H    ARG  53           HN       ARG  53  38.001   0.553 -15.145
  379    HA   ARG  53           HA       ARG  53  36.955   0.928 -17.926
  380    HB2  ARG  53           HB2      ARG  53  37.809  -1.550 -16.419
  381    HB3  ARG  53           HB1      ARG  53  37.192  -1.542 -18.073
  382    HG2  ARG  53           HG2      ARG  53  39.037  -0.086 -18.779
  383    HG3  ARG  53           HG1      ARG  53  39.644  -0.030 -17.122
  384    HD2  ARG  53           HD2      ARG  53  40.923  -1.684 -18.369
  385    HD3  ARG  53           HD1      ARG  53  39.913  -2.518 -17.189
  386    HE   ARG  53           HE       ARG  53  38.610  -3.402 -18.979
  387   HH11  ARG  53          HH21      ARG  53  40.854  -0.990 -20.021
  388   HH12  ARG  53          HH22      ARG  53  40.636  -1.335 -21.703
  389   HH21  ARG  53          HH11      ARG  53  38.324  -3.858 -21.162
  390   HH22  ARG  53          HH12      ARG  53  39.206  -2.955 -22.349
  391    H    ARG  54           HN       ARG  54  34.873   0.540 -18.398
  392    HA   ARG  54           HA       ARG  54  33.054   0.015 -16.134
  393    HB2  ARG  54           HB2      ARG  54  31.336   0.509 -18.126
  394    HB3  ARG  54           HB1      ARG  54  32.173   1.821 -17.294
  395    HG2  ARG  54           HG2      ARG  54  33.580   0.582 -19.632
  396    HG3  ARG  54           HG1      ARG  54  32.186   1.608 -19.977
  397    HD2  ARG  54           HD2      ARG  54  33.171   3.455 -18.759
  398    HD3  ARG  54           HD1      ARG  54  34.524   2.449 -18.242
  399    HE   ARG  54           HE       ARG  54  34.240   2.590 -21.140
  400   HH11  ARG  54          HH21      ARG  54  35.495   4.033 -18.266
  401   HH12  ARG  54          HH22      ARG  54  36.771   4.866 -19.091
  402   HH21  ARG  54          HH11      ARG  54  35.888   3.665 -22.220
  403   HH22  ARG  54          HH12      ARG  54  36.992   4.657 -21.328
  404    HA   PRO  55           HA       PRO  55  32.039  -4.188 -17.051
  405    HB2  PRO  55           HB2      PRO  55  29.214  -3.306 -17.506
  406    HB3  PRO  55           HB1      PRO  55  29.837  -4.583 -16.448
  407    HG2  PRO  55           HG2      PRO  55  29.019  -2.179 -15.516
  408    HG3  PRO  55           HG1      PRO  55  30.304  -3.124 -14.743
  409    HD2  PRO  55           HD2      PRO  55  30.517  -0.619 -16.308
  410    HD3  PRO  55           HD1      PRO  55  31.639  -1.322 -15.127
  411    H    GLU  56           HN       GLU  56  32.116  -5.417 -18.854
  412    HA   GLU  56           HA       GLU  56  32.330  -5.865 -21.152
  413    HB2  GLU  56           HB2      GLU  56  29.559  -4.636 -21.022
  414    HB3  GLU  56           HB1      GLU  56  30.178  -5.577 -22.380
  415    HG2  GLU  56           HG2      GLU  56  29.970  -6.605 -19.534
  416    HG3  GLU  56           HG1      GLU  56  28.799  -6.949 -20.807
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1  36.595  11.066  21.258
    2    H2   MET   1           HT2      MET   1  36.284  10.353  22.769
    3    H3   MET   1           HT3      MET   1  35.486   9.789  21.379
    4    HA   MET   1           HA       MET   1  38.412   9.726  21.394
    5    HB2  MET   1           HB2      MET   1  38.223   7.418  22.458
    6    HB3  MET   1           HB1      MET   1  37.993   8.778  23.555
    7    HG2  MET   1           HG2      MET   1  35.604   8.525  23.504
    8    HG3  MET   1           HG1      MET   1  35.696   7.363  22.180
    9    HE1  MET   1           HE1      MET   1  34.424   7.071  25.525
   10    HE2  MET   1           HE2      MET   1  34.381   5.343  25.183
   11    HE3  MET   1           HE3      MET   1  33.974   6.496  23.914
   12    HA   PRO   2           HA       PRO   2  35.773   7.777  17.954
   13    HB2  PRO   2           HB2      PRO   2  36.740   9.386  15.910
   14    HB3  PRO   2           HB1      PRO   2  35.257   9.716  16.826
   15    HG2  PRO   2           HG2      PRO   2  37.983  10.885  17.157
   16    HG3  PRO   2           HG1      PRO   2  36.396  11.666  17.288
   17    HD2  PRO   2           HD2      PRO   2  37.853  10.950  19.482
   18    HD3  PRO   2           HD1      PRO   2  36.075  10.950  19.480
   19    H    LEU   3           HN       LEU   3  36.591   6.274  16.491
   20    HA   LEU   3           HA       LEU   3  39.462   5.638  16.786
   21    HB2  LEU   3           HB2      LEU   3  38.539   3.627  15.227
   22    HB3  LEU   3           HB1      LEU   3  38.323   3.633  16.975
   23    HG   LEU   3           HG       LEU   3  36.080   4.610  16.722
   24   HD11  LEU   3          HD11      LEU   3  36.142   5.954  14.786
   25   HD12  LEU   3          HD12      LEU   3  35.191   4.574  14.252
   26   HD13  LEU   3          HD13      LEU   3  36.895   4.691  13.816
   27   HD21  LEU   3          HD21      LEU   3  36.490   2.228  14.888
   28   HD22  LEU   3          HD22      LEU   3  34.994   2.667  15.714
   29   HD23  LEU   3          HD23      LEU   3  36.394   2.140  16.647
   30    H    GLU   4           HN       GLU   4  40.843   5.315  14.972
   31    HA   GLU   4           HA       GLU   4  40.305   7.160  12.741
   32    HB2  GLU   4           HB2      GLU   4  42.631   6.577  12.067
   33    HB3  GLU   4           HB1      GLU   4  42.547   7.103  13.749
   34    HG2  GLU   4           HG2      GLU   4  42.480   4.733  14.475
   35    HG3  GLU   4           HG1      GLU   4  42.615   4.224  12.792
   36    H    ALA   5           HN       ALA   5  38.992   4.369  13.226
   37    HA   ALA   5           HA       ALA   5  39.810   2.608  11.139
   38    HB1  ALA   5           HB1      ALA   5  37.676   1.509  11.453
   39    HB2  ALA   5           HB2      ALA   5  36.992   2.953  12.199
   40    HB3  ALA   5           HB3      ALA   5  38.247   2.038  13.035
   41    H    GLY   6           HN       GLY   6  39.263   2.493   8.978
   42    HA2  GLY   6           HA2      GLY   6  37.148   3.451   7.546
   43    HA3  GLY   6           HA1      GLY   6  38.111   4.913   7.767
   44    H    LEU   7           HN       LEU   7  37.552   2.552   5.592
   45    HA   LEU   7           HA       LEU   7  38.734   1.706   3.756
   46    HB2  LEU   7           HB2      LEU   7  40.174   4.303   4.317
   47    HB3  LEU   7           HB1      LEU   7  40.634   3.264   2.970
   48    HG   LEU   7           HG       LEU   7  38.350   3.379   2.077
   49   HD11  LEU   7          HD11      LEU   7  36.844   5.180   3.190
   50   HD12  LEU   7          HD12      LEU   7  37.876   4.965   4.603
   51   HD13  LEU   7          HD13      LEU   7  36.953   3.603   3.967
   52   HD21  LEU   7          HD21      LEU   7  38.379   5.723   1.391
   53   HD22  LEU   7          HD22      LEU   7  40.035   5.119   1.462
   54   HD23  LEU   7          HD23      LEU   7  39.412   6.138   2.759
   55    H    LEU   8           HN       LEU   8  39.930   1.585   6.784
   56    HA   LEU   8           HA       LEU   8  42.699   0.970   6.424
   57    HB2  LEU   8           HB2      LEU   8  41.252   1.346   8.600
   58    HB3  LEU   8           HB1      LEU   8  41.004  -0.394   8.512
   59    HG   LEU   8           HG       LEU   8  43.703   0.986   8.563
   60   HD11  LEU   8          HD11      LEU   8  43.825  -0.073  10.848
   61   HD12  LEU   8          HD12      LEU   8  42.116  -0.477  10.688
   62   HD13  LEU   8          HD13      LEU   8  42.625   1.212  10.710
   63   HD21  LEU   8          HD21      LEU   8  44.135  -1.034   7.479
   64   HD22  LEU   8          HD22      LEU   8  42.823  -1.884   8.297
   65   HD23  LEU   8          HD23      LEU   8  44.319  -1.526   9.160
   66    H    GLU   9           HN       GLU   9  39.796  -1.111   6.462
   67    HA   GLU   9           HA       GLU   9  41.437  -3.324   5.249
   68    HB2  GLU   9           HB2      GLU   9  40.492  -3.817   7.509
   69    HB3  GLU   9           HB1      GLU   9  38.877  -3.546   6.854
   70    HG2  GLU   9           HG2      GLU   9  39.195  -5.369   5.244
   71    HG3  GLU   9           HG1      GLU   9  40.840  -5.617   5.828
   72    H    ILE  10           HN       ILE  10  38.082  -2.050   5.339
   73    HA   ILE  10           HA       ILE  10  37.442  -3.386   2.825
   74    HB   ILE  10           HB       ILE  10  35.958  -1.301   4.449
   75   HG12  ILE  10          HG12      ILE  10  35.425  -4.265   4.112
   76   HG13  ILE  10          HG11      ILE  10  36.367  -3.601   5.448
   77   HG21  ILE  10          HG21      ILE  10  35.129  -1.106   2.231
   78   HG22  ILE  10          HG22      ILE  10  33.997  -2.187   3.044
   79   HG23  ILE  10          HG23      ILE  10  35.222  -2.846   1.958
   80   HD11  ILE  10          HD11      ILE  10  33.888  -3.975   5.921
   81   HD12  ILE  10          HD12      ILE  10  33.571  -2.649   4.801
   82   HD13  ILE  10          HD13      ILE  10  34.501  -2.358   6.270
   83    H    LEU  11           HN       LEU  11  37.960  -2.616   0.872
   84    HA   LEU  11           HA       LEU  11  39.051   0.083   0.564
   85    HB2  LEU  11           HB2      LEU  11  38.472  -2.055  -1.505
   86    HB3  LEU  11           HB1      LEU  11  39.458  -0.613  -1.756
   87    HG   LEU  11           HG       LEU  11  40.039  -2.799   0.266
   88   HD11  LEU  11          HD11      LEU  11  41.858  -3.432  -1.226
   89   HD12  LEU  11          HD12      LEU  11  41.444  -2.124  -2.334
   90   HD13  LEU  11          HD13      LEU  11  40.336  -3.479  -2.115
   91   HD21  LEU  11          HD21      LEU  11  41.049  -0.894   1.176
   92   HD22  LEU  11          HD22      LEU  11  41.334  -0.159  -0.402
   93   HD23  LEU  11          HD23      LEU  11  42.343  -1.498   0.145
   94    H    ALA  12           HN       ALA  12  38.173   1.679  -0.872
   95    HA   ALA  12           HA       ALA  12  35.308   1.317  -1.649
   96    HB1  ALA  12           HB1      ALA  12  34.732   3.502  -0.748
   97    HB2  ALA  12           HB2      ALA  12  36.399   3.770  -0.240
   98    HB3  ALA  12           HB3      ALA  12  35.428   2.524   0.543
   99    H    CYS  13           HN       CYS  13  34.789   2.319  -3.554
  100    HA   CYS  13           HA       CYS  13  37.007   3.155  -5.244
  101    HB2  CYS  13           HB2      CYS  13  34.395   3.805  -6.357
  102    HB3  CYS  13           HB1      CYS  13  35.543   2.589  -6.907
  103    HA   PRO  14           HA       PRO  14  36.607   7.559  -4.764
  104    HB2  PRO  14           HB2      PRO  14  37.069   8.538  -7.265
  105    HB3  PRO  14           HB1      PRO  14  38.331   7.731  -6.313
  106    HG2  PRO  14           HG2      PRO  14  36.714   6.681  -8.584
  107    HG3  PRO  14           HG1      PRO  14  38.406   6.371  -8.165
  108    HD2  PRO  14           HD2      PRO  14  36.279   4.648  -7.597
  109    HD3  PRO  14           HD1      PRO  14  37.860   4.613  -6.789
  110    H    ALA  15           HN       ALA  15  35.365   7.680  -8.049
  111    HA   ALA  15           HA       ALA  15  33.137   9.340  -7.353
  112    HB1  ALA  15           HB1      ALA  15  33.663   7.680  -9.833
  113    HB2  ALA  15           HB2      ALA  15  34.111   9.370  -9.594
  114    HB3  ALA  15           HB3      ALA  15  32.410   8.914  -9.699
  115    H    CYS  16           HN       CYS  16  33.325   5.877  -8.203
  116    HA   CYS  16           HA       CYS  16  30.464   5.549  -7.473
  117    HB2  CYS  16           HB2      CYS  16  30.799   3.224  -8.291
  118    HB3  CYS  16           HB1      CYS  16  31.254   4.418  -9.501
  119    H    HIS  17           HN       HIS  17  31.716   6.306  -5.264
  120    HA   HIS  17           HA       HIS  17  33.190   4.675  -3.626
  121    HB2  HIS  17           HB2      HIS  17  30.730   6.293  -2.929
  122    HB3  HIS  17           HB1      HIS  17  31.749   5.529  -1.708
  123    HD2  HIS  17           HD2      HIS  17  31.589   8.858  -3.460
  124    HE1  HIS  17           HE1      HIS  17  35.667   8.344  -2.486
  125    HE2  HIS  17           HE2      HIS  17  33.922  10.011  -3.269
  126    H    ALA  18           HN       ALA  18  33.017   2.512  -3.476
  127    HA   ALA  18           HA       ALA  18  30.826   1.343  -2.089
  128    HB1  ALA  18           HB1      ALA  18  30.270   1.689  -4.810
  129    HB2  ALA  18           HB2      ALA  18  29.416   0.592  -3.728
  130    HB3  ALA  18           HB3      ALA  18  30.754  -0.001  -4.708
  131    HA   PRO  19           HA       PRO  19  33.685  -1.998  -1.593
  132    HB2  PRO  19           HB2      PRO  19  31.802  -4.127  -2.429
  133    HB3  PRO  19           HB1      PRO  19  32.476  -3.796  -0.826
  134    HG2  PRO  19           HG2      PRO  19  29.897  -3.333  -1.404
  135    HG3  PRO  19           HG1      PRO  19  30.811  -2.298  -0.291
  136    HD2  PRO  19           HD2      PRO  19  30.119  -1.795  -3.177
  137    HD3  PRO  19           HD1      PRO  19  30.049  -0.688  -1.792
  138    H    LEU  20           HN       LEU  20  35.210  -3.281  -2.671
  139    HA   LEU  20           HA       LEU  20  34.777  -3.820  -5.583
  140    HB2  LEU  20           HB2      LEU  20  37.369  -2.803  -4.390
  141    HB3  LEU  20           HB1      LEU  20  37.002  -3.051  -6.096
  142    HG   LEU  20           HG       LEU  20  34.958  -1.350  -5.420
  143   HD11  LEU  20          HD11      LEU  20  37.344  -0.446  -3.782
  144   HD12  LEU  20          HD12      LEU  20  35.868  -1.131  -3.102
  145   HD13  LEU  20          HD13      LEU  20  35.811   0.402  -3.967
  146   HD21  LEU  20          HD21      LEU  20  36.537  -1.086  -7.308
  147   HD22  LEU  20          HD22      LEU  20  37.766  -0.495  -6.189
  148   HD23  LEU  20          HD23      LEU  20  36.291   0.433  -6.450
  149    H    GLU  21           HN       GLU  21  35.953  -5.629  -6.376
  150    HA   GLU  21           HA       GLU  21  37.129  -7.401  -4.245
  151    HB2  GLU  21           HB2      GLU  21  35.360  -8.108  -6.599
  152    HB3  GLU  21           HB1      GLU  21  36.240  -9.307  -5.649
  153    HG2  GLU  21           HG2      GLU  21  34.297  -7.307  -4.467
  154    HG3  GLU  21           HG1      GLU  21  33.863  -8.963  -4.887
  155    H    GLU  22           HN       GLU  22  39.102  -8.193  -4.670
  156    HA   GLU  22           HA       GLU  22  40.488  -7.301  -7.088
  157    HB2  GLU  22           HB2      GLU  22  41.617  -7.246  -4.892
  158    HB3  GLU  22           HB1      GLU  22  41.454  -8.999  -4.776
  159    HG2  GLU  22           HG2      GLU  22  42.845  -9.296  -6.764
  160    HG3  GLU  22           HG1      GLU  22  42.945  -7.550  -6.984
  161    H    ARG  23           HN       ARG  23  40.696  -8.488  -8.909
  162    HA   ARG  23           HA       ARG  23  41.099 -11.340  -8.866
  163    HB2  ARG  23           HB2      ARG  23  38.695 -11.379  -8.336
  164    HB3  ARG  23           HB1      ARG  23  38.359 -10.401  -9.765
  165    HG2  ARG  23           HG2      ARG  23  39.147 -12.147 -11.233
  166    HG3  ARG  23           HG1      ARG  23  39.754 -13.089  -9.871
  167    HD2  ARG  23           HD2      ARG  23  36.836 -12.370 -10.254
  168    HD3  ARG  23           HD1      ARG  23  37.546 -13.897 -10.777
  169    HE   ARG  23           HE       ARG  23  38.226 -13.596  -8.060
  170   HH11  ARG  23          HH21      ARG  23  35.433 -13.838 -10.069
  171   HH12  ARG  23          HH22      ARG  23  34.463 -14.604  -8.855
  172   HH21  ARG  23          HH11      ARG  23  36.978 -14.597  -6.465
  173   HH22  ARG  23          HH12      ARG  23  35.339 -15.033  -6.815
  174    H    ASP  24           HN       ASP  24  41.392 -12.199 -11.033
  175    HA   ASP  24           HA       ASP  24  42.250 -12.017 -13.204
  176    HB2  ASP  24           HB2      ASP  24  39.842 -11.281 -13.539
  177    HB3  ASP  24           HB1      ASP  24  40.413  -9.620 -13.434
  178    H    ALA  25           HN       ALA  25  43.400 -10.401 -10.916
  179    HA   ALA  25           HA       ALA  25  45.264  -8.996 -10.698
  180    HB1  ALA  25           HB1      ALA  25  46.659  -8.674 -12.528
  181    HB2  ALA  25           HB2      ALA  25  45.321  -8.415 -13.648
  182    HB3  ALA  25           HB3      ALA  25  45.709 -10.044 -13.097
  183    H    GLU  26           HN       GLU  26  42.294  -8.108 -11.200
  184    HA   GLU  26           HA       GLU  26  42.955  -5.198 -11.152
  185    HB2  GLU  26           HB2      GLU  26  40.788  -4.902 -12.587
  186    HB3  GLU  26           HB1      GLU  26  42.293  -5.328 -13.400
  187    HG2  GLU  26           HG2      GLU  26  41.665  -7.670 -13.443
  188    HG3  GLU  26           HG1      GLU  26  40.204  -7.333 -12.514
  189    H    LEU  27           HN       LEU  27  41.050  -3.918 -10.334
  190    HA   LEU  27           HA       LEU  27  39.640  -5.505  -8.225
  191    HB2  LEU  27           HB2      LEU  27  39.855  -2.496  -8.433
  192    HB3  LEU  27           HB1      LEU  27  39.438  -3.454  -7.012
  193    HG   LEU  27           HG       LEU  27  42.129  -3.342  -8.407
  194   HD11  LEU  27          HD11      LEU  27  41.776  -1.459  -6.942
  195   HD12  LEU  27          HD12      LEU  27  42.853  -2.588  -6.117
  196   HD13  LEU  27          HD13      LEU  27  41.151  -2.505  -5.667
  197   HD21  LEU  27          HD21      LEU  27  41.922  -5.601  -7.753
  198   HD22  LEU  27          HD22      LEU  27  41.041  -5.190  -6.280
  199   HD23  LEU  27          HD23      LEU  27  42.768  -4.854  -6.400
  200    H    ILE  28           HN       ILE  28  37.601  -6.035  -8.657
  201    HA   ILE  28           HA       ILE  28  36.103  -4.505 -10.723
  202    HB   ILE  28           HB       ILE  28  35.534  -7.166  -9.394
  203   HG12  ILE  28          HG12      ILE  28  36.299  -6.535 -12.258
  204   HG13  ILE  28          HG11      ILE  28  37.483  -6.971 -11.027
  205   HG21  ILE  28          HG21      ILE  28  33.837  -7.302 -11.306
  206   HG22  ILE  28          HG22      ILE  28  34.067  -5.564 -11.504
  207   HG23  ILE  28          HG23      ILE  28  33.426  -6.202  -9.991
  208   HD11  ILE  28          HD11      ILE  28  35.097  -8.673 -11.795
  209   HD12  ILE  28          HD12      ILE  28  36.377  -9.110 -10.662
  210   HD13  ILE  28          HD13      ILE  28  36.742  -8.928 -12.378
  211    H    CYS  29           HN       CYS  29  34.456  -3.185 -10.184
  212    HA   CYS  29           HA       CYS  29  33.948  -2.618  -7.379
  213    HB2  CYS  29           HB2      CYS  29  32.976  -1.575 -10.008
  214    HB3  CYS  29           HB1      CYS  29  32.058  -1.188  -8.572
  215    H    THR  30           HN       THR  30  32.087  -3.149  -6.170
  216    HA   THR  30           HA       THR  30  29.902  -4.642  -7.544
  217    HB   THR  30           HB       THR  30  31.148  -6.532  -6.932
  218    HG1  THR  30           HG1      THR  30  29.852  -6.176  -4.477
  219   HG21  THR  30          HG21      THR  30  32.039  -4.820  -4.634
  220   HG22  THR  30          HG22      THR  30  33.007  -5.780  -5.750
  221   HG23  THR  30          HG23      THR  30  32.096  -6.572  -4.463
  222    H    GLY  31           HN       GLY  31  28.249  -3.294  -6.955
  223    HA2  GLY  31           HA2      GLY  31  27.477  -3.159  -4.155
  224    HA3  GLY  31           HA1      GLY  31  28.044  -1.603  -4.765
  225    H    GLN  32           HN       GLN  32  25.773  -0.921  -4.326
  226    HA   GLN  32           HA       GLN  32  23.525  -2.024  -5.696
  227    HB2  GLN  32           HB2      GLN  32  24.071   0.776  -4.678
  228    HB3  GLN  32           HB1      GLN  32  22.501   0.244  -5.282
  229    HG2  GLN  32           HG2      GLN  32  22.411  -1.510  -3.574
  230    HG3  GLN  32           HG1      GLN  32  24.010  -1.045  -2.991
  231   HE21  GLN  32          HE21      GLN  32  22.370  -0.820  -0.964
  232   HE22  GLN  32          HE22      GLN  32  21.773   0.752  -0.726
  233    H    ASP  33           HN       ASP  33  25.472   0.867  -6.529
  234    HA   ASP  33           HA       ASP  33  24.518   0.597  -9.367
  235    HB2  ASP  33           HB2      ASP  33  25.161   3.021  -9.550
  236    HB3  ASP  33           HB1      ASP  33  23.850   2.726  -8.407
  237    H    CYS  34           HN       CYS  34  27.000  -0.316  -7.541
  238    HA   CYS  34           HA       CYS  34  29.206   0.710  -9.198
  239    HB2  CYS  34           HB2      CYS  34  28.933  -0.372  -6.573
  240    HB3  CYS  34           HB1      CYS  34  30.022  -1.448  -7.444
  241    H    GLY  35           HN       GLY  35  30.750  -0.839 -10.176
  242    HA2  GLY  35           HA2      GLY  35  30.354  -3.529 -10.770
  243    HA3  GLY  35           HA1      GLY  35  29.365  -2.666 -11.951
  244    H    LEU  36           HN       LEU  36  31.397  -0.378 -11.712
  245    HA   LEU  36           HA       LEU  36  32.872  -0.848 -14.058
  246    HB2  LEU  36           HB2      LEU  36  33.687   0.896 -11.716
  247    HB3  LEU  36           HB1      LEU  36  34.259   1.055 -13.376
  248    HG   LEU  36           HG       LEU  36  31.380   1.359 -12.468
  249   HD11  LEU  36          HD11      LEU  36  31.702   3.733 -12.951
  250   HD12  LEU  36          HD12      LEU  36  33.363   3.429 -13.459
  251   HD13  LEU  36          HD13      LEU  36  32.903   3.206 -11.771
  252   HD21  LEU  36          HD21      LEU  36  32.733   1.361 -15.164
  253   HD22  LEU  36          HD22      LEU  36  31.311   2.372 -14.910
  254   HD23  LEU  36          HD23      LEU  36  31.201   0.629 -14.687
  255    H    ALA  37           HN       ALA  37  35.420  -0.691 -13.978
  256    HA   ALA  37           HA       ALA  37  36.509  -2.641 -11.992
  257    HB1  ALA  37           HB1      ALA  37  36.752  -2.782 -15.004
  258    HB2  ALA  37           HB2      ALA  37  36.025  -3.985 -13.940
  259    HB3  ALA  37           HB3      ALA  37  37.768  -3.712 -13.901
  260    H    TYR  38           HN       TYR  38  38.564  -2.178 -11.330
  261    HA   TYR  38           HA       TYR  38  39.945   0.124 -12.670
  262    HB2  TYR  38           HB2      TYR  38  39.705  -0.576  -9.743
  263    HB3  TYR  38           HB1      TYR  38  40.889   0.581 -10.354
  264    HD1  TYR  38           HD2      TYR  38  37.274  -0.141  -9.996
  265    HD2  TYR  38           HD1      TYR  38  40.223   2.756 -11.160
  266    HE1  TYR  38           HE2      TYR  38  35.521   1.610 -10.082
  267    HE2  TYR  38           HE1      TYR  38  38.474   4.507 -11.243
  268    HH   TYR  38           HH       TYR  38  35.889   4.592  -9.876
  269    HA   PRO  39           HA       PRO  39  43.053  -3.165 -12.994
  270    HB2  PRO  39           HB2      PRO  39  44.806  -1.916 -14.640
  271    HB3  PRO  39           HB1      PRO  39  43.246  -2.531 -15.225
  272    HG2  PRO  39           HG2      PRO  39  44.025   0.263 -14.509
  273    HG3  PRO  39           HG1      PRO  39  43.052  -0.320 -15.872
  274    HD2  PRO  39           HD2      PRO  39  41.970   0.740 -13.563
  275    HD3  PRO  39           HD1      PRO  39  41.111  -0.409 -14.616
  276    H    VAL  40           HN       VAL  40  45.402  -3.384 -12.438
  277    HA   VAL  40           HA       VAL  40  46.216  -1.391 -10.354
  278    HB   VAL  40           HB       VAL  40  46.886  -4.324 -10.719
  279   HG11  VAL  40          HG11      VAL  40  48.023  -2.231  -8.857
  280   HG12  VAL  40          HG12      VAL  40  48.896  -3.347  -9.906
  281   HG13  VAL  40          HG13      VAL  40  48.076  -3.950  -8.466
  282   HG21  VAL  40          HG21      VAL  40  45.644  -4.653  -8.700
  283   HG22  VAL  40          HG22      VAL  40  44.652  -3.600  -9.709
  284   HG23  VAL  40          HG23      VAL  40  45.583  -2.920  -8.375
  285    H    ARG  41           HN       ARG  41  48.088  -0.253 -10.674
  286    HA   ARG  41           HA       ARG  41  49.681  -0.946 -13.115
  287    HB2  ARG  41           HB2      ARG  41  48.665   1.335 -12.967
  288    HB3  ARG  41           HB1      ARG  41  49.618   1.629 -11.515
  289    HG2  ARG  41           HG2      ARG  41  50.760   2.591 -13.449
  290    HG3  ARG  41           HG1      ARG  41  51.695   1.233 -12.826
  291    HD2  ARG  41           HD2      ARG  41  49.677   0.648 -14.968
  292    HD3  ARG  41           HD1      ARG  41  51.161   1.473 -15.442
  293    HE   ARG  41           HE       ARG  41  51.995  -0.678 -13.858
  294   HH11  ARG  41          HH21      ARG  41  50.133  -0.150 -16.714
  295   HH12  ARG  41          HH22      ARG  41  50.580  -1.657 -17.443
  296   HH21  ARG  41          HH11      ARG  41  52.589  -2.648 -14.794
  297   HH22  ARG  41          HH12      ARG  41  51.969  -3.070 -16.356
  298    H    ASP  42           HN       ASP  42  51.357  -2.255 -12.542
  299    HA   ASP  42           HA       ASP  42  53.236  -3.047 -11.390
  300    HB2  ASP  42           HB2      ASP  42  53.435  -0.064 -10.922
  301    HB3  ASP  42           HB1      ASP  42  54.705  -1.199 -10.460
  302    H    GLY  43           HN       GLY  43  50.775  -3.192  -9.932
  303    HA2  GLY  43           HA2      GLY  43  50.323  -3.988  -7.733
  304    HA3  GLY  43           HA1      GLY  43  51.894  -3.380  -7.216
  305    H    ILE  44           HN       ILE  44  50.380  -0.967  -8.964
  306    HA   ILE  44           HA       ILE  44  49.445   0.358  -6.442
  307    HB   ILE  44           HB       ILE  44  50.129   1.670  -9.077
  308   HG12  ILE  44          HG12      ILE  44  51.863   1.172  -6.632
  309   HG13  ILE  44          HG11      ILE  44  52.095   0.454  -8.226
  310   HG21  ILE  44          HG21      ILE  44  50.180   3.684  -7.773
  311   HG22  ILE  44          HG22      ILE  44  50.096   2.781  -6.261
  312   HG23  ILE  44          HG23      ILE  44  48.693   2.847  -7.327
  313   HD11  ILE  44          HD11      ILE  44  53.613   2.327  -8.030
  314   HD12  ILE  44          HD12      ILE  44  52.309   3.389  -7.500
  315   HD13  ILE  44          HD13      ILE  44  52.334   2.785  -9.156
  316    HA   PRO  45           HA       PRO  45  45.380  -0.585  -8.403
  317    HB2  PRO  45           HB2      PRO  45  44.494   0.988  -6.018
  318    HB3  PRO  45           HB1      PRO  45  43.904  -0.569  -6.624
  319    HG2  PRO  45           HG2      PRO  45  45.469  -0.413  -4.467
  320    HG3  PRO  45           HG1      PRO  45  45.597  -1.760  -5.614
  321    HD2  PRO  45           HD2      PRO  45  47.435   0.569  -5.234
  322    HD3  PRO  45           HD1      PRO  45  47.798  -1.092  -5.761
  323    H    VAL  46           HN       VAL  46  44.095   0.694  -9.733
  324    HA   VAL  46           HA       VAL  46  44.824   3.572  -9.931
  325    HB   VAL  46           HB       VAL  46  43.240   1.738 -11.754
  326   HG11  VAL  46          HG11      VAL  46  43.514   3.721 -13.350
  327   HG12  VAL  46          HG12      VAL  46  43.908   4.681 -11.925
  328   HG13  VAL  46          HG13      VAL  46  42.326   3.915 -12.062
  329   HG21  VAL  46          HG21      VAL  46  45.974   3.031 -12.015
  330   HG22  VAL  46          HG22      VAL  46  45.197   2.026 -13.238
  331   HG23  VAL  46          HG23      VAL  46  45.674   1.324 -11.693
  332    H    LEU  47           HN       LEU  47  43.453   5.146  -9.294
  333    HA   LEU  47           HA       LEU  47  40.605   4.422  -8.653
  334    HB2  LEU  47           HB2      LEU  47  42.436   6.340  -7.174
  335    HB3  LEU  47           HB1      LEU  47  40.753   6.002  -6.768
  336    HG   LEU  47           HG       LEU  47  42.969   3.931  -6.812
  337   HD11  LEU  47          HD11      LEU  47  42.715   3.990  -4.333
  338   HD12  LEU  47          HD12      LEU  47  41.620   5.362  -4.504
  339   HD13  LEU  47          HD13      LEU  47  43.310   5.515  -4.987
  340   HD21  LEU  47          HD21      LEU  47  41.081   2.732  -5.397
  341   HD22  LEU  47          HD22      LEU  47  41.001   2.709  -7.155
  342   HD23  LEU  47          HD23      LEU  47  40.009   3.848  -6.244
  343    H    LEU  48           HN       LEU  48  41.654   5.506 -11.137
  344    HA   LEU  48           HA       LEU  48  40.658   8.334 -11.072
  345    HB2  LEU  48           HB2      LEU  48  42.195   6.894 -13.246
  346    HB3  LEU  48           HB1      LEU  48  41.839   8.616 -13.181
  347    HG   LEU  48           HG       LEU  48  43.511   7.106 -11.151
  348   HD11  LEU  48          HD11      LEU  48  44.425   9.130 -13.208
  349   HD12  LEU  48          HD12      LEU  48  44.485   7.388 -13.489
  350   HD13  LEU  48          HD13      LEU  48  45.430   8.106 -12.181
  351   HD21  LEU  48          HD21      LEU  48  42.614   8.956 -10.002
  352   HD22  LEU  48          HD22      LEU  48  42.625   9.979 -11.438
  353   HD23  LEU  48          HD23      LEU  48  44.136   9.595 -10.615
  354    H    VAL  49           HN       VAL  49  38.771   8.798 -12.032
  355    HA   VAL  49           HA       VAL  49  36.999   6.760 -12.958
  356    HB   VAL  49           HB       VAL  49  36.905   9.760 -13.355
  357   HG11  VAL  49          HG11      VAL  49  35.416   8.754 -14.939
  358   HG12  VAL  49          HG12      VAL  49  34.418   9.272 -13.581
  359   HG13  VAL  49          HG13      VAL  49  34.856   7.572 -13.755
  360   HG21  VAL  49          HG21      VAL  49  35.431   8.046 -11.341
  361   HG22  VAL  49          HG22      VAL  49  35.572   9.805 -11.365
  362   HG23  VAL  49          HG23      VAL  49  36.979   8.812 -10.983
  363    H    ASP  50           HN       ASP  50  38.956   9.165 -14.702
  364    HA   ASP  50           HA       ASP  50  38.025   8.546 -17.320
  365    HB2  ASP  50           HB2      ASP  50  40.660   9.644 -16.317
  366    HB3  ASP  50           HB1      ASP  50  40.282   9.490 -18.034
  367    H    GLU  51           HN       GLU  51  40.626   7.098 -15.376
  368    HA   GLU  51           HA       GLU  51  41.362   5.284 -17.592
  369    HB2  GLU  51           HB2      GLU  51  43.013   6.289 -15.901
  370    HB3  GLU  51           HB1      GLU  51  42.319   5.175 -14.728
  371    HG2  GLU  51           HG2      GLU  51  42.955   3.264 -16.058
  372    HG3  GLU  51           HG1      GLU  51  43.501   4.310 -17.368
  373    H    ALA  52           HN       ALA  52  38.994   5.379 -15.209
  374    HA   ALA  52           HA       ALA  52  38.914   2.701 -14.247
  375    HB1  ALA  52           HB1      ALA  52  36.545   3.122 -13.780
  376    HB2  ALA  52           HB2      ALA  52  36.566   4.522 -14.854
  377    HB3  ALA  52           HB3      ALA  52  37.502   4.540 -13.362
  378    H    ARG  53           HN       ARG  53  37.920   0.829 -15.051
  379    HA   ARG  53           HA       ARG  53  37.224   0.910 -17.970
  380    HB2  ARG  53           HB2      ARG  53  38.191  -1.404 -16.270
  381    HB3  ARG  53           HB1      ARG  53  37.846  -1.473 -17.997
  382    HG2  ARG  53           HG2      ARG  53  39.844   0.484 -16.852
  383    HG3  ARG  53           HG1      ARG  53  40.309  -1.150 -17.318
  384    HD2  ARG  53           HD2      ARG  53  39.378  -0.693 -19.610
  385    HD3  ARG  53           HD1      ARG  53  39.118   0.980 -19.122
  386    HE   ARG  53           HE       ARG  53  41.855   0.068 -18.696
  387   HH11  ARG  53          HH21      ARG  53  39.519   1.426 -20.833
  388   HH12  ARG  53          HH22      ARG  53  40.693   2.208 -21.839
  389   HH21  ARG  53          HH11      ARG  53  43.411   1.083 -19.997
  390   HH22  ARG  53          HH12      ARG  53  42.897   2.012 -21.366
  391    H    ARG  54           HN       ARG  54  35.553  -0.586 -18.670
  392    HA   ARG  54           HA       ARG  54  33.294  -0.540 -16.778
  393    HB2  ARG  54           HB2      ARG  54  32.756  -1.702 -19.440
  394    HB3  ARG  54           HB1      ARG  54  31.983  -0.334 -18.643
  395    HG2  ARG  54           HG2      ARG  54  34.040   1.035 -19.229
  396    HG3  ARG  54           HG1      ARG  54  34.571  -0.325 -20.220
  397    HD2  ARG  54           HD2      ARG  54  31.889   1.046 -20.535
  398    HD3  ARG  54           HD1      ARG  54  33.312   1.425 -21.507
  399    HE   ARG  54           HE       ARG  54  32.819  -1.397 -21.604
  400   HH11  ARG  54          HH21      ARG  54  31.616   1.663 -22.635
  401   HH12  ARG  54          HH22      ARG  54  30.891   1.041 -24.079
  402   HH21  ARG  54          HH11      ARG  54  31.880  -2.232 -23.484
  403   HH22  ARG  54          HH12      ARG  54  31.040  -1.166 -24.559
  404    HA   PRO  55           HA       PRO  55  32.989  -4.846 -15.841
  405    HB2  PRO  55           HB2      PRO  55  30.520  -5.260 -17.469
  406    HB3  PRO  55           HB1      PRO  55  30.771  -5.484 -15.726
  407    HG2  PRO  55           HG2      PRO  55  29.371  -3.418 -16.676
  408    HG3  PRO  55           HG1      PRO  55  30.421  -3.253 -15.255
  409    HD2  PRO  55           HD2      PRO  55  30.917  -2.358 -18.080
  410    HD3  PRO  55           HD1      PRO  55  31.324  -1.554 -16.548
  411    H    GLU  56           HN       GLU  56  33.695  -6.846 -16.617
  412    HA   GLU  56           HA       GLU  56  35.045  -7.083 -19.042
  413    HB2  GLU  56           HB2      GLU  56  35.121  -8.686 -17.089
  414    HB3  GLU  56           HB1      GLU  56  33.597  -9.361 -17.661
  415    HG2  GLU  56           HG2      GLU  56  35.356 -10.738 -18.551
  416    HG3  GLU  56           HG1      GLU  56  34.729  -9.773 -19.889
  Start of MODEL   11
    1    H1   MET   1           HT1      MET   1  41.950 -15.292  12.320
    2    H2   MET   1           HT2      MET   1  42.753 -15.551  10.845
    3    H3   MET   1           HT3      MET   1  41.673 -14.249  11.011
    4    HA   MET   1           HA       MET   1  43.654 -14.091  13.015
    5    HB2  MET   1           HB2      MET   1  44.624 -14.235  10.146
    6    HB3  MET   1           HB1      MET   1  45.588 -13.697  11.521
    7    HG2  MET   1           HG2      MET   1  44.280 -16.426  11.332
    8    HG3  MET   1           HG1      MET   1  45.961 -16.113  10.911
    9    HE1  MET   1           HE1      MET   1  46.907 -13.935  13.449
   10    HE2  MET   1           HE2      MET   1  47.532 -15.005  12.199
   11    HE3  MET   1           HE3      MET   1  47.842 -15.368  13.892
   12    HA   PRO   2           HA       PRO   2  41.543 -10.419  10.893
   13    HB2  PRO   2           HB2      PRO   2  39.887  -9.719  12.972
   14    HB3  PRO   2           HB1      PRO   2  39.418 -10.858  11.695
   15    HG2  PRO   2           HG2      PRO   2  40.431 -11.430  14.451
   16    HG3  PRO   2           HG1      PRO   2  39.106 -12.199  13.554
   17    HD2  PRO   2           HD2      PRO   2  41.560 -13.350  13.755
   18    HD3  PRO   2           HD1      PRO   2  40.542 -13.540  12.308
   19    H    LEU   3           HN       LEU   3  42.184  -8.315  11.235
   20    HA   LEU   3           HA       LEU   3  44.107  -7.870  13.473
   21    HB2  LEU   3           HB2      LEU   3  43.578  -6.163  11.017
   22    HB3  LEU   3           HB1      LEU   3  44.919  -6.004  12.151
   23    HG   LEU   3           HG       LEU   3  44.384  -8.440  10.426
   24   HD11  LEU   3          HD11      LEU   3  46.471  -7.708   9.259
   25   HD12  LEU   3          HD12      LEU   3  46.442  -6.221  10.207
   26   HD13  LEU   3          HD13      LEU   3  45.143  -6.563   9.065
   27   HD21  LEU   3          HD21      LEU   3  46.435  -7.756  12.535
   28   HD22  LEU   3          HD22      LEU   3  46.854  -8.860  11.224
   29   HD23  LEU   3          HD23      LEU   3  45.527  -9.252  12.310
   30    H    GLU   4           HN       GLU   4  43.617  -6.613  15.107
   31    HA   GLU   4           HA       GLU   4  42.381  -5.253  16.544
   32    HB2  GLU   4           HB2      GLU   4  43.330  -3.563  15.007
   33    HB3  GLU   4           HB1      GLU   4  41.900  -3.716  13.980
   34    HG2  GLU   4           HG2      GLU   4  40.461  -3.001  15.832
   35    HG3  GLU   4           HG1      GLU   4  41.858  -2.915  16.904
   36    H    ALA   5           HN       ALA   5  40.653  -6.333  17.279
   37    HA   ALA   5           HA       ALA   5  38.417  -7.184  15.709
   38    HB1  ALA   5           HB1      ALA   5  38.421  -6.639  18.691
   39    HB2  ALA   5           HB2      ALA   5  39.092  -8.101  17.967
   40    HB3  ALA   5           HB3      ALA   5  37.373  -7.749  17.805
   41    H    GLY   6           HN       GLY   6  36.454  -6.264  15.346
   42    HA2  GLY   6           HA2      GLY   6  35.260  -4.083  16.634
   43    HA3  GLY   6           HA1      GLY   6  36.273  -3.388  15.369
   44    H    LEU   7           HN       LEU   7  34.050  -2.701  14.677
   45    HA   LEU   7           HA       LEU   7  32.271  -4.676  13.486
   46    HB2  LEU   7           HB2      LEU   7  30.892  -2.826  12.898
   47    HB3  LEU   7           HB1      LEU   7  31.615  -2.373  14.438
   48    HG   LEU   7           HG       LEU   7  32.558  -1.465  11.690
   49   HD11  LEU   7          HD11      LEU   7  31.795   0.701  12.340
   50   HD12  LEU   7          HD12      LEU   7  31.398   0.135  13.964
   51   HD13  LEU   7          HD13      LEU   7  30.464  -0.432  12.577
   52   HD21  LEU   7          HD21      LEU   7  33.647  -1.045  14.483
   53   HD22  LEU   7          HD22      LEU   7  34.038   0.035  13.151
   54   HD23  LEU   7          HD23      LEU   7  34.507  -1.657  13.070
   55    H    LEU   8           HN       LEU   8  35.217  -3.553  12.592
   56    HA   LEU   8           HA       LEU   8  36.343  -3.250  10.541
   57    HB2  LEU   8           HB2      LEU   8  34.540  -5.581   9.838
   58    HB3  LEU   8           HB1      LEU   8  36.077  -5.178   9.072
   59    HG   LEU   8           HG       LEU   8  35.726  -5.893  12.002
   60   HD11  LEU   8          HD11      LEU   8  36.995  -7.478   9.749
   61   HD12  LEU   8          HD12      LEU   8  35.388  -7.794  10.406
   62   HD13  LEU   8          HD13      LEU   8  36.814  -7.995  11.426
   63   HD21  LEU   8          HD21      LEU   8  37.636  -4.537  11.947
   64   HD22  LEU   8          HD22      LEU   8  38.071  -5.029  10.309
   65   HD23  LEU   8          HD23      LEU   8  38.337  -6.126  11.663
   66    H    GLU   9           HN       GLU   9  35.575  -1.265   9.848
   67    HA   GLU   9           HA       GLU   9  33.074  -0.820   8.543
   68    HB2  GLU   9           HB2      GLU   9  34.500   0.996   9.467
   69    HB3  GLU   9           HB1      GLU   9  35.675   0.704   8.181
   70    HG2  GLU   9           HG2      GLU   9  34.006   1.245   6.482
   71    HG3  GLU   9           HG1      GLU   9  32.770   1.439   7.724
   72    H    ILE  10           HN       ILE  10  32.487  -1.000   6.475
   73    HA   ILE  10           HA       ILE  10  34.061  -2.666   4.685
   74    HB   ILE  10           HB       ILE  10  32.137  -2.664   3.258
   75   HG12  ILE  10          HG12      ILE  10  31.707  -0.226   3.197
   76   HG13  ILE  10          HG11      ILE  10  30.240  -1.095   3.604
   77   HG21  ILE  10          HG21      ILE  10  30.308  -3.211   4.848
   78   HG22  ILE  10          HG22      ILE  10  31.244  -2.484   6.152
   79   HG23  ILE  10          HG23      ILE  10  31.840  -3.930   5.340
   80   HD11  ILE  10          HD11      ILE  10  30.320   0.692   5.156
   81   HD12  ILE  10          HD12      ILE  10  32.032   0.485   5.450
   82   HD13  ILE  10          HD13      ILE  10  30.879  -0.688   6.077
   83    H    LEU  11           HN       LEU  11  34.847  -2.075   2.665
   84    HA   LEU  11           HA       LEU  11  35.943   0.600   2.476
   85    HB2  LEU  11           HB2      LEU  11  35.867  -1.583   0.367
   86    HB3  LEU  11           HB1      LEU  11  36.947  -0.188   0.400
   87    HG   LEU  11           HG       LEU  11  36.850  -2.368   2.507
   88   HD11  LEU  11          HD11      LEU  11  37.806  -3.041   0.274
   89   HD12  LEU  11          HD12      LEU  11  38.969  -3.105   1.599
   90   HD13  LEU  11          HD13      LEU  11  39.001  -1.758   0.460
   91   HD21  LEU  11          HD21      LEU  11  38.386   0.213   2.218
   92   HD22  LEU  11          HD22      LEU  11  39.116  -1.148   3.069
   93   HD23  LEU  11          HD23      LEU  11  37.604  -0.462   3.647
   94    H    ALA  12           HN       ALA  12  35.522   2.157   0.913
   95    HA   ALA  12           HA       ALA  12  32.905   1.900  -0.542
   96    HB1  ALA  12           HB1      ALA  12  33.951   4.219   1.099
   97    HB2  ALA  12           HB2      ALA  12  32.462   3.306   1.347
   98    HB3  ALA  12           HB3      ALA  12  32.623   4.367  -0.051
   99    H    CYS  13           HN       CYS  13  33.097   2.259  -2.603
  100    HA   CYS  13           HA       CYS  13  35.538   2.885  -3.907
  101    HB2  CYS  13           HB2      CYS  13  33.551   3.566  -5.770
  102    HB3  CYS  13           HB1      CYS  13  34.200   1.953  -5.517
  103    HA   PRO  14           HA       PRO  14  35.760   7.281  -3.824
  104    HB2  PRO  14           HB2      PRO  14  36.673   7.858  -6.370
  105    HB3  PRO  14           HB1      PRO  14  37.693   7.145  -5.103
  106    HG2  PRO  14           HG2      PRO  14  36.301   5.801  -7.381
  107    HG3  PRO  14           HG1      PRO  14  37.924   5.520  -6.729
  108    HD2  PRO  14           HD2      PRO  14  35.825   3.895  -6.140
  109    HD3  PRO  14           HD1      PRO  14  37.147   4.194  -4.992
  110    H    ALA  15           HN       ALA  15  34.959   6.929  -7.239
  111    HA   ALA  15           HA       ALA  15  33.085   9.052  -7.317
  112    HB1  ALA  15           HB1      ALA  15  32.297   7.883  -9.458
  113    HB2  ALA  15           HB2      ALA  15  33.481   6.627  -9.094
  114    HB3  ALA  15           HB3      ALA  15  34.012   8.282  -9.390
  115    H    CYS  16           HN       CYS  16  32.581   5.539  -7.055
  116    HA   CYS  16           HA       CYS  16  29.714   6.046  -6.335
  117    HB2  CYS  16           HB2      CYS  16  29.791   3.381  -6.599
  118    HB3  CYS  16           HB1      CYS  16  29.617   4.434  -7.995
  119    H    HIS  17           HN       HIS  17  28.851   4.630  -4.621
  120    HA   HIS  17           HA       HIS  17  30.863   4.213  -2.424
  121    HB2  HIS  17           HB2      HIS  17  29.013   4.684  -0.869
  122    HB3  HIS  17           HB1      HIS  17  29.313   6.046  -1.947
  123    HD2  HIS  17           HD2      HIS  17  26.419   3.678  -0.991
  124    HE1  HIS  17           HE1      HIS  17  25.154   5.816  -4.408
  125    HE2  HIS  17           HE2      HIS  17  24.409   4.267  -2.544
  126    H    ALA  18           HN       ALA  18  31.267   2.104  -2.438
  127    HA   ALA  18           HA       ALA  18  29.345   0.272  -1.487
  128    HB1  ALA  18           HB1      ALA  18  30.058  -0.730  -4.182
  129    HB2  ALA  18           HB2      ALA  18  29.005   0.670  -4.203
  130    HB3  ALA  18           HB3      ALA  18  28.506  -0.786  -3.353
  131    HA   PRO  19           HA       PRO  19  32.925  -2.174  -0.726
  132    HB2  PRO  19           HB2      PRO  19  31.832  -4.685  -1.841
  133    HB3  PRO  19           HB1      PRO  19  32.129  -4.248  -0.148
  134    HG2  PRO  19           HG2      PRO  19  29.640  -4.486  -1.180
  135    HG3  PRO  19           HG1      PRO  19  30.036  -3.357   0.129
  136    HD2  PRO  19           HD2      PRO  19  29.661  -2.792  -2.801
  137    HD3  PRO  19           HD1      PRO  19  29.124  -1.872  -1.380
  138    H    LEU  20           HN       LEU  20  34.776  -3.231  -1.584
  139    HA   LEU  20           HA       LEU  20  34.964  -3.190  -4.586
  140    HB2  LEU  20           HB2      LEU  20  37.130  -2.734  -2.514
  141    HB3  LEU  20           HB1      LEU  20  37.362  -2.735  -4.262
  142    HG   LEU  20           HG       LEU  20  35.478  -0.868  -2.792
  143   HD11  LEU  20          HD11      LEU  20  37.159   0.867  -3.215
  144   HD12  LEU  20          HD12      LEU  20  38.217  -0.321  -3.978
  145   HD13  LEU  20          HD13      LEU  20  37.864  -0.432  -2.251
  146   HD21  LEU  20          HD21      LEU  20  34.668  -0.975  -4.987
  147   HD22  LEU  20          HD22      LEU  20  36.264  -1.271  -5.679
  148   HD23  LEU  20          HD23      LEU  20  35.827   0.339  -5.121
  149    H    GLU  21           HN       GLU  21  35.725  -4.942  -5.611
  150    HA   GLU  21           HA       GLU  21  36.358  -7.350  -3.914
  151    HB2  GLU  21           HB2      GLU  21  34.303  -7.477  -5.347
  152    HB3  GLU  21           HB1      GLU  21  35.336  -7.282  -6.759
  153    HG2  GLU  21           HG2      GLU  21  36.612  -9.290  -6.124
  154    HG3  GLU  21           HG1      GLU  21  35.592  -9.479  -4.698
  155    H    GLU  22           HN       GLU  22  38.330  -8.095  -4.032
  156    HA   GLU  22           HA       GLU  22  40.300  -6.923  -5.828
  157    HB2  GLU  22           HB2      GLU  22  40.506  -9.137  -3.763
  158    HB3  GLU  22           HB1      GLU  22  41.878  -8.469  -4.646
  159    HG2  GLU  22           HG2      GLU  22  41.908  -7.199  -2.674
  160    HG3  GLU  22           HG1      GLU  22  41.006  -6.152  -3.765
  161    H    ARG  23           HN       ARG  23  41.326  -7.856  -7.526
  162    HA   ARG  23           HA       ARG  23  40.660 -10.662  -8.235
  163    HB2  ARG  23           HB2      ARG  23  39.081  -8.836  -9.322
  164    HB3  ARG  23           HB1      ARG  23  40.464  -8.544 -10.371
  165    HG2  ARG  23           HG2      ARG  23  39.381 -10.227 -11.578
  166    HG3  ARG  23           HG1      ARG  23  40.460 -11.201 -10.590
  167    HD2  ARG  23           HD2      ARG  23  38.661 -11.505  -8.911
  168    HD3  ARG  23           HD1      ARG  23  37.582 -10.559  -9.923
  169    HE   ARG  23           HE       ARG  23  38.504 -12.592 -11.586
  170   HH11  ARG  23          HH21      ARG  23  36.898 -12.313  -8.525
  171   HH12  ARG  23          HH22      ARG  23  36.042 -13.810  -8.704
  172   HH21  ARG  23          HH11      ARG  23  37.391 -14.532 -11.813
  173   HH22  ARG  23          HH12      ARG  23  36.321 -15.059 -10.558
  174    H    ASP  24           HN       ASP  24  42.037 -11.467  -9.954
  175    HA   ASP  24           HA       ASP  24  44.727 -11.239  -9.534
  176    HB2  ASP  24           HB2      ASP  24  43.650 -12.916 -11.034
  177    HB3  ASP  24           HB1      ASP  24  43.479 -11.664 -12.267
  178    H    ALA  25           HN       ALA  25  46.023  -9.571  -9.560
  179    HA   ALA  25           HA       ALA  25  46.781  -7.370  -9.985
  180    HB1  ALA  25           HB1      ALA  25  48.075  -8.639 -11.542
  181    HB2  ALA  25           HB2      ALA  25  47.509  -7.215 -12.414
  182    HB3  ALA  25           HB3      ALA  25  46.720  -8.773 -12.662
  183    H    GLU  26           HN       GLU  26  43.913  -7.529  -9.852
  184    HA   GLU  26           HA       GLU  26  43.301  -5.033 -11.251
  185    HB2  GLU  26           HB2      GLU  26  42.835  -6.593 -13.058
  186    HB3  GLU  26           HB1      GLU  26  41.846  -7.587 -11.989
  187    HG2  GLU  26           HG2      GLU  26  40.207  -5.835 -11.744
  188    HG3  GLU  26           HG1      GLU  26  41.248  -4.673 -12.563
  189    H    LEU  27           HN       LEU  27  41.278  -4.127 -10.569
  190    HA   LEU  27           HA       LEU  27  40.095  -5.407  -8.112
  191    HB2  LEU  27           HB2      LEU  27  40.606  -2.454  -8.544
  192    HB3  LEU  27           HB1      LEU  27  39.893  -3.194  -7.120
  193    HG   LEU  27           HG       LEU  27  42.666  -3.844  -8.152
  194   HD11  LEU  27          HD11      LEU  27  42.764  -1.581  -7.418
  195   HD12  LEU  27          HD12      LEU  27  43.347  -2.538  -6.057
  196   HD13  LEU  27          HD13      LEU  27  41.703  -1.900  -6.046
  197   HD21  LEU  27          HD21      LEU  27  42.782  -4.656  -5.659
  198   HD22  LEU  27          HD22      LEU  27  41.974  -5.669  -6.843
  199   HD23  LEU  27          HD23      LEU  27  41.023  -4.665  -5.750
  200    H    ILE  28           HN       ILE  28  37.992  -5.692  -8.237
  201    HA   ILE  28           HA       ILE  28  36.463  -4.249 -10.391
  202    HB   ILE  28           HB       ILE  28  35.853  -6.834  -8.944
  203   HG12  ILE  28          HG12      ILE  28  36.592  -6.337 -11.837
  204   HG13  ILE  28          HG11      ILE  28  37.742  -6.873 -10.611
  205   HG21  ILE  28          HG21      ILE  28  34.405  -5.288 -11.099
  206   HG22  ILE  28          HG22      ILE  28  33.787  -5.740  -9.510
  207   HG23  ILE  28          HG23      ILE  28  34.062  -6.978 -10.733
  208   HD11  ILE  28          HD11      ILE  28  36.120  -8.801 -10.150
  209   HD12  ILE  28          HD12      ILE  28  36.986  -8.866 -11.684
  210   HD13  ILE  28          HD13      ILE  28  35.306  -8.336 -11.640
  211    H    CYS  29           HN       CYS  29  35.067  -2.759  -9.790
  212    HA   CYS  29           HA       CYS  29  34.563  -2.166  -6.993
  213    HB2  CYS  29           HB2      CYS  29  34.656  -0.556  -9.035
  214    HB3  CYS  29           HB1      CYS  29  32.979  -1.032  -9.294
  215    H    THR  30           HN       THR  30  33.103  -3.161  -5.744
  216    HA   THR  30           HA       THR  30  31.077  -4.878  -6.948
  217    HB   THR  30           HB       THR  30  30.979  -4.343  -4.008
  218    HG1  THR  30           HG1      THR  30  33.337  -4.793  -5.330
  219   HG21  THR  30          HG21      THR  30  31.529  -6.938  -5.442
  220   HG22  THR  30          HG22      THR  30  29.906  -6.243  -5.406
  221   HG23  THR  30          HG23      THR  30  30.711  -6.684  -3.900
  222    H    GLY  31           HN       GLY  31  28.858  -4.743  -5.968
  223    HA2  GLY  31           HA2      GLY  31  27.007  -3.411  -5.140
  224    HA3  GLY  31           HA1      GLY  31  27.910  -1.946  -5.526
  225    H    GLN  32           HN       GLN  32  25.205  -2.763  -6.314
  226    HA   GLN  32           HA       GLN  32  25.198  -3.475  -9.122
  227    HB2  GLN  32           HB2      GLN  32  23.097  -2.221  -7.321
  228    HB3  GLN  32           HB1      GLN  32  22.796  -2.689  -8.996
  229    HG2  GLN  32           HG2      GLN  32  23.424  -5.010  -8.477
  230    HG3  GLN  32           HG1      GLN  32  23.752  -4.555  -6.805
  231   HE21  GLN  32          HE21      GLN  32  21.944  -4.239  -5.382
  232   HE22  GLN  32          HE22      GLN  32  20.346  -4.569  -5.846
  233    H    ASP  33           HN       ASP  33  25.124  -0.447  -7.300
  234    HA   ASP  33           HA       ASP  33  24.684   1.220  -9.651
  235    HB2  ASP  33           HB2      ASP  33  25.602   1.853  -6.825
  236    HB3  ASP  33           HB1      ASP  33  25.306   3.083  -8.056
  237    H    CYS  34           HN       CYS  34  27.303  -0.531  -8.565
  238    HA   CYS  34           HA       CYS  34  29.328   1.408  -9.621
  239    HB2  CYS  34           HB2      CYS  34  29.699  -1.230  -8.176
  240    HB3  CYS  34           HB1      CYS  34  30.971  -0.101  -8.622
  241    H    GLY  35           HN       GLY  35  30.565  -1.649  -9.773
  242    HA2  GLY  35           HA2      GLY  35  30.498  -3.338 -11.502
  243    HA3  GLY  35           HA1      GLY  35  29.594  -2.233 -12.539
  244    H    LEU  36           HN       LEU  36  31.802  -0.259 -11.289
  245    HA   LEU  36           HA       LEU  36  33.407  -0.159 -13.678
  246    HB2  LEU  36           HB2      LEU  36  33.980   1.109 -10.982
  247    HB3  LEU  36           HB1      LEU  36  34.645   1.599 -12.540
  248    HG   LEU  36           HG       LEU  36  31.703   1.646 -11.806
  249   HD11  LEU  36          HD11      LEU  36  33.830   3.789 -11.958
  250   HD12  LEU  36          HD12      LEU  36  32.753   3.419 -10.612
  251   HD13  LEU  36          HD13      LEU  36  32.112   4.168 -12.074
  252   HD21  LEU  36          HD21      LEU  36  33.256   2.254 -14.323
  253   HD22  LEU  36          HD22      LEU  36  31.750   3.111 -13.991
  254   HD23  LEU  36          HD23      LEU  36  31.747   1.359 -14.136
  255    H    ALA  37           HN       ALA  37  35.569  -0.638 -13.969
  256    HA   ALA  37           HA       ALA  37  36.771  -2.532 -11.950
  257    HB1  ALA  37           HB1      ALA  37  36.592  -2.714 -14.958
  258    HB2  ALA  37           HB2      ALA  37  36.144  -3.919 -13.752
  259    HB3  ALA  37           HB3      ALA  37  37.844  -3.573 -14.059
  260    H    TYR  38           HN       TYR  38  38.941  -2.364 -11.608
  261    HA   TYR  38           HA       TYR  38  40.363  -0.139 -12.990
  262    HB2  TYR  38           HB2      TYR  38  40.402  -0.743 -10.055
  263    HB3  TYR  38           HB1      TYR  38  41.445   0.422 -10.862
  264    HD1  TYR  38           HD2      TYR  38  37.898  -0.432 -10.138
  265    HD2  TYR  38           HD1      TYR  38  40.649   2.583 -11.477
  266    HE1  TYR  38           HE2      TYR  38  36.100   1.270 -10.005
  267    HE2  TYR  38           HE1      TYR  38  38.853   4.285 -11.340
  268    HH   TYR  38           HH       TYR  38  36.228   4.056  -9.666
  269    HA   PRO  39           HA       PRO  39  43.194  -3.680 -13.342
  270    HB2  PRO  39           HB2      PRO  39  44.783  -2.663 -15.294
  271    HB3  PRO  39           HB1      PRO  39  43.159  -3.293 -15.629
  272    HG2  PRO  39           HG2      PRO  39  44.070  -0.465 -15.353
  273    HG3  PRO  39           HG1      PRO  39  42.889  -1.166 -16.476
  274    HD2  PRO  39           HD2      PRO  39  42.230   0.195 -14.162
  275    HD3  PRO  39           HD1      PRO  39  41.165  -0.982 -14.976
  276    H    VAL  40           HN       VAL  40  45.537  -3.992 -13.054
  277    HA   VAL  40           HA       VAL  40  46.680  -1.895 -11.251
  278    HB   VAL  40           HB       VAL  40  47.264  -4.848 -11.542
  279   HG11  VAL  40          HG11      VAL  40  48.644  -2.655  -9.979
  280   HG12  VAL  40          HG12      VAL  40  49.371  -3.836 -11.068
  281   HG13  VAL  40          HG13      VAL  40  48.752  -4.348  -9.499
  282   HG21  VAL  40          HG21      VAL  40  46.303  -3.276  -9.141
  283   HG22  VAL  40          HG22      VAL  40  46.295  -5.024  -9.361
  284   HG23  VAL  40          HG23      VAL  40  45.190  -4.014 -10.291
  285    H    ARG  41           HN       ARG  41  48.431  -0.816 -11.794
  286    HA   ARG  41           HA       ARG  41  50.003  -1.715 -14.202
  287    HB2  ARG  41           HB2      ARG  41  48.606   0.312 -14.626
  288    HB3  ARG  41           HB1      ARG  41  49.459   1.135 -13.317
  289    HG2  ARG  41           HG2      ARG  41  51.594   0.841 -14.478
  290    HG3  ARG  41           HG1      ARG  41  50.797  -0.080 -15.750
  291    HD2  ARG  41           HD2      ARG  41  51.142   2.222 -16.500
  292    HD3  ARG  41           HD1      ARG  41  49.418   1.913 -16.299
  293    HE   ARG  41           HE       ARG  41  49.393   3.404 -14.439
  294   HH11  ARG  41          HH21      ARG  41  52.600   2.712 -15.561
  295   HH12  ARG  41          HH22      ARG  41  53.327   3.968 -14.616
  296   HH21  ARG  41          HH11      ARG  41  50.341   5.032 -13.220
  297   HH22  ARG  41          HH12      ARG  41  52.054   5.275 -13.295
  298    H    ASP  42           HN       ASP  42  52.075  -2.013 -13.845
  299    HA   ASP  42           HA       ASP  42  54.143  -2.110 -12.774
  300    HB2  ASP  42           HB2      ASP  42  53.201   0.634 -11.916
  301    HB3  ASP  42           HB1      ASP  42  54.806   0.009 -11.557
  302    H    GLY  43           HN       GLY  43  51.762  -3.182 -11.475
  303    HA2  GLY  43           HA2      GLY  43  51.425  -4.373  -9.472
  304    HA3  GLY  43           HA1      GLY  43  52.926  -3.683  -8.851
  305    H    ILE  44           HN       ILE  44  51.023  -1.226 -10.079
  306    HA   ILE  44           HA       ILE  44  50.015  -0.603  -7.356
  307    HB   ILE  44           HB       ILE  44  50.623   1.367  -9.545
  308   HG12  ILE  44          HG12      ILE  44  52.271   0.519  -7.136
  309   HG13  ILE  44          HG11      ILE  44  52.657   0.156  -8.819
  310   HG21  ILE  44          HG21      ILE  44  50.456   2.997  -7.741
  311   HG22  ILE  44          HG22      ILE  44  50.229   1.714  -6.555
  312   HG23  ILE  44          HG23      ILE  44  48.982   2.030  -7.762
  313   HD11  ILE  44          HD11      ILE  44  53.955   2.085  -8.215
  314   HD12  ILE  44          HD12      ILE  44  52.550   2.880  -7.505
  315   HD13  ILE  44          HD13      ILE  44  52.646   2.655  -9.251
  316    HA   PRO  45           HA       PRO  45  45.988  -0.918  -9.333
  317    HB2  PRO  45           HB2      PRO  45  44.474  -0.017  -7.234
  318    HB3  PRO  45           HB1      PRO  45  45.168  -1.648  -7.307
  319    HG2  PRO  45           HG2      PRO  45  46.127   0.754  -5.822
  320    HG3  PRO  45           HG1      PRO  45  46.120  -0.948  -5.330
  321    HD2  PRO  45           HD2      PRO  45  48.340   0.351  -6.247
  322    HD3  PRO  45           HD1      PRO  45  48.096  -1.408  -6.405
  323    H    VAL  46           HN       VAL  46  44.691   0.440 -10.498
  324    HA   VAL  46           HA       VAL  46  45.390   3.325 -10.433
  325    HB   VAL  46           HB       VAL  46  43.633   1.704 -12.304
  326   HG11  VAL  46          HG11      VAL  46  42.798   3.934 -12.348
  327   HG12  VAL  46          HG12      VAL  46  43.904   3.833 -13.719
  328   HG13  VAL  46          HG13      VAL  46  44.416   4.624 -12.229
  329   HG21  VAL  46          HG21      VAL  46  46.136   1.295 -12.330
  330   HG22  VAL  46          HG22      VAL  46  46.337   2.990 -12.773
  331   HG23  VAL  46          HG23      VAL  46  45.476   1.894 -13.853
  332    H    LEU  47           HN       LEU  47  44.166   4.797  -9.474
  333    HA   LEU  47           HA       LEU  47  41.345   4.098  -8.688
  334    HB2  LEU  47           HB2      LEU  47  43.282   5.970  -7.285
  335    HB3  LEU  47           HB1      LEU  47  41.654   5.548  -6.753
  336    HG   LEU  47           HG       LEU  47  43.929   3.573  -7.100
  337   HD11  LEU  47          HD11      LEU  47  43.752   3.443  -4.585
  338   HD12  LEU  47          HD12      LEU  47  42.705   4.860  -4.646
  339   HD13  LEU  47          HD13      LEU  47  44.380   4.977  -5.188
  340   HD21  LEU  47          HD21      LEU  47  42.189   2.200  -5.662
  341   HD22  LEU  47          HD22      LEU  47  41.980   2.307  -7.405
  342   HD23  LEU  47          HD23      LEU  47  41.017   3.331  -6.337
  343    H    LEU  48           HN       LEU  48  42.343   5.339 -11.181
  344    HA   LEU  48           HA       LEU  48  41.274   8.122 -10.909
  345    HB2  LEU  48           HB2      LEU  48  43.007   6.714 -12.930
  346    HB3  LEU  48           HB1      LEU  48  42.104   8.150 -13.417
  347    HG   LEU  48           HG       LEU  48  43.114   9.400 -11.533
  348   HD11  LEU  48          HD11      LEU  48  43.591   7.760  -9.902
  349   HD12  LEU  48          HD12      LEU  48  45.182   8.221 -10.499
  350   HD13  LEU  48          HD13      LEU  48  44.433   6.724 -11.053
  351   HD21  LEU  48          HD21      LEU  48  45.276   8.047 -13.152
  352   HD22  LEU  48          HD22      LEU  48  45.248   9.704 -12.547
  353   HD23  LEU  48          HD23      LEU  48  44.163   9.222 -13.852
  354    H    VAL  49           HN       VAL  49  39.356   8.631 -11.655
  355    HA   VAL  49           HA       VAL  49  37.461   6.661 -12.487
  356    HB   VAL  49           HB       VAL  49  37.362   9.686 -12.726
  357   HG11  VAL  49          HG11      VAL  49  35.710   8.756 -14.198
  358   HG12  VAL  49          HG12      VAL  49  34.858   9.221 -12.724
  359   HG13  VAL  49          HG13      VAL  49  35.260   7.529 -13.015
  360   HG21  VAL  49          HG21      VAL  49  36.226   9.639 -10.612
  361   HG22  VAL  49          HG22      VAL  49  37.659   8.630 -10.416
  362   HG23  VAL  49          HG23      VAL  49  36.080   7.883 -10.656
  363    H    ASP  50           HN       ASP  50  39.276   9.132 -14.281
  364    HA   ASP  50           HA       ASP  50  38.068   8.640 -16.831
  365    HB2  ASP  50           HB2      ASP  50  40.767   9.776 -16.038
  366    HB3  ASP  50           HB1      ASP  50  40.219   9.694 -17.714
  367    H    GLU  51           HN       GLU  51  40.310   6.841 -14.967
  368    HA   GLU  51           HA       GLU  51  41.243   5.289 -17.356
  369    HB2  GLU  51           HB2      GLU  51  42.138   5.197 -14.455
  370    HB3  GLU  51           HB1      GLU  51  42.860   4.291 -15.783
  371    HG2  GLU  51           HG2      GLU  51  42.687   7.315 -15.677
  372    HG3  GLU  51           HG1      GLU  51  44.123   6.384 -15.251
  373    H    ALA  52           HN       ALA  52  38.950   5.240 -14.843
  374    HA   ALA  52           HA       ALA  52  38.756   2.496 -14.176
  375    HB1  ALA  52           HB1      ALA  52  36.556   2.973 -13.411
  376    HB2  ALA  52           HB2      ALA  52  36.353   4.292 -14.564
  377    HB3  ALA  52           HB3      ALA  52  37.450   4.472 -13.198
  378    H    ARG  53           HN       ARG  53  37.748   0.770 -15.095
  379    HA   ARG  53           HA       ARG  53  36.959   1.074 -17.976
  380    HB2  ARG  53           HB2      ARG  53  37.850  -1.368 -16.410
  381    HB3  ARG  53           HB1      ARG  53  37.396  -1.360 -18.116
  382    HG2  ARG  53           HG2      ARG  53  39.191   0.280 -18.578
  383    HG3  ARG  53           HG1      ARG  53  39.669   0.224 -16.881
  384    HD2  ARG  53           HD2      ARG  53  39.620  -2.178 -18.736
  385    HD3  ARG  53           HD1      ARG  53  41.069  -1.262 -18.319
  386    HE   ARG  53           HE       ARG  53  39.894  -2.025 -15.873
  387   HH11  ARG  53          HH21      ARG  53  41.212  -3.493 -18.724
  388   HH12  ARG  53          HH22      ARG  53  41.743  -4.916 -17.889
  389   HH21  ARG  53          HH11      ARG  53  40.583  -3.874 -14.794
  390   HH22  ARG  53          HH12      ARG  53  41.390  -5.129 -15.674
  391    H    ARG  54           HN       ARG  54  35.053   0.214 -18.700
  392    HA   ARG  54           HA       ARG  54  32.934   0.008 -16.709
  393    HB2  ARG  54           HB2      ARG  54  33.050   0.104 -19.718
  394    HB3  ARG  54           HB1      ARG  54  31.558  -0.416 -18.937
  395    HG2  ARG  54           HG2      ARG  54  31.609   2.043 -19.375
  396    HG3  ARG  54           HG1      ARG  54  31.452   1.655 -17.660
  397    HD2  ARG  54           HD2      ARG  54  33.754   2.128 -17.233
  398    HD3  ARG  54           HD1      ARG  54  34.140   2.159 -18.954
  399    HE   ARG  54           HE       ARG  54  32.228   4.178 -18.579
  400   HH11  ARG  54          HH21      ARG  54  35.367   3.329 -17.381
  401   HH12  ARG  54          HH22      ARG  54  35.840   4.973 -17.110
  402   HH21  ARG  54          HH11      ARG  54  32.846   6.313 -18.229
  403   HH22  ARG  54          HH12      ARG  54  34.419   6.656 -17.590
  404    HA   PRO  55           HA       PRO  55  32.798  -4.389 -16.453
  405    HB2  PRO  55           HB2      PRO  55  30.111  -4.800 -16.019
  406    HB3  PRO  55           HB1      PRO  55  31.206  -4.129 -14.793
  407    HG2  PRO  55           HG2      PRO  55  29.326  -2.697 -16.628
  408    HG3  PRO  55           HG1      PRO  55  29.640  -2.428 -14.901
  409    HD2  PRO  55           HD2      PRO  55  30.745  -0.863 -16.815
  410    HD3  PRO  55           HD1      PRO  55  31.590  -1.239 -15.297
  411    H    GLU  56           HN       GLU  56  32.321  -6.241 -17.650
  412    HA   GLU  56           HA       GLU  56  30.464  -6.120 -19.929
  413    HB2  GLU  56           HB2      GLU  56  32.192  -6.675 -21.596
  414    HB3  GLU  56           HB1      GLU  56  32.514  -5.105 -20.862
  415    HG2  GLU  56           HG2      GLU  56  34.107  -6.210 -19.284
  416    HG3  GLU  56           HG1      GLU  56  33.840  -7.736 -20.127
  Start of MODEL   12
    1    H1   MET   1           HT1      MET   1  34.831 -13.524  20.923
    2    H2   MET   1           HT2      MET   1  34.190 -13.480  19.351
    3    H3   MET   1           HT3      MET   1  33.628 -14.630  20.469
    4    HA   MET   1           HA       MET   1  31.958 -13.181  20.773
    5    HB2  MET   1           HB2      MET   1  34.102 -11.622  22.244
    6    HB3  MET   1           HB1      MET   1  32.382 -11.700  22.628
    7    HG2  MET   1           HG2      MET   1  34.280 -14.065  22.699
    8    HG3  MET   1           HG1      MET   1  33.733 -13.167  24.114
    9    HE1  MET   1           HE1      MET   1  33.294 -15.793  24.686
   10    HE2  MET   1           HE2      MET   1  31.573 -16.079  24.923
   11    HE3  MET   1           HE3      MET   1  32.306 -14.603  25.544
   12    HA   PRO   2           HA       PRO   2  33.387 -10.271  17.378
   13    HB2  PRO   2           HB2      PRO   2  30.629 -10.987  16.454
   14    HB3  PRO   2           HB1      PRO   2  32.140 -10.895  15.526
   15    HG2  PRO   2           HG2      PRO   2  31.085 -13.242  16.174
   16    HG3  PRO   2           HG1      PRO   2  32.842 -12.991  16.212
   17    HD2  PRO   2           HD2      PRO   2  30.908 -13.099  18.510
   18    HD3  PRO   2           HD1      PRO   2  32.562 -13.744  18.400
   19    H    LEU   3           HN       LEU   3  32.895  -8.096  17.332
   20    HA   LEU   3           HA       LEU   3  30.598  -7.201  19.023
   21    HB2  LEU   3           HB2      LEU   3  32.902  -6.508  19.734
   22    HB3  LEU   3           HB1      LEU   3  33.059  -5.633  18.213
   23    HG   LEU   3           HG       LEU   3  31.029  -4.309  18.797
   24   HD11  LEU   3          HD11      LEU   3  30.562  -4.452  21.423
   25   HD12  LEU   3          HD12      LEU   3  31.098  -6.114  21.192
   26   HD13  LEU   3          HD13      LEU   3  29.714  -5.498  20.289
   27   HD21  LEU   3          HD21      LEU   3  33.234  -3.398  19.292
   28   HD22  LEU   3          HD22      LEU   3  33.292  -4.279  20.817
   29   HD23  LEU   3          HD23      LEU   3  32.129  -2.972  20.598
   30    H    GLU   4           HN       GLU   4  28.923  -6.338  17.970
   31    HA   GLU   4           HA       GLU   4  29.219  -5.579  15.125
   32    HB2  GLU   4           HB2      GLU   4  26.787  -5.846  16.924
   33    HB3  GLU   4           HB1      GLU   4  26.725  -5.420  15.215
   34    HG2  GLU   4           HG2      GLU   4  26.394  -7.744  15.164
   35    HG3  GLU   4           HG1      GLU   4  28.121  -7.606  14.852
   36    H    ALA   5           HN       ALA   5  29.507  -3.500  14.560
   37    HA   ALA   5           HA       ALA   5  28.092  -1.328  15.802
   38    HB1  ALA   5           HB1      ALA   5  29.881  -0.184  16.914
   39    HB2  ALA   5           HB2      ALA   5  31.079  -1.328  16.308
   40    HB3  ALA   5           HB3      ALA   5  29.905  -1.840  17.521
   41    H    GLY   6           HN       GLY   6  27.931   0.250  14.294
   42    HA2  GLY   6           HA2      GLY   6  29.251  -0.035  11.743
   43    HA3  GLY   6           HA1      GLY   6  28.215   1.310  12.221
   44    H    LEU   7           HN       LEU   7  30.591   0.857  14.540
   45    HA   LEU   7           HA       LEU   7  31.993   3.289  13.675
   46    HB2  LEU   7           HB2      LEU   7  32.086   1.496  16.104
   47    HB3  LEU   7           HB1      LEU   7  33.337   2.714  15.845
   48    HG   LEU   7           HG       LEU   7  31.607   4.470  15.714
   49   HD11  LEU   7          HD11      LEU   7  29.717   3.324  14.838
   50   HD12  LEU   7          HD12      LEU   7  29.264   3.742  16.490
   51   HD13  LEU   7          HD13      LEU   7  29.773   2.098  16.105
   52   HD21  LEU   7          HD21      LEU   7  32.620   3.792  17.916
   53   HD22  LEU   7          HD22      LEU   7  31.233   2.733  18.177
   54   HD23  LEU   7          HD23      LEU   7  31.004   4.479  18.069
   55    H    LEU   8           HN       LEU   8  32.311  -0.032  13.140
   56    HA   LEU   8           HA       LEU   8  35.186  -0.238  13.109
   57    HB2  LEU   8           HB2      LEU   8  33.123  -1.899  11.635
   58    HB3  LEU   8           HB1      LEU   8  34.805  -2.348  11.920
   59    HG   LEU   8           HG       LEU   8  32.764  -1.800  14.094
   60   HD11  LEU   8          HD11      LEU   8  32.163  -3.857  13.042
   61   HD12  LEU   8          HD12      LEU   8  33.075  -4.304  14.484
   62   HD13  LEU   8          HD13      LEU   8  33.848  -4.359  12.900
   63   HD21  LEU   8          HD21      LEU   8  35.696  -2.506  14.093
   64   HD22  LEU   8          HD22      LEU   8  34.672  -3.050  15.420
   65   HD23  LEU   8          HD23      LEU   8  34.838  -1.331  15.089
   66    H    GLU   9           HN       GLU   9  36.602  -0.159  11.369
   67    HA   GLU   9           HA       GLU   9  36.163   1.837   9.422
   68    HB2  GLU   9           HB2      GLU   9  38.395   0.948  10.166
   69    HB3  GLU   9           HB1      GLU   9  38.085  -0.494   9.198
   70    HG2  GLU   9           HG2      GLU   9  39.408   1.007   7.853
   71    HG3  GLU   9           HG1      GLU   9  37.774   1.022   7.196
   72    H    ILE  10           HN       ILE  10  35.406   1.794   7.338
   73    HA   ILE  10           HA       ILE  10  34.638  -0.839   6.164
   74    HB   ILE  10           HB       ILE  10  32.640   0.166   7.218
   75   HG12  ILE  10          HG12      ILE  10  32.497   0.420   4.205
   76   HG13  ILE  10          HG11      ILE  10  32.598  -1.137   5.027
   77   HG21  ILE  10          HG21      ILE  10  32.936   2.417   5.223
   78   HG22  ILE  10          HG22      ILE  10  33.528   2.550   6.878
   79   HG23  ILE  10          HG23      ILE  10  31.809   2.300   6.575
   80   HD11  ILE  10          HD11      ILE  10  30.258  -0.612   4.611
   81   HD12  ILE  10          HD12      ILE  10  30.439   0.957   5.395
   82   HD13  ILE  10          HD13      ILE  10  30.568  -0.523   6.345
   83    H    LEU  11           HN       LEU  11  35.178  -1.015   4.067
   84    HA   LEU  11           HA       LEU  11  36.702   1.071   2.778
   85    HB2  LEU  11           HB2      LEU  11  35.512  -1.463   1.615
   86    HB3  LEU  11           HB1      LEU  11  36.794  -0.491   0.889
   87    HG   LEU  11           HG       LEU  11  36.961  -1.872   3.586
   88   HD11  LEU  11          HD11      LEU  11  38.726  -3.237   2.312
   89   HD12  LEU  11          HD12      LEU  11  38.005  -2.585   0.840
   90   HD13  LEU  11          HD13      LEU  11  37.038  -3.576   1.932
   91   HD21  LEU  11          HD21      LEU  11  39.492  -1.302   3.084
   92   HD22  LEU  11          HD22      LEU  11  38.441  -0.063   3.759
   93   HD23  LEU  11          HD23      LEU  11  38.808  -0.062   2.033
   94    H    ALA  12           HN       ALA  12  36.131   2.324   0.967
   95    HA   ALA  12           HA       ALA  12  33.268   2.278   0.139
   96    HB1  ALA  12           HB1      ALA  12  33.439   4.016   1.861
   97    HB2  ALA  12           HB2      ALA  12  33.222   4.764   0.279
   98    HB3  ALA  12           HB3      ALA  12  34.819   4.732   1.029
   99    H    CYS  13           HN       CYS  13  33.030   2.511  -2.012
  100    HA   CYS  13           HA       CYS  13  35.472   2.880  -3.621
  101    HB2  CYS  13           HB2      CYS  13  33.575   2.504  -5.485
  102    HB3  CYS  13           HB1      CYS  13  34.265   1.166  -4.582
  103    HA   PRO  14           HA       PRO  14  34.687   7.096  -4.717
  104    HB2  PRO  14           HB2      PRO  14  35.558   7.132  -7.339
  105    HB3  PRO  14           HB1      PRO  14  36.644   7.116  -5.937
  106    HG2  PRO  14           HG2      PRO  14  35.786   4.856  -7.688
  107    HG3  PRO  14           HG1      PRO  14  37.382   5.205  -6.999
  108    HD2  PRO  14           HD2      PRO  14  35.725   3.328  -5.928
  109    HD3  PRO  14           HD1      PRO  14  36.837   4.288  -4.925
  110    H    ALA  15           HN       ALA  15  33.031   8.329  -5.570
  111    HA   ALA  15           HA       ALA  15  31.076   8.857  -6.738
  112    HB1  ALA  15           HB1      ALA  15  31.329   6.409  -8.469
  113    HB2  ALA  15           HB2      ALA  15  32.497   7.714  -8.666
  114    HB3  ALA  15           HB3      ALA  15  30.777   8.028  -8.894
  115    H    CYS  16           HN       CYS  16  31.674   5.889  -5.176
  116    HA   CYS  16           HA       CYS  16  28.742   5.519  -4.756
  117    HB2  CYS  16           HB2      CYS  16  29.919   2.923  -4.711
  118    HB3  CYS  16           HB1      CYS  16  28.781   3.544  -5.890
  119    H    HIS  17           HN       HIS  17  28.859   3.411  -3.013
  120    HA   HIS  17           HA       HIS  17  30.770   4.199  -0.865
  121    HB2  HIS  17           HB2      HIS  17  28.600   5.446  -0.573
  122    HB3  HIS  17           HB1      HIS  17  27.785   3.887  -0.427
  123    HD2  HIS  17           HD2      HIS  17  30.419   6.030   1.595
  124    HE1  HIS  17           HE1      HIS  17  29.004   2.929   4.088
  125    HE2  HIS  17           HE2      HIS  17  30.444   5.017   3.997
  126    H    ALA  18           HN       ALA  18  30.296   1.848  -2.721
  127    HA   ALA  18           HA       ALA  18  29.625  -0.271  -0.750
  128    HB1  ALA  18           HB1      ALA  18  30.244  -1.286  -3.386
  129    HB2  ALA  18           HB2      ALA  18  29.143   0.074  -3.529
  130    HB3  ALA  18           HB3      ALA  18  28.698  -1.310  -2.547
  131    HA   PRO  19           HA       PRO  19  33.836  -1.609  -0.499
  132    HB2  PRO  19           HB2      PRO  19  33.664  -4.343  -0.494
  133    HB3  PRO  19           HB1      PRO  19  33.137  -3.330   0.864
  134    HG2  PRO  19           HG2      PRO  19  31.512  -4.699  -1.205
  135    HG3  PRO  19           HG1      PRO  19  31.134  -4.373   0.490
  136    HD2  PRO  19           HD2      PRO  19  30.154  -2.894  -1.673
  137    HD3  PRO  19           HD1      PRO  19  30.197  -2.335   0.006
  138    H    LEU  20           HN       LEU  20  35.500  -3.232  -1.499
  139    HA   LEU  20           HA       LEU  20  35.198  -3.196  -4.481
  140    HB2  LEU  20           HB2      LEU  20  37.694  -3.001  -2.767
  141    HB3  LEU  20           HB1      LEU  20  37.661  -2.995  -4.530
  142    HG   LEU  20           HG       LEU  20  36.245  -0.960  -2.771
  143   HD11  LEU  20          HD11      LEU  20  38.011   0.567  -3.324
  144   HD12  LEU  20          HD12      LEU  20  38.727  -0.569  -4.468
  145   HD13  LEU  20          HD13      LEU  20  38.783  -0.905  -2.737
  146   HD21  LEU  20          HD21      LEU  20  35.070  -0.940  -4.782
  147   HD22  LEU  20          HD22      LEU  20  36.468  -1.406  -5.748
  148   HD23  LEU  20          HD23      LEU  20  36.326   0.239  -5.134
  149    H    GLU  21           HN       GLU  21  35.760  -5.009  -5.624
  150    HA   GLU  21           HA       GLU  21  36.291  -7.473  -3.993
  151    HB2  GLU  21           HB2      GLU  21  34.763  -7.005  -6.558
  152    HB3  GLU  21           HB1      GLU  21  35.332  -8.611  -6.105
  153    HG2  GLU  21           HG2      GLU  21  33.661  -6.878  -4.281
  154    HG3  GLU  21           HG1      GLU  21  32.967  -8.083  -5.359
  155    H    GLU  22           HN       GLU  22  38.367  -7.957  -4.100
  156    HA   GLU  22           HA       GLU  22  40.097  -7.112  -6.254
  157    HB2  GLU  22           HB2      GLU  22  41.769  -8.623  -5.041
  158    HB3  GLU  22           HB1      GLU  22  41.118  -7.271  -4.116
  159    HG2  GLU  22           HG2      GLU  22  39.501  -8.747  -3.029
  160    HG3  GLU  22           HG1      GLU  22  40.042 -10.105  -4.012
  161    H    ARG  23           HN       ARG  23  40.656  -8.218  -8.076
  162    HA   ARG  23           HA       ARG  23  40.151 -11.149  -8.177
  163    HB2  ARG  23           HB2      ARG  23  38.131 -10.035  -9.106
  164    HB3  ARG  23           HB1      ARG  23  39.153  -9.212 -10.287
  165    HG2  ARG  23           HG2      ARG  23  39.866 -11.353 -11.220
  166    HG3  ARG  23           HG1      ARG  23  38.956 -12.224  -9.985
  167    HD2  ARG  23           HD2      ARG  23  37.671 -12.157 -12.071
  168    HD3  ARG  23           HD1      ARG  23  36.858 -11.194 -10.837
  169    HE   ARG  23           HE       ARG  23  38.637  -9.544 -12.386
  170   HH11  ARG  23          HH21      ARG  23  35.626 -11.225 -12.441
  171   HH12  ARG  23          HH22      ARG  23  34.897 -10.153 -13.589
  172   HH21  ARG  23          HH11      ARG  23  37.700  -8.135 -13.882
  173   HH22  ARG  23          HH12      ARG  23  36.072  -8.403 -14.406
  174    H    ASP  24           HN       ASP  24  41.903 -12.115  -8.959
  175    HA   ASP  24           HA       ASP  24  44.039 -12.362  -9.886
  176    HB2  ASP  24           HB2      ASP  24  42.586 -12.483 -11.886
  177    HB3  ASP  24           HB1      ASP  24  42.722 -10.735 -12.079
  178    H    ALA  25           HN       ALA  25  44.172  -9.660 -11.881
  179    HA   ALA  25           HA       ALA  25  45.888  -8.185  -9.910
  180    HB1  ALA  25           HB1      ALA  25  46.104  -8.147 -12.932
  181    HB2  ALA  25           HB2      ALA  25  47.033  -9.241 -11.907
  182    HB3  ALA  25           HB3      ALA  25  47.257  -7.497 -11.765
  183    H    GLU  26           HN       GLU  26  42.995  -7.855 -10.227
  184    HA   GLU  26           HA       GLU  26  43.023  -4.954 -10.759
  185    HB2  GLU  26           HB2      GLU  26  41.134  -5.043 -12.327
  186    HB3  GLU  26           HB1      GLU  26  42.511  -5.934 -12.977
  187    HG2  GLU  26           HG2      GLU  26  41.511  -8.044 -12.139
  188    HG3  GLU  26           HG1      GLU  26  40.109  -7.136 -11.572
  189    H    LEU  27           HN       LEU  27  41.141  -3.882  -9.902
  190    HA   LEU  27           HA       LEU  27  39.670  -5.549  -7.885
  191    HB2  LEU  27           HB2      LEU  27  40.381  -2.604  -7.797
  192    HB3  LEU  27           HB1      LEU  27  39.451  -3.472  -6.578
  193    HG   LEU  27           HG       LEU  27  41.617  -5.100  -6.666
  194   HD11  LEU  27          HD11      LEU  27  42.687  -2.342  -7.350
  195   HD12  LEU  27          HD12      LEU  27  42.784  -3.771  -8.377
  196   HD13  LEU  27          HD13      LEU  27  43.662  -3.722  -6.852
  197   HD21  LEU  27          HD21      LEU  27  42.554  -3.660  -4.770
  198   HD22  LEU  27          HD22      LEU  27  40.879  -4.179  -4.596
  199   HD23  LEU  27          HD23      LEU  27  41.243  -2.532  -5.112
  200    H    ILE  28           HN       ILE  28  37.516  -5.630  -8.050
  201    HA   ILE  28           HA       ILE  28  36.222  -3.916 -10.125
  202    HB   ILE  28           HB       ILE  28  35.159  -6.428  -8.809
  203   HG12  ILE  28          HG12      ILE  28  37.216  -7.013  -9.955
  204   HG13  ILE  28          HG11      ILE  28  35.868  -7.529 -10.963
  205   HG21  ILE  28          HG21      ILE  28  34.423  -4.938 -11.348
  206   HG22  ILE  28          HG22      ILE  28  33.474  -4.977  -9.860
  207   HG23  ILE  28          HG23      ILE  28  33.693  -6.450 -10.805
  208   HD11  ILE  28          HD11      ILE  28  37.284  -6.465 -12.504
  209   HD12  ILE  28          HD12      ILE  28  37.738  -5.202 -11.364
  210   HD13  ILE  28          HD13      ILE  28  36.139  -5.188 -12.103
  211    H    CYS  29           HN       CYS  29  34.791  -2.393  -9.546
  212    HA   CYS  29           HA       CYS  29  34.372  -1.698  -6.813
  213    HB2  CYS  29           HB2      CYS  29  34.148  -0.321  -9.034
  214    HB3  CYS  29           HB1      CYS  29  32.491  -0.872  -8.999
  215    H    THR  30           HN       THR  30  33.166  -2.903  -5.361
  216    HA   THR  30           HA       THR  30  31.339  -4.911  -6.260
  217    HB   THR  30           HB       THR  30  31.286  -3.753  -3.483
  218    HG1  THR  30           HG1      THR  30  33.393  -4.967  -4.832
  219   HG21  THR  30          HG21      THR  30  29.811  -5.646  -3.991
  220   HG22  THR  30          HG22      THR  30  31.097  -6.165  -2.906
  221   HG23  THR  30          HG23      THR  30  31.179  -6.565  -4.616
  222    H    GLY  31           HN       GLY  31  29.129  -4.927  -6.264
  223    HA2  GLY  31           HA2      GLY  31  26.977  -3.903  -5.546
  224    HA3  GLY  31           HA1      GLY  31  27.703  -2.329  -5.831
  225    H    GLN  32           HN       GLN  32  25.301  -3.630  -7.007
  226    HA   GLN  32           HA       GLN  32  25.794  -4.352  -9.736
  227    HB2  GLN  32           HB2      GLN  32  23.355  -3.868 -10.024
  228    HB3  GLN  32           HB1      GLN  32  23.682  -4.909  -8.640
  229    HG2  GLN  32           HG2      GLN  32  23.681  -2.819  -7.197
  230    HG3  GLN  32           HG1      GLN  32  23.081  -1.941  -8.604
  231   HE21  GLN  32          HE21      GLN  32  21.298  -1.821  -6.627
  232   HE22  GLN  32          HE22      GLN  32  20.033  -2.939  -6.813
  233    H    ASP  33           HN       ASP  33  25.018  -1.269  -8.153
  234    HA   ASP  33           HA       ASP  33  25.154   0.178 -10.715
  235    HB2  ASP  33           HB2      ASP  33  24.740   2.180  -9.270
  236    HB3  ASP  33           HB1      ASP  33  23.510   0.931  -9.086
  237    H    CYS  34           HN       CYS  34  27.377  -1.078  -8.640
  238    HA   CYS  34           HA       CYS  34  29.294   1.168  -8.719
  239    HB2  CYS  34           HB2      CYS  34  29.142  -1.528  -7.446
  240    HB3  CYS  34           HB1      CYS  34  30.730  -0.840  -7.684
  241    H    GLY  35           HN       GLY  35  29.915  -2.278  -9.386
  242    HA2  GLY  35           HA2      GLY  35  30.960  -3.309 -11.212
  243    HA3  GLY  35           HA1      GLY  35  30.347  -1.987 -12.205
  244    H    LEU  36           HN       LEU  36  31.691  -0.179 -12.609
  245    HA   LEU  36           HA       LEU  36  33.877   0.467 -13.319
  246    HB2  LEU  36           HB2      LEU  36  33.136   1.148 -10.535
  247    HB3  LEU  36           HB1      LEU  36  34.838   1.401 -10.912
  248    HG   LEU  36           HG       LEU  36  33.375   3.396 -11.367
  249   HD11  LEU  36          HD11      LEU  36  34.711   4.057 -13.107
  250   HD12  LEU  36          HD12      LEU  36  34.350   2.632 -14.077
  251   HD13  LEU  36          HD13      LEU  36  35.539   2.540 -12.785
  252   HD21  LEU  36          HD21      LEU  36  32.319   2.120 -13.852
  253   HD22  LEU  36          HD22      LEU  36  31.601   3.355 -12.825
  254   HD23  LEU  36          HD23      LEU  36  31.545   1.672 -12.336
  255    H    ALA  37           HN       ALA  37  35.467  -0.801 -13.974
  256    HA   ALA  37           HA       ALA  37  36.715  -2.686 -12.032
  257    HB1  ALA  37           HB1      ALA  37  37.806  -3.541 -14.196
  258    HB2  ALA  37           HB2      ALA  37  36.651  -2.508 -15.041
  259    HB3  ALA  37           HB3      ALA  37  36.075  -3.809 -14.004
  260    H    TYR  38           HN       TYR  38  38.575  -2.147 -11.130
  261    HA   TYR  38           HA       TYR  38  40.207   0.030 -12.344
  262    HB2  TYR  38           HB2      TYR  38  40.199  -1.031  -9.518
  263    HB3  TYR  38           HB1      TYR  38  41.144   0.330 -10.113
  264    HD1  TYR  38           HD2      TYR  38  39.866   2.294 -11.203
  265    HD2  TYR  38           HD1      TYR  38  37.991  -0.703  -8.765
  266    HE1  TYR  38           HE2      TYR  38  37.930   3.802 -10.833
  267    HE2  TYR  38           HE1      TYR  38  36.063   0.806  -8.396
  268    HH   TYR  38           HH       TYR  38  35.096   2.725  -8.970
  269    HA   PRO  39           HA       PRO  39  42.880  -3.626 -12.989
  270    HB2  PRO  39           HB2      PRO  39  44.310  -2.664 -15.092
  271    HB3  PRO  39           HB1      PRO  39  42.666  -3.308 -15.273
  272    HG2  PRO  39           HG2      PRO  39  43.596  -0.480 -15.199
  273    HG3  PRO  39           HG1      PRO  39  42.291  -1.217 -16.147
  274    HD2  PRO  39           HD2      PRO  39  41.924   0.245 -13.793
  275    HD3  PRO  39           HD1      PRO  39  40.738  -0.894 -14.472
  276    H    VAL  40           HN       VAL  40  45.218  -3.996 -12.772
  277    HA   VAL  40           HA       VAL  40  46.510  -1.863 -11.142
  278    HB   VAL  40           HB       VAL  40  47.073  -4.817 -11.455
  279   HG11  VAL  40          HG11      VAL  40  48.689  -4.318  -9.515
  280   HG12  VAL  40          HG12      VAL  40  48.561  -2.626  -9.994
  281   HG13  VAL  40          HG13      VAL  40  49.207  -3.815 -11.124
  282   HG21  VAL  40          HG21      VAL  40  46.306  -4.951  -9.166
  283   HG22  VAL  40          HG22      VAL  40  45.087  -4.071 -10.087
  284   HG23  VAL  40          HG23      VAL  40  46.209  -3.194  -9.046
  285    H    ARG  41           HN       ARG  41  48.232  -0.764 -11.898
  286    HA   ARG  41           HA       ARG  41  49.580  -1.782 -14.385
  287    HB2  ARG  41           HB2      ARG  41  48.116   0.273 -14.674
  288    HB3  ARG  41           HB1      ARG  41  49.248   1.125 -13.622
  289    HG2  ARG  41           HG2      ARG  41  51.099   0.561 -15.152
  290    HG3  ARG  41           HG1      ARG  41  49.973  -0.293 -16.205
  291    HD2  ARG  41           HD2      ARG  41  50.325   1.929 -17.112
  292    HD3  ARG  41           HD1      ARG  41  48.687   1.850 -16.463
  293    HE   ARG  41           HE       ARG  41  50.455   2.811 -14.430
  294   HH11  ARG  41          HH21      ARG  41  49.007   3.668 -17.443
  295   HH12  ARG  41          HH22      ARG  41  49.004   5.367 -17.107
  296   HH21  ARG  41          HH11      ARG  41  50.458   5.025 -13.981
  297   HH22  ARG  41          HH12      ARG  41  49.824   6.137 -15.149
  298    H    ASP  42           HN       ASP  42  51.698  -2.135 -14.148
  299    HA   ASP  42           HA       ASP  42  53.839  -2.159 -13.223
  300    HB2  ASP  42           HB2      ASP  42  53.601   0.294 -13.842
  301    HB3  ASP  42           HB1      ASP  42  53.158   0.593 -12.161
  302    H    GLY  43           HN       GLY  43  51.449  -3.014 -11.626
  303    HA2  GLY  43           HA2      GLY  43  51.332  -4.075  -9.518
  304    HA3  GLY  43           HA1      GLY  43  52.861  -3.312  -9.078
  305    H    ILE  44           HN       ILE  44  50.833  -0.974 -10.378
  306    HA   ILE  44           HA       ILE  44  50.002  -0.140  -7.643
  307    HB   ILE  44           HB       ILE  44  50.400   1.630 -10.048
  308   HG12  ILE  44          HG12      ILE  44  52.209   1.030  -7.685
  309   HG13  ILE  44          HG11      ILE  44  52.507   0.545  -9.354
  310   HG21  ILE  44          HG21      ILE  44  50.197   2.251  -7.083
  311   HG22  ILE  44          HG22      ILE  44  48.855   2.418  -8.215
  312   HG23  ILE  44          HG23      ILE  44  50.290   3.423  -8.397
  313   HD11  ILE  44          HD11      ILE  44  52.446   2.977  -9.995
  314   HD12  ILE  44          HD12      ILE  44  53.784   2.552  -8.926
  315   HD13  ILE  44          HD13      ILE  44  52.364   3.371  -8.278
  316    HA   PRO  45           HA       PRO  45  45.843  -0.752  -9.256
  317    HB2  PRO  45           HB2      PRO  45  44.446   0.332  -7.147
  318    HB3  PRO  45           HB1      PRO  45  45.154  -1.293  -7.127
  319    HG2  PRO  45           HG2      PRO  45  46.161   1.225  -5.897
  320    HG3  PRO  45           HG1      PRO  45  46.242  -0.441  -5.296
  321    HD2  PRO  45           HD2      PRO  45  48.364   0.861  -6.471
  322    HD3  PRO  45           HD1      PRO  45  48.176  -0.911  -6.464
  323    H    VAL  46           HN       VAL  46  44.356   0.470 -10.426
  324    HA   VAL  46           HA       VAL  46  44.999   3.337 -10.733
  325    HB   VAL  46           HB       VAL  46  43.048   1.526 -12.183
  326   HG11  VAL  46          HG11      VAL  46  43.098   3.428 -13.861
  327   HG12  VAL  46          HG12      VAL  46  43.878   4.406 -12.618
  328   HG13  VAL  46          HG13      VAL  46  42.247   3.785 -12.359
  329   HG21  VAL  46          HG21      VAL  46  45.663   2.715 -13.139
  330   HG22  VAL  46          HG22      VAL  46  44.702   1.457 -13.918
  331   HG23  VAL  46          HG23      VAL  46  45.555   1.110 -12.414
  332    H    LEU  47           HN       LEU  47  44.042   4.700  -9.322
  333    HA   LEU  47           HA       LEU  47  41.298   4.089  -8.313
  334    HB2  LEU  47           HB2      LEU  47  43.350   6.103  -7.341
  335    HB3  LEU  47           HB1      LEU  47  41.810   5.735  -6.562
  336    HG   LEU  47           HG       LEU  47  44.062   3.754  -7.016
  337   HD11  LEU  47          HD11      LEU  47  44.295   3.859  -4.540
  338   HD12  LEU  47          HD12      LEU  47  43.100   5.156  -4.504
  339   HD13  LEU  47          HD13      LEU  47  44.648   5.404  -5.313
  340   HD21  LEU  47          HD21      LEU  47  41.270   3.525  -5.903
  341   HD22  LEU  47          HD22      LEU  47  42.542   2.496  -5.249
  342   HD23  LEU  47          HD23      LEU  47  42.144   2.418  -6.961
  343    H    LEU  48           HN       LEU  48  42.250   5.353 -10.977
  344    HA   LEU  48           HA       LEU  48  40.751   7.936 -10.757
  345    HB2  LEU  48           HB2      LEU  48  42.606   6.984 -12.954
  346    HB3  LEU  48           HB1      LEU  48  41.886   8.587 -12.809
  347    HG   LEU  48           HG       LEU  48  43.806   7.326 -10.829
  348   HD11  LEU  48          HD11      LEU  48  45.306   9.199 -11.628
  349   HD12  LEU  48          HD12      LEU  48  44.144   9.487 -12.923
  350   HD13  LEU  48          HD13      LEU  48  44.995   7.945 -12.827
  351   HD21  LEU  48          HD21      LEU  48  42.231   9.899 -10.851
  352   HD22  LEU  48          HD22      LEU  48  43.802   9.847 -10.052
  353   HD23  LEU  48          HD23      LEU  48  42.511   8.776  -9.519
  354    H    VAL  49           HN       VAL  49  38.812   8.063 -11.665
  355    HA   VAL  49           HA       VAL  49  37.496   5.813 -12.830
  356    HB   VAL  49           HB       VAL  49  36.815   8.763 -12.887
  357   HG11  VAL  49          HG11      VAL  49  34.469   7.814 -13.313
  358   HG12  VAL  49          HG12      VAL  49  35.276   6.308 -13.750
  359   HG13  VAL  49          HG13      VAL  49  35.591   7.779 -14.673
  360   HG21  VAL  49          HG21      VAL  49  35.157   8.001 -11.125
  361   HG22  VAL  49          HG22      VAL  49  36.847   7.910 -10.630
  362   HG23  VAL  49          HG23      VAL  49  35.990   6.447 -11.112
  363    H    ASP  50           HN       ASP  50  39.003   8.692 -14.260
  364    HA   ASP  50           HA       ASP  50  38.214   8.306 -16.944
  365    HB2  ASP  50           HB2      ASP  50  39.369  10.330 -16.145
  366    HB3  ASP  50           HB1      ASP  50  40.840   9.391 -15.887
  367    H    GLU  51           HN       GLU  51  41.017   6.964 -15.191
  368    HA   GLU  51           HA       GLU  51  41.824   5.411 -17.570
  369    HB2  GLU  51           HB2      GLU  51  42.936   5.567 -14.754
  370    HB3  GLU  51           HB1      GLU  51  43.652   4.623 -16.056
  371    HG2  GLU  51           HG2      GLU  51  43.171   7.614 -16.183
  372    HG3  GLU  51           HG1      GLU  51  44.717   6.873 -15.767
  373    H    ALA  52           HN       ALA  52  39.583   5.070 -15.111
  374    HA   ALA  52           HA       ALA  52  39.938   2.261 -14.511
  375    HB1  ALA  52           HB1      ALA  52  38.704   3.830 -13.028
  376    HB2  ALA  52           HB2      ALA  52  37.759   2.408 -13.450
  377    HB3  ALA  52           HB3      ALA  52  37.438   3.949 -14.246
  378    H    ARG  53           HN       ARG  53  38.484   0.524 -15.205
  379    HA   ARG  53           HA       ARG  53  37.583   0.937 -18.030
  380    HB2  ARG  53           HB2      ARG  53  38.245  -1.559 -16.454
  381    HB3  ARG  53           HB1      ARG  53  37.605  -1.567 -18.098
  382    HG2  ARG  53           HG2      ARG  53  39.526  -0.275 -18.886
  383    HG3  ARG  53           HG1      ARG  53  40.150  -0.160 -17.240
  384    HD2  ARG  53           HD2      ARG  53  41.316  -1.948 -18.429
  385    HD3  ARG  53           HD1      ARG  53  40.310  -2.643 -17.159
  386    HE   ARG  53           HE       ARG  53  38.820  -2.541 -19.602
  387   HH11  ARG  53          HH21      ARG  53  41.451  -4.138 -18.044
  388   HH12  ARG  53          HH22      ARG  53  41.244  -5.617 -18.920
  389   HH21  ARG  53          HH11      ARG  53  38.537  -4.464 -20.752
  390   HH22  ARG  53          HH12      ARG  53  39.594  -5.803 -20.453
  391    H    ARG  54           HN       ARG  54  35.484   0.622 -18.613
  392    HA   ARG  54           HA       ARG  54  33.537   0.401 -16.428
  393    HB2  ARG  54           HB2      ARG  54  33.439   1.225 -19.313
  394    HB3  ARG  54           HB1      ARG  54  31.939   0.748 -18.518
  395    HG2  ARG  54           HG2      ARG  54  32.252   2.428 -16.793
  396    HG3  ARG  54           HG1      ARG  54  33.841   2.844 -17.434
  397    HD2  ARG  54           HD2      ARG  54  32.733   3.489 -19.591
  398    HD3  ARG  54           HD1      ARG  54  31.172   3.227 -18.814
  399    HE   ARG  54           HE       ARG  54  32.940   5.503 -18.386
  400   HH11  ARG  54          HH21      ARG  54  30.500   3.448 -17.059
  401   HH12  ARG  54          HH22      ARG  54  29.907   4.648 -15.959
  402   HH21  ARG  54          HH11      ARG  54  32.176   7.070 -16.958
  403   HH22  ARG  54          HH12      ARG  54  30.856   6.697 -15.902
  404    HA   PRO  55           HA       PRO  55  32.378  -3.853 -16.832
  405    HB2  PRO  55           HB2      PRO  55  29.623  -2.882 -17.540
  406    HB3  PRO  55           HB1      PRO  55  30.117  -4.077 -16.324
  407    HG2  PRO  55           HG2      PRO  55  29.408  -1.570 -15.663
  408    HG3  PRO  55           HG1      PRO  55  30.637  -2.479 -14.765
  409    HD2  PRO  55           HD2      PRO  55  30.997  -0.160 -16.583
  410    HD3  PRO  55           HD1      PRO  55  32.056  -0.770 -15.293
  411    H    GLU  56           HN       GLU  56  32.389  -5.346 -18.468
  412    HA   GLU  56           HA       GLU  56  32.811  -4.646 -21.151
  413    HB2  GLU  56           HB2      GLU  56  32.364  -7.045 -21.645
  414    HB3  GLU  56           HB1      GLU  56  33.426  -6.832 -20.255
  415    HG2  GLU  56           HG2      GLU  56  31.867  -8.450 -19.524
  416    HG3  GLU  56           HG1      GLU  56  31.264  -6.949 -18.830
  Start of MODEL   13
    1    H1   MET   1           HT1      MET   1  53.761   6.890   5.566
    2    H2   MET   1           HT2      MET   1  54.958   6.285   6.608
    3    H3   MET   1           HT3      MET   1  53.600   5.337   6.226
    4    HA   MET   1           HA       MET   1  54.786   6.052   3.817
    5    HB2  MET   1           HB2      MET   1  56.689   5.618   6.039
    6    HB3  MET   1           HB1      MET   1  56.975   4.544   4.668
    7    HG2  MET   1           HG2      MET   1  57.043   6.500   3.158
    8    HG3  MET   1           HG1      MET   1  56.778   7.569   4.536
    9    HE1  MET   1           HE1      MET   1  60.493   7.957   3.291
   10    HE2  MET   1           HE2      MET   1  58.828   8.504   3.107
   11    HE3  MET   1           HE3      MET   1  59.374   7.064   2.253
   12    HA   PRO   2           HA       PRO   2  54.811   1.253   4.482
   13    HB2  PRO   2           HB2      PRO   2  54.006   0.379   6.992
   14    HB3  PRO   2           HB1      PRO   2  55.699   0.598   6.509
   15    HG2  PRO   2           HG2      PRO   2  53.918   2.460   8.027
   16    HG3  PRO   2           HG1      PRO   2  55.610   2.013   8.340
   17    HD2  PRO   2           HD2      PRO   2  55.027   4.334   7.158
   18    HD3  PRO   2           HD1      PRO   2  56.429   3.386   6.627
   19    H    LEU   3           HN       LEU   3  53.024  -0.021   3.956
   20    HA   LEU   3           HA       LEU   3  50.458   1.346   3.903
   21    HB2  LEU   3           HB2      LEU   3  49.824  -1.097   2.975
   22    HB3  LEU   3           HB1      LEU   3  50.678   0.075   1.977
   23    HG   LEU   3           HG       LEU   3  52.328  -1.722   3.740
   24   HD11  LEU   3          HD11      LEU   3  51.084  -2.603   1.119
   25   HD12  LEU   3          HD12      LEU   3  50.738  -3.278   2.711
   26   HD13  LEU   3          HD13      LEU   3  52.340  -3.473   2.001
   27   HD21  LEU   3          HD21      LEU   3  53.144   0.187   2.139
   28   HD22  LEU   3          HD22      LEU   3  52.827  -0.971   0.855
   29   HD23  LEU   3          HD23      LEU   3  53.997  -1.353   2.119
   30    H    GLU   4           HN       GLU   4  48.578   0.718   4.987
   31    HA   GLU   4           HA       GLU   4  48.924  -0.338   7.632
   32    HB2  GLU   4           HB2      GLU   4  46.419   0.181   5.997
   33    HB3  GLU   4           HB1      GLU   4  46.429  -0.197   7.717
   34    HG2  GLU   4           HG2      GLU   4  46.384   2.143   7.747
   35    HG3  GLU   4           HG1      GLU   4  48.106   1.820   7.902
   36    H    ALA   5           HN       ALA   5  48.854  -2.396   8.309
   37    HA   ALA   5           HA       ALA   5  48.369  -4.557   6.380
   38    HB1  ALA   5           HB1      ALA   5  49.092  -6.013   8.229
   39    HB2  ALA   5           HB2      ALA   5  49.052  -4.640   9.334
   40    HB3  ALA   5           HB3      ALA   5  50.227  -4.681   8.020
   41    H    GLY   6           HN       GLY   6  46.488  -2.715   8.511
   42    HA2  GLY   6           HA2      GLY   6  44.248  -4.619   8.228
   43    HA3  GLY   6           HA1      GLY   6  44.735  -4.237   9.878
   44    H    LEU   7           HN       LEU   7  43.129  -2.950  10.617
   45    HA   LEU   7           HA       LEU   7  41.692  -1.128  10.813
   46    HB2  LEU   7           HB2      LEU   7  43.992   0.035   9.235
   47    HB3  LEU   7           HB1      LEU   7  42.589   1.015   9.661
   48    HG   LEU   7           HG       LEU   7  42.921   0.455  12.043
   49   HD11  LEU   7          HD11      LEU   7  45.215  -1.144  10.896
   50   HD12  LEU   7          HD12      LEU   7  43.956  -1.675  12.012
   51   HD13  LEU   7          HD13      LEU   7  45.228  -0.594  12.571
   52   HD21  LEU   7          HD21      LEU   7  45.410   1.522  10.672
   53   HD22  LEU   7          HD22      LEU   7  44.985   1.773  12.366
   54   HD23  LEU   7          HD23      LEU   7  43.985   2.472  11.092
   55    H    LEU   8           HN       LEU   8  39.778  -1.365   9.875
   56    HA   LEU   8           HA       LEU   8  38.141  -1.601   8.214
   57    HB2  LEU   8           HB2      LEU   8  39.767   0.618   6.938
   58    HB3  LEU   8           HB1      LEU   8  38.053   0.282   6.679
   59    HG   LEU   8           HG       LEU   8  39.318   1.078   9.317
   60   HD11  LEU   8          HD11      LEU   8  39.250   2.981   7.854
   61   HD12  LEU   8          HD12      LEU   8  37.896   3.141   8.972
   62   HD13  LEU   8          HD13      LEU   8  37.614   2.587   7.321
   63   HD21  LEU   8          HD21      LEU   8  36.762   1.383   9.854
   64   HD22  LEU   8          HD22      LEU   8  37.463  -0.227   9.935
   65   HD23  LEU   8          HD23      LEU   8  36.525   0.255   8.520
   66    H    GLU   9           HN       GLU   9  38.413  -3.569   7.247
   67    HA   GLU   9           HA       GLU   9  40.513  -3.959   5.216
   68    HB2  GLU   9           HB2      GLU   9  39.679  -5.711   6.935
   69    HB3  GLU   9           HB1      GLU   9  38.278  -5.886   5.881
   70    HG2  GLU   9           HG2      GLU   9  39.857  -7.548   5.188
   71    HG3  GLU   9           HG1      GLU   9  39.915  -6.276   3.970
   72    H    ILE  10           HN       ILE  10  37.305  -2.810   5.344
   73    HA   ILE  10           HA       ILE  10  36.606  -3.717   2.630
   74    HB   ILE  10           HB       ILE  10  35.184  -1.835   4.536
   75   HG12  ILE  10          HG12      ILE  10  35.486  -4.391   5.081
   76   HG13  ILE  10          HG11      ILE  10  33.897  -3.659   5.248
   77   HG21  ILE  10          HG21      ILE  10  34.391  -1.259   2.391
   78   HG22  ILE  10          HG22      ILE  10  33.217  -2.447   2.958
   79   HG23  ILE  10          HG23      ILE  10  34.469  -2.924   1.811
   80   HD11  ILE  10          HD11      ILE  10  34.083  -5.925   3.983
   81   HD12  ILE  10          HD12      ILE  10  34.707  -4.964   2.649
   82   HD13  ILE  10          HD13      ILE  10  33.092  -4.656   3.271
   83    H    LEU  11           HN       LEU  11  37.039  -2.599   0.833
   84    HA   LEU  11           HA       LEU  11  38.074   0.196   1.102
   85    HB2  LEU  11           HB2      LEU  11  38.406  -1.766  -1.181
   86    HB3  LEU  11           HB1      LEU  11  39.220  -0.211  -0.998
   87    HG   LEU  11           HG       LEU  11  39.489  -2.573   0.885
   88   HD11  LEU  11          HD11      LEU  11  41.352  -1.408  -1.200
   89   HD12  LEU  11          HD12      LEU  11  40.628  -3.016  -1.203
   90   HD13  LEU  11          HD13      LEU  11  41.841  -2.597   0.006
   91   HD21  LEU  11          HD21      LEU  11  41.480  -1.057   1.675
   92   HD22  LEU  11          HD22      LEU  11  39.859  -0.683   2.240
   93   HD23  LEU  11          HD23      LEU  11  40.566   0.248   0.918
   94    H    ALA  12           HN       ALA  12  36.925   1.809   0.268
   95    HA   ALA  12           HA       ALA  12  34.417   1.179  -1.169
   96    HB1  ALA  12           HB1      ALA  12  35.525   3.714   0.053
   97    HB2  ALA  12           HB2      ALA  12  34.177   2.737   0.637
   98    HB3  ALA  12           HB3      ALA  12  34.017   3.654  -0.861
   99    H    CYS  13           HN       CYS  13  33.865   2.348  -3.108
  100    HA   CYS  13           HA       CYS  13  35.972   2.305  -5.002
  101    HB2  CYS  13           HB2      CYS  13  33.581   3.873  -5.743
  102    HB3  CYS  13           HB1      CYS  13  34.315   2.508  -6.568
  103    HA   PRO  14           HA       PRO  14  37.841   6.349  -4.857
  104    HB2  PRO  14           HB2      PRO  14  37.340   6.564  -7.806
  105    HB3  PRO  14           HB1      PRO  14  38.861   6.725  -6.908
  106    HG2  PRO  14           HG2      PRO  14  38.285   4.548  -8.364
  107    HG3  PRO  14           HG1      PRO  14  39.228   4.458  -6.865
  108    HD2  PRO  14           HD2      PRO  14  36.400   3.631  -7.362
  109    HD3  PRO  14           HD1      PRO  14  37.593   2.994  -6.206
  110    H    ALA  15           HN       ALA  15  35.039   6.164  -7.080
  111    HA   ALA  15           HA       ALA  15  34.145   8.870  -6.136
  112    HB1  ALA  15           HB1      ALA  15  33.567   7.366  -8.707
  113    HB2  ALA  15           HB2      ALA  15  34.577   8.802  -8.537
  114    HB3  ALA  15           HB3      ALA  15  32.837   8.912  -8.266
  115    H    CYS  16           HN       CYS  16  32.673   5.888  -7.470
  116    HA   CYS  16           HA       CYS  16  30.129   6.342  -6.281
  117    HB2  CYS  16           HB2      CYS  16  30.160   3.625  -6.533
  118    HB3  CYS  16           HB1      CYS  16  29.892   4.716  -7.891
  119    H    HIS  17           HN       HIS  17  29.131   5.025  -4.542
  120    HA   HIS  17           HA       HIS  17  31.058   4.613  -2.288
  121    HB2  HIS  17           HB2      HIS  17  29.278   6.336  -1.987
  122    HB3  HIS  17           HB1      HIS  17  28.065   5.069  -2.185
  123    HD2  HIS  17           HD2      HIS  17  30.552   6.367   0.522
  124    HE1  HIS  17           HE1      HIS  17  28.587   2.991   2.124
  125    HE2  HIS  17           HE2      HIS  17  30.142   4.924   2.654
  126    H    ALA  18           HN       ALA  18  31.593   2.464  -2.365
  127    HA   ALA  18           HA       ALA  18  29.783   0.521  -1.435
  128    HB1  ALA  18           HB1      ALA  18  28.553   0.111  -3.327
  129    HB2  ALA  18           HB2      ALA  18  29.982  -0.742  -3.902
  130    HB3  ALA  18           HB3      ALA  18  29.714   0.939  -4.361
  131    HA   PRO  19           HA       PRO  19  33.602  -1.622  -0.936
  132    HB2  PRO  19           HB2      PRO  19  32.784  -4.276  -1.115
  133    HB3  PRO  19           HB1      PRO  19  32.574  -3.254   0.319
  134    HG2  PRO  19           HG2      PRO  19  30.597  -3.969  -1.787
  135    HG3  PRO  19           HG1      PRO  19  30.364  -3.765  -0.051
  136    HD2  PRO  19           HD2      PRO  19  29.632  -1.859  -1.867
  137    HD3  PRO  19           HD1      PRO  19  30.153  -1.459  -0.215
  138    H    LEU  20           HN       LEU  20  35.250  -2.786  -2.043
  139    HA   LEU  20           HA       LEU  20  34.792  -3.041  -4.992
  140    HB2  LEU  20           HB2      LEU  20  37.347  -2.684  -3.393
  141    HB3  LEU  20           HB1      LEU  20  37.258  -2.816  -5.150
  142    HG   LEU  20           HG       LEU  20  35.891  -0.677  -3.487
  143   HD11  LEU  20          HD11      LEU  20  38.455  -0.628  -3.689
  144   HD12  LEU  20          HD12      LEU  20  37.589   0.822  -4.194
  145   HD13  LEU  20          HD13      LEU  20  38.197  -0.308  -5.405
  146   HD21  LEU  20          HD21      LEU  20  35.821   0.292  -5.992
  147   HD22  LEU  20          HD22      LEU  20  34.563  -0.762  -5.380
  148   HD23  LEU  20          HD23      LEU  20  35.852  -1.415  -6.395
  149    H    GLU  21           HN       GLU  21  35.502  -4.871  -6.083
  150    HA   GLU  21           HA       GLU  21  35.930  -7.281  -4.365
  151    HB2  GLU  21           HB2      GLU  21  33.946  -7.357  -5.829
  152    HB3  GLU  21           HB1      GLU  21  34.965  -7.055  -7.226
  153    HG2  GLU  21           HG2      GLU  21  36.164  -9.143  -6.862
  154    HG3  GLU  21           HG1      GLU  21  35.269  -9.427  -5.368
  155    H    GLU  22           HN       GLU  22  37.849  -8.203  -4.410
  156    HA   GLU  22           HA       GLU  22  40.020  -7.165  -6.027
  157    HB2  GLU  22           HB2      GLU  22  40.301  -8.008  -3.683
  158    HB3  GLU  22           HB1      GLU  22  39.959  -9.634  -4.273
  159    HG2  GLU  22           HG2      GLU  22  42.360  -9.386  -4.182
  160    HG3  GLU  22           HG1      GLU  22  41.901  -9.367  -5.881
  161    H    ARG  23           HN       ARG  23  40.745  -7.918  -7.957
  162    HA   ARG  23           HA       ARG  23  40.008 -10.696  -8.747
  163    HB2  ARG  23           HB2      ARG  23  38.480  -8.716  -9.683
  164    HB3  ARG  23           HB1      ARG  23  39.815  -8.516 -10.805
  165    HG2  ARG  23           HG2      ARG  23  38.496 -10.056 -11.961
  166    HG3  ARG  23           HG1      ARG  23  39.587 -11.135 -11.105
  167    HD2  ARG  23           HD2      ARG  23  37.909 -11.415  -9.308
  168    HD3  ARG  23           HD1      ARG  23  36.821 -10.334 -10.168
  169    HE   ARG  23           HE       ARG  23  36.368 -12.069 -11.712
  170   HH11  ARG  23          HH21      ARG  23  39.041 -12.786  -9.642
  171   HH12  ARG  23          HH22      ARG  23  39.125 -14.450 -10.116
  172   HH21  ARG  23          HH11      ARG  23  36.466 -14.220 -12.331
  173   HH22  ARG  23          HH12      ARG  23  37.664 -15.262 -11.641
  174    H    ASP  24           HN       ASP  24  41.260 -11.396 -10.663
  175    HA   ASP  24           HA       ASP  24  43.960 -11.433 -10.349
  176    HB2  ASP  24           HB2      ASP  24  42.699 -12.713 -12.072
  177    HB3  ASP  24           HB1      ASP  24  42.598 -11.247 -13.049
  178    H    ALA  25           HN       ALA  25  45.106  -9.638  -9.832
  179    HA   ALA  25           HA       ALA  25  45.951  -7.450  -9.954
  180    HB1  ALA  25           HB1      ALA  25  47.195  -7.087 -11.980
  181    HB2  ALA  25           HB2      ALA  25  46.139  -8.167 -12.890
  182    HB3  ALA  25           HB3      ALA  25  47.220  -8.819 -11.657
  183    H    GLU  26           HN       GLU  26  43.101  -7.479 -10.089
  184    HA   GLU  26           HA       GLU  26  42.697  -4.882 -11.381
  185    HB2  GLU  26           HB2      GLU  26  42.294  -6.404 -13.267
  186    HB3  GLU  26           HB1      GLU  26  41.129  -7.307 -12.304
  187    HG2  GLU  26           HG2      GLU  26  39.666  -5.380 -12.148
  188    HG3  GLU  26           HG1      GLU  26  40.863  -4.355 -12.937
  189    H    LEU  27           HN       LEU  27  40.733  -3.864 -10.709
  190    HA   LEU  27           HA       LEU  27  39.434  -5.188  -8.343
  191    HB2  LEU  27           HB2      LEU  27  40.267  -2.336  -8.857
  192    HB3  LEU  27           HB1      LEU  27  39.026  -2.715  -7.663
  193    HG   LEU  27           HG       LEU  27  41.635  -4.227  -7.588
  194   HD11  LEU  27          HD11      LEU  27  42.250  -1.835  -7.716
  195   HD12  LEU  27          HD12      LEU  27  42.595  -2.520  -6.127
  196   HD13  LEU  27          HD13      LEU  27  41.179  -1.496  -6.356
  197   HD21  LEU  27          HD21      LEU  27  39.697  -3.259  -5.456
  198   HD22  LEU  27          HD22      LEU  27  41.109  -4.274  -5.174
  199   HD23  LEU  27          HD23      LEU  27  39.756  -4.889  -6.110
  200    H    ILE  28           HN       ILE  28  37.267  -5.379  -8.386
  201    HA   ILE  28           HA       ILE  28  35.813  -3.906 -10.577
  202    HB   ILE  28           HB       ILE  28  35.311  -6.667  -9.463
  203   HG12  ILE  28          HG12      ILE  28  36.007  -5.748 -12.267
  204   HG13  ILE  28          HG11      ILE  28  37.194  -6.356 -11.114
  205   HG21  ILE  28          HG21      ILE  28  33.532  -6.686 -11.281
  206   HG22  ILE  28          HG22      ILE  28  33.741  -4.939 -11.387
  207   HG23  ILE  28          HG23      ILE  28  33.170  -5.671  -9.887
  208   HD11  ILE  28          HD11      ILE  28  34.875  -7.841 -12.353
  209   HD12  ILE  28          HD12      ILE  28  35.704  -8.435 -10.917
  210   HD13  ILE  28          HD13      ILE  28  36.589  -8.244 -12.427
  211    H    CYS  29           HN       CYS  29  34.313  -2.506  -9.882
  212    HA   CYS  29           HA       CYS  29  33.794  -2.002  -7.154
  213    HB2  CYS  29           HB2      CYS  29  32.610  -1.198  -9.741
  214    HB3  CYS  29           HB1      CYS  29  31.551  -1.009  -8.353
  215    H    THR  30           HN       THR  30  32.508  -2.999  -5.659
  216    HA   THR  30           HA       THR  30  30.718  -5.181  -6.653
  217    HB   THR  30           HB       THR  30  31.431  -4.687  -3.773
  218    HG1  THR  30           HG1      THR  30  33.155  -5.125  -5.747
  219   HG21  THR  30          HG21      THR  30  31.142  -7.285  -5.276
  220   HG22  THR  30          HG22      THR  30  29.750  -6.442  -4.595
  221   HG23  THR  30          HG23      THR  30  31.039  -7.016  -3.537
  222    H    GLY  31           HN       GLY  31  30.067  -2.247  -6.743
  223    HA2  GLY  31           HA2      GLY  31  27.946  -2.036  -4.664
  224    HA3  GLY  31           HA1      GLY  31  28.508  -0.734  -5.696
  225    H    GLN  32           HN       GLN  32  25.773  -1.880  -5.199
  226    HA   GLN  32           HA       GLN  32  24.911  -3.168  -7.631
  227    HB2  GLN  32           HB2      GLN  32  23.389  -1.567  -5.555
  228    HB3  GLN  32           HB1      GLN  32  22.635  -2.521  -6.832
  229    HG2  GLN  32           HG2      GLN  32  24.531  -3.640  -4.746
  230    HG3  GLN  32           HG1      GLN  32  22.772  -3.749  -4.660
  231   HE21  GLN  32          HE21      GLN  32  25.321  -5.641  -5.420
  232   HE22  GLN  32          HE22      GLN  32  24.651  -6.585  -6.662
  233    H    ASP  33           HN       ASP  33  25.242   0.190  -6.596
  234    HA   ASP  33           HA       ASP  33  24.011   1.160  -9.117
  235    HB2  ASP  33           HB2      ASP  33  25.085   2.589  -6.668
  236    HB3  ASP  33           HB1      ASP  33  24.429   3.415  -8.082
  237    H    CYS  34           HN       CYS  34  27.006   0.103  -8.104
  238    HA   CYS  34           HA       CYS  34  28.324   1.535 -10.345
  239    HB2  CYS  34           HB2      CYS  34  30.127   2.343  -9.054
  240    HB3  CYS  34           HB1      CYS  34  28.712   2.708  -8.069
  241    H    GLY  35           HN       GLY  35  29.467   0.130 -11.530
  242    HA2  GLY  35           HA2      GLY  35  30.580  -2.329 -10.258
  243    HA3  GLY  35           HA1      GLY  35  29.578  -2.474 -11.703
  244    H    LEU  36           HN       LEU  36  31.670   0.279 -11.256
  245    HA   LEU  36           HA       LEU  36  32.977  -0.116 -13.771
  246    HB2  LEU  36           HB2      LEU  36  33.894   1.577 -11.429
  247    HB3  LEU  36           HB1      LEU  36  34.403   1.755 -13.108
  248    HG   LEU  36           HG       LEU  36  31.562   2.062 -12.095
  249   HD11  LEU  36          HD11      LEU  36  33.453   4.179 -13.157
  250   HD12  LEU  36          HD12      LEU  36  33.190   3.876 -11.439
  251   HD13  LEU  36          HD13      LEU  36  31.856   4.430 -12.451
  252   HD21  LEU  36          HD21      LEU  36  31.315   1.373 -14.323
  253   HD22  LEU  36          HD22      LEU  36  32.824   2.133 -14.835
  254   HD23  LEU  36          HD23      LEU  36  31.403   3.122 -14.505
  255    H    ALA  37           HN       ALA  37  35.270  -0.528 -14.140
  256    HA   ALA  37           HA       ALA  37  36.485  -2.284 -12.028
  257    HB1  ALA  37           HB1      ALA  37  37.540  -3.429 -14.082
  258    HB2  ALA  37           HB2      ALA  37  36.289  -2.611 -15.015
  259    HB3  ALA  37           HB3      ALA  37  35.842  -3.757 -13.752
  260    H    TYR  38           HN       TYR  38  38.622  -2.007 -11.609
  261    HA   TYR  38           HA       TYR  38  40.055   0.116 -13.152
  262    HB2  TYR  38           HB2      TYR  38  40.476  -0.396 -10.219
  263    HB3  TYR  38           HB1      TYR  38  40.961   1.007 -11.172
  264    HD1  TYR  38           HD2      TYR  38  37.948  -0.899 -10.058
  265    HD2  TYR  38           HD1      TYR  38  39.541   2.883 -11.327
  266    HE1  TYR  38           HE2      TYR  38  35.779   0.183  -9.553
  267    HE2  TYR  38           HE1      TYR  38  37.369   3.967 -10.820
  268    HH   TYR  38           HH       TYR  38  35.144   3.525 -10.424
  269    HA   PRO  39           HA       PRO  39  42.916  -3.392 -13.443
  270    HB2  PRO  39           HB2      PRO  39  44.676  -2.335 -15.214
  271    HB3  PRO  39           HB1      PRO  39  43.061  -2.881 -15.703
  272    HG2  PRO  39           HG2      PRO  39  44.045  -0.112 -15.190
  273    HG3  PRO  39           HG1      PRO  39  42.946  -0.704 -16.451
  274    HD2  PRO  39           HD2      PRO  39  42.099   0.552 -14.125
  275    HD3  PRO  39           HD1      PRO  39  41.093  -0.563 -15.086
  276    H    VAL  40           HN       VAL  40  45.187  -3.832 -12.899
  277    HA   VAL  40           HA       VAL  40  46.217  -1.912 -10.886
  278    HB   VAL  40           HB       VAL  40  46.867  -4.804 -11.488
  279   HG11  VAL  40          HG11      VAL  40  48.240  -4.557  -9.324
  280   HG12  VAL  40          HG12      VAL  40  48.155  -2.817  -9.603
  281   HG13  VAL  40          HG13      VAL  40  48.941  -3.863 -10.786
  282   HG21  VAL  40          HG21      VAL  40  45.854  -5.201  -9.319
  283   HG22  VAL  40          HG22      VAL  40  44.732  -4.240 -10.283
  284   HG23  VAL  40          HG23      VAL  40  45.702  -3.469  -9.028
  285    H    ARG  41           HN       ARG  41  48.053  -0.745 -11.221
  286    HA   ARG  41           HA       ARG  41  49.842  -1.540 -13.484
  287    HB2  ARG  41           HB2      ARG  41  48.294   0.197 -14.323
  288    HB3  ARG  41           HB1      ARG  41  48.789   1.265 -13.007
  289    HG2  ARG  41           HG2      ARG  41  51.081   1.292 -13.822
  290    HG3  ARG  41           HG1      ARG  41  50.695   0.091 -15.055
  291    HD2  ARG  41           HD2      ARG  41  49.380   2.815 -14.884
  292    HD3  ARG  41           HD1      ARG  41  50.762   2.454 -15.919
  293    HE   ARG  41           HE       ARG  41  48.739   0.531 -16.455
  294   HH11  ARG  41          HH21      ARG  41  49.394   3.905 -16.728
  295   HH12  ARG  41          HH22      ARG  41  48.396   4.119 -18.128
  296   HH21  ARG  41          HH11      ARG  41  47.438   0.792 -18.279
  297   HH22  ARG  41          HH12      ARG  41  47.289   2.356 -19.007
  298    H    ASP  42           HN       ASP  42  51.988  -0.975 -13.198
  299    HA   ASP  42           HA       ASP  42  53.930  -0.584 -11.969
  300    HB2  ASP  42           HB2      ASP  42  52.143   1.640 -10.944
  301    HB3  ASP  42           HB1      ASP  42  53.842   1.494 -10.504
  302    H    GLY  43           HN       GLY  43  51.838  -2.431 -10.902
  303    HA2  GLY  43           HA2      GLY  43  51.790  -3.848  -9.025
  304    HA3  GLY  43           HA1      GLY  43  53.084  -2.882  -8.320
  305    H    ILE  44           HN       ILE  44  50.586  -0.856  -9.322
  306    HA   ILE  44           HA       ILE  44  49.260  -0.985  -6.645
  307    HB   ILE  44           HB       ILE  44  49.174   1.562  -6.775
  308   HG12  ILE  44          HG12      ILE  44  51.344   1.049  -8.829
  309   HG13  ILE  44          HG11      ILE  44  49.751   1.727  -9.177
  310   HG21  ILE  44          HG21      ILE  44  51.384   1.795  -5.798
  311   HG22  ILE  44          HG22      ILE  44  51.931   0.317  -6.589
  312   HG23  ILE  44          HG23      ILE  44  50.725   0.236  -5.307
  313   HD11  ILE  44          HD11      ILE  44  51.248   3.592  -8.969
  314   HD12  ILE  44          HD12      ILE  44  51.945   2.945  -7.483
  315   HD13  ILE  44          HD13      ILE  44  50.288   3.551  -7.489
  316    HA   PRO  45           HA       PRO  45  45.520  -0.867  -9.002
  317    HB2  PRO  45           HB2      PRO  45  43.789   0.196  -7.170
  318    HB3  PRO  45           HB1      PRO  45  44.436  -1.452  -7.052
  319    HG2  PRO  45           HG2      PRO  45  45.340   1.026  -5.649
  320    HG3  PRO  45           HG1      PRO  45  45.098  -0.611  -5.004
  321    HD2  PRO  45           HD2      PRO  45  47.567   0.314  -5.657
  322    HD3  PRO  45           HD1      PRO  45  47.120  -1.395  -5.844
  323    H    VAL  46           HN       VAL  46  44.406   0.526 -10.376
  324    HA   VAL  46           HA       VAL  46  45.280   3.347 -10.359
  325    HB   VAL  46           HB       VAL  46  43.546   1.775 -12.288
  326   HG11  VAL  46          HG11      VAL  46  44.144   3.768 -13.794
  327   HG12  VAL  46          HG12      VAL  46  44.610   4.607 -12.314
  328   HG13  VAL  46          HG13      VAL  46  42.944   4.067 -12.537
  329   HG21  VAL  46          HG21      VAL  46  45.883   1.014 -12.204
  330   HG22  VAL  46          HG22      VAL  46  46.443   2.676 -12.401
  331   HG23  VAL  46          HG23      VAL  46  45.578   1.876 -13.713
  332    H    LEU  47           HN       LEU  47  44.150   4.229  -8.584
  333    HA   LEU  47           HA       LEU  47  41.257   3.867  -8.324
  334    HB2  LEU  47           HB2      LEU  47  43.107   5.806  -6.904
  335    HB3  LEU  47           HB1      LEU  47  41.483   5.340  -6.393
  336    HG   LEU  47           HG       LEU  47  43.844   3.454  -6.661
  337   HD11  LEU  47          HD11      LEU  47  42.508   4.719  -4.255
  338   HD12  LEU  47          HD12      LEU  47  44.192   4.878  -4.754
  339   HD13  LEU  47          HD13      LEU  47  43.596   3.334  -4.145
  340   HD21  LEU  47          HD21      LEU  47  41.948   2.111  -7.022
  341   HD22  LEU  47          HD22      LEU  47  40.937   3.074  -5.943
  342   HD23  LEU  47          HD23      LEU  47  42.159   1.992  -5.279
  343    H    LEU  48           HN       LEU  48  41.933   4.905 -10.852
  344    HA   LEU  48           HA       LEU  48  40.910   7.723 -10.667
  345    HB2  LEU  48           HB2      LEU  48  42.626   6.487 -12.842
  346    HB3  LEU  48           HB1      LEU  48  42.089   8.165 -12.762
  347    HG   LEU  48           HG       LEU  48  43.852   6.792 -10.710
  348   HD11  LEU  48          HD11      LEU  48  44.865   7.275 -12.995
  349   HD12  LEU  48          HD12      LEU  48  45.677   8.038 -11.628
  350   HD13  LEU  48          HD13      LEU  48  44.601   8.985 -12.656
  351   HD21  LEU  48          HD21      LEU  48  42.620   9.541 -10.905
  352   HD22  LEU  48          HD22      LEU  48  44.168   9.336 -10.090
  353   HD23  LEU  48          HD23      LEU  48  42.749   8.478  -9.503
  354    H    VAL  49           HN       VAL  49  38.876   7.884 -11.342
  355    HA   VAL  49           HA       VAL  49  37.471   5.765 -12.664
  356    HB   VAL  49           HB       VAL  49  35.723   7.607 -13.021
  357   HG11  VAL  49          HG11      VAL  49  35.629   6.126 -11.092
  358   HG12  VAL  49          HG12      VAL  49  35.276   7.770 -10.562
  359   HG13  VAL  49          HG13      VAL  49  36.867   7.070 -10.264
  360   HG21  VAL  49          HG21      VAL  49  37.584   9.187 -11.229
  361   HG22  VAL  49          HG22      VAL  49  36.112   9.742 -12.029
  362   HG23  VAL  49          HG23      VAL  49  37.558   9.408 -12.978
  363    H    ASP  50           HN       ASP  50  39.225   8.575 -13.798
  364    HA   ASP  50           HA       ASP  50  38.197   8.662 -16.454
  365    HB2  ASP  50           HB2      ASP  50  40.862   9.470 -15.276
  366    HB3  ASP  50           HB1      ASP  50  40.443   9.753 -16.965
  367    H    GLU  51           HN       GLU  51  40.889   6.836 -15.021
  368    HA   GLU  51           HA       GLU  51  41.480   5.550 -17.622
  369    HB2  GLU  51           HB2      GLU  51  42.713   5.299 -14.863
  370    HB3  GLU  51           HB1      GLU  51  43.274   4.408 -16.277
  371    HG2  GLU  51           HG2      GLU  51  43.754   6.509 -17.446
  372    HG3  GLU  51           HG1      GLU  51  43.121   7.431 -16.082
  373    H    ALA  52           HN       ALA  52  39.359   5.095 -15.065
  374    HA   ALA  52           HA       ALA  52  39.446   2.263 -14.704
  375    HB1  ALA  52           HB1      ALA  52  37.175   4.238 -14.407
  376    HB2  ALA  52           HB2      ALA  52  38.223   3.619 -13.133
  377    HB3  ALA  52           HB3      ALA  52  37.072   2.546 -13.927
  378    H    ARG  53           HN       ARG  53  37.934   0.664 -15.549
  379    HA   ARG  53           HA       ARG  53  36.796   1.370 -18.234
  380    HB2  ARG  53           HB2      ARG  53  37.536  -0.845 -19.043
  381    HB3  ARG  53           HB1      ARG  53  38.904   0.155 -18.553
  382    HG2  ARG  53           HG2      ARG  53  38.950  -0.984 -16.362
  383    HG3  ARG  53           HG1      ARG  53  37.599  -2.000 -16.864
  384    HD2  ARG  53           HD2      ARG  53  39.653  -3.239 -17.217
  385    HD3  ARG  53           HD1      ARG  53  38.992  -2.799 -18.791
  386    HE   ARG  53           HE       ARG  53  40.908  -0.851 -17.766
  387   HH11  ARG  53          HH21      ARG  53  40.404  -3.800 -19.478
  388   HH12  ARG  53          HH22      ARG  53  41.893  -3.699 -20.358
  389   HH21  ARG  53          HH11      ARG  53  42.854  -0.704 -18.903
  390   HH22  ARG  53          HH12      ARG  53  43.281  -1.947 -20.031
  391    H    ARG  54           HN       ARG  54  35.218  -0.339 -18.965
  392    HA   ARG  54           HA       ARG  54  33.275  -0.731 -16.853
  393    HB2  ARG  54           HB2      ARG  54  33.397  -1.236 -19.812
  394    HB3  ARG  54           HB1      ARG  54  32.131  -2.034 -18.886
  395    HG2  ARG  54           HG2      ARG  54  31.271   0.069 -18.093
  396    HG3  ARG  54           HG1      ARG  54  32.660   0.942 -18.740
  397    HD2  ARG  54           HD2      ARG  54  30.696  -0.616 -20.443
  398    HD3  ARG  54           HD1      ARG  54  30.610   1.125 -20.175
  399    HE   ARG  54           HE       ARG  54  33.199   0.708 -21.079
  400   HH11  ARG  54          HH21      ARG  54  30.012  -0.048 -22.147
  401   HH12  ARG  54          HH22      ARG  54  30.417   0.020 -23.830
  402   HH21  ARG  54          HH11      ARG  54  33.747   0.803 -23.266
  403   HH22  ARG  54          HH12      ARG  54  32.532   0.502 -24.465
  404    HA   PRO  55           HA       PRO  55  34.356  -4.815 -15.569
  405    HB2  PRO  55           HB2      PRO  55  31.852  -5.930 -15.152
  406    HB3  PRO  55           HB1      PRO  55  32.627  -4.783 -14.042
  407    HG2  PRO  55           HG2      PRO  55  30.552  -4.282 -16.132
  408    HG3  PRO  55           HG1      PRO  55  30.691  -3.613 -14.493
  409    HD2  PRO  55           HD2      PRO  55  31.426  -2.187 -16.678
  410    HD3  PRO  55           HD1      PRO  55  32.274  -2.022 -15.128
  411    H    GLU  56           HN       GLU  56  34.674  -6.890 -16.400
  412    HA   GLU  56           HA       GLU  56  34.074  -7.272 -19.218
  413    HB2  GLU  56           HB2      GLU  56  36.173  -8.059 -18.048
  414    HB3  GLU  56           HB1      GLU  56  35.190  -9.280 -17.240
  415    HG2  GLU  56           HG2      GLU  56  36.149 -10.334 -19.173
  416    HG3  GLU  56           HG1      GLU  56  34.449 -10.051 -19.543
  Start of MODEL   14
    1    H1   MET   1           HT1      MET   1  26.873 -15.981  17.736
    2    H2   MET   1           HT2      MET   1  26.883 -17.672  17.905
    3    H3   MET   1           HT3      MET   1  27.421 -16.955  16.461
    4    HA   MET   1           HA       MET   1  28.724 -16.942  19.110
    5    HB2  MET   1           HB2      MET   1  29.331 -18.013  16.362
    6    HB3  MET   1           HB1      MET   1  30.665 -17.629  17.447
    7    HG2  MET   1           HG2      MET   1  29.804 -19.136  19.138
    8    HG3  MET   1           HG1      MET   1  28.342 -19.423  18.197
    9    HE1  MET   1           HE1      MET   1  30.444 -22.743  18.222
   10    HE2  MET   1           HE2      MET   1  29.184 -21.804  19.018
   11    HE3  MET   1           HE3      MET   1  30.876 -21.476  19.378
   12    HA   PRO   2           HA       PRO   2  30.214 -12.853  18.275
   13    HB2  PRO   2           HB2      PRO   2  32.685 -12.922  19.470
   14    HB3  PRO   2           HB1      PRO   2  31.165 -12.880  20.385
   15    HG2  PRO   2           HG2      PRO   2  32.906 -15.217  19.721
   16    HG3  PRO   2           HG1      PRO   2  32.096 -14.815  21.249
   17    HD2  PRO   2           HD2      PRO   2  31.084 -16.661  19.523
   18    HD3  PRO   2           HD1      PRO   2  30.038 -15.636  20.531
   19    H    LEU   3           HN       LEU   3  32.726 -11.926  17.779
   20    HA   LEU   3           HA       LEU   3  34.246 -11.581  16.044
   21    HB2  LEU   3           HB2      LEU   3  34.087 -14.595  15.724
   22    HB3  LEU   3           HB1      LEU   3  35.393 -13.543  15.186
   23    HG   LEU   3           HG       LEU   3  34.538 -13.938  18.068
   24   HD11  LEU   3          HD11      LEU   3  36.507 -15.253  18.343
   25   HD12  LEU   3          HD12      LEU   3  37.125 -14.795  16.756
   26   HD13  LEU   3          HD13      LEU   3  35.728 -15.865  16.884
   27   HD21  LEU   3          HD21      LEU   3  35.443 -11.769  18.009
   28   HD22  LEU   3          HD22      LEU   3  36.578 -12.169  16.719
   29   HD23  LEU   3          HD23      LEU   3  36.866 -12.746  18.359
   30    H    GLU   4           HN       GLU   4  31.543 -11.228  15.414
   31    HA   GLU   4           HA       GLU   4  31.668 -11.438  12.524
   32    HB2  GLU   4           HB2      GLU   4  29.574 -12.764  12.280
   33    HB3  GLU   4           HB1      GLU   4  30.871 -13.705  13.017
   34    HG2  GLU   4           HG2      GLU   4  29.942 -13.212  15.257
   35    HG3  GLU   4           HG1      GLU   4  28.625 -12.313  14.503
   36    H    ALA   5           HN       ALA   5  31.492  -9.296  14.362
   37    HA   ALA   5           HA       ALA   5  28.748  -8.382  14.609
   38    HB1  ALA   5           HB1      ALA   5  31.402  -6.928  14.843
   39    HB2  ALA   5           HB2      ALA   5  30.433  -7.569  16.169
   40    HB3  ALA   5           HB3      ALA   5  29.840  -6.202  15.227
   41    H    GLY   6           HN       GLY   6  30.907  -8.590  12.019
   42    HA2  GLY   6           HA2      GLY   6  30.330  -8.024   9.755
   43    HA3  GLY   6           HA1      GLY   6  29.154  -6.860  10.364
   44    H    LEU   7           HN       LEU   7  30.438  -5.184  11.907
   45    HA   LEU   7           HA       LEU   7  31.823  -3.323  11.907
   46    HB2  LEU   7           HB2      LEU   7  33.576  -5.070  12.249
   47    HB3  LEU   7           HB1      LEU   7  33.799  -5.146  10.503
   48    HG   LEU   7           HG       LEU   7  34.351  -2.711  10.497
   49   HD11  LEU   7          HD11      LEU   7  33.398  -1.702  12.359
   50   HD12  LEU   7          HD12      LEU   7  35.047  -1.907  12.936
   51   HD13  LEU   7          HD13      LEU   7  33.796  -3.047  13.430
   52   HD21  LEU   7          HD21      LEU   7  36.098  -4.483  10.636
   53   HD22  LEU   7          HD22      LEU   7  36.058  -4.350  12.395
   54   HD23  LEU   7          HD23      LEU   7  36.592  -2.982  11.416
   55    H    LEU   8           HN       LEU   8  32.341  -1.558  10.610
   56    HA   LEU   8           HA       LEU   8  31.121  -1.542   8.007
   57    HB2  LEU   8           HB2      LEU   8  31.142   0.475   9.381
   58    HB3  LEU   8           HB1      LEU   8  32.904   0.503   9.360
   59    HG   LEU   8           HG       LEU   8  32.902   0.855   6.932
   60   HD11  LEU   8          HD11      LEU   8  29.944   0.397   7.269
   61   HD12  LEU   8          HD12      LEU   8  31.044  -0.266   6.060
   62   HD13  LEU   8          HD13      LEU   8  30.524   1.412   5.947
   63   HD21  LEU   8          HD21      LEU   8  32.755   2.833   8.391
   64   HD22  LEU   8          HD22      LEU   8  30.996   2.726   8.374
   65   HD23  LEU   8          HD23      LEU   8  31.871   3.102   6.889
   66    H    GLU   9           HN       GLU   9  32.015  -1.847   6.038
   67    HA   GLU   9           HA       GLU   9  34.544  -3.085   5.731
   68    HB2  GLU   9           HB2      GLU   9  32.814  -1.619   3.717
   69    HB3  GLU   9           HB1      GLU   9  34.196  -2.632   3.289
   70    HG2  GLU   9           HG2      GLU   9  31.833  -3.607   4.917
   71    HG3  GLU   9           HG1      GLU   9  31.977  -3.825   3.173
   72    H    ILE  10           HN       ILE  10  36.558  -2.309   5.302
   73    HA   ILE  10           HA       ILE  10  37.034   0.563   5.704
   74    HB   ILE  10           HB       ILE  10  38.900  -1.770   5.188
   75   HG12  ILE  10          HG12      ILE  10  38.428  -0.203   7.738
   76   HG13  ILE  10          HG11      ILE  10  37.583  -1.705   7.361
   77   HG21  ILE  10          HG21      ILE  10  39.398   1.167   5.662
   78   HG22  ILE  10          HG22      ILE  10  40.134   0.096   4.469
   79   HG23  ILE  10          HG23      ILE  10  40.587  -0.033   6.165
   80   HD11  ILE  10          HD11      ILE  10  39.621  -2.055   8.774
   81   HD12  ILE  10          HD12      ILE  10  40.601  -1.423   7.452
   82   HD13  ILE  10          HD13      ILE  10  39.689  -2.918   7.238
   83    H    LEU  11           HN       LEU  11  36.247  -1.362   3.090
   84    HA   LEU  11           HA       LEU  11  37.877   0.219   1.148
   85    HB2  LEU  11           HB2      LEU  11  36.105  -2.195   0.673
   86    HB3  LEU  11           HB1      LEU  11  37.216  -1.462  -0.485
   87    HG   LEU  11           HG       LEU  11  38.008  -2.715   2.162
   88   HD11  LEU  11          HD11      LEU  11  38.385  -3.670  -0.693
   89   HD12  LEU  11          HD12      LEU  11  37.298  -4.380   0.500
   90   HD13  LEU  11          HD13      LEU  11  39.043  -4.456   0.741
   91   HD21  LEU  11          HD21      LEU  11  39.663  -1.101   1.776
   92   HD22  LEU  11          HD22      LEU  11  39.525  -1.226   0.022
   93   HD23  LEU  11          HD23      LEU  11  40.338  -2.494   0.936
   94    H    ALA  12           HN       ALA  12  36.944   1.835   0.033
   95    HA   ALA  12           HA       ALA  12  34.014   1.798  -0.397
   96    HB1  ALA  12           HB1      ALA  12  34.232   3.087   1.637
   97    HB2  ALA  12           HB2      ALA  12  33.865   4.187   0.308
   98    HB3  ALA  12           HB3      ALA  12  35.514   4.067   0.924
   99    H    CYS  13           HN       CYS  13  33.492   2.537  -2.385
  100    HA   CYS  13           HA       CYS  13  35.499   2.993  -4.332
  101    HB2  CYS  13           HB2      CYS  13  32.851   4.209  -4.913
  102    HB3  CYS  13           HB1      CYS  13  33.738   2.989  -5.813
  103    HA   PRO  14           HA       PRO  14  36.481   7.295  -3.826
  104    HB2  PRO  14           HB2      PRO  14  36.907   8.082  -6.435
  105    HB3  PRO  14           HB1      PRO  14  38.051   7.085  -5.515
  106    HG2  PRO  14           HG2      PRO  14  36.043   6.261  -7.562
  107    HG3  PRO  14           HG1      PRO  14  37.689   5.660  -7.288
  108    HD2  PRO  14           HD2      PRO  14  35.459   4.315  -6.445
  109    HD3  PRO  14           HD1      PRO  14  37.022   4.197  -5.615
  110    H    ALA  15           HN       ALA  15  33.668   6.286  -5.425
  111    HA   ALA  15           HA       ALA  15  32.440   8.964  -5.067
  112    HB1  ALA  15           HB1      ALA  15  32.443   7.418  -7.674
  113    HB2  ALA  15           HB2      ALA  15  33.153   9.009  -7.397
  114    HB3  ALA  15           HB3      ALA  15  31.402   8.803  -7.343
  115    H    CYS  16           HN       CYS  16  31.944   5.623  -6.166
  116    HA   CYS  16           HA       CYS  16  29.129   5.591  -5.548
  117    HB2  CYS  16           HB2      CYS  16  30.267   2.938  -5.427
  118    HB3  CYS  16           HB1      CYS  16  29.244   3.616  -6.679
  119    H    HIS  17           HN       HIS  17  32.013   5.127  -3.666
  120    HA   HIS  17           HA       HIS  17  32.291   4.875  -1.358
  121    HB2  HIS  17           HB2      HIS  17  30.132   6.357  -1.368
  122    HB3  HIS  17           HB1      HIS  17  29.289   4.854  -0.994
  123    HD2  HIS  17           HD2      HIS  17  31.612   7.424   0.764
  124    HE1  HIS  17           HE1      HIS  17  30.828   4.319   3.516
  125    HE2  HIS  17           HE2      HIS  17  31.844   6.628   3.237
  126    H    ALA  18           HN       ALA  18  30.017   2.889  -3.095
  127    HA   ALA  18           HA       ALA  18  29.472   0.828  -1.331
  128    HB1  ALA  18           HB1      ALA  18  29.173   1.257  -4.042
  129    HB2  ALA  18           HB2      ALA  18  28.696  -0.221  -3.214
  130    HB3  ALA  18           HB3      ALA  18  30.264  -0.116  -4.010
  131    HA   PRO  19           HA       PRO  19  33.306  -1.350  -0.799
  132    HB2  PRO  19           HB2      PRO  19  32.602  -4.009  -0.962
  133    HB3  PRO  19           HB1      PRO  19  32.160  -2.949   0.389
  134    HG2  PRO  19           HG2      PRO  19  30.455  -4.056  -1.716
  135    HG3  PRO  19           HG1      PRO  19  30.001  -3.322  -0.175
  136    HD2  PRO  19           HD2      PRO  19  29.970  -2.107  -2.823
  137    HD3  PRO  19           HD1      PRO  19  29.399  -1.417  -1.288
  138    H    LEU  20           HN       LEU  20  34.996  -2.787  -1.704
  139    HA   LEU  20           HA       LEU  20  34.854  -2.950  -4.701
  140    HB2  LEU  20           HB2      LEU  20  37.313  -2.753  -2.946
  141    HB3  LEU  20           HB1      LEU  20  37.249  -2.642  -4.706
  142    HG   LEU  20           HG       LEU  20  35.875  -0.713  -2.812
  143   HD11  LEU  20          HD11      LEU  20  38.333  -0.547  -2.693
  144   HD12  LEU  20          HD12      LEU  20  37.639   0.867  -3.490
  145   HD13  LEU  20          HD13      LEU  20  38.407  -0.399  -4.450
  146   HD21  LEU  20          HD21      LEU  20  35.832   0.651  -5.014
  147   HD22  LEU  20          HD22      LEU  20  34.691  -0.679  -4.874
  148   HD23  LEU  20          HD23      LEU  20  36.171  -0.880  -5.816
  149    H    GLU  21           HN       GLU  21  35.735  -4.805  -5.698
  150    HA   GLU  21           HA       GLU  21  36.163  -7.143  -3.858
  151    HB2  GLU  21           HB2      GLU  21  33.986  -7.210  -5.103
  152    HB3  GLU  21           HB1      GLU  21  34.898  -7.199  -6.611
  153    HG2  GLU  21           HG2      GLU  21  34.372  -9.495  -6.081
  154    HG3  GLU  21           HG1      GLU  21  36.097  -9.269  -5.800
  155    H    GLU  22           HN       GLU  22  37.989  -8.260  -4.186
  156    HA   GLU  22           HA       GLU  22  39.921  -7.274  -6.146
  157    HB2  GLU  22           HB2      GLU  22  40.021  -9.458  -4.051
  158    HB3  GLU  22           HB1      GLU  22  41.384  -9.048  -5.093
  159    HG2  GLU  22           HG2      GLU  22  41.399  -6.770  -4.250
  160    HG3  GLU  22           HG1      GLU  22  39.954  -7.075  -3.291
  161    H    ARG  23           HN       ARG  23  40.245  -8.145  -8.146
  162    HA   ARG  23           HA       ARG  23  39.349 -10.969  -8.609
  163    HB2  ARG  23           HB2      ARG  23  37.636  -9.408  -9.489
  164    HB3  ARG  23           HB1      ARG  23  38.873  -8.631 -10.477
  165    HG2  ARG  23           HG2      ARG  23  39.276 -10.695 -11.694
  166    HG3  ARG  23           HG1      ARG  23  38.178 -11.577 -10.632
  167    HD2  ARG  23           HD2      ARG  23  37.344  -9.238 -12.371
  168    HD3  ARG  23           HD1      ARG  23  37.137 -10.930 -12.822
  169    HE   ARG  23           HE       ARG  23  35.958 -10.618 -10.277
  170   HH11  ARG  23          HH21      ARG  23  35.612  -9.456 -13.505
  171   HH12  ARG  23          HH22      ARG  23  33.903  -9.211 -13.373
  172   HH21  ARG  23          HH11      ARG  23  33.733 -10.304 -10.089
  173   HH22  ARG  23          HH12      ARG  23  32.839  -9.691 -11.439
  174    H    ASP  24           HN       ASP  24  41.099 -12.077  -9.160
  175    HA   ASP  24           HA       ASP  24  43.210 -12.599 -10.024
  176    HB2  ASP  24           HB2      ASP  24  42.057 -10.766 -12.138
  177    HB3  ASP  24           HB1      ASP  24  43.601 -11.593 -12.343
  178    H    ALA  25           HN       ALA  25  43.847  -9.812 -11.796
  179    HA   ALA  25           HA       ALA  25  45.615  -8.731  -9.627
  180    HB1  ALA  25           HB1      ALA  25  47.157  -8.081 -11.387
  181    HB2  ALA  25           HB2      ALA  25  46.009  -8.579 -12.631
  182    HB3  ALA  25           HB3      ALA  25  46.770  -9.787 -11.595
  183    H    GLU  26           HN       GLU  26  42.756  -8.058 -10.363
  184    HA   GLU  26           HA       GLU  26  43.208  -5.127 -10.635
  185    HB2  GLU  26           HB2      GLU  26  41.286  -4.970 -12.219
  186    HB3  GLU  26           HB1      GLU  26  42.665  -5.836 -12.898
  187    HG2  GLU  26           HG2      GLU  26  41.616  -7.980 -12.350
  188    HG3  GLU  26           HG1      GLU  26  40.247  -7.136 -11.624
  189    H    LEU  27           HN       LEU  27  41.319  -3.858  -9.950
  190    HA   LEU  27           HA       LEU  27  39.754  -5.327  -7.844
  191    HB2  LEU  27           HB2      LEU  27  40.412  -2.376  -8.029
  192    HB3  LEU  27           HB1      LEU  27  39.626  -3.192  -6.679
  193    HG   LEU  27           HG       LEU  27  42.433  -3.752  -7.684
  194   HD11  LEU  27          HD11      LEU  27  43.067  -2.799  -5.439
  195   HD12  LEU  27          HD12      LEU  27  41.389  -2.293  -5.242
  196   HD13  LEU  27          HD13      LEU  27  42.366  -1.620  -6.547
  197   HD21  LEU  27          HD21      LEU  27  42.432  -4.989  -5.358
  198   HD22  LEU  27          HD22      LEU  27  41.730  -5.790  -6.758
  199   HD23  LEU  27          HD23      LEU  27  40.681  -5.005  -5.574
  200    H    ILE  28           HN       ILE  28  37.605  -5.448  -8.087
  201    HA   ILE  28           HA       ILE  28  36.344  -3.797 -10.239
  202    HB   ILE  28           HB       ILE  28  35.315  -6.342  -8.966
  203   HG12  ILE  28          HG12      ILE  28  37.368  -6.867 -10.143
  204   HG13  ILE  28          HG11      ILE  28  36.019  -7.384 -11.149
  205   HG21  ILE  28          HG21      ILE  28  33.523  -5.073  -9.928
  206   HG22  ILE  28          HG22      ILE  28  33.923  -6.333 -11.094
  207   HG23  ILE  28          HG23      ILE  28  34.481  -4.681 -11.356
  208   HD11  ILE  28          HD11      ILE  28  37.855  -5.026 -11.522
  209   HD12  ILE  28          HD12      ILE  28  36.244  -5.016 -12.242
  210   HD13  ILE  28          HD13      ILE  28  37.397  -6.268 -12.686
  211    H    CYS  29           HN       CYS  29  34.830  -2.331  -9.722
  212    HA   CYS  29           HA       CYS  29  34.355  -1.723  -6.945
  213    HB2  CYS  29           HB2      CYS  29  34.155  -0.360  -9.329
  214    HB3  CYS  29           HB1      CYS  29  32.463  -0.582  -8.914
  215    H    THR  30           HN       THR  30  32.951  -2.794  -5.614
  216    HA   THR  30           HA       THR  30  30.929  -4.564  -6.817
  217    HB   THR  30           HB       THR  30  31.391  -4.133  -3.864
  218    HG1  THR  30           HG1      THR  30  33.182  -5.300  -3.953
  219   HG21  THR  30          HG21      THR  30  29.542  -5.592  -4.570
  220   HG22  THR  30          HG22      THR  30  30.818  -6.536  -3.802
  221   HG23  THR  30          HG23      THR  30  30.656  -6.537  -5.558
  222    H    GLY  31           HN       GLY  31  28.739  -4.518  -5.832
  223    HA2  GLY  31           HA2      GLY  31  27.220  -3.066  -4.370
  224    HA3  GLY  31           HA1      GLY  31  27.792  -1.724  -5.346
  225    H    GLN  32           HN       GLN  32  25.266  -1.755  -5.543
  226    HA   GLN  32           HA       GLN  32  24.065  -3.692  -7.317
  227    HB2  GLN  32           HB2      GLN  32  22.763  -2.309  -5.726
  228    HB3  GLN  32           HB1      GLN  32  23.198  -0.867  -6.645
  229    HG2  GLN  32           HG2      GLN  32  22.043  -1.691  -8.609
  230    HG3  GLN  32           HG1      GLN  32  21.731  -3.240  -7.825
  231   HE21  GLN  32          HE21      GLN  32  19.594  -1.611  -8.804
  232   HE22  GLN  32          HE22      GLN  32  18.696  -1.049  -7.477
  233    H    ASP  33           HN       ASP  33  24.906  -0.251  -7.834
  234    HA   ASP  33           HA       ASP  33  25.148  -0.826 -10.768
  235    HB2  ASP  33           HB2      ASP  33  23.344   0.782 -10.103
  236    HB3  ASP  33           HB1      ASP  33  24.588   1.829  -9.417
  237    H    CYS  34           HN       CYS  34  27.205  -1.131  -8.620
  238    HA   CYS  34           HA       CYS  34  29.095   1.063  -8.981
  239    HB2  CYS  34           HB2      CYS  34  28.832  -1.314  -7.338
  240    HB3  CYS  34           HB1      CYS  34  30.449  -1.242  -7.993
  241    H    GLY  35           HN       GLY  35  29.832  -2.368  -9.507
  242    HA2  GLY  35           HA2      GLY  35  30.902  -3.448 -11.280
  243    HA3  GLY  35           HA1      GLY  35  30.186  -2.229 -12.339
  244    H    LEU  36           HN       LEU  36  31.605  -0.916 -13.322
  245    HA   LEU  36           HA       LEU  36  33.688  -0.047 -13.939
  246    HB2  LEU  36           HB2      LEU  36  33.342   0.826 -11.077
  247    HB3  LEU  36           HB1      LEU  36  34.622   1.448 -12.108
  248    HG   LEU  36           HG       LEU  36  31.691   1.516 -12.874
  249   HD11  LEU  36          HD11      LEU  36  32.135   2.790 -10.766
  250   HD12  LEU  36          HD12      LEU  36  31.623   3.817 -12.103
  251   HD13  LEU  36          HD13      LEU  36  33.325   3.754 -11.641
  252   HD21  LEU  36          HD21      LEU  36  34.233   2.685 -14.014
  253   HD22  LEU  36          HD22      LEU  36  32.709   3.533 -14.258
  254   HD23  LEU  36          HD23      LEU  36  32.902   1.891 -14.853
  255    H    ALA  37           HN       ALA  37  35.541  -1.032 -14.359
  256    HA   ALA  37           HA       ALA  37  36.761  -2.752 -12.239
  257    HB1  ALA  37           HB1      ALA  37  37.878  -3.900 -14.100
  258    HB2  ALA  37           HB2      ALA  37  37.120  -2.789 -15.243
  259    HB3  ALA  37           HB3      ALA  37  36.129  -3.908 -14.307
  260    H    TYR  38           HN       TYR  38  38.692  -2.288 -11.453
  261    HA   TYR  38           HA       TYR  38  40.220  -0.039 -12.686
  262    HB2  TYR  38           HB2      TYR  38  40.444  -0.877  -9.814
  263    HB3  TYR  38           HB1      TYR  38  40.876   0.660 -10.554
  264    HD1  TYR  38           HD1      TYR  38  38.872   1.854 -11.850
  265    HD2  TYR  38           HD2      TYR  38  38.416  -0.985  -8.664
  266    HE1  TYR  38           HE1      TYR  38  36.599   2.737 -11.391
  267    HE2  TYR  38           HE2      TYR  38  36.155  -0.105  -8.198
  268    HH   TYR  38           HH       TYR  38  34.674   2.360 -10.275
  269    HA   PRO  39           HA       PRO  39  43.125  -3.551 -13.029
  270    HB2  PRO  39           HB2      PRO  39  44.633  -2.583 -15.065
  271    HB3  PRO  39           HB1      PRO  39  43.017  -3.270 -15.329
  272    HG2  PRO  39           HG2      PRO  39  43.868  -0.417 -15.231
  273    HG3  PRO  39           HG1      PRO  39  42.657  -1.204 -16.257
  274    HD2  PRO  39           HD2      PRO  39  42.077   0.268 -13.954
  275    HD3  PRO  39           HD1      PRO  39  40.980  -0.917 -14.705
  276    H    VAL  40           HN       VAL  40  45.463  -3.796 -12.694
  277    HA   VAL  40           HA       VAL  40  46.531  -1.642 -10.963
  278    HB   VAL  40           HB       VAL  40  47.477  -4.476 -11.426
  279   HG11  VAL  40          HG11      VAL  40  48.745  -3.906  -9.235
  280   HG12  VAL  40          HG12      VAL  40  48.456  -2.221  -9.668
  281   HG13  VAL  40          HG13      VAL  40  49.389  -3.262 -10.745
  282   HG21  VAL  40          HG21      VAL  40  45.237  -4.049 -10.235
  283   HG22  VAL  40          HG22      VAL  40  46.189  -3.301  -8.955
  284   HG23  VAL  40          HG23      VAL  40  46.428  -5.002  -9.353
  285    H    ARG  41           HN       ARG  41  48.229  -0.386 -11.546
  286    HA   ARG  41           HA       ARG  41  49.483  -0.983 -14.199
  287    HB2  ARG  41           HB2      ARG  41  48.317   1.194 -13.957
  288    HB3  ARG  41           HB1      ARG  41  49.405   1.608 -12.635
  289    HG2  ARG  41           HG2      ARG  41  50.217   2.614 -14.712
  290    HG3  ARG  41           HG1      ARG  41  51.344   1.372 -14.181
  291    HD2  ARG  41           HD2      ARG  41  50.747  -0.092 -15.896
  292    HD3  ARG  41           HD1      ARG  41  49.139   0.609 -16.080
  293    HE   ARG  41           HE       ARG  41  50.991   2.603 -16.812
  294   HH11  ARG  41          HH21      ARG  41  49.992  -0.565 -17.733
  295   HH12  ARG  41          HH22      ARG  41  50.373  -0.342 -19.409
  296   HH21  ARG  41          HH11      ARG  41  51.493   2.911 -18.981
  297   HH22  ARG  41          HH12      ARG  41  51.224   1.631 -20.116
  298    H    ASP  42           HN       ASP  42  51.323  -2.119 -13.883
  299    HA   ASP  42           HA       ASP  42  53.421  -2.722 -13.057
  300    HB2  ASP  42           HB2      ASP  42  53.430   0.267 -12.553
  301    HB3  ASP  42           HB1      ASP  42  54.842  -0.758 -12.292
  302    H    GLY  43           HN       GLY  43  51.194  -3.082 -11.293
  303    HA2  GLY  43           HA2      GLY  43  51.075  -3.940  -9.083
  304    HA3  GLY  43           HA1      GLY  43  52.671  -3.266  -8.759
  305    H    ILE  44           HN       ILE  44  50.810  -0.917 -10.241
  306    HA   ILE  44           HA       ILE  44  50.164   0.316  -7.595
  307    HB   ILE  44           HB       ILE  44  50.451   1.749 -10.226
  308   HG12  ILE  44          HG12      ILE  44  52.511   1.151  -8.080
  309   HG13  ILE  44          HG11      ILE  44  52.542   0.557  -9.740
  310   HG21  ILE  44          HG21      ILE  44  49.251   2.804  -8.244
  311   HG22  ILE  44          HG22      ILE  44  50.670   3.695  -8.800
  312   HG23  ILE  44          HG23      ILE  44  50.768   2.683  -7.357
  313   HD11  ILE  44          HD11      ILE  44  52.823   3.417  -8.799
  314   HD12  ILE  44          HD12      ILE  44  52.553   2.981 -10.486
  315   HD13  ILE  44          HD13      ILE  44  54.016   2.444  -9.660
  316    HA   PRO  45           HA       PRO  45  45.909  -0.708  -9.025
  317    HB2  PRO  45           HB2      PRO  45  45.335   0.819  -6.516
  318    HB3  PRO  45           HB1      PRO  45  44.680  -0.739  -7.061
  319    HG2  PRO  45           HG2      PRO  45  46.532  -0.610  -5.148
  320    HG3  PRO  45           HG1      PRO  45  46.530  -1.917  -6.347
  321    HD2  PRO  45           HD2      PRO  45  48.342   0.457  -6.156
  322    HD3  PRO  45           HD1      PRO  45  48.676  -1.187  -6.762
  323    H    VAL  46           HN       VAL  46  44.633   0.537 -10.350
  324    HA   VAL  46           HA       VAL  46  45.190   3.431 -10.503
  325    HB   VAL  46           HB       VAL  46  43.406   1.650 -12.186
  326   HG11  VAL  46          HG11      VAL  46  42.632   3.875 -12.475
  327   HG12  VAL  46          HG12      VAL  46  43.752   3.618 -13.812
  328   HG13  VAL  46          HG13      VAL  46  44.265   4.540 -12.400
  329   HG21  VAL  46          HG21      VAL  46  46.151   2.781 -12.797
  330   HG22  VAL  46          HG22      VAL  46  45.234   1.631 -13.769
  331   HG23  VAL  46          HG23      VAL  46  45.883   1.141 -12.205
  332    H    LEU  47           HN       LEU  47  44.149   4.388  -8.759
  333    HA   LEU  47           HA       LEU  47  41.315   3.733  -8.205
  334    HB2  LEU  47           HB2      LEU  47  43.131   5.748  -6.852
  335    HB3  LEU  47           HB1      LEU  47  41.598   5.125  -6.238
  336    HG   LEU  47           HG       LEU  47  44.087   3.473  -6.765
  337   HD11  LEU  47          HD11      LEU  47  44.400   4.865  -4.810
  338   HD12  LEU  47          HD12      LEU  47  44.058   3.223  -4.262
  339   HD13  LEU  47          HD13      LEU  47  42.795   4.453  -4.204
  340   HD21  LEU  47          HD21      LEU  47  42.298   1.979  -7.079
  341   HD22  LEU  47          HD22      LEU  47  41.277   2.793  -5.891
  342   HD23  LEU  47          HD23      LEU  47  42.631   1.798  -5.359
  343    H    LEU  48           HN       LEU  48  42.079   5.052 -10.733
  344    HA   LEU  48           HA       LEU  48  40.752   7.716 -10.366
  345    HB2  LEU  48           HB2      LEU  48  42.504   6.759 -12.642
  346    HB3  LEU  48           HB1      LEU  48  41.842   8.378 -12.450
  347    HG   LEU  48           HG       LEU  48  43.760   7.017 -10.534
  348   HD11  LEU  48          HD11      LEU  48  44.263   9.399 -12.336
  349   HD12  LEU  48          HD12      LEU  48  44.671   7.745 -12.791
  350   HD13  LEU  48          HD13      LEU  48  45.445   8.490 -11.393
  351   HD21  LEU  48          HD21      LEU  48  42.569   8.506  -9.172
  352   HD22  LEU  48          HD22      LEU  48  42.281   9.646 -10.487
  353   HD23  LEU  48          HD23      LEU  48  43.875   9.541  -9.742
  354    H    VAL  49           HN       VAL  49  38.773   7.917 -11.134
  355    HA   VAL  49           HA       VAL  49  37.349   5.771 -12.370
  356    HB   VAL  49           HB       VAL  49  36.632   8.704 -12.385
  357   HG11  VAL  49          HG11      VAL  49  35.284   7.203 -13.850
  358   HG12  VAL  49          HG12      VAL  49  34.340   7.870 -12.522
  359   HG13  VAL  49          HG13      VAL  49  34.914   6.205 -12.444
  360   HG21  VAL  49          HG21      VAL  49  35.338   8.045 -10.290
  361   HG22  VAL  49          HG22      VAL  49  37.090   8.122 -10.103
  362   HG23  VAL  49          HG23      VAL  49  36.289   6.560 -10.273
  363    H    ASP  50           HN       ASP  50  38.866   8.696 -13.664
  364    HA   ASP  50           HA       ASP  50  37.906   8.530 -16.328
  365    HB2  ASP  50           HB2      ASP  50  39.141  10.473 -15.412
  366    HB3  ASP  50           HB1      ASP  50  40.611   9.499 -15.375
  367    H    GLU  51           HN       GLU  51  40.636   6.892 -14.760
  368    HA   GLU  51           HA       GLU  51  41.415   5.617 -17.320
  369    HB2  GLU  51           HB2      GLU  51  42.500   5.428 -14.506
  370    HB3  GLU  51           HB1      GLU  51  43.179   4.560 -15.878
  371    HG2  GLU  51           HG2      GLU  51  43.629   6.677 -17.027
  372    HG3  GLU  51           HG1      GLU  51  42.880   7.573 -15.706
  373    H    ALA  52           HN       ALA  52  39.247   5.051 -14.776
  374    HA   ALA  52           HA       ALA  52  39.420   2.231 -14.436
  375    HB1  ALA  52           HB1      ALA  52  38.038   3.689 -13.008
  376    HB2  ALA  52           HB2      ALA  52  37.090   2.363 -13.675
  377    HB3  ALA  52           HB3      ALA  52  36.948   3.981 -14.364
  378    H    ARG  53           HN       ARG  53  38.316   0.510 -15.466
  379    HA   ARG  53           HA       ARG  53  37.344   1.160 -18.237
  380    HB2  ARG  53           HB2      ARG  53  38.770  -1.242 -17.100
  381    HB3  ARG  53           HB1      ARG  53  37.927  -1.297 -18.649
  382    HG2  ARG  53           HG2      ARG  53  39.303   0.532 -19.507
  383    HG3  ARG  53           HG1      ARG  53  40.094   0.705 -17.938
  384    HD2  ARG  53           HD2      ARG  53  41.060  -1.512 -18.120
  385    HD3  ARG  53           HD1      ARG  53  40.157  -1.825 -19.601
  386    HE   ARG  53           HE       ARG  53  41.772  -0.583 -20.782
  387   HH11  ARG  53          HH21      ARG  53  41.898   0.068 -17.398
  388   HH12  ARG  53          HH22      ARG  53  43.348   1.009 -17.504
  389   HH21  ARG  53          HH11      ARG  53  43.654   0.636 -20.932
  390   HH22  ARG  53          HH12      ARG  53  44.341   1.332 -19.503
  391    H    ARG  54           HN       ARG  54  35.388   0.439 -18.878
  392    HA   ARG  54           HA       ARG  54  33.558  -0.421 -16.794
  393    HB2  ARG  54           HB2      ARG  54  32.030  -0.556 -19.030
  394    HB3  ARG  54           HB1      ARG  54  32.379   0.963 -18.211
  395    HG2  ARG  54           HG2      ARG  54  34.111   1.511 -19.746
  396    HG3  ARG  54           HG1      ARG  54  34.167  -0.132 -20.389
  397    HD2  ARG  54           HD2      ARG  54  31.979   0.125 -21.394
  398    HD3  ARG  54           HD1      ARG  54  31.756   1.690 -20.613
  399    HE   ARG  54           HE       ARG  54  34.129   1.643 -22.277
  400   HH11  ARG  54          HH21      ARG  54  30.695   1.939 -22.211
  401   HH12  ARG  54          HH22      ARG  54  30.617   2.876 -23.666
  402   HH21  ARG  54          HH11      ARG  54  34.045   2.860 -24.170
  403   HH22  ARG  54          HH12      ARG  54  32.515   3.398 -24.776
  404    HA   PRO  55           HA       PRO  55  33.542  -4.822 -17.265
  405    HB2  PRO  55           HB2      PRO  55  30.651  -4.692 -18.048
  406    HB3  PRO  55           HB1      PRO  55  31.430  -5.640 -16.765
  407    HG2  PRO  55           HG2      PRO  55  29.990  -3.419 -16.256
  408    HG3  PRO  55           HG1      PRO  55  31.377  -3.908 -15.268
  409    HD2  PRO  55           HD2      PRO  55  31.160  -1.658 -17.195
  410    HD3  PRO  55           HD1      PRO  55  32.254  -1.872 -15.813
  411    H    GLU  56           HN       GLU  56  34.003  -6.245 -18.904
  412    HA   GLU  56           HA       GLU  56  34.258  -5.421 -21.585
  413    HB2  GLU  56           HB2      GLU  56  33.993  -8.198 -20.400
  414    HB3  GLU  56           HB1      GLU  56  34.462  -7.887 -22.072
  415    HG2  GLU  56           HG2      GLU  56  36.399  -6.585 -21.307
  416    HG3  GLU  56           HG1      GLU  56  35.916  -6.831 -19.629
  Start of MODEL   15
    1    H1   MET   1           HT1      MET   1  40.002  -6.785  19.801
    2    H2   MET   1           HT2      MET   1  41.666  -6.450  19.861
    3    H3   MET   1           HT3      MET   1  41.115  -7.904  19.179
    4    HA   MET   1           HA       MET   1  39.803  -5.941  17.779
    5    HB2  MET   1           HB2      MET   1  41.541  -4.410  18.839
    6    HB3  MET   1           HB1      MET   1  42.759  -5.306  17.931
    7    HG2  MET   1           HG2      MET   1  41.538  -4.769  15.826
    8    HG3  MET   1           HG1      MET   1  40.403  -3.797  16.762
    9    HE1  MET   1           HE1      MET   1  41.171  -2.179  14.769
   10    HE2  MET   1           HE2      MET   1  42.066  -0.784  15.367
   11    HE3  MET   1           HE3      MET   1  40.652  -1.357  16.248
   12    HA   PRO   2           HA       PRO   2  41.942  -9.592  15.756
   13    HB2  PRO   2           HB2      PRO   2  39.692 -11.089  15.251
   14    HB3  PRO   2           HB1      PRO   2  40.624 -11.217  16.755
   15    HG2  PRO   2           HG2      PRO   2  38.042  -9.830  16.243
   16    HG3  PRO   2           HG1      PRO   2  38.606 -10.665  17.700
   17    HD2  PRO   2           HD2      PRO   2  38.595  -7.893  17.372
   18    HD3  PRO   2           HD1      PRO   2  39.604  -8.764  18.544
   19    H    LEU   3           HN       LEU   3  39.662  -7.232  15.036
   20    HA   LEU   3           HA       LEU   3  38.932  -7.968  12.368
   21    HB2  LEU   3           HB2      LEU   3  37.693  -6.262  13.619
   22    HB3  LEU   3           HB1      LEU   3  39.117  -5.223  13.644
   23    HG   LEU   3           HG       LEU   3  39.076  -5.080  11.183
   24   HD11  LEU   3          HD11      LEU   3  36.798  -5.995  10.166
   25   HD12  LEU   3          HD12      LEU   3  36.887  -7.112  11.529
   26   HD13  LEU   3          HD13      LEU   3  38.191  -7.059  10.344
   27   HD21  LEU   3          HD21      LEU   3  36.807  -3.924  10.977
   28   HD22  LEU   3          HD22      LEU   3  37.852  -3.350  12.276
   29   HD23  LEU   3          HD23      LEU   3  36.505  -4.430  12.640
   30    H    GLU   4           HN       GLU   4  39.970  -7.677  10.457
   31    HA   GLU   4           HA       GLU   4  42.787  -7.303  10.374
   32    HB2  GLU   4           HB2      GLU   4  40.679  -7.112   8.210
   33    HB3  GLU   4           HB1      GLU   4  42.414  -7.071   7.885
   34    HG2  GLU   4           HG2      GLU   4  42.691  -9.268   8.928
   35    HG3  GLU   4           HG1      GLU   4  40.979  -9.307   9.349
   36    H    ALA   5           HN       ALA   5  44.031  -5.531  10.184
   37    HA   ALA   5           HA       ALA   5  42.801  -2.885  10.430
   38    HB1  ALA   5           HB1      ALA   5  45.050  -2.096  10.778
   39    HB2  ALA   5           HB2      ALA   5  45.732  -3.554  10.056
   40    HB3  ALA   5           HB3      ALA   5  44.923  -3.641  11.621
   41    H    GLY   6           HN       GLY   6  43.552  -4.914   7.881
   42    HA2  GLY   6           HA2      GLY   6  44.778  -3.486   5.875
   43    HA3  GLY   6           HA1      GLY   6  43.382  -4.512   5.556
   44    H    LEU   7           HN       LEU   7  44.497  -1.518   5.035
   45    HA   LEU   7           HA       LEU   7  42.254   0.166   5.704
   46    HB2  LEU   7           HB2      LEU   7  44.313   0.520   3.505
   47    HB3  LEU   7           HB1      LEU   7  43.318   1.791   4.217
   48    HG   LEU   7           HG       LEU   7  45.382   0.128   5.695
   49   HD11  LEU   7          HD11      LEU   7  46.567   2.341   5.864
   50   HD12  LEU   7          HD12      LEU   7  45.386   3.004   4.735
   51   HD13  LEU   7          HD13      LEU   7  46.470   1.712   4.220
   52   HD21  LEU   7          HD21      LEU   7  43.379   2.213   6.555
   53   HD22  LEU   7          HD22      LEU   7  44.908   2.061   7.421
   54   HD23  LEU   7          HD23      LEU   7  43.805   0.690   7.338
   55    H    LEU   8           HN       LEU   8  42.643  -2.294   3.450
   56    HA   LEU   8           HA       LEU   8  41.130  -1.285   1.239
   57    HB2  LEU   8           HB2      LEU   8  41.785  -4.036   2.259
   58    HB3  LEU   8           HB1      LEU   8  40.694  -3.831   0.888
   59    HG   LEU   8           HG       LEU   8  43.106  -4.157   0.236
   60   HD11  LEU   8          HD11      LEU   8  41.246  -2.562  -0.962
   61   HD12  LEU   8          HD12      LEU   8  42.865  -2.806  -1.610
   62   HD13  LEU   8          HD13      LEU   8  42.507  -1.368  -0.656
   63   HD21  LEU   8          HD21      LEU   8  44.739  -2.485   0.736
   64   HD22  LEU   8          HD22      LEU   8  43.912  -2.800   2.263
   65   HD23  LEU   8          HD23      LEU   8  43.515  -1.360   1.323
   66    H    GLU   9           HN       GLU   9  40.238  -2.728   4.300
   67    HA   GLU   9           HA       GLU   9  37.522  -3.353   3.702
   68    HB2  GLU   9           HB2      GLU   9  38.820  -2.496   6.300
   69    HB3  GLU   9           HB1      GLU   9  37.193  -3.163   6.177
   70    HG2  GLU   9           HG2      GLU   9  39.697  -4.578   5.216
   71    HG3  GLU   9           HG1      GLU   9  38.919  -4.881   6.771
   72    H    ILE  10           HN       ILE  10  39.114  -0.329   4.331
   73    HA   ILE  10           HA       ILE  10  36.467   1.066   4.464
   74    HB   ILE  10           HB       ILE  10  37.762   2.984   5.354
   75   HG12  ILE  10          HG12      ILE  10  40.096   1.041   5.417
   76   HG13  ILE  10          HG11      ILE  10  39.941   2.345   4.239
   77   HG21  ILE  10          HG21      ILE  10  36.766   1.117   6.783
   78   HG22  ILE  10          HG22      ILE  10  38.046   2.064   7.541
   79   HG23  ILE  10          HG23      ILE  10  38.399   0.461   6.896
   80   HD11  ILE  10          HD11      ILE  10  39.709   3.933   6.227
   81   HD12  ILE  10          HD12      ILE  10  41.305   3.219   6.000
   82   HD13  ILE  10          HD13      ILE  10  40.224   2.586   7.242
   83    H    LEU  11           HN       LEU  11  37.494   0.048   1.987
   84    HA   LEU  11           HA       LEU  11  38.347   2.570   0.614
   85    HB2  LEU  11           HB2      LEU  11  39.609   0.232   0.447
   86    HB3  LEU  11           HB1      LEU  11  38.374  -0.105  -0.758
   87    HG   LEU  11           HG       LEU  11  40.309   0.861  -1.873
   88   HD11  LEU  11          HD11      LEU  11  38.300   3.102  -1.680
   89   HD12  LEU  11          HD12      LEU  11  37.894   1.576  -2.464
   90   HD13  LEU  11          HD13      LEU  11  39.208   2.571  -3.090
   91   HD21  LEU  11          HD21      LEU  11  40.739   2.252   0.489
   92   HD22  LEU  11          HD22      LEU  11  40.137   3.527  -0.566
   93   HD23  LEU  11          HD23      LEU  11  41.557   2.595  -1.032
   94    H    ALA  12           HN       ALA  12  36.779   3.624  -0.399
   95    HA   ALA  12           HA       ALA  12  34.474   2.074  -1.534
   96    HB1  ALA  12           HB1      ALA  12  34.346   4.925  -0.553
   97    HB2  ALA  12           HB2      ALA  12  33.996   3.551   0.494
   98    HB3  ALA  12           HB3      ALA  12  33.006   3.844  -0.935
   99    H    CYS  13           HN       CYS  13  34.155   2.345  -3.647
  100    HA   CYS  13           HA       CYS  13  35.993   3.658  -5.308
  101    HB2  CYS  13           HB2      CYS  13  33.984   3.511  -7.013
  102    HB3  CYS  13           HB1      CYS  13  34.770   2.048  -6.431
  103    HA   PRO  14           HA       PRO  14  34.702   7.947  -4.393
  104    HB2  PRO  14           HB2      PRO  14  36.213   8.442  -6.927
  105    HB3  PRO  14           HB1      PRO  14  36.380   9.231  -5.348
  106    HG2  PRO  14           HG2      PRO  14  38.153   7.420  -6.269
  107    HG3  PRO  14           HG1      PRO  14  37.791   7.616  -4.544
  108    HD2  PRO  14           HD2      PRO  14  37.009   5.422  -6.386
  109    HD3  PRO  14           HD1      PRO  14  37.195   5.407  -4.617
  110    H    ALA  15           HN       ALA  15  33.950   5.970  -7.052
  111    HA   ALA  15           HA       ALA  15  32.216   8.028  -8.346
  112    HB1  ALA  15           HB1      ALA  15  31.972   6.317 -10.132
  113    HB2  ALA  15           HB2      ALA  15  33.001   5.231  -9.199
  114    HB3  ALA  15           HB3      ALA  15  33.661   6.736  -9.839
  115    H    CYS  16           HN       CYS  16  31.800   4.530  -7.873
  116    HA   CYS  16           HA       CYS  16  28.930   4.935  -7.372
  117    HB2  CYS  16           HB2      CYS  16  29.702   2.197  -6.936
  118    HB3  CYS  16           HB1      CYS  16  28.818   2.861  -8.306
  119    H    HIS  17           HN       HIS  17  31.767   4.752  -5.519
  120    HA   HIS  17           HA       HIS  17  32.150   4.569  -3.217
  121    HB2  HIS  17           HB2      HIS  17  30.625   6.485  -3.150
  122    HB3  HIS  17           HB1      HIS  17  29.235   5.403  -3.122
  123    HD2  HIS  17           HD2      HIS  17  28.522   4.570  -0.577
  124    HE1  HIS  17           HE1      HIS  17  32.039   5.776   1.426
  125    HE2  HIS  17           HE2      HIS  17  29.713   4.808   1.731
  126    H    ALA  18           HN       ALA  18  32.489   2.322  -3.238
  127    HA   ALA  18           HA       ALA  18  30.744   0.865  -1.531
  128    HB1  ALA  18           HB1      ALA  18  29.731   0.874  -4.074
  129    HB2  ALA  18           HB2      ALA  18  29.468  -0.444  -2.936
  130    HB3  ALA  18           HB3      ALA  18  30.744  -0.566  -4.141
  131    HA   PRO  19           HA       PRO  19  34.278  -1.737  -0.996
  132    HB2  PRO  19           HB2      PRO  19  32.699  -4.206  -1.558
  133    HB3  PRO  19           HB1      PRO  19  33.586  -3.746  -0.091
  134    HG2  PRO  19           HG2      PRO  19  30.926  -3.694  -0.169
  135    HG3  PRO  19           HG1      PRO  19  31.847  -2.458   0.712
  136    HD2  PRO  19           HD2      PRO  19  30.518  -2.261  -1.971
  137    HD3  PRO  19           HD1      PRO  19  30.594  -1.072  -0.657
  138    H    LEU  20           HN       LEU  20  35.885  -2.963  -2.084
  139    HA   LEU  20           HA       LEU  20  35.437  -3.298  -5.032
  140    HB2  LEU  20           HB2      LEU  20  38.045  -2.804  -3.578
  141    HB3  LEU  20           HB1      LEU  20  37.783  -2.821  -5.322
  142    HG   LEU  20           HG       LEU  20  36.490  -0.878  -3.393
  143   HD11  LEU  20          HD11      LEU  20  38.820  -0.332  -3.574
  144   HD12  LEU  20          HD12      LEU  20  37.960   0.771  -4.648
  145   HD13  LEU  20          HD13      LEU  20  38.814  -0.619  -5.315
  146   HD21  LEU  20          HD21      LEU  20  34.994  -1.046  -5.199
  147   HD22  LEU  20          HD22      LEU  20  36.287  -1.348  -6.364
  148   HD23  LEU  20          HD23      LEU  20  36.046   0.269  -5.714
  149    H    GLU  21           HN       GLU  21  36.267  -5.127  -6.030
  150    HA   GLU  21           HA       GLU  21  37.037  -7.366  -4.179
  151    HB2  GLU  21           HB2      GLU  21  34.803  -7.619  -5.265
  152    HB3  GLU  21           HB1      GLU  21  35.599  -7.553  -6.838
  153    HG2  GLU  21           HG2      GLU  21  36.942  -9.524  -6.252
  154    HG3  GLU  21           HG1      GLU  21  36.181  -9.576  -4.662
  155    H    GLU  22           HN       GLU  22  38.895  -8.402  -4.632
  156    HA   GLU  22           HA       GLU  22  40.560  -7.387  -6.855
  157    HB2  GLU  22           HB2      GLU  22  41.143  -9.140  -4.460
  158    HB3  GLU  22           HB1      GLU  22  42.342  -8.763  -5.700
  159    HG2  GLU  22           HG2      GLU  22  42.167  -6.403  -5.246
  160    HG3  GLU  22           HG1      GLU  22  40.812  -6.660  -4.146
  161    H    ARG  23           HN       ARG  23  40.740  -8.458  -8.713
  162    HA   ARG  23           HA       ARG  23  40.189 -11.414  -8.727
  163    HB2  ARG  23           HB2      ARG  23  38.425  -9.955  -9.842
  164    HB3  ARG  23           HB1      ARG  23  39.658  -9.526 -11.029
  165    HG2  ARG  23           HG2      ARG  23  39.971 -11.900 -11.583
  166    HG3  ARG  23           HG1      ARG  23  38.767 -12.351 -10.376
  167    HD2  ARG  23           HD2      ARG  23  37.710 -12.329 -12.565
  168    HD3  ARG  23           HD1      ARG  23  37.082 -10.983 -11.619
  169    HE   ARG  23           HE       ARG  23  38.216  -9.473 -13.070
  170   HH11  ARG  23          HH21      ARG  23  39.079 -12.770 -13.627
  171   HH12  ARG  23          HH22      ARG  23  39.887 -12.437 -15.120
  172   HH21  ARG  23          HH11      ARG  23  39.262  -9.031 -15.011
  173   HH22  ARG  23          HH12      ARG  23  39.991 -10.323 -15.905
  174    H    ASP  24           HN       ASP  24  42.080 -12.388  -9.009
  175    HA   ASP  24           HA       ASP  24  44.222 -12.886  -9.807
  176    HB2  ASP  24           HB2      ASP  24  42.986 -11.517 -12.204
  177    HB3  ASP  24           HB1      ASP  24  44.577 -12.275 -12.250
  178    H    ALA  25           HN       ALA  25  44.032  -9.964 -11.733
  179    HA   ALA  25           HA       ALA  25  45.873  -8.562  -9.851
  180    HB1  ALA  25           HB1      ALA  25  47.167  -9.803 -11.657
  181    HB2  ALA  25           HB2      ALA  25  47.446  -8.063 -11.599
  182    HB3  ALA  25           HB3      ALA  25  46.383  -8.746 -12.829
  183    H    GLU  26           HN       GLU  26  43.021  -8.296 -10.660
  184    HA   GLU  26           HA       GLU  26  43.170  -5.434 -11.535
  185    HB2  GLU  26           HB2      GLU  26  41.326  -7.551 -12.657
  186    HB3  GLU  26           HB1      GLU  26  41.106  -5.818 -12.907
  187    HG2  GLU  26           HG2      GLU  26  43.305  -5.660 -13.963
  188    HG3  GLU  26           HG1      GLU  26  43.598  -7.371 -13.656
  189    H    LEU  27           HN       LEU  27  41.385  -4.146 -10.845
  190    HA   LEU  27           HA       LEU  27  40.029  -5.268  -8.433
  191    HB2  LEU  27           HB2      LEU  27  40.974  -2.539  -9.233
  192    HB3  LEU  27           HB1      LEU  27  39.638  -2.661  -8.091
  193    HG   LEU  27           HG       LEU  27  41.946  -2.515  -7.049
  194   HD11  LEU  27          HD11      LEU  27  39.834  -3.608  -6.014
  195   HD12  LEU  27          HD12      LEU  27  41.390  -3.959  -5.274
  196   HD13  LEU  27          HD13      LEU  27  40.637  -5.134  -6.337
  197   HD21  LEU  27          HD21      LEU  27  42.259  -5.406  -7.880
  198   HD22  LEU  27          HD22      LEU  27  43.475  -4.317  -7.216
  199   HD23  LEU  27          HD23      LEU  27  42.908  -4.097  -8.870
  200    H    ILE  28           HN       ILE  28  37.908  -5.404  -8.304
  201    HA   ILE  28           HA       ILE  28  36.295  -4.246 -10.546
  202    HB   ILE  28           HB       ILE  28  35.934  -6.865  -9.090
  203   HG12  ILE  28          HG12      ILE  28  36.430  -6.261 -12.022
  204   HG13  ILE  28          HG11      ILE  28  37.704  -6.709 -10.887
  205   HG21  ILE  28          HG21      ILE  28  33.747  -5.987  -9.489
  206   HG22  ILE  28          HG22      ILE  28  34.054  -7.102 -10.818
  207   HG23  ILE  28          HG23      ILE  28  34.207  -5.364 -11.073
  208   HD11  ILE  28          HD11      ILE  28  36.945  -8.698 -12.080
  209   HD12  ILE  28          HD12      ILE  28  35.278  -8.374 -11.611
  210   HD13  ILE  28          HD13      ILE  28  36.468  -8.813 -10.387
  211    H    CYS  29           HN       CYS  29  34.720  -2.907  -9.972
  212    HA   CYS  29           HA       CYS  29  34.322  -2.132  -7.238
  213    HB2  CYS  29           HB2      CYS  29  33.364  -1.337  -9.876
  214    HB3  CYS  29           HB1      CYS  29  32.083  -1.242  -8.694
  215    H    THR  30           HN       THR  30  33.098  -3.081  -5.700
  216    HA   THR  30           HA       THR  30  31.048  -5.076  -6.583
  217    HB   THR  30           HB       THR  30  32.161  -5.012  -3.795
  218    HG1  THR  30           HG1      THR  30  33.471  -6.240  -5.980
  219   HG21  THR  30          HG21      THR  30  30.356  -6.578  -4.482
  220   HG22  THR  30          HG22      THR  30  31.825  -7.429  -4.001
  221   HG23  THR  30          HG23      THR  30  31.430  -7.244  -5.710
  222    H    GLY  31           HN       GLY  31  28.997  -4.592  -6.138
  223    HA2  GLY  31           HA2      GLY  31  27.863  -3.635  -3.825
  224    HA3  GLY  31           HA1      GLY  31  28.310  -2.162  -4.686
  225    H    GLN  32           HN       GLN  32  25.830  -2.032  -4.504
  226    HA   GLN  32           HA       GLN  32  24.221  -3.685  -6.261
  227    HB2  GLN  32           HB2      GLN  32  23.279  -2.485  -4.307
  228    HB3  GLN  32           HB1      GLN  32  23.658  -0.949  -5.088
  229    HG2  GLN  32           HG2      GLN  32  22.148  -1.423  -6.913
  230    HG3  GLN  32           HG1      GLN  32  21.877  -3.062  -6.324
  231   HE21  GLN  32          HE21      GLN  32  19.685  -1.290  -6.677
  232   HE22  GLN  32          HE22      GLN  32  19.056  -0.889  -5.152
  233    H    ASP  33           HN       ASP  33  25.174  -0.243  -6.465
  234    HA   ASP  33           HA       ASP  33  24.528  -0.232  -9.351
  235    HB2  ASP  33           HB2      ASP  33  25.484   1.930  -7.452
  236    HB3  ASP  33           HB1      ASP  33  25.148   2.202  -9.162
  237    H    CYS  34           HN       CYS  34  27.039  -1.350  -7.661
  238    HA   CYS  34           HA       CYS  34  29.256  -0.082  -9.082
  239    HB2  CYS  34           HB2      CYS  34  28.902  -2.078  -6.947
  240    HB3  CYS  34           HB1      CYS  34  30.287  -2.401  -7.975
  241    H    GLY  35           HN       GLY  35  30.821  -1.529 -10.270
  242    HA2  GLY  35           HA2      GLY  35  30.413  -3.958 -11.456
  243    HA3  GLY  35           HA1      GLY  35  29.396  -2.891 -12.429
  244    H    LEU  36           HN       LEU  36  31.617  -0.798 -11.513
  245    HA   LEU  36           HA       LEU  36  33.040  -0.839 -14.020
  246    HB2  LEU  36           HB2      LEU  36  33.665   0.713 -11.497
  247    HB3  LEU  36           HB1      LEU  36  34.261   1.076 -13.118
  248    HG   LEU  36           HG       LEU  36  31.343   1.052 -12.289
  249   HD11  LEU  36          HD11      LEU  36  33.040   3.434 -13.064
  250   HD12  LEU  36          HD12      LEU  36  32.822   2.932 -11.388
  251   HD13  LEU  36          HD13      LEU  36  31.430   3.437 -12.344
  252   HD21  LEU  36          HD21      LEU  36  31.313   0.555 -14.581
  253   HD22  LEU  36          HD22      LEU  36  32.777   1.485 -14.906
  254   HD23  LEU  36          HD23      LEU  36  31.251   2.315 -14.601
  255    H    ALA  37           HN       ALA  37  35.352  -1.017 -14.295
  256    HA   ALA  37           HA       ALA  37  36.675  -2.766 -12.250
  257    HB1  ALA  37           HB1      ALA  37  36.608  -3.027 -15.252
  258    HB2  ALA  37           HB2      ALA  37  36.107  -4.216 -14.050
  259    HB3  ALA  37           HB3      ALA  37  37.818  -3.837 -14.256
  260    H    TYR  38           HN       TYR  38  38.839  -2.445 -11.929
  261    HA   TYR  38           HA       TYR  38  40.085  -0.160 -13.377
  262    HB2  TYR  38           HB2      TYR  38  40.184  -0.685 -10.407
  263    HB3  TYR  38           HB1      TYR  38  41.122   0.548 -11.252
  264    HD1  TYR  38           HD2      TYR  38  37.667  -0.595 -10.507
  265    HD2  TYR  38           HD1      TYR  38  40.147   2.620 -11.899
  266    HE1  TYR  38           HE2      TYR  38  35.726   0.942 -10.412
  267    HE2  TYR  38           HE1      TYR  38  38.206   4.159 -11.808
  268    HH   TYR  38           HH       TYR  38  35.638   3.885 -11.926
  269    HA   PRO  39           HA       PRO  39  43.269  -3.330 -13.758
  270    HB2  PRO  39           HB2      PRO  39  45.098  -1.906 -15.177
  271    HB3  PRO  39           HB1      PRO  39  43.579  -2.477 -15.899
  272    HG2  PRO  39           HG2      PRO  39  44.272   0.237 -14.860
  273    HG3  PRO  39           HG1      PRO  39  43.393  -0.213 -16.333
  274    HD2  PRO  39           HD2      PRO  39  42.143   0.596 -14.022
  275    HD3  PRO  39           HD1      PRO  39  41.391  -0.492 -15.213
  276    H    VAL  40           HN       VAL  40  45.562  -3.631 -13.144
  277    HA   VAL  40           HA       VAL  40  46.329  -1.881 -10.845
  278    HB   VAL  40           HB       VAL  40  46.931  -4.779 -11.463
  279   HG11  VAL  40          HG11      VAL  40  48.098  -2.890  -9.408
  280   HG12  VAL  40          HG12      VAL  40  48.956  -3.946 -10.530
  281   HG13  VAL  40          HG13      VAL  40  48.086  -4.636  -9.159
  282   HG21  VAL  40          HG21      VAL  40  45.623  -5.236  -9.517
  283   HG22  VAL  40          HG22      VAL  40  44.701  -4.039 -10.427
  284   HG23  VAL  40          HG23      VAL  40  45.641  -3.544  -9.019
  285    H    ARG  41           HN       ARG  41  48.191  -0.776 -10.942
  286    HA   ARG  41           HA       ARG  41  50.101  -1.411 -13.173
  287    HB2  ARG  41           HB2      ARG  41  48.815   0.669 -13.579
  288    HB3  ARG  41           HB1      ARG  41  49.418   1.318 -12.054
  289    HG2  ARG  41           HG2      ARG  41  51.720   1.160 -12.857
  290    HG3  ARG  41           HG1      ARG  41  51.170   0.409 -14.355
  291    HD2  ARG  41           HD2      ARG  41  51.579   2.774 -14.761
  292    HD3  ARG  41           HD1      ARG  41  49.843   2.471 -14.846
  293    HE   ARG  41           HE       ARG  41  50.550   3.224 -12.173
  294   HH11  ARG  41          HH21      ARG  41  50.236   4.445 -15.384
  295   HH12  ARG  41          HH22      ARG  41  49.854   6.054 -14.872
  296   HH21  ARG  41          HH11      ARG  41  50.055   5.314 -11.494
  297   HH22  ARG  41          HH12      ARG  41  49.752   6.546 -12.673
  298    H    ASP  42           HN       ASP  42  52.101  -1.828 -12.540
  299    HA   ASP  42           HA       ASP  42  53.971  -2.089 -11.177
  300    HB2  ASP  42           HB2      ASP  42  53.875   0.426 -11.412
  301    HB3  ASP  42           HB1      ASP  42  53.049   0.472  -9.854
  302    H    GLY  43           HN       GLY  43  51.366  -3.192 -10.329
  303    HA2  GLY  43           HA2      GLY  43  50.781  -4.580  -8.507
  304    HA3  GLY  43           HA1      GLY  43  52.164  -3.940  -7.618
  305    H    ILE  44           HN       ILE  44  50.485  -1.351  -8.883
  306    HA   ILE  44           HA       ILE  44  49.016  -1.004  -6.305
  307    HB   ILE  44           HB       ILE  44  49.996   1.163  -8.162
  308   HG12  ILE  44          HG12      ILE  44  51.169   0.093  -5.575
  309   HG13  ILE  44          HG11      ILE  44  51.856  -0.156  -7.180
  310   HG21  ILE  44          HG21      ILE  44  48.051   1.681  -6.638
  311   HG22  ILE  44          HG22      ILE  44  49.494   2.628  -6.279
  312   HG23  ILE  44          HG23      ILE  44  49.074   1.245  -5.269
  313   HD11  ILE  44          HD11      ILE  44  51.878   2.400  -7.393
  314   HD12  ILE  44          HD12      ILE  44  53.049   1.690  -6.282
  315   HD13  ILE  44          HD13      ILE  44  51.578   2.434  -5.655
  316    HA   PRO  45           HA       PRO  45  45.368  -1.089  -8.936
  317    HB2  PRO  45           HB2      PRO  45  43.514  -0.317  -7.062
  318    HB3  PRO  45           HB1      PRO  45  44.205  -1.949  -7.146
  319    HG2  PRO  45           HG2      PRO  45  44.902   0.307  -5.328
  320    HG3  PRO  45           HG1      PRO  45  44.801  -1.431  -4.988
  321    HD2  PRO  45           HD2      PRO  45  47.171  -0.113  -5.398
  322    HD3  PRO  45           HD1      PRO  45  46.940  -1.843  -5.750
  323    H    VAL  46           HN       VAL  46  44.165   0.380 -10.142
  324    HA   VAL  46           HA       VAL  46  44.938   3.217  -9.827
  325    HB   VAL  46           HB       VAL  46  43.270   1.824 -11.938
  326   HG11  VAL  46          HG11      VAL  46  42.652   4.115 -11.974
  327   HG12  VAL  46          HG12      VAL  46  43.904   3.980 -13.208
  328   HG13  VAL  46          HG13      VAL  46  44.295   4.650 -11.625
  329   HG21  VAL  46          HG21      VAL  46  45.738   1.198 -11.699
  330   HG22  VAL  46          HG22      VAL  46  46.104   2.868 -12.132
  331   HG23  VAL  46          HG23      VAL  46  45.256   1.828 -13.275
  332    H    LEU  47           HN       LEU  47  43.676   4.613  -8.756
  333    HA   LEU  47           HA       LEU  47  40.791   3.937  -8.289
  334    HB2  LEU  47           HB2      LEU  47  42.561   5.836  -6.722
  335    HB3  LEU  47           HB1      LEU  47  40.947   5.276  -6.275
  336    HG   LEU  47           HG       LEU  47  43.393   3.504  -6.585
  337   HD11  LEU  47          HD11      LEU  47  43.260   3.282  -4.137
  338   HD12  LEU  47          HD12      LEU  47  41.897   4.400  -4.102
  339   HD13  LEU  47          HD13      LEU  47  43.492   4.970  -4.594
  340   HD21  LEU  47          HD21      LEU  47  40.485   2.979  -5.957
  341   HD22  LEU  47          HD22      LEU  47  41.735   1.900  -5.339
  342   HD23  LEU  47          HD23      LEU  47  41.547   2.123  -7.076
  343    H    LEU  48           HN       LEU  48  41.892   5.217 -10.700
  344    HA   LEU  48           HA       LEU  48  40.870   8.012 -10.426
  345    HB2  LEU  48           HB2      LEU  48  42.364   6.727 -12.727
  346    HB3  LEU  48           HB1      LEU  48  41.979   8.439 -12.553
  347    HG   LEU  48           HG       LEU  48  43.722   6.836 -10.659
  348   HD11  LEU  48          HD11      LEU  48  45.562   8.205 -11.587
  349   HD12  LEU  48          HD12      LEU  48  44.433   8.942 -12.724
  350   HD13  LEU  48          HD13      LEU  48  44.802   7.220 -12.836
  351   HD21  LEU  48          HD21      LEU  48  42.709   9.678 -10.680
  352   HD22  LEU  48          HD22      LEU  48  44.274   9.314  -9.951
  353   HD23  LEU  48          HD23      LEU  48  42.817   8.547  -9.330
  354    H    VAL  49           HN       VAL  49  39.001   8.580 -11.319
  355    HA   VAL  49           HA       VAL  49  37.148   6.637 -12.312
  356    HB   VAL  49           HB       VAL  49  37.124   9.659 -12.500
  357   HG11  VAL  49          HG11      VAL  49  35.018   7.558 -13.047
  358   HG12  VAL  49          HG12      VAL  49  35.586   8.828 -14.132
  359   HG13  VAL  49          HG13      VAL  49  34.615   9.242 -12.719
  360   HG21  VAL  49          HG21      VAL  49  36.002   7.668 -10.511
  361   HG22  VAL  49          HG22      VAL  49  35.467   9.347 -10.590
  362   HG23  VAL  49          HG23      VAL  49  37.146   8.975 -10.198
  363    H    ASP  50           HN       ASP  50  39.170   9.063 -13.928
  364    HA   ASP  50           HA       ASP  50  38.147   8.752 -16.560
  365    HB2  ASP  50           HB2      ASP  50  40.911   9.456 -15.555
  366    HB3  ASP  50           HB1      ASP  50  40.468   9.516 -17.261
  367    H    GLU  51           HN       GLU  51  40.676   6.937 -14.847
  368    HA   GLU  51           HA       GLU  51  41.182   5.234 -17.190
  369    HB2  GLU  51           HB2      GLU  51  42.137   5.050 -14.316
  370    HB3  GLU  51           HB1      GLU  51  42.717   4.033 -15.634
  371    HG2  GLU  51           HG2      GLU  51  42.894   7.062 -15.598
  372    HG3  GLU  51           HG1      GLU  51  44.224   5.979 -15.184
  373    H    ALA  52           HN       ALA  52  38.608   5.420 -15.271
  374    HA   ALA  52           HA       ALA  52  38.233   2.782 -14.233
  375    HB1  ALA  52           HB1      ALA  52  35.858   3.368 -14.134
  376    HB2  ALA  52           HB2      ALA  52  36.133   4.727 -15.225
  377    HB3  ALA  52           HB3      ALA  52  36.834   4.738 -13.609
  378    H    ARG  53           HN       ARG  53  37.454   0.914 -15.179
  379    HA   ARG  53           HA       ARG  53  36.975   1.046 -18.138
  380    HB2  ARG  53           HB2      ARG  53  38.909  -0.377 -16.884
  381    HB3  ARG  53           HB1      ARG  53  37.604  -1.557 -16.806
  382    HG2  ARG  53           HG2      ARG  53  38.544  -0.171 -19.338
  383    HG3  ARG  53           HG1      ARG  53  38.972  -1.817 -18.866
  384    HD2  ARG  53           HD2      ARG  53  36.514  -2.352 -18.784
  385    HD3  ARG  53           HD1      ARG  53  36.201  -0.756 -19.458
  386    HE   ARG  53           HE       ARG  53  37.388  -3.037 -20.894
  387   HH11  ARG  53          HH21      ARG  53  36.663   0.345 -20.758
  388   HH12  ARG  53          HH22      ARG  53  36.794   0.565 -22.470
  389   HH21  ARG  53          HH11      ARG  53  37.558  -2.753 -23.109
  390   HH22  ARG  53          HH12      ARG  53  37.301  -1.186 -23.799
  391    H    ARG  54           HN       ARG  54  34.938   0.779 -18.701
  392    HA   ARG  54           HA       ARG  54  32.973  -0.271 -16.808
  393    HB2  ARG  54           HB2      ARG  54  31.431   0.171 -18.869
  394    HB3  ARG  54           HB1      ARG  54  32.141   1.551 -18.034
  395    HG2  ARG  54           HG2      ARG  54  33.807   1.846 -19.707
  396    HG3  ARG  54           HG1      ARG  54  33.497   0.256 -20.408
  397    HD2  ARG  54           HD2      ARG  54  31.361   0.950 -21.253
  398    HD3  ARG  54           HD1      ARG  54  31.413   2.449 -20.327
  399    HE   ARG  54           HE       ARG  54  32.711   3.387 -22.049
  400   HH11  ARG  54          HH21      ARG  54  32.782  -0.064 -22.152
  401   HH12  ARG  54          HH22      ARG  54  33.668  -0.128 -23.638
  402   HH21  ARG  54          HH11      ARG  54  33.858   3.315 -23.981
  403   HH22  ARG  54          HH12      ARG  54  34.277   1.784 -24.673
  404    HA   PRO  55           HA       PRO  55  32.988  -4.426 -18.362
  405    HB2  PRO  55           HB2      PRO  55  30.360  -5.140 -17.984
  406    HB3  PRO  55           HB1      PRO  55  31.523  -4.963 -16.653
  407    HG2  PRO  55           HG2      PRO  55  29.476  -3.016 -17.639
  408    HG3  PRO  55           HG1      PRO  55  29.887  -3.467 -15.972
  409    HD2  PRO  55           HD2      PRO  55  30.825  -1.188 -17.092
  410    HD3  PRO  55           HD1      PRO  55  31.796  -2.125 -15.937
  411    H    GLU  56           HN       GLU  56  32.578  -5.593 -20.230
  412    HA   GLU  56           HA       GLU  56  32.149  -5.802 -22.530
  413    HB2  GLU  56           HB2      GLU  56  29.456  -4.855 -21.498
  414    HB3  GLU  56           HB1      GLU  56  29.719  -5.576 -23.086
  415    HG2  GLU  56           HG2      GLU  56  30.411  -6.933 -20.463
  416    HG3  GLU  56           HG1      GLU  56  28.927  -7.227 -21.370
  Start of MODEL   16
    1    H1   MET   1           HT1      MET   1  23.105 -11.620  10.626
    2    H2   MET   1           HT2      MET   1  21.987 -11.165   9.429
    3    H3   MET   1           HT3      MET   1  21.751 -10.681  11.041
    4    HA   MET   1           HA       MET   1  22.616  -8.758  10.215
    5    HB2  MET   1           HB2      MET   1  25.251 -10.186  10.587
    6    HB3  MET   1           HB1      MET   1  24.826  -8.521  10.990
    7    HG2  MET   1           HG2      MET   1  23.492 -10.872  12.358
    8    HG3  MET   1           HG1      MET   1  25.000 -10.196  12.948
    9    HE1  MET   1           HE1      MET   1  21.926 -10.344  14.454
   10    HE2  MET   1           HE2      MET   1  22.338  -8.977  15.486
   11    HE3  MET   1           HE3      MET   1  23.568 -10.174  15.088
   12    HA   PRO   2           HA       PRO   2  22.535 -10.429   5.830
   13    HB2  PRO   2           HB2      PRO   2  22.701  -7.400   5.990
   14    HB3  PRO   2           HB1      PRO   2  22.029  -8.392   4.657
   15    HG2  PRO   2           HG2      PRO   2  20.421  -7.535   6.557
   16    HG3  PRO   2           HG1      PRO   2  20.294  -9.216   6.002
   17    HD2  PRO   2           HD2      PRO   2  21.291  -8.229   8.615
   18    HD3  PRO   2           HD1      PRO   2  20.756  -9.873   8.182
   19    H    LEU   3           HN       LEU   3  24.584  -7.809   4.934
   20    HA   LEU   3           HA       LEU   3  26.644  -9.788   4.361
   21    HB2  LEU   3           HB2      LEU   3  26.880  -6.781   4.097
   22    HB3  LEU   3           HB1      LEU   3  27.845  -8.007   3.271
   23    HG   LEU   3           HG       LEU   3  24.860  -7.560   2.923
   24   HD11  LEU   3          HD11      LEU   3  26.047  -5.884   1.682
   25   HD12  LEU   3          HD12      LEU   3  25.608  -7.134   0.517
   26   HD13  LEU   3          HD13      LEU   3  27.257  -7.047   1.136
   27   HD21  LEU   3          HD21      LEU   3  25.099  -9.870   2.672
   28   HD22  LEU   3          HD22      LEU   3  26.734  -9.742   2.015
   29   HD23  LEU   3          HD23      LEU   3  25.343  -9.307   1.022
   30    H    GLU   4           HN       GLU   4  28.212 -10.451   5.541
   31    HA   GLU   4           HA       GLU   4  29.034  -8.983   7.998
   32    HB2  GLU   4           HB2      GLU   4  30.157 -11.130   8.572
   33    HB3  GLU   4           HB1      GLU   4  28.444 -11.373   8.237
   34    HG2  GLU   4           HG2      GLU   4  28.998 -12.076   5.923
   35    HG3  GLU   4           HG1      GLU   4  30.714 -11.868   6.273
   36    H    ALA   5           HN       ALA   5  29.960  -9.566   4.768
   37    HA   ALA   5           HA       ALA   5  32.813  -9.585   4.985
   38    HB1  ALA   5           HB1      ALA   5  31.557 -10.128   2.900
   39    HB2  ALA   5           HB2      ALA   5  32.800  -8.906   2.632
   40    HB3  ALA   5           HB3      ALA   5  31.105  -8.430   2.755
   41    H    GLY   6           HN       GLY   6  30.437  -7.051   5.246
   42    HA2  GLY   6           HA2      GLY   6  32.089  -4.791   4.718
   43    HA3  GLY   6           HA1      GLY   6  30.660  -4.775   5.753
   44    H    LEU   7           HN       LEU   7  31.918  -6.962   7.426
   45    HA   LEU   7           HA       LEU   7  33.074  -5.292   9.439
   46    HB2  LEU   7           HB2      LEU   7  33.221  -8.293   9.025
   47    HB3  LEU   7           HB1      LEU   7  33.750  -7.471  10.490
   48    HG   LEU   7           HG       LEU   7  30.942  -7.293   9.356
   49   HD11  LEU   7          HD11      LEU   7  31.662  -9.591  10.183
   50   HD12  LEU   7          HD12      LEU   7  30.267  -8.894  11.006
   51   HD13  LEU   7          HD13      LEU   7  31.851  -8.863  11.779
   52   HD21  LEU   7          HD21      LEU   7  30.620  -6.580  11.898
   53   HD22  LEU   7          HD22      LEU   7  31.151  -5.400  10.705
   54   HD23  LEU   7          HD23      LEU   7  32.329  -6.156  11.778
   55    H    LEU   8           HN       LEU   8  34.513  -7.392   6.970
   56    HA   LEU   8           HA       LEU   8  37.232  -6.968   7.876
   57    HB2  LEU   8           HB2      LEU   8  36.244  -7.869   5.154
   58    HB3  LEU   8           HB1      LEU   8  37.869  -8.091   5.803
   59    HG   LEU   8           HG       LEU   8  35.330  -9.259   6.987
   60   HD11  LEU   8          HD11      LEU   8  36.288 -11.422   6.240
   61   HD12  LEU   8          HD12      LEU   8  37.610 -10.552   5.461
   62   HD13  LEU   8          HD13      LEU   8  35.957 -10.347   4.881
   63   HD21  LEU   8          HD21      LEU   8  37.202 -10.629   8.243
   64   HD22  LEU   8          HD22      LEU   8  36.768  -9.024   8.823
   65   HD23  LEU   8          HD23      LEU   8  38.222  -9.245   7.847
   66    H    GLU   9           HN       GLU   9  38.788  -5.565   7.036
   67    HA   GLU   9           HA       GLU   9  37.906  -3.000   6.145
   68    HB2  GLU   9           HB2      GLU   9  40.064  -3.421   7.321
   69    HB3  GLU   9           HB1      GLU   9  40.665  -4.236   5.876
   70    HG2  GLU   9           HG2      GLU   9  40.408  -2.183   4.572
   71    HG3  GLU   9           HG1      GLU   9  39.718  -1.357   5.969
   72    H    ILE  10           HN       ILE  10  36.705  -3.087   4.239
   73    HA   ILE  10           HA       ILE  10  38.019  -4.281   1.827
   74    HB   ILE  10           HB       ILE  10  35.713  -5.075   2.422
   75   HG12  ILE  10          HG12      ILE  10  34.758  -4.719   0.141
   76   HG13  ILE  10          HG11      ILE  10  35.990  -3.496  -0.159
   77   HG21  ILE  10          HG21      ILE  10  34.834  -2.294   1.623
   78   HG22  ILE  10          HG22      ILE  10  35.023  -2.786   3.306
   79   HG23  ILE  10          HG23      ILE  10  33.842  -3.596   2.278
   80   HD11  ILE  10          HD11      ILE  10  36.921  -6.195   0.755
   81   HD12  ILE  10          HD12      ILE  10  37.684  -5.054  -0.353
   82   HD13  ILE  10          HD13      ILE  10  36.333  -6.042  -0.901
   83    H    LEU  11           HN       LEU  11  38.569  -2.977   0.137
   84    HA   LEU  11           HA       LEU  11  38.785  -0.142   0.575
   85    HB2  LEU  11           HB2      LEU  11  39.068  -1.695  -2.011
   86    HB3  LEU  11           HB1      LEU  11  39.696  -0.077  -1.692
   87    HG   LEU  11           HG       LEU  11  40.497  -2.596  -0.204
   88   HD11  LEU  11          HD11      LEU  11  42.098  -0.917  -2.153
   89   HD12  LEU  11          HD12      LEU  11  41.283  -2.418  -2.591
   90   HD13  LEU  11          HD13      LEU  11  42.589  -2.437  -1.406
   91   HD21  LEU  11          HD21      LEU  11  40.842  -0.871   1.345
   92   HD22  LEU  11          HD22      LEU  11  41.190   0.326   0.095
   93   HD23  LEU  11          HD23      LEU  11  42.392  -0.898   0.506
   94    H    ALA  12           HN       ALA  12  37.712   1.560  -0.505
   95    HA   ALA  12           HA       ALA  12  35.026   0.848  -1.626
   96    HB1  ALA  12           HB1      ALA  12  34.364   3.148  -0.842
   97    HB2  ALA  12           HB2      ALA  12  35.931   3.261  -0.040
   98    HB3  ALA  12           HB3      ALA  12  34.771   2.030   0.460
   99    H    CYS  13           HN       CYS  13  34.293   2.043  -3.429
  100    HA   CYS  13           HA       CYS  13  36.324   2.812  -5.326
  101    HB2  CYS  13           HB2      CYS  13  33.671   3.819  -6.019
  102    HB3  CYS  13           HB1      CYS  13  34.607   2.554  -6.808
  103    HA   PRO  14           HA       PRO  14  36.716   7.132  -4.489
  104    HB2  PRO  14           HB2      PRO  14  37.039   8.228  -6.974
  105    HB3  PRO  14           HB1      PRO  14  38.270   7.198  -6.213
  106    HG2  PRO  14           HG2      PRO  14  36.256   6.503  -8.305
  107    HG3  PRO  14           HG1      PRO  14  37.948   6.001  -8.158
  108    HD2  PRO  14           HD2      PRO  14  35.818   4.412  -7.416
  109    HD3  PRO  14           HD1      PRO  14  37.444   4.267  -6.716
  110    H    ALA  15           HN       ALA  15  35.111   7.637  -7.590
  111    HA   ALA  15           HA       ALA  15  33.306   9.595  -6.549
  112    HB1  ALA  15           HB1      ALA  15  32.369   9.659  -8.742
  113    HB2  ALA  15           HB2      ALA  15  32.881   8.006  -9.085
  114    HB3  ALA  15           HB3      ALA  15  34.079   9.293  -8.970
  115    H    CYS  16           HN       CYS  16  32.763   6.194  -7.525
  116    HA   CYS  16           HA       CYS  16  30.049   6.311  -6.301
  117    HB2  CYS  16           HB2      CYS  16  29.690   4.155  -7.373
  118    HB3  CYS  16           HB1      CYS  16  30.307   5.302  -8.558
  119    H    HIS  17           HN       HIS  17  31.442   6.538  -4.199
  120    HA   HIS  17           HA       HIS  17  32.994   4.632  -2.993
  121    HB2  HIS  17           HB2      HIS  17  32.226   6.716  -1.887
  122    HB3  HIS  17           HB1      HIS  17  30.629   5.995  -1.677
  123    HD2  HIS  17           HD2      HIS  17  34.087   5.967   0.062
  124    HE1  HIS  17           HE1      HIS  17  31.760   2.964   1.909
  125    HE2  HIS  17           HE2      HIS  17  33.917   4.292   2.055
  126    H    ALA  18           HN       ALA  18  32.792   2.495  -2.821
  127    HA   ALA  18           HA       ALA  18  30.550   1.225  -1.628
  128    HB1  ALA  18           HB1      ALA  18  30.551   0.148  -4.370
  129    HB2  ALA  18           HB2      ALA  18  30.043   1.831  -4.302
  130    HB3  ALA  18           HB3      ALA  18  29.184   0.617  -3.359
  131    HA   PRO  19           HA       PRO  19  33.481  -2.042  -1.033
  132    HB2  PRO  19           HB2      PRO  19  31.488  -3.987  -2.135
  133    HB3  PRO  19           HB1      PRO  19  32.371  -4.038  -0.601
  134    HG2  PRO  19           HG2      PRO  19  29.794  -3.367  -0.698
  135    HG3  PRO  19           HG1      PRO  19  30.912  -2.579   0.429
  136    HD2  PRO  19           HD2      PRO  19  29.718  -1.503  -2.096
  137    HD3  PRO  19           HD1      PRO  19  30.180  -0.658  -0.601
  138    H    LEU  20           HN       LEU  20  35.167  -2.849  -2.210
  139    HA   LEU  20           HA       LEU  20  34.833  -3.076  -5.192
  140    HB2  LEU  20           HB2      LEU  20  37.345  -2.597  -3.566
  141    HB3  LEU  20           HB1      LEU  20  37.214  -2.572  -5.323
  142    HG   LEU  20           HG       LEU  20  35.736  -0.699  -3.453
  143   HD11  LEU  20          HD11      LEU  20  37.356   0.971  -4.552
  144   HD12  LEU  20          HD12      LEU  20  38.298  -0.430  -5.034
  145   HD13  LEU  20          HD13      LEU  20  38.022  -0.093  -3.326
  146   HD21  LEU  20          HD21      LEU  20  35.852  -1.043  -6.454
  147   HD22  LEU  20          HD22      LEU  20  35.534   0.547  -5.760
  148   HD23  LEU  20          HD23      LEU  20  34.445  -0.795  -5.418
  149    H    GLU  21           HN       GLU  21  35.747  -4.875  -6.247
  150    HA   GLU  21           HA       GLU  21  36.549  -7.160  -4.457
  151    HB2  GLU  21           HB2      GLU  21  34.422  -7.468  -5.776
  152    HB3  GLU  21           HB1      GLU  21  35.366  -7.285  -7.253
  153    HG2  GLU  21           HG2      GLU  21  35.134  -9.647  -6.819
  154    HG3  GLU  21           HG1      GLU  21  36.804  -9.209  -6.466
  155    H    GLU  22           HN       GLU  22  38.695  -7.520  -4.574
  156    HA   GLU  22           HA       GLU  22  40.207  -6.678  -6.996
  157    HB2  GLU  22           HB2      GLU  22  41.008  -5.914  -4.770
  158    HB3  GLU  22           HB1      GLU  22  41.238  -7.601  -4.306
  159    HG2  GLU  22           HG2      GLU  22  42.851  -7.917  -6.117
  160    HG3  GLU  22           HG1      GLU  22  42.577  -6.269  -6.679
  161    H    ARG  23           HN       ARG  23  40.752  -8.185  -8.476
  162    HA   ARG  23           HA       ARG  23  41.095 -11.027  -7.545
  163    HB2  ARG  23           HB2      ARG  23  40.196 -11.620  -9.893
  164    HB3  ARG  23           HB1      ARG  23  39.024 -11.101  -8.683
  165    HG2  ARG  23           HG2      ARG  23  39.040  -8.831  -9.589
  166    HG3  ARG  23           HG1      ARG  23  40.280  -9.287 -10.757
  167    HD2  ARG  23           HD2      ARG  23  38.145  -9.364 -11.886
  168    HD3  ARG  23           HD1      ARG  23  38.692 -11.023 -11.653
  169    HE   ARG  23           HE       ARG  23  37.060 -10.236  -9.429
  170   HH11  ARG  23          HH21      ARG  23  36.983 -11.021 -12.783
  171   HH12  ARG  23          HH22      ARG  23  35.357 -11.617 -12.745
  172   HH21  ARG  23          HH11      ARG  23  34.934 -11.004  -9.357
  173   HH22  ARG  23          HH12      ARG  23  34.197 -11.607 -10.804
  174    H    ASP  24           HN       ASP  24  43.035 -11.797  -8.029
  175    HA   ASP  24           HA       ASP  24  45.185 -11.964  -8.934
  176    HB2  ASP  24           HB2      ASP  24  43.559 -11.191 -11.368
  177    HB3  ASP  24           HB1      ASP  24  45.265 -11.626 -11.454
  178    H    ALA  25           HN       ALA  25  44.349  -9.438 -11.206
  179    HA   ALA  25           HA       ALA  25  45.842  -7.415  -9.603
  180    HB1  ALA  25           HB1      ALA  25  46.451  -8.093 -12.499
  181    HB2  ALA  25           HB2      ALA  25  47.478  -8.506 -11.127
  182    HB3  ALA  25           HB3      ALA  25  47.210  -6.815 -11.550
  183    H    GLU  26           HN       GLU  26  43.012  -7.886 -10.409
  184    HA   GLU  26           HA       GLU  26  42.575  -5.243 -11.776
  185    HB2  GLU  26           HB2      GLU  26  41.127  -7.844 -12.375
  186    HB3  GLU  26           HB1      GLU  26  40.681  -6.267 -13.025
  187    HG2  GLU  26           HG2      GLU  26  43.381  -7.592 -13.423
  188    HG3  GLU  26           HG1      GLU  26  42.077  -7.598 -14.611
  189    H    LEU  27           HN       LEU  27  40.927  -4.028 -10.882
  190    HA   LEU  27           HA       LEU  27  39.499  -5.244  -8.539
  191    HB2  LEU  27           HB2      LEU  27  40.360  -2.420  -9.149
  192    HB3  LEU  27           HB1      LEU  27  39.144  -2.770  -7.926
  193    HG   LEU  27           HG       LEU  27  40.862  -4.392  -6.904
  194   HD11  LEU  27          HD11      LEU  27  42.592  -2.893  -8.887
  195   HD12  LEU  27          HD12      LEU  27  42.482  -4.633  -8.629
  196   HD13  LEU  27          HD13      LEU  27  43.258  -3.613  -7.423
  197   HD21  LEU  27          HD21      LEU  27  41.412  -1.412  -6.967
  198   HD22  LEU  27          HD22      LEU  27  42.028  -2.526  -5.746
  199   HD23  LEU  27          HD23      LEU  27  40.293  -2.242  -5.887
  200    H    ILE  28           HN       ILE  28  37.318  -5.289  -8.513
  201    HA   ILE  28           HA       ILE  28  35.855  -3.842 -10.690
  202    HB   ILE  28           HB       ILE  28  35.401  -6.656  -9.703
  203   HG12  ILE  28          HG12      ILE  28  36.057  -5.590 -12.466
  204   HG13  ILE  28          HG11      ILE  28  37.275  -6.197 -11.344
  205   HG21  ILE  28          HG21      ILE  28  33.631  -6.611 -11.548
  206   HG22  ILE  28          HG22      ILE  28  33.792  -4.855 -11.531
  207   HG23  ILE  28          HG23      ILE  28  33.236  -5.703 -10.088
  208   HD11  ILE  28          HD11      ILE  28  34.912  -7.770 -12.404
  209   HD12  ILE  28          HD12      ILE  28  36.117  -8.373 -11.267
  210   HD13  ILE  28          HD13      ILE  28  36.589  -7.958 -12.914
  211    H    CYS  29           HN       CYS  29  34.166  -2.626 -10.033
  212    HA   CYS  29           HA       CYS  29  33.695  -2.137  -7.264
  213    HB2  CYS  29           HB2      CYS  29  32.233  -1.528  -9.814
  214    HB3  CYS  29           HB1      CYS  29  31.375  -1.278  -8.295
  215    H    THR  30           HN       THR  30  32.660  -3.438  -5.768
  216    HA   THR  30           HA       THR  30  31.029  -5.721  -6.798
  217    HB   THR  30           HB       THR  30  31.569  -5.440  -3.871
  218    HG1  THR  30           HG1      THR  30  33.682  -5.697  -4.016
  219   HG21  THR  30          HG21      THR  30  31.981  -7.808  -4.019
  220   HG22  THR  30          HG22      THR  30  32.083  -7.730  -5.778
  221   HG23  THR  30          HG23      THR  30  30.539  -7.456  -4.972
  222    H    GLY  31           HN       GLY  31  30.754  -2.659  -5.235
  223    HA2  GLY  31           HA2      GLY  31  28.273  -3.076  -3.850
  224    HA3  GLY  31           HA1      GLY  31  28.905  -1.511  -4.361
  225    H    GLN  32           HN       GLN  32  26.183  -2.984  -4.594
  226    HA   GLN  32           HA       GLN  32  25.652  -3.376  -7.379
  227    HB2  GLN  32           HB2      GLN  32  24.163  -4.160  -5.542
  228    HB3  GLN  32           HB1      GLN  32  23.743  -2.483  -5.194
  229    HG2  GLN  32           HG2      GLN  32  22.745  -2.209  -7.379
  230    HG3  GLN  32           HG1      GLN  32  23.327  -3.794  -7.895
  231   HE21  GLN  32          HE21      GLN  32  20.540  -3.229  -7.968
  232   HE22  GLN  32          HE22      GLN  32  19.761  -4.151  -6.776
  233    H    ASP  33           HN       ASP  33  26.265  -0.564  -5.550
  234    HA   ASP  33           HA       ASP  33  24.722   1.267  -7.230
  235    HB2  ASP  33           HB2      ASP  33  26.892   1.725  -5.160
  236    HB3  ASP  33           HB1      ASP  33  26.023   3.022  -5.981
  237    H    CYS  34           HN       CYS  34  27.509  -0.510  -7.715
  238    HA   CYS  34           HA       CYS  34  28.227   1.125 -10.046
  239    HB2  CYS  34           HB2      CYS  34  30.737   0.970  -9.165
  240    HB3  CYS  34           HB1      CYS  34  29.696   2.304  -8.693
  241    H    GLY  35           HN       GLY  35  29.959   0.029 -11.325
  242    HA2  GLY  35           HA2      GLY  35  30.498  -2.798 -10.726
  243    HA3  GLY  35           HA1      GLY  35  29.450  -2.523 -12.120
  244    H    LEU  36           HN       LEU  36  31.708  -0.033 -11.493
  245    HA   LEU  36           HA       LEU  36  33.030  -0.427 -14.031
  246    HB2  LEU  36           HB2      LEU  36  33.802   1.372 -11.715
  247    HB3  LEU  36           HB1      LEU  36  34.399   1.499 -13.369
  248    HG   LEU  36           HG       LEU  36  31.496   1.775 -12.535
  249   HD11  LEU  36          HD11      LEU  36  32.966   3.651 -11.806
  250   HD12  LEU  36          HD12      LEU  36  31.794   4.151 -13.026
  251   HD13  LEU  36          HD13      LEU  36  33.475   3.870 -13.480
  252   HD21  LEU  36          HD21      LEU  36  31.483   2.777 -14.983
  253   HD22  LEU  36          HD22      LEU  36  31.393   1.035 -14.757
  254   HD23  LEU  36          HD23      LEU  36  32.928   1.786 -15.190
  255    H    ALA  37           HN       ALA  37  35.359  -0.725 -14.312
  256    HA   ALA  37           HA       ALA  37  36.588  -2.402 -12.162
  257    HB1  ALA  37           HB1      ALA  37  35.932  -3.816 -14.034
  258    HB2  ALA  37           HB2      ALA  37  37.689  -3.684 -13.981
  259    HB3  ALA  37           HB3      ALA  37  36.770  -2.746 -15.158
  260    H    TYR  38           HN       TYR  38  38.745  -2.111 -11.728
  261    HA   TYR  38           HA       TYR  38  40.147   0.070 -13.224
  262    HB2  TYR  38           HB2      TYR  38  40.340  -0.366 -10.240
  263    HB3  TYR  38           HB1      TYR  38  40.964   0.995 -11.171
  264    HD1  TYR  38           HD2      TYR  38  37.801  -0.765 -10.245
  265    HD2  TYR  38           HD1      TYR  38  39.611   2.891 -11.592
  266    HE1  TYR  38           HE2      TYR  38  35.628   0.401  -9.996
  267    HE2  TYR  38           HE1      TYR  38  37.436   4.057 -11.341
  268    HH   TYR  38           HH       TYR  38  35.324   3.887 -10.688
  269    HA   PRO  39           HA       PRO  39  43.180  -3.294 -13.281
  270    HB2  PRO  39           HB2      PRO  39  45.069  -2.150 -14.843
  271    HB3  PRO  39           HB1      PRO  39  43.506  -2.677 -15.505
  272    HG2  PRO  39           HG2      PRO  39  44.390   0.070 -14.722
  273    HG3  PRO  39           HG1      PRO  39  43.493  -0.454 -16.161
  274    HD2  PRO  39           HD2      PRO  39  42.279   0.646 -13.946
  275    HD3  PRO  39           HD1      PRO  39  41.462  -0.489 -15.047
  276    H    VAL  40           HN       VAL  40  45.352  -3.691 -12.423
  277    HA   VAL  40           HA       VAL  40  46.139  -1.696 -10.362
  278    HB   VAL  40           HB       VAL  40  46.889  -4.599 -10.779
  279   HG11  VAL  40          HG11      VAL  40  47.826  -2.549  -8.764
  280   HG12  VAL  40          HG12      VAL  40  48.809  -3.587  -9.797
  281   HG13  VAL  40          HG13      VAL  40  47.912  -4.282  -8.446
  282   HG21  VAL  40          HG21      VAL  40  44.572  -3.981  -9.906
  283   HG22  VAL  40          HG22      VAL  40  45.383  -3.297  -8.498
  284   HG23  VAL  40          HG23      VAL  40  45.529  -5.018  -8.850
  285    H    ARG  41           HN       ARG  41  47.979  -0.498 -10.564
  286    HA   ARG  41           HA       ARG  41  49.728  -1.078 -12.934
  287    HB2  ARG  41           HB2      ARG  41  48.645   1.164 -12.780
  288    HB3  ARG  41           HB1      ARG  41  49.493   1.441 -11.260
  289    HG2  ARG  41           HG2      ARG  41  51.654   1.228 -12.391
  290    HG3  ARG  41           HG1      ARG  41  50.841   0.862 -13.915
  291    HD2  ARG  41           HD2      ARG  41  49.759   3.079 -13.880
  292    HD3  ARG  41           HD1      ARG  41  50.551   3.443 -12.348
  293    HE   ARG  41           HE       ARG  41  52.608   3.747 -13.512
  294   HH11  ARG  41          HH21      ARG  41  50.103   2.452 -15.511
  295   HH12  ARG  41          HH22      ARG  41  50.968   2.719 -16.985
  296   HH21  ARG  41          HH11      ARG  41  53.743   4.092 -15.429
  297   HH22  ARG  41          HH12      ARG  41  53.025   3.644 -16.941
  298    H    ASP  42           HN       ASP  42  51.412  -2.345 -12.312
  299    HA   ASP  42           HA       ASP  42  53.250  -3.123 -11.086
  300    HB2  ASP  42           HB2      ASP  42  53.321  -0.161 -10.467
  301    HB3  ASP  42           HB1      ASP  42  54.593  -1.280  -9.978
  302    H    GLY  43           HN       GLY  43  50.684  -3.373  -9.775
  303    HA2  GLY  43           HA2      GLY  43  50.119  -4.275  -7.647
  304    HA3  GLY  43           HA1      GLY  43  51.654  -3.684  -7.012
  305    H    ILE  44           HN       ILE  44  50.266  -1.179  -8.701
  306    HA   ILE  44           HA       ILE  44  49.111  -0.009  -6.193
  307    HB   ILE  44           HB       ILE  44  50.088   1.475  -8.636
  308   HG12  ILE  44          HG12      ILE  44  51.577   0.686  -6.108
  309   HG13  ILE  44          HG11      ILE  44  51.952   0.162  -7.749
  310   HG21  ILE  44          HG21      ILE  44  49.791   2.352  -5.750
  311   HG22  ILE  44          HG22      ILE  44  48.539   2.590  -6.968
  312   HG23  ILE  44          HG23      ILE  44  50.106   3.376  -7.151
  313   HD11  ILE  44          HD11      ILE  44  53.470   1.951  -7.231
  314   HD12  ILE  44          HD12      ILE  44  52.162   2.963  -6.618
  315   HD13  ILE  44          HD13      ILE  44  52.270   2.610  -8.343
  316    HA   PRO  45           HA       PRO  45  45.237  -0.623  -8.615
  317    HB2  PRO  45           HB2      PRO  45  44.205   0.968  -6.297
  318    HB3  PRO  45           HB1      PRO  45  43.558  -0.518  -7.021
  319    HG2  PRO  45           HG2      PRO  45  44.870  -0.578  -4.708
  320    HG3  PRO  45           HG1      PRO  45  45.060  -1.872  -5.907
  321    HD2  PRO  45           HD2      PRO  45  46.960   0.335  -5.205
  322    HD3  PRO  45           HD1      PRO  45  47.299  -1.331  -5.732
  323    H    VAL  46           HN       VAL  46  44.418   0.734 -10.178
  324    HA   VAL  46           HA       VAL  46  45.228   3.591 -10.101
  325    HB   VAL  46           HB       VAL  46  43.930   1.926 -12.284
  326   HG11  VAL  46          HG11      VAL  46  43.304   4.199 -12.660
  327   HG12  VAL  46          HG12      VAL  46  44.706   3.921 -13.696
  328   HG13  VAL  46          HG13      VAL  46  44.892   4.793 -12.174
  329   HG21  VAL  46          HG21      VAL  46  46.200   1.203 -11.892
  330   HG22  VAL  46          HG22      VAL  46  46.768   2.869 -11.784
  331   HG23  VAL  46          HG23      VAL  46  46.218   2.222 -13.330
  332    H    LEU  47           HN       LEU  47  43.774   4.523  -8.641
  333    HA   LEU  47           HA       LEU  47  40.872   4.055  -8.972
  334    HB2  LEU  47           HB2      LEU  47  42.330   5.941  -7.093
  335    HB3  LEU  47           HB1      LEU  47  40.645   5.435  -6.981
  336    HG   LEU  47           HG       LEU  47  43.039   3.584  -6.778
  337   HD11  LEU  47          HD11      LEU  47  41.096   4.365  -4.596
  338   HD12  LEU  47          HD12      LEU  47  42.618   5.217  -4.855
  339   HD13  LEU  47          HD13      LEU  47  42.626   3.506  -4.428
  340   HD21  LEU  47          HD21      LEU  47  41.101   2.069  -5.848
  341   HD22  LEU  47          HD22      LEU  47  41.294   2.237  -7.589
  342   HD23  LEU  47          HD23      LEU  47  40.050   3.163  -6.749
  343    H    LEU  48           HN       LEU  48  41.370   5.024 -11.282
  344    HA   LEU  48           HA       LEU  48  40.899   7.992 -11.170
  345    HB2  LEU  48           HB2      LEU  48  42.257   6.395 -13.359
  346    HB3  LEU  48           HB1      LEU  48  42.018   8.141 -13.342
  347    HG   LEU  48           HG       LEU  48  43.633   6.574 -11.307
  348   HD11  LEU  48          HD11      LEU  48  44.571   6.801 -13.677
  349   HD12  LEU  48          HD12      LEU  48  45.586   7.430 -12.378
  350   HD13  LEU  48          HD13      LEU  48  44.643   8.538 -13.374
  351   HD21  LEU  48          HD21      LEU  48  42.850   9.475 -11.577
  352   HD22  LEU  48          HD22      LEU  48  44.403   9.063 -10.847
  353   HD23  LEU  48          HD23      LEU  48  42.910   8.466 -10.131
  354    H    VAL  49           HN       VAL  49  38.966   8.581 -11.911
  355    HA   VAL  49           HA       VAL  49  37.035   6.728 -12.905
  356    HB   VAL  49           HB       VAL  49  37.119   9.753 -13.059
  357   HG11  VAL  49          HG11      VAL  49  35.516   8.994 -14.670
  358   HG12  VAL  49          HG12      VAL  49  34.597   9.447 -13.234
  359   HG13  VAL  49          HG13      VAL  49  34.914   7.747 -13.578
  360   HG21  VAL  49          HG21      VAL  49  35.607   7.955 -11.146
  361   HG22  VAL  49          HG22      VAL  49  35.828   9.701 -11.035
  362   HG23  VAL  49          HG23      VAL  49  37.199   8.621 -10.778
  363    H    ASP  50           HN       ASP  50  39.063   9.142 -14.561
  364    HA   ASP  50           HA       ASP  50  37.992   8.770 -17.173
  365    HB2  ASP  50           HB2      ASP  50  40.723   9.642 -16.205
  366    HB3  ASP  50           HB1      ASP  50  40.273   9.635 -17.911
  367    H    GLU  51           HN       GLU  51  40.638   7.074 -15.480
  368    HA   GLU  51           HA       GLU  51  41.136   5.374 -17.839
  369    HB2  GLU  51           HB2      GLU  51  42.868   6.223 -16.047
  370    HB3  GLU  51           HB1      GLU  51  42.287   4.858 -15.098
  371    HG2  GLU  51           HG2      GLU  51  44.169   4.053 -16.338
  372    HG3  GLU  51           HG1      GLU  51  42.740   3.402 -17.141
  373    H    ALA  52           HN       ALA  52  38.871   5.401 -15.378
  374    HA   ALA  52           HA       ALA  52  38.709   2.725 -14.501
  375    HB1  ALA  52           HB1      ALA  52  36.427   4.612 -15.169
  376    HB2  ALA  52           HB2      ALA  52  37.269   4.523 -13.623
  377    HB3  ALA  52           HB3      ALA  52  36.297   3.162 -14.174
  378    H    ARG  53           HN       ARG  53  37.815   0.860 -15.381
  379    HA   ARG  53           HA       ARG  53  37.201   0.951 -18.314
  380    HB2  ARG  53           HB2      ARG  53  38.152  -1.294 -16.513
  381    HB3  ARG  53           HB1      ARG  53  37.664  -1.521 -18.194
  382    HG2  ARG  53           HG2      ARG  53  39.376   0.094 -18.918
  383    HG3  ARG  53           HG1      ARG  53  39.869   0.328 -17.240
  384    HD2  ARG  53           HD2      ARG  53  40.467  -2.058 -17.079
  385    HD3  ARG  53           HD1      ARG  53  39.974  -2.296 -18.757
  386    HE   ARG  53           HE       ARG  53  41.971  -0.197 -18.468
  387   HH11  ARG  53          HH21      ARG  53  41.339  -3.572 -18.710
  388   HH12  ARG  53          HH22      ARG  53  42.897  -3.955 -19.363
  389   HH21  ARG  53          HH11      ARG  53  44.008  -0.668 -19.321
  390   HH22  ARG  53          HH12      ARG  53  44.411  -2.307 -19.709
  391    H    ARG  54           HN       ARG  54  35.274   0.126 -19.056
  392    HA   ARG  54           HA       ARG  54  33.147  -0.208 -17.053
  393    HB2  ARG  54           HB2      ARG  54  33.126  -0.133 -20.088
  394    HB3  ARG  54           HB1      ARG  54  31.677  -0.312 -19.107
  395    HG2  ARG  54           HG2      ARG  54  31.648   1.992 -19.317
  396    HG3  ARG  54           HG1      ARG  54  32.689   1.890 -17.903
  397    HD2  ARG  54           HD2      ARG  54  33.734   3.378 -19.502
  398    HD3  ARG  54           HD1      ARG  54  34.675   1.887 -19.464
  399    HE   ARG  54           HE       ARG  54  32.648   1.746 -21.508
  400   HH11  ARG  54          HH21      ARG  54  35.688   3.143 -20.661
  401   HH12  ARG  54          HH22      ARG  54  36.220   3.299 -22.302
  402   HH21  ARG  54          HH11      ARG  54  33.326   1.942 -23.649
  403   HH22  ARG  54          HH12      ARG  54  34.883   2.619 -23.993
  404    HA   PRO  55           HA       PRO  55  32.908  -4.631 -16.740
  405    HB2  PRO  55           HB2      PRO  55  30.189  -4.317 -17.993
  406    HB3  PRO  55           HB1      PRO  55  30.669  -5.276 -16.578
  407    HG2  PRO  55           HG2      PRO  55  29.461  -2.878 -16.348
  408    HG3  PRO  55           HG1      PRO  55  30.653  -3.460 -15.173
  409    HD2  PRO  55           HD2      PRO  55  30.918  -1.271 -17.136
  410    HD3  PRO  55           HD1      PRO  55  31.917  -1.628 -15.713
  411    H    GLU  56           HN       GLU  56  33.596  -6.262 -18.071
  412    HA   GLU  56           HA       GLU  56  33.934  -5.777 -20.908
  413    HB2  GLU  56           HB2      GLU  56  34.358  -8.244 -19.198
  414    HB3  GLU  56           HB1      GLU  56  34.794  -8.144 -20.904
  415    HG2  GLU  56           HG2      GLU  56  36.315  -6.293 -20.450
  416    HG3  GLU  56           HG1      GLU  56  35.823  -6.269 -18.756
  Start of MODEL   17
    1    H1   MET   1           HT1      MET   1  42.845  -7.561  18.755
    2    H2   MET   1           HT2      MET   1  41.199  -7.967  18.856
    3    H3   MET   1           HT3      MET   1  41.661  -6.388  18.435
    4    HA   MET   1           HA       MET   1  42.899  -8.123  16.641
    5    HB2  MET   1           HB2      MET   1  40.189  -8.952  17.499
    6    HB3  MET   1           HB1      MET   1  40.339  -8.750  15.754
    7    HG2  MET   1           HG2      MET   1  42.223 -10.288  15.690
    8    HG3  MET   1           HG1      MET   1  42.222 -10.416  17.449
    9    HE1  MET   1           HE1      MET   1  40.838 -13.835  17.223
   10    HE2  MET   1           HE2      MET   1  41.770 -12.646  18.129
   11    HE3  MET   1           HE3      MET   1  42.266 -13.085  16.497
   12    HA   PRO   2           HA       PRO   2  39.906  -5.108  14.311
   13    HB2  PRO   2           HB2      PRO   2  38.369  -3.466  15.970
   14    HB3  PRO   2           HB1      PRO   2  37.778  -4.939  15.177
   15    HG2  PRO   2           HG2      PRO   2  38.758  -4.557  17.971
   16    HG3  PRO   2           HG1      PRO   2  37.390  -5.521  17.377
   17    HD2  PRO   2           HD2      PRO   2  39.702  -6.696  18.066
   18    HD3  PRO   2           HD1      PRO   2  38.763  -7.285  16.679
   19    H    LEU   3           HN       LEU   3  40.633  -3.085  13.668
   20    HA   LEU   3           HA       LEU   3  42.883  -1.973  15.121
   21    HB2  LEU   3           HB2      LEU   3  41.421  -0.877  12.702
   22    HB3  LEU   3           HB1      LEU   3  43.033  -0.412  13.243
   23    HG   LEU   3           HG       LEU   3  42.220  -3.200  12.358
   24   HD11  LEU   3          HD11      LEU   3  43.610  -2.737  10.387
   25   HD12  LEU   3          HD12      LEU   3  43.952  -1.116  10.992
   26   HD13  LEU   3          HD13      LEU   3  42.312  -1.549  10.509
   27   HD21  LEU   3          HD21      LEU   3  44.860  -3.341  12.326
   28   HD22  LEU   3          HD22      LEU   3  43.997  -3.559  13.843
   29   HD23  LEU   3          HD23      LEU   3  44.755  -2.009  13.478
   30    H    GLU   4           HN       GLU   4  43.000  -0.078  16.274
   31    HA   GLU   4           HA       GLU   4  42.169   1.533  17.770
   32    HB2  GLU   4           HB2      GLU   4  42.152   2.572  15.403
   33    HB3  GLU   4           HB1      GLU   4  40.406   2.348  15.453
   34    HG2  GLU   4           HG2      GLU   4  40.798   4.565  16.260
   35    HG3  GLU   4           HG1      GLU   4  40.449   3.597  17.689
   36    H    ALA   5           HN       ALA   5  39.248   2.476  16.826
   37    HA   ALA   5           HA       ALA   5  37.892   1.010  18.943
   38    HB1  ALA   5           HB1      ALA   5  37.445   3.422  18.399
   39    HB2  ALA   5           HB2      ALA   5  35.990   2.426  18.426
   40    HB3  ALA   5           HB3      ALA   5  36.707   2.898  16.885
   41    H    GLY   6           HN       GLY   6  38.501   0.390  15.683
   42    HA2  GLY   6           HA2      GLY   6  37.835  -1.527  14.444
   43    HA3  GLY   6           HA1      GLY   6  36.669  -1.903  15.714
   44    H    LEU   7           HN       LEU   7  37.246   0.462  13.097
   45    HA   LEU   7           HA       LEU   7  34.432   1.238  13.062
   46    HB2  LEU   7           HB2      LEU   7  36.828   1.892  11.348
   47    HB3  LEU   7           HB1      LEU   7  35.212   2.382  10.851
   48    HG   LEU   7           HG       LEU   7  36.454   4.134  12.171
   49   HD11  LEU   7          HD11      LEU   7  33.804   3.610  12.195
   50   HD12  LEU   7          HD12      LEU   7  34.514   4.905  13.148
   51   HD13  LEU   7          HD13      LEU   7  34.140   3.365  13.909
   52   HD21  LEU   7          HD21      LEU   7  36.933   3.806  14.485
   53   HD22  LEU   7          HD22      LEU   7  37.520   2.349  13.684
   54   HD23  LEU   7          HD23      LEU   7  35.981   2.324  14.550
   55    H    LEU   8           HN       LEU   8  32.845   0.410  11.811
   56    HA   LEU   8           HA       LEU   8  33.311  -2.106  10.430
   57    HB2  LEU   8           HB2      LEU   8  30.832  -0.362  10.496
   58    HB3  LEU   8           HB1      LEU   8  30.898  -2.057  10.012
   59    HG   LEU   8           HG       LEU   8  31.616  -0.984  12.759
   60   HD11  LEU   8          HD11      LEU   8  29.245  -2.647  11.863
   61   HD12  LEU   8          HD12      LEU   8  29.183  -0.916  12.197
   62   HD13  LEU   8          HD13      LEU   8  29.553  -2.053  13.494
   63   HD21  LEU   8          HD21      LEU   8  31.406  -3.583  13.202
   64   HD22  LEU   8          HD22      LEU   8  32.905  -2.930  12.553
   65   HD23  LEU   8          HD23      LEU   8  31.746  -3.709  11.475
   66    H    GLU   9           HN       GLU   9  33.233  -2.511   8.230
   67    HA   GLU   9           HA       GLU   9  33.671  -2.049   5.980
   68    HB2  GLU   9           HB2      GLU   9  31.244  -1.416   6.202
   69    HB3  GLU   9           HB1      GLU   9  31.759   0.252   6.454
   70    HG2  GLU   9           HG2      GLU   9  31.240   0.007   4.111
   71    HG3  GLU   9           HG1      GLU   9  32.993   0.113   4.250
   72    H    ILE  10           HN       ILE  10  35.787  -1.401   5.888
   73    HA   ILE  10           HA       ILE  10  36.421   1.488   6.359
   74    HB   ILE  10           HB       ILE  10  38.212  -0.948   6.123
   75   HG12  ILE  10          HG12      ILE  10  37.707   0.864   8.498
   76   HG13  ILE  10          HG11      ILE  10  36.845  -0.652   8.238
   77   HG21  ILE  10          HG21      ILE  10  38.808   1.998   6.469
   78   HG22  ILE  10          HG22      ILE  10  39.434   0.903   5.238
   79   HG23  ILE  10          HG23      ILE  10  39.966   0.743   6.911
   80   HD11  ILE  10          HD11      ILE  10  38.964  -1.887   8.241
   81   HD12  ILE  10          HD12      ILE  10  38.803  -0.957   9.731
   82   HD13  ILE  10          HD13      ILE  10  39.858  -0.380   8.440
   83    H    LEU  11           HN       LEU  11  36.194  -0.999   3.944
   84    HA   LEU  11           HA       LEU  11  37.724   0.530   1.937
   85    HB2  LEU  11           HB2      LEU  11  36.257  -2.108   1.936
   86    HB3  LEU  11           HB1      LEU  11  36.804  -1.379   0.425
   87    HG   LEU  11           HG       LEU  11  39.115  -1.259   1.372
   88   HD11  LEU  11          HD11      LEU  11  39.469  -2.814   3.397
   89   HD12  LEU  11          HD12      LEU  11  37.735  -2.658   3.669
   90   HD13  LEU  11          HD13      LEU  11  38.767  -1.230   3.721
   91   HD21  LEU  11          HD21      LEU  11  38.376  -3.160  -0.049
   92   HD22  LEU  11          HD22      LEU  11  37.879  -4.031   1.401
   93   HD23  LEU  11          HD23      LEU  11  39.581  -3.654   1.138
   94    H    ALA  12           HN       ALA  12  36.809   1.682   0.255
   95    HA   ALA  12           HA       ALA  12  33.875   1.661  -0.133
   96    HB1  ALA  12           HB1      ALA  12  34.048   3.359   1.563
   97    HB2  ALA  12           HB2      ALA  12  33.848   4.198   0.024
   98    HB3  ALA  12           HB3      ALA  12  35.443   4.091   0.770
   99    H    CYS  13           HN       CYS  13  33.298   2.411  -2.211
  100    HA   CYS  13           HA       CYS  13  35.216   2.104  -4.270
  101    HB2  CYS  13           HB2      CYS  13  32.796   3.810  -4.731
  102    HB3  CYS  13           HB1      CYS  13  33.463   2.536  -5.737
  103    HA   PRO  14           HA       PRO  14  37.284   6.042  -4.366
  104    HB2  PRO  14           HB2      PRO  14  37.754   6.331  -7.082
  105    HB3  PRO  14           HB1      PRO  14  38.698   5.264  -6.024
  106    HG2  PRO  14           HG2      PRO  14  36.451   4.589  -7.871
  107    HG3  PRO  14           HG1      PRO  14  37.960   3.709  -7.562
  108    HD2  PRO  14           HD2      PRO  14  35.605   2.943  -6.456
  109    HD3  PRO  14           HD1      PRO  14  37.150   2.734  -5.604
  110    H    ALA  15           HN       ALA  15  34.414   5.518  -6.265
  111    HA   ALA  15           HA       ALA  15  33.848   8.471  -6.233
  112    HB1  ALA  15           HB1      ALA  15  33.079   6.450  -8.366
  113    HB2  ALA  15           HB2      ALA  15  34.303   7.708  -8.542
  114    HB3  ALA  15           HB3      ALA  15  32.606   8.149  -8.349
  115    H    CYS  16           HN       CYS  16  32.663   5.188  -5.907
  116    HA   CYS  16           HA       CYS  16  29.955   6.168  -5.146
  117    HB2  CYS  16           HB2      CYS  16  30.202   3.289  -4.944
  118    HB3  CYS  16           HB1      CYS  16  29.247   4.219  -6.092
  119    H    HIS  17           HN       HIS  17  29.200   4.272  -3.304
  120    HA   HIS  17           HA       HIS  17  31.119   4.641  -1.020
  121    HB2  HIS  17           HB2      HIS  17  29.137   4.909   0.437
  122    HB3  HIS  17           HB1      HIS  17  29.204   6.166  -0.798
  123    HD2  HIS  17           HD2      HIS  17  26.747   3.493   0.431
  124    HE1  HIS  17           HE1      HIS  17  25.370   4.687  -3.379
  125    HE2  HIS  17           HE2      HIS  17  24.776   3.399  -1.275
  126    H    ALA  18           HN       ALA  18  30.357   2.371  -2.965
  127    HA   ALA  18           HA       ALA  18  29.321   0.348  -1.056
  128    HB1  ALA  18           HB1      ALA  18  28.889   0.765  -3.747
  129    HB2  ALA  18           HB2      ALA  18  28.561  -0.754  -2.925
  130    HB3  ALA  18           HB3      ALA  18  30.084  -0.523  -3.783
  131    HA   PRO  19           HA       PRO  19  33.309  -1.570  -0.656
  132    HB2  PRO  19           HB2      PRO  19  32.805  -4.264  -0.779
  133    HB3  PRO  19           HB1      PRO  19  32.293  -3.229   0.566
  134    HG2  PRO  19           HG2      PRO  19  30.664  -4.479  -1.528
  135    HG3  PRO  19           HG1      PRO  19  30.169  -3.813   0.029
  136    HD2  PRO  19           HD2      PRO  19  29.971  -2.553  -2.584
  137    HD3  PRO  19           HD1      PRO  19  29.406  -1.930  -1.026
  138    H    LEU  20           HN       LEU  20  35.022  -3.001  -1.554
  139    HA   LEU  20           HA       LEU  20  34.940  -3.079  -4.553
  140    HB2  LEU  20           HB2      LEU  20  37.282  -2.824  -2.646
  141    HB3  LEU  20           HB1      LEU  20  37.409  -2.899  -4.402
  142    HG   LEU  20           HG       LEU  20  35.856  -0.785  -2.876
  143   HD11  LEU  20          HD11      LEU  20  38.187  -0.416  -2.442
  144   HD12  LEU  20          HD12      LEU  20  37.742   0.700  -3.735
  145   HD13  LEU  20          HD13      LEU  20  38.620  -0.782  -4.113
  146   HD21  LEU  20          HD21      LEU  20  36.327  -1.388  -5.785
  147   HD22  LEU  20          HD22      LEU  20  36.199   0.292  -5.290
  148   HD23  LEU  20          HD23      LEU  20  34.867  -0.813  -4.982
  149    H    GLU  21           HN       GLU  21  35.800  -4.911  -5.598
  150    HA   GLU  21           HA       GLU  21  36.341  -7.283  -3.842
  151    HB2  GLU  21           HB2      GLU  21  34.043  -7.338  -4.843
  152    HB3  GLU  21           HB1      GLU  21  34.785  -7.299  -6.441
  153    HG2  GLU  21           HG2      GLU  21  35.971  -9.390  -5.969
  154    HG3  GLU  21           HG1      GLU  21  35.298  -9.418  -4.338
  155    H    GLU  22           HN       GLU  22  38.335  -8.014  -4.233
  156    HA   GLU  22           HA       GLU  22  39.843  -7.133  -6.571
  157    HB2  GLU  22           HB2      GLU  22  40.939  -7.420  -4.375
  158    HB3  GLU  22           HB1      GLU  22  40.561  -9.142  -4.419
  159    HG2  GLU  22           HG2      GLU  22  41.929  -9.431  -6.423
  160    HG3  GLU  22           HG1      GLU  22  42.247  -7.700  -6.483
  161    H    ARG  23           HN       ARG  23  40.224  -8.299  -8.433
  162    HA   ARG  23           HA       ARG  23  39.290 -11.167  -8.482
  163    HB2  ARG  23           HB2      ARG  23  37.646  -9.668  -9.624
  164    HB3  ARG  23           HB1      ARG  23  38.933  -9.123 -10.700
  165    HG2  ARG  23           HG2      ARG  23  39.263 -11.448 -11.479
  166    HG3  ARG  23           HG1      ARG  23  37.972 -11.983 -10.401
  167    HD2  ARG  23           HD2      ARG  23  36.410 -10.430 -11.585
  168    HD3  ARG  23           HD1      ARG  23  37.702 -10.055 -12.723
  169    HE   ARG  23           HE       ARG  23  36.185 -12.579 -12.589
  170   HH11  ARG  23          HH21      ARG  23  38.958 -10.846 -13.708
  171   HH12  ARG  23          HH22      ARG  23  39.261 -11.927 -15.025
  172   HH21  ARG  23          HH11      ARG  23  36.580 -13.996 -14.296
  173   HH22  ARG  23          HH12      ARG  23  37.918 -13.710 -15.357
  174    H    ASP  24           HN       ASP  24  41.226 -12.186  -8.536
  175    HA   ASP  24           HA       ASP  24  43.738 -11.690  -9.197
  176    HB2  ASP  24           HB2      ASP  24  42.125 -13.987 -10.335
  177    HB3  ASP  24           HB1      ASP  24  43.881 -13.891 -10.474
  178    H    ALA  25           HN       ALA  25  43.607  -9.728 -10.509
  179    HA   ALA  25           HA       ALA  25  44.683  -9.755 -13.005
  180    HB1  ALA  25           HB1      ALA  25  41.749 -10.383 -13.170
  181    HB2  ALA  25           HB2      ALA  25  43.070 -10.963 -14.187
  182    HB3  ALA  25           HB3      ALA  25  42.440  -9.338 -14.414
  183    H    GLU  26           HN       GLU  26  42.163  -8.382 -10.991
  184    HA   GLU  26           HA       GLU  26  43.282  -5.746 -11.054
  185    HB2  GLU  26           HB2      GLU  26  41.403  -4.633 -12.330
  186    HB3  GLU  26           HB1      GLU  26  42.504  -5.579 -13.323
  187    HG2  GLU  26           HG2      GLU  26  40.932  -7.486 -13.249
  188    HG3  GLU  26           HG1      GLU  26  39.817  -6.519 -12.282
  189    H    LEU  27           HN       LEU  27  41.291  -4.078 -10.457
  190    HA   LEU  27           HA       LEU  27  39.936  -5.392  -8.116
  191    HB2  LEU  27           HB2      LEU  27  40.348  -2.436  -8.608
  192    HB3  LEU  27           HB1      LEU  27  39.876  -3.211  -7.100
  193    HG   LEU  27           HG       LEU  27  42.536  -3.532  -8.519
  194   HD11  LEU  27          HD11      LEU  27  43.408  -2.432  -6.454
  195   HD12  LEU  27          HD12      LEU  27  41.745  -2.169  -5.929
  196   HD13  LEU  27          HD13      LEU  27  42.344  -1.384  -7.390
  197   HD21  LEU  27          HD21      LEU  27  43.045  -4.719  -6.246
  198   HD22  LEU  27          HD22      LEU  27  42.170  -5.609  -7.487
  199   HD23  LEU  27          HD23      LEU  27  41.294  -4.899  -6.131
  200    H    ILE  28           HN       ILE  28  37.760  -5.576  -8.147
  201    HA   ILE  28           HA       ILE  28  36.249  -4.171 -10.313
  202    HB   ILE  28           HB       ILE  28  35.558  -6.665  -8.737
  203   HG12  ILE  28          HG12      ILE  28  37.494  -6.714 -10.492
  204   HG13  ILE  28          HG11      ILE  28  36.249  -7.951 -10.576
  205   HG21  ILE  28          HG21      ILE  28  33.493  -5.731  -9.361
  206   HG22  ILE  28          HG22      ILE  28  33.840  -6.849 -10.679
  207   HG23  ILE  28          HG23      ILE  28  34.122  -5.122 -10.893
  208   HD11  ILE  28          HD11      ILE  28  35.257  -7.012 -12.478
  209   HD12  ILE  28          HD12      ILE  28  36.969  -6.710 -12.769
  210   HD13  ILE  28          HD13      ILE  28  35.937  -5.416 -12.179
  211    H    CYS  29           HN       CYS  29  34.736  -2.700  -9.758
  212    HA   CYS  29           HA       CYS  29  34.446  -1.980  -6.952
  213    HB2  CYS  29           HB2      CYS  29  34.373  -0.462  -9.046
  214    HB3  CYS  29           HB1      CYS  29  32.697  -0.980  -9.194
  215    H    THR  30           HN       THR  30  33.000  -2.940  -5.533
  216    HA   THR  30           HA       THR  30  31.027  -4.805  -6.635
  217    HB   THR  30           HB       THR  30  31.236  -4.108  -3.720
  218    HG1  THR  30           HG1      THR  30  32.984  -5.747  -3.760
  219   HG21  THR  30          HG21      THR  30  29.670  -5.877  -4.805
  220   HG22  THR  30          HG22      THR  30  30.597  -6.343  -3.380
  221   HG23  THR  30          HG23      THR  30  31.141  -6.835  -4.984
  222    H    GLY  31           HN       GLY  31  28.771  -4.661  -6.049
  223    HA2  GLY  31           HA2      GLY  31  26.948  -3.278  -4.995
  224    HA3  GLY  31           HA1      GLY  31  27.797  -1.857  -5.593
  225    H    GLN  32           HN       GLN  32  25.183  -2.158  -6.262
  226    HA   GLN  32           HA       GLN  32  24.825  -3.524  -8.807
  227    HB2  GLN  32           HB2      GLN  32  22.938  -3.130  -7.247
  228    HB3  GLN  32           HB1      GLN  32  23.130  -1.392  -7.468
  229    HG2  GLN  32           HG2      GLN  32  22.613  -1.594  -9.845
  230    HG3  GLN  32           HG1      GLN  32  22.526  -3.352  -9.699
  231   HE21  GLN  32          HE21      GLN  32  20.416  -4.095  -9.507
  232   HE22  GLN  32          HE22      GLN  32  19.140  -3.243  -8.779
  233    H    ASP  33           HN       ASP  33  24.891  -0.069  -7.886
  234    HA   ASP  33           HA       ASP  33  25.159   0.758 -10.680
  235    HB2  ASP  33           HB2      ASP  33  23.949   2.095  -8.911
  236    HB3  ASP  33           HB1      ASP  33  25.518   2.429  -8.178
  237    H    CYS  34           HN       CYS  34  27.258  -0.531  -8.486
  238    HA   CYS  34           HA       CYS  34  29.594   1.136  -9.069
  239    HB2  CYS  34           HB2      CYS  34  29.169  -1.476  -7.621
  240    HB3  CYS  34           HB1      CYS  34  30.776  -0.815  -7.886
  241    H    GLY  35           HN       GLY  35  30.563  -2.059  -9.166
  242    HA2  GLY  35           HA2      GLY  35  31.022  -3.555 -10.954
  243    HA3  GLY  35           HA1      GLY  35  30.265  -2.426 -12.076
  244    H    LEU  36           HN       LEU  36  31.546  -0.199 -12.077
  245    HA   LEU  36           HA       LEU  36  33.652   0.082 -13.524
  246    HB2  LEU  36           HB2      LEU  36  33.926   1.108 -10.688
  247    HB3  LEU  36           HB1      LEU  36  34.697   1.774 -12.123
  248    HG   LEU  36           HG       LEU  36  31.704   1.626 -11.645
  249   HD11  LEU  36          HD11      LEU  36  33.649   3.955 -11.587
  250   HD12  LEU  36          HD12      LEU  36  32.758   3.302 -10.213
  251   HD13  LEU  36          HD13      LEU  36  31.894   4.113 -11.519
  252   HD21  LEU  36          HD21      LEU  36  31.849   3.287 -13.684
  253   HD22  LEU  36          HD22      LEU  36  31.933   1.555 -13.980
  254   HD23  LEU  36          HD23      LEU  36  33.410   2.518 -13.967
  255    H    ALA  37           HN       ALA  37  35.524  -0.901 -14.004
  256    HA   ALA  37           HA       ALA  37  36.840  -2.584 -11.896
  257    HB1  ALA  37           HB1      ALA  37  36.022  -3.802 -13.891
  258    HB2  ALA  37           HB2      ALA  37  37.781  -3.871 -13.763
  259    HB3  ALA  37           HB3      ALA  37  37.021  -2.770 -14.914
  260    H    TYR  38           HN       TYR  38  38.837  -2.048 -11.242
  261    HA   TYR  38           HA       TYR  38  40.294   0.073 -12.764
  262    HB2  TYR  38           HB2      TYR  38  40.800  -0.583  -9.875
  263    HB3  TYR  38           HB1      TYR  38  41.150   0.902 -10.745
  264    HD1  TYR  38           HD2      TYR  38  38.968   1.957 -11.938
  265    HD2  TYR  38           HD1      TYR  38  38.938  -0.534  -8.440
  266    HE1  TYR  38           HE2      TYR  38  36.757   2.886 -11.298
  267    HE2  TYR  38           HE1      TYR  38  36.725   0.394  -7.801
  268    HH   TYR  38           HH       TYR  38  35.083   2.809  -9.854
  269    HA   PRO  39           HA       PRO  39  43.204  -3.375 -13.238
  270    HB2  PRO  39           HB2      PRO  39  44.815  -2.301 -15.122
  271    HB3  PRO  39           HB1      PRO  39  43.174  -2.859 -15.509
  272    HG2  PRO  39           HG2      PRO  39  44.165  -0.082 -15.038
  273    HG3  PRO  39           HG1      PRO  39  43.007  -0.677 -16.245
  274    HD2  PRO  39           HD2      PRO  39  42.274   0.548 -13.861
  275    HD3  PRO  39           HD1      PRO  39  41.228  -0.562 -14.780
  276    H    VAL  40           HN       VAL  40  45.579  -3.666 -12.922
  277    HA   VAL  40           HA       VAL  40  46.690  -1.613 -11.049
  278    HB   VAL  40           HB       VAL  40  47.167  -4.592 -11.294
  279   HG11  VAL  40          HG11      VAL  40  48.626  -2.468  -9.713
  280   HG12  VAL  40          HG12      VAL  40  49.309  -3.697 -10.775
  281   HG13  VAL  40          HG13      VAL  40  48.627  -4.162  -9.218
  282   HG21  VAL  40          HG21      VAL  40  45.116  -3.882 -10.097
  283   HG22  VAL  40          HG22      VAL  40  46.096  -2.866  -9.039
  284   HG23  VAL  40          HG23      VAL  40  46.281  -4.620  -8.998
  285    H    ARG  41           HN       ARG  41  48.524  -0.571 -11.631
  286    HA   ARG  41           HA       ARG  41  50.047  -1.622 -14.007
  287    HB2  ARG  41           HB2      ARG  41  48.772   0.456 -14.488
  288    HB3  ARG  41           HB1      ARG  41  49.632   1.265 -13.179
  289    HG2  ARG  41           HG2      ARG  41  51.765   0.899 -14.308
  290    HG3  ARG  41           HG1      ARG  41  50.958  -0.010 -15.586
  291    HD2  ARG  41           HD2      ARG  41  49.682   1.981 -16.230
  292    HD3  ARG  41           HD1      ARG  41  50.415   2.897 -14.915
  293    HE   ARG  41           HE       ARG  41  52.439   3.021 -16.166
  294   HH11  ARG  41          HH21      ARG  41  50.109   0.897 -17.581
  295   HH12  ARG  41          HH22      ARG  41  50.956   0.764 -19.085
  296   HH21  ARG  41          HH11      ARG  41  53.551   2.846 -18.116
  297   HH22  ARG  41          HH12      ARG  41  52.903   1.864 -19.388
  298    H    ASP  42           HN       ASP  42  52.113  -2.115 -13.583
  299    HA   ASP  42           HA       ASP  42  54.155  -2.274 -12.447
  300    HB2  ASP  42           HB2      ASP  42  54.132   0.181 -13.104
  301    HB3  ASP  42           HB1      ASP  42  53.539   0.528 -11.478
  302    H    GLY  43           HN       GLY  43  51.614  -2.994 -11.062
  303    HA2  GLY  43           HA2      GLY  43  51.261  -3.990  -8.935
  304    HA3  GLY  43           HA1      GLY  43  52.765  -3.260  -8.377
  305    H    ILE  44           HN       ILE  44  51.086  -0.805  -9.826
  306    HA   ILE  44           HA       ILE  44  49.976   0.085  -7.196
  307    HB   ILE  44           HB       ILE  44  50.611   1.780  -9.620
  308   HG12  ILE  44          HG12      ILE  44  52.695   0.777  -8.898
  309   HG13  ILE  44          HG11      ILE  44  52.667   2.429  -8.286
  310   HG21  ILE  44          HG21      ILE  44  50.210   2.473  -6.694
  311   HG22  ILE  44          HG22      ILE  44  49.009   2.711  -7.964
  312   HG23  ILE  44          HG23      ILE  44  50.521   3.619  -7.998
  313   HD11  ILE  44          HD11      ILE  44  52.267  -0.147  -6.778
  314   HD12  ILE  44          HD12      ILE  44  51.629   1.366  -6.138
  315   HD13  ILE  44          HD13      ILE  44  53.359   1.185  -6.413
  316    HA   PRO  45           HA       PRO  45  45.981  -0.418  -9.241
  317    HB2  PRO  45           HB2      PRO  45  44.361   0.526  -7.284
  318    HB3  PRO  45           HB1      PRO  45  45.192  -1.037  -7.146
  319    HG2  PRO  45           HG2      PRO  45  45.930   1.607  -5.961
  320    HG3  PRO  45           HG1      PRO  45  45.956  -0.005  -5.218
  321    HD2  PRO  45           HD2      PRO  45  48.205   1.217  -6.214
  322    HD3  PRO  45           HD1      PRO  45  48.006  -0.551  -6.152
  323    H    VAL  46           HN       VAL  46  44.653   0.887 -10.513
  324    HA   VAL  46           HA       VAL  46  45.278   3.797 -10.504
  325    HB   VAL  46           HB       VAL  46  43.690   2.123 -12.471
  326   HG11  VAL  46          HG11      VAL  46  44.570   5.012 -12.424
  327   HG12  VAL  46          HG12      VAL  46  42.955   4.365 -12.715
  328   HG13  VAL  46          HG13      VAL  46  44.213   4.179 -13.937
  329   HG21  VAL  46          HG21      VAL  46  46.029   1.458 -12.455
  330   HG22  VAL  46          HG22      VAL  46  46.544   3.144 -12.488
  331   HG23  VAL  46          HG23      VAL  46  45.740   2.442 -13.890
  332    H    LEU  47           HN       LEU  47  44.059   4.562  -8.765
  333    HA   LEU  47           HA       LEU  47  41.208   3.867  -8.531
  334    HB2  LEU  47           HB2      LEU  47  42.825   5.924  -6.997
  335    HB3  LEU  47           HB1      LEU  47  41.251   5.271  -6.542
  336    HG   LEU  47           HG       LEU  47  43.804   3.654  -6.816
  337   HD11  LEU  47          HD11      LEU  47  43.941   5.057  -4.859
  338   HD12  LEU  47          HD12      LEU  47  43.526   3.430  -4.317
  339   HD13  LEU  47          HD13      LEU  47  42.280   4.674  -4.406
  340   HD21  LEU  47          HD21      LEU  47  42.072   2.130  -7.260
  341   HD22  LEU  47          HD22      LEU  47  40.934   2.956  -6.197
  342   HD23  LEU  47          HD23      LEU  47  42.236   1.987  -5.512
  343    H    LEU  48           HN       LEU  48  41.897   5.106 -10.990
  344    HA   LEU  48           HA       LEU  48  40.676   7.834 -10.726
  345    HB2  LEU  48           HB2      LEU  48  42.307   6.686 -13.003
  346    HB3  LEU  48           HB1      LEU  48  41.747   8.351 -12.852
  347    HG   LEU  48           HG       LEU  48  43.655   6.952 -10.949
  348   HD11  LEU  48          HD11      LEU  48  44.696   7.447 -13.112
  349   HD12  LEU  48          HD12      LEU  48  45.316   8.549 -11.882
  350   HD13  LEU  48          HD13      LEU  48  44.105   9.108 -13.036
  351   HD21  LEU  48          HD21      LEU  48  42.571   8.552  -9.617
  352   HD22  LEU  48          HD22      LEU  48  42.332   9.664 -10.966
  353   HD23  LEU  48          HD23      LEU  48  43.930   9.479 -10.247
  354    H    VAL  49           HN       VAL  49  38.687   8.086 -11.510
  355    HA   VAL  49           HA       VAL  49  37.170   5.924 -12.620
  356    HB   VAL  49           HB       VAL  49  36.609   8.900 -12.607
  357   HG11  VAL  49          HG11      VAL  49  34.907   6.484 -13.251
  358   HG12  VAL  49          HG12      VAL  49  35.170   7.920 -14.240
  359   HG13  VAL  49          HG13      VAL  49  34.203   8.028 -12.770
  360   HG21  VAL  49          HG21      VAL  49  35.695   6.669 -10.763
  361   HG22  VAL  49          HG22      VAL  49  35.269   8.375 -10.616
  362   HG23  VAL  49          HG23      VAL  49  36.938   7.858 -10.371
  363    H    ASP  50           HN       ASP  50  38.716   8.761 -14.082
  364    HA   ASP  50           HA       ASP  50  37.733   8.462 -16.720
  365    HB2  ASP  50           HB2      ASP  50  39.013  10.434 -15.933
  366    HB3  ASP  50           HB1      ASP  50  40.469   9.442 -15.858
  367    H    GLU  51           HN       GLU  51  40.567   6.957 -15.171
  368    HA   GLU  51           HA       GLU  51  41.182   5.458 -17.654
  369    HB2  GLU  51           HB2      GLU  51  42.468   5.363 -14.915
  370    HB3  GLU  51           HB1      GLU  51  43.087   4.581 -16.366
  371    HG2  GLU  51           HG2      GLU  51  42.642   7.564 -16.078
  372    HG3  GLU  51           HG1      GLU  51  44.204   6.768 -15.894
  373    H    ALA  52           HN       ALA  52  39.116   5.106 -15.040
  374    HA   ALA  52           HA       ALA  52  39.375   2.310 -14.441
  375    HB1  ALA  52           HB1      ALA  52  37.053   2.498 -13.585
  376    HB2  ALA  52           HB2      ALA  52  36.924   4.094 -14.319
  377    HB3  ALA  52           HB3      ALA  52  38.069   3.819 -13.009
  378    H    ARG  53           HN       ARG  53  38.185   0.536 -15.272
  379    HA   ARG  53           HA       ARG  53  37.211   0.938 -18.074
  380    HB2  ARG  53           HB2      ARG  53  38.102  -1.573 -16.626
  381    HB3  ARG  53           HB1      ARG  53  37.595  -1.499 -18.312
  382    HG2  ARG  53           HG2      ARG  53  39.826   0.286 -17.336
  383    HG3  ARG  53           HG1      ARG  53  40.160  -1.397 -17.734
  384    HD2  ARG  53           HD2      ARG  53  38.872   0.614 -19.610
  385    HD3  ARG  53           HD1      ARG  53  40.546   0.083 -19.680
  386    HE   ARG  53           HE       ARG  53  38.980  -2.250 -19.769
  387   HH11  ARG  53          HH21      ARG  53  39.445   0.663 -21.561
  388   HH12  ARG  53          HH22      ARG  53  39.072  -0.065 -23.087
  389   HH21  ARG  53          HH11      ARG  53  38.496  -3.211 -21.743
  390   HH22  ARG  53          HH12      ARG  53  38.534  -2.261 -23.190
  391    H    ARG  54           HN       ARG  54  35.185   0.233 -18.682
  392    HA   ARG  54           HA       ARG  54  33.269  -0.249 -16.478
  393    HB2  ARG  54           HB2      ARG  54  32.814   1.492 -18.215
  394    HB3  ARG  54           HB1      ARG  54  32.711   0.199 -19.415
  395    HG2  ARG  54           HG2      ARG  54  30.874  -0.847 -18.190
  396    HG3  ARG  54           HG1      ARG  54  31.015   0.354 -16.908
  397    HD2  ARG  54           HD2      ARG  54  30.333   0.977 -19.796
  398    HD3  ARG  54           HD1      ARG  54  29.167   0.885 -18.477
  399    HE   ARG  54           HE       ARG  54  30.996   3.097 -18.987
  400   HH11  ARG  54          HH21      ARG  54  29.213   1.297 -16.645
  401   HH12  ARG  54          HH22      ARG  54  29.075   2.621 -15.538
  402   HH21  ARG  54          HH11      ARG  54  30.826   4.832 -17.554
  403   HH22  ARG  54          HH12      ARG  54  29.988   4.623 -16.053
  404    HA   PRO  55           HA       PRO  55  33.666  -4.698 -17.538
  405    HB2  PRO  55           HB2      PRO  55  31.176  -4.832 -15.881
  406    HB3  PRO  55           HB1      PRO  55  32.658  -5.802 -15.768
  407    HG2  PRO  55           HG2      PRO  55  32.094  -3.856 -14.013
  408    HG3  PRO  55           HG1      PRO  55  33.754  -4.218 -14.515
  409    HD2  PRO  55           HD2      PRO  55  32.027  -1.902 -15.270
  410    HD3  PRO  55           HD1      PRO  55  33.801  -2.009 -15.149
  411    H    GLU  56           HN       GLU  56  32.659  -5.974 -19.087
  412    HA   GLU  56           HA       GLU  56  29.867  -5.550 -19.854
  413    HB2  GLU  56           HB2      GLU  56  31.013  -3.714 -21.075
  414    HB3  GLU  56           HB1      GLU  56  32.064  -4.903 -21.846
  415    HG2  GLU  56           HG2      GLU  56  30.133  -5.984 -22.891
  416    HG3  GLU  56           HG1      GLU  56  29.037  -4.878 -22.061
  Start of MODEL   18
    1    H1   MET   1           HT1      MET   1  38.121 -10.571  19.734
    2    H2   MET   1           HT2      MET   1  37.500 -10.222  21.277
    3    H3   MET   1           HT3      MET   1  39.156 -10.547  21.078
    4    HA   MET   1           HA       MET   1  38.503  -8.437  19.363
    5    HB2  MET   1           HB2      MET   1  36.546  -8.223  20.962
    6    HB3  MET   1           HB1      MET   1  37.719  -7.922  22.245
    7    HG2  MET   1           HG2      MET   1  38.646  -6.058  20.750
    8    HG3  MET   1           HG1      MET   1  37.185  -6.252  19.783
    9    HE1  MET   1           HE1      MET   1  37.692  -3.377  21.051
   10    HE2  MET   1           HE2      MET   1  35.985  -3.133  21.417
   11    HE3  MET   1           HE3      MET   1  36.450  -4.030  19.973
   12    HA   PRO   2           HA       PRO   2  42.629  -8.988  21.608
   13    HB2  PRO   2           HB2      PRO   2  43.551  -8.478  18.808
   14    HB3  PRO   2           HB1      PRO   2  44.115  -9.689  19.978
   15    HG2  PRO   2           HG2      PRO   2  42.583 -10.369  17.898
   16    HG3  PRO   2           HG1      PRO   2  42.418 -11.165  19.473
   17    HD2  PRO   2           HD2      PRO   2  40.640  -9.107  18.206
   18    HD3  PRO   2           HD1      PRO   2  40.213 -10.474  19.258
   19    H    LEU   3           HN       LEU   3  41.811  -6.727  18.965
   20    HA   LEU   3           HA       LEU   3  42.161  -4.418  20.642
   21    HB2  LEU   3           HB2      LEU   3  44.568  -5.292  20.107
   22    HB3  LEU   3           HB1      LEU   3  44.281  -4.615  18.505
   23    HG   LEU   3           HG       LEU   3  44.023  -3.086  21.113
   24   HD11  LEU   3          HD11      LEU   3  46.150  -2.871  18.965
   25   HD12  LEU   3          HD12      LEU   3  46.368  -3.736  20.486
   26   HD13  LEU   3          HD13      LEU   3  46.097  -1.993  20.493
   27   HD21  LEU   3          HD21      LEU   3  44.101  -1.142  19.351
   28   HD22  LEU   3          HD22      LEU   3  42.585  -2.004  19.604
   29   HD23  LEU   3          HD23      LEU   3  43.596  -2.387  18.207
   30    H    GLU   4           HN       GLU   4  40.560  -3.215  19.801
   31    HA   GLU   4           HA       GLU   4  39.517  -3.518  17.153
   32    HB2  GLU   4           HB2      GLU   4  38.328  -1.344  17.681
   33    HB3  GLU   4           HB1      GLU   4  38.087  -2.628  18.865
   34    HG2  GLU   4           HG2      GLU   4  39.880  -1.655  20.274
   35    HG3  GLU   4           HG1      GLU   4  40.086  -0.357  19.096
   36    H    ALA   5           HN       ALA   5  39.980  -2.455  15.268
   37    HA   ALA   5           HA       ALA   5  42.512  -1.069  15.036
   38    HB1  ALA   5           HB1      ALA   5  40.243  -1.568  13.102
   39    HB2  ALA   5           HB2      ALA   5  41.812  -2.373  13.162
   40    HB3  ALA   5           HB3      ALA   5  41.702  -0.688  12.649
   41    H    GLY   6           HN       GLY   6  42.882   1.132  14.578
   42    HA2  GLY   6           HA2      GLY   6  40.979   2.986  15.745
   43    HA3  GLY   6           HA1      GLY   6  42.505   3.419  14.977
   44    H    LEU   7           HN       LEU   7  42.521   3.439  12.569
   45    HA   LEU   7           HA       LEU   7  40.166   4.799  11.564
   46    HB2  LEU   7           HB2      LEU   7  42.792   3.944  10.350
   47    HB3  LEU   7           HB1      LEU   7  41.512   4.626   9.345
   48    HG   LEU   7           HG       LEU   7  41.443   6.625  10.788
   49   HD11  LEU   7          HD11      LEU   7  43.566   5.092  12.295
   50   HD12  LEU   7          HD12      LEU   7  42.104   5.851  12.924
   51   HD13  LEU   7          HD13      LEU   7  43.458   6.849  12.401
   52   HD21  LEU   7          HD21      LEU   7  42.954   6.551   8.820
   53   HD22  LEU   7          HD22      LEU   7  44.248   5.942   9.854
   54   HD23  LEU   7          HD23      LEU   7  43.606   7.565  10.106
   55    H    LEU   8           HN       LEU   8  38.703   4.094  10.012
   56    HA   LEU   8           HA       LEU   8  38.050   1.290  10.066
   57    HB2  LEU   8           HB2      LEU   8  37.011   3.683   8.554
   58    HB3  LEU   8           HB1      LEU   8  36.414   2.068   8.178
   59    HG   LEU   8           HG       LEU   8  35.024   3.312   9.871
   60   HD11  LEU   8          HD11      LEU   8  35.533   0.661   9.767
   61   HD12  LEU   8          HD12      LEU   8  34.493   1.377  10.994
   62   HD13  LEU   8          HD13      LEU   8  36.168   0.994  11.380
   63   HD21  LEU   8          HD21      LEU   8  37.109   4.377  10.919
   64   HD22  LEU   8          HD22      LEU   8  37.342   2.841  11.754
   65   HD23  LEU   8          HD23      LEU   8  35.883   3.789  12.042
   66    H    GLU   9           HN       GLU   9  38.589  -0.296   8.679
   67    HA   GLU   9           HA       GLU   9  40.479   0.336   6.479
   68    HB2  GLU   9           HB2      GLU   9  40.945  -1.467   8.203
   69    HB3  GLU   9           HB1      GLU   9  39.596  -2.374   7.517
   70    HG2  GLU   9           HG2      GLU   9  40.690  -2.495   5.362
   71    HG3  GLU   9           HG1      GLU   9  41.971  -1.409   5.902
   72    H    ILE  10           HN       ILE  10  37.174  -0.169   6.930
   73    HA   ILE  10           HA       ILE  10  36.313  -1.814   4.865
   74    HB   ILE  10           HB       ILE  10  34.838  -0.557   6.481
   75   HG12  ILE  10          HG12      ILE  10  34.029  -0.151   3.592
   76   HG13  ILE  10          HG11      ILE  10  34.038  -1.734   4.370
   77   HG21  ILE  10          HG21      ILE  10  36.022   1.673   5.903
   78   HG22  ILE  10          HG22      ILE  10  34.272   1.711   6.111
   79   HG23  ILE  10          HG23      ILE  10  34.967   1.714   4.490
   80   HD11  ILE  10          HD11      ILE  10  32.453  -0.961   6.054
   81   HD12  ILE  10          HD12      ILE  10  31.795  -0.641   4.448
   82   HD13  ILE  10          HD13      ILE  10  32.502   0.672   5.391
   83    H    LEU  11           HN       LEU  11  36.497  -1.783   2.701
   84    HA   LEU  11           HA       LEU  11  38.002   0.339   1.387
   85    HB2  LEU  11           HB2      LEU  11  36.523  -2.014   0.170
   86    HB3  LEU  11           HB1      LEU  11  37.787  -1.056  -0.603
   87    HG   LEU  11           HG       LEU  11  38.130  -2.740   1.895
   88   HD11  LEU  11          HD11      LEU  11  38.977  -3.139  -0.983
   89   HD12  LEU  11          HD12      LEU  11  37.911  -4.169  -0.029
   90   HD13  LEU  11          HD13      LEU  11  39.628  -4.076   0.361
   91   HD21  LEU  11          HD21      LEU  11  39.712  -1.027   2.135
   92   HD22  LEU  11          HD22      LEU  11  39.937  -0.849   0.393
   93   HD23  LEU  11          HD23      LEU  11  40.630  -2.234   1.239
   94    H    ALA  12           HN       ALA  12  37.209   1.804  -0.158
   95    HA   ALA  12           HA       ALA  12  34.318   1.819  -0.774
   96    HB1  ALA  12           HB1      ALA  12  35.684   4.124   0.654
   97    HB2  ALA  12           HB2      ALA  12  34.443   3.078   1.343
   98    HB3  ALA  12           HB3      ALA  12  34.044   4.154   0.004
   99    H    CYS  13           HN       CYS  13  33.911   2.814  -2.714
  100    HA   CYS  13           HA       CYS  13  36.260   3.516  -4.330
  101    HB2  CYS  13           HB2      CYS  13  34.063   3.970  -5.955
  102    HB3  CYS  13           HB1      CYS  13  34.874   2.420  -5.774
  103    HA   PRO  14           HA       PRO  14  35.883   7.913  -4.005
  104    HB2  PRO  14           HB2      PRO  14  36.555   8.738  -6.543
  105    HB3  PRO  14           HB1      PRO  14  37.737   8.089  -5.387
  106    HG2  PRO  14           HG2      PRO  14  36.379   6.722  -7.669
  107    HG3  PRO  14           HG1      PRO  14  38.063   6.609  -7.129
  108    HD2  PRO  14           HD2      PRO  14  36.198   4.700  -6.534
  109    HD3  PRO  14           HD1      PRO  14  37.569   5.070  -5.467
  110    H    ALA  15           HN       ALA  15  34.898   7.653  -7.390
  111    HA   ALA  15           HA       ALA  15  32.760   9.489  -7.197
  112    HB1  ALA  15           HB1      ALA  15  33.758   8.840  -9.338
  113    HB2  ALA  15           HB2      ALA  15  32.020   8.539  -9.367
  114    HB3  ALA  15           HB3      ALA  15  33.142   7.197  -9.142
  115    H    CYS  16           HN       CYS  16  32.663   5.911  -7.164
  116    HA   CYS  16           HA       CYS  16  29.811   6.043  -6.293
  117    HB2  CYS  16           HB2      CYS  16  30.198   3.419  -6.587
  118    HB3  CYS  16           HB1      CYS  16  29.888   4.453  -7.975
  119    H    HIS  17           HN       HIS  17  29.163   4.669  -4.473
  120    HA   HIS  17           HA       HIS  17  31.283   4.547  -2.358
  121    HB2  HIS  17           HB2      HIS  17  29.398   4.670  -0.765
  122    HB3  HIS  17           HB1      HIS  17  29.385   6.045  -1.867
  123    HD2  HIS  17           HD2      HIS  17  27.186   2.925  -1.015
  124    HE1  HIS  17           HE1      HIS  17  25.250   5.059  -4.105
  125    HE2  HIS  17           HE2      HIS  17  25.008   3.167  -2.433
  126    H    ALA  18           HN       ALA  18  32.038   2.497  -2.155
  127    HA   ALA  18           HA       ALA  18  30.632   0.350  -1.151
  128    HB1  ALA  18           HB1      ALA  18  30.208   0.665  -4.071
  129    HB2  ALA  18           HB2      ALA  18  29.195  -0.148  -2.882
  130    HB3  ALA  18           HB3      ALA  18  30.602  -0.973  -3.555
  131    HA   PRO  19           HA       PRO  19  34.765  -1.225  -1.248
  132    HB2  PRO  19           HB2      PRO  19  34.363  -3.918  -0.920
  133    HB3  PRO  19           HB1      PRO  19  34.123  -2.736   0.383
  134    HG2  PRO  19           HG2      PRO  19  32.096  -4.045  -1.375
  135    HG3  PRO  19           HG1      PRO  19  32.024  -3.693   0.359
  136    HD2  PRO  19           HD2      PRO  19  30.776  -2.131  -1.520
  137    HD3  PRO  19           HD1      PRO  19  31.377  -1.494   0.029
  138    H    LEU  20           HN       LEU  20  36.264  -2.643  -2.461
  139    HA   LEU  20           HA       LEU  20  35.246  -3.348  -5.193
  140    HB2  LEU  20           HB2      LEU  20  38.023  -2.347  -4.518
  141    HB3  LEU  20           HB1      LEU  20  37.336  -2.600  -6.121
  142    HG   LEU  20           HG       LEU  20  35.470  -0.877  -5.065
  143   HD11  LEU  20          HD11      LEU  20  36.864  -0.667  -2.983
  144   HD12  LEU  20          HD12      LEU  20  36.576   0.865  -3.810
  145   HD13  LEU  20          HD13      LEU  20  38.135   0.055  -3.969
  146   HD21  LEU  20          HD21      LEU  20  36.604   0.892  -6.354
  147   HD22  LEU  20          HD22      LEU  20  36.622  -0.636  -7.234
  148   HD23  LEU  20          HD23      LEU  20  38.076  -0.080  -6.406
  149    H    GLU  21           HN       GLU  21  36.103  -5.228  -6.115
  150    HA   GLU  21           HA       GLU  21  37.468  -7.065  -4.176
  151    HB2  GLU  21           HB2      GLU  21  35.779  -7.594  -6.635
  152    HB3  GLU  21           HB1      GLU  21  36.636  -8.851  -5.743
  153    HG2  GLU  21           HG2      GLU  21  35.409  -8.292  -3.704
  154    HG3  GLU  21           HG1      GLU  21  34.592  -6.968  -4.534
  155    H    GLU  22           HN       GLU  22  39.524  -7.570  -4.561
  156    HA   GLU  22           HA       GLU  22  40.836  -6.659  -7.035
  157    HB2  GLU  22           HB2      GLU  22  42.899  -7.625  -5.762
  158    HB3  GLU  22           HB1      GLU  22  42.141  -6.157  -5.148
  159    HG2  GLU  22           HG2      GLU  22  40.932  -7.397  -3.465
  160    HG3  GLU  22           HG1      GLU  22  41.438  -8.937  -4.163
  161    H    ARG  23           HN       ARG  23  41.102  -7.978  -8.756
  162    HA   ARG  23           HA       ARG  23  41.977 -10.705  -8.484
  163    HB2  ARG  23           HB2      ARG  23  39.827 -11.667  -9.591
  164    HB3  ARG  23           HB1      ARG  23  39.821 -11.375  -7.852
  165    HG2  ARG  23           HG2      ARG  23  38.606  -9.327  -8.100
  166    HG3  ARG  23           HG1      ARG  23  38.842  -9.321  -9.849
  167    HD2  ARG  23           HD2      ARG  23  36.559 -10.212  -8.742
  168    HD3  ARG  23           HD1      ARG  23  37.212 -10.926 -10.216
  169    HE   ARG  23           HE       ARG  23  37.723 -12.881  -8.984
  170   HH11  ARG  23          HH21      ARG  23  36.986 -10.194  -6.951
  171   HH12  ARG  23          HH22      ARG  23  36.938 -11.138  -5.500
  172   HH21  ARG  23          HH11      ARG  23  37.664 -14.128  -7.099
  173   HH22  ARG  23          HH12      ARG  23  37.322 -13.363  -5.583
  174    H    ASP  24           HN       ASP  24  42.167 -11.769 -10.617
  175    HA   ASP  24           HA       ASP  24  42.893 -11.666 -12.839
  176    HB2  ASP  24           HB2      ASP  24  40.491  -9.826 -12.888
  177    HB3  ASP  24           HB1      ASP  24  41.365 -10.306 -14.342
  178    H    ALA  25           HN       ALA  25  44.095  -9.815 -10.892
  179    HA   ALA  25           HA       ALA  25  45.656  -8.078 -10.924
  180    HB1  ALA  25           HB1      ALA  25  46.206  -9.318 -13.140
  181    HB2  ALA  25           HB2      ALA  25  46.825  -7.683 -12.916
  182    HB3  ALA  25           HB3      ALA  25  45.404  -7.955 -13.924
  183    H    GLU  26           HN       GLU  26  42.636  -7.608 -11.069
  184    HA   GLU  26           HA       GLU  26  42.858  -4.678 -11.496
  185    HB2  GLU  26           HB2      GLU  26  40.668  -4.734 -12.778
  186    HB3  GLU  26           HB1      GLU  26  42.065  -5.360 -13.655
  187    HG2  GLU  26           HG2      GLU  26  41.419  -7.660 -13.053
  188    HG3  GLU  26           HG1      GLU  26  40.026  -7.040 -12.166
  189    H    LEU  27           HN       LEU  27  41.036  -3.521 -10.522
  190    HA   LEU  27           HA       LEU  27  39.803  -5.078  -8.288
  191    HB2  LEU  27           HB2      LEU  27  40.554  -2.167  -8.566
  192    HB3  LEU  27           HB1      LEU  27  39.423  -2.711  -7.331
  193    HG   LEU  27           HG       LEU  27  41.226  -4.402  -6.631
  194   HD11  LEU  27          HD11      LEU  27  42.696  -4.369  -8.520
  195   HD12  LEU  27          HD12      LEU  27  43.566  -3.589  -7.206
  196   HD13  LEU  27          HD13      LEU  27  42.826  -2.612  -8.474
  197   HD21  LEU  27          HD21      LEU  27  42.550  -2.592  -5.432
  198   HD22  LEU  27          HD22      LEU  27  40.800  -2.522  -5.221
  199   HD23  LEU  27          HD23      LEU  27  41.598  -1.416  -6.340
  200    H    ILE  28           HN       ILE  28  37.688  -5.453  -8.400
  201    HA   ILE  28           HA       ILE  28  36.075  -3.941 -10.414
  202    HB   ILE  28           HB       ILE  28  35.523  -6.543  -8.968
  203   HG12  ILE  28          HG12      ILE  28  36.167  -6.019 -11.886
  204   HG13  ILE  28          HG11      ILE  28  37.371  -6.514 -10.697
  205   HG21  ILE  28          HG21      ILE  28  33.978  -4.960 -11.032
  206   HG22  ILE  28          HG22      ILE  28  33.418  -5.526  -9.459
  207   HG23  ILE  28          HG23      ILE  28  33.701  -6.681 -10.761
  208   HD11  ILE  28          HD11      ILE  28  34.941  -8.060 -11.615
  209   HD12  ILE  28          HD12      ILE  28  35.875  -8.506 -10.188
  210   HD13  ILE  28          HD13      ILE  28  36.637  -8.517 -11.779
  211    H    CYS  29           HN       CYS  29  34.591  -2.510  -9.750
  212    HA   CYS  29           HA       CYS  29  34.302  -1.925  -6.923
  213    HB2  CYS  29           HB2      CYS  29  33.727  -0.662  -9.429
  214    HB3  CYS  29           HB1      CYS  29  32.243  -0.636  -8.488
  215    H    THR  30           HN       THR  30  32.795  -2.721  -5.516
  216    HA   THR  30           HA       THR  30  30.885  -4.721  -6.490
  217    HB   THR  30           HB       THR  30  30.446  -5.106  -4.119
  218    HG1  THR  30           HG1      THR  30  30.582  -3.402  -2.918
  219   HG21  THR  30          HG21      THR  30  32.832  -5.498  -3.356
  220   HG22  THR  30          HG22      THR  30  33.357  -4.694  -4.834
  221   HG23  THR  30          HG23      THR  30  32.425  -6.189  -4.926
  222    H    GLY  31           HN       GLY  31  28.639  -4.612  -5.510
  223    HA2  GLY  31           HA2      GLY  31  26.743  -3.273  -4.759
  224    HA3  GLY  31           HA1      GLY  31  27.556  -1.832  -5.357
  225    H    GLN  32           HN       GLN  32  24.854  -2.974  -5.958
  226    HA   GLN  32           HA       GLN  32  24.841  -4.003  -8.644
  227    HB2  GLN  32           HB2      GLN  32  22.948  -4.188  -6.994
  228    HB3  GLN  32           HB1      GLN  32  22.649  -2.464  -7.220
  229    HG2  GLN  32           HG2      GLN  32  21.150  -3.674  -8.682
  230    HG3  GLN  32           HG1      GLN  32  22.382  -2.913  -9.688
  231   HE21  GLN  32          HE21      GLN  32  22.488  -4.466 -11.388
  232   HE22  GLN  32          HE22      GLN  32  22.932  -6.086 -11.143
  233    H    ASP  33           HN       ASP  33  24.085  -0.747  -7.359
  234    HA   ASP  33           HA       ASP  33  24.119   0.394 -10.061
  235    HB2  ASP  33           HB2      ASP  33  23.816   1.622  -7.310
  236    HB3  ASP  33           HB1      ASP  33  23.763   2.553  -8.807
  237    H    CYS  34           HN       CYS  34  26.465  -0.459  -7.858
  238    HA   CYS  34           HA       CYS  34  28.374   1.618  -8.894
  239    HB2  CYS  34           HB2      CYS  34  28.344   1.933  -6.560
  240    HB3  CYS  34           HB1      CYS  34  28.163   0.214  -6.236
  241    H    GLY  35           HN       GLY  35  28.817   0.326 -10.756
  242    HA2  GLY  35           HA2      GLY  35  30.221  -2.277 -10.230
  243    HA3  GLY  35           HA1      GLY  35  29.463  -1.835 -11.763
  244    H    LEU  36           HN       LEU  36  31.251  -1.901 -13.060
  245    HA   LEU  36           HA       LEU  36  33.090  -1.005 -14.195
  246    HB2  LEU  36           HB2      LEU  36  33.244   1.113 -12.024
  247    HB3  LEU  36           HB1      LEU  36  33.981   1.159 -13.615
  248    HG   LEU  36           HG       LEU  36  30.988   1.042 -13.130
  249   HD11  LEU  36          HD11      LEU  36  31.687   3.198 -12.407
  250   HD12  LEU  36          HD12      LEU  36  31.151   3.426 -14.071
  251   HD13  LEU  36          HD13      LEU  36  32.874   3.332 -13.704
  252   HD21  LEU  36          HD21      LEU  36  31.368   0.126 -15.266
  253   HD22  LEU  36          HD22      LEU  36  32.744   1.185 -15.583
  254   HD23  LEU  36          HD23      LEU  36  31.105   1.831 -15.618
  255    H    ALA  37           HN       ALA  37  35.450  -0.893 -13.952
  256    HA   ALA  37           HA       ALA  37  36.506  -1.871 -11.351
  257    HB1  ALA  37           HB1      ALA  37  35.822  -3.866 -12.763
  258    HB2  ALA  37           HB2      ALA  37  37.523  -3.833 -12.294
  259    HB3  ALA  37           HB3      ALA  37  37.047  -3.363 -13.926
  260    H    TYR  38           HN       TYR  38  38.745  -1.558 -11.128
  261    HA   TYR  38           HA       TYR  38  39.958   0.241 -13.201
  262    HB2  TYR  38           HB2      TYR  38  40.759   0.164 -10.293
  263    HB3  TYR  38           HB1      TYR  38  41.057   1.436 -11.480
  264    HD1  TYR  38           HD1      TYR  38  38.302  -0.366  -9.713
  265    HD2  TYR  38           HD2      TYR  38  39.535   3.232 -11.709
  266    HE1  TYR  38           HE1      TYR  38  36.171   0.725  -9.068
  267    HE2  TYR  38           HE2      TYR  38  37.403   4.321 -11.061
  268    HH   TYR  38           HH       TYR  38  35.677   3.972  -9.135
  269    HA   PRO  39           HA       PRO  39  42.931  -3.118 -13.490
  270    HB2  PRO  39           HB2      PRO  39  44.781  -1.945 -15.113
  271    HB3  PRO  39           HB1      PRO  39  43.197  -2.486 -15.706
  272    HG2  PRO  39           HG2      PRO  39  44.097   0.268 -14.969
  273    HG3  PRO  39           HG1      PRO  39  43.113  -0.265 -16.344
  274    HD2  PRO  39           HD2      PRO  39  42.034   0.842 -14.073
  275    HD3  PRO  39           HD1      PRO  39  41.161  -0.321 -15.097
  276    H    VAL  40           HN       VAL  40  45.180  -3.600 -12.886
  277    HA   VAL  40           HA       VAL  40  46.244  -1.700 -10.837
  278    HB   VAL  40           HB       VAL  40  46.515  -4.699 -11.156
  279   HG11  VAL  40          HG11      VAL  40  47.973  -2.753  -9.362
  280   HG12  VAL  40          HG12      VAL  40  48.654  -4.017 -10.387
  281   HG13  VAL  40          HG13      VAL  40  47.777  -4.449  -8.918
  282   HG21  VAL  40          HG21      VAL  40  44.425  -3.614 -10.116
  283   HG22  VAL  40          HG22      VAL  40  45.482  -3.115  -8.795
  284   HG23  VAL  40          HG23      VAL  40  45.252  -4.829  -9.141
  285    H    ARG  41           HN       ARG  41  48.206  -0.803 -11.151
  286    HA   ARG  41           HA       ARG  41  49.830  -1.778 -13.486
  287    HB2  ARG  41           HB2      ARG  41  48.919   0.531 -13.692
  288    HB3  ARG  41           HB1      ARG  41  49.773   0.976 -12.213
  289    HG2  ARG  41           HG2      ARG  41  51.918   0.419 -13.256
  290    HG3  ARG  41           HG1      ARG  41  51.087  -0.097 -14.723
  291    HD2  ARG  41           HD2      ARG  41  50.155   2.208 -14.956
  292    HD3  ARG  41           HD1      ARG  41  51.105   2.697 -13.552
  293    HE   ARG  41           HE       ARG  41  53.078   2.584 -14.883
  294   HH11  ARG  41          HH21      ARG  41  50.293   1.295 -16.479
  295   HH12  ARG  41          HH22      ARG  41  51.058   1.232 -18.031
  296   HH21  ARG  41          HH11      ARG  41  54.083   2.492 -16.898
  297   HH22  ARG  41          HH12      ARG  41  53.199   1.906 -18.268
  298    H    ASP  42           HN       ASP  42  51.651  -2.798 -12.909
  299    HA   ASP  42           HA       ASP  42  53.520  -3.459 -11.669
  300    HB2  ASP  42           HB2      ASP  42  54.023  -0.991 -12.090
  301    HB3  ASP  42           HB1      ASP  42  53.409  -0.684 -10.470
  302    H    GLY  43           HN       GLY  43  50.699  -3.570 -10.498
  303    HA2  GLY  43           HA2      GLY  43  50.064  -4.773  -8.520
  304    HA3  GLY  43           HA1      GLY  43  51.579  -4.295  -7.759
  305    H    ILE  44           HN       ILE  44  50.475  -1.541  -9.171
  306    HA   ILE  44           HA       ILE  44  49.219  -0.644  -6.622
  307    HB   ILE  44           HB       ILE  44  50.458   0.927  -8.904
  308   HG12  ILE  44          HG12      ILE  44  51.897   1.586  -6.692
  309   HG13  ILE  44          HG11      ILE  44  51.408  -0.036  -6.215
  310   HG21  ILE  44          HG21      ILE  44  48.644   2.233  -7.985
  311   HG22  ILE  44          HG22      ILE  44  50.150   2.871  -7.327
  312   HG23  ILE  44          HG23      ILE  44  49.128   1.830  -6.335
  313   HD11  ILE  44          HD11      ILE  44  52.288  -0.860  -8.436
  314   HD12  ILE  44          HD12      ILE  44  53.524  -0.210  -7.359
  315   HD13  ILE  44          HD13      ILE  44  52.931   0.758  -8.709
  316    HA   PRO  45           HA       PRO  45  45.387  -0.685  -9.027
  317    HB2  PRO  45           HB2      PRO  45  43.698   0.276  -7.102
  318    HB3  PRO  45           HB1      PRO  45  44.286  -1.394  -7.135
  319    HG2  PRO  45           HG2      PRO  45  45.213   0.897  -5.476
  320    HG3  PRO  45           HG1      PRO  45  45.030  -0.812  -5.040
  321    HD2  PRO  45           HD2      PRO  45  47.447   0.350  -5.649
  322    HD3  PRO  45           HD1      PRO  45  47.113  -1.381  -5.874
  323    H    VAL  46           HN       VAL  46  44.305   0.822 -10.287
  324    HA   VAL  46           HA       VAL  46  45.220   3.635 -10.040
  325    HB   VAL  46           HB       VAL  46  43.396   2.385 -12.119
  326   HG11  VAL  46          HG11      VAL  46  43.254   4.804 -12.082
  327   HG12  VAL  46          HG12      VAL  46  44.238   4.336 -13.469
  328   HG13  VAL  46          HG13      VAL  46  45.009   4.950 -12.006
  329   HG21  VAL  46          HG21      VAL  46  45.652   1.287 -11.962
  330   HG22  VAL  46          HG22      VAL  46  46.391   2.864 -12.241
  331   HG23  VAL  46          HG23      VAL  46  45.392   2.125 -13.492
  332    H    LEU  47           HN       LEU  47  44.056   5.020  -8.841
  333    HA   LEU  47           HA       LEU  47  41.187   4.424  -8.282
  334    HB2  LEU  47           HB2      LEU  47  42.960   6.520  -6.999
  335    HB3  LEU  47           HB1      LEU  47  41.415   5.909  -6.402
  336    HG   LEU  47           HG       LEU  47  43.969   4.299  -6.694
  337   HD11  LEU  47          HD11      LEU  47  42.471   5.323  -4.264
  338   HD12  LEU  47          HD12      LEU  47  44.064   5.845  -4.811
  339   HD13  LEU  47          HD13      LEU  47  43.832   4.205  -4.205
  340   HD21  LEU  47          HD21      LEU  47  42.506   2.639  -5.310
  341   HD22  LEU  47          HD22      LEU  47  42.229   2.747  -7.046
  342   HD23  LEU  47          HD23      LEU  47  41.139   3.568  -5.929
  343    H    LEU  48           HN       LEU  48  42.109   5.512 -10.856
  344    HA   LEU  48           HA       LEU  48  40.963   8.282 -10.765
  345    HB2  LEU  48           HB2      LEU  48  42.555   6.931 -12.964
  346    HB3  LEU  48           HB1      LEU  48  42.061   8.622 -12.915
  347    HG   LEU  48           HG       LEU  48  43.906   7.273 -10.921
  348   HD11  LEU  48          HD11      LEU  48  45.046   7.562 -13.029
  349   HD12  LEU  48          HD12      LEU  48  45.597   8.840 -11.947
  350   HD13  LEU  48          HD13      LEU  48  44.414   9.200 -13.203
  351   HD21  LEU  48          HD21      LEU  48  42.689  10.027 -11.110
  352   HD22  LEU  48          HD22      LEU  48  44.281   9.824 -10.374
  353   HD23  LEU  48          HD23      LEU  48  42.887   8.990  -9.695
  354    H    VAL  49           HN       VAL  49  39.013   8.604 -11.605
  355    HA   VAL  49           HA       VAL  49  37.365   6.469 -12.532
  356    HB   VAL  49           HB       VAL  49  37.026   9.471 -12.784
  357   HG11  VAL  49          HG11      VAL  49  34.568   8.781 -12.955
  358   HG12  VAL  49          HG12      VAL  49  35.156   7.152 -13.287
  359   HG13  VAL  49          HG13      VAL  49  35.562   8.475 -14.381
  360   HG21  VAL  49          HG21      VAL  49  37.232   8.446 -10.467
  361   HG22  VAL  49          HG22      VAL  49  35.772   7.527 -10.827
  362   HG23  VAL  49          HG23      VAL  49  35.712   9.288 -10.772
  363    H    ASP  50           HN       ASP  50  39.097   9.052 -14.253
  364    HA   ASP  50           HA       ASP  50  38.077   8.539 -16.846
  365    HB2  ASP  50           HB2      ASP  50  40.754   9.608 -15.916
  366    HB3  ASP  50           HB1      ASP  50  40.278   9.561 -17.614
  367    H    GLU  51           HN       GLU  51  40.286   6.711 -14.912
  368    HA   GLU  51           HA       GLU  51  41.195   5.126 -17.281
  369    HB2  GLU  51           HB2      GLU  51  42.123   5.120 -14.388
  370    HB3  GLU  51           HB1      GLU  51  42.799   4.114 -15.670
  371    HG2  GLU  51           HG2      GLU  51  42.734   7.145 -15.724
  372    HG3  GLU  51           HG1      GLU  51  44.139   6.184 -15.266
  373    H    ALA  52           HN       ALA  52  38.656   5.161 -15.216
  374    HA   ALA  52           HA       ALA  52  38.547   2.450 -14.266
  375    HB1  ALA  52           HB1      ALA  52  37.132   4.324 -13.393
  376    HB2  ALA  52           HB2      ALA  52  36.197   2.896 -13.827
  377    HB3  ALA  52           HB3      ALA  52  36.224   4.293 -14.904
  378    H    ARG  53           HN       ARG  53  37.525   0.643 -15.168
  379    HA   ARG  53           HA       ARG  53  36.784   0.871 -18.077
  380    HB2  ARG  53           HB2      ARG  53  38.898  -0.387 -17.685
  381    HB3  ARG  53           HB1      ARG  53  38.006  -1.519 -16.665
  382    HG2  ARG  53           HG2      ARG  53  36.566  -2.131 -18.539
  383    HG3  ARG  53           HG1      ARG  53  37.352  -0.931 -19.567
  384    HD2  ARG  53           HD2      ARG  53  38.309  -3.120 -20.043
  385    HD3  ARG  53           HD1      ARG  53  39.520  -2.130 -19.227
  386    HE   ARG  53           HE       ARG  53  38.052  -3.631 -17.277
  387   HH11  ARG  53          HH21      ARG  53  40.365  -3.909 -19.824
  388   HH12  ARG  53          HH22      ARG  53  41.148  -5.294 -19.141
  389   HH21  ARG  53          HH11      ARG  53  39.061  -5.439 -16.371
  390   HH22  ARG  53          HH12      ARG  53  40.409  -6.160 -17.185
  391    H    ARG  54           HN       ARG  54  34.914  -0.114 -18.715
  392    HA   ARG  54           HA       ARG  54  33.058  -0.905 -16.567
  393    HB2  ARG  54           HB2      ARG  54  32.020  -1.046 -19.333
  394    HB3  ARG  54           HB1      ARG  54  31.409  -0.130 -17.957
  395    HG2  ARG  54           HG2      ARG  54  33.317   1.503 -18.338
  396    HG3  ARG  54           HG1      ARG  54  33.639   0.655 -19.851
  397    HD2  ARG  54           HD2      ARG  54  32.204   2.460 -20.442
  398    HD3  ARG  54           HD1      ARG  54  31.163   1.036 -20.407
  399    HE   ARG  54           HE       ARG  54  31.213   2.358 -17.835
  400   HH11  ARG  54          HH21      ARG  54  29.959   2.436 -21.050
  401   HH12  ARG  54          HH22      ARG  54  28.523   3.298 -20.610
  402   HH21  ARG  54          HH11      ARG  54  29.347   3.480 -17.242
  403   HH22  ARG  54          HH12      ARG  54  28.177   3.889 -18.452
  404    HA   PRO  55           HA       PRO  55  32.895  -5.255 -17.250
  405    HB2  PRO  55           HB2      PRO  55  30.173  -5.186 -18.481
  406    HB3  PRO  55           HB1      PRO  55  30.730  -6.034 -17.024
  407    HG2  PRO  55           HG2      PRO  55  29.205  -3.860 -16.845
  408    HG3  PRO  55           HG1      PRO  55  30.520  -4.156 -15.693
  409    HD2  PRO  55           HD2      PRO  55  30.456  -2.273 -18.036
  410    HD3  PRO  55           HD1      PRO  55  31.143  -2.038 -16.413
  411    H    GLU  56           HN       GLU  56  33.415  -6.820 -18.808
  412    HA   GLU  56           HA       GLU  56  34.017  -7.666 -20.898
  413    HB2  GLU  56           HB2      GLU  56  31.472  -7.253 -21.205
  414    HB3  GLU  56           HB1      GLU  56  31.956  -5.838 -22.137
  415    HG2  GLU  56           HG2      GLU  56  32.950  -8.651 -22.697
  416    HG3  GLU  56           HG1      GLU  56  31.601  -7.893 -23.542
  Start of MODEL   19
    1    H1   MET   1           HT1      MET   1  54.772  -3.892  20.253
    2    H2   MET   1           HT2      MET   1  53.300  -3.094  20.526
    3    H3   MET   1           HT3      MET   1  54.311  -3.486  21.833
    4    HA   MET   1           HA       MET   1  54.906  -1.328  21.633
    5    HB2  MET   1           HB2      MET   1  56.521  -2.523  19.363
    6    HB3  MET   1           HB1      MET   1  56.973  -1.155  20.382
    7    HG2  MET   1           HG2      MET   1  58.145  -2.973  21.334
    8    HG3  MET   1           HG1      MET   1  56.727  -2.803  22.367
    9    HE1  MET   1           HE1      MET   1  57.654  -5.974  19.222
   10    HE2  MET   1           HE2      MET   1  58.824  -5.334  20.374
   11    HE3  MET   1           HE3      MET   1  58.089  -4.259  19.189
   12    HA   PRO   2           HA       PRO   2  52.416  -0.262  17.857
   13    HB2  PRO   2           HB2      PRO   2  50.340   1.002  19.118
   14    HB3  PRO   2           HB1      PRO   2  50.383  -0.750  18.842
   15    HG2  PRO   2           HG2      PRO   2  50.885   0.778  21.340
   16    HG3  PRO   2           HG1      PRO   2  50.184  -0.833  21.124
   17    HD2  PRO   2           HD2      PRO   2  52.836  -0.304  21.902
   18    HD3  PRO   2           HD1      PRO   2  52.237  -1.857  21.287
   19    H    LEU   3           HN       LEU   3  53.485   1.383  16.948
   20    HA   LEU   3           HA       LEU   3  54.550   3.632  18.326
   21    HB2  LEU   3           HB2      LEU   3  55.430   2.924  16.145
   22    HB3  LEU   3           HB1      LEU   3  53.882   3.278  15.378
   23    HG   LEU   3           HG       LEU   3  54.123   5.660  15.936
   24   HD11  LEU   3          HD11      LEU   3  56.534   6.273  16.815
   25   HD12  LEU   3          HD12      LEU   3  56.522   4.625  17.441
   26   HD13  LEU   3          HD13      LEU   3  55.291   5.779  17.958
   27   HD21  LEU   3          HD21      LEU   3  55.054   5.083  13.823
   28   HD22  LEU   3          HD22      LEU   3  56.476   4.351  14.569
   29   HD23  LEU   3          HD23      LEU   3  56.257   6.101  14.615
   30    H    GLU   4           HN       GLU   4  51.561   3.153  16.498
   31    HA   GLU   4           HA       GLU   4  50.127   5.134  18.006
   32    HB2  GLU   4           HB2      GLU   4  49.787   6.786  16.193
   33    HB3  GLU   4           HB1      GLU   4  51.468   6.715  16.712
   34    HG2  GLU   4           HG2      GLU   4  51.970   5.189  14.814
   35    HG3  GLU   4           HG1      GLU   4  50.297   5.336  14.276
   36    H    ALA   5           HN       ALA   5  47.966   4.916  17.687
   37    HA   ALA   5           HA       ALA   5  46.970   2.607  16.334
   38    HB1  ALA   5           HB1      ALA   5  45.915   3.874  18.296
   39    HB2  ALA   5           HB2      ALA   5  44.810   3.322  17.039
   40    HB3  ALA   5           HB3      ALA   5  45.304   5.014  17.098
   41    H    GLY   6           HN       GLY   6  47.694   2.758  14.197
   42    HA2  GLY   6           HA2      GLY   6  47.081   4.977  12.450
   43    HA3  GLY   6           HA1      GLY   6  47.636   3.384  11.939
   44    H    LEU   7           HN       LEU   7  45.596   4.943  10.685
   45    HA   LEU   7           HA       LEU   7  43.008   3.729  11.388
   46    HB2  LEU   7           HB2      LEU   7  43.762   5.509   9.048
   47    HB3  LEU   7           HB1      LEU   7  42.127   5.109   9.572
   48    HG   LEU   7           HG       LEU   7  44.182   6.549  11.275
   49   HD11  LEU   7          HD11      LEU   7  41.700   7.622   9.904
   50   HD12  LEU   7          HD12      LEU   7  43.350   7.891   9.342
   51   HD13  LEU   7          HD13      LEU   7  42.828   8.545  10.896
   52   HD21  LEU   7          HD21      LEU   7  41.897   7.044  12.535
   53   HD22  LEU   7          HD22      LEU   7  42.757   5.536  12.820
   54   HD23  LEU   7          HD23      LEU   7  41.370   5.564  11.733
   55    H    LEU   8           HN       LEU   8  42.236   1.935  10.526
   56    HA   LEU   8           HA       LEU   8  43.771   0.281   8.769
   57    HB2  LEU   8           HB2      LEU   8  41.719  -0.220  10.452
   58    HB3  LEU   8           HB1      LEU   8  40.785  -0.094   8.962
   59    HG   LEU   8           HG       LEU   8  43.176  -1.905   9.397
   60   HD11  LEU   8          HD11      LEU   8  41.409  -3.686   9.057
   61   HD12  LEU   8          HD12      LEU   8  40.202  -2.413   9.238
   62   HD13  LEU   8          HD13      LEU   8  41.292  -2.793  10.572
   63   HD21  LEU   8          HD21      LEU   8  42.209  -2.831   7.134
   64   HD22  LEU   8          HD22      LEU   8  43.242  -1.409   7.114
   65   HD23  LEU   8          HD23      LEU   8  41.492  -1.225   6.989
   66    H    GLU   9           HN       GLU   9  40.973   2.385   8.241
   67    HA   GLU   9           HA       GLU   9  40.062   3.288   6.292
   68    HB2  GLU   9           HB2      GLU   9  42.450   4.059   6.060
   69    HB3  GLU   9           HB1      GLU   9  42.744   2.642   5.052
   70    HG2  GLU   9           HG2      GLU   9  42.233   4.459   3.566
   71    HG3  GLU   9           HG1      GLU   9  40.825   3.400   3.586
   72    H    ILE  10           HN       ILE  10  38.489   2.013   5.555
   73    HA   ILE  10           HA       ILE  10  39.029  -0.635   4.415
   74    HB   ILE  10           HB       ILE  10  36.999  -0.196   5.777
   75   HG12  ILE  10          HG12      ILE  10  36.268  -0.813   2.904
   76   HG13  ILE  10          HG11      ILE  10  37.132  -1.952   3.938
   77   HG21  ILE  10          HG21      ILE  10  36.721   2.168   4.819
   78   HG22  ILE  10          HG22      ILE  10  35.245   1.221   5.001
   79   HG23  ILE  10          HG23      ILE  10  35.989   1.397   3.412
   80   HD11  ILE  10          HD11      ILE  10  35.300  -1.982   5.530
   81   HD12  ILE  10          HD12      ILE  10  34.651  -2.312   3.924
   82   HD13  ILE  10          HD13      ILE  10  34.458  -0.713   4.642
   83    H    LEU  11           HN       LEU  11  38.652  -1.232   2.284
   84    HA   LEU  11           HA       LEU  11  39.380   0.704   0.281
   85    HB2  LEU  11           HB2      LEU  11  38.184  -2.057  -0.129
   86    HB3  LEU  11           HB1      LEU  11  39.127  -1.129  -1.296
   87    HG   LEU  11           HG       LEU  11  40.147  -2.120   1.382
   88   HD11  LEU  11          HD11      LEU  11  41.550  -3.622   0.002
   89   HD12  LEU  11          HD12      LEU  11  40.740  -3.032  -1.450
   90   HD13  LEU  11          HD13      LEU  11  39.832  -3.943  -0.242
   91   HD21  LEU  11          HD21      LEU  11  41.402  -0.189   0.943
   92   HD22  LEU  11          HD22      LEU  11  41.317  -0.403  -0.807
   93   HD23  LEU  11          HD23      LEU  11  42.378  -1.429   0.159
   94    H    ALA  12           HN       ALA  12  38.161   1.875  -1.050
   95    HA   ALA  12           HA       ALA  12  35.331   1.259  -1.519
   96    HB1  ALA  12           HB1      ALA  12  36.206   3.698   0.041
   97    HB2  ALA  12           HB2      ALA  12  35.049   2.459   0.530
   98    HB3  ALA  12           HB3      ALA  12  34.641   3.581  -0.767
   99    H    CYS  13           HN       CYS  13  34.452   2.493  -3.228
  100    HA   CYS  13           HA       CYS  13  36.405   3.236  -5.201
  101    HB2  CYS  13           HB2      CYS  13  33.573   4.029  -5.704
  102    HB3  CYS  13           HB1      CYS  13  34.668   3.079  -6.708
  103    HA   PRO  14           HA       PRO  14  36.641   7.591  -4.355
  104    HB2  PRO  14           HB2      PRO  14  37.315   8.539  -6.836
  105    HB3  PRO  14           HB1      PRO  14  38.437   7.603  -5.835
  106    HG2  PRO  14           HG2      PRO  14  36.747   6.689  -8.119
  107    HG3  PRO  14           HG1      PRO  14  38.433   6.293  -7.741
  108    HD2  PRO  14           HD2      PRO  14  36.365   4.615  -7.165
  109    HD3  PRO  14           HD1      PRO  14  37.852   4.689  -6.190
  110    H    ALA  15           HN       ALA  15  34.329   6.256  -6.467
  111    HA   ALA  15           HA       ALA  15  32.737   8.807  -6.417
  112    HB1  ALA  15           HB1      ALA  15  33.156   6.869  -8.712
  113    HB2  ALA  15           HB2      ALA  15  33.493   8.600  -8.684
  114    HB3  ALA  15           HB3      ALA  15  31.826   8.028  -8.666
  115    H    CYS  16           HN       CYS  16  32.510   5.304  -7.082
  116    HA   CYS  16           HA       CYS  16  29.704   5.139  -6.491
  117    HB2  CYS  16           HB2      CYS  16  31.220   2.658  -5.980
  118    HB3  CYS  16           HB1      CYS  16  29.960   2.961  -7.162
  119    H    HIS  17           HN       HIS  17  32.583   4.984  -4.535
  120    HA   HIS  17           HA       HIS  17  32.893   4.938  -2.222
  121    HB2  HIS  17           HB2      HIS  17  31.020   6.685  -2.388
  122    HB3  HIS  17           HB1      HIS  17  29.914   5.383  -1.948
  123    HD2  HIS  17           HD2      HIS  17  32.721   7.552  -0.287
  124    HE1  HIS  17           HE1      HIS  17  31.078   5.041   2.686
  125    HE2  HIS  17           HE2      HIS  17  32.650   6.985   2.257
  126    H    ALA  18           HN       ALA  18  31.142   2.768  -3.955
  127    HA   ALA  18           HA       ALA  18  30.190   1.065  -1.773
  128    HB1  ALA  18           HB1      ALA  18  29.823   1.243  -4.605
  129    HB2  ALA  18           HB2      ALA  18  28.977   0.176  -3.501
  130    HB3  ALA  18           HB3      ALA  18  30.460  -0.366  -4.287
  131    HA   PRO  19           HA       PRO  19  33.781  -1.363  -1.088
  132    HB2  PRO  19           HB2      PRO  19  32.885  -3.959  -1.120
  133    HB3  PRO  19           HB1      PRO  19  32.513  -2.818   0.189
  134    HG2  PRO  19           HG2      PRO  19  30.836  -3.622  -2.149
  135    HG3  PRO  19           HG1      PRO  19  30.368  -3.399  -0.452
  136    HD2  PRO  19           HD2      PRO  19  29.888  -1.527  -2.330
  137    HD3  PRO  19           HD1      PRO  19  30.230  -1.086  -0.652
  138    H    LEU  20           HN       LEU  20  35.411  -2.617  -2.057
  139    HA   LEU  20           HA       LEU  20  35.031  -3.143  -4.994
  140    HB2  LEU  20           HB2      LEU  20  37.628  -2.643  -3.514
  141    HB3  LEU  20           HB1      LEU  20  37.383  -2.715  -5.257
  142    HG   LEU  20           HG       LEU  20  36.072  -0.670  -3.442
  143   HD11  LEU  20          HD11      LEU  20  38.547  -0.412  -3.576
  144   HD12  LEU  20          HD12      LEU  20  37.686   0.922  -4.342
  145   HD13  LEU  20          HD13      LEU  20  38.418  -0.339  -5.333
  146   HD21  LEU  20          HD21      LEU  20  34.729  -0.900  -5.377
  147   HD22  LEU  20          HD22      LEU  20  36.126  -1.148  -6.428
  148   HD23  LEU  20          HD23      LEU  20  35.789   0.449  -5.768
  149    H    GLU  21           HN       GLU  21  35.961  -4.987  -5.872
  150    HA   GLU  21           HA       GLU  21  36.706  -7.148  -3.916
  151    HB2  GLU  21           HB2      GLU  21  34.826  -7.258  -6.284
  152    HB3  GLU  21           HB1      GLU  21  35.533  -8.704  -5.567
  153    HG2  GLU  21           HG2      GLU  21  33.993  -6.653  -3.969
  154    HG3  GLU  21           HG1      GLU  21  33.256  -8.103  -4.656
  155    H    GLU  22           HN       GLU  22  38.384  -8.384  -4.471
  156    HA   GLU  22           HA       GLU  22  40.064  -7.493  -6.708
  157    HB2  GLU  22           HB2      GLU  22  40.458  -9.552  -4.518
  158    HB3  GLU  22           HB1      GLU  22  41.658  -9.218  -5.768
  159    HG2  GLU  22           HG2      GLU  22  41.836  -6.914  -5.071
  160    HG3  GLU  22           HG1      GLU  22  40.503  -7.101  -3.934
  161    H    ARG  23           HN       ARG  23  40.173  -8.432  -8.630
  162    HA   ARG  23           HA       ARG  23  39.068 -11.226  -8.940
  163    HB2  ARG  23           HB2      ARG  23  37.557  -9.510  -9.903
  164    HB3  ARG  23           HB1      ARG  23  38.884  -8.947 -10.924
  165    HG2  ARG  23           HG2      ARG  23  39.026 -11.085 -12.034
  166    HG3  ARG  23           HG1      ARG  23  37.861 -11.796 -10.914
  167    HD2  ARG  23           HD2      ARG  23  36.165 -10.143 -11.725
  168    HD3  ARG  23           HD1      ARG  23  37.333  -9.593 -12.929
  169    HE   ARG  23           HE       ARG  23  37.071 -12.417 -13.181
  170   HH11  ARG  23          HH21      ARG  23  35.254  -9.491 -13.569
  171   HH12  ARG  23          HH22      ARG  23  34.245 -10.142 -14.818
  172   HH21  ARG  23          HH11      ARG  23  35.760 -13.258 -14.804
  173   HH22  ARG  23          HH12      ARG  23  34.532 -12.265 -15.515
  174    H    ASP  24           HN       ASP  24  40.031 -12.436 -10.629
  175    HA   ASP  24           HA       ASP  24  42.215 -13.367 -11.167
  176    HB2  ASP  24           HB2      ASP  24  40.997 -12.892 -13.212
  177    HB3  ASP  24           HB1      ASP  24  41.490 -11.198 -13.158
  178    H    ALA  25           HN       ALA  25  42.801 -10.146 -12.422
  179    HA   ALA  25           HA       ALA  25  44.942  -9.682 -10.397
  180    HB1  ALA  25           HB1      ALA  25  46.557  -9.150 -12.171
  181    HB2  ALA  25           HB2      ALA  25  45.365  -9.580 -13.399
  182    HB3  ALA  25           HB3      ALA  25  46.004 -10.818 -12.315
  183    H    GLU  26           HN       GLU  26  42.285  -8.500 -11.003
  184    HA   GLU  26           HA       GLU  26  43.198  -5.670 -11.211
  185    HB2  GLU  26           HB2      GLU  26  40.923  -6.816 -12.855
  186    HB3  GLU  26           HB1      GLU  26  41.387  -5.116 -12.771
  187    HG2  GLU  26           HG2      GLU  26  42.512  -5.820 -14.702
  188    HG3  GLU  26           HG1      GLU  26  43.764  -5.985 -13.475
  189    H    LEU  27           HN       LEU  27  41.425  -4.169 -10.601
  190    HA   LEU  27           HA       LEU  27  39.922  -5.308  -8.297
  191    HB2  LEU  27           HB2      LEU  27  40.840  -2.546  -9.077
  192    HB3  LEU  27           HB1      LEU  27  39.555  -2.733  -7.890
  193    HG   LEU  27           HG       LEU  27  41.878  -2.575  -6.906
  194   HD11  LEU  27          HD11      LEU  27  41.366  -4.052  -5.181
  195   HD12  LEU  27          HD12      LEU  27  40.776  -5.297  -6.265
  196   HD13  LEU  27          HD13      LEU  27  39.787  -3.883  -5.934
  197   HD21  LEU  27          HD21      LEU  27  42.854  -4.008  -8.826
  198   HD22  LEU  27          HD22      LEU  27  42.233  -5.397  -7.935
  199   HD23  LEU  27          HD23      LEU  27  43.441  -4.350  -7.198
  200    H    ILE  28           HN       ILE  28  37.801  -5.421  -8.209
  201    HA   ILE  28           HA       ILE  28  36.236  -4.259 -10.505
  202    HB   ILE  28           HB       ILE  28  35.645  -6.771  -8.907
  203   HG12  ILE  28          HG12      ILE  28  37.621  -7.077 -10.323
  204   HG13  ILE  28          HG11      ILE  28  36.253  -7.935 -11.023
  205   HG21  ILE  28          HG21      ILE  28  34.367  -5.458 -11.317
  206   HG22  ILE  28          HG22      ILE  28  33.618  -5.755  -9.749
  207   HG23  ILE  28          HG23      ILE  28  34.010  -7.108 -10.812
  208   HD11  ILE  28          HD11      ILE  28  35.912  -5.654 -12.357
  209   HD12  ILE  28          HD12      ILE  28  37.084  -6.842 -12.901
  210   HD13  ILE  28          HD13      ILE  28  37.616  -5.447 -11.979
  211    H    CYS  29           HN       CYS  29  34.657  -2.938 -10.030
  212    HA   CYS  29           HA       CYS  29  34.201  -2.068  -7.310
  213    HB2  CYS  29           HB2      CYS  29  33.301  -1.315 -10.023
  214    HB3  CYS  29           HB1      CYS  29  32.102  -1.026  -8.791
  215    H    THR  30           HN       THR  30  32.828  -2.870  -5.842
  216    HA   THR  30           HA       THR  30  30.659  -4.719  -6.822
  217    HB   THR  30           HB       THR  30  32.229  -4.839  -4.230
  218    HG1  THR  30           HG1      THR  30  32.398  -6.137  -6.711
  219   HG21  THR  30          HG21      THR  30  31.043  -7.137  -4.215
  220   HG22  THR  30          HG22      THR  30  29.943  -6.425  -5.396
  221   HG23  THR  30          HG23      THR  30  30.087  -5.717  -3.787
  222    H    GLY  31           HN       GLY  31  28.702  -4.042  -6.388
  223    HA2  GLY  31           HA2      GLY  31  27.639  -3.148  -3.993
  224    HA3  GLY  31           HA1      GLY  31  28.190  -1.671  -4.777
  225    H    GLN  32           HN       GLN  32  25.864  -1.162  -4.744
  226    HA   GLN  32           HA       GLN  32  23.996  -2.669  -6.380
  227    HB2  GLN  32           HB2      GLN  32  23.297  -1.213  -4.468
  228    HB3  GLN  32           HB1      GLN  32  23.816   0.200  -5.388
  229    HG2  GLN  32           HG2      GLN  32  22.214  -0.346  -7.169
  230    HG3  GLN  32           HG1      GLN  32  21.716  -1.791  -6.291
  231   HE21  GLN  32          HE21      GLN  32  19.604  -1.262  -5.640
  232   HE22  GLN  32          HE22      GLN  32  19.203   0.121  -4.740
  233    H    ASP  33           HN       ASP  33  25.412   0.595  -6.761
  234    HA   ASP  33           HA       ASP  33  24.846   0.462  -9.688
  235    HB2  ASP  33           HB2      ASP  33  24.183   2.491  -8.374
  236    HB3  ASP  33           HB1      ASP  33  25.889   2.779  -8.019
  237    H    CYS  34           HN       CYS  34  27.112  -0.822  -7.957
  238    HA   CYS  34           HA       CYS  34  29.505   0.338  -9.261
  239    HB2  CYS  34           HB2      CYS  34  28.945  -1.392  -6.947
  240    HB3  CYS  34           HB1      CYS  34  30.330  -1.936  -7.863
  241    H    GLY  35           HN       GLY  35  31.021  -1.127 -10.326
  242    HA2  GLY  35           HA2      GLY  35  30.637  -3.690 -11.273
  243    HA3  GLY  35           HA1      GLY  35  29.670  -2.704 -12.372
  244    H    LEU  36           HN       LEU  36  31.871  -0.544 -11.613
  245    HA   LEU  36           HA       LEU  36  33.338  -0.753 -14.056
  246    HB2  LEU  36           HB2      LEU  36  34.098   0.809 -11.566
  247    HB3  LEU  36           HB1      LEU  36  34.661   1.111 -13.210
  248    HG   LEU  36           HG       LEU  36  31.771   1.275 -12.304
  249   HD11  LEU  36          HD11      LEU  36  33.868   3.387 -12.867
  250   HD12  LEU  36          HD12      LEU  36  32.967   3.138 -11.371
  251   HD13  LEU  36          HD13      LEU  36  32.141   3.739 -12.808
  252   HD21  LEU  36          HD21      LEU  36  33.169   1.596 -14.960
  253   HD22  LEU  36          HD22      LEU  36  31.690   2.498 -14.631
  254   HD23  LEU  36          HD23      LEU  36  31.674   0.740 -14.589
  255    H    ALA  37           HN       ALA  37  35.684  -0.941 -14.240
  256    HA   ALA  37           HA       ALA  37  36.897  -2.767 -12.179
  257    HB1  ALA  37           HB1      ALA  37  37.801  -4.163 -13.940
  258    HB2  ALA  37           HB2      ALA  37  37.116  -3.113 -15.181
  259    HB3  ALA  37           HB3      ALA  37  36.053  -4.065 -14.143
  260    H    TYR  38           HN       TYR  38  39.021  -2.459 -11.802
  261    HA   TYR  38           HA       TYR  38  40.404  -0.341 -13.385
  262    HB2  TYR  38           HB2      TYR  38  40.899  -0.683 -10.448
  263    HB3  TYR  38           HB1      TYR  38  41.214   0.714 -11.475
  264    HD1  TYR  38           HD2      TYR  38  38.398  -1.424 -10.236
  265    HD2  TYR  38           HD1      TYR  38  39.654   2.462 -11.557
  266    HE1  TYR  38           HE2      TYR  38  36.177  -0.523  -9.686
  267    HE2  TYR  38           HE1      TYR  38  37.420   3.374 -10.983
  268    HH   TYR  38           HH       TYR  38  35.508   2.577  -9.224
  269    HA   PRO  39           HA       PRO  39  43.427  -3.682 -13.537
  270    HB2  PRO  39           HB2      PRO  39  45.280  -2.465 -15.115
  271    HB3  PRO  39           HB1      PRO  39  43.741  -3.077 -15.753
  272    HG2  PRO  39           HG2      PRO  39  44.525  -0.278 -15.073
  273    HG3  PRO  39           HG1      PRO  39  43.552  -0.882 -16.427
  274    HD2  PRO  39           HD2      PRO  39  42.490   0.244 -14.137
  275    HD3  PRO  39           HD1      PRO  39  41.615  -0.886 -15.203
  276    H    VAL  40           HN       VAL  40  45.752  -3.981 -12.996
  277    HA   VAL  40           HA       VAL  40  46.498  -2.259 -10.696
  278    HB   VAL  40           HB       VAL  40  47.546  -4.934 -11.657
  279   HG11  VAL  40          HG11      VAL  40  49.392  -3.832 -10.621
  280   HG12  VAL  40          HG12      VAL  40  48.701  -4.862  -9.368
  281   HG13  VAL  40          HG13      VAL  40  48.365  -3.131  -9.371
  282   HG21  VAL  40          HG21      VAL  40  45.241  -4.753 -10.567
  283   HG22  VAL  40          HG22      VAL  40  46.073  -4.221  -9.108
  284   HG23  VAL  40          HG23      VAL  40  46.380  -5.831  -9.763
  285    H    ARG  41           HN       ARG  41  48.067  -0.816 -10.813
  286    HA   ARG  41           HA       ARG  41  50.167  -1.083 -12.916
  287    HB2  ARG  41           HB2      ARG  41  48.290   0.500 -13.627
  288    HB3  ARG  41           HB1      ARG  41  48.791   1.540 -12.294
  289    HG2  ARG  41           HG2      ARG  41  50.099   2.423 -14.016
  290    HG3  ARG  41           HG1      ARG  41  51.213   1.222 -13.365
  291    HD2  ARG  41           HD2      ARG  41  50.442  -0.410 -15.064
  292    HD3  ARG  41           HD1      ARG  41  49.337   0.799 -15.710
  293    HE   ARG  41           HE       ARG  41  51.177   1.866 -16.740
  294   HH11  ARG  41          HH21      ARG  41  52.174  -0.472 -14.385
  295   HH12  ARG  41          HH22      ARG  41  53.843  -0.398 -14.845
  296   HH21  ARG  41          HH11      ARG  41  53.336   1.956 -17.337
  297   HH22  ARG  41          HH12      ARG  41  54.497   0.971 -16.511
  298    H    ASP  42           HN       ASP  42  52.140  -0.392 -12.299
  299    HA   ASP  42           HA       ASP  42  53.881   0.152 -10.845
  300    HB2  ASP  42           HB2      ASP  42  51.759   2.119  -9.966
  301    HB3  ASP  42           HB1      ASP  42  53.398   2.127  -9.321
  302    H    GLY  43           HN       GLY  43  51.903  -1.928 -10.123
  303    HA2  GLY  43           HA2      GLY  43  51.775  -3.462  -8.345
  304    HA3  GLY  43           HA1      GLY  43  52.867  -2.426  -7.425
  305    H    ILE  44           HN       ILE  44  50.254  -0.695  -8.707
  306    HA   ILE  44           HA       ILE  44  48.610  -1.091  -6.246
  307    HB   ILE  44           HB       ILE  44  48.333   1.430  -6.178
  308   HG12  ILE  44          HG12      ILE  44  50.776   1.324  -7.976
  309   HG13  ILE  44          HG11      ILE  44  49.170   1.849  -8.483
  310   HG21  ILE  44          HG21      ILE  44  50.407   1.763  -4.945
  311   HG22  ILE  44          HG22      ILE  44  51.147   0.386  -5.762
  312   HG23  ILE  44          HG23      ILE  44  49.810   0.131  -4.640
  313   HD11  ILE  44          HD11      ILE  44  50.914   3.138  -6.367
  314   HD12  ILE  44          HD12      ILE  44  49.244   3.605  -6.692
  315   HD13  ILE  44          HD13      ILE  44  50.479   3.818  -7.934
  316    HA   PRO  45           HA       PRO  45  45.310  -0.982  -9.213
  317    HB2  PRO  45           HB2      PRO  45  43.203  -0.296  -7.619
  318    HB3  PRO  45           HB1      PRO  45  43.986  -1.889  -7.554
  319    HG2  PRO  45           HG2      PRO  45  44.377   0.475  -5.765
  320    HG3  PRO  45           HG1      PRO  45  44.217  -1.242  -5.344
  321    HD2  PRO  45           HD2      PRO  45  46.635   0.010  -5.469
  322    HD3  PRO  45           HD1      PRO  45  46.428  -1.715  -5.848
  323    H    VAL  46           HN       VAL  46  44.175   0.449 -10.513
  324    HA   VAL  46           HA       VAL  46  44.901   3.293 -10.215
  325    HB   VAL  46           HB       VAL  46  43.308   1.828 -12.343
  326   HG11  VAL  46          HG11      VAL  46  42.610   4.100 -12.411
  327   HG12  VAL  46          HG12      VAL  46  43.877   3.983 -13.632
  328   HG13  VAL  46          HG13      VAL  46  44.231   4.693 -12.056
  329   HG21  VAL  46          HG21      VAL  46  45.641   1.139 -12.302
  330   HG22  VAL  46          HG22      VAL  46  46.174   2.816 -12.182
  331   HG23  VAL  46          HG23      VAL  46  45.415   2.237 -13.665
  332    H    LEU  47           HN       LEU  47  43.724   4.106  -8.532
  333    HA   LEU  47           HA       LEU  47  40.840   3.655  -8.276
  334    HB2  LEU  47           HB2      LEU  47  42.591   5.679  -6.840
  335    HB3  LEU  47           HB1      LEU  47  41.002   5.101  -6.335
  336    HG   LEU  47           HG       LEU  47  43.497   3.396  -6.590
  337   HD11  LEU  47          HD11      LEU  47  41.975   4.452  -4.191
  338   HD12  LEU  47          HD12      LEU  47  43.632   4.848  -4.649
  339   HD13  LEU  47          HD13      LEU  47  43.233   3.221  -4.100
  340   HD21  LEU  47          HD21      LEU  47  41.887   1.784  -5.285
  341   HD22  LEU  47          HD22      LEU  47  41.717   1.925  -7.031
  342   HD23  LEU  47          HD23      LEU  47  40.606   2.788  -5.965
  343    H    LEU  48           HN       LEU  48  41.637   4.751 -10.783
  344    HA   LEU  48           HA       LEU  48  40.459   7.520 -10.630
  345    HB2  LEU  48           HB2      LEU  48  42.208   6.392 -12.833
  346    HB3  LEU  48           HB1      LEU  48  41.690   8.065 -12.609
  347    HG   LEU  48           HG       LEU  48  43.452   6.520 -10.688
  348   HD11  LEU  48          HD11      LEU  48  44.036   8.628 -12.778
  349   HD12  LEU  48          HD12      LEU  48  44.753   7.023 -12.630
  350   HD13  LEU  48          HD13      LEU  48  45.142   8.276 -11.451
  351   HD21  LEU  48          HD21      LEU  48  42.307   8.097  -9.372
  352   HD22  LEU  48          HD22      LEU  48  42.239   9.285 -10.674
  353   HD23  LEU  48          HD23      LEU  48  43.759   8.979  -9.836
  354    H    VAL  49           HN       VAL  49  38.461   7.578 -11.317
  355    HA   VAL  49           HA       VAL  49  37.124   5.439 -12.677
  356    HB   VAL  49           HB       VAL  49  35.353   7.333 -13.057
  357   HG11  VAL  49          HG11      VAL  49  34.878   7.323 -10.528
  358   HG12  VAL  49          HG12      VAL  49  36.336   6.344 -10.382
  359   HG13  VAL  49          HG13      VAL  49  34.974   5.757 -11.332
  360   HG21  VAL  49          HG21      VAL  49  37.205   9.108 -12.706
  361   HG22  VAL  49          HG22      VAL  49  37.070   8.731 -10.986
  362   HG23  VAL  49          HG23      VAL  49  35.676   9.364 -11.864
  363    H    ASP  50           HN       ASP  50  38.792   8.308 -13.760
  364    HA   ASP  50           HA       ASP  50  37.747   8.443 -16.409
  365    HB2  ASP  50           HB2      ASP  50  39.070  10.263 -15.374
  366    HB3  ASP  50           HB1      ASP  50  40.500   9.236 -15.400
  367    H    GLU  51           HN       GLU  51  40.575   6.754 -15.077
  368    HA   GLU  51           HA       GLU  51  41.115   5.499 -17.715
  369    HB2  GLU  51           HB2      GLU  51  42.546   5.358 -15.034
  370    HB3  GLU  51           HB1      GLU  51  43.069   4.490 -16.477
  371    HG2  GLU  51           HG2      GLU  51  44.345   6.455 -16.604
  372    HG3  GLU  51           HG1      GLU  51  42.976   6.851 -17.636
  373    H    ALA  52           HN       ALA  52  39.143   4.925 -15.111
  374    HA   ALA  52           HA       ALA  52  39.443   2.081 -14.764
  375    HB1  ALA  52           HB1      ALA  52  38.261   3.486 -13.136
  376    HB2  ALA  52           HB2      ALA  52  37.212   2.197 -13.718
  377    HB3  ALA  52           HB3      ALA  52  37.014   3.840 -14.330
  378    H    ARG  53           HN       ARG  53  38.156   0.407 -15.601
  379    HA   ARG  53           HA       ARG  53  37.047   0.987 -18.325
  380    HB2  ARG  53           HB2      ARG  53  38.002  -1.596 -17.056
  381    HB3  ARG  53           HB1      ARG  53  37.313  -1.464 -18.675
  382    HG2  ARG  53           HG2      ARG  53  39.096   0.062 -19.352
  383    HG3  ARG  53           HG1      ARG  53  39.764   0.041 -17.720
  384    HD2  ARG  53           HD2      ARG  53  41.043  -1.494 -19.123
  385    HD3  ARG  53           HD1      ARG  53  40.122  -2.425 -17.942
  386    HE   ARG  53           HE       ARG  53  38.590  -2.140 -20.359
  387   HH11  ARG  53          HH21      ARG  53  41.349  -3.743 -18.996
  388   HH12  ARG  53          HH22      ARG  53  41.223  -5.110 -20.052
  389   HH21  ARG  53          HH11      ARG  53  38.433  -3.919 -21.724
  390   HH22  ARG  53          HH12      ARG  53  39.581  -5.208 -21.588
  391    H    ARG  54           HN       ARG  54  35.018   0.383 -18.872
  392    HA   ARG  54           HA       ARG  54  33.200  -0.213 -16.632
  393    HB2  ARG  54           HB2      ARG  54  31.468   0.242 -18.605
  394    HB3  ARG  54           HB1      ARG  54  32.283   1.576 -17.796
  395    HG2  ARG  54           HG2      ARG  54  33.692   0.333 -20.139
  396    HG3  ARG  54           HG1      ARG  54  32.271   1.319 -20.480
  397    HD2  ARG  54           HD2      ARG  54  34.544   2.283 -18.725
  398    HD3  ARG  54           HD1      ARG  54  34.472   2.586 -20.459
  399    HE   ARG  54           HE       ARG  54  32.004   3.397 -19.220
  400   HH11  ARG  54          HH21      ARG  54  35.354   4.213 -19.541
  401   HH12  ARG  54          HH22      ARG  54  35.087   5.911 -19.318
  402   HH21  ARG  54          HH11      ARG  54  31.658   5.603 -18.927
  403   HH22  ARG  54          HH12      ARG  54  33.002   6.693 -18.973
  404    HA   PRO  55           HA       PRO  55  32.385  -4.440 -17.615
  405    HB2  PRO  55           HB2      PRO  55  29.508  -3.666 -17.999
  406    HB3  PRO  55           HB1      PRO  55  30.205  -4.939 -16.977
  407    HG2  PRO  55           HG2      PRO  55  29.315  -2.618 -15.957
  408    HG3  PRO  55           HG1      PRO  55  30.703  -3.483 -15.273
  409    HD2  PRO  55           HD2      PRO  55  30.657  -0.973 -16.849
  410    HD3  PRO  55           HD1      PRO  55  31.846  -1.563 -15.672
  411    H    GLU  56           HN       GLU  56  32.412  -5.667 -19.419
  412    HA   GLU  56           HA       GLU  56  32.548  -6.145 -21.707
  413    HB2  GLU  56           HB2      GLU  56  30.125  -6.416 -21.303
  414    HB3  GLU  56           HB1      GLU  56  29.879  -4.709 -21.680
  415    HG2  GLU  56           HG2      GLU  56  30.753  -5.051 -23.941
  416    HG3  GLU  56           HG1      GLU  56  31.099  -6.740 -23.572
  Start of MODEL   20
    1    H1   MET   1           HT1      MET   1  48.142  17.484  16.549
    2    H2   MET   1           HT2      MET   1  46.728  17.772  15.652
    3    H3   MET   1           HT3      MET   1  48.243  17.782  14.882
    4    HA   MET   1           HA       MET   1  47.765  15.327  16.265
    5    HB2  MET   1           HB2      MET   1  45.849  16.235  14.102
    6    HB3  MET   1           HB1      MET   1  46.073  14.546  14.559
    7    HG2  MET   1           HG2      MET   1  45.520  15.195  16.932
    8    HG3  MET   1           HG1      MET   1  45.105  16.802  16.335
    9    HE1  MET   1           HE1      MET   1  43.795  13.431  17.258
   10    HE2  MET   1           HE2      MET   1  44.636  13.040  15.762
   11    HE3  MET   1           HE3      MET   1  42.887  12.855  15.854
   12    HA   PRO   2           HA       PRO   2  50.634  15.818  12.545
   13    HB2  PRO   2           HB2      PRO   2  53.015  15.538  13.887
   14    HB3  PRO   2           HB1      PRO   2  52.219  17.105  13.634
   15    HG2  PRO   2           HG2      PRO   2  52.210  15.351  16.055
   16    HG3  PRO   2           HG1      PRO   2  52.356  17.116  15.942
   17    HD2  PRO   2           HD2      PRO   2  50.009  15.876  16.591
   18    HD3  PRO   2           HD1      PRO   2  50.065  17.428  15.727
   19    H    LEU   3           HN       LEU   3  51.596  14.102  11.494
   20    HA   LEU   3           HA       LEU   3  51.956  11.855  10.955
   21    HB2  LEU   3           HB2      LEU   3  52.734  11.642  13.875
   22    HB3  LEU   3           HB1      LEU   3  53.237  10.575  12.563
   23    HG   LEU   3           HG       LEU   3  53.880  13.533  12.749
   24   HD11  LEU   3          HD11      LEU   3  55.577  11.059  13.187
   25   HD12  LEU   3          HD12      LEU   3  55.135  12.257  14.404
   26   HD13  LEU   3          HD13      LEU   3  56.214  12.700  13.080
   27   HD21  LEU   3          HD21      LEU   3  54.398  11.395  10.682
   28   HD22  LEU   3          HD22      LEU   3  55.537  12.729  10.870
   29   HD23  LEU   3          HD23      LEU   3  53.861  13.059  10.450
   30    H    GLU   4           HN       GLU   4  51.543   9.530  12.022
   31    HA   GLU   4           HA       GLU   4  49.881   7.963  12.474
   32    HB2  GLU   4           HB2      GLU   4  49.099  10.121  14.449
   33    HB3  GLU   4           HB1      GLU   4  48.441   8.486  14.449
   34    HG2  GLU   4           HG2      GLU   4  51.403   9.095  14.625
   35    HG3  GLU   4           HG1      GLU   4  50.378   8.818  16.034
   36    H    ALA   5           HN       ALA   5  47.549   7.542  12.350
   37    HA   ALA   5           HA       ALA   5  45.713   9.574  11.416
   38    HB1  ALA   5           HB1      ALA   5  46.753   7.610   9.353
   39    HB2  ALA   5           HB2      ALA   5  47.147   9.330   9.395
   40    HB3  ALA   5           HB3      ALA   5  45.486   8.813   9.107
   41    H    GLY   6           HN       GLY   6  46.579   6.436  12.357
   42    HA2  GLY   6           HA2      GLY   6  45.200   4.793  13.348
   43    HA3  GLY   6           HA1      GLY   6  43.783   5.735  12.887
   44    H    LEU   7           HN       LEU   7  43.999   2.936  12.609
   45    HA   LEU   7           HA       LEU   7  44.642   2.238   9.854
   46    HB2  LEU   7           HB2      LEU   7  42.988   0.684  11.867
   47    HB3  LEU   7           HB1      LEU   7  43.775   0.047  10.423
   48    HG   LEU   7           HG       LEU   7  45.201   1.292  12.789
   49   HD11  LEU   7          HD11      LEU   7  44.148  -1.020  13.089
   50   HD12  LEU   7          HD12      LEU   7  45.887  -0.919  13.370
   51   HD13  LEU   7          HD13      LEU   7  45.275  -1.582  11.855
   52   HD21  LEU   7          HD21      LEU   7  46.591   1.725  10.945
   53   HD22  LEU   7          HD22      LEU   7  46.109   0.250  10.106
   54   HD23  LEU   7          HD23      LEU   7  47.190   0.164  11.495
   55    H    LEU   8           HN       LEU   8  43.271   1.935   8.176
   56    HA   LEU   8           HA       LEU   8  40.806   3.462   8.163
   57    HB2  LEU   8           HB2      LEU   8  41.880   1.537   6.078
   58    HB3  LEU   8           HB1      LEU   8  40.643   2.769   5.827
   59    HG   LEU   8           HG       LEU   8  43.500   3.328   6.682
   60   HD11  LEU   8          HD11      LEU   8  43.902   4.065   4.445
   61   HD12  LEU   8          HD12      LEU   8  42.192   3.958   4.028
   62   HD13  LEU   8          HD13      LEU   8  43.126   2.487   4.298
   63   HD21  LEU   8          HD21      LEU   8  42.667   5.706   5.908
   64   HD22  LEU   8          HD22      LEU   8  42.243   5.129   7.513
   65   HD23  LEU   8          HD23      LEU   8  41.059   5.043   6.208
   66    H    GLU   9           HN       GLU   9  38.736   2.745   8.063
   67    HA   GLU   9           HA       GLU   9  38.221   0.099   9.231
   68    HB2  GLU   9           HB2      GLU   9  36.372   2.368   8.404
   69    HB3  GLU   9           HB1      GLU   9  35.838   0.888   9.199
   70    HG2  GLU   9           HG2      GLU   9  36.110   2.348  11.012
   71    HG3  GLU   9           HG1      GLU   9  37.645   1.485  11.002
   72    H    ILE  10           HN       ILE  10  35.735   1.097   7.194
   73    HA   ILE  10           HA       ILE  10  36.217  -1.223   5.413
   74    HB   ILE  10           HB       ILE  10  33.881  -0.803   4.681
   75   HG12  ILE  10          HG12      ILE  10  33.936   1.389   6.784
   76   HG13  ILE  10          HG11      ILE  10  33.913   1.672   5.044
   77   HG21  ILE  10          HG21      ILE  10  34.474  -2.218   6.685
   78   HG22  ILE  10          HG22      ILE  10  32.850  -1.532   6.737
   79   HG23  ILE  10          HG23      ILE  10  34.141  -0.813   7.700
   80   HD11  ILE  10          HD11      ILE  10  31.783   0.245   6.654
   81   HD12  ILE  10          HD12      ILE  10  31.782   0.391   4.896
   82   HD13  ILE  10          HD13      ILE  10  31.642   1.834   5.901
   83    H    LEU  11           HN       LEU  11  36.503  -1.071   3.256
   84    HA   LEU  11           HA       LEU  11  37.331   1.568   2.200
   85    HB2  LEU  11           HB2      LEU  11  37.842  -0.027   0.137
   86    HB3  LEU  11           HB1      LEU  11  38.897  -0.023   1.546
   87    HG   LEU  11           HG       LEU  11  36.545  -1.901   1.619
   88   HD11  LEU  11          HD11      LEU  11  37.322  -2.327  -0.617
   89   HD12  LEU  11          HD12      LEU  11  37.954  -3.613   0.410
   90   HD13  LEU  11          HD13      LEU  11  39.006  -2.293  -0.100
   91   HD21  LEU  11          HD21      LEU  11  37.973  -3.176   3.009
   92   HD22  LEU  11          HD22      LEU  11  38.388  -1.516   3.427
   93   HD23  LEU  11          HD23      LEU  11  39.430  -2.439   2.347
   94    H    ALA  12           HN       ALA  12  36.511   2.412   0.265
   95    HA   ALA  12           HA       ALA  12  34.022   1.265  -0.857
   96    HB1  ALA  12           HB1      ALA  12  34.143   4.105   0.185
   97    HB2  ALA  12           HB2      ALA  12  33.355   2.772   1.031
   98    HB3  ALA  12           HB3      ALA  12  32.751   3.299  -0.540
   99    H    CYS  13           HN       CYS  13  33.606   1.971  -2.928
  100    HA   CYS  13           HA       CYS  13  35.808   2.685  -4.542
  101    HB2  CYS  13           HB2      CYS  13  33.544   3.435  -6.040
  102    HB3  CYS  13           HB1      CYS  13  34.278   1.837  -6.022
  103    HA   PRO  14           HA       PRO  14  36.067   7.062  -4.320
  104    HB2  PRO  14           HB2      PRO  14  36.538   7.744  -6.971
  105    HB3  PRO  14           HB1      PRO  14  37.759   7.035  -5.897
  106    HG2  PRO  14           HG2      PRO  14  36.094   5.722  -7.995
  107    HG3  PRO  14           HG1      PRO  14  37.785   5.432  -7.548
  108    HD2  PRO  14           HD2      PRO  14  35.742   3.794  -6.761
  109    HD3  PRO  14           HD1      PRO  14  37.223   4.021  -5.805
  110    H    ALA  15           HN       ALA  15  34.708   6.887  -7.567
  111    HA   ALA  15           HA       ALA  15  32.878   9.033  -7.167
  112    HB1  ALA  15           HB1      ALA  15  33.504   8.471  -9.415
  113    HB2  ALA  15           HB2      ALA  15  31.785   8.103  -9.281
  114    HB3  ALA  15           HB3      ALA  15  32.973   6.802  -9.217
  115    H    CYS  16           HN       CYS  16  32.438   5.516  -7.030
  116    HA   CYS  16           HA       CYS  16  29.650   5.947  -6.001
  117    HB2  CYS  16           HB2      CYS  16  29.703   3.303  -6.402
  118    HB3  CYS  16           HB1      CYS  16  29.401   4.419  -7.725
  119    H    HIS  17           HN       HIS  17  28.967   4.698  -4.197
  120    HA   HIS  17           HA       HIS  17  31.159   4.212  -2.218
  121    HB2  HIS  17           HB2      HIS  17  28.182   4.679  -1.874
  122    HB3  HIS  17           HB1      HIS  17  29.293   4.317  -0.553
  123    HD2  HIS  17           HD2      HIS  17  31.008   6.443   0.188
  124    HE1  HIS  17           HE1      HIS  17  29.445   9.269  -2.536
  125    HE2  HIS  17           HE2      HIS  17  30.991   8.944  -0.552
  126    H    ALA  18           HN       ALA  18  31.784   2.152  -2.429
  127    HA   ALA  18           HA       ALA  18  30.155   0.015  -1.501
  128    HB1  ALA  18           HB1      ALA  18  30.741  -0.536  -4.384
  129    HB2  ALA  18           HB2      ALA  18  29.440   0.594  -4.062
  130    HB3  ALA  18           HB3      ALA  18  29.359  -1.023  -3.408
  131    HA   PRO  19           HA       PRO  19  34.202  -1.691  -1.078
  132    HB2  PRO  19           HB2      PRO  19  33.690  -4.389  -1.028
  133    HB3  PRO  19           HB1      PRO  19  33.285  -3.295   0.311
  134    HG2  PRO  19           HG2      PRO  19  31.521  -4.368  -1.849
  135    HG3  PRO  19           HG1      PRO  19  31.192  -4.176  -0.116
  136    HD2  PRO  19           HD2      PRO  19  30.284  -2.419  -1.968
  137    HD3  PRO  19           HD1      PRO  19  30.698  -1.917  -0.321
  138    H    LEU  20           HN       LEU  20  35.829  -3.076  -2.081
  139    HA   LEU  20           HA       LEU  20  35.359  -3.434  -5.034
  140    HB2  LEU  20           HB2      LEU  20  38.011  -2.991  -3.632
  141    HB3  LEU  20           HB1      LEU  20  37.682  -2.942  -5.364
  142    HG   LEU  20           HG       LEU  20  36.451  -1.042  -3.346
  143   HD11  LEU  20          HD11      LEU  20  38.630  -0.470  -5.366
  144   HD12  LEU  20          HD12      LEU  20  38.952  -0.821  -3.668
  145   HD13  LEU  20          HD13      LEU  20  38.017   0.607  -4.111
  146   HD21  LEU  20          HD21      LEU  20  36.022   0.231  -5.557
  147   HD22  LEU  20          HD22      LEU  20  35.011  -1.170  -5.230
  148   HD23  LEU  20          HD23      LEU  20  36.362  -1.301  -6.358
  149    H    GLU  21           HN       GLU  21  36.233  -5.243  -6.024
  150    HA   GLU  21           HA       GLU  21  37.082  -7.460  -4.174
  151    HB2  GLU  21           HB2      GLU  21  34.702  -7.605  -5.154
  152    HB3  GLU  21           HB1      GLU  21  35.483  -7.885  -6.708
  153    HG2  GLU  21           HG2      GLU  21  36.114  -9.509  -4.231
  154    HG3  GLU  21           HG1      GLU  21  34.878  -9.979  -5.392
  155    H    GLU  22           HN       GLU  22  39.046  -8.096  -4.609
  156    HA   GLU  22           HA       GLU  22  40.383  -7.360  -7.099
  157    HB2  GLU  22           HB2      GLU  22  41.466  -7.398  -4.782
  158    HB3  GLU  22           HB1      GLU  22  41.461  -9.158  -4.911
  159    HG2  GLU  22           HG2      GLU  22  42.677  -7.382  -7.041
  160    HG3  GLU  22           HG1      GLU  22  43.606  -7.992  -5.674
  161    H    ARG  23           HN       ARG  23  40.820  -8.630  -8.786
  162    HA   ARG  23           HA       ARG  23  40.808 -11.526  -8.670
  163    HB2  ARG  23           HB2      ARG  23  38.365 -11.098  -8.593
  164    HB3  ARG  23           HB1      ARG  23  38.492 -10.204 -10.110
  165    HG2  ARG  23           HG2      ARG  23  39.318 -12.196 -11.259
  166    HG3  ARG  23           HG1      ARG  23  39.312 -13.102  -9.746
  167    HD2  ARG  23           HD2      ARG  23  36.846 -11.854 -10.999
  168    HD3  ARG  23           HD1      ARG  23  37.301 -13.550 -11.174
  169    HE   ARG  23           HE       ARG  23  37.264 -13.039  -8.404
  170   HH11  ARG  23          HH21      ARG  23  35.104 -12.944 -11.113
  171   HH12  ARG  23          HH22      ARG  23  33.702 -13.305 -10.161
  172   HH21  ARG  23          HH11      ARG  23  35.440 -13.507  -7.171
  173   HH22  ARG  23          HH12      ARG  23  33.893 -13.621  -7.940
  174    H    ASP  24           HN       ASP  24  41.722 -12.393 -10.481
  175    HA   ASP  24           HA       ASP  24  43.074 -12.436 -12.380
  176    HB2  ASP  24           HB2      ASP  24  40.745 -11.977 -13.316
  177    HB3  ASP  24           HB1      ASP  24  41.236 -10.286 -13.445
  178    H    ALA  25           HN       ALA  25  43.889 -10.689 -10.274
  179    HA   ALA  25           HA       ALA  25  45.539  -9.077  -9.882
  180    HB1  ALA  25           HB1      ALA  25  45.996  -8.927 -12.861
  181    HB2  ALA  25           HB2      ALA  25  46.520 -10.328 -11.926
  182    HB3  ALA  25           HB3      ALA  25  47.159  -8.729 -11.550
  183    H    GLU  26           HN       GLU  26  42.664  -8.457 -10.856
  184    HA   GLU  26           HA       GLU  26  43.181  -5.521 -11.297
  185    HB2  GLU  26           HB2      GLU  26  41.075  -7.230 -12.664
  186    HB3  GLU  26           HB1      GLU  26  41.223  -5.476 -12.798
  187    HG2  GLU  26           HG2      GLU  26  43.458  -5.704 -13.765
  188    HG3  GLU  26           HG1      GLU  26  43.380  -7.451 -13.578
  189    H    LEU  27           HN       LEU  27  41.426  -4.164 -10.598
  190    HA   LEU  27           HA       LEU  27  40.003  -5.330  -8.237
  191    HB2  LEU  27           HB2      LEU  27  40.675  -2.487  -9.024
  192    HB3  LEU  27           HB1      LEU  27  39.704  -2.902  -7.619
  193    HG   LEU  27           HG       LEU  27  42.491  -3.989  -8.103
  194   HD11  LEU  27          HD11      LEU  27  42.808  -1.645  -7.841
  195   HD12  LEU  27          HD12      LEU  27  43.082  -2.333  -6.239
  196   HD13  LEU  27          HD13      LEU  27  41.554  -1.537  -6.605
  197   HD21  LEU  27          HD21      LEU  27  40.472  -4.144  -5.862
  198   HD22  LEU  27          HD22      LEU  27  42.190  -4.195  -5.474
  199   HD23  LEU  27          HD23      LEU  27  41.498  -5.407  -6.533
  200    H    ILE  28           HN       ILE  28  37.916  -5.673  -8.321
  201    HA   ILE  28           HA       ILE  28  36.316  -4.414 -10.536
  202    HB   ILE  28           HB       ILE  28  35.792  -6.927  -8.919
  203   HG12  ILE  28          HG12      ILE  28  36.495  -6.615 -11.853
  204   HG13  ILE  28          HG11      ILE  28  37.689  -6.985 -10.607
  205   HG21  ILE  28          HG21      ILE  28  34.018  -7.226 -10.714
  206   HG22  ILE  28          HG22      ILE  28  34.309  -5.548 -11.168
  207   HG23  ILE  28          HG23      ILE  28  33.700  -5.932  -9.559
  208   HD11  ILE  28          HD11      ILE  28  36.386  -9.001  -9.979
  209   HD12  ILE  28          HD12      ILE  28  36.907  -9.057 -11.664
  210   HD13  ILE  28          HD13      ILE  28  35.238  -8.644 -11.270
  211    H    CYS  29           HN       CYS  29  34.847  -2.964  -9.997
  212    HA   CYS  29           HA       CYS  29  34.419  -2.138  -7.268
  213    HB2  CYS  29           HB2      CYS  29  34.173  -0.849  -9.571
  214    HB3  CYS  29           HB1      CYS  29  32.506  -1.400  -9.467
  215    H    THR  30           HN       THR  30  33.174  -3.127  -5.797
  216    HA   THR  30           HA       THR  30  30.941  -4.884  -6.788
  217    HB   THR  30           HB       THR  30  32.219  -4.812  -4.042
  218    HG1  THR  30           HG1      THR  30  33.570  -5.381  -5.974
  219   HG21  THR  30          HG21      THR  30  30.562  -6.887  -5.496
  220   HG22  THR  30          HG22      THR  30  29.962  -5.815  -4.231
  221   HG23  THR  30          HG23      THR  30  31.186  -7.028  -3.854
  222    H    GLY  31           HN       GLY  31  29.063  -3.861  -6.774
  223    HA2  GLY  31           HA2      GLY  31  27.899  -2.819  -4.371
  224    HA3  GLY  31           HA1      GLY  31  28.391  -1.480  -5.407
  225    H    GLN  32           HN       GLN  32  25.772  -1.731  -4.864
  226    HA   GLN  32           HA       GLN  32  24.243  -3.344  -6.687
  227    HB2  GLN  32           HB2      GLN  32  23.540  -0.719  -5.315
  228    HB3  GLN  32           HB1      GLN  32  22.383  -1.791  -6.106
  229    HG2  GLN  32           HG2      GLN  32  24.176  -2.613  -3.805
  230    HG3  GLN  32           HG1      GLN  32  22.489  -2.130  -3.627
  231   HE21  GLN  32          HE21      GLN  32  24.207  -4.862  -3.583
  232   HE22  GLN  32          HE22      GLN  32  23.157  -5.930  -4.379
  233    H    ASP  33           HN       ASP  33  25.164   0.105  -6.770
  234    HA   ASP  33           HA       ASP  33  24.335   0.247  -9.633
  235    HB2  ASP  33           HB2      ASP  33  25.213   2.371  -7.646
  236    HB3  ASP  33           HB1      ASP  33  24.802   2.699  -9.330
  237    H    CYS  34           HN       CYS  34  27.014  -0.622  -7.927
  238    HA   CYS  34           HA       CYS  34  29.049   0.779  -9.504
  239    HB2  CYS  34           HB2      CYS  34  29.224  -1.555  -7.575
  240    HB3  CYS  34           HB1      CYS  34  30.610  -0.780  -8.324
  241    H    GLY  35           HN       GLY  35  30.849  -1.064 -10.201
  242    HA2  GLY  35           HA2      GLY  35  30.453  -3.466 -11.344
  243    HA3  GLY  35           HA1      GLY  35  29.532  -2.457 -12.462
  244    H    LEU  36           HN       LEU  36  31.744  -0.357 -11.511
  245    HA   LEU  36           HA       LEU  36  33.287  -0.485 -13.924
  246    HB2  LEU  36           HB2      LEU  36  33.970   0.984 -11.357
  247    HB3  LEU  36           HB1      LEU  36  34.582   1.343 -12.971
  248    HG   LEU  36           HG       LEU  36  31.671   1.487 -12.136
  249   HD11  LEU  36          HD11      LEU  36  33.238   3.264 -11.210
  250   HD12  LEU  36          HD12      LEU  36  31.917   3.874 -12.208
  251   HD13  LEU  36          HD13      LEU  36  33.543   3.748 -12.878
  252   HD21  LEU  36          HD21      LEU  36  33.128   1.866 -14.753
  253   HD22  LEU  36          HD22      LEU  36  31.648   2.770 -14.435
  254   HD23  LEU  36          HD23      LEU  36  31.619   1.011 -14.435
  255    H    ALA  37           HN       ALA  37  35.602  -0.719 -14.075
  256    HA   ALA  37           HA       ALA  37  36.781  -2.587 -12.029
  257    HB1  ALA  37           HB1      ALA  37  36.125  -4.014 -13.833
  258    HB2  ALA  37           HB2      ALA  37  37.860  -3.760 -14.004
  259    HB3  ALA  37           HB3      ALA  37  36.734  -2.882 -15.040
  260    H    TYR  38           HN       TYR  38  38.856  -2.209 -11.542
  261    HA   TYR  38           HA       TYR  38  40.279  -0.082 -13.080
  262    HB2  TYR  38           HB2      TYR  38  40.732  -0.486 -10.149
  263    HB3  TYR  38           HB1      TYR  38  41.045   0.935 -11.139
  264    HD1  TYR  38           HD2      TYR  38  39.206   2.388 -11.887
  265    HD2  TYR  38           HD1      TYR  38  38.510  -0.983  -9.319
  266    HE1  TYR  38           HE2      TYR  38  36.957   3.274 -11.332
  267    HE2  TYR  38           HE1      TYR  38  36.260  -0.098  -8.764
  268    HH   TYR  38           HH       TYR  38  34.899   2.644 -10.458
  269    HA   PRO  39           HA       PRO  39  43.281  -3.454 -13.259
  270    HB2  PRO  39           HB2      PRO  39  45.073  -2.286 -14.932
  271    HB3  PRO  39           HB1      PRO  39  43.508  -2.898 -15.502
  272    HG2  PRO  39           HG2      PRO  39  44.336  -0.094 -14.902
  273    HG3  PRO  39           HG1      PRO  39  43.316  -0.713 -16.213
  274    HD2  PRO  39           HD2      PRO  39  42.339   0.458 -13.905
  275    HD3  PRO  39           HD1      PRO  39  41.420  -0.675 -14.929
  276    H    VAL  40           HN       VAL  40  45.611  -3.742 -12.781
  277    HA   VAL  40           HA       VAL  40  46.596  -1.704 -10.800
  278    HB   VAL  40           HB       VAL  40  46.933  -4.713 -10.885
  279   HG11  VAL  40          HG11      VAL  40  48.196  -4.221  -8.682
  280   HG12  VAL  40          HG12      VAL  40  48.335  -2.568  -9.279
  281   HG13  VAL  40          HG13      VAL  40  49.054  -3.898 -10.189
  282   HG21  VAL  40          HG21      VAL  40  45.702  -4.675  -8.829
  283   HG22  VAL  40          HG22      VAL  40  44.813  -3.637  -9.945
  284   HG23  VAL  40          HG23      VAL  40  45.842  -2.921  -8.704
  285    H    ARG  41           HN       ARG  41  48.488  -0.793 -11.199
  286    HA   ARG  41           HA       ARG  41  50.251  -1.973 -13.339
  287    HB2  ARG  41           HB2      ARG  41  49.151   0.155 -14.004
  288    HB3  ARG  41           HB1      ARG  41  49.894   0.950 -12.614
  289    HG2  ARG  41           HG2      ARG  41  52.129   0.393 -13.471
  290    HG3  ARG  41           HG1      ARG  41  51.404  -0.447 -14.843
  291    HD2  ARG  41           HD2      ARG  41  50.285   1.699 -15.494
  292    HD3  ARG  41           HD1      ARG  41  51.160   2.501 -14.192
  293    HE   ARG  41           HE       ARG  41  53.184   2.298 -15.450
  294   HH11  ARG  41          HH21      ARG  41  50.511   0.625 -16.890
  295   HH12  ARG  41          HH22      ARG  41  51.323   0.383 -18.399
  296   HH21  ARG  41          HH11      ARG  41  54.234   1.983 -17.410
  297   HH22  ARG  41          HH12      ARG  41  53.422   1.147 -18.692
  298    H    ASP  42           HN       ASP  42  52.074  -2.694 -12.548
  299    HA   ASP  42           HA       ASP  42  53.942  -2.997 -11.186
  300    HB2  ASP  42           HB2      ASP  42  53.533  -0.010 -10.985
  301    HB3  ASP  42           HB1      ASP  42  54.902  -0.831 -10.244
  302    H    GLY  43           HN       GLY  43  51.329  -3.405 -10.055
  303    HA2  GLY  43           HA2      GLY  43  50.635  -4.162  -7.923
  304    HA3  GLY  43           HA1      GLY  43  52.101  -3.463  -7.230
  305    H    ILE  44           HN       ILE  44  50.892  -1.080  -9.112
  306    HA   ILE  44           HA       ILE  44  49.603   0.195  -6.785
  307    HB   ILE  44           HB       ILE  44  50.396   1.529  -9.359
  308   HG12  ILE  44          HG12      ILE  44  52.389   0.468  -8.484
  309   HG13  ILE  44          HG11      ILE  44  52.466   2.175  -8.051
  310   HG21  ILE  44          HG21      ILE  44  48.840   2.737  -7.833
  311   HG22  ILE  44          HG22      ILE  44  50.412   3.532  -7.933
  312   HG23  ILE  44          HG23      ILE  44  50.010   2.549  -6.525
  313   HD11  ILE  44          HD11      ILE  44  53.038   1.067  -6.041
  314   HD12  ILE  44          HD12      ILE  44  51.827  -0.183  -6.282
  315   HD13  ILE  44          HD13      ILE  44  51.332   1.444  -5.823
  316    HA   PRO  45           HA       PRO  45  45.743  -0.501  -9.004
  317    HB2  PRO  45           HB2      PRO  45  44.051   0.438  -7.098
  318    HB3  PRO  45           HB1      PRO  45  44.902  -1.112  -6.938
  319    HG2  PRO  45           HG2      PRO  45  45.554   1.530  -5.709
  320    HG3  PRO  45           HG1      PRO  45  45.608  -0.092  -4.991
  321    HD2  PRO  45           HD2      PRO  45  47.816   1.233  -5.941
  322    HD3  PRO  45           HD1      PRO  45  47.687  -0.545  -5.842
  323    H    VAL  46           HN       VAL  46  44.385   0.718 -10.266
  324    HA   VAL  46           HA       VAL  46  45.020   3.608 -10.475
  325    HB   VAL  46           HB       VAL  46  43.271   1.778 -12.152
  326   HG11  VAL  46          HG11      VAL  46  42.372   3.973 -12.387
  327   HG12  VAL  46          HG12      VAL  46  43.452   3.764 -13.767
  328   HG13  VAL  46          HG13      VAL  46  43.975   4.712 -12.374
  329   HG21  VAL  46          HG21      VAL  46  46.050   2.943 -12.482
  330   HG22  VAL  46          HG22      VAL  46  45.148   2.216 -13.812
  331   HG23  VAL  46          HG23      VAL  46  45.604   1.238 -12.417
  332    H    LEU  47           HN       LEU  47  43.782   5.136  -9.628
  333    HA   LEU  47           HA       LEU  47  40.989   4.457  -8.724
  334    HB2  LEU  47           HB2      LEU  47  42.870   6.512  -7.521
  335    HB3  LEU  47           HB1      LEU  47  41.304   5.995  -6.891
  336    HG   LEU  47           HG       LEU  47  43.727   4.200  -7.217
  337   HD11  LEU  47          HD11      LEU  47  42.495   5.589  -4.831
  338   HD12  LEU  47          HD12      LEU  47  44.165   5.675  -5.392
  339   HD13  LEU  47          HD13      LEU  47  43.554   4.189  -4.663
  340   HD21  LEU  47          HD21      LEU  47  40.880   3.756  -6.309
  341   HD22  LEU  47          HD22      LEU  47  42.178   2.748  -5.670
  342   HD23  LEU  47          HD23      LEU  47  41.860   2.778  -7.400
  343    H    LEU  48           HN       LEU  48  42.052   5.602 -11.314
  344    HA   LEU  48           HA       LEU  48  40.817   8.328 -11.221
  345    HB2  LEU  48           HB2      LEU  48  42.639   6.920 -13.172
  346    HB3  LEU  48           HB1      LEU  48  41.738   8.352 -13.662
  347    HG   LEU  48           HG       LEU  48  42.713   9.524 -11.631
  348   HD11  LEU  48          HD11      LEU  48  44.288   6.943 -11.568
  349   HD12  LEU  48          HD12      LEU  48  43.407   7.717 -10.252
  350   HD13  LEU  48          HD13      LEU  48  44.900   8.432 -10.851
  351   HD21  LEU  48          HD21      LEU  48  44.901   9.897 -12.710
  352   HD22  LEU  48          HD22      LEU  48  43.590   9.893 -13.890
  353   HD23  LEU  48          HD23      LEU  48  44.635   8.481 -13.726
  354    H    VAL  49           HN       VAL  49  38.894   8.677 -12.029
  355    HA   VAL  49           HA       VAL  49  37.152   6.562 -12.846
  356    HB   VAL  49           HB       VAL  49  36.893   9.571 -13.150
  357   HG11  VAL  49          HG11      VAL  49  34.959   7.296 -13.625
  358   HG12  VAL  49          HG12      VAL  49  35.375   8.616 -14.716
  359   HG13  VAL  49          HG13      VAL  49  34.404   8.934 -13.279
  360   HG21  VAL  49          HG21      VAL  49  37.083   8.631 -10.819
  361   HG22  VAL  49          HG22      VAL  49  35.650   7.659 -11.149
  362   HG23  VAL  49          HG23      VAL  49  35.537   9.418 -11.138
  363    H    ASP  50           HN       ASP  50  38.888   9.060 -14.666
  364    HA   ASP  50           HA       ASP  50  37.792   8.475 -17.234
  365    HB2  ASP  50           HB2      ASP  50  40.457   9.644 -16.375
  366    HB3  ASP  50           HB1      ASP  50  39.986   9.500 -18.069
  367    H    GLU  51           HN       GLU  51  40.562   7.115 -15.487
  368    HA   GLU  51           HA       GLU  51  41.270   5.365 -17.756
  369    HB2  GLU  51           HB2      GLU  51  42.318   5.456 -14.910
  370    HB3  GLU  51           HB1      GLU  51  43.021   4.521 -16.224
  371    HG2  GLU  51           HG2      GLU  51  43.382   6.620 -17.501
  372    HG3  GLU  51           HG1      GLU  51  42.745   7.539 -16.137
  373    H    ALA  52           HN       ALA  52  39.018   5.319 -15.254
  374    HA   ALA  52           HA       ALA  52  39.054   2.565 -14.464
  375    HB1  ALA  52           HB1      ALA  52  36.635   4.382 -14.667
  376    HB2  ALA  52           HB2      ALA  52  37.764   4.375 -13.312
  377    HB3  ALA  52           HB3      ALA  52  36.797   2.944 -13.657
  378    H    ARG  53           HN       ARG  53  37.944   0.791 -15.244
  379    HA   ARG  53           HA       ARG  53  37.112   0.985 -18.117
  380    HB2  ARG  53           HB2      ARG  53  37.936  -1.363 -16.382
  381    HB3  ARG  53           HB1      ARG  53  37.373  -1.510 -18.047
  382    HG2  ARG  53           HG2      ARG  53  39.199  -0.103 -18.838
  383    HG3  ARG  53           HG1      ARG  53  39.744   0.171 -17.182
  384    HD2  ARG  53           HD2      ARG  53  39.569  -2.579 -18.449
  385    HD3  ARG  53           HD1      ARG  53  41.043  -1.609 -18.429
  386    HE   ARG  53           HE       ARG  53  40.111  -1.755 -15.755
  387   HH11  ARG  53          HH21      ARG  53  41.274  -3.816 -18.288
  388   HH12  ARG  53          HH22      ARG  53  41.962  -4.971 -17.195
  389   HH21  ARG  53          HH11      ARG  53  41.005  -3.255 -14.340
  390   HH22  ARG  53          HH12      ARG  53  41.811  -4.650 -14.969
  391    H    ARG  54           HN       ARG  54  35.119   0.425 -18.762
  392    HA   ARG  54           HA       ARG  54  33.056   0.136 -16.683
  393    HB2  ARG  54           HB2      ARG  54  33.051   0.741 -19.637
  394    HB3  ARG  54           HB1      ARG  54  31.557   0.226 -18.860
  395    HG2  ARG  54           HG2      ARG  54  31.639   2.064 -17.307
  396    HG3  ARG  54           HG1      ARG  54  33.261   2.511 -17.841
  397    HD2  ARG  54           HD2      ARG  54  32.448   3.151 -20.020
  398    HD3  ARG  54           HD1      ARG  54  30.848   2.489 -19.674
  399    HE   ARG  54           HE       ARG  54  31.171   4.377 -17.689
  400   HH11  ARG  54          HH21      ARG  54  31.544   4.357 -21.134
  401   HH12  ARG  54          HH22      ARG  54  31.107   6.025 -21.311
  402   HH21  ARG  54          HH11      ARG  54  30.601   6.541 -17.922
  403   HH22  ARG  54          HH12      ARG  54  30.574   7.255 -19.500
  404    HA   PRO  55           HA       PRO  55  32.576  -4.216 -17.130
  405    HB2  PRO  55           HB2      PRO  55  29.822  -4.465 -16.838
  406    HB3  PRO  55           HB1      PRO  55  30.952  -4.209 -15.495
  407    HG2  PRO  55           HG2      PRO  55  29.231  -2.230 -16.920
  408    HG3  PRO  55           HG1      PRO  55  29.622  -2.351 -15.194
  409    HD2  PRO  55           HD2      PRO  55  30.815  -0.543 -16.823
  410    HD3  PRO  55           HD1      PRO  55  31.655  -1.268 -15.439
  411    H    GLU  56           HN       GLU  56  32.141  -5.763 -18.666
  412    HA   GLU  56           HA       GLU  56  30.250  -5.302 -20.847
  413    HB2  GLU  56           HB2      GLU  56  32.218  -3.948 -21.558
  414    HB3  GLU  56           HB1      GLU  56  33.216  -5.401 -21.473
  415    HG2  GLU  56           HG2      GLU  56  31.814  -6.499 -23.154
  416    HG3  GLU  56           HG1      GLU  56  30.749  -5.094 -23.206